data_18517 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18517 _Entry.PDB_ID 2LUD save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 18517 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 LYS N N 70 126.600 126.600 122.969 3.631 18517 2 1 1 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.195 0.165 18517 3 1 1 . 1 1 2 2 LYS C C 70 176.000 176.000 174.902 1.098 18517 4 1 1 . 1 1 2 2 LYS CA C 70 56.450 56.450 56.704 -0.254 18517 5 1 1 . 1 1 2 2 LYS CB C 70 33.850 33.850 32.267 1.583 18517 6 1 1 . 1 1 2 2 LYS H H 70 8.530 8.530 8.457 0.073 18517 7 1 1 . 1 1 3 3 THR N N 71 111.030 111.030 114.986 -3.956 18517 8 1 1 . 1 1 3 3 THR HA H 71 4.400 4.400 4.489 -0.089 18517 9 1 1 . 1 1 3 3 THR C C 71 175.650 175.650 175.097 0.553 18517 10 1 1 . 1 1 3 3 THR CA C 71 60.610 60.610 60.824 -0.214 18517 11 1 1 . 1 1 3 3 THR CB C 71 71.520 71.520 70.405 1.115 18517 12 1 1 . 1 1 3 3 THR H H 71 7.390 7.390 8.033 -0.643 18517 13 1 1 . 1 1 4 4 LEU N N 72 121.560 121.560 122.865 -1.305 18517 14 1 1 . 1 1 4 4 LEU C C 72 177.870 177.870 178.070 -0.200 18517 15 1 1 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.382 0.098 18517 16 1 1 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.373 0.807 18517 17 1 1 . 1 1 4 4 LEU H H 72 8.980 8.980 8.623 0.357 18517 18 1 1 . 1 1 5 5 ASP N N 73 115.530 115.530 117.295 -1.765 18517 19 1 1 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.363 -0.033 18517 20 1 1 . 1 1 5 5 ASP C C 73 179.290 179.290 178.389 0.901 18517 21 1 1 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.452 0.388 18517 22 1 1 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.748 0.082 18517 23 1 1 . 1 1 5 5 ASP H H 73 8.270 8.270 8.739 -0.469 18517 24 1 1 . 1 1 6 6 VAL N N 74 122.330 122.330 120.291 2.039 18517 25 1 1 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.772 -0.032 18517 26 1 1 . 1 1 6 6 VAL C C 74 178.970 178.970 177.792 1.178 18517 27 1 1 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.951 0.409 18517 28 1 1 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.876 0.074 18517 29 1 1 . 1 1 6 6 VAL H H 74 7.400 7.400 7.397 0.003 18517 30 1 1 . 1 1 7 7 LEU N N 75 121.360 121.360 121.265 0.095 18517 31 1 1 . 1 1 7 7 LEU HA H 75 4.030 4.030 4.040 -0.010 18517 32 1 1 . 1 1 7 7 LEU C C 75 179.240 179.240 179.310 -0.070 18517 33 1 1 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.001 0.229 18517 34 1 1 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.111 1.779 18517 35 1 1 . 1 1 7 7 LEU H H 75 8.300 8.300 8.583 -0.283 18517 36 1 1 . 1 1 8 8 ARG N N 76 117.230 117.230 119.825 -2.595 18517 37 1 1 . 1 1 8 8 ARG HA H 76 3.920 3.920 3.976 -0.056 18517 38 1 1 . 1 1 8 8 ARG C C 76 178.290 178.290 178.692 -0.402 18517 39 1 1 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.988 0.782 18517 40 1 1 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.949 0.261 18517 41 1 1 . 1 1 8 8 ARG H H 76 8.520 8.520 8.786 -0.266 18517 42 1 1 . 1 1 9 9 GLY N N 77 104.570 104.570 106.877 -2.307 18517 43 1 1 . 1 1 9 9 GLY C C 77 176.180 176.180 176.216 -0.036 18517 44 1 1 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.936 0.234 18517 45 1 1 . 1 1 9 9 GLY H H 77 7.620 7.620 8.183 -0.563 18517 46 1 1 . 1 1 10 10 GLU N N 78 120.270 120.270 122.979 -2.709 18517 47 1 1 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.029 0.241 18517 48 1 1 . 1 1 10 10 GLU C C 78 179.030 179.030 179.185 -0.155 18517 49 1 1 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.401 -0.531 18517 50 1 1 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.537 1.863 18517 51 1 1 . 1 1 10 10 GLU H H 78 8.100 8.100 8.314 -0.214 18517 52 1 1 . 1 1 11 11 LEU N N 79 116.000 116.000 120.561 -4.561 18517 53 1 1 . 1 1 11 11 LEU HA H 79 4.510 4.510 4.067 0.443 18517 54 1 1 . 1 1 11 11 LEU C C 79 179.630 179.630 179.378 0.252 18517 55 1 1 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.132 -1.442 18517 56 1 1 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.791 3.009 18517 57 1 1 . 1 1 11 11 LEU H H 79 8.230 8.230 8.680 -0.450 18517 58 1 1 . 1 1 12 12 ARG N N 80 120.020 120.020 119.646 0.374 18517 59 1 1 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.982 -0.232 18517 60 1 1 . 1 1 12 12 ARG C C 80 178.490 178.490 178.821 -0.331 18517 61 1 1 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.869 2.131 18517 62 1 1 . 1 1 12 12 ARG CB C 80 31.240 31.240 30.076 1.164 18517 63 1 1 . 1 1 12 12 ARG H H 80 8.210 8.210 8.507 -0.297 18517 64 1 1 . 1 1 13 13 GLY N N 81 108.090 108.090 106.873 1.217 18517 65 1 1 . 1 1 13 13 GLY C C 81 173.540 173.540 175.886 -2.346 18517 66 1 1 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.917 1.083 18517 67 1 1 . 1 1 13 13 GLY H H 81 8.890 8.890 8.530 0.360 18517 68 1 1 . 1 1 14 14 GLN C C 82 179.540 179.540 178.527 1.013 18517 69 1 1 . 1 1 14 14 GLN CA C 82 58.710 58.710 59.306 -0.596 18517 70 1 1 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.688 0.412 18517 71 1 1 . 1 1 15 15 ARG N N 83 118.220 118.220 119.128 -0.908 18517 72 1 1 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.184 -0.234 18517 73 1 1 . 1 1 15 15 ARG C C 83 177.710 177.710 178.956 -1.246 18517 74 1 1 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.677 0.223 18517 75 1 1 . 1 1 15 15 ARG CB C 83 29.650 29.650 30.271 -0.621 18517 76 1 1 . 1 1 15 15 ARG H H 83 7.320 7.320 8.317 -0.997 18517 77 1 1 . 1 1 16 16 GLU N N 84 118.810 118.810 120.709 -1.899 18517 78 1 1 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.118 -0.268 18517 79 1 1 . 1 1 16 16 GLU C C 84 178.750 178.750 179.034 -0.284 18517 80 1 1 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.504 1.506 18517 81 1 1 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.435 -0.025 18517 82 1 1 . 1 1 16 16 GLU H H 84 8.450 8.450 8.773 -0.323 18517 83 1 1 . 1 1 17 17 ALA N N 85 122.790 122.790 123.164 -0.374 18517 84 1 1 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.119 0.071 18517 85 1 1 . 1 1 17 17 ALA C C 85 180.360 180.360 179.274 1.086 18517 86 1 1 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.224 0.236 18517 87 1 1 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.470 -0.390 18517 88 1 1 . 1 1 17 17 ALA H H 85 8.420 8.420 8.385 0.035 18517 89 1 1 . 1 1 18 18 PHE N N 86 119.400 119.400 120.107 -0.707 18517 90 1 1 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.253 0.037 18517 91 1 1 . 1 1 18 18 PHE C C 86 177.560 177.560 177.359 0.201 18517 92 1 1 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.076 0.564 18517 93 1 1 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.381 0.259 18517 94 1 1 . 1 1 18 18 PHE H H 86 7.490 7.490 8.312 -0.822 18517 95 1 1 . 1 1 19 19 LEU N N 87 117.470 117.470 119.963 -2.493 18517 96 1 1 . 1 1 19 19 LEU HA H 87 4.070 4.070 3.970 0.100 18517 97 1 1 . 1 1 19 19 LEU C C 87 178.880 178.880 178.482 0.398 18517 98 1 1 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.274 -0.314 18517 99 1 1 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.674 0.426 18517 100 1 1 . 1 1 19 19 LEU H H 87 8.010 8.010 8.936 -0.926 18517 101 1 1 . 1 1 20 20 SER N N 88 113.770 113.770 115.021 -1.251 18517 102 1 1 . 1 1 20 20 SER HA H 88 4.070 4.070 4.150 -0.080 18517 103 1 1 . 1 1 20 20 SER C C 88 175.680 175.680 176.897 -1.217 18517 104 1 1 . 1 1 20 20 SER CA C 88 63.070 63.070 62.410 0.660 18517 105 1 1 . 1 1 20 20 SER H H 88 8.100 8.100 8.411 -0.311 18517 106 1 1 . 1 1 21 21 GLU N N 89 120.570 120.570 121.854 -1.284 18517 107 1 1 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.041 -0.071 18517 108 1 1 . 1 1 21 21 GLU C C 89 178.940 178.940 178.895 0.045 18517 109 1 1 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.094 0.165 18517 110 1 1 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.171 0.159 18517 111 1 1 . 1 1 21 21 GLU H H 89 7.400 7.400 7.942 -0.542 18517 112 1 1 . 1 1 22 22 ILE N N 90 119.350 119.350 119.644 -0.294 18517 113 1 1 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.907 -0.217 18517 114 1 1 . 1 1 22 22 ILE C C 90 177.230 177.230 178.322 -1.092 18517 115 1 1 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.849 0.621 18517 116 1 1 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.413 -0.023 18517 117 1 1 . 1 1 22 22 ILE H H 90 7.250 7.250 8.038 -0.788 18517 118 1 1 . 1 1 23 23 ILE N N 91 116.350 116.350 117.944 -1.594 18517 119 1 1 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.793 -0.393 18517 120 1 1 . 1 1 23 23 ILE C C 91 176.690 176.690 176.721 -0.031 18517 121 1 1 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.181 2.549 18517 122 1 1 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.206 0.564 18517 123 1 1 . 1 1 23 23 ILE H H 91 7.860 7.860 8.279 -0.419 18517 124 1 1 . 1 1 24 24 LYS N N 92 116.000 116.000 117.932 -1.932 18517 125 1 1 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.151 -0.011 18517 126 1 1 . 1 1 24 24 LYS C C 92 176.270 176.270 176.931 -0.661 18517 127 1 1 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.641 -0.161 18517 128 1 1 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.930 0.370 18517 129 1 1 . 1 1 24 24 LYS H H 92 7.170 7.170 7.872 -0.702 18517 130 1 1 . 1 1 25 25 SER N N 93 114.650 114.650 115.429 -0.779 18517 131 1 1 . 1 1 25 25 SER HA H 93 4.550 4.550 4.287 0.263 18517 132 1 1 . 1 1 25 25 SER C C 93 173.370 173.370 173.249 0.121 18517 133 1 1 . 1 1 25 25 SER CA C 93 57.240 57.240 59.990 -2.750 18517 134 1 1 . 1 1 25 25 SER CB C 93 65.650 65.650 63.670 1.980 18517 135 1 1 . 1 1 25 25 SER H H 93 7.730 7.730 7.731 -0.001 18517 136 1 1 . 1 1 26 26 ASP N N 94 121.230 121.230 123.149 -1.919 18517 137 1 1 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.681 0.249 18517 138 1 1 . 1 1 26 26 ASP C C 94 176.560 176.560 175.750 0.810 18517 139 1 1 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.637 0.873 18517 140 1 1 . 1 1 26 26 ASP CB C 94 42.650 42.650 42.000 0.650 18517 141 1 1 . 1 1 26 26 ASP H H 94 8.280 8.280 8.365 -0.085 18517 142 1 1 . 1 1 27 27 GLY N N 95 109.310 109.310 108.772 0.538 18517 143 1 1 . 1 1 27 27 GLY C C 95 171.080 171.080 171.815 -0.735 18517 144 1 1 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.509 -0.739 18517 145 1 1 . 1 1 27 27 GLY H H 95 8.160 8.160 7.636 0.524 18517 146 1 1 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.584 0.556 18517 147 1 1 . 1 1 29 29 PHE C C 97 175.230 175.230 175.448 -0.218 18517 148 1 1 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.472 0.018 18517 149 1 1 . 1 1 29 29 PHE CB C 97 41.620 41.620 42.495 -0.875 18517 150 1 1 . 1 1 30 30 THR N N 98 112.600 112.600 116.859 -4.259 18517 151 1 1 . 1 1 30 30 THR HA H 98 4.570 4.570 4.281 0.289 18517 152 1 1 . 1 1 30 30 THR C C 98 176.690 176.690 175.235 1.455 18517 153 1 1 . 1 1 30 30 THR CA C 98 60.290 60.290 60.936 -0.646 18517 154 1 1 . 1 1 30 30 THR CB C 98 71.600 71.600 70.924 0.676 18517 155 1 1 . 1 1 30 30 THR H H 98 8.990 8.990 9.245 -0.255 18517 156 1 1 . 1 1 31 31 ILE N N 99 119.240 119.240 124.757 -5.517 18517 157 1 1 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.558 0.262 18517 158 1 1 . 1 1 31 31 ILE C C 99 176.090 176.090 176.580 -0.490 18517 159 1 1 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.472 -3.332 18517 160 1 1 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.825 -0.875 18517 161 1 1 . 1 1 31 31 ILE H H 99 9.230 9.230 8.101 1.129 18517 162 1 1 . 1 1 32 32 LEU N N 100 119.660 119.660 118.252 1.408 18517 163 1 1 . 1 1 32 32 LEU HA H 100 4.030 4.030 3.862 0.168 18517 164 1 1 . 1 1 32 32 LEU C C 100 181.050 181.050 179.381 1.669 18517 165 1 1 . 1 1 32 32 LEU CA C 100 57.560 57.560 58.011 -0.451 18517 166 1 1 . 1 1 32 32 LEU CB C 100 40.120 40.120 41.158 -1.038 18517 167 1 1 . 1 1 32 32 LEU H H 100 7.310 7.310 8.235 -0.925 18517 168 1 1 . 1 1 33 33 GLN N N 101 121.450 121.450 118.164 3.286 18517 169 1 1 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.394 -0.144 18517 170 1 1 . 1 1 33 33 GLN CA C 101 59.700 59.700 58.835 0.865 18517 171 1 1 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.806 2.984 18517 172 1 1 . 1 1 33 33 GLN H H 101 7.790 7.790 7.273 0.517 18517 173 1 1 . 1 1 34 34 LEU C C 102 178.590 178.590 178.813 -0.223 18517 174 1 1 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.128 0.502 18517 175 1 1 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.838 -0.528 18517 176 1 1 . 1 1 35 35 VAL N N 103 118.520 118.520 117.283 1.237 18517 177 1 1 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.727 -0.307 18517 178 1 1 . 1 1 35 35 VAL C C 103 177.930 177.930 178.402 -0.472 18517 179 1 1 . 1 1 35 35 VAL CA C 103 66.040 66.040 65.898 0.142 18517 180 1 1 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.173 1.457 18517 181 1 1 . 1 1 35 35 VAL H H 103 8.670 8.670 8.668 0.002 18517 182 1 1 . 1 1 36 36 GLY N N 104 109.430 109.430 108.915 0.515 18517 183 1 1 . 1 1 36 36 GLY C C 104 174.600 174.600 175.830 -1.230 18517 184 1 1 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.149 0.891 18517 185 1 1 . 1 1 36 36 GLY H H 104 7.880 7.880 7.958 -0.078 18517 186 1 1 . 1 1 37 37 TYR N N 105 122.270 122.270 124.101 -1.831 18517 187 1 1 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.444 -0.564 18517 188 1 1 . 1 1 37 37 TYR C C 105 176.310 176.310 177.150 -0.840 18517 189 1 1 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.295 3.805 18517 190 1 1 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.757 -0.387 18517 191 1 1 . 1 1 37 37 TYR H H 105 8.170 8.170 8.307 -0.137 18517 192 1 1 . 1 1 38 38 LEU N N 106 120.100 120.100 120.821 -0.721 18517 193 1 1 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.913 -0.173 18517 194 1 1 . 1 1 38 38 LEU C C 106 178.280 178.280 178.746 -0.466 18517 195 1 1 . 1 1 38 38 LEU CA C 106 58.630 58.630 57.975 0.655 18517 196 1 1 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.726 1.004 18517 197 1 1 . 1 1 38 38 LEU H H 106 7.610 7.610 8.364 -0.754 18517 198 1 1 . 1 1 39 39 ARG N N 107 116.670 116.670 118.264 -1.594 18517 199 1 1 . 1 1 39 39 ARG HA H 107 3.680 3.680 4.165 -0.485 18517 200 1 1 . 1 1 39 39 ARG C C 107 179.480 179.480 178.876 0.604 18517 201 1 1 . 1 1 39 39 ARG CA C 107 59.580 59.580 56.897 2.683 18517 202 1 1 . 1 1 39 39 ARG CB C 107 31.240 31.240 28.933 2.307 18517 203 1 1 . 1 1 39 39 ARG H H 107 8.240 8.240 8.034 0.206 18517 204 1 1 . 1 1 40 40 VAL N N 108 121.970 121.970 121.670 0.300 18517 205 1 1 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.673 -0.273 18517 206 1 1 . 1 1 40 40 VAL C C 108 178.440 178.440 177.932 0.508 18517 207 1 1 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.737 1.212 18517 208 1 1 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.689 -1.249 18517 209 1 1 . 1 1 40 40 VAL H H 108 8.200 8.200 8.219 -0.019 18517 210 1 1 . 1 1 41 41 VAL N N 109 108.940 108.940 116.133 -7.193 18517 211 1 1 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.511 0.729 18517 212 1 1 . 1 1 41 41 VAL C C 109 175.070 175.070 177.545 -2.475 18517 213 1 1 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.817 -3.227 18517 214 1 1 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.271 -0.621 18517 215 1 1 . 1 1 41 41 VAL H H 109 7.760 7.760 8.108 -0.348 18517 216 1 1 . 1 1 42 42 ASP N N 110 124.670 124.670 120.673 3.997 18517 217 1 1 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.281 0.339 18517 218 1 1 . 1 1 42 42 ASP C C 110 177.310 177.310 178.222 -0.912 18517 219 1 1 . 1 1 42 42 ASP CA C 110 59.980 59.980 57.995 1.986 18517 220 1 1 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.817 4.133 18517 221 1 1 . 1 1 42 42 ASP H H 110 7.360 7.360 8.108 -0.748 18517 222 1 1 . 1 1 43 43 THR N N 111 102.340 102.340 112.619 -10.279 18517 223 1 1 . 1 1 43 43 THR HA H 111 5.100 5.100 4.365 0.735 18517 224 1 1 . 1 1 43 43 THR C C 111 174.940 174.940 175.710 -0.770 18517 225 1 1 . 1 1 43 43 THR CA C 111 60.650 60.650 64.416 -3.766 18517 226 1 1 . 1 1 43 43 THR CB C 111 69.610 69.610 68.941 0.669 18517 227 1 1 . 1 1 43 43 THR H H 111 6.380 6.380 7.825 -1.445 18517 228 1 1 . 1 1 44 44 ASP N N 112 119.750 119.750 123.008 -3.258 18517 229 1 1 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.599 -0.739 18517 230 1 1 . 1 1 44 44 ASP C C 112 178.850 178.850 177.691 1.159 18517 231 1 1 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.040 1.190 18517 232 1 1 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.777 -1.377 18517 233 1 1 . 1 1 44 44 ASP H H 112 9.050 9.050 8.617 0.433 18517 234 1 1 . 1 1 45 45 LEU N N 113 123.910 123.910 121.954 1.956 18517 235 1 1 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.975 -0.165 18517 236 1 1 . 1 1 45 45 LEU C C 113 182.040 182.040 177.774 4.266 18517 237 1 1 . 1 1 45 45 LEU CA C 113 57.320 57.320 58.417 -1.097 18517 238 1 1 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.778 -1.028 18517 239 1 1 . 1 1 45 45 LEU H H 113 9.710 9.710 7.953 1.757 18517 240 1 1 . 1 1 46 46 LEU N N 114 117.640 117.640 114.145 3.495 18517 241 1 1 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.504 -0.394 18517 242 1 1 . 1 1 46 46 LEU C C 114 179.540 179.540 178.708 0.832 18517 243 1 1 . 1 1 46 46 LEU CA C 114 57.560 57.560 56.898 0.662 18517 244 1 1 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.090 0.380 18517 245 1 1 . 1 1 46 46 LEU H H 114 8.270 8.270 7.633 0.637 18517 246 1 1 . 1 1 47 47 LEU N N 115 116.520 116.520 118.073 -1.553 18517 247 1 1 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.302 -0.162 18517 248 1 1 . 1 1 47 47 LEU C C 115 173.850 173.850 176.751 -2.901 18517 249 1 1 . 1 1 47 47 LEU CA C 115 55.420 55.420 55.470 -0.050 18517 250 1 1 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.284 3.436 18517 251 1 1 . 1 1 47 47 LEU H H 115 8.160 8.160 7.987 0.173 18517 252 1 1 . 1 1 48 48 LYS N N 116 114.710 114.710 115.430 -0.720 18517 253 1 1 . 1 1 48 48 LYS HA H 116 3.810 3.810 4.099 -0.289 18517 254 1 1 . 1 1 48 48 LYS C C 116 176.510 176.510 175.957 0.553 18517 255 1 1 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.764 0.436 18517 256 1 1 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.812 -0.792 18517 257 1 1 . 1 1 48 48 LYS H H 116 7.580 7.580 7.832 -0.252 18517 258 1 1 . 1 1 49 49 VAL N N 117 119.050 119.050 119.488 -0.438 18517 259 1 1 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.086 -0.476 18517 260 1 1 . 1 1 49 49 VAL C C 117 175.860 175.860 176.313 -0.453 18517 261 1 1 . 1 1 49 49 VAL CA C 117 63.510 63.510 61.208 2.302 18517 262 1 1 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.210 0.140 18517 263 1 1 . 1 1 49 49 VAL H H 117 7.980 7.980 8.002 -0.022 18517 264 1 1 . 1 1 50 50 ASP N N 118 126.900 126.900 122.925 3.975 18517 265 1 1 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.477 -0.227 18517 266 1 1 . 1 1 50 50 ASP C C 118 177.700 177.700 177.014 0.686 18517 267 1 1 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.739 0.311 18517 268 1 1 . 1 1 50 50 ASP CB C 118 42.580 42.580 40.930 1.650 18517 269 1 1 . 1 1 50 50 ASP H H 118 8.930 8.930 8.664 0.266 18517 270 1 1 . 1 1 51 51 SER N N 119 124.790 124.790 119.833 4.957 18517 271 1 1 . 1 1 51 51 SER HA H 119 4.070 4.070 4.204 -0.134 18517 272 1 1 . 1 1 51 51 SER C C 119 177.220 177.220 176.172 1.048 18517 273 1 1 . 1 1 51 51 SER CA C 119 61.640 61.640 61.791 -0.151 18517 274 1 1 . 1 1 51 51 SER CB C 119 63.510 63.510 63.235 0.275 18517 275 1 1 . 1 1 51 51 SER H H 119 8.560 8.560 8.830 -0.270 18517 276 1 1 . 1 1 52 52 THR N N 120 119.880 119.880 117.361 2.519 18517 277 1 1 . 1 1 52 52 THR HA H 120 4.190 4.190 4.139 0.051 18517 278 1 1 . 1 1 52 52 THR C C 120 177.120 177.120 176.247 0.873 18517 279 1 1 . 1 1 52 52 THR CA C 120 66.280 66.280 66.329 -0.049 18517 280 1 1 . 1 1 52 52 THR CB C 120 68.420 68.420 68.608 -0.188 18517 281 1 1 . 1 1 52 52 THR H H 120 8.310 8.310 8.193 0.117 18517 282 1 1 . 1 1 53 53 LYS N N 121 122.270 122.270 122.478 -0.208 18517 283 1 1 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.172 -0.052 18517 284 1 1 . 1 1 53 53 LYS C C 121 178.970 178.970 178.530 0.440 18517 285 1 1 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.340 0.240 18517 286 1 1 . 1 1 53 53 LYS CB C 121 34.250 34.250 32.294 1.956 18517 287 1 1 . 1 1 53 53 LYS H H 121 7.700 7.700 8.086 -0.386 18517 288 1 1 . 1 1 54 54 VAL N N 122 120.070 120.070 119.850 0.220 18517 289 1 1 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.963 -0.533 18517 290 1 1 . 1 1 54 54 VAL C C 122 179.860 179.860 177.501 2.359 18517 291 1 1 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.494 3.086 18517 292 1 1 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.386 1.435 18517 293 1 1 . 1 1 54 54 VAL H H 122 7.890 7.890 8.149 -0.259 18517 294 1 1 . 1 1 55 55 ASP N N 123 122.270 122.270 121.171 1.099 18517 295 1 1 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.379 0.091 18517 296 1 1 . 1 1 55 55 ASP C C 123 178.630 178.630 178.441 0.189 18517 297 1 1 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.782 0.018 18517 298 1 1 . 1 1 55 55 ASP CB C 123 42.020 42.020 41.123 0.897 18517 299 1 1 . 1 1 55 55 ASP H H 123 8.270 8.270 8.004 0.266 18517 300 1 1 . 1 1 56 56 GLU N N 124 119.600 119.600 119.326 0.274 18517 301 1 1 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.036 -0.066 18517 302 1 1 . 1 1 56 56 GLU C C 124 179.920 179.920 178.992 0.928 18517 303 1 1 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.178 0.882 18517 304 1 1 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.377 0.593 18517 305 1 1 . 1 1 56 56 GLU H H 124 8.610 8.610 8.477 0.133 18517 306 1 1 . 1 1 57 57 ALA N N 125 120.070 120.070 122.107 -2.037 18517 307 1 1 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.025 -0.195 18517 308 1 1 . 1 1 57 57 ALA C C 125 178.760 178.760 179.578 -0.818 18517 309 1 1 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.986 0.395 18517 310 1 1 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.363 1.778 18517 311 1 1 . 1 1 57 57 ALA H H 125 8.420 8.420 8.368 0.052 18517 312 1 1 . 1 1 58 58 GLY N N 126 106.740 106.740 106.036 0.704 18517 313 1 1 . 1 1 58 58 GLY C C 126 175.740 175.740 175.967 -0.227 18517 314 1 1 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.822 0.468 18517 315 1 1 . 1 1 58 58 GLY H H 126 8.200 8.200 8.503 -0.303 18517 316 1 1 . 1 1 59 59 LYS N N 127 120.920 120.920 122.084 -1.164 18517 317 1 1 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.016 -0.086 18517 318 1 1 . 1 1 59 59 LYS C C 127 180.320 180.320 178.668 1.652 18517 319 1 1 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.319 0.891 18517 320 1 1 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.413 0.567 18517 321 1 1 . 1 1 59 59 LYS H H 127 8.000 8.000 8.092 -0.092 18517 322 1 1 . 1 1 60 60 LYS N N 128 118.400 118.400 119.262 -0.862 18517 323 1 1 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.158 0.012 18517 324 1 1 . 1 1 60 60 LYS C C 128 180.030 180.030 179.094 0.936 18517 325 1 1 . 1 1 60 60 LYS CA C 128 58.750 58.750 58.914 -0.164 18517 326 1 1 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.222 0.048 18517 327 1 1 . 1 1 60 60 LYS H H 128 7.170 7.170 7.842 -0.672 18517 328 1 1 . 1 1 61 61 VAL N N 129 121.050 121.050 120.549 0.501 18517 329 1 1 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.566 -0.286 18517 330 1 1 . 1 1 61 61 VAL C C 129 177.120 177.120 177.735 -0.615 18517 331 1 1 . 1 1 61 61 VAL CA C 129 67.350 67.350 67.093 0.257 18517 332 1 1 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.380 0.250 18517 333 1 1 . 1 1 61 61 VAL H H 129 7.980 7.980 8.126 -0.146 18517 334 1 1 . 1 1 62 62 LYS N N 130 120.040 120.040 120.103 -0.063 18517 335 1 1 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.915 -0.215 18517 336 1 1 . 1 1 62 62 LYS C C 130 178.550 178.550 178.715 -0.165 18517 337 1 1 . 1 1 62 62 LYS CA C 130 60.330 60.330 60.031 0.299 18517 338 1 1 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.312 1.458 18517 339 1 1 . 1 1 62 62 LYS H H 130 8.910 8.910 8.482 0.428 18517 340 1 1 . 1 1 63 63 ALA N N 131 119.570 119.570 121.952 -2.382 18517 341 1 1 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.041 0.179 18517 342 1 1 . 1 1 63 63 ALA C C 131 180.520 180.520 179.417 1.103 18517 343 1 1 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.146 0.074 18517 344 1 1 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.190 0.280 18517 345 1 1 . 1 1 63 63 ALA H H 131 7.920 7.920 8.183 -0.263 18517 346 1 1 . 1 1 64 64 TYR N N 132 120.510 120.510 120.422 0.088 18517 347 1 1 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.181 0.279 18517 348 1 1 . 1 1 64 64 TYR C C 132 176.510 176.510 177.829 -1.319 18517 349 1 1 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.741 -0.101 18517 350 1 1 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.607 0.083 18517 351 1 1 . 1 1 64 64 TYR H H 132 7.930 7.930 8.102 -0.172 18517 352 1 1 . 1 1 65 65 LEU N N 133 117.290 117.290 118.797 -1.507 18517 353 1 1 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.515 0.325 18517 354 1 1 . 1 1 65 65 LEU C C 133 178.610 178.610 179.222 -0.612 18517 355 1 1 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.007 -0.287 18517 356 1 1 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.660 -1.230 18517 357 1 1 . 1 1 65 65 LEU H H 133 8.240 8.240 8.643 -0.403 18517 358 1 1 . 1 1 66 66 GLU N N 134 119.140 119.140 118.894 0.246 18517 359 1 1 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.220 -0.360 18517 360 1 1 . 1 1 66 66 GLU C C 134 180.200 180.200 178.759 1.441 18517 361 1 1 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.592 1.348 18517 362 1 1 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.497 0.313 18517 363 1 1 . 1 1 66 66 GLU H H 134 8.370 8.370 8.634 -0.264 18517 364 1 1 . 1 1 67 67 LYS N N 135 121.390 121.390 120.526 0.864 18517 365 1 1 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.082 -0.082 18517 366 1 1 . 1 1 67 67 LYS C C 135 179.080 179.080 178.441 0.639 18517 367 1 1 . 1 1 67 67 LYS CA C 135 59.620 59.620 59.012 0.608 18517 368 1 1 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.499 -0.229 18517 369 1 1 . 1 1 67 67 LYS H H 135 7.820 7.820 7.607 0.213 18517 370 1 1 . 1 1 68 68 ILE N N 136 110.310 110.310 111.466 -1.156 18517 371 1 1 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.057 0.243 18517 372 1 1 . 1 1 68 68 ILE C C 136 175.520 175.520 176.646 -1.126 18517 373 1 1 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.621 0.809 18517 374 1 1 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.657 -0.677 18517 375 1 1 . 1 1 68 68 ILE H H 136 7.380 7.380 7.592 -0.212 18517 376 1 1 . 1 1 69 69 GLY N N 137 106.680 106.680 108.575 -1.895 18517 377 1 1 . 1 1 69 69 GLY C C 137 174.160 174.160 173.467 0.693 18517 378 1 1 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.652 0.818 18517 379 1 1 . 1 1 69 69 GLY H H 137 7.470 7.470 7.953 -0.483 18517 380 1 1 . 1 1 70 70 ILE N N 138 124.310 124.310 120.927 3.383 18517 381 1 1 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.350 -0.150 18517 382 1 1 . 1 1 70 70 ILE C C 138 174.190 174.190 175.300 -1.110 18517 383 1 1 . 1 1 70 70 ILE CA C 138 59.380 59.380 58.438 0.942 18517 384 1 1 . 1 1 70 70 ILE CB C 138 37.340 37.340 37.499 -0.159 18517 385 1 1 . 1 1 70 70 ILE H H 138 8.530 8.530 8.297 0.233 18517 386 1 1 . 1 1 71 71 ARG N N 139 125.490 125.490 128.705 -3.215 18517 387 1 1 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.439 0.181 18517 388 1 1 . 1 1 71 71 ARG C C 139 175.750 175.750 176.098 -0.348 18517 389 1 1 . 1 1 71 71 ARG CA C 139 54.660 54.660 55.151 -0.491 18517 390 1 1 . 1 1 71 71 ARG CB C 139 33.140 33.140 31.140 2.000 18517 391 1 1 . 1 1 71 71 ARG H H 139 8.240 8.240 8.478 -0.238 18517 392 1 1 . 1 1 72 72 GLY N N 140 104.750 104.750 110.361 -5.611 18517 393 1 1 . 1 1 72 72 GLY C C 140 172.920 172.920 173.185 -0.265 18517 394 1 1 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.854 0.576 18517 395 1 1 . 1 1 72 72 GLY H H 140 7.900 7.900 7.991 -0.091 18517 396 1 1 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.416 0.094 18517 397 1 1 . 1 1 73 73 ASP C C 141 175.060 175.060 176.752 -1.692 18517 398 1 1 . 1 1 73 73 ASP CA C 141 56.170 56.170 56.462 -0.292 18517 399 1 1 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.379 -0.549 18517 400 1 1 . 1 1 74 74 SER N N 142 110.240 110.240 108.713 1.527 18517 401 1 1 . 1 1 74 74 SER HA H 142 4.740 4.740 4.549 0.191 18517 402 1 1 . 1 1 74 74 SER C C 142 175.110 175.110 173.964 1.146 18517 403 1 1 . 1 1 74 74 SER CA C 142 55.700 55.700 56.684 -0.985 18517 404 1 1 . 1 1 74 74 SER CB C 142 67.390 67.390 64.084 3.306 18517 405 1 1 . 1 1 74 74 SER H H 142 7.560 7.560 7.453 0.107 18517 406 1 1 . 1 1 75 75 VAL N N 143 122.950 122.950 120.177 2.773 18517 407 1 1 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.775 -0.045 18517 408 1 1 . 1 1 75 75 VAL C C 143 176.230 176.230 177.167 -0.937 18517 409 1 1 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.998 0.642 18517 410 1 1 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.924 -0.683 18517 411 1 1 . 1 1 75 75 VAL H H 143 9.470 9.470 8.863 0.607 18517 412 1 1 . 1 1 76 76 GLU N N 144 121.390 121.390 121.169 0.221 18517 413 1 1 . 1 1 76 76 GLU HA H 144 3.640 3.640 3.966 -0.326 18517 414 1 1 . 1 1 76 76 GLU C C 144 176.880 176.880 178.046 -1.166 18517 415 1 1 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.560 3.750 18517 416 1 1 . 1 1 76 76 GLU CB C 144 28.070 28.070 29.227 -1.157 18517 417 1 1 . 1 1 76 76 GLU H H 144 9.640 9.640 8.623 1.017 18517 418 1 1 . 1 1 77 77 ALA N N 145 118.770 118.770 121.550 -2.780 18517 419 1 1 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.238 0.022 18517 420 1 1 . 1 1 77 77 ALA C C 145 180.350 180.350 179.698 0.652 18517 421 1 1 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.526 0.253 18517 422 1 1 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.127 1.063 18517 423 1 1 . 1 1 77 77 ALA H H 145 7.860 7.860 7.601 0.259 18517 424 1 1 . 1 1 78 78 ALA N N 146 120.920 120.920 122.667 -1.747 18517 425 1 1 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.033 0.107 18517 426 1 1 . 1 1 78 78 ALA C C 146 179.150 179.150 179.288 -0.138 18517 427 1 1 . 1 1 78 78 ALA CA C 146 55.260 55.260 54.893 0.367 18517 428 1 1 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.617 0.173 18517 429 1 1 . 1 1 78 78 ALA H H 146 8.110 8.110 8.407 -0.297 18517 430 1 1 . 1 1 79 79 LEU N N 147 118.810 118.810 119.393 -0.583 18517 431 1 1 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.019 -0.139 18517 432 1 1 . 1 1 79 79 LEU C C 147 179.080 179.080 178.831 0.249 18517 433 1 1 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.986 0.404 18517 434 1 1 . 1 1 79 79 LEU CB C 147 42.260 42.260 41.206 1.054 18517 435 1 1 . 1 1 79 79 LEU H H 147 8.360 8.360 8.564 -0.204 18517 436 1 1 . 1 1 80 80 ASP N N 148 121.620 121.620 120.123 1.497 18517 437 1 1 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.184 0.336 18517 438 1 1 . 1 1 80 80 ASP C C 148 178.800 178.800 177.949 0.851 18517 439 1 1 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.095 0.295 18517 440 1 1 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.870 -0.120 18517 441 1 1 . 1 1 80 80 ASP H H 148 8.770 8.770 8.457 0.313 18517 442 1 1 . 1 1 81 81 ASN N N 149 118.630 118.630 118.332 0.298 18517 443 1 1 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.478 0.092 18517 444 1 1 . 1 1 81 81 ASN C C 149 177.970 177.970 177.719 0.251 18517 445 1 1 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.004 0.006 18517 446 1 1 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.540 0.070 18517 447 1 1 . 1 1 81 81 ASN H H 149 7.960 7.960 7.821 0.139 18517 448 1 1 . 1 1 82 82 LEU N N 150 120.030 120.030 120.947 -0.917 18517 449 1 1 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.881 0.179 18517 450 1 1 . 1 1 82 82 LEU C C 150 177.790 177.790 179.188 -1.398 18517 451 1 1 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.032 0.838 18517 452 1 1 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.743 0.117 18517 453 1 1 . 1 1 82 82 LEU H H 150 8.230 8.230 8.517 -0.287 18517 454 1 1 . 1 1 83 83 MET N N 151 115.820 115.820 118.443 -2.623 18517 455 1 1 . 1 1 83 83 MET HA H 151 4.390 4.390 4.194 0.196 18517 456 1 1 . 1 1 83 83 MET C C 151 179.760 179.760 179.037 0.723 18517 457 1 1 . 1 1 83 83 MET CA C 151 57.400 57.400 58.061 -0.661 18517 458 1 1 . 1 1 83 83 MET CB C 151 31.080 31.080 31.392 -0.312 18517 459 1 1 . 1 1 83 83 MET H H 151 8.800 8.800 8.536 0.264 18517 460 1 1 . 1 1 84 84 ILE N N 152 120.330 120.330 119.514 0.816 18517 461 1 1 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.738 0.102 18517 462 1 1 . 1 1 84 84 ILE C C 152 178.660 178.660 178.384 0.276 18517 463 1 1 . 1 1 84 84 ILE CA C 152 65.800 65.800 64.266 1.534 18517 464 1 1 . 1 1 84 84 ILE CB C 152 38.450 38.450 36.229 2.221 18517 465 1 1 . 1 1 84 84 ILE H H 152 8.540 8.540 8.448 0.092 18517 466 1 1 . 1 1 85 85 LYS N N 153 118.930 118.930 119.782 -0.852 18517 467 1 1 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.093 0.107 18517 468 1 1 . 1 1 85 85 LYS C C 153 179.650 179.650 179.776 -0.126 18517 469 1 1 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.777 1.203 18517 470 1 1 . 1 1 85 85 LYS CB C 153 33.540 33.540 32.118 1.422 18517 471 1 1 . 1 1 85 85 LYS H H 153 7.510 7.510 8.142 -0.632 18517 472 1 1 . 1 1 86 86 VAL N N 154 119.810 119.810 120.437 -0.627 18517 473 1 1 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.617 0.013 18517 474 1 1 . 1 1 86 86 VAL C C 154 178.350 178.350 178.053 0.297 18517 475 1 1 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.776 0.454 18517 476 1 1 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.828 0.912 18517 477 1 1 . 1 1 86 86 VAL H H 154 8.740 8.740 8.540 0.200 18517 478 1 1 . 1 1 87 87 TYR N N 155 118.370 118.370 118.049 0.321 18517 479 1 1 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.205 0.065 18517 480 1 1 . 1 1 87 87 TYR C C 155 178.580 178.580 178.143 0.437 18517 481 1 1 . 1 1 87 87 TYR CA C 155 62.910 62.910 61.548 1.362 18517 482 1 1 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.387 0.593 18517 483 1 1 . 1 1 87 87 TYR H H 155 8.520 8.520 8.292 0.228 18517 484 1 1 . 1 1 88 88 GLU N N 156 119.900 119.900 121.055 -1.155 18517 485 1 1 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.091 0.089 18517 486 1 1 . 1 1 88 88 GLU C C 156 179.270 179.270 178.802 0.468 18517 487 1 1 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.796 -0.416 18517 488 1 1 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.565 0.645 18517 489 1 1 . 1 1 88 88 GLU H H 156 8.250 8.250 8.488 -0.238 18517 490 1 1 . 1 1 89 89 ILE N N 157 119.510 119.510 117.521 1.989 18517 491 1 1 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.948 0.132 18517 492 1 1 . 1 1 89 89 ILE C C 157 177.890 177.890 178.011 -0.121 18517 493 1 1 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.149 0.161 18517 494 1 1 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.299 0.911 18517 495 1 1 . 1 1 89 89 ILE H H 157 7.630 7.630 7.767 -0.137 18517 496 1 1 . 1 1 90 90 THR N N 158 114.240 114.240 114.671 -0.431 18517 497 1 1 . 1 1 90 90 THR HA H 158 4.130 4.130 4.106 0.024 18517 498 1 1 . 1 1 90 90 THR C C 158 175.530 175.530 175.979 -0.449 18517 499 1 1 . 1 1 90 90 THR CA C 158 64.460 64.460 65.523 -1.063 18517 500 1 1 . 1 1 90 90 THR CB C 158 69.610 69.610 69.021 0.589 18517 501 1 1 . 1 1 90 90 THR H H 158 7.770 7.770 8.243 -0.473 18517 502 1 1 . 1 1 91 91 LYS N N 159 120.280 120.280 117.126 3.154 18517 503 1 1 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.560 -0.250 18517 504 1 1 . 1 1 91 91 LYS C C 159 177.420 177.420 176.966 0.454 18517 505 1 1 . 1 1 91 91 LYS CA C 159 57.400 57.400 56.007 1.393 18517 506 1 1 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.803 -0.583 18517 507 1 1 . 1 1 91 91 LYS H H 159 7.890 7.890 8.065 -0.175 18517 508 1 1 . 1 1 92 92 GLY N N 160 107.910 107.910 109.276 -1.366 18517 509 1 1 . 1 1 92 92 GLY C C 160 174.430 174.430 174.742 -0.312 18517 510 1 1 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.715 0.265 18517 511 1 1 . 1 1 92 92 GLY H H 160 7.930 7.930 8.274 -0.344 18517 512 1 1 . 1 1 93 93 THR N N 161 113.570 113.570 116.271 -2.701 18517 513 1 1 . 1 1 93 93 THR HA H 161 4.390 4.390 4.297 0.093 18517 514 1 1 . 1 1 93 93 THR C C 161 174.790 174.790 174.088 0.702 18517 515 1 1 . 1 1 93 93 THR CA C 161 61.960 61.960 62.539 -0.579 18517 516 1 1 . 1 1 93 93 THR CB C 161 70.010 70.010 69.990 0.021 18517 517 1 1 . 1 1 93 93 THR H H 161 7.970 7.970 7.455 0.515 18517 518 1 1 . 1 1 94 94 VAL N N 162 121.980 121.980 119.517 2.463 18517 519 1 1 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.271 -0.151 18517 520 1 1 . 1 1 94 94 VAL C C 162 176.300 176.300 175.614 0.686 18517 521 1 1 . 1 1 94 94 VAL CA C 162 62.830 62.830 60.351 2.479 18517 522 1 1 . 1 1 94 94 VAL CB C 162 33.060 33.060 32.826 0.234 18517 523 1 1 . 1 1 94 94 VAL H H 162 8.130 8.130 7.993 0.137 18517 524 1 1 . 1 1 95 95 GLU N N 163 124.140 124.140 122.096 2.044 18517 525 1 1 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.219 0.091 18517 526 1 1 . 1 1 95 95 GLU C C 163 176.870 176.870 176.447 0.423 18517 527 1 1 . 1 1 95 95 GLU CA C 163 57.080 57.080 57.042 0.038 18517 528 1 1 . 1 1 95 95 GLU CB C 163 30.440 30.440 30.337 0.103 18517 529 1 1 . 1 1 95 95 GLU H H 163 8.490 8.490 8.492 -0.002 18517 530 1 1 . 1 1 96 96 SER N N 164 116.800 116.800 121.169 -4.369 18517 531 1 1 . 1 1 96 96 SER HA H 164 4.430 4.430 4.458 -0.028 18517 532 1 1 . 1 1 96 96 SER C C 164 174.940 174.940 174.113 0.827 18517 533 1 1 . 1 1 96 96 SER CA C 164 59.070 59.070 60.035 -0.965 18517 534 1 1 . 1 1 96 96 SER CB C 164 64.220 64.220 63.548 0.672 18517 535 1 1 . 1 1 96 96 SER H H 164 8.300 8.300 8.592 -0.292 18517 536 1 1 . 1 1 97 97 SER C C 165 174.660 174.660 173.070 1.590 18517 537 1 1 . 1 1 97 97 SER CA C 165 58.870 58.870 58.317 0.553 18517 538 1 1 . 1 1 97 97 SER CB C 165 64.060 64.060 65.005 -0.945 18517 539 1 1 . 1 1 98 98 ALA N N 166 125.490 125.490 124.515 0.975 18517 540 1 1 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.682 -0.332 18517 541 1 1 . 1 1 98 98 ALA C C 166 177.780 177.780 177.873 -0.093 18517 542 1 1 . 1 1 98 98 ALA CA C 166 53.000 53.000 52.303 0.697 18517 543 1 1 . 1 1 98 98 ALA CB C 166 19.340 19.340 20.722 -1.382 18517 544 1 1 . 1 1 98 98 ALA H H 166 8.180 8.180 8.597 -0.417 18517 545 1 1 . 1 1 99 99 GLN N N 167 118.690 118.690 116.441 2.249 18517 546 1 1 . 1 1 99 99 GLN HA H 167 4.340 4.340 3.950 0.390 18517 547 1 1 . 1 1 99 99 GLN C C 167 176.680 176.680 174.720 1.960 18517 548 1 1 . 1 1 99 99 GLN CA C 167 56.250 56.250 57.522 -1.272 18517 549 1 1 . 1 1 99 99 GLN CB C 167 29.650 29.650 26.638 3.012 18517 550 1 1 . 1 1 99 99 GLN H H 167 8.170 8.170 8.810 -0.640 18517 551 1 1 . 1 1 100 100 GLY N N 168 109.670 109.670 109.621 0.049 18517 552 1 1 . 1 1 100 100 GLY C C 168 174.460 174.460 173.881 0.579 18517 553 1 1 . 1 1 100 100 GLY CA C 168 45.670 45.670 44.115 1.555 18517 554 1 1 . 1 1 100 100 GLY H H 168 8.250 8.250 8.005 0.245 18517 555 1 1 . 1 1 101 101 THR N N 169 112.660 112.660 113.236 -0.576 18517 556 1 1 . 1 1 101 101 THR HA H 169 4.360 4.360 4.420 -0.060 18517 557 1 1 . 1 1 101 101 THR C C 169 174.720 174.720 174.495 0.225 18517 558 1 1 . 1 1 101 101 THR CA C 169 62.080 62.080 61.730 0.350 18517 559 1 1 . 1 1 101 101 THR CB C 169 69.930 69.930 70.240 -0.311 18517 560 1 1 . 1 1 101 101 THR H H 169 8.070 8.070 8.039 0.031 18517 561 1 1 . 1 1 102 102 ASP N N 170 123.090 123.090 121.777 1.313 18517 562 1 1 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.709 -0.009 18517 563 1 1 . 1 1 102 102 ASP C C 170 176.130 176.130 175.747 0.383 18517 564 1 1 . 1 1 102 102 ASP CA C 170 54.780 54.780 53.529 1.251 18517 565 1 1 . 1 1 102 102 ASP CB C 170 42.260 42.260 42.145 0.115 18517 566 1 1 . 1 1 102 102 ASP H H 170 8.170 8.170 8.240 -0.070 18517 567 1 1 . 1 1 103 103 SER N N 171 117.110 117.110 112.897 4.213 18517 568 1 1 . 1 1 103 103 SER HA H 171 4.430 4.430 4.506 -0.076 18517 569 1 1 . 1 1 103 103 SER C C 171 174.770 174.770 174.217 0.553 18517 570 1 1 . 1 1 103 103 SER CA C 171 57.960 57.960 57.571 0.389 18517 571 1 1 . 1 1 103 103 SER CB C 171 64.940 64.940 64.909 0.031 18517 572 1 1 . 1 1 103 103 SER H H 171 8.450 8.450 7.977 0.473 18517 573 1 1 . 1 1 104 104 GLU N N 172 122.970 122.970 122.906 0.064 18517 574 1 1 . 1 1 104 104 GLU HA H 172 4.030 4.030 4.039 -0.009 18517 575 1 1 . 1 1 104 104 GLU C C 172 178.860 178.860 177.923 0.937 18517 576 1 1 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.699 -0.999 18517 577 1 1 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.681 -0.031 18517 578 1 1 . 1 1 104 104 GLU H H 172 8.830 8.830 8.965 -0.135 18517 579 1 1 . 1 1 105 105 GLU N N 173 119.750 119.750 117.718 2.032 18517 580 1 1 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.167 -0.187 18517 581 1 1 . 1 1 105 105 GLU C C 173 178.920 178.920 178.292 0.628 18517 582 1 1 . 1 1 105 105 GLU CA C 173 60.060 60.060 58.564 1.496 18517 583 1 1 . 1 1 105 105 GLU CB C 173 29.730 29.730 28.602 1.128 18517 584 1 1 . 1 1 105 105 GLU H H 173 8.580 8.580 8.753 -0.173 18517 585 1 1 . 1 1 106 106 LEU N N 174 121.860 121.860 120.664 1.196 18517 586 1 1 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.082 0.098 18517 587 1 1 . 1 1 106 106 LEU C C 174 178.210 178.210 179.084 -0.874 18517 588 1 1 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.092 0.788 18517 589 1 1 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.605 -0.455 18517 590 1 1 . 1 1 106 106 LEU H H 174 7.920 7.920 7.623 0.297 18517 591 1 1 . 1 1 107 107 LYS N N 175 118.740 118.740 118.609 0.131 18517 592 1 1 . 1 1 107 107 LYS HA H 175 3.780 3.780 4.055 -0.275 18517 593 1 1 . 1 1 107 107 LYS C C 175 178.700 178.700 179.170 -0.470 18517 594 1 1 . 1 1 107 107 LYS CA C 175 61.170 61.170 59.585 1.585 18517 595 1 1 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.157 0.273 18517 596 1 1 . 1 1 107 107 LYS H H 175 8.340 8.340 8.157 0.183 18517 597 1 1 . 1 1 108 108 THR N N 176 113.820 113.820 117.308 -3.488 18517 598 1 1 . 1 1 108 108 THR HA H 176 3.840 3.840 4.046 -0.206 18517 599 1 1 . 1 1 108 108 THR C C 176 176.620 176.620 175.836 0.784 18517 600 1 1 . 1 1 108 108 THR CA C 176 66.910 66.910 66.808 0.102 18517 601 1 1 . 1 1 108 108 THR CB C 176 69.610 69.610 68.819 0.791 18517 602 1 1 . 1 1 108 108 THR H H 176 7.950 7.950 8.288 -0.338 18517 603 1 1 . 1 1 109 109 LEU N N 177 124.380 124.380 123.396 0.984 18517 604 1 1 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.239 -0.409 18517 605 1 1 . 1 1 109 109 LEU C C 177 177.790 177.790 177.773 0.017 18517 606 1 1 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.896 0.094 18517 607 1 1 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.347 1.233 18517 608 1 1 . 1 1 109 109 LEU H H 177 7.480 7.480 7.975 -0.495 18517 609 1 1 . 1 1 110 110 LEU N N 178 117.230 117.230 118.662 -1.432 18517 610 1 1 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.888 -0.048 18517 611 1 1 . 1 1 110 110 LEU C C 178 179.540 179.540 179.366 0.174 18517 612 1 1 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.549 0.841 18517 613 1 1 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.205 1.135 18517 614 1 1 . 1 1 110 110 LEU H H 178 8.670 8.670 7.954 0.716 18517 615 1 1 . 1 1 111 111 LEU N N 179 119.230 119.230 122.132 -2.902 18517 616 1 1 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.281 -0.201 18517 617 1 1 . 1 1 111 111 LEU C C 179 179.310 179.310 178.564 0.746 18517 618 1 1 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.605 0.785 18517 619 1 1 . 1 1 111 111 LEU CB C 179 42.020 42.020 41.678 0.342 18517 620 1 1 . 1 1 111 111 LEU H H 179 7.940 7.940 8.184 -0.244 18517 621 1 1 . 1 1 112 112 LYS N N 180 121.910 121.910 120.275 1.635 18517 622 1 1 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.005 0.185 18517 623 1 1 . 1 1 112 112 LYS C C 180 178.740 178.740 179.062 -0.322 18517 624 1 1 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.964 -0.784 18517 625 1 1 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.247 -0.377 18517 626 1 1 . 1 1 112 112 LYS H H 180 7.420 7.420 7.992 -0.572 18517 627 1 1 . 1 1 113 113 PHE N N 181 118.220 118.220 118.597 -0.377 18517 628 1 1 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.213 0.537 18517 629 1 1 . 1 1 113 113 PHE C C 181 178.520 178.520 177.952 0.568 18517 630 1 1 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.793 -3.713 18517 631 1 1 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.517 -0.537 18517 632 1 1 . 1 1 113 113 PHE H H 181 9.000 9.000 8.558 0.442 18517 633 1 1 . 1 1 114 114 SER N N 182 113.300 113.300 115.074 -1.774 18517 634 1 1 . 1 1 114 114 SER HA H 182 3.930 3.930 4.086 -0.156 18517 635 1 1 . 1 1 114 114 SER C C 182 177.080 177.080 177.063 0.017 18517 636 1 1 . 1 1 114 114 SER CA C 182 62.000 62.000 62.235 -0.235 18517 637 1 1 . 1 1 114 114 SER CB C 182 63.510 63.510 62.838 0.672 18517 638 1 1 . 1 1 114 114 SER H H 182 8.620 8.620 8.762 -0.142 18517 639 1 1 . 1 1 115 115 GLU N N 183 121.540 121.540 121.964 -0.424 18517 640 1 1 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.224 -0.154 18517 641 1 1 . 1 1 115 115 GLU C C 183 179.860 179.860 178.812 1.048 18517 642 1 1 . 1 1 115 115 GLU CA C 183 59.780 59.780 58.678 1.102 18517 643 1 1 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.255 0.635 18517 644 1 1 . 1 1 115 115 GLU H H 183 8.250 8.250 8.413 -0.163 18517 645 1 1 . 1 1 116 116 ASP N N 184 121.740 121.740 121.210 0.530 18517 646 1 1 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.422 0.088 18517 647 1 1 . 1 1 116 116 ASP C C 184 179.570 179.570 178.354 1.216 18517 648 1 1 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.395 0.165 18517 649 1 1 . 1 1 116 116 ASP CB C 184 40.990 40.990 41.011 -0.021 18517 650 1 1 . 1 1 116 116 ASP H H 184 8.840 8.840 8.425 0.415 18517 651 1 1 . 1 1 117 117 LEU N N 185 121.420 121.420 121.412 0.008 18517 652 1 1 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.069 0.061 18517 653 1 1 . 1 1 117 117 LEU C C 185 178.840 178.840 178.548 0.292 18517 654 1 1 . 1 1 117 117 LEU CA C 185 58.230 58.230 57.848 0.382 18517 655 1 1 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.871 0.779 18517 656 1 1 . 1 1 117 117 LEU H H 185 8.350 8.350 8.018 0.332 18517 657 1 1 . 1 1 118 118 LYS N N 186 119.640 119.640 119.347 0.293 18517 658 1 1 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.947 0.173 18517 659 1 1 . 1 1 118 118 LYS C C 186 178.820 178.820 178.623 0.197 18517 660 1 1 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.224 0.516 18517 661 1 1 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.066 0.444 18517 662 1 1 . 1 1 118 118 LYS H H 186 8.220 8.220 8.121 0.099 18517 663 1 1 . 1 1 119 119 ALA N N 187 120.160 120.160 121.530 -1.370 18517 664 1 1 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.098 0.062 18517 665 1 1 . 1 1 119 119 ALA C C 187 180.450 180.450 179.768 0.682 18517 666 1 1 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.279 -0.140 18517 667 1 1 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.163 0.307 18517 668 1 1 . 1 1 119 119 ALA H H 187 8.010 8.010 7.962 0.048 18517 669 1 1 . 1 1 120 120 GLU N N 188 117.930 117.930 118.692 -0.762 18517 670 1 1 . 1 1 120 120 GLU HA H 188 4.180 4.180 3.949 0.231 18517 671 1 1 . 1 1 120 120 GLU C C 188 178.780 178.780 178.386 0.394 18517 672 1 1 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.031 -0.200 18517 673 1 1 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.419 0.551 18517 674 1 1 . 1 1 120 120 GLU H H 188 7.640 7.640 8.439 -0.799 18517 675 1 1 . 1 1 121 121 GLN N N 189 117.230 117.230 120.341 -3.111 18517 676 1 1 . 1 1 121 121 GLN HA H 189 4.230 4.230 3.284 0.946 18517 677 1 1 . 1 1 121 121 GLN C C 189 179.190 179.190 177.915 1.275 18517 678 1 1 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.955 0.786 18517 679 1 1 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.558 1.091 18517 680 1 1 . 1 1 121 121 GLN H H 189 8.280 8.280 8.062 0.218 18517 681 1 1 . 1 1 122 122 GLU N N 190 118.340 118.340 119.369 -1.029 18517 682 1 1 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.940 0.180 18517 683 1 1 . 1 1 122 122 GLU C C 190 178.210 178.210 178.981 -0.771 18517 684 1 1 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.808 -0.058 18517 685 1 1 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.277 0.692 18517 686 1 1 . 1 1 122 122 GLU H H 190 8.250 8.250 7.927 0.323 18517 687 1 1 . 1 1 123 123 LEU N N 191 118.930 118.930 122.465 -3.535 18517 688 1 1 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.865 0.225 18517 689 1 1 . 1 1 123 123 LEU C C 191 178.500 178.500 178.317 0.183 18517 690 1 1 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.178 -1.178 18517 691 1 1 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.712 0.788 18517 692 1 1 . 1 1 123 123 LEU H H 191 7.530 7.530 8.179 -0.649 18517 693 1 1 . 1 1 124 124 HIS N N 192 115.650 115.650 118.022 -2.372 18517 694 1 1 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.670 0.050 18517 695 1 1 . 1 1 124 124 HIS C C 192 176.090 176.090 177.629 -1.539 18517 696 1 1 . 1 1 124 124 HIS CA C 192 56.690 56.690 59.052 -2.362 18517 697 1 1 . 1 1 124 124 HIS CB C 192 30.760 30.760 29.808 0.952 18517 698 1 1 . 1 1 124 124 HIS H H 192 7.450 7.450 8.543 -1.093 18517 699 1 1 . 1 1 125 125 SER N N 193 115.480 115.480 115.678 -0.198 18517 700 1 1 . 1 1 125 125 SER HA H 193 4.310 4.310 4.351 -0.041 18517 701 1 1 . 1 1 125 125 SER CA C 193 60.180 60.180 61.964 -1.784 18517 702 1 1 . 1 1 125 125 SER CB C 193 64.060 64.060 62.662 1.398 18517 703 1 1 . 1 1 125 125 SER H H 193 8.020 8.020 8.175 -0.155 18517 704 1 1 . 1 1 126 126 GLU C C 194 177.410 177.410 179.203 -1.793 18517 705 1 1 . 1 1 126 126 GLU CA C 194 57.840 57.840 58.642 -0.802 18517 706 1 1 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.435 0.455 18517 707 1 1 . 1 1 127 127 ALA N N 195 122.910 122.910 123.340 -0.430 18517 708 1 1 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.053 0.137 18517 709 1 1 . 1 1 127 127 ALA C C 195 178.610 178.610 179.290 -0.680 18517 710 1 1 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.982 -1.192 18517 711 1 1 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.709 0.551 18517 712 1 1 . 1 1 127 127 ALA H H 195 8.020 8.020 8.218 -0.198 18517 713 1 1 . 1 1 128 128 LYS N N 196 117.770 117.770 114.202 3.568 18517 714 1 1 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.516 -0.256 18517 715 1 1 . 1 1 128 128 LYS C C 196 177.400 177.400 176.345 1.055 18517 716 1 1 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.850 2.150 18517 717 1 1 . 1 1 128 128 LYS CB C 196 32.740 32.740 33.226 -0.486 18517 718 1 1 . 1 1 128 128 LYS H H 196 7.990 7.990 8.045 -0.055 18517 719 1 1 . 1 1 129 129 GLY N N 197 109.010 109.010 108.710 0.300 18517 720 1 1 . 1 1 129 129 GLY C C 197 175.770 175.770 175.535 0.235 18517 721 1 1 . 1 1 129 129 GLY CA C 197 46.100 46.100 45.095 1.005 18517 722 1 1 . 1 1 129 129 GLY H H 197 8.220 8.220 7.658 0.562 18517 723 1 1 . 1 1 130 130 GLY N N 198 109.150 109.150 112.056 -2.906 18517 724 1 1 . 1 1 130 130 GLY C C 198 174.760 174.760 175.312 -0.552 18517 725 1 1 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.106 -0.176 18517 726 1 1 . 1 1 130 130 GLY H H 198 8.210 8.210 8.825 -0.615 18517 727 1 1 . 1 1 131 131 GLU N N 199 121.560 121.560 121.576 -0.016 18517 728 1 1 . 1 1 131 131 GLU HA H 199 4.020 4.020 3.944 0.076 18517 729 1 1 . 1 1 131 131 GLU C C 199 178.500 178.500 178.294 0.206 18517 730 1 1 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.259 0.641 18517 731 1 1 . 1 1 131 131 GLU CB C 199 29.570 29.570 28.558 1.012 18517 732 1 1 . 1 1 131 131 GLU H H 199 8.510 8.510 8.692 -0.182 18517 733 1 1 . 1 1 132 132 ALA N N 200 122.390 122.390 123.472 -1.082 18517 734 1 1 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.154 0.046 18517 735 1 1 . 1 1 132 132 ALA C C 200 180.360 180.360 179.583 0.777 18517 736 1 1 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.466 0.314 18517 737 1 1 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.290 0.100 18517 738 1 1 . 1 1 132 132 ALA H H 200 8.190 8.190 7.701 0.489 18517 739 1 1 . 1 1 133 133 LEU N N 201 120.800 120.800 120.892 -0.092 18517 740 1 1 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.057 0.153 18517 741 1 1 . 1 1 133 133 LEU C C 201 179.270 179.270 178.587 0.683 18517 742 1 1 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.945 -0.265 18517 743 1 1 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.916 0.264 18517 744 1 1 . 1 1 133 133 LEU H H 201 7.720 7.720 8.379 -0.659 18517 745 1 1 . 1 1 134 134 LEU N N 202 120.680 120.680 119.271 1.409 18517 746 1 1 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.999 -0.019 18517 747 1 1 . 1 1 134 134 LEU C C 202 179.030 179.030 178.512 0.518 18517 748 1 1 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.374 1.056 18517 749 1 1 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.186 0.434 18517 750 1 1 . 1 1 134 134 LEU H H 202 8.470 8.470 8.577 -0.107 18517 751 1 1 . 1 1 135 135 SER N N 203 113.290 113.290 115.730 -2.440 18517 752 1 1 . 1 1 135 135 SER HA H 203 4.180 4.180 4.112 0.068 18517 753 1 1 . 1 1 135 135 SER C C 203 177.300 177.300 176.797 0.503 18517 754 1 1 . 1 1 135 135 SER CA C 203 62.080 62.080 62.631 -0.551 18517 755 1 1 . 1 1 135 135 SER CB C 203 63.030 63.030 62.753 0.277 18517 756 1 1 . 1 1 135 135 SER H H 203 8.210 8.210 8.317 -0.107 18517 757 1 1 . 1 1 136 136 SER N N 204 117.500 117.500 119.174 -1.674 18517 758 1 1 . 1 1 136 136 SER HA H 204 4.050 4.050 4.182 -0.132 18517 759 1 1 . 1 1 136 136 SER C C 204 177.570 177.570 176.511 1.059 18517 760 1 1 . 1 1 136 136 SER CA C 204 61.880 61.880 61.699 0.181 18517 761 1 1 . 1 1 136 136 SER CB C 204 63.510 63.510 62.804 0.706 18517 762 1 1 . 1 1 136 136 SER H H 204 7.730 7.730 8.049 -0.319 18517 763 1 1 . 1 1 137 137 MET N N 205 122.500 122.500 121.627 0.873 18517 764 1 1 . 1 1 137 137 MET HA H 205 4.140 4.140 4.001 0.139 18517 765 1 1 . 1 1 137 137 MET C C 205 177.680 177.680 178.484 -0.804 18517 766 1 1 . 1 1 137 137 MET CA C 205 60.140 60.140 59.597 0.542 18517 767 1 1 . 1 1 137 137 MET CB C 205 33.460 33.460 32.385 1.075 18517 768 1 1 . 1 1 137 137 MET H H 205 8.170 8.170 8.580 -0.410 18517 769 1 1 . 1 1 138 138 LYS N N 206 121.410 121.410 119.248 2.162 18517 770 1 1 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.902 -0.152 18517 771 1 1 . 1 1 138 138 LYS C C 206 178.780 178.780 179.141 -0.361 18517 772 1 1 . 1 1 138 138 LYS CA C 206 60.330 60.330 60.060 0.270 18517 773 1 1 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.434 -0.164 18517 774 1 1 . 1 1 138 138 LYS H H 206 8.810 8.810 8.321 0.489 18517 775 1 1 . 1 1 139 139 THR N N 207 116.580 116.580 116.998 -0.418 18517 776 1 1 . 1 1 139 139 THR HA H 207 4.060 4.060 3.951 0.109 18517 777 1 1 . 1 1 139 139 THR C C 207 176.730 176.730 176.920 -0.190 18517 778 1 1 . 1 1 139 139 THR CA C 207 67.150 67.150 66.953 0.198 18517 779 1 1 . 1 1 139 139 THR CB C 207 69.220 69.220 68.720 0.500 18517 780 1 1 . 1 1 139 139 THR H H 207 7.930 7.930 8.107 -0.177 18517 781 1 1 . 1 1 140 140 GLN N N 208 121.390 121.390 119.669 1.721 18517 782 1 1 . 1 1 140 140 GLN HA H 208 4.060 4.060 3.990 0.070 18517 783 1 1 . 1 1 140 140 GLN C C 208 178.550 178.550 178.141 0.409 18517 784 1 1 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.408 -0.108 18517 785 1 1 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.763 0.097 18517 786 1 1 . 1 1 140 140 GLN H H 208 7.600 7.600 8.283 -0.683 18517 787 1 1 . 1 1 141 141 HIS N N 209 122.360 122.360 119.242 3.118 18517 788 1 1 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.334 -0.504 18517 789 1 1 . 1 1 141 141 HIS C C 209 176.390 176.390 177.161 -0.771 18517 790 1 1 . 1 1 141 141 HIS CA C 209 61.720 61.720 59.537 2.183 18517 791 1 1 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.381 -1.281 18517 792 1 1 . 1 1 141 141 HIS H H 209 8.980 8.980 8.377 0.603 18517 793 1 1 . 1 1 142 142 ASP N N 210 120.740 120.740 120.998 -0.258 18517 794 1 1 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.295 0.055 18517 795 1 1 . 1 1 142 142 ASP C C 210 179.490 179.490 178.028 1.462 18517 796 1 1 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.728 0.192 18517 797 1 1 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.811 -0.221 18517 798 1 1 . 1 1 142 142 ASP H H 210 8.770 8.770 8.369 0.401 18517 799 1 1 . 1 1 143 143 GLU N N 211 119.010 119.010 120.281 -1.271 18517 800 1 1 . 1 1 143 143 GLU HA H 211 3.970 3.970 3.980 -0.010 18517 801 1 1 . 1 1 143 143 GLU C C 211 179.070 179.070 178.894 0.176 18517 802 1 1 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.195 0.105 18517 803 1 1 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.368 0.122 18517 804 1 1 . 1 1 143 143 GLU H H 211 7.850 7.850 8.146 -0.296 18517 805 1 1 . 1 1 144 144 LEU N N 212 122.500 122.500 119.629 2.871 18517 806 1 1 . 1 1 144 144 LEU HA H 212 4.070 4.070 3.977 0.093 18517 807 1 1 . 1 1 144 144 LEU C C 212 179.340 179.340 179.291 0.049 18517 808 1 1 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.332 0.058 18517 809 1 1 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.757 0.423 18517 810 1 1 . 1 1 144 144 LEU H H 212 8.070 8.070 7.944 0.126 18517 811 1 1 . 1 1 145 145 LEU N N 213 118.110 118.110 118.300 -0.190 18517 812 1 1 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.583 0.617 18517 813 1 1 . 1 1 145 145 LEU C C 213 179.610 179.610 178.924 0.686 18517 814 1 1 . 1 1 145 145 LEU CA C 213 58.750 58.750 58.038 0.712 18517 815 1 1 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.086 0.144 18517 816 1 1 . 1 1 145 145 LEU H H 213 8.370 8.370 7.863 0.507 18517 817 1 1 . 1 1 146 146 LYS N N 214 117.290 117.290 120.226 -2.936 18517 818 1 1 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.828 0.002 18517 819 1 1 . 1 1 146 146 LYS C C 214 179.900 179.900 178.764 1.136 18517 820 1 1 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.970 0.360 18517 821 1 1 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.286 0.064 18517 822 1 1 . 1 1 146 146 LYS H H 214 7.560 7.560 8.532 -0.972 18517 823 1 1 . 1 1 147 147 LYS N N 215 120.330 120.330 118.793 1.537 18517 824 1 1 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.052 -0.032 18517 825 1 1 . 1 1 147 147 LYS C C 215 180.550 180.550 179.437 1.113 18517 826 1 1 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.367 0.733 18517 827 1 1 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.348 0.392 18517 828 1 1 . 1 1 147 147 LYS H H 215 7.830 7.830 7.920 -0.090 18517 829 1 1 . 1 1 148 148 PHE N N 216 117.370 117.370 118.226 -0.856 18517 830 1 1 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.181 -0.101 18517 831 1 1 . 1 1 148 148 PHE C C 216 178.200 178.200 177.499 0.701 18517 832 1 1 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.125 0.995 18517 833 1 1 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.248 1.472 18517 834 1 1 . 1 1 148 148 PHE H H 216 8.010 8.010 8.437 -0.427 18517 835 1 1 . 1 1 149 149 ALA N N 217 118.990 118.990 120.285 -1.295 18517 836 1 1 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.386 -0.276 18517 837 1 1 . 1 1 149 149 ALA C C 217 177.330 177.330 178.046 -0.716 18517 838 1 1 . 1 1 149 149 ALA CA C 217 53.750 53.750 52.864 0.886 18517 839 1 1 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.734 -1.134 18517 840 1 1 . 1 1 149 149 ALA H H 217 7.720 7.720 7.968 -0.248 18517 841 1 1 . 1 1 150 150 ALA N N 218 118.690 118.690 120.954 -2.264 18517 842 1 1 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.360 -0.000 18517 843 1 1 . 1 1 150 150 ALA C C 218 177.930 177.930 177.694 0.236 18517 844 1 1 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.892 -0.803 18517 845 1 1 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.705 0.035 18517 846 1 1 . 1 1 150 150 ALA H H 218 7.280 7.280 7.769 -0.489 18517 847 1 1 . 1 1 151 151 LEU N N 219 119.980 119.980 121.152 -1.172 18517 848 1 1 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.479 -0.209 18517 849 1 1 . 1 1 151 151 LEU C C 219 176.150 176.150 174.978 1.172 18517 850 1 1 . 1 1 151 151 LEU CA C 219 56.170 56.170 54.576 1.594 18517 851 1 1 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.583 -0.773 18517 852 1 1 . 1 1 151 151 LEU H H 219 7.050 7.050 7.713 -0.663 18517 853 1 1 . 1 1 152 152 THR N N 220 112.070 112.070 116.902 -4.832 18517 854 1 1 . 1 1 152 152 THR HA H 220 4.700 4.700 4.803 -0.103 18517 855 1 1 . 1 1 152 152 THR C C 220 173.400 173.400 173.026 0.374 18517 856 1 1 . 1 1 152 152 THR CA C 220 58.190 58.190 58.569 -0.379 18517 857 1 1 . 1 1 152 152 THR CB C 220 70.960 70.960 69.013 1.947 18517 858 1 1 . 1 1 152 152 THR H H 220 8.040 8.040 8.017 0.023 18517 859 1 1 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.634 0.076 18517 860 1 1 . 1 1 153 153 PRO C C 221 176.720 176.720 175.565 1.155 18517 861 1 1 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.551 0.359 18517 862 1 1 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.797 1.453 18517 863 1 1 . 1 1 154 154 THR N N 222 120.460 120.460 114.323 6.137 18517 864 1 1 . 1 1 154 154 THR HA H 222 4.250 4.250 4.410 -0.160 18517 865 1 1 . 1 1 154 154 THR C C 222 175.190 175.190 174.617 0.573 18517 866 1 1 . 1 1 154 154 THR CA C 222 64.650 64.650 60.664 3.986 18517 867 1 1 . 1 1 154 154 THR CB C 222 70.410 70.410 70.087 0.323 18517 868 1 1 . 1 1 154 154 THR H H 222 8.530 8.530 8.091 0.439 18517 869 1 1 . 1 1 155 155 PHE N N 223 122.260 122.260 123.302 -1.042 18517 870 1 1 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.938 0.052 18517 871 1 1 . 1 1 155 155 PHE C C 223 172.560 172.560 174.606 -2.046 18517 872 1 1 . 1 1 155 155 PHE CA C 223 56.770 56.770 56.447 0.323 18517 873 1 1 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.388 1.202 18517 874 1 1 . 1 1 155 155 PHE H H 223 8.950 8.950 8.010 0.940 18517 875 1 1 . 1 1 156 156 LEU N N 224 123.440 123.440 121.204 2.236 18517 876 1 1 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.582 0.088 18517 877 1 1 . 1 1 156 156 LEU C C 224 175.090 175.090 177.004 -1.914 18517 878 1 1 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.147 -0.117 18517 879 1 1 . 1 1 156 156 LEU CB C 224 46.300 46.300 43.395 2.905 18517 880 1 1 . 1 1 156 156 LEU H H 224 7.210 7.210 7.085 0.125 18517 881 1 1 . 1 1 157 157 THR N N 225 113.010 113.010 112.197 0.813 18517 882 1 1 . 1 1 157 157 THR HA H 225 4.790 4.790 4.593 0.197 18517 883 1 1 . 1 1 157 157 THR C C 225 176.130 176.130 174.077 2.053 18517 884 1 1 . 1 1 157 157 THR CA C 225 59.860 59.860 60.623 -0.763 18517 885 1 1 . 1 1 157 157 THR CB C 225 72.860 72.860 70.528 2.332 18517 886 1 1 . 1 1 157 157 THR H H 225 9.200 9.200 8.171 1.029 18517 887 1 1 . 1 1 158 158 SER N N 226 115.350 115.350 116.056 -0.706 18517 888 1 1 . 1 1 158 158 SER C C 226 177.410 177.410 176.267 1.143 18517 889 1 1 . 1 1 158 158 SER CA C 226 57.400 57.400 58.091 -0.691 18517 890 1 1 . 1 1 158 158 SER CB C 226 66.200 66.200 63.653 2.547 18517 891 1 1 . 1 1 158 158 SER H H 226 8.830 8.830 8.477 0.353 18517 892 1 1 . 1 1 159 159 GLU N N 227 121.200 121.200 120.633 0.567 18517 893 1 1 . 1 1 159 159 GLU HA H 227 4.020 4.020 4.124 -0.104 18517 894 1 1 . 1 1 159 159 GLU C C 227 177.680 177.680 176.721 0.959 18517 895 1 1 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.629 0.871 18517 896 1 1 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.127 0.443 18517 897 1 1 . 1 1 159 159 GLU H H 227 8.320 8.320 8.836 -0.516 18517 898 1 1 . 1 1 160 160 ASP N N 228 115.350 115.350 117.914 -2.564 18517 899 1 1 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.395 0.155 18517 900 1 1 . 1 1 160 160 ASP C C 228 177.640 177.640 177.326 0.314 18517 901 1 1 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.923 0.477 18517 902 1 1 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.575 2.475 18517 903 1 1 . 1 1 160 160 ASP H H 228 7.570 7.570 8.304 -0.734 18517 904 1 1 . 1 1 161 161 ILE N N 229 108.150 108.150 113.295 -5.145 18517 905 1 1 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.428 0.082 18517 906 1 1 . 1 1 161 161 ILE C C 229 173.130 173.130 177.306 -4.176 18517 907 1 1 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.321 -1.031 18517 908 1 1 . 1 1 161 161 ILE CB C 229 39.400 39.400 39.110 0.290 18517 909 1 1 . 1 1 161 161 ILE H H 229 7.190 7.190 7.595 -0.405 18517 910 1 1 . 1 1 162 162 SER N N 230 115.290 115.290 117.102 -1.812 18517 911 1 1 . 1 1 162 162 SER HA H 230 4.760 4.760 3.862 0.898 18517 912 1 1 . 1 1 162 162 SER C C 230 176.060 176.060 175.240 0.820 18517 913 1 1 . 1 1 162 162 SER CA C 230 57.920 57.920 57.441 0.479 18517 914 1 1 . 1 1 162 162 SER CB C 230 66.120 66.120 61.506 4.614 18517 915 1 1 . 1 1 162 162 SER H H 230 7.460 7.460 8.167 -0.707 18517 916 1 1 . 1 1 163 163 GLY C C 231 173.260 173.260 173.313 -0.053 18517 917 1 1 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.900 0.650 18517 918 1 1 . 1 1 164 164 TYR N N 232 115.290 115.290 117.162 -1.872 18517 919 1 1 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.766 -0.066 18517 920 1 1 . 1 1 164 164 TYR C C 232 172.820 172.820 174.050 -1.230 18517 921 1 1 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.017 0.083 18517 922 1 1 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.637 0.163 18517 923 1 1 . 1 1 164 164 TYR H H 232 7.370 7.370 7.321 0.049 18517 924 1 1 . 1 1 165 165 LEU N N 233 120.980 120.980 123.790 -2.810 18517 925 1 1 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.485 -0.055 18517 926 1 1 . 1 1 165 165 LEU C C 233 176.360 176.360 177.521 -1.161 18517 927 1 1 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.514 1.146 18517 928 1 1 . 1 1 165 165 LEU CB C 233 40.430 40.430 41.253 -0.823 18517 929 1 1 . 1 1 165 165 LEU H H 233 8.830 8.830 8.887 -0.057 18517 930 1 1 . 1 1 166 166 THR N N 234 116.170 116.170 114.333 1.837 18517 931 1 1 . 1 1 166 166 THR HA H 234 4.010 4.010 3.570 0.440 18517 932 1 1 . 1 1 166 166 THR C C 234 173.070 173.070 174.075 -1.005 18517 933 1 1 . 1 1 166 166 THR CA C 234 62.910 62.910 64.523 -1.613 18517 934 1 1 . 1 1 166 166 THR CB C 234 70.170 70.170 69.245 0.925 18517 935 1 1 . 1 1 166 166 THR H H 234 8.050 8.050 8.158 -0.108 18517 936 1 1 . 1 1 167 167 VAL N N 235 117.640 117.640 116.631 1.009 18517 937 1 1 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.355 -0.145 18517 938 1 1 . 1 1 167 167 VAL C C 235 172.330 172.330 174.076 -1.746 18517 939 1 1 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.380 1.369 18517 940 1 1 . 1 1 167 167 VAL CB C 235 35.880 35.880 31.017 4.862 18517 941 1 1 . 1 1 167 167 VAL H H 235 7.160 7.160 7.748 -0.588 18517 942 1 1 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.634 -0.444 18517 943 1 1 . 1 1 168 168 PRO C C 236 173.710 173.710 175.586 -1.876 18517 944 1 1 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.473 1.357 18517 945 1 1 . 1 1 168 168 PRO CB C 236 32.270 32.270 32.732 -0.462 18517 946 1 1 . 1 1 169 169 GLU N N 237 113.540 113.540 119.036 -5.496 18517 947 1 1 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.025 0.355 18517 948 1 1 . 1 1 169 169 GLU C C 237 176.690 176.690 178.274 -1.584 18517 949 1 1 . 1 1 169 169 GLU CA C 237 53.750 53.750 56.016 -2.266 18517 950 1 1 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.455 2.765 18517 951 1 1 . 1 1 169 169 GLU H H 237 7.930 7.930 8.268 -0.338 18517 952 1 1 . 1 1 170 170 TYR N N 238 119.400 119.400 121.310 -1.910 18517 953 1 1 . 1 1 170 170 TYR HA H 238 4.000 4.000 3.839 0.161 18517 954 1 1 . 1 1 170 170 TYR C C 238 177.610 177.610 176.716 0.894 18517 955 1 1 . 1 1 170 170 TYR CA C 238 62.630 62.630 60.517 2.113 18517 956 1 1 . 1 1 170 170 TYR CB C 238 37.740 37.740 37.956 -0.216 18517 957 1 1 . 1 1 170 170 TYR H H 238 8.490 8.490 8.758 -0.268 18517 958 1 1 . 1 1 171 171 GLY N N 239 104.160 104.160 102.549 1.611 18517 959 1 1 . 1 1 171 171 GLY C C 239 173.350 173.350 172.990 0.360 18517 960 1 1 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.292 0.978 18517 961 1 1 . 1 1 171 171 GLY H H 239 7.960 7.960 8.103 -0.143 18517 962 1 1 . 1 1 172 172 ALA N N 240 121.860 121.860 123.616 -1.756 18517 963 1 1 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.920 -0.750 18517 964 1 1 . 1 1 172 172 ALA C C 240 172.160 172.160 174.990 -2.830 18517 965 1 1 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.136 0.974 18517 966 1 1 . 1 1 172 172 ALA CB C 240 20.930 20.930 19.852 1.078 18517 967 1 1 . 1 1 172 172 ALA H H 240 6.910 6.910 7.943 -1.033 18517 968 1 1 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.475 1.075 18517 969 1 1 . 1 1 173 173 PRO C C 241 176.610 176.610 175.576 1.034 18517 970 1 1 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.809 -1.289 18517 971 1 1 . 1 1 173 173 PRO CB C 241 33.300 33.300 31.894 1.406 18517 972 1 1 . 1 1 174 174 MET N N 242 114.000 114.000 122.025 -8.025 18517 973 1 1 . 1 1 174 174 MET HA H 242 4.390 4.390 4.551 -0.161 18517 974 1 1 . 1 1 174 174 MET C C 242 173.960 173.960 174.289 -0.329 18517 975 1 1 . 1 1 174 174 MET CA C 242 54.660 54.660 53.811 0.849 18517 976 1 1 . 1 1 174 174 MET CB C 242 34.170 34.170 36.234 -2.064 18517 977 1 1 . 1 1 174 174 MET H H 242 8.040 8.040 7.747 0.293 18517 978 1 1 . 1 1 175 175 ASN N N 243 119.570 119.570 123.102 -3.532 18517 979 1 1 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.714 0.226 18517 980 1 1 . 1 1 175 175 ASN C C 243 174.320 174.320 175.128 -0.808 18517 981 1 1 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.601 0.479 18517 982 1 1 . 1 1 175 175 ASN CB C 243 38.850 38.850 39.026 -0.176 18517 983 1 1 . 1 1 175 175 ASN H H 243 7.960 7.960 8.445 -0.485 18517 984 1 1 . 1 1 176 176 ALA N N 244 132.250 132.250 128.147 4.103 18517 985 1 1 . 1 1 176 176 ALA C C 244 181.580 181.580 178.343 3.237 18517 986 1 1 . 1 1 176 176 ALA CA C 244 55.770 55.770 54.958 0.812 18517 987 1 1 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.882 0.148 18517 988 1 1 . 1 1 176 176 ALA H H 244 12.110 12.110 8.079 4.031 18517 989 1 1 . 1 1 177 177 ALA N N 245 125.780 125.780 122.043 3.737 18517 990 1 1 . 1 1 177 177 ALA HA H 245 3.870 3.870 4.073 -0.203 18517 991 1 1 . 1 1 177 177 ALA C C 245 180.640 180.640 179.608 1.032 18517 992 1 1 . 1 1 177 177 ALA CA C 245 55.660 55.660 54.967 0.693 18517 993 1 1 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.185 -0.345 18517 994 1 1 . 1 1 177 177 ALA H H 245 10.240 10.240 8.047 2.193 18517 995 1 1 . 1 1 178 178 LYS N N 246 119.810 119.810 119.358 0.452 18517 996 1 1 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.085 -0.255 18517 997 1 1 . 1 1 178 178 LYS C C 246 180.500 180.500 178.409 2.091 18517 998 1 1 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.264 0.636 18517 999 1 1 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.501 -1.181 18517 1000 1 1 . 1 1 178 178 LYS H H 246 8.470 8.470 8.611 -0.141 18517 1001 1 1 . 1 1 179 179 TRP N N 247 121.170 121.170 121.623 -0.453 18517 1002 1 1 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.357 0.263 18517 1003 1 1 . 1 1 179 179 TRP C C 247 176.510 176.510 177.751 -1.241 18517 1004 1 1 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.884 -0.064 18517 1005 1 1 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.702 -0.132 18517 1006 1 1 . 1 1 179 179 TRP H H 247 8.330 8.330 8.222 0.108 18517 1007 1 1 . 1 1 180 180 ALA N N 248 119.130 119.130 120.061 -0.931 18517 1008 1 1 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.860 0.680 18517 1009 1 1 . 1 1 180 180 ALA C C 248 182.110 182.110 179.818 2.292 18517 1010 1 1 . 1 1 180 180 ALA CA C 248 54.190 54.190 55.121 -0.931 18517 1011 1 1 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.115 0.595 18517 1012 1 1 . 1 1 180 180 ALA H H 248 7.990 7.990 8.376 -0.386 18517 1013 1 1 . 1 1 181 181 LYS N N 249 116.000 116.000 119.428 -3.428 18517 1014 1 1 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.036 -0.066 18517 1015 1 1 . 1 1 181 181 LYS C C 249 179.380 179.380 178.933 0.447 18517 1016 1 1 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.502 -0.792 18517 1017 1 1 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.614 -0.104 18517 1018 1 1 . 1 1 181 181 LYS H H 249 6.900 6.900 7.866 -0.966 18517 1019 1 1 . 1 1 182 182 VAL N N 250 122.270 122.270 116.581 5.689 18517 1020 1 1 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.688 -0.348 18517 1021 1 1 . 1 1 182 182 VAL C C 250 178.160 178.160 177.675 0.485 18517 1022 1 1 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.388 0.372 18517 1023 1 1 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.420 -0.580 18517 1024 1 1 . 1 1 182 182 VAL H H 250 7.050 7.050 8.148 -1.098 18517 1025 1 1 . 1 1 183 183 GLU N N 251 120.520 120.520 119.869 0.651 18517 1026 1 1 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.933 -0.753 18517 1027 1 1 . 1 1 183 183 GLU C C 251 179.480 179.480 179.320 0.160 18517 1028 1 1 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.254 1.436 18517 1029 1 1 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.443 -0.373 18517 1030 1 1 . 1 1 183 183 GLU H H 251 8.020 8.020 8.701 -0.681 18517 1031 1 1 . 1 1 184 184 GLY N N 252 102.930 102.930 107.807 -4.877 18517 1032 1 1 . 1 1 184 184 GLY C C 252 176.920 176.920 176.477 0.443 18517 1033 1 1 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.136 0.274 18517 1034 1 1 . 1 1 184 184 GLY H H 252 7.830 7.830 8.145 -0.315 18517 1035 1 1 . 1 1 185 185 MET N N 253 123.200 123.200 121.507 1.693 18517 1036 1 1 . 1 1 185 185 MET HA H 253 4.250 4.250 4.114 0.136 18517 1037 1 1 . 1 1 185 185 MET C C 253 179.370 179.370 178.423 0.947 18517 1038 1 1 . 1 1 185 185 MET CA C 253 59.300 59.300 59.096 0.204 18517 1039 1 1 . 1 1 185 185 MET CB C 253 33.930 33.930 32.646 1.284 18517 1040 1 1 . 1 1 185 185 MET H H 253 7.890 7.890 7.924 -0.034 18517 1041 1 1 . 1 1 186 186 ILE N N 254 120.150 120.150 120.558 -0.408 18517 1042 1 1 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.561 -0.001 18517 1043 1 1 . 1 1 186 186 ILE C C 254 177.250 177.250 177.965 -0.715 18517 1044 1 1 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.636 0.884 18517 1045 1 1 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.655 0.635 18517 1046 1 1 . 1 1 186 186 ILE H H 254 8.260 8.260 8.394 -0.134 18517 1047 1 1 . 1 1 187 187 HIS N N 255 119.810 119.810 119.198 0.612 18517 1048 1 1 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.194 -0.194 18517 1049 1 1 . 1 1 187 187 HIS C C 255 176.460 176.460 177.492 -1.032 18517 1050 1 1 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.805 0.525 18517 1051 1 1 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.599 2.031 18517 1052 1 1 . 1 1 187 187 HIS H H 255 8.900 8.900 8.739 0.161 18517 1053 1 1 . 1 1 188 188 GLY N N 256 103.160 103.160 106.898 -3.738 18517 1054 1 1 . 1 1 188 188 GLY C C 256 176.320 176.320 175.823 0.497 18517 1055 1 1 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.626 0.264 18517 1056 1 1 . 1 1 188 188 GLY H H 256 8.030 8.030 8.223 -0.193 18517 1057 1 1 . 1 1 189 189 LYS N N 257 119.510 119.510 119.957 -0.447 18517 1058 1 1 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.094 -0.094 18517 1059 1 1 . 1 1 189 189 LYS C C 257 178.660 178.660 178.582 0.078 18517 1060 1 1 . 1 1 189 189 LYS CA C 257 56.490 56.490 56.568 -0.078 18517 1061 1 1 . 1 1 189 189 LYS CB C 257 31.550 31.550 32.258 -0.708 18517 1062 1 1 . 1 1 189 189 LYS H H 257 7.120 7.120 7.712 -0.592 18517 1063 1 1 . 1 1 190 190 LEU N N 258 120.570 120.570 121.782 -1.212 18517 1064 1 1 . 1 1 190 190 LEU HA H 258 3.930 3.930 4.212 -0.282 18517 1065 1 1 . 1 1 190 190 LEU C C 258 177.230 177.230 176.542 0.688 18517 1066 1 1 . 1 1 190 190 LEU CA C 258 57.520 57.520 56.107 1.413 18517 1067 1 1 . 1 1 190 190 LEU CB C 258 42.970 42.970 41.932 1.038 18517 1068 1 1 . 1 1 190 190 LEU H H 258 8.060 8.060 8.266 -0.206 18517 1069 1 1 . 1 1 191 191 GLU N N 259 114.590 114.590 115.813 -1.223 18517 1070 1 1 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.321 -0.041 18517 1071 1 1 . 1 1 191 191 GLU C C 259 176.230 176.230 176.708 -0.478 18517 1072 1 1 . 1 1 191 191 GLU CA C 259 55.340 55.340 55.562 -0.222 18517 1073 1 1 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.061 0.268 18517 1074 1 1 . 1 1 191 191 GLU H H 259 7.330 7.330 7.977 -0.647 18517 1075 1 1 . 1 1 192 192 SER N N 260 115.240 115.240 115.006 0.234 18517 1076 1 1 . 1 1 192 192 SER HA H 260 4.490 4.490 4.493 -0.003 18517 1077 1 1 . 1 1 192 192 SER C C 260 173.770 173.770 174.572 -0.802 18517 1078 1 1 . 1 1 192 192 SER CA C 260 58.350 58.350 56.716 1.634 18517 1079 1 1 . 1 1 192 192 SER CB C 260 65.090 65.090 64.079 1.011 18517 1080 1 1 . 1 1 192 192 SER H H 260 7.130 7.130 7.542 -0.412 18517 1081 1 1 . 1 1 193 193 SER C C 261 174.600 174.600 173.759 0.841 18517 1082 1 1 . 1 1 193 193 SER CA C 261 59.980 59.980 58.694 1.286 18517 1083 1 1 . 1 1 193 193 SER CB C 261 63.750 63.750 63.212 0.538 18517 1084 1 1 . 1 1 194 194 GLU N N 262 121.800 121.800 121.657 0.143 18517 1085 1 1 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.319 0.151 18517 1086 1 1 . 1 1 194 194 GLU C C 262 174.650 174.650 175.425 -0.775 18517 1087 1 1 . 1 1 194 194 GLU CA C 262 55.620 55.620 56.412 -0.792 18517 1088 1 1 . 1 1 194 194 GLU CB C 262 30.210 30.210 29.812 0.398 18517 1089 1 1 . 1 1 194 194 GLU H H 262 7.840 7.840 7.764 0.076 18517 1090 1 1 . 1 1 195 195 VAL N N 263 124.080 124.080 125.233 -1.153 18517 1091 1 1 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.544 -0.294 18517 1092 1 1 . 1 1 195 195 VAL C C 263 174.460 174.460 174.198 0.262 18517 1093 1 1 . 1 1 195 195 VAL CA C 263 59.820 59.820 58.749 1.071 18517 1094 1 1 . 1 1 195 195 VAL CB C 263 33.620 33.620 33.160 0.460 18517 1095 1 1 . 1 1 195 195 VAL H H 263 8.020 8.020 8.430 -0.410 18517 1096 1 1 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.760 -0.240 18517 1097 1 1 . 1 1 198 198 ASN C C 266 176.490 176.490 177.298 -0.808 18517 1098 1 1 . 1 1 198 198 ASN CA C 266 54.780 54.780 55.429 -0.649 18517 1099 1 1 . 1 1 198 198 ASN CB C 266 38.060 38.060 38.135 -0.075 18517 1100 1 1 . 1 1 199 199 LEU N N 267 120.680 120.680 120.661 0.019 18517 1101 1 1 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.960 0.050 18517 1102 1 1 . 1 1 199 199 LEU C C 267 178.050 178.050 178.165 -0.115 18517 1103 1 1 . 1 1 199 199 LEU CA C 267 58.830 58.830 57.883 0.947 18517 1104 1 1 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.356 0.984 18517 1105 1 1 . 1 1 199 199 LEU H H 267 7.660 7.660 7.895 -0.235 18517 1106 1 1 . 1 1 200 200 LYS N N 268 116.740 116.740 118.806 -2.066 18517 1107 1 1 . 1 1 200 200 LYS HA H 268 3.730 3.730 4.006 -0.276 18517 1108 1 1 . 1 1 200 200 LYS C C 268 178.520 178.520 178.434 0.086 18517 1109 1 1 . 1 1 200 200 LYS CA C 268 61.800 61.800 59.250 2.550 18517 1110 1 1 . 1 1 200 200 LYS CB C 268 32.110 32.110 32.114 -0.003 18517 1111 1 1 . 1 1 200 200 LYS H H 268 8.280 8.280 8.370 -0.090 18517 1112 1 1 . 1 1 201 201 ALA N N 269 121.270 121.270 123.341 -2.071 18517 1113 1 1 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.018 0.222 18517 1114 1 1 . 1 1 201 201 ALA C C 269 180.890 180.890 179.359 1.531 18517 1115 1 1 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.335 -0.155 18517 1116 1 1 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.429 0.041 18517 1117 1 1 . 1 1 201 201 ALA H H 269 7.710 7.710 8.183 -0.473 18517 1118 1 1 . 1 1 202 202 LEU N N 270 119.980 119.980 119.476 0.504 18517 1119 1 1 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.999 0.091 18517 1120 1 1 . 1 1 202 202 LEU C C 270 179.330 179.330 179.667 -0.337 18517 1121 1 1 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.716 0.354 18517 1122 1 1 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.430 0.990 18517 1123 1 1 . 1 1 202 202 LEU H H 270 7.750 7.750 8.111 -0.361 18517 1124 1 1 . 1 1 203 203 VAL N N 271 118.450 118.450 119.418 -0.968 18517 1125 1 1 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.792 0.038 18517 1126 1 1 . 1 1 203 203 VAL C C 271 177.110 177.110 177.907 -0.797 18517 1127 1 1 . 1 1 203 203 VAL CA C 271 67.710 67.710 66.923 0.787 18517 1128 1 1 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.392 0.318 18517 1129 1 1 . 1 1 203 203 VAL H H 271 8.560 8.560 8.064 0.496 18517 1130 1 1 . 1 1 204 204 ALA N N 272 122.560 122.560 122.239 0.321 18517 1131 1 1 . 1 1 204 204 ALA HA H 272 3.880 3.880 3.919 -0.039 18517 1132 1 1 . 1 1 204 204 ALA C C 272 178.700 178.700 179.398 -0.698 18517 1133 1 1 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.566 0.565 18517 1134 1 1 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.163 0.227 18517 1135 1 1 . 1 1 204 204 ALA H H 272 8.120 8.120 8.610 -0.490 18517 1136 1 1 . 1 1 205 205 GLU N N 273 117.290 117.290 119.124 -1.834 18517 1137 1 1 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.078 -0.088 18517 1138 1 1 . 1 1 205 205 GLU C C 273 178.630 178.630 179.168 -0.538 18517 1139 1 1 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.214 0.926 18517 1140 1 1 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.567 0.403 18517 1141 1 1 . 1 1 205 205 GLU H H 273 7.670 7.670 8.241 -0.571 18517 1142 1 1 . 1 1 206 206 LEU N N 274 120.450 120.450 121.984 -1.534 18517 1143 1 1 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.118 -0.118 18517 1144 1 1 . 1 1 206 206 LEU C C 274 178.400 178.400 178.644 -0.244 18517 1145 1 1 . 1 1 206 206 LEU CA C 274 58.910 58.910 57.861 1.049 18517 1146 1 1 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.526 2.004 18517 1147 1 1 . 1 1 206 206 LEU H H 274 8.420 8.420 8.371 0.049 18517 1148 1 1 . 1 1 207 207 ILE N N 275 117.580 117.580 120.840 -3.260 18517 1149 1 1 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.598 -0.068 18517 1150 1 1 . 1 1 207 207 ILE C C 275 178.850 178.850 178.352 0.498 18517 1151 1 1 . 1 1 207 207 ILE CA C 275 66.080 66.080 66.109 -0.029 18517 1152 1 1 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.956 0.814 18517 1153 1 1 . 1 1 207 207 ILE H H 275 8.700 8.700 8.340 0.360 18517 1154 1 1 . 1 1 208 208 GLU N N 276 119.100 119.100 119.118 -0.018 18517 1155 1 1 . 1 1 208 208 GLU HA H 276 4.000 4.000 4.008 -0.008 18517 1156 1 1 . 1 1 208 208 GLU C C 276 178.540 178.540 179.285 -0.745 18517 1157 1 1 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.607 0.843 18517 1158 1 1 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.674 0.846 18517 1159 1 1 . 1 1 208 208 GLU H H 276 7.950 7.950 8.598 -0.648 18517 1160 1 1 . 1 1 209 209 LEU N N 277 120.590 120.590 120.872 -0.282 18517 1161 1 1 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.167 0.053 18517 1162 1 1 . 1 1 209 209 LEU C C 277 179.520 179.520 178.520 1.000 18517 1163 1 1 . 1 1 209 209 LEU CA C 277 58.350 58.350 57.823 0.527 18517 1164 1 1 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.620 1.670 18517 1165 1 1 . 1 1 209 209 LEU H H 277 8.550 8.550 8.558 -0.008 18517 1166 1 1 . 1 1 210 210 ARG N N 278 116.470 116.470 119.701 -3.231 18517 1167 1 1 . 1 1 210 210 ARG HA H 278 3.740 3.740 3.986 -0.246 18517 1168 1 1 . 1 1 210 210 ARG C C 278 179.190 179.190 178.588 0.602 18517 1169 1 1 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.754 1.926 18517 1170 1 1 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.286 1.114 18517 1171 1 1 . 1 1 210 210 ARG H H 278 8.590 8.590 8.453 0.137 18517 1172 1 1 . 1 1 211 211 ALA N N 279 120.470 120.470 122.534 -2.064 18517 1173 1 1 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.017 -0.107 18517 1174 1 1 . 1 1 211 211 ALA C C 279 181.350 181.350 179.905 1.445 18517 1175 1 1 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.346 0.354 18517 1176 1 1 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.311 -1.031 18517 1177 1 1 . 1 1 211 211 ALA H H 279 8.050 8.050 8.334 -0.284 18517 1178 1 1 . 1 1 212 212 GLN N N 280 120.070 120.070 118.140 1.930 18517 1179 1 1 . 1 1 212 212 GLN HA H 280 4.020 4.020 4.034 -0.014 18517 1180 1 1 . 1 1 212 212 GLN C C 280 179.490 179.490 178.632 0.858 18517 1181 1 1 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.620 0.680 18517 1182 1 1 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.354 0.826 18517 1183 1 1 . 1 1 212 212 GLN H H 280 8.300 8.300 8.166 0.134 18517 1184 1 1 . 1 1 213 213 MET N N 281 119.810 119.810 120.987 -1.177 18517 1185 1 1 . 1 1 213 213 MET HA H 281 3.730 3.730 4.100 -0.370 18517 1186 1 1 . 1 1 213 213 MET C C 281 177.490 177.490 178.250 -0.760 18517 1187 1 1 . 1 1 213 213 MET CA C 281 60.690 60.690 58.366 2.324 18517 1188 1 1 . 1 1 213 213 MET CB C 281 33.930 33.930 32.244 1.686 18517 1189 1 1 . 1 1 213 213 MET H H 281 8.420 8.420 8.568 -0.148 18517 1190 1 1 . 1 1 214 214 MET N N 282 114.000 114.000 118.230 -4.230 18517 1191 1 1 . 1 1 214 214 MET HA H 282 3.880 3.880 4.136 -0.256 18517 1192 1 1 . 1 1 214 214 MET C C 282 177.650 177.650 178.120 -0.470 18517 1193 1 1 . 1 1 214 214 MET CA C 282 58.670 58.670 57.702 0.968 18517 1194 1 1 . 1 1 214 214 MET CB C 282 33.300 33.300 31.804 1.496 18517 1195 1 1 . 1 1 214 214 MET H H 282 7.890 7.890 8.453 -0.563 18517 1196 1 1 . 1 1 215 215 ALA N N 283 119.970 119.970 122.963 -2.993 18517 1197 1 1 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.097 0.043 18517 1198 1 1 . 1 1 215 215 ALA C C 283 180.580 180.580 178.830 1.750 18517 1199 1 1 . 1 1 215 215 ALA CA C 283 54.110 54.110 54.987 -0.877 18517 1200 1 1 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.239 -0.559 18517 1201 1 1 . 1 1 215 215 ALA H H 283 7.580 7.580 7.939 -0.359 18517 1202 1 1 . 1 1 216 216 LEU N N 284 120.920 120.920 117.541 3.379 18517 1203 1 1 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.034 -0.074 18517 1204 1 1 . 1 1 216 216 LEU C C 284 177.910 177.910 179.395 -1.485 18517 1205 1 1 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.006 0.914 18517 1206 1 1 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.153 0.347 18517 1207 1 1 . 1 1 216 216 LEU H H 284 7.460 7.460 8.073 -0.613 18517 1208 1 1 . 1 1 217 217 LEU N N 285 116.470 116.470 120.067 -3.597 18517 1209 1 1 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.590 0.090 18517 1210 1 1 . 1 1 217 217 LEU C C 285 178.310 178.310 176.993 1.317 18517 1211 1 1 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.329 0.111 18517 1212 1 1 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.849 1.201 18517 1213 1 1 . 1 1 217 217 LEU H H 285 6.980 6.980 8.136 -1.156 18517 1214 1 1 . 1 1 218 218 TYR N N 286 111.080 111.080 113.483 -2.403 18517 1215 1 1 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.498 0.402 18517 1216 1 1 . 1 1 218 218 TYR C C 286 176.090 176.090 176.110 -0.020 18517 1217 1 1 . 1 1 218 218 TYR CA C 286 56.050 56.050 57.465 -1.415 18517 1218 1 1 . 1 1 218 218 TYR CB C 286 40.910 40.910 37.869 3.041 18517 1219 1 1 . 1 1 218 218 TYR H H 286 7.660 7.660 7.724 -0.064 18517 1220 1 1 . 1 1 219 219 GLY N N 287 108.260 108.260 110.521 -2.261 18517 1221 1 1 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.635 0.686 18517 1222 1 1 . 1 1 219 219 GLY H H 287 7.750 7.750 7.714 0.036 18517 1223 1 1 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.556 -0.066 18517 1224 1 1 . 1 1 221 221 ILE CA C 289 63.580 63.580 64.180 -0.600 18517 1225 1 1 . 1 1 221 221 ILE CB C 289 38.280 38.280 36.852 1.428 18517 1226 1 1 . 1 1 222 222 GLY CA C 290 45.740 45.740 44.563 1.177 18517 1227 1 2 . 1 1 2 2 LYS N N 70 126.600 126.600 126.736 -0.136 18517 1228 1 2 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.694 -0.334 18517 1229 1 2 . 1 1 2 2 LYS C C 70 176.000 176.000 175.360 0.640 18517 1230 1 2 . 1 1 2 2 LYS CA C 70 56.450 56.450 56.146 0.304 18517 1231 1 2 . 1 1 2 2 LYS CB C 70 33.850 33.850 33.941 -0.092 18517 1232 1 2 . 1 1 2 2 LYS H H 70 8.530 8.530 8.325 0.205 18517 1233 1 2 . 1 1 3 3 THR N N 71 111.030 111.030 118.194 -7.164 18517 1234 1 2 . 1 1 3 3 THR HA H 71 4.400 4.400 4.435 -0.035 18517 1235 1 2 . 1 1 3 3 THR C C 71 175.650 175.650 175.771 -0.121 18517 1236 1 2 . 1 1 3 3 THR CA C 71 60.610 60.610 61.377 -0.767 18517 1237 1 2 . 1 1 3 3 THR CB C 71 71.520 71.520 70.374 1.146 18517 1238 1 2 . 1 1 3 3 THR H H 71 7.390 7.390 8.345 -0.955 18517 1239 1 2 . 1 1 4 4 LEU N N 72 121.560 121.560 124.270 -2.710 18517 1240 1 2 . 1 1 4 4 LEU C C 72 177.870 177.870 178.210 -0.340 18517 1241 1 2 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.913 -0.433 18517 1242 1 2 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.202 0.978 18517 1243 1 2 . 1 1 4 4 LEU H H 72 8.980 8.980 8.669 0.311 18517 1244 1 2 . 1 1 5 5 ASP N N 73 115.530 115.530 118.730 -3.200 18517 1245 1 2 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.458 -0.128 18517 1246 1 2 . 1 1 5 5 ASP C C 73 179.290 179.290 178.461 0.829 18517 1247 1 2 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.445 0.395 18517 1248 1 2 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.176 0.654 18517 1249 1 2 . 1 1 5 5 ASP H H 73 8.270 8.270 8.614 -0.344 18517 1250 1 2 . 1 1 6 6 VAL N N 74 122.330 122.330 121.425 0.905 18517 1251 1 2 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.760 -0.020 18517 1252 1 2 . 1 1 6 6 VAL C C 74 178.970 178.970 177.843 1.127 18517 1253 1 2 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.550 0.810 18517 1254 1 2 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.696 0.254 18517 1255 1 2 . 1 1 6 6 VAL H H 74 7.400 7.400 7.689 -0.289 18517 1256 1 2 . 1 1 7 7 LEU N N 75 121.360 121.360 120.808 0.552 18517 1257 1 2 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.933 0.097 18517 1258 1 2 . 1 1 7 7 LEU C C 75 179.240 179.240 179.410 -0.170 18517 1259 1 2 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.286 -0.056 18517 1260 1 2 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.148 1.742 18517 1261 1 2 . 1 1 7 7 LEU H H 75 8.300 8.300 8.659 -0.359 18517 1262 1 2 . 1 1 8 8 ARG N N 76 117.230 117.230 118.387 -1.157 18517 1263 1 2 . 1 1 8 8 ARG HA H 76 3.920 3.920 3.985 -0.065 18517 1264 1 2 . 1 1 8 8 ARG C C 76 178.290 178.290 179.164 -0.874 18517 1265 1 2 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.745 1.026 18517 1266 1 2 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.869 0.341 18517 1267 1 2 . 1 1 8 8 ARG H H 76 8.520 8.520 8.679 -0.159 18517 1268 1 2 . 1 1 9 9 GLY N N 77 104.570 104.570 107.612 -3.042 18517 1269 1 2 . 1 1 9 9 GLY C C 77 176.180 176.180 176.100 0.080 18517 1270 1 2 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.746 0.424 18517 1271 1 2 . 1 1 9 9 GLY H H 77 7.620 7.620 8.213 -0.593 18517 1272 1 2 . 1 1 10 10 GLU N N 78 120.270 120.270 123.119 -2.849 18517 1273 1 2 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.013 0.257 18517 1274 1 2 . 1 1 10 10 GLU C C 78 179.030 179.030 179.165 -0.135 18517 1275 1 2 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.371 -0.501 18517 1276 1 2 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.556 1.844 18517 1277 1 2 . 1 1 10 10 GLU H H 78 8.100 8.100 8.312 -0.212 18517 1278 1 2 . 1 1 11 11 LEU N N 79 116.000 116.000 120.619 -4.619 18517 1279 1 2 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.975 0.535 18517 1280 1 2 . 1 1 11 11 LEU C C 79 179.630 179.630 179.036 0.594 18517 1281 1 2 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.159 -1.469 18517 1282 1 2 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.541 3.259 18517 1283 1 2 . 1 1 11 11 LEU H H 79 8.230 8.230 8.660 -0.430 18517 1284 1 2 . 1 1 12 12 ARG N N 80 120.020 120.020 119.512 0.508 18517 1285 1 2 . 1 1 12 12 ARG HA H 80 3.750 3.750 4.055 -0.305 18517 1286 1 2 . 1 1 12 12 ARG C C 80 178.490 178.490 178.878 -0.388 18517 1287 1 2 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.091 2.909 18517 1288 1 2 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.487 1.753 18517 1289 1 2 . 1 1 12 12 ARG H H 80 8.210 8.210 8.641 -0.431 18517 1290 1 2 . 1 1 13 13 GLY N N 81 108.090 108.090 106.976 1.114 18517 1291 1 2 . 1 1 13 13 GLY C C 81 173.540 173.540 176.362 -2.822 18517 1292 1 2 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.813 1.187 18517 1293 1 2 . 1 1 13 13 GLY H H 81 8.890 8.890 8.462 0.428 18517 1294 1 2 . 1 1 14 14 GLN C C 82 179.540 179.540 178.996 0.544 18517 1295 1 2 . 1 1 14 14 GLN CA C 82 58.710 58.710 59.493 -0.783 18517 1296 1 2 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.732 0.368 18517 1297 1 2 . 1 1 15 15 ARG N N 83 118.220 118.220 118.792 -0.572 18517 1298 1 2 . 1 1 15 15 ARG HA H 83 3.950 3.950 3.973 -0.023 18517 1299 1 2 . 1 1 15 15 ARG C C 83 177.710 177.710 178.648 -0.938 18517 1300 1 2 . 1 1 15 15 ARG CA C 83 59.900 59.900 60.342 -0.442 18517 1301 1 2 . 1 1 15 15 ARG CB C 83 29.650 29.650 30.060 -0.410 18517 1302 1 2 . 1 1 15 15 ARG H H 83 7.320 7.320 8.633 -1.313 18517 1303 1 2 . 1 1 16 16 GLU N N 84 118.810 118.810 120.018 -1.208 18517 1304 1 2 . 1 1 16 16 GLU HA H 84 3.850 3.850 3.970 -0.120 18517 1305 1 2 . 1 1 16 16 GLU C C 84 178.750 178.750 178.960 -0.210 18517 1306 1 2 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.663 1.347 18517 1307 1 2 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.607 -0.197 18517 1308 1 2 . 1 1 16 16 GLU H H 84 8.450 8.450 8.393 0.057 18517 1309 1 2 . 1 1 17 17 ALA N N 85 122.790 122.790 122.313 0.477 18517 1310 1 2 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.094 0.096 18517 1311 1 2 . 1 1 17 17 ALA C C 85 180.360 180.360 179.729 0.631 18517 1312 1 2 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.163 0.297 18517 1313 1 2 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.356 -0.276 18517 1314 1 2 . 1 1 17 17 ALA H H 85 8.420 8.420 8.550 -0.130 18517 1315 1 2 . 1 1 18 18 PHE N N 86 119.400 119.400 120.497 -1.097 18517 1316 1 2 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.457 -0.167 18517 1317 1 2 . 1 1 18 18 PHE C C 86 177.560 177.560 177.693 -0.133 18517 1318 1 2 . 1 1 18 18 PHE CA C 86 61.640 61.640 60.635 1.006 18517 1319 1 2 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.362 0.278 18517 1320 1 2 . 1 1 18 18 PHE H H 86 7.490 7.490 8.489 -0.999 18517 1321 1 2 . 1 1 19 19 LEU N N 87 117.470 117.470 120.156 -2.686 18517 1322 1 2 . 1 1 19 19 LEU HA H 87 4.070 4.070 3.996 0.074 18517 1323 1 2 . 1 1 19 19 LEU C C 87 178.880 178.880 178.539 0.341 18517 1324 1 2 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.308 -0.348 18517 1325 1 2 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.643 0.457 18517 1326 1 2 . 1 1 19 19 LEU H H 87 8.010 8.010 8.718 -0.708 18517 1327 1 2 . 1 1 20 20 SER N N 88 113.770 113.770 115.216 -1.446 18517 1328 1 2 . 1 1 20 20 SER HA H 88 4.070 4.070 4.081 -0.011 18517 1329 1 2 . 1 1 20 20 SER C C 88 175.680 175.680 176.951 -1.271 18517 1330 1 2 . 1 1 20 20 SER CA C 88 63.070 63.070 62.625 0.445 18517 1331 1 2 . 1 1 20 20 SER H H 88 8.100 8.100 8.487 -0.387 18517 1332 1 2 . 1 1 21 21 GLU N N 89 120.570 120.570 121.601 -1.031 18517 1333 1 2 . 1 1 21 21 GLU HA H 89 3.970 3.970 3.983 -0.013 18517 1334 1 2 . 1 1 21 21 GLU C C 89 178.940 178.940 178.875 0.065 18517 1335 1 2 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.359 -0.099 18517 1336 1 2 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.356 -0.026 18517 1337 1 2 . 1 1 21 21 GLU H H 89 7.400 7.400 7.845 -0.445 18517 1338 1 2 . 1 1 22 22 ILE N N 90 119.350 119.350 119.171 0.179 18517 1339 1 2 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.863 -0.173 18517 1340 1 2 . 1 1 22 22 ILE C C 90 177.230 177.230 178.371 -1.141 18517 1341 1 2 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.485 0.985 18517 1342 1 2 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.479 -0.089 18517 1343 1 2 . 1 1 22 22 ILE H H 90 7.250 7.250 7.943 -0.693 18517 1344 1 2 . 1 1 23 23 ILE N N 91 116.350 116.350 119.493 -3.143 18517 1345 1 2 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.849 -0.449 18517 1346 1 2 . 1 1 23 23 ILE C C 91 176.690 176.690 177.223 -0.533 18517 1347 1 2 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.026 2.704 18517 1348 1 2 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.442 0.328 18517 1349 1 2 . 1 1 23 23 ILE H H 91 7.860 7.860 8.268 -0.408 18517 1350 1 2 . 1 1 24 24 LYS N N 92 116.000 116.000 118.742 -2.742 18517 1351 1 2 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.214 -0.074 18517 1352 1 2 . 1 1 24 24 LYS C C 92 176.270 176.270 176.930 -0.660 18517 1353 1 2 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.322 0.158 18517 1354 1 2 . 1 1 24 24 LYS CB C 92 33.300 33.300 33.181 0.119 18517 1355 1 2 . 1 1 24 24 LYS H H 92 7.170 7.170 7.793 -0.623 18517 1356 1 2 . 1 1 25 25 SER N N 93 114.650 114.650 114.400 0.250 18517 1357 1 2 . 1 1 25 25 SER HA H 93 4.550 4.550 4.460 0.090 18517 1358 1 2 . 1 1 25 25 SER C C 93 173.370 173.370 172.848 0.522 18517 1359 1 2 . 1 1 25 25 SER CA C 93 57.240 57.240 58.941 -1.701 18517 1360 1 2 . 1 1 25 25 SER CB C 93 65.650 65.650 64.413 1.237 18517 1361 1 2 . 1 1 25 25 SER H H 93 7.730 7.730 7.781 -0.051 18517 1362 1 2 . 1 1 26 26 ASP N N 94 121.230 121.230 118.788 2.442 18517 1363 1 2 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.687 0.243 18517 1364 1 2 . 1 1 26 26 ASP C C 94 176.560 176.560 175.710 0.850 18517 1365 1 2 . 1 1 26 26 ASP CA C 94 54.510 54.510 54.641 -0.131 18517 1366 1 2 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.849 0.801 18517 1367 1 2 . 1 1 26 26 ASP H H 94 8.280 8.280 8.340 -0.060 18517 1368 1 2 . 1 1 27 27 GLY N N 95 109.310 109.310 108.727 0.583 18517 1369 1 2 . 1 1 27 27 GLY C C 95 171.080 171.080 172.013 -0.933 18517 1370 1 2 . 1 1 27 27 GLY CA C 95 42.770 42.770 44.175 -1.405 18517 1371 1 2 . 1 1 27 27 GLY H H 95 8.160 8.160 7.666 0.494 18517 1372 1 2 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.532 0.608 18517 1373 1 2 . 1 1 29 29 PHE C C 97 175.230 175.230 175.088 0.142 18517 1374 1 2 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.704 -0.214 18517 1375 1 2 . 1 1 29 29 PHE CB C 97 41.620 41.620 41.442 0.178 18517 1376 1 2 . 1 1 30 30 THR N N 98 112.600 112.600 111.867 0.733 18517 1377 1 2 . 1 1 30 30 THR HA H 98 4.570 4.570 4.042 0.528 18517 1378 1 2 . 1 1 30 30 THR C C 98 176.690 176.690 173.923 2.767 18517 1379 1 2 . 1 1 30 30 THR CA C 98 60.290 60.290 60.294 -0.004 18517 1380 1 2 . 1 1 30 30 THR CB C 98 71.600 71.600 69.886 1.714 18517 1381 1 2 . 1 1 30 30 THR H H 98 8.990 8.990 8.086 0.904 18517 1382 1 2 . 1 1 31 31 ILE N N 99 119.240 119.240 120.449 -1.209 18517 1383 1 2 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.708 0.112 18517 1384 1 2 . 1 1 31 31 ILE C C 99 176.090 176.090 176.637 -0.547 18517 1385 1 2 . 1 1 31 31 ILE CA C 99 60.140 60.140 62.580 -2.440 18517 1386 1 2 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.934 -0.984 18517 1387 1 2 . 1 1 31 31 ILE H H 99 9.230 9.230 7.435 1.795 18517 1388 1 2 . 1 1 32 32 LEU N N 100 119.660 119.660 120.127 -0.467 18517 1389 1 2 . 1 1 32 32 LEU HA H 100 4.030 4.030 4.006 0.024 18517 1390 1 2 . 1 1 32 32 LEU C C 100 181.050 181.050 179.624 1.426 18517 1391 1 2 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.835 -0.275 18517 1392 1 2 . 1 1 32 32 LEU CB C 100 40.120 40.120 40.160 -0.041 18517 1393 1 2 . 1 1 32 32 LEU H H 100 7.310 7.310 7.489 -0.179 18517 1394 1 2 . 1 1 33 33 GLN N N 101 121.450 121.450 118.439 3.011 18517 1395 1 2 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.377 -0.127 18517 1396 1 2 . 1 1 33 33 GLN CA C 101 59.700 59.700 58.946 0.754 18517 1397 1 2 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.525 3.265 18517 1398 1 2 . 1 1 33 33 GLN H H 101 7.790 7.790 8.143 -0.353 18517 1399 1 2 . 1 1 34 34 LEU C C 102 178.590 178.590 179.093 -0.503 18517 1400 1 2 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.174 0.456 18517 1401 1 2 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.605 -0.294 18517 1402 1 2 . 1 1 35 35 VAL N N 103 118.520 118.520 117.092 1.428 18517 1403 1 2 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.672 -0.252 18517 1404 1 2 . 1 1 35 35 VAL C C 103 177.930 177.930 178.009 -0.079 18517 1405 1 2 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.012 0.028 18517 1406 1 2 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.550 1.080 18517 1407 1 2 . 1 1 35 35 VAL H H 103 8.670 8.670 8.618 0.052 18517 1408 1 2 . 1 1 36 36 GLY N N 104 109.430 109.430 109.494 -0.064 18517 1409 1 2 . 1 1 36 36 GLY C C 104 174.600 174.600 175.728 -1.128 18517 1410 1 2 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.299 0.741 18517 1411 1 2 . 1 1 36 36 GLY H H 104 7.880 7.880 8.042 -0.162 18517 1412 1 2 . 1 1 37 37 TYR N N 105 122.270 122.270 124.141 -1.871 18517 1413 1 2 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.477 -0.597 18517 1414 1 2 . 1 1 37 37 TYR C C 105 176.310 176.310 176.993 -0.683 18517 1415 1 2 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.100 3.999 18517 1416 1 2 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.754 -0.384 18517 1417 1 2 . 1 1 37 37 TYR H H 105 8.170 8.170 8.642 -0.472 18517 1418 1 2 . 1 1 38 38 LEU N N 106 120.100 120.100 120.984 -0.884 18517 1419 1 2 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.806 -0.066 18517 1420 1 2 . 1 1 38 38 LEU C C 106 178.280 178.280 178.451 -0.171 18517 1421 1 2 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.009 0.621 18517 1422 1 2 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.576 1.154 18517 1423 1 2 . 1 1 38 38 LEU H H 106 7.610 7.610 8.221 -0.611 18517 1424 1 2 . 1 1 39 39 ARG N N 107 116.670 116.670 118.819 -2.149 18517 1425 1 2 . 1 1 39 39 ARG HA H 107 3.680 3.680 3.909 -0.229 18517 1426 1 2 . 1 1 39 39 ARG C C 107 179.480 179.480 178.662 0.818 18517 1427 1 2 . 1 1 39 39 ARG CA C 107 59.580 59.580 59.726 -0.146 18517 1428 1 2 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.814 1.426 18517 1429 1 2 . 1 1 39 39 ARG H H 107 8.240 8.240 7.873 0.367 18517 1430 1 2 . 1 1 40 40 VAL N N 108 121.970 121.970 120.263 1.707 18517 1431 1 2 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.671 -0.271 18517 1432 1 2 . 1 1 40 40 VAL C C 108 178.440 178.440 178.342 0.098 18517 1433 1 2 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.942 1.008 18517 1434 1 2 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.725 -1.285 18517 1435 1 2 . 1 1 40 40 VAL H H 108 8.200 8.200 7.918 0.282 18517 1436 1 2 . 1 1 41 41 VAL N N 109 108.940 108.940 115.496 -6.556 18517 1437 1 2 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.389 0.851 18517 1438 1 2 . 1 1 41 41 VAL C C 109 175.070 175.070 177.071 -2.001 18517 1439 1 2 . 1 1 41 41 VAL CA C 109 62.590 62.590 66.322 -3.732 18517 1440 1 2 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.928 -1.278 18517 1441 1 2 . 1 1 41 41 VAL H H 109 7.760 7.760 7.878 -0.118 18517 1442 1 2 . 1 1 42 42 ASP N N 110 124.670 124.670 120.936 3.734 18517 1443 1 2 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.319 0.301 18517 1444 1 2 . 1 1 42 42 ASP C C 110 177.310 177.310 178.270 -0.960 18517 1445 1 2 . 1 1 42 42 ASP CA C 110 59.980 59.980 58.059 1.921 18517 1446 1 2 . 1 1 42 42 ASP CB C 110 44.950 44.950 41.328 3.622 18517 1447 1 2 . 1 1 42 42 ASP H H 110 7.360 7.360 8.611 -1.251 18517 1448 1 2 . 1 1 43 43 THR N N 111 102.340 102.340 111.793 -9.453 18517 1449 1 2 . 1 1 43 43 THR HA H 111 5.100 5.100 4.166 0.934 18517 1450 1 2 . 1 1 43 43 THR C C 111 174.940 174.940 176.539 -1.599 18517 1451 1 2 . 1 1 43 43 THR CA C 111 60.650 60.650 65.004 -4.354 18517 1452 1 2 . 1 1 43 43 THR CB C 111 69.610 69.610 68.626 0.984 18517 1453 1 2 . 1 1 43 43 THR H H 111 6.380 6.380 8.060 -1.680 18517 1454 1 2 . 1 1 44 44 ASP N N 112 119.750 119.750 123.326 -3.576 18517 1455 1 2 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.298 -0.438 18517 1456 1 2 . 1 1 44 44 ASP C C 112 178.850 178.850 177.703 1.147 18517 1457 1 2 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.785 0.445 18517 1458 1 2 . 1 1 44 44 ASP CB C 112 39.400 39.400 41.040 -1.640 18517 1459 1 2 . 1 1 44 44 ASP H H 112 9.050 9.050 8.278 0.772 18517 1460 1 2 . 1 1 45 45 LEU N N 113 123.910 123.910 121.679 2.231 18517 1461 1 2 . 1 1 45 45 LEU HA H 113 3.810 3.810 4.005 -0.195 18517 1462 1 2 . 1 1 45 45 LEU C C 113 182.040 182.040 179.649 2.391 18517 1463 1 2 . 1 1 45 45 LEU CA C 113 57.320 57.320 57.867 -0.547 18517 1464 1 2 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.789 -1.039 18517 1465 1 2 . 1 1 45 45 LEU H H 113 9.710 9.710 7.957 1.753 18517 1466 1 2 . 1 1 46 46 LEU N N 114 117.640 117.640 118.080 -0.440 18517 1467 1 2 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.114 -0.004 18517 1468 1 2 . 1 1 46 46 LEU C C 114 179.540 179.540 178.667 0.873 18517 1469 1 2 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.645 -0.085 18517 1470 1 2 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.519 -0.049 18517 1471 1 2 . 1 1 46 46 LEU H H 114 8.270 8.270 7.718 0.552 18517 1472 1 2 . 1 1 47 47 LEU N N 115 116.520 116.520 115.157 1.363 18517 1473 1 2 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.367 -0.227 18517 1474 1 2 . 1 1 47 47 LEU C C 115 173.850 173.850 176.281 -2.431 18517 1475 1 2 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.482 0.938 18517 1476 1 2 . 1 1 47 47 LEU CB C 115 44.720 44.720 42.218 2.502 18517 1477 1 2 . 1 1 47 47 LEU H H 115 8.160 8.160 8.064 0.096 18517 1478 1 2 . 1 1 48 48 LYS N N 116 114.710 114.710 118.051 -3.341 18517 1479 1 2 . 1 1 48 48 LYS HA H 116 3.810 3.810 4.109 -0.299 18517 1480 1 2 . 1 1 48 48 LYS C C 116 176.510 176.510 175.461 1.049 18517 1481 1 2 . 1 1 48 48 LYS CA C 116 57.200 57.200 57.003 0.197 18517 1482 1 2 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.393 -0.373 18517 1483 1 2 . 1 1 48 48 LYS H H 116 7.580 7.580 7.808 -0.228 18517 1484 1 2 . 1 1 49 49 VAL N N 117 119.050 119.050 119.781 -0.731 18517 1485 1 2 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.339 -0.729 18517 1486 1 2 . 1 1 49 49 VAL C C 117 175.860 175.860 175.987 -0.127 18517 1487 1 2 . 1 1 49 49 VAL CA C 117 63.510 63.510 60.734 2.776 18517 1488 1 2 . 1 1 49 49 VAL CB C 117 32.350 32.350 33.230 -0.880 18517 1489 1 2 . 1 1 49 49 VAL H H 117 7.980 7.980 8.305 -0.325 18517 1490 1 2 . 1 1 50 50 ASP N N 118 126.900 126.900 122.514 4.386 18517 1491 1 2 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.550 -0.300 18517 1492 1 2 . 1 1 50 50 ASP C C 118 177.700 177.700 176.531 1.169 18517 1493 1 2 . 1 1 50 50 ASP CA C 118 56.050 56.050 54.276 1.774 18517 1494 1 2 . 1 1 50 50 ASP CB C 118 42.580 42.580 40.707 1.873 18517 1495 1 2 . 1 1 50 50 ASP H H 118 8.930 8.930 8.515 0.415 18517 1496 1 2 . 1 1 51 51 SER N N 119 124.790 124.790 122.464 2.326 18517 1497 1 2 . 1 1 51 51 SER HA H 119 4.070 4.070 4.452 -0.382 18517 1498 1 2 . 1 1 51 51 SER C C 119 177.220 177.220 176.145 1.075 18517 1499 1 2 . 1 1 51 51 SER CA C 119 61.640 61.640 60.725 0.915 18517 1500 1 2 . 1 1 51 51 SER CB C 119 63.510 63.510 63.196 0.314 18517 1501 1 2 . 1 1 51 51 SER H H 119 8.560 8.560 8.539 0.021 18517 1502 1 2 . 1 1 52 52 THR N N 120 119.880 119.880 118.514 1.366 18517 1503 1 2 . 1 1 52 52 THR HA H 120 4.190 4.190 4.149 0.041 18517 1504 1 2 . 1 1 52 52 THR C C 120 177.120 177.120 176.193 0.927 18517 1505 1 2 . 1 1 52 52 THR CA C 120 66.280 66.280 66.377 -0.097 18517 1506 1 2 . 1 1 52 52 THR CB C 120 68.420 68.420 68.799 -0.379 18517 1507 1 2 . 1 1 52 52 THR H H 120 8.310 8.310 8.368 -0.058 18517 1508 1 2 . 1 1 53 53 LYS N N 121 122.270 122.270 122.655 -0.385 18517 1509 1 2 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.312 -0.192 18517 1510 1 2 . 1 1 53 53 LYS C C 121 178.970 178.970 178.765 0.205 18517 1511 1 2 . 1 1 53 53 LYS CA C 121 59.580 59.580 57.922 1.658 18517 1512 1 2 . 1 1 53 53 LYS CB C 121 34.250 34.250 31.976 2.274 18517 1513 1 2 . 1 1 53 53 LYS H H 121 7.700 7.700 7.906 -0.206 18517 1514 1 2 . 1 1 54 54 VAL N N 122 120.070 120.070 120.514 -0.444 18517 1515 1 2 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.971 -0.541 18517 1516 1 2 . 1 1 54 54 VAL C C 122 179.860 179.860 177.947 1.913 18517 1517 1 2 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.781 2.799 18517 1518 1 2 . 1 1 54 54 VAL CB C 122 32.820 32.820 32.054 0.765 18517 1519 1 2 . 1 1 54 54 VAL H H 122 7.890 7.890 8.109 -0.219 18517 1520 1 2 . 1 1 55 55 ASP N N 123 122.270 122.270 120.644 1.626 18517 1521 1 2 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.379 0.091 18517 1522 1 2 . 1 1 55 55 ASP C C 123 178.630 178.630 178.305 0.325 18517 1523 1 2 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.764 0.036 18517 1524 1 2 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.936 1.084 18517 1525 1 2 . 1 1 55 55 ASP H H 123 8.270 8.270 7.959 0.311 18517 1526 1 2 . 1 1 56 56 GLU N N 124 119.600 119.600 119.893 -0.293 18517 1527 1 2 . 1 1 56 56 GLU HA H 124 3.970 3.970 3.984 -0.014 18517 1528 1 2 . 1 1 56 56 GLU C C 124 179.920 179.920 179.070 0.850 18517 1529 1 2 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.204 0.856 18517 1530 1 2 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.647 0.323 18517 1531 1 2 . 1 1 56 56 GLU H H 124 8.610 8.610 8.189 0.421 18517 1532 1 2 . 1 1 57 57 ALA N N 125 120.070 120.070 121.206 -1.136 18517 1533 1 2 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.130 -0.300 18517 1534 1 2 . 1 1 57 57 ALA C C 125 178.760 178.760 179.446 -0.686 18517 1535 1 2 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.691 0.689 18517 1536 1 2 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.429 1.711 18517 1537 1 2 . 1 1 57 57 ALA H H 125 8.420 8.420 8.285 0.135 18517 1538 1 2 . 1 1 58 58 GLY N N 126 106.740 106.740 106.774 -0.034 18517 1539 1 2 . 1 1 58 58 GLY C C 126 175.740 175.740 175.938 -0.198 18517 1540 1 2 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.927 0.363 18517 1541 1 2 . 1 1 58 58 GLY H H 126 8.200 8.200 8.264 -0.064 18517 1542 1 2 . 1 1 59 59 LYS N N 127 120.920 120.920 122.300 -1.380 18517 1543 1 2 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.004 -0.074 18517 1544 1 2 . 1 1 59 59 LYS C C 127 180.320 180.320 178.570 1.750 18517 1545 1 2 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.361 0.849 18517 1546 1 2 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.394 0.586 18517 1547 1 2 . 1 1 59 59 LYS H H 127 8.000 8.000 8.202 -0.202 18517 1548 1 2 . 1 1 60 60 LYS N N 128 118.400 118.400 119.184 -0.784 18517 1549 1 2 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.142 0.028 18517 1550 1 2 . 1 1 60 60 LYS C C 128 180.030 180.030 179.176 0.854 18517 1551 1 2 . 1 1 60 60 LYS CA C 128 58.750 58.750 58.805 -0.055 18517 1552 1 2 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.009 0.261 18517 1553 1 2 . 1 1 60 60 LYS H H 128 7.170 7.170 7.801 -0.631 18517 1554 1 2 . 1 1 61 61 VAL N N 129 121.050 121.050 120.117 0.933 18517 1555 1 2 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.366 -0.086 18517 1556 1 2 . 1 1 61 61 VAL C C 129 177.120 177.120 177.671 -0.551 18517 1557 1 2 . 1 1 61 61 VAL CA C 129 67.350 67.350 66.976 0.374 18517 1558 1 2 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.366 0.264 18517 1559 1 2 . 1 1 61 61 VAL H H 129 7.980 7.980 8.056 -0.076 18517 1560 1 2 . 1 1 62 62 LYS N N 130 120.040 120.040 120.280 -0.240 18517 1561 1 2 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.896 -0.196 18517 1562 1 2 . 1 1 62 62 LYS C C 130 178.550 178.550 178.711 -0.161 18517 1563 1 2 . 1 1 62 62 LYS CA C 130 60.330 60.330 60.060 0.270 18517 1564 1 2 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.309 1.461 18517 1565 1 2 . 1 1 62 62 LYS H H 130 8.910 8.910 8.376 0.534 18517 1566 1 2 . 1 1 63 63 ALA N N 131 119.570 119.570 121.725 -2.155 18517 1567 1 2 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.007 0.213 18517 1568 1 2 . 1 1 63 63 ALA C C 131 180.520 180.520 179.291 1.229 18517 1569 1 2 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.242 -0.022 18517 1570 1 2 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.183 0.287 18517 1571 1 2 . 1 1 63 63 ALA H H 131 7.920 7.920 8.420 -0.500 18517 1572 1 2 . 1 1 64 64 TYR N N 132 120.510 120.510 120.230 0.280 18517 1573 1 2 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.157 0.303 18517 1574 1 2 . 1 1 64 64 TYR C C 132 176.510 176.510 178.001 -1.491 18517 1575 1 2 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.990 -0.350 18517 1576 1 2 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.541 0.149 18517 1577 1 2 . 1 1 64 64 TYR H H 132 7.930 7.930 8.057 -0.127 18517 1578 1 2 . 1 1 65 65 LEU N N 133 117.290 117.290 118.656 -1.366 18517 1579 1 2 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.524 0.316 18517 1580 1 2 . 1 1 65 65 LEU C C 133 178.610 178.610 179.151 -0.541 18517 1581 1 2 . 1 1 65 65 LEU CA C 133 57.720 57.720 57.966 -0.246 18517 1582 1 2 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.742 -1.312 18517 1583 1 2 . 1 1 65 65 LEU H H 133 8.240 8.240 8.414 -0.174 18517 1584 1 2 . 1 1 66 66 GLU N N 134 119.140 119.140 118.802 0.338 18517 1585 1 2 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.138 -0.278 18517 1586 1 2 . 1 1 66 66 GLU C C 134 180.200 180.200 178.768 1.432 18517 1587 1 2 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.646 1.294 18517 1588 1 2 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.547 0.263 18517 1589 1 2 . 1 1 66 66 GLU H H 134 8.370 8.370 8.698 -0.328 18517 1590 1 2 . 1 1 67 67 LYS N N 135 121.390 121.390 120.203 1.187 18517 1591 1 2 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.124 -0.124 18517 1592 1 2 . 1 1 67 67 LYS C C 135 179.080 179.080 178.495 0.585 18517 1593 1 2 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.751 0.869 18517 1594 1 2 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.619 -0.349 18517 1595 1 2 . 1 1 67 67 LYS H H 135 7.820 7.820 7.652 0.168 18517 1596 1 2 . 1 1 68 68 ILE N N 136 110.310 110.310 113.402 -3.092 18517 1597 1 2 . 1 1 68 68 ILE HA H 136 4.300 4.300 3.923 0.377 18517 1598 1 2 . 1 1 68 68 ILE C C 136 175.520 175.520 176.566 -1.046 18517 1599 1 2 . 1 1 68 68 ILE CA C 136 62.430 62.430 62.141 0.289 18517 1600 1 2 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.384 -0.404 18517 1601 1 2 . 1 1 68 68 ILE H H 136 7.380 7.380 7.684 -0.304 18517 1602 1 2 . 1 1 69 69 GLY N N 137 106.680 106.680 107.467 -0.787 18517 1603 1 2 . 1 1 69 69 GLY C C 137 174.160 174.160 174.003 0.157 18517 1604 1 2 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.400 1.070 18517 1605 1 2 . 1 1 69 69 GLY H H 137 7.470 7.470 7.753 -0.283 18517 1606 1 2 . 1 1 70 70 ILE N N 138 124.310 124.310 122.359 1.951 18517 1607 1 2 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.285 -0.085 18517 1608 1 2 . 1 1 70 70 ILE C C 138 174.190 174.190 175.090 -0.900 18517 1609 1 2 . 1 1 70 70 ILE CA C 138 59.380 59.380 59.380 0.000 18517 1610 1 2 . 1 1 70 70 ILE CB C 138 37.340 37.340 37.974 -0.634 18517 1611 1 2 . 1 1 70 70 ILE H H 138 8.530 8.530 8.341 0.189 18517 1612 1 2 . 1 1 71 71 ARG N N 139 125.490 125.490 127.645 -2.155 18517 1613 1 2 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.502 0.118 18517 1614 1 2 . 1 1 71 71 ARG C C 139 175.750 175.750 175.776 -0.026 18517 1615 1 2 . 1 1 71 71 ARG CA C 139 54.660 54.660 55.076 -0.416 18517 1616 1 2 . 1 1 71 71 ARG CB C 139 33.140 33.140 31.463 1.677 18517 1617 1 2 . 1 1 71 71 ARG H H 139 8.240 8.240 8.551 -0.311 18517 1618 1 2 . 1 1 72 72 GLY N N 140 104.750 104.750 108.578 -3.828 18517 1619 1 2 . 1 1 72 72 GLY C C 140 172.920 172.920 172.600 0.320 18517 1620 1 2 . 1 1 72 72 GLY CA C 140 45.430 45.430 45.207 0.223 18517 1621 1 2 . 1 1 72 72 GLY H H 140 7.900 7.900 7.941 -0.041 18517 1622 1 2 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.434 0.076 18517 1623 1 2 . 1 1 73 73 ASP C C 141 175.060 175.060 176.788 -1.728 18517 1624 1 2 . 1 1 73 73 ASP CA C 141 56.170 56.170 56.363 -0.193 18517 1625 1 2 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.801 -0.971 18517 1626 1 2 . 1 1 74 74 SER N N 142 110.240 110.240 111.588 -1.348 18517 1627 1 2 . 1 1 74 74 SER HA H 142 4.740 4.740 4.742 -0.002 18517 1628 1 2 . 1 1 74 74 SER C C 142 175.110 175.110 174.383 0.727 18517 1629 1 2 . 1 1 74 74 SER CA C 142 55.700 55.700 57.198 -1.498 18517 1630 1 2 . 1 1 74 74 SER CB C 142 67.390 67.390 65.769 1.621 18517 1631 1 2 . 1 1 74 74 SER H H 142 7.560 7.560 7.541 0.019 18517 1632 1 2 . 1 1 75 75 VAL N N 143 122.950 122.950 122.794 0.156 18517 1633 1 2 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.775 -0.045 18517 1634 1 2 . 1 1 75 75 VAL C C 143 176.230 176.230 177.162 -0.932 18517 1635 1 2 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.834 0.806 18517 1636 1 2 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.948 -0.708 18517 1637 1 2 . 1 1 75 75 VAL H H 143 9.470 9.470 9.046 0.424 18517 1638 1 2 . 1 1 76 76 GLU N N 144 121.390 121.390 119.878 1.512 18517 1639 1 2 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.128 -0.488 18517 1640 1 2 . 1 1 76 76 GLU C C 144 176.880 176.880 177.896 -1.016 18517 1641 1 2 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.315 3.995 18517 1642 1 2 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.000 0.070 18517 1643 1 2 . 1 1 76 76 GLU H H 144 9.640 9.640 8.515 1.125 18517 1644 1 2 . 1 1 77 77 ALA N N 145 118.770 118.770 122.919 -4.149 18517 1645 1 2 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.209 0.051 18517 1646 1 2 . 1 1 77 77 ALA C C 145 180.350 180.350 179.520 0.830 18517 1647 1 2 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.426 0.353 18517 1648 1 2 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.017 1.173 18517 1649 1 2 . 1 1 77 77 ALA H H 145 7.860 7.860 7.476 0.384 18517 1650 1 2 . 1 1 78 78 ALA N N 146 120.920 120.920 122.546 -1.626 18517 1651 1 2 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.038 0.102 18517 1652 1 2 . 1 1 78 78 ALA C C 146 179.150 179.150 179.142 0.008 18517 1653 1 2 . 1 1 78 78 ALA CA C 146 55.260 55.260 54.914 0.346 18517 1654 1 2 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.454 0.336 18517 1655 1 2 . 1 1 78 78 ALA H H 146 8.110 8.110 8.422 -0.312 18517 1656 1 2 . 1 1 79 79 LEU N N 147 118.810 118.810 119.448 -0.638 18517 1657 1 2 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.034 -0.154 18517 1658 1 2 . 1 1 79 79 LEU C C 147 179.080 179.080 178.426 0.654 18517 1659 1 2 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.906 0.484 18517 1660 1 2 . 1 1 79 79 LEU CB C 147 42.260 42.260 40.899 1.361 18517 1661 1 2 . 1 1 79 79 LEU H H 147 8.360 8.360 8.271 0.089 18517 1662 1 2 . 1 1 80 80 ASP N N 148 121.620 121.620 120.129 1.491 18517 1663 1 2 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.253 0.267 18517 1664 1 2 . 1 1 80 80 ASP C C 148 178.800 178.800 178.321 0.479 18517 1665 1 2 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.013 0.377 18517 1666 1 2 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.947 -0.197 18517 1667 1 2 . 1 1 80 80 ASP H H 148 8.770 8.770 8.378 0.392 18517 1668 1 2 . 1 1 81 81 ASN N N 149 118.630 118.630 118.082 0.548 18517 1669 1 2 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.450 0.120 18517 1670 1 2 . 1 1 81 81 ASN C C 149 177.970 177.970 178.084 -0.114 18517 1671 1 2 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.544 -0.534 18517 1672 1 2 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.812 -0.202 18517 1673 1 2 . 1 1 81 81 ASN H H 149 7.960 7.960 8.368 -0.408 18517 1674 1 2 . 1 1 82 82 LEU N N 150 120.030 120.030 118.318 1.712 18517 1675 1 2 . 1 1 82 82 LEU HA H 150 4.060 4.060 4.283 -0.223 18517 1676 1 2 . 1 1 82 82 LEU C C 150 177.790 177.790 178.780 -0.990 18517 1677 1 2 . 1 1 82 82 LEU CA C 150 58.870 58.870 57.797 1.073 18517 1678 1 2 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.375 0.485 18517 1679 1 2 . 1 1 82 82 LEU H H 150 8.230 8.230 8.124 0.106 18517 1680 1 2 . 1 1 83 83 MET N N 151 115.820 115.820 120.776 -4.956 18517 1681 1 2 . 1 1 83 83 MET HA H 151 4.390 4.390 4.105 0.285 18517 1682 1 2 . 1 1 83 83 MET C C 151 179.760 179.760 178.381 1.379 18517 1683 1 2 . 1 1 83 83 MET CA C 151 57.400 57.400 59.105 -1.706 18517 1684 1 2 . 1 1 83 83 MET CB C 151 31.080 31.080 32.775 -1.695 18517 1685 1 2 . 1 1 83 83 MET H H 151 8.800 8.800 8.371 0.429 18517 1686 1 2 . 1 1 84 84 ILE N N 152 120.330 120.330 119.407 0.923 18517 1687 1 2 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.799 0.041 18517 1688 1 2 . 1 1 84 84 ILE C C 152 178.660 178.660 178.235 0.425 18517 1689 1 2 . 1 1 84 84 ILE CA C 152 65.800 65.800 64.047 1.753 18517 1690 1 2 . 1 1 84 84 ILE CB C 152 38.450 38.450 36.227 2.223 18517 1691 1 2 . 1 1 84 84 ILE H H 152 8.540 8.540 8.669 -0.129 18517 1692 1 2 . 1 1 85 85 LYS N N 153 118.930 118.930 119.851 -0.921 18517 1693 1 2 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.013 0.187 18517 1694 1 2 . 1 1 85 85 LYS C C 153 179.650 179.650 179.444 0.206 18517 1695 1 2 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.895 1.085 18517 1696 1 2 . 1 1 85 85 LYS CB C 153 33.540 33.540 31.968 1.572 18517 1697 1 2 . 1 1 85 85 LYS H H 153 7.510 7.510 8.043 -0.533 18517 1698 1 2 . 1 1 86 86 VAL N N 154 119.810 119.810 119.399 0.411 18517 1699 1 2 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.681 -0.051 18517 1700 1 2 . 1 1 86 86 VAL C C 154 178.350 178.350 178.399 -0.049 18517 1701 1 2 . 1 1 86 86 VAL CA C 154 67.230 67.230 65.852 1.378 18517 1702 1 2 . 1 1 86 86 VAL CB C 154 32.740 32.740 30.936 1.804 18517 1703 1 2 . 1 1 86 86 VAL H H 154 8.740 8.740 8.174 0.566 18517 1704 1 2 . 1 1 87 87 TYR N N 155 118.370 118.370 119.171 -0.801 18517 1705 1 2 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.291 -0.021 18517 1706 1 2 . 1 1 87 87 TYR C C 155 178.580 178.580 177.912 0.668 18517 1707 1 2 . 1 1 87 87 TYR CA C 155 62.910 62.910 60.464 2.446 18517 1708 1 2 . 1 1 87 87 TYR CB C 155 37.980 37.980 36.981 0.999 18517 1709 1 2 . 1 1 87 87 TYR H H 155 8.520 8.520 8.237 0.283 18517 1710 1 2 . 1 1 88 88 GLU N N 156 119.900 119.900 121.492 -1.592 18517 1711 1 2 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.247 -0.067 18517 1712 1 2 . 1 1 88 88 GLU C C 156 179.270 179.270 178.983 0.287 18517 1713 1 2 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.391 -0.011 18517 1714 1 2 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.610 0.600 18517 1715 1 2 . 1 1 88 88 GLU H H 156 8.250 8.250 8.557 -0.307 18517 1716 1 2 . 1 1 89 89 ILE N N 157 119.510 119.510 118.498 1.012 18517 1717 1 2 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.906 0.174 18517 1718 1 2 . 1 1 89 89 ILE C C 157 177.890 177.890 178.489 -0.599 18517 1719 1 2 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.270 0.041 18517 1720 1 2 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.119 1.091 18517 1721 1 2 . 1 1 89 89 ILE H H 157 7.630 7.630 7.757 -0.127 18517 1722 1 2 . 1 1 90 90 THR N N 158 114.240 114.240 116.078 -1.838 18517 1723 1 2 . 1 1 90 90 THR HA H 158 4.130 4.130 4.054 0.076 18517 1724 1 2 . 1 1 90 90 THR C C 158 175.530 175.530 176.387 -0.857 18517 1725 1 2 . 1 1 90 90 THR CA C 158 64.460 64.460 65.853 -1.393 18517 1726 1 2 . 1 1 90 90 THR CB C 158 69.610 69.610 69.022 0.588 18517 1727 1 2 . 1 1 90 90 THR H H 158 7.770 7.770 8.073 -0.303 18517 1728 1 2 . 1 1 91 91 LYS N N 159 120.280 120.280 119.108 1.172 18517 1729 1 2 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.270 0.040 18517 1730 1 2 . 1 1 91 91 LYS C C 159 177.420 177.420 177.352 0.068 18517 1731 1 2 . 1 1 91 91 LYS CA C 159 57.400 57.400 57.116 0.284 18517 1732 1 2 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.200 0.020 18517 1733 1 2 . 1 1 91 91 LYS H H 159 7.890 7.890 8.371 -0.481 18517 1734 1 2 . 1 1 92 92 GLY N N 160 107.910 107.910 107.814 0.096 18517 1735 1 2 . 1 1 92 92 GLY C C 160 174.430 174.430 174.218 0.212 18517 1736 1 2 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.256 0.724 18517 1737 1 2 . 1 1 92 92 GLY H H 160 7.930 7.930 7.938 -0.008 18517 1738 1 2 . 1 1 93 93 THR N N 161 113.570 113.570 113.332 0.238 18517 1739 1 2 . 1 1 93 93 THR HA H 161 4.390 4.390 4.502 -0.112 18517 1740 1 2 . 1 1 93 93 THR C C 161 174.790 174.790 172.776 2.014 18517 1741 1 2 . 1 1 93 93 THR CA C 161 61.960 61.960 61.096 0.864 18517 1742 1 2 . 1 1 93 93 THR CB C 161 70.010 70.010 70.145 -0.135 18517 1743 1 2 . 1 1 93 93 THR H H 161 7.970 7.970 7.689 0.281 18517 1744 1 2 . 1 1 94 94 VAL N N 162 121.980 121.980 121.904 0.076 18517 1745 1 2 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.401 -0.281 18517 1746 1 2 . 1 1 94 94 VAL C C 162 176.300 176.300 175.528 0.772 18517 1747 1 2 . 1 1 94 94 VAL CA C 162 62.830 62.830 62.162 0.668 18517 1748 1 2 . 1 1 94 94 VAL CB C 162 33.060 33.060 32.255 0.805 18517 1749 1 2 . 1 1 94 94 VAL H H 162 8.130 8.130 8.476 -0.346 18517 1750 1 2 . 1 1 95 95 GLU N N 163 124.140 124.140 129.709 -5.569 18517 1751 1 2 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.207 0.103 18517 1752 1 2 . 1 1 95 95 GLU C C 163 176.870 176.870 176.449 0.421 18517 1753 1 2 . 1 1 95 95 GLU CA C 163 57.080 57.080 58.013 -0.933 18517 1754 1 2 . 1 1 95 95 GLU CB C 163 30.440 30.440 30.505 -0.065 18517 1755 1 2 . 1 1 95 95 GLU H H 163 8.490 8.490 8.760 -0.270 18517 1756 1 2 . 1 1 96 96 SER N N 164 116.800 116.800 112.605 4.195 18517 1757 1 2 . 1 1 96 96 SER HA H 164 4.430 4.430 4.502 -0.072 18517 1758 1 2 . 1 1 96 96 SER C C 164 174.940 174.940 174.481 0.459 18517 1759 1 2 . 1 1 96 96 SER CA C 164 59.070 59.070 58.817 0.253 18517 1760 1 2 . 1 1 96 96 SER CB C 164 64.220 64.220 62.542 1.678 18517 1761 1 2 . 1 1 96 96 SER H H 164 8.300 8.300 8.128 0.172 18517 1762 1 2 . 1 1 97 97 SER C C 165 174.660 174.660 174.047 0.613 18517 1763 1 2 . 1 1 97 97 SER CA C 165 58.870 58.870 58.383 0.486 18517 1764 1 2 . 1 1 97 97 SER CB C 165 64.060 64.060 63.676 0.384 18517 1765 1 2 . 1 1 98 98 ALA N N 166 125.490 125.490 124.070 1.420 18517 1766 1 2 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.074 0.276 18517 1767 1 2 . 1 1 98 98 ALA C C 166 177.780 177.780 177.845 -0.065 18517 1768 1 2 . 1 1 98 98 ALA CA C 166 53.000 53.000 52.676 0.324 18517 1769 1 2 . 1 1 98 98 ALA CB C 166 19.340 19.340 18.283 1.057 18517 1770 1 2 . 1 1 98 98 ALA H H 166 8.180 8.180 7.576 0.604 18517 1771 1 2 . 1 1 99 99 GLN N N 167 118.690 118.690 120.095 -1.405 18517 1772 1 2 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.219 0.121 18517 1773 1 2 . 1 1 99 99 GLN C C 167 176.680 176.680 178.113 -1.433 18517 1774 1 2 . 1 1 99 99 GLN CA C 167 56.250 56.250 57.315 -1.065 18517 1775 1 2 . 1 1 99 99 GLN CB C 167 29.650 29.650 29.561 0.089 18517 1776 1 2 . 1 1 99 99 GLN H H 167 8.170 8.170 8.698 -0.528 18517 1777 1 2 . 1 1 100 100 GLY N N 168 109.670 109.670 108.572 1.098 18517 1778 1 2 . 1 1 100 100 GLY C C 168 174.460 174.460 174.673 -0.213 18517 1779 1 2 . 1 1 100 100 GLY CA C 168 45.670 45.670 46.143 -0.473 18517 1780 1 2 . 1 1 100 100 GLY H H 168 8.250 8.250 8.286 -0.036 18517 1781 1 2 . 1 1 101 101 THR N N 169 112.660 112.660 119.267 -6.607 18517 1782 1 2 . 1 1 101 101 THR HA H 169 4.360 4.360 4.407 -0.047 18517 1783 1 2 . 1 1 101 101 THR C C 169 174.720 174.720 172.710 2.010 18517 1784 1 2 . 1 1 101 101 THR CA C 169 62.080 62.080 62.022 0.058 18517 1785 1 2 . 1 1 101 101 THR CB C 169 69.930 69.930 69.221 0.709 18517 1786 1 2 . 1 1 101 101 THR H H 169 8.070 8.070 8.111 -0.041 18517 1787 1 2 . 1 1 102 102 ASP N N 170 123.090 123.090 123.010 0.080 18517 1788 1 2 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.543 0.157 18517 1789 1 2 . 1 1 102 102 ASP C C 170 176.130 176.130 175.487 0.643 18517 1790 1 2 . 1 1 102 102 ASP CA C 170 54.780 54.780 54.846 -0.066 18517 1791 1 2 . 1 1 102 102 ASP CB C 170 42.260 42.260 40.812 1.448 18517 1792 1 2 . 1 1 102 102 ASP H H 170 8.170 8.170 7.788 0.382 18517 1793 1 2 . 1 1 103 103 SER N N 171 117.110 117.110 119.496 -2.386 18517 1794 1 2 . 1 1 103 103 SER HA H 171 4.430 4.430 4.560 -0.130 18517 1795 1 2 . 1 1 103 103 SER C C 171 174.770 174.770 175.211 -0.441 18517 1796 1 2 . 1 1 103 103 SER CA C 171 57.960 57.960 56.385 1.575 18517 1797 1 2 . 1 1 103 103 SER CB C 171 64.940 64.940 65.147 -0.207 18517 1798 1 2 . 1 1 103 103 SER H H 171 8.450 8.450 8.027 0.423 18517 1799 1 2 . 1 1 104 104 GLU N N 172 122.970 122.970 122.304 0.666 18517 1800 1 2 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.941 0.089 18517 1801 1 2 . 1 1 104 104 GLU C C 172 178.860 178.860 178.336 0.524 18517 1802 1 2 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.537 -0.837 18517 1803 1 2 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.404 0.246 18517 1804 1 2 . 1 1 104 104 GLU H H 172 8.830 8.830 8.979 -0.149 18517 1805 1 2 . 1 1 105 105 GLU N N 173 119.750 119.750 118.063 1.687 18517 1806 1 2 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.105 -0.125 18517 1807 1 2 . 1 1 105 105 GLU C C 173 178.920 178.920 178.547 0.373 18517 1808 1 2 . 1 1 105 105 GLU CA C 173 60.060 60.060 59.014 1.046 18517 1809 1 2 . 1 1 105 105 GLU CB C 173 29.730 29.730 28.427 1.303 18517 1810 1 2 . 1 1 105 105 GLU H H 173 8.580 8.580 8.979 -0.399 18517 1811 1 2 . 1 1 106 106 LEU N N 174 121.860 121.860 121.315 0.545 18517 1812 1 2 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.097 0.083 18517 1813 1 2 . 1 1 106 106 LEU C C 174 178.210 178.210 178.969 -0.759 18517 1814 1 2 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.237 0.643 18517 1815 1 2 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.161 -0.011 18517 1816 1 2 . 1 1 106 106 LEU H H 174 7.920 7.920 7.505 0.415 18517 1817 1 2 . 1 1 107 107 LYS N N 175 118.740 118.740 118.634 0.106 18517 1818 1 2 . 1 1 107 107 LYS HA H 175 3.780 3.780 4.005 -0.225 18517 1819 1 2 . 1 1 107 107 LYS C C 175 178.700 178.700 179.027 -0.327 18517 1820 1 2 . 1 1 107 107 LYS CA C 175 61.170 61.170 59.629 1.541 18517 1821 1 2 . 1 1 107 107 LYS CB C 175 32.430 32.430 31.896 0.534 18517 1822 1 2 . 1 1 107 107 LYS H H 175 8.340 8.340 8.406 -0.066 18517 1823 1 2 . 1 1 108 108 THR N N 176 113.820 113.820 118.015 -4.195 18517 1824 1 2 . 1 1 108 108 THR HA H 176 3.840 3.840 3.987 -0.147 18517 1825 1 2 . 1 1 108 108 THR C C 176 176.620 176.620 176.155 0.465 18517 1826 1 2 . 1 1 108 108 THR CA C 176 66.910 66.910 67.299 -0.389 18517 1827 1 2 . 1 1 108 108 THR CB C 176 69.610 69.610 68.807 0.803 18517 1828 1 2 . 1 1 108 108 THR H H 176 7.950 7.950 8.463 -0.513 18517 1829 1 2 . 1 1 109 109 LEU N N 177 124.380 124.380 122.684 1.696 18517 1830 1 2 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.082 -0.252 18517 1831 1 2 . 1 1 109 109 LEU C C 177 177.790 177.790 177.884 -0.094 18517 1832 1 2 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.936 0.054 18517 1833 1 2 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.773 0.807 18517 1834 1 2 . 1 1 109 109 LEU H H 177 7.480 7.480 7.819 -0.339 18517 1835 1 2 . 1 1 110 110 LEU N N 178 117.230 117.230 119.626 -2.396 18517 1836 1 2 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.762 0.078 18517 1837 1 2 . 1 1 110 110 LEU C C 178 179.540 179.540 179.136 0.404 18517 1838 1 2 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.795 0.595 18517 1839 1 2 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.352 0.988 18517 1840 1 2 . 1 1 110 110 LEU H H 178 8.670 8.670 7.840 0.830 18517 1841 1 2 . 1 1 111 111 LEU N N 179 119.230 119.230 121.317 -2.087 18517 1842 1 2 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.267 -0.187 18517 1843 1 2 . 1 1 111 111 LEU C C 179 179.310 179.310 179.639 -0.329 18517 1844 1 2 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.474 0.916 18517 1845 1 2 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.680 1.340 18517 1846 1 2 . 1 1 111 111 LEU H H 179 7.940 7.940 8.597 -0.657 18517 1847 1 2 . 1 1 112 112 LYS N N 180 121.910 121.910 120.884 1.026 18517 1848 1 2 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.105 0.085 18517 1849 1 2 . 1 1 112 112 LYS C C 180 178.740 178.740 179.253 -0.513 18517 1850 1 2 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.236 -0.056 18517 1851 1 2 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.026 -0.157 18517 1852 1 2 . 1 1 112 112 LYS H H 180 7.420 7.420 8.119 -0.699 18517 1853 1 2 . 1 1 113 113 PHE N N 181 118.220 118.220 119.031 -0.811 18517 1854 1 2 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.212 0.538 18517 1855 1 2 . 1 1 113 113 PHE C C 181 178.520 178.520 177.561 0.959 18517 1856 1 2 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.480 -3.400 18517 1857 1 2 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.255 -0.275 18517 1858 1 2 . 1 1 113 113 PHE H H 181 9.000 9.000 8.532 0.468 18517 1859 1 2 . 1 1 114 114 SER N N 182 113.300 113.300 114.712 -1.412 18517 1860 1 2 . 1 1 114 114 SER HA H 182 3.930 3.930 4.102 -0.172 18517 1861 1 2 . 1 1 114 114 SER C C 182 177.080 177.080 177.016 0.064 18517 1862 1 2 . 1 1 114 114 SER CA C 182 62.000 62.000 61.842 0.158 18517 1863 1 2 . 1 1 114 114 SER CB C 182 63.510 63.510 62.292 1.218 18517 1864 1 2 . 1 1 114 114 SER H H 182 8.620 8.620 8.769 -0.149 18517 1865 1 2 . 1 1 115 115 GLU N N 183 121.540 121.540 122.941 -1.401 18517 1866 1 2 . 1 1 115 115 GLU HA H 183 4.070 4.070 3.926 0.144 18517 1867 1 2 . 1 1 115 115 GLU C C 183 179.860 179.860 178.319 1.541 18517 1868 1 2 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.586 0.194 18517 1869 1 2 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.647 0.243 18517 1870 1 2 . 1 1 115 115 GLU H H 183 8.250 8.250 8.517 -0.267 18517 1871 1 2 . 1 1 116 116 ASP N N 184 121.740 121.740 120.932 0.808 18517 1872 1 2 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.346 0.164 18517 1873 1 2 . 1 1 116 116 ASP C C 184 179.570 179.570 178.473 1.097 18517 1874 1 2 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.498 0.062 18517 1875 1 2 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.688 0.302 18517 1876 1 2 . 1 1 116 116 ASP H H 184 8.840 8.840 8.379 0.461 18517 1877 1 2 . 1 1 117 117 LEU N N 185 121.420 121.420 120.567 0.853 18517 1878 1 2 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.052 0.078 18517 1879 1 2 . 1 1 117 117 LEU C C 185 178.840 178.840 178.665 0.175 18517 1880 1 2 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.427 -0.197 18517 1881 1 2 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.651 0.999 18517 1882 1 2 . 1 1 117 117 LEU H H 185 8.350 8.350 8.425 -0.075 18517 1883 1 2 . 1 1 118 118 LYS N N 186 119.640 119.640 118.610 1.030 18517 1884 1 2 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.984 0.136 18517 1885 1 2 . 1 1 118 118 LYS C C 186 178.820 178.820 178.971 -0.151 18517 1886 1 2 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.699 0.041 18517 1887 1 2 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.586 -0.076 18517 1888 1 2 . 1 1 118 118 LYS H H 186 8.220 8.220 8.182 0.038 18517 1889 1 2 . 1 1 119 119 ALA N N 187 120.160 120.160 121.623 -1.463 18517 1890 1 2 . 1 1 119 119 ALA HA H 187 4.160 4.160 3.993 0.167 18517 1891 1 2 . 1 1 119 119 ALA C C 187 180.450 180.450 179.219 1.231 18517 1892 1 2 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.504 -0.364 18517 1893 1 2 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.300 0.170 18517 1894 1 2 . 1 1 119 119 ALA H H 187 8.010 8.010 8.581 -0.571 18517 1895 1 2 . 1 1 120 120 GLU N N 188 117.930 117.930 118.770 -0.840 18517 1896 1 2 . 1 1 120 120 GLU HA H 188 4.180 4.180 4.101 0.079 18517 1897 1 2 . 1 1 120 120 GLU C C 188 178.780 178.780 179.100 -0.320 18517 1898 1 2 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.066 -0.236 18517 1899 1 2 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.521 0.449 18517 1900 1 2 . 1 1 120 120 GLU H H 188 7.640 7.640 8.172 -0.532 18517 1901 1 2 . 1 1 121 121 GLN N N 189 117.230 117.230 118.130 -0.900 18517 1902 1 2 . 1 1 121 121 GLN HA H 189 4.230 4.230 4.176 0.054 18517 1903 1 2 . 1 1 121 121 GLN C C 189 179.190 179.190 178.126 1.064 18517 1904 1 2 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.495 1.245 18517 1905 1 2 . 1 1 121 121 GLN CB C 189 29.650 29.650 29.341 0.309 18517 1906 1 2 . 1 1 121 121 GLN H H 189 8.280 8.280 7.976 0.304 18517 1907 1 2 . 1 1 122 122 GLU N N 190 118.340 118.340 120.206 -1.866 18517 1908 1 2 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.911 0.209 18517 1909 1 2 . 1 1 122 122 GLU C C 190 178.210 178.210 178.726 -0.516 18517 1910 1 2 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.311 0.439 18517 1911 1 2 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.533 0.437 18517 1912 1 2 . 1 1 122 122 GLU H H 190 8.250 8.250 8.530 -0.280 18517 1913 1 2 . 1 1 123 123 LEU N N 191 118.930 118.930 122.818 -3.888 18517 1914 1 2 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.888 0.202 18517 1915 1 2 . 1 1 123 123 LEU C C 191 178.500 178.500 178.550 -0.050 18517 1916 1 2 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.139 -1.139 18517 1917 1 2 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.283 1.217 18517 1918 1 2 . 1 1 123 123 LEU H H 191 7.530 7.530 8.216 -0.686 18517 1919 1 2 . 1 1 124 124 HIS N N 192 115.650 115.650 117.223 -1.573 18517 1920 1 2 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.334 0.386 18517 1921 1 2 . 1 1 124 124 HIS C C 192 176.090 176.090 177.896 -1.806 18517 1922 1 2 . 1 1 124 124 HIS CA C 192 56.690 56.690 60.587 -3.897 18517 1923 1 2 . 1 1 124 124 HIS CB C 192 30.760 30.760 29.622 1.138 18517 1924 1 2 . 1 1 124 124 HIS H H 192 7.450 7.450 8.275 -0.825 18517 1925 1 2 . 1 1 125 125 SER N N 193 115.480 115.480 115.643 -0.163 18517 1926 1 2 . 1 1 125 125 SER HA H 193 4.310 4.310 4.285 0.025 18517 1927 1 2 . 1 1 125 125 SER CA C 193 60.180 60.180 61.381 -1.201 18517 1928 1 2 . 1 1 125 125 SER CB C 193 64.060 64.060 62.843 1.217 18517 1929 1 2 . 1 1 125 125 SER H H 193 8.020 8.020 8.260 -0.240 18517 1930 1 2 . 1 1 126 126 GLU C C 194 177.410 177.410 179.208 -1.798 18517 1931 1 2 . 1 1 126 126 GLU CA C 194 57.840 57.840 58.673 -0.833 18517 1932 1 2 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.330 0.560 18517 1933 1 2 . 1 1 127 127 ALA N N 195 122.910 122.910 123.014 -0.104 18517 1934 1 2 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.081 0.109 18517 1935 1 2 . 1 1 127 127 ALA C C 195 178.610 178.610 179.342 -0.732 18517 1936 1 2 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.976 -1.186 18517 1937 1 2 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.651 0.609 18517 1938 1 2 . 1 1 127 127 ALA H H 195 8.020 8.020 8.121 -0.101 18517 1939 1 2 . 1 1 128 128 LYS N N 196 117.770 117.770 118.048 -0.278 18517 1940 1 2 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.401 -0.141 18517 1941 1 2 . 1 1 128 128 LYS C C 196 177.400 177.400 176.420 0.980 18517 1942 1 2 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.565 2.435 18517 1943 1 2 . 1 1 128 128 LYS CB C 196 32.740 32.740 33.233 -0.493 18517 1944 1 2 . 1 1 128 128 LYS H H 196 7.990 7.990 8.130 -0.140 18517 1945 1 2 . 1 1 129 129 GLY N N 197 109.010 109.010 107.865 1.145 18517 1946 1 2 . 1 1 129 129 GLY C C 197 175.770 175.770 175.295 0.475 18517 1947 1 2 . 1 1 129 129 GLY CA C 197 46.100 46.100 44.886 1.214 18517 1948 1 2 . 1 1 129 129 GLY H H 197 8.220 8.220 7.605 0.615 18517 1949 1 2 . 1 1 130 130 GLY N N 198 109.150 109.150 109.941 -0.791 18517 1950 1 2 . 1 1 130 130 GLY C C 198 174.760 174.760 175.323 -0.563 18517 1951 1 2 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.146 -0.216 18517 1952 1 2 . 1 1 130 130 GLY H H 198 8.210 8.210 8.819 -0.609 18517 1953 1 2 . 1 1 131 131 GLU N N 199 121.560 121.560 121.828 -0.268 18517 1954 1 2 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.017 0.003 18517 1955 1 2 . 1 1 131 131 GLU C C 199 178.500 178.500 178.693 -0.193 18517 1956 1 2 . 1 1 131 131 GLU CA C 199 59.900 59.900 58.958 0.942 18517 1957 1 2 . 1 1 131 131 GLU CB C 199 29.570 29.570 28.947 0.623 18517 1958 1 2 . 1 1 131 131 GLU H H 199 8.510 8.510 8.717 -0.207 18517 1959 1 2 . 1 1 132 132 ALA N N 200 122.390 122.390 123.280 -0.890 18517 1960 1 2 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.165 0.035 18517 1961 1 2 . 1 1 132 132 ALA C C 200 180.360 180.360 179.867 0.493 18517 1962 1 2 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.828 -0.048 18517 1963 1 2 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.377 0.013 18517 1964 1 2 . 1 1 132 132 ALA H H 200 8.190 8.190 7.559 0.631 18517 1965 1 2 . 1 1 133 133 LEU N N 201 120.800 120.800 119.495 1.305 18517 1966 1 2 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.466 -0.256 18517 1967 1 2 . 1 1 133 133 LEU C C 201 179.270 179.270 179.824 -0.554 18517 1968 1 2 . 1 1 133 133 LEU CA C 201 57.680 57.680 56.868 0.812 18517 1969 1 2 . 1 1 133 133 LEU CB C 201 42.180 42.180 40.708 1.472 18517 1970 1 2 . 1 1 133 133 LEU H H 201 7.720 7.720 8.207 -0.487 18517 1971 1 2 . 1 1 134 134 LEU N N 202 120.680 120.680 121.871 -1.191 18517 1972 1 2 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.930 0.050 18517 1973 1 2 . 1 1 134 134 LEU C C 202 179.030 179.030 178.469 0.561 18517 1974 1 2 . 1 1 134 134 LEU CA C 202 58.430 58.430 58.092 0.338 18517 1975 1 2 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.427 0.193 18517 1976 1 2 . 1 1 134 134 LEU H H 202 8.470 8.470 8.912 -0.442 18517 1977 1 2 . 1 1 135 135 SER N N 203 113.290 113.290 114.475 -1.185 18517 1978 1 2 . 1 1 135 135 SER HA H 203 4.180 4.180 4.095 0.085 18517 1979 1 2 . 1 1 135 135 SER C C 203 177.300 177.300 176.853 0.447 18517 1980 1 2 . 1 1 135 135 SER CA C 203 62.080 62.080 62.447 -0.367 18517 1981 1 2 . 1 1 135 135 SER CB C 203 63.030 63.030 63.023 0.007 18517 1982 1 2 . 1 1 135 135 SER H H 203 8.210 8.210 8.419 -0.209 18517 1983 1 2 . 1 1 136 136 SER N N 204 117.500 117.500 118.352 -0.852 18517 1984 1 2 . 1 1 136 136 SER HA H 204 4.050 4.050 4.129 -0.079 18517 1985 1 2 . 1 1 136 136 SER C C 204 177.570 177.570 176.576 0.994 18517 1986 1 2 . 1 1 136 136 SER CA C 204 61.880 61.880 61.715 0.165 18517 1987 1 2 . 1 1 136 136 SER CB C 204 63.510 63.510 62.884 0.626 18517 1988 1 2 . 1 1 136 136 SER H H 204 7.730 7.730 8.345 -0.615 18517 1989 1 2 . 1 1 137 137 MET N N 205 122.500 122.500 122.676 -0.176 18517 1990 1 2 . 1 1 137 137 MET HA H 205 4.140 4.140 4.107 0.033 18517 1991 1 2 . 1 1 137 137 MET C C 205 177.680 177.680 177.863 -0.183 18517 1992 1 2 . 1 1 137 137 MET CA C 205 60.140 60.140 59.061 1.079 18517 1993 1 2 . 1 1 137 137 MET CB C 205 33.460 33.460 32.632 0.828 18517 1994 1 2 . 1 1 137 137 MET H H 205 8.170 8.170 8.296 -0.126 18517 1995 1 2 . 1 1 138 138 LYS N N 206 121.410 121.410 119.704 1.706 18517 1996 1 2 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.977 -0.227 18517 1997 1 2 . 1 1 138 138 LYS C C 206 178.780 178.780 178.971 -0.191 18517 1998 1 2 . 1 1 138 138 LYS CA C 206 60.330 60.330 59.308 1.022 18517 1999 1 2 . 1 1 138 138 LYS CB C 206 32.270 32.270 31.888 0.382 18517 2000 1 2 . 1 1 138 138 LYS H H 206 8.810 8.810 8.444 0.366 18517 2001 1 2 . 1 1 139 139 THR N N 207 116.580 116.580 116.026 0.554 18517 2002 1 2 . 1 1 139 139 THR HA H 207 4.060 4.060 4.003 0.057 18517 2003 1 2 . 1 1 139 139 THR C C 207 176.730 176.730 176.928 -0.198 18517 2004 1 2 . 1 1 139 139 THR CA C 207 67.150 67.150 66.929 0.221 18517 2005 1 2 . 1 1 139 139 THR CB C 207 69.220 69.220 68.305 0.915 18517 2006 1 2 . 1 1 139 139 THR H H 207 7.930 7.930 8.323 -0.393 18517 2007 1 2 . 1 1 140 140 GLN N N 208 121.390 121.390 121.467 -0.077 18517 2008 1 2 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.042 0.018 18517 2009 1 2 . 1 1 140 140 GLN C C 208 178.550 178.550 178.151 0.399 18517 2010 1 2 . 1 1 140 140 GLN CA C 208 59.300 59.300 58.775 0.525 18517 2011 1 2 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.254 0.606 18517 2012 1 2 . 1 1 140 140 GLN H H 208 7.600 7.600 8.376 -0.776 18517 2013 1 2 . 1 1 141 141 HIS N N 209 122.360 122.360 118.853 3.507 18517 2014 1 2 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.193 -0.363 18517 2015 1 2 . 1 1 141 141 HIS C C 209 176.390 176.390 177.166 -0.776 18517 2016 1 2 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.438 1.282 18517 2017 1 2 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.095 -0.995 18517 2018 1 2 . 1 1 141 141 HIS H H 209 8.980 8.980 8.340 0.640 18517 2019 1 2 . 1 1 142 142 ASP N N 210 120.740 120.740 120.476 0.264 18517 2020 1 2 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.311 0.039 18517 2021 1 2 . 1 1 142 142 ASP C C 210 179.490 179.490 178.253 1.237 18517 2022 1 2 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.888 0.032 18517 2023 1 2 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.783 -0.193 18517 2024 1 2 . 1 1 142 142 ASP H H 210 8.770 8.770 8.718 0.052 18517 2025 1 2 . 1 1 143 143 GLU N N 211 119.010 119.010 120.433 -1.423 18517 2026 1 2 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.048 -0.078 18517 2027 1 2 . 1 1 143 143 GLU C C 211 179.070 179.070 178.902 0.168 18517 2028 1 2 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.026 0.274 18517 2029 1 2 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.377 0.113 18517 2030 1 2 . 1 1 143 143 GLU H H 211 7.850 7.850 8.163 -0.313 18517 2031 1 2 . 1 1 144 144 LEU N N 212 122.500 122.500 119.898 2.602 18517 2032 1 2 . 1 1 144 144 LEU HA H 212 4.070 4.070 3.892 0.178 18517 2033 1 2 . 1 1 144 144 LEU C C 212 179.340 179.340 179.097 0.243 18517 2034 1 2 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.107 0.283 18517 2035 1 2 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.477 0.702 18517 2036 1 2 . 1 1 144 144 LEU H H 212 8.070 8.070 8.253 -0.183 18517 2037 1 2 . 1 1 145 145 LEU N N 213 118.110 118.110 119.268 -1.158 18517 2038 1 2 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.428 0.772 18517 2039 1 2 . 1 1 145 145 LEU C C 213 179.610 179.610 178.274 1.336 18517 2040 1 2 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.989 0.762 18517 2041 1 2 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.569 -0.339 18517 2042 1 2 . 1 1 145 145 LEU H H 213 8.370 8.370 8.234 0.136 18517 2043 1 2 . 1 1 146 146 LYS N N 214 117.290 117.290 117.801 -0.511 18517 2044 1 2 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.961 -0.131 18517 2045 1 2 . 1 1 146 146 LYS C C 214 179.900 179.900 179.014 0.886 18517 2046 1 2 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.218 1.112 18517 2047 1 2 . 1 1 146 146 LYS CB C 214 32.350 32.350 31.953 0.397 18517 2048 1 2 . 1 1 146 146 LYS H H 214 7.560 7.560 8.207 -0.647 18517 2049 1 2 . 1 1 147 147 LYS N N 215 120.330 120.330 120.297 0.033 18517 2050 1 2 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.138 -0.118 18517 2051 1 2 . 1 1 147 147 LYS C C 215 180.550 180.550 179.242 1.308 18517 2052 1 2 . 1 1 147 147 LYS CA C 215 60.100 60.100 58.805 1.295 18517 2053 1 2 . 1 1 147 147 LYS CB C 215 32.740 32.740 31.938 0.802 18517 2054 1 2 . 1 1 147 147 LYS H H 215 7.830 7.830 8.048 -0.218 18517 2055 1 2 . 1 1 148 148 PHE N N 216 117.370 117.370 117.956 -0.586 18517 2056 1 2 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.273 -0.193 18517 2057 1 2 . 1 1 148 148 PHE C C 216 178.200 178.200 177.606 0.594 18517 2058 1 2 . 1 1 148 148 PHE CA C 216 62.120 62.120 59.982 2.138 18517 2059 1 2 . 1 1 148 148 PHE CB C 216 39.720 39.720 37.938 1.782 18517 2060 1 2 . 1 1 148 148 PHE H H 216 8.010 8.010 8.647 -0.637 18517 2061 1 2 . 1 1 149 149 ALA N N 217 118.990 118.990 119.052 -0.062 18517 2062 1 2 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.238 -0.128 18517 2063 1 2 . 1 1 149 149 ALA C C 217 177.330 177.330 177.873 -0.543 18517 2064 1 2 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.002 0.748 18517 2065 1 2 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.822 -1.222 18517 2066 1 2 . 1 1 149 149 ALA H H 217 7.720 7.720 7.845 -0.125 18517 2067 1 2 . 1 1 150 150 ALA N N 218 118.690 118.690 120.967 -2.277 18517 2068 1 2 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.406 -0.046 18517 2069 1 2 . 1 1 150 150 ALA C C 218 177.930 177.930 177.875 0.055 18517 2070 1 2 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.429 -0.339 18517 2071 1 2 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.812 -0.072 18517 2072 1 2 . 1 1 150 150 ALA H H 218 7.280 7.280 7.664 -0.384 18517 2073 1 2 . 1 1 151 151 LEU N N 219 119.980 119.980 121.681 -1.701 18517 2074 1 2 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.464 -0.194 18517 2075 1 2 . 1 1 151 151 LEU C C 219 176.150 176.150 175.428 0.722 18517 2076 1 2 . 1 1 151 151 LEU CA C 219 56.170 56.170 55.041 1.129 18517 2077 1 2 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.557 -0.747 18517 2078 1 2 . 1 1 151 151 LEU H H 219 7.050 7.050 7.978 -0.928 18517 2079 1 2 . 1 1 152 152 THR N N 220 112.070 112.070 116.361 -4.291 18517 2080 1 2 . 1 1 152 152 THR HA H 220 4.700 4.700 4.954 -0.254 18517 2081 1 2 . 1 1 152 152 THR C C 220 173.400 173.400 173.098 0.302 18517 2082 1 2 . 1 1 152 152 THR CA C 220 58.190 58.190 58.090 0.099 18517 2083 1 2 . 1 1 152 152 THR CB C 220 70.960 70.960 70.052 0.908 18517 2084 1 2 . 1 1 152 152 THR H H 220 8.040 8.040 8.153 -0.113 18517 2085 1 2 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.616 0.094 18517 2086 1 2 . 1 1 153 153 PRO C C 221 176.720 176.720 175.817 0.903 18517 2087 1 2 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.074 0.836 18517 2088 1 2 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.749 1.501 18517 2089 1 2 . 1 1 154 154 THR N N 222 120.460 120.460 117.602 2.858 18517 2090 1 2 . 1 1 154 154 THR HA H 222 4.250 4.250 4.404 -0.154 18517 2091 1 2 . 1 1 154 154 THR C C 222 175.190 175.190 175.055 0.135 18517 2092 1 2 . 1 1 154 154 THR CA C 222 64.650 64.650 62.337 2.313 18517 2093 1 2 . 1 1 154 154 THR CB C 222 70.410 70.410 68.981 1.429 18517 2094 1 2 . 1 1 154 154 THR H H 222 8.530 8.530 8.274 0.256 18517 2095 1 2 . 1 1 155 155 PHE N N 223 122.260 122.260 124.071 -1.811 18517 2096 1 2 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.580 0.410 18517 2097 1 2 . 1 1 155 155 PHE C C 223 172.560 172.560 174.740 -2.180 18517 2098 1 2 . 1 1 155 155 PHE CA C 223 56.770 56.770 57.543 -0.773 18517 2099 1 2 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.143 1.447 18517 2100 1 2 . 1 1 155 155 PHE H H 223 8.950 8.950 8.057 0.892 18517 2101 1 2 . 1 1 156 156 LEU N N 224 123.440 123.440 119.322 4.118 18517 2102 1 2 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.085 0.585 18517 2103 1 2 . 1 1 156 156 LEU C C 224 175.090 175.090 177.233 -2.143 18517 2104 1 2 . 1 1 156 156 LEU CA C 224 54.030 54.030 53.936 0.094 18517 2105 1 2 . 1 1 156 156 LEU CB C 224 46.300 46.300 42.542 3.758 18517 2106 1 2 . 1 1 156 156 LEU H H 224 7.210 7.210 7.123 0.087 18517 2107 1 2 . 1 1 157 157 THR N N 225 113.010 113.010 114.445 -1.435 18517 2108 1 2 . 1 1 157 157 THR HA H 225 4.790 4.790 4.535 0.255 18517 2109 1 2 . 1 1 157 157 THR C C 225 176.130 176.130 174.982 1.148 18517 2110 1 2 . 1 1 157 157 THR CA C 225 59.860 59.860 60.427 -0.567 18517 2111 1 2 . 1 1 157 157 THR CB C 225 72.860 72.860 70.030 2.830 18517 2112 1 2 . 1 1 157 157 THR H H 225 9.200 9.200 8.236 0.964 18517 2113 1 2 . 1 1 158 158 SER N N 226 115.350 115.350 118.409 -3.059 18517 2114 1 2 . 1 1 158 158 SER C C 226 177.410 177.410 175.294 2.116 18517 2115 1 2 . 1 1 158 158 SER CA C 226 57.400 57.400 59.431 -2.031 18517 2116 1 2 . 1 1 158 158 SER CB C 226 66.200 66.200 63.829 2.371 18517 2117 1 2 . 1 1 158 158 SER H H 226 8.830 8.830 8.562 0.268 18517 2118 1 2 . 1 1 159 159 GLU N N 227 121.200 121.200 124.076 -2.876 18517 2119 1 2 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.954 0.066 18517 2120 1 2 . 1 1 159 159 GLU C C 227 177.680 177.680 177.471 0.209 18517 2121 1 2 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.961 0.539 18517 2122 1 2 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.749 -0.179 18517 2123 1 2 . 1 1 159 159 GLU H H 227 8.320 8.320 9.044 -0.724 18517 2124 1 2 . 1 1 160 160 ASP N N 228 115.350 115.350 117.730 -2.380 18517 2125 1 2 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.393 0.157 18517 2126 1 2 . 1 1 160 160 ASP C C 228 177.640 177.640 178.007 -0.367 18517 2127 1 2 . 1 1 160 160 ASP CA C 228 57.400 57.400 57.221 0.180 18517 2128 1 2 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.265 2.785 18517 2129 1 2 . 1 1 160 160 ASP H H 228 7.570 7.570 8.417 -0.847 18517 2130 1 2 . 1 1 161 161 ILE N N 229 108.150 108.150 115.891 -7.741 18517 2131 1 2 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.210 0.300 18517 2132 1 2 . 1 1 161 161 ILE C C 229 173.130 173.130 177.387 -4.257 18517 2133 1 2 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.967 -1.677 18517 2134 1 2 . 1 1 161 161 ILE CB C 229 39.400 39.400 38.339 1.061 18517 2135 1 2 . 1 1 161 161 ILE H H 229 7.190 7.190 7.521 -0.331 18517 2136 1 2 . 1 1 162 162 SER N N 230 115.290 115.290 117.576 -2.286 18517 2137 1 2 . 1 1 162 162 SER HA H 230 4.760 4.760 4.327 0.433 18517 2138 1 2 . 1 1 162 162 SER C C 230 176.060 176.060 173.984 2.076 18517 2139 1 2 . 1 1 162 162 SER CA C 230 57.920 57.920 58.369 -0.449 18517 2140 1 2 . 1 1 162 162 SER CB C 230 66.120 66.120 62.049 4.071 18517 2141 1 2 . 1 1 162 162 SER H H 230 7.460 7.460 8.192 -0.732 18517 2142 1 2 . 1 1 163 163 GLY C C 231 173.260 173.260 173.116 0.144 18517 2143 1 2 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.935 0.615 18517 2144 1 2 . 1 1 164 164 TYR N N 232 115.290 115.290 117.911 -2.621 18517 2145 1 2 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.702 -0.002 18517 2146 1 2 . 1 1 164 164 TYR C C 232 172.820 172.820 173.632 -0.812 18517 2147 1 2 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.301 -0.201 18517 2148 1 2 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.510 0.291 18517 2149 1 2 . 1 1 164 164 TYR H H 232 7.370 7.370 7.404 -0.034 18517 2150 1 2 . 1 1 165 165 LEU N N 233 120.980 120.980 123.135 -2.155 18517 2151 1 2 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.570 -0.140 18517 2152 1 2 . 1 1 165 165 LEU C C 233 176.360 176.360 177.244 -0.884 18517 2153 1 2 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.178 1.482 18517 2154 1 2 . 1 1 165 165 LEU CB C 233 40.430 40.430 41.733 -1.303 18517 2155 1 2 . 1 1 165 165 LEU H H 233 8.830 8.830 8.393 0.437 18517 2156 1 2 . 1 1 166 166 THR N N 234 116.170 116.170 114.544 1.626 18517 2157 1 2 . 1 1 166 166 THR HA H 234 4.010 4.010 3.709 0.301 18517 2158 1 2 . 1 1 166 166 THR C C 234 173.070 173.070 174.184 -1.114 18517 2159 1 2 . 1 1 166 166 THR CA C 234 62.910 62.910 64.000 -1.090 18517 2160 1 2 . 1 1 166 166 THR CB C 234 70.170 70.170 69.165 1.005 18517 2161 1 2 . 1 1 166 166 THR H H 234 8.050 8.050 8.357 -0.307 18517 2162 1 2 . 1 1 167 167 VAL N N 235 117.640 117.640 115.841 1.799 18517 2163 1 2 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.353 -0.143 18517 2164 1 2 . 1 1 167 167 VAL C C 235 172.330 172.330 173.258 -0.928 18517 2165 1 2 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.596 1.154 18517 2166 1 2 . 1 1 167 167 VAL CB C 235 35.880 35.880 31.921 3.959 18517 2167 1 2 . 1 1 167 167 VAL H H 235 7.160 7.160 7.493 -0.333 18517 2168 1 2 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.476 -0.286 18517 2169 1 2 . 1 1 168 168 PRO C C 236 173.710 173.710 175.721 -2.011 18517 2170 1 2 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.769 1.062 18517 2171 1 2 . 1 1 168 168 PRO CB C 236 32.270 32.270 32.876 -0.605 18517 2172 1 2 . 1 1 169 169 GLU N N 237 113.540 113.540 118.475 -4.935 18517 2173 1 2 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.046 0.334 18517 2174 1 2 . 1 1 169 169 GLU C C 237 176.690 176.690 178.641 -1.951 18517 2175 1 2 . 1 1 169 169 GLU CA C 237 53.750 53.750 54.557 -0.807 18517 2176 1 2 . 1 1 169 169 GLU CB C 237 33.220 33.220 31.294 1.926 18517 2177 1 2 . 1 1 169 169 GLU H H 237 7.930 7.930 8.284 -0.354 18517 2178 1 2 . 1 1 170 170 TYR N N 238 119.400 119.400 119.536 -0.136 18517 2179 1 2 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.395 -0.395 18517 2180 1 2 . 1 1 170 170 TYR C C 238 177.610 177.610 176.633 0.977 18517 2181 1 2 . 1 1 170 170 TYR CA C 238 62.630 62.630 60.225 2.405 18517 2182 1 2 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.562 -0.822 18517 2183 1 2 . 1 1 170 170 TYR H H 238 8.490 8.490 8.225 0.265 18517 2184 1 2 . 1 1 171 171 GLY N N 239 104.160 104.160 103.449 0.711 18517 2185 1 2 . 1 1 171 171 GLY C C 239 173.350 173.350 173.456 -0.106 18517 2186 1 2 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.879 0.391 18517 2187 1 2 . 1 1 171 171 GLY H H 239 7.960 7.960 8.119 -0.159 18517 2188 1 2 . 1 1 172 172 ALA N N 240 121.860 121.860 124.762 -2.902 18517 2189 1 2 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.714 -0.544 18517 2190 1 2 . 1 1 172 172 ALA C C 240 172.160 172.160 174.777 -2.617 18517 2191 1 2 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.310 0.800 18517 2192 1 2 . 1 1 172 172 ALA CB C 240 20.930 20.930 19.106 1.824 18517 2193 1 2 . 1 1 172 172 ALA H H 240 6.910 6.910 7.854 -0.944 18517 2194 1 2 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.147 1.403 18517 2195 1 2 . 1 1 173 173 PRO C C 241 176.610 176.610 174.822 1.788 18517 2196 1 2 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.027 -0.507 18517 2197 1 2 . 1 1 173 173 PRO CB C 241 33.300 33.300 32.844 0.456 18517 2198 1 2 . 1 1 174 174 MET N N 242 114.000 114.000 118.842 -4.842 18517 2199 1 2 . 1 1 174 174 MET HA H 242 4.390 4.390 4.521 -0.131 18517 2200 1 2 . 1 1 174 174 MET C C 242 173.960 173.960 173.991 -0.031 18517 2201 1 2 . 1 1 174 174 MET CA C 242 54.660 54.660 53.483 1.177 18517 2202 1 2 . 1 1 174 174 MET CB C 242 34.170 34.170 36.522 -2.352 18517 2203 1 2 . 1 1 174 174 MET H H 242 8.040 8.040 7.979 0.061 18517 2204 1 2 . 1 1 175 175 ASN N N 243 119.570 119.570 122.366 -2.796 18517 2205 1 2 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.888 0.052 18517 2206 1 2 . 1 1 175 175 ASN C C 243 174.320 174.320 175.473 -1.153 18517 2207 1 2 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.160 0.920 18517 2208 1 2 . 1 1 175 175 ASN CB C 243 38.850 38.850 38.746 0.104 18517 2209 1 2 . 1 1 175 175 ASN H H 243 7.960 7.960 8.310 -0.350 18517 2210 1 2 . 1 1 176 176 ALA N N 244 132.250 132.250 128.800 3.450 18517 2211 1 2 . 1 1 176 176 ALA C C 244 181.580 181.580 178.862 2.718 18517 2212 1 2 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.169 0.601 18517 2213 1 2 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.771 0.259 18517 2214 1 2 . 1 1 176 176 ALA H H 244 12.110 12.110 8.870 3.240 18517 2215 1 2 . 1 1 177 177 ALA N N 245 125.780 125.780 120.778 5.002 18517 2216 1 2 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.943 -0.073 18517 2217 1 2 . 1 1 177 177 ALA C C 245 180.640 180.640 179.074 1.566 18517 2218 1 2 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.324 0.336 18517 2219 1 2 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.267 -0.427 18517 2220 1 2 . 1 1 177 177 ALA H H 245 10.240 10.240 8.798 1.442 18517 2221 1 2 . 1 1 178 178 LYS N N 246 119.810 119.810 119.332 0.478 18517 2222 1 2 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.132 -0.302 18517 2223 1 2 . 1 1 178 178 LYS C C 246 180.500 180.500 178.104 2.396 18517 2224 1 2 . 1 1 178 178 LYS CA C 246 59.900 59.900 58.611 1.289 18517 2225 1 2 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.158 -0.838 18517 2226 1 2 . 1 1 178 178 LYS H H 246 8.470 8.470 8.021 0.449 18517 2227 1 2 . 1 1 179 179 TRP N N 247 121.170 121.170 121.435 -0.265 18517 2228 1 2 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.353 0.267 18517 2229 1 2 . 1 1 179 179 TRP C C 247 176.510 176.510 177.997 -1.487 18517 2230 1 2 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.746 0.074 18517 2231 1 2 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.616 -0.046 18517 2232 1 2 . 1 1 179 179 TRP H H 247 8.330 8.330 8.186 0.144 18517 2233 1 2 . 1 1 180 180 ALA N N 248 119.130 119.130 120.721 -1.591 18517 2234 1 2 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.954 0.586 18517 2235 1 2 . 1 1 180 180 ALA C C 248 182.110 182.110 179.381 2.729 18517 2236 1 2 . 1 1 180 180 ALA CA C 248 54.190 54.190 55.019 -0.829 18517 2237 1 2 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.057 0.653 18517 2238 1 2 . 1 1 180 180 ALA H H 248 7.990 7.990 8.452 -0.462 18517 2239 1 2 . 1 1 181 181 LYS N N 249 116.000 116.000 119.176 -3.176 18517 2240 1 2 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.032 -0.062 18517 2241 1 2 . 1 1 181 181 LYS C C 249 179.380 179.380 178.794 0.586 18517 2242 1 2 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.560 -0.850 18517 2243 1 2 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.699 -0.189 18517 2244 1 2 . 1 1 181 181 LYS H H 249 6.900 6.900 7.780 -0.880 18517 2245 1 2 . 1 1 182 182 VAL N N 250 122.270 122.270 115.676 6.594 18517 2246 1 2 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.802 -0.462 18517 2247 1 2 . 1 1 182 182 VAL C C 250 178.160 178.160 177.485 0.675 18517 2248 1 2 . 1 1 182 182 VAL CA C 250 66.760 66.760 65.551 1.209 18517 2249 1 2 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.113 -0.273 18517 2250 1 2 . 1 1 182 182 VAL H H 250 7.050 7.050 7.936 -0.886 18517 2251 1 2 . 1 1 183 183 GLU N N 251 120.520 120.520 121.230 -0.710 18517 2252 1 2 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.747 -0.567 18517 2253 1 2 . 1 1 183 183 GLU C C 251 179.480 179.480 178.730 0.750 18517 2254 1 2 . 1 1 183 183 GLU CA C 251 60.690 60.690 60.076 0.614 18517 2255 1 2 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.949 -0.879 18517 2256 1 2 . 1 1 183 183 GLU H H 251 8.020 8.020 8.681 -0.661 18517 2257 1 2 . 1 1 184 184 GLY N N 252 102.930 102.930 107.093 -4.163 18517 2258 1 2 . 1 1 184 184 GLY C C 252 176.920 176.920 176.587 0.333 18517 2259 1 2 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.072 0.338 18517 2260 1 2 . 1 1 184 184 GLY H H 252 7.830 7.830 8.165 -0.335 18517 2261 1 2 . 1 1 185 185 MET N N 253 123.200 123.200 122.062 1.138 18517 2262 1 2 . 1 1 185 185 MET HA H 253 4.250 4.250 4.059 0.191 18517 2263 1 2 . 1 1 185 185 MET C C 253 179.370 179.370 178.614 0.756 18517 2264 1 2 . 1 1 185 185 MET CA C 253 59.300 59.300 59.583 -0.283 18517 2265 1 2 . 1 1 185 185 MET CB C 253 33.930 33.930 32.584 1.346 18517 2266 1 2 . 1 1 185 185 MET H H 253 7.890 7.890 7.820 0.070 18517 2267 1 2 . 1 1 186 186 ILE N N 254 120.150 120.150 119.519 0.631 18517 2268 1 2 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.590 -0.030 18517 2269 1 2 . 1 1 186 186 ILE C C 254 177.250 177.250 177.951 -0.701 18517 2270 1 2 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.560 0.960 18517 2271 1 2 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.636 0.654 18517 2272 1 2 . 1 1 186 186 ILE H H 254 8.260 8.260 8.744 -0.484 18517 2273 1 2 . 1 1 187 187 HIS N N 255 119.810 119.810 119.325 0.485 18517 2274 1 2 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.133 -0.133 18517 2275 1 2 . 1 1 187 187 HIS C C 255 176.460 176.460 177.360 -0.900 18517 2276 1 2 . 1 1 187 187 HIS CA C 255 60.330 60.330 60.020 0.311 18517 2277 1 2 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.574 2.056 18517 2278 1 2 . 1 1 187 187 HIS H H 255 8.900 8.900 8.576 0.324 18517 2279 1 2 . 1 1 188 188 GLY N N 256 103.160 103.160 106.754 -3.594 18517 2280 1 2 . 1 1 188 188 GLY C C 256 176.320 176.320 176.269 0.051 18517 2281 1 2 . 1 1 188 188 GLY CA C 256 46.890 46.890 47.018 -0.128 18517 2282 1 2 . 1 1 188 188 GLY H H 256 8.030 8.030 8.468 -0.438 18517 2283 1 2 . 1 1 189 189 LYS N N 257 119.510 119.510 122.504 -2.994 18517 2284 1 2 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.152 -0.152 18517 2285 1 2 . 1 1 189 189 LYS C C 257 178.660 178.660 179.468 -0.808 18517 2286 1 2 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.277 -0.787 18517 2287 1 2 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.745 -0.195 18517 2288 1 2 . 1 1 189 189 LYS H H 257 7.120 7.120 7.782 -0.662 18517 2289 1 2 . 1 1 190 190 LEU N N 258 120.570 120.570 119.941 0.629 18517 2290 1 2 . 1 1 190 190 LEU HA H 258 3.930 3.930 3.864 0.066 18517 2291 1 2 . 1 1 190 190 LEU C C 258 177.230 177.230 176.970 0.260 18517 2292 1 2 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.436 0.084 18517 2293 1 2 . 1 1 190 190 LEU CB C 258 42.970 42.970 42.154 0.816 18517 2294 1 2 . 1 1 190 190 LEU H H 258 8.060 8.060 8.249 -0.189 18517 2295 1 2 . 1 1 191 191 GLU N N 259 114.590 114.590 115.027 -0.437 18517 2296 1 2 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.313 -0.033 18517 2297 1 2 . 1 1 191 191 GLU C C 259 176.230 176.230 176.505 -0.275 18517 2298 1 2 . 1 1 191 191 GLU CA C 259 55.340 55.340 55.130 0.210 18517 2299 1 2 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.502 -0.172 18517 2300 1 2 . 1 1 191 191 GLU H H 259 7.330 7.330 7.688 -0.358 18517 2301 1 2 . 1 1 192 192 SER N N 260 115.240 115.240 117.935 -2.695 18517 2302 1 2 . 1 1 192 192 SER HA H 260 4.490 4.490 4.396 0.094 18517 2303 1 2 . 1 1 192 192 SER C C 260 173.770 173.770 176.132 -2.362 18517 2304 1 2 . 1 1 192 192 SER CA C 260 58.350 58.350 58.147 0.203 18517 2305 1 2 . 1 1 192 192 SER CB C 260 65.090 65.090 63.928 1.162 18517 2306 1 2 . 1 1 192 192 SER H H 260 7.130 7.130 7.679 -0.549 18517 2307 1 2 . 1 1 193 193 SER C C 261 174.600 174.600 174.850 -0.250 18517 2308 1 2 . 1 1 193 193 SER CA C 261 59.980 59.980 61.023 -1.044 18517 2309 1 2 . 1 1 193 193 SER CB C 261 63.750 63.750 63.309 0.441 18517 2310 1 2 . 1 1 194 194 GLU N N 262 121.800 121.800 120.210 1.590 18517 2311 1 2 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.386 0.084 18517 2312 1 2 . 1 1 194 194 GLU C C 262 174.650 174.650 175.092 -0.442 18517 2313 1 2 . 1 1 194 194 GLU CA C 262 55.620 55.620 55.686 -0.066 18517 2314 1 2 . 1 1 194 194 GLU CB C 262 30.210 30.210 29.883 0.327 18517 2315 1 2 . 1 1 194 194 GLU H H 262 7.840 7.840 7.949 -0.109 18517 2316 1 2 . 1 1 195 195 VAL N N 263 124.080 124.080 123.874 0.206 18517 2317 1 2 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.206 0.044 18517 2318 1 2 . 1 1 195 195 VAL C C 263 174.460 174.460 173.850 0.610 18517 2319 1 2 . 1 1 195 195 VAL CA C 263 59.820 59.820 58.719 1.101 18517 2320 1 2 . 1 1 195 195 VAL CB C 263 33.620 33.620 33.332 0.288 18517 2321 1 2 . 1 1 195 195 VAL H H 263 8.020 8.020 8.158 -0.138 18517 2322 1 2 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.310 0.210 18517 2323 1 2 . 1 1 198 198 ASN C C 266 176.490 176.490 177.391 -0.901 18517 2324 1 2 . 1 1 198 198 ASN CA C 266 54.780 54.780 55.109 -0.329 18517 2325 1 2 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.668 0.392 18517 2326 1 2 . 1 1 199 199 LEU N N 267 120.680 120.680 122.323 -1.643 18517 2327 1 2 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.895 0.115 18517 2328 1 2 . 1 1 199 199 LEU C C 267 178.050 178.050 177.709 0.341 18517 2329 1 2 . 1 1 199 199 LEU CA C 267 58.830 58.830 57.918 0.912 18517 2330 1 2 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.670 0.670 18517 2331 1 2 . 1 1 199 199 LEU H H 267 7.660 7.660 8.043 -0.383 18517 2332 1 2 . 1 1 200 200 LYS N N 268 116.740 116.740 119.481 -2.741 18517 2333 1 2 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.744 -0.014 18517 2334 1 2 . 1 1 200 200 LYS C C 268 178.520 178.520 178.581 -0.061 18517 2335 1 2 . 1 1 200 200 LYS CA C 268 61.800 61.800 59.824 1.976 18517 2336 1 2 . 1 1 200 200 LYS CB C 268 32.110 32.110 32.291 -0.181 18517 2337 1 2 . 1 1 200 200 LYS H H 268 8.280 8.280 8.523 -0.243 18517 2338 1 2 . 1 1 201 201 ALA N N 269 121.270 121.270 121.991 -0.721 18517 2339 1 2 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.090 0.150 18517 2340 1 2 . 1 1 201 201 ALA C C 269 180.890 180.890 179.949 0.941 18517 2341 1 2 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.090 0.090 18517 2342 1 2 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.141 0.329 18517 2343 1 2 . 1 1 201 201 ALA H H 269 7.710 7.710 7.897 -0.187 18517 2344 1 2 . 1 1 202 202 LEU N N 270 119.980 119.980 119.658 0.322 18517 2345 1 2 . 1 1 202 202 LEU HA H 270 4.090 4.090 4.082 0.008 18517 2346 1 2 . 1 1 202 202 LEU C C 270 179.330 179.330 179.814 -0.484 18517 2347 1 2 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.822 0.248 18517 2348 1 2 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.901 0.519 18517 2349 1 2 . 1 1 202 202 LEU H H 270 7.750 7.750 8.167 -0.417 18517 2350 1 2 . 1 1 203 203 VAL N N 271 118.450 118.450 119.695 -1.245 18517 2351 1 2 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.772 0.058 18517 2352 1 2 . 1 1 203 203 VAL C C 271 177.110 177.110 177.910 -0.800 18517 2353 1 2 . 1 1 203 203 VAL CA C 271 67.710 67.710 67.001 0.709 18517 2354 1 2 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.317 0.393 18517 2355 1 2 . 1 1 203 203 VAL H H 271 8.560 8.560 8.514 0.046 18517 2356 1 2 . 1 1 204 204 ALA N N 272 122.560 122.560 122.018 0.542 18517 2357 1 2 . 1 1 204 204 ALA HA H 272 3.880 3.880 3.965 -0.085 18517 2358 1 2 . 1 1 204 204 ALA C C 272 178.700 178.700 179.527 -0.827 18517 2359 1 2 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.461 0.669 18517 2360 1 2 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.165 0.225 18517 2361 1 2 . 1 1 204 204 ALA H H 272 8.120 8.120 8.458 -0.338 18517 2362 1 2 . 1 1 205 205 GLU N N 273 117.290 117.290 119.184 -1.894 18517 2363 1 2 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.020 -0.030 18517 2364 1 2 . 1 1 205 205 GLU C C 273 178.630 178.630 179.141 -0.511 18517 2365 1 2 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.317 0.823 18517 2366 1 2 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.604 0.366 18517 2367 1 2 . 1 1 205 205 GLU H H 273 7.670 7.670 8.165 -0.495 18517 2368 1 2 . 1 1 206 206 LEU N N 274 120.450 120.450 121.347 -0.897 18517 2369 1 2 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.048 -0.048 18517 2370 1 2 . 1 1 206 206 LEU C C 274 178.400 178.400 178.904 -0.504 18517 2371 1 2 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.021 0.889 18517 2372 1 2 . 1 1 206 206 LEU CB C 274 43.530 43.530 42.107 1.423 18517 2373 1 2 . 1 1 206 206 LEU H H 274 8.420 8.420 8.252 0.168 18517 2374 1 2 . 1 1 207 207 ILE N N 275 117.580 117.580 120.762 -3.182 18517 2375 1 2 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.585 -0.055 18517 2376 1 2 . 1 1 207 207 ILE C C 275 178.850 178.850 178.450 0.400 18517 2377 1 2 . 1 1 207 207 ILE CA C 275 66.080 66.080 65.819 0.261 18517 2378 1 2 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.778 0.992 18517 2379 1 2 . 1 1 207 207 ILE H H 275 8.700 8.700 8.346 0.354 18517 2380 1 2 . 1 1 208 208 GLU N N 276 119.100 119.100 119.063 0.037 18517 2381 1 2 . 1 1 208 208 GLU HA H 276 4.000 4.000 4.141 -0.141 18517 2382 1 2 . 1 1 208 208 GLU C C 276 178.540 178.540 179.445 -0.905 18517 2383 1 2 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.481 0.969 18517 2384 1 2 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.375 1.145 18517 2385 1 2 . 1 1 208 208 GLU H H 276 7.950 7.950 8.037 -0.087 18517 2386 1 2 . 1 1 209 209 LEU N N 277 120.590 120.590 119.631 0.959 18517 2387 1 2 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.259 -0.039 18517 2388 1 2 . 1 1 209 209 LEU C C 277 179.520 179.520 179.327 0.193 18517 2389 1 2 . 1 1 209 209 LEU CA C 277 58.350 58.350 57.860 0.490 18517 2390 1 2 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.157 2.133 18517 2391 1 2 . 1 1 209 209 LEU H H 277 8.550 8.550 8.307 0.243 18517 2392 1 2 . 1 1 210 210 ARG N N 278 116.470 116.470 119.634 -3.164 18517 2393 1 2 . 1 1 210 210 ARG HA H 278 3.740 3.740 4.121 -0.381 18517 2394 1 2 . 1 1 210 210 ARG C C 278 179.190 179.190 178.502 0.688 18517 2395 1 2 . 1 1 210 210 ARG CA C 278 61.680 61.680 58.633 3.047 18517 2396 1 2 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.078 1.322 18517 2397 1 2 . 1 1 210 210 ARG H H 278 8.590 8.590 8.335 0.255 18517 2398 1 2 . 1 1 211 211 ALA N N 279 120.470 120.470 123.866 -3.396 18517 2399 1 2 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.051 -0.141 18517 2400 1 2 . 1 1 211 211 ALA C C 279 181.350 181.350 179.681 1.669 18517 2401 1 2 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.303 0.397 18517 2402 1 2 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.429 -1.149 18517 2403 1 2 . 1 1 211 211 ALA H H 279 8.050 8.050 8.136 -0.086 18517 2404 1 2 . 1 1 212 212 GLN N N 280 120.070 120.070 117.770 2.300 18517 2405 1 2 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.952 0.068 18517 2406 1 2 . 1 1 212 212 GLN C C 280 179.490 179.490 178.684 0.806 18517 2407 1 2 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.867 0.433 18517 2408 1 2 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.683 0.497 18517 2409 1 2 . 1 1 212 212 GLN H H 280 8.300 8.300 8.100 0.200 18517 2410 1 2 . 1 1 213 213 MET N N 281 119.810 119.810 118.749 1.061 18517 2411 1 2 . 1 1 213 213 MET HA H 281 3.730 3.730 4.242 -0.512 18517 2412 1 2 . 1 1 213 213 MET C C 281 177.490 177.490 178.700 -1.210 18517 2413 1 2 . 1 1 213 213 MET CA C 281 60.690 60.690 57.214 3.476 18517 2414 1 2 . 1 1 213 213 MET CB C 281 33.930 33.930 31.899 2.030 18517 2415 1 2 . 1 1 213 213 MET H H 281 8.420 8.420 8.320 0.100 18517 2416 1 2 . 1 1 214 214 MET N N 282 114.000 114.000 118.798 -4.798 18517 2417 1 2 . 1 1 214 214 MET HA H 282 3.880 3.880 4.284 -0.404 18517 2418 1 2 . 1 1 214 214 MET C C 282 177.650 177.650 178.555 -0.905 18517 2419 1 2 . 1 1 214 214 MET CA C 282 58.670 58.670 57.482 1.188 18517 2420 1 2 . 1 1 214 214 MET CB C 282 33.300 33.300 31.609 1.691 18517 2421 1 2 . 1 1 214 214 MET H H 282 7.890 7.890 8.445 -0.555 18517 2422 1 2 . 1 1 215 215 ALA N N 283 119.970 119.970 123.015 -3.045 18517 2423 1 2 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.081 0.059 18517 2424 1 2 . 1 1 215 215 ALA C C 283 180.580 180.580 179.674 0.906 18517 2425 1 2 . 1 1 215 215 ALA CA C 283 54.110 54.110 54.912 -0.802 18517 2426 1 2 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.209 -0.529 18517 2427 1 2 . 1 1 215 215 ALA H H 283 7.580 7.580 8.202 -0.622 18517 2428 1 2 . 1 1 216 216 LEU N N 284 120.920 120.920 119.198 1.722 18517 2429 1 2 . 1 1 216 216 LEU HA H 284 3.960 3.960 3.971 -0.011 18517 2430 1 2 . 1 1 216 216 LEU C C 284 177.910 177.910 179.211 -1.301 18517 2431 1 2 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.281 0.639 18517 2432 1 2 . 1 1 216 216 LEU CB C 284 42.500 42.500 41.998 0.501 18517 2433 1 2 . 1 1 216 216 LEU H H 284 7.460 7.460 8.089 -0.629 18517 2434 1 2 . 1 1 217 217 LEU N N 285 116.470 116.470 120.324 -3.854 18517 2435 1 2 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.907 -0.227 18517 2436 1 2 . 1 1 217 217 LEU C C 285 178.310 178.310 176.779 1.531 18517 2437 1 2 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.631 -0.191 18517 2438 1 2 . 1 1 217 217 LEU CB C 285 43.050 43.050 42.088 0.962 18517 2439 1 2 . 1 1 217 217 LEU H H 285 6.980 6.980 8.379 -1.399 18517 2440 1 2 . 1 1 218 218 TYR N N 286 111.080 111.080 113.392 -2.312 18517 2441 1 2 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.593 0.307 18517 2442 1 2 . 1 1 218 218 TYR C C 286 176.090 176.090 175.800 0.290 18517 2443 1 2 . 1 1 218 218 TYR CA C 286 56.050 56.050 56.727 -0.677 18517 2444 1 2 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.571 2.339 18517 2445 1 2 . 1 1 218 218 TYR H H 286 7.660 7.660 7.704 -0.044 18517 2446 1 2 . 1 1 219 219 GLY N N 287 108.260 108.260 109.541 -1.281 18517 2447 1 2 . 1 1 219 219 GLY CA C 287 44.320 44.320 42.961 1.359 18517 2448 1 2 . 1 1 219 219 GLY H H 287 7.750 7.750 7.471 0.279 18517 2449 1 2 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.806 -0.316 18517 2450 1 2 . 1 1 221 221 ILE CA C 289 63.580 63.580 62.331 1.249 18517 2451 1 2 . 1 1 221 221 ILE CB C 289 38.280 38.280 37.630 0.650 18517 2452 1 2 . 1 1 222 222 GLY CA C 290 45.740 45.740 45.310 0.430 18517 2453 1 3 . 1 1 2 2 LYS N N 70 126.600 126.600 121.865 4.735 18517 2454 1 3 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.853 -0.493 18517 2455 1 3 . 1 1 2 2 LYS C C 70 176.000 176.000 174.713 1.287 18517 2456 1 3 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.975 0.475 18517 2457 1 3 . 1 1 2 2 LYS CB C 70 33.850 33.850 34.270 -0.420 18517 2458 1 3 . 1 1 2 2 LYS H H 70 8.530 8.530 8.339 0.191 18517 2459 1 3 . 1 1 3 3 THR N N 71 111.030 111.030 115.435 -4.405 18517 2460 1 3 . 1 1 3 3 THR HA H 71 4.400 4.400 4.481 -0.081 18517 2461 1 3 . 1 1 3 3 THR C C 71 175.650 175.650 174.618 1.032 18517 2462 1 3 . 1 1 3 3 THR CA C 71 60.610 60.610 61.058 -0.448 18517 2463 1 3 . 1 1 3 3 THR CB C 71 71.520 71.520 69.906 1.614 18517 2464 1 3 . 1 1 3 3 THR H H 71 7.390 7.390 8.051 -0.661 18517 2465 1 3 . 1 1 4 4 LEU N N 72 121.560 121.560 123.103 -1.543 18517 2466 1 3 . 1 1 4 4 LEU C C 72 177.870 177.870 178.396 -0.526 18517 2467 1 3 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.916 -0.436 18517 2468 1 3 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.738 0.442 18517 2469 1 3 . 1 1 4 4 LEU H H 72 8.980 8.980 8.647 0.333 18517 2470 1 3 . 1 1 5 5 ASP N N 73 115.530 115.530 119.337 -3.807 18517 2471 1 3 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.372 -0.042 18517 2472 1 3 . 1 1 5 5 ASP C C 73 179.290 179.290 178.560 0.730 18517 2473 1 3 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.846 -0.006 18517 2474 1 3 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.701 0.129 18517 2475 1 3 . 1 1 5 5 ASP H H 73 8.270 8.270 8.464 -0.194 18517 2476 1 3 . 1 1 6 6 VAL N N 74 122.330 122.330 119.245 3.085 18517 2477 1 3 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.613 0.127 18517 2478 1 3 . 1 1 6 6 VAL C C 74 178.970 178.970 177.927 1.043 18517 2479 1 3 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.725 0.635 18517 2480 1 3 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.747 0.203 18517 2481 1 3 . 1 1 6 6 VAL H H 74 7.400 7.400 7.924 -0.524 18517 2482 1 3 . 1 1 7 7 LEU N N 75 121.360 121.360 119.676 1.684 18517 2483 1 3 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.919 0.111 18517 2484 1 3 . 1 1 7 7 LEU C C 75 179.240 179.240 178.754 0.486 18517 2485 1 3 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.373 -0.143 18517 2486 1 3 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.242 1.648 18517 2487 1 3 . 1 1 7 7 LEU H H 75 8.300 8.300 8.521 -0.221 18517 2488 1 3 . 1 1 8 8 ARG N N 76 117.230 117.230 118.678 -1.448 18517 2489 1 3 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.202 -0.282 18517 2490 1 3 . 1 1 8 8 ARG C C 76 178.290 178.290 178.766 -0.476 18517 2491 1 3 . 1 1 8 8 ARG CA C 76 60.770 60.770 58.579 2.191 18517 2492 1 3 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.026 1.184 18517 2493 1 3 . 1 1 8 8 ARG H H 76 8.520 8.520 8.759 -0.239 18517 2494 1 3 . 1 1 9 9 GLY N N 77 104.570 104.570 109.718 -5.148 18517 2495 1 3 . 1 1 9 9 GLY C C 77 176.180 176.180 176.351 -0.171 18517 2496 1 3 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.989 0.181 18517 2497 1 3 . 1 1 9 9 GLY H H 77 7.620 7.620 8.496 -0.876 18517 2498 1 3 . 1 1 10 10 GLU N N 78 120.270 120.270 122.968 -2.698 18517 2499 1 3 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.131 0.139 18517 2500 1 3 . 1 1 10 10 GLU C C 78 179.030 179.030 179.225 -0.195 18517 2501 1 3 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.101 -0.231 18517 2502 1 3 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.247 2.153 18517 2503 1 3 . 1 1 10 10 GLU H H 78 8.100 8.100 8.384 -0.284 18517 2504 1 3 . 1 1 11 11 LEU N N 79 116.000 116.000 119.981 -3.981 18517 2505 1 3 . 1 1 11 11 LEU HA H 79 4.510 4.510 4.045 0.465 18517 2506 1 3 . 1 1 11 11 LEU C C 79 179.630 179.630 179.441 0.189 18517 2507 1 3 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.092 -1.402 18517 2508 1 3 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.614 3.186 18517 2509 1 3 . 1 1 11 11 LEU H H 79 8.230 8.230 8.379 -0.149 18517 2510 1 3 . 1 1 12 12 ARG N N 80 120.020 120.020 119.593 0.427 18517 2511 1 3 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.935 -0.185 18517 2512 1 3 . 1 1 12 12 ARG C C 80 178.490 178.490 178.606 -0.116 18517 2513 1 3 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.786 2.214 18517 2514 1 3 . 1 1 12 12 ARG CB C 80 31.240 31.240 30.010 1.230 18517 2515 1 3 . 1 1 12 12 ARG H H 80 8.210 8.210 8.589 -0.379 18517 2516 1 3 . 1 1 13 13 GLY N N 81 108.090 108.090 107.045 1.045 18517 2517 1 3 . 1 1 13 13 GLY C C 81 173.540 173.540 176.506 -2.966 18517 2518 1 3 . 1 1 13 13 GLY CA C 81 48.000 48.000 47.182 0.818 18517 2519 1 3 . 1 1 13 13 GLY H H 81 8.890 8.890 8.446 0.444 18517 2520 1 3 . 1 1 14 14 GLN C C 82 179.540 179.540 178.928 0.612 18517 2521 1 3 . 1 1 14 14 GLN CA C 82 58.710 58.710 58.823 -0.113 18517 2522 1 3 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.958 0.142 18517 2523 1 3 . 1 1 15 15 ARG N N 83 118.220 118.220 119.340 -1.120 18517 2524 1 3 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.169 -0.219 18517 2525 1 3 . 1 1 15 15 ARG C C 83 177.710 177.710 178.531 -0.821 18517 2526 1 3 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.066 0.834 18517 2527 1 3 . 1 1 15 15 ARG CB C 83 29.650 29.650 29.363 0.287 18517 2528 1 3 . 1 1 15 15 ARG H H 83 7.320 7.320 8.255 -0.935 18517 2529 1 3 . 1 1 16 16 GLU N N 84 118.810 118.810 120.795 -1.985 18517 2530 1 3 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.134 -0.284 18517 2531 1 3 . 1 1 16 16 GLU C C 84 178.750 178.750 178.795 -0.045 18517 2532 1 3 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.400 1.610 18517 2533 1 3 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.233 0.177 18517 2534 1 3 . 1 1 16 16 GLU H H 84 8.450 8.450 8.805 -0.355 18517 2535 1 3 . 1 1 17 17 ALA N N 85 122.790 122.790 122.698 0.092 18517 2536 1 3 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.079 0.111 18517 2537 1 3 . 1 1 17 17 ALA C C 85 180.360 180.360 179.362 0.998 18517 2538 1 3 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.310 0.150 18517 2539 1 3 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.381 -0.301 18517 2540 1 3 . 1 1 17 17 ALA H H 85 8.420 8.420 8.106 0.314 18517 2541 1 3 . 1 1 18 18 PHE N N 86 119.400 119.400 120.118 -0.718 18517 2542 1 3 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.169 0.121 18517 2543 1 3 . 1 1 18 18 PHE C C 86 177.560 177.560 177.587 -0.027 18517 2544 1 3 . 1 1 18 18 PHE CA C 86 61.640 61.640 62.137 -0.497 18517 2545 1 3 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.286 0.354 18517 2546 1 3 . 1 1 18 18 PHE H H 86 7.490 7.490 8.123 -0.633 18517 2547 1 3 . 1 1 19 19 LEU N N 87 117.470 117.470 119.744 -2.274 18517 2548 1 3 . 1 1 19 19 LEU HA H 87 4.070 4.070 3.982 0.088 18517 2549 1 3 . 1 1 19 19 LEU C C 87 178.880 178.880 178.567 0.313 18517 2550 1 3 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.486 -0.526 18517 2551 1 3 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.677 0.423 18517 2552 1 3 . 1 1 19 19 LEU H H 87 8.010 8.010 8.853 -0.843 18517 2553 1 3 . 1 1 20 20 SER N N 88 113.770 113.770 115.112 -1.342 18517 2554 1 3 . 1 1 20 20 SER HA H 88 4.070 4.070 4.106 -0.036 18517 2555 1 3 . 1 1 20 20 SER C C 88 175.680 175.680 176.895 -1.215 18517 2556 1 3 . 1 1 20 20 SER CA C 88 63.070 63.070 62.469 0.601 18517 2557 1 3 . 1 1 20 20 SER H H 88 8.100 8.100 8.353 -0.253 18517 2558 1 3 . 1 1 21 21 GLU N N 89 120.570 120.570 120.934 -0.364 18517 2559 1 3 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.030 -0.060 18517 2560 1 3 . 1 1 21 21 GLU C C 89 178.940 178.940 178.776 0.164 18517 2561 1 3 . 1 1 21 21 GLU CA C 89 59.260 59.260 58.602 0.658 18517 2562 1 3 . 1 1 21 21 GLU CB C 89 29.330 29.330 28.842 0.488 18517 2563 1 3 . 1 1 21 21 GLU H H 89 7.400 7.400 7.956 -0.556 18517 2564 1 3 . 1 1 22 22 ILE N N 90 119.350 119.350 120.717 -1.367 18517 2565 1 3 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.886 -0.196 18517 2566 1 3 . 1 1 22 22 ILE C C 90 177.230 177.230 177.872 -0.642 18517 2567 1 3 . 1 1 22 22 ILE CA C 90 63.470 63.470 63.368 0.102 18517 2568 1 3 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.855 -0.465 18517 2569 1 3 . 1 1 22 22 ILE H H 90 7.250 7.250 8.044 -0.794 18517 2570 1 3 . 1 1 23 23 ILE N N 91 116.350 116.350 116.679 -0.329 18517 2571 1 3 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.748 -0.348 18517 2572 1 3 . 1 1 23 23 ILE C C 91 176.690 176.690 177.354 -0.664 18517 2573 1 3 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.810 1.920 18517 2574 1 3 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.151 0.619 18517 2575 1 3 . 1 1 23 23 ILE H H 91 7.860 7.860 7.891 -0.031 18517 2576 1 3 . 1 1 24 24 LYS N N 92 116.000 116.000 117.819 -1.819 18517 2577 1 3 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.143 -0.003 18517 2578 1 3 . 1 1 24 24 LYS C C 92 176.270 176.270 176.695 -0.425 18517 2579 1 3 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.702 -0.222 18517 2580 1 3 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.837 0.463 18517 2581 1 3 . 1 1 24 24 LYS H H 92 7.170 7.170 7.937 -0.767 18517 2582 1 3 . 1 1 25 25 SER N N 93 114.650 114.650 114.963 -0.313 18517 2583 1 3 . 1 1 25 25 SER HA H 93 4.550 4.550 4.275 0.275 18517 2584 1 3 . 1 1 25 25 SER C C 93 173.370 173.370 173.153 0.217 18517 2585 1 3 . 1 1 25 25 SER CA C 93 57.240 57.240 59.458 -2.218 18517 2586 1 3 . 1 1 25 25 SER CB C 93 65.650 65.650 63.602 2.048 18517 2587 1 3 . 1 1 25 25 SER H H 93 7.730 7.730 7.781 -0.051 18517 2588 1 3 . 1 1 26 26 ASP N N 94 121.230 121.230 123.560 -2.330 18517 2589 1 3 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.770 0.160 18517 2590 1 3 . 1 1 26 26 ASP C C 94 176.560 176.560 175.639 0.921 18517 2591 1 3 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.366 1.144 18517 2592 1 3 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.785 0.865 18517 2593 1 3 . 1 1 26 26 ASP H H 94 8.280 8.280 8.491 -0.211 18517 2594 1 3 . 1 1 27 27 GLY N N 95 109.310 109.310 109.025 0.285 18517 2595 1 3 . 1 1 27 27 GLY C C 95 171.080 171.080 171.775 -0.695 18517 2596 1 3 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.658 -0.888 18517 2597 1 3 . 1 1 27 27 GLY H H 95 8.160 8.160 7.553 0.607 18517 2598 1 3 . 1 1 29 29 PHE HA H 97 5.140 5.140 5.198 -0.058 18517 2599 1 3 . 1 1 29 29 PHE C C 97 175.230 175.230 176.602 -1.372 18517 2600 1 3 . 1 1 29 29 PHE CA C 97 56.490 56.490 55.924 0.566 18517 2601 1 3 . 1 1 29 29 PHE CB C 97 41.620 41.620 41.467 0.153 18517 2602 1 3 . 1 1 30 30 THR N N 98 112.600 112.600 112.883 -0.283 18517 2603 1 3 . 1 1 30 30 THR HA H 98 4.570 4.570 4.309 0.261 18517 2604 1 3 . 1 1 30 30 THR C C 98 176.690 176.690 174.393 2.297 18517 2605 1 3 . 1 1 30 30 THR CA C 98 60.290 60.290 60.014 0.276 18517 2606 1 3 . 1 1 30 30 THR CB C 98 71.600 71.600 70.680 0.920 18517 2607 1 3 . 1 1 30 30 THR H H 98 8.990 8.990 8.674 0.316 18517 2608 1 3 . 1 1 31 31 ILE N N 99 119.240 119.240 120.884 -1.644 18517 2609 1 3 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.508 0.312 18517 2610 1 3 . 1 1 31 31 ILE C C 99 176.090 176.090 176.374 -0.284 18517 2611 1 3 . 1 1 31 31 ILE CA C 99 60.140 60.140 62.627 -2.486 18517 2612 1 3 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.790 -0.840 18517 2613 1 3 . 1 1 31 31 ILE H H 99 9.230 9.230 8.043 1.187 18517 2614 1 3 . 1 1 32 32 LEU N N 100 119.660 119.660 118.881 0.779 18517 2615 1 3 . 1 1 32 32 LEU HA H 100 4.030 4.030 3.890 0.140 18517 2616 1 3 . 1 1 32 32 LEU C C 100 181.050 181.050 178.900 2.150 18517 2617 1 3 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.780 -0.220 18517 2618 1 3 . 1 1 32 32 LEU CB C 100 40.120 40.120 41.268 -1.148 18517 2619 1 3 . 1 1 32 32 LEU H H 100 7.310 7.310 7.974 -0.664 18517 2620 1 3 . 1 1 33 33 GLN N N 101 121.450 121.450 119.354 2.096 18517 2621 1 3 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.310 -0.060 18517 2622 1 3 . 1 1 33 33 GLN CA C 101 59.700 59.700 59.205 0.495 18517 2623 1 3 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.963 2.827 18517 2624 1 3 . 1 1 33 33 GLN H H 101 7.790 7.790 7.780 0.010 18517 2625 1 3 . 1 1 34 34 LEU C C 102 178.590 178.590 178.892 -0.302 18517 2626 1 3 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.117 0.513 18517 2627 1 3 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.734 -0.424 18517 2628 1 3 . 1 1 35 35 VAL N N 103 118.520 118.520 117.562 0.958 18517 2629 1 3 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.563 -0.143 18517 2630 1 3 . 1 1 35 35 VAL C C 103 177.930 177.930 177.824 0.106 18517 2631 1 3 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.232 -0.192 18517 2632 1 3 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.955 0.675 18517 2633 1 3 . 1 1 35 35 VAL H H 103 8.670 8.670 8.295 0.375 18517 2634 1 3 . 1 1 36 36 GLY N N 104 109.430 109.430 108.584 0.846 18517 2635 1 3 . 1 1 36 36 GLY C C 104 174.600 174.600 175.555 -0.955 18517 2636 1 3 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.007 1.033 18517 2637 1 3 . 1 1 36 36 GLY H H 104 7.880 7.880 8.141 -0.261 18517 2638 1 3 . 1 1 37 37 TYR N N 105 122.270 122.270 124.025 -1.755 18517 2639 1 3 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.392 -0.512 18517 2640 1 3 . 1 1 37 37 TYR C C 105 176.310 176.310 177.001 -0.691 18517 2641 1 3 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.128 3.972 18517 2642 1 3 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.716 -0.346 18517 2643 1 3 . 1 1 37 37 TYR H H 105 8.170 8.170 8.432 -0.262 18517 2644 1 3 . 1 1 38 38 LEU N N 106 120.100 120.100 121.446 -1.346 18517 2645 1 3 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.812 -0.072 18517 2646 1 3 . 1 1 38 38 LEU C C 106 178.280 178.280 178.549 -0.269 18517 2647 1 3 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.088 0.542 18517 2648 1 3 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.579 1.151 18517 2649 1 3 . 1 1 38 38 LEU H H 106 7.610 7.610 8.182 -0.572 18517 2650 1 3 . 1 1 39 39 ARG N N 107 116.670 116.670 118.467 -1.797 18517 2651 1 3 . 1 1 39 39 ARG HA H 107 3.680 3.680 4.211 -0.531 18517 2652 1 3 . 1 1 39 39 ARG C C 107 179.480 179.480 178.528 0.952 18517 2653 1 3 . 1 1 39 39 ARG CA C 107 59.580 59.580 58.234 1.346 18517 2654 1 3 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.202 2.038 18517 2655 1 3 . 1 1 39 39 ARG H H 107 8.240 8.240 7.850 0.390 18517 2656 1 3 . 1 1 40 40 VAL N N 108 121.970 121.970 119.736 2.234 18517 2657 1 3 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.670 -0.270 18517 2658 1 3 . 1 1 40 40 VAL C C 108 178.440 178.440 177.940 0.500 18517 2659 1 3 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.662 1.288 18517 2660 1 3 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.136 -0.696 18517 2661 1 3 . 1 1 40 40 VAL H H 108 8.200 8.200 7.879 0.321 18517 2662 1 3 . 1 1 41 41 VAL N N 109 108.940 108.940 116.411 -7.471 18517 2663 1 3 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.504 0.736 18517 2664 1 3 . 1 1 41 41 VAL C C 109 175.070 175.070 177.215 -2.145 18517 2665 1 3 . 1 1 41 41 VAL CA C 109 62.590 62.590 66.027 -3.437 18517 2666 1 3 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.523 -0.873 18517 2667 1 3 . 1 1 41 41 VAL H H 109 7.760 7.760 7.986 -0.226 18517 2668 1 3 . 1 1 42 42 ASP N N 110 124.670 124.670 120.384 4.286 18517 2669 1 3 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.204 0.416 18517 2670 1 3 . 1 1 42 42 ASP C C 110 177.310 177.310 177.959 -0.649 18517 2671 1 3 . 1 1 42 42 ASP CA C 110 59.980 59.980 57.649 2.331 18517 2672 1 3 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.326 4.624 18517 2673 1 3 . 1 1 42 42 ASP H H 110 7.360 7.360 8.218 -0.858 18517 2674 1 3 . 1 1 43 43 THR N N 111 102.340 102.340 114.242 -11.902 18517 2675 1 3 . 1 1 43 43 THR HA H 111 5.100 5.100 4.092 1.008 18517 2676 1 3 . 1 1 43 43 THR C C 111 174.940 174.940 176.819 -1.879 18517 2677 1 3 . 1 1 43 43 THR CA C 111 60.650 60.650 66.062 -5.412 18517 2678 1 3 . 1 1 43 43 THR CB C 111 69.610 69.610 68.567 1.042 18517 2679 1 3 . 1 1 43 43 THR H H 111 6.380 6.380 7.752 -1.372 18517 2680 1 3 . 1 1 44 44 ASP N N 112 119.750 119.750 122.486 -2.736 18517 2681 1 3 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.415 -0.555 18517 2682 1 3 . 1 1 44 44 ASP C C 112 178.850 178.850 178.296 0.554 18517 2683 1 3 . 1 1 44 44 ASP CA C 112 58.230 58.230 58.338 -0.108 18517 2684 1 3 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.558 -1.158 18517 2685 1 3 . 1 1 44 44 ASP H H 112 9.050 9.050 8.451 0.599 18517 2686 1 3 . 1 1 45 45 LEU N N 113 123.910 123.910 121.759 2.151 18517 2687 1 3 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.981 -0.171 18517 2688 1 3 . 1 1 45 45 LEU C C 113 182.040 182.040 178.419 3.621 18517 2689 1 3 . 1 1 45 45 LEU CA C 113 57.320 57.320 57.973 -0.653 18517 2690 1 3 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.834 -1.085 18517 2691 1 3 . 1 1 45 45 LEU H H 113 9.710 9.710 7.911 1.799 18517 2692 1 3 . 1 1 46 46 LEU N N 114 117.640 117.640 118.813 -1.173 18517 2693 1 3 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.072 0.038 18517 2694 1 3 . 1 1 46 46 LEU C C 114 179.540 179.540 178.663 0.877 18517 2695 1 3 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.720 -0.160 18517 2696 1 3 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.861 -0.391 18517 2697 1 3 . 1 1 46 46 LEU H H 114 8.270 8.270 7.817 0.453 18517 2698 1 3 . 1 1 47 47 LEU N N 115 116.520 116.520 115.510 1.010 18517 2699 1 3 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.455 -0.315 18517 2700 1 3 . 1 1 47 47 LEU C C 115 173.850 173.850 176.176 -2.326 18517 2701 1 3 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.142 1.278 18517 2702 1 3 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.082 3.638 18517 2703 1 3 . 1 1 47 47 LEU H H 115 8.160 8.160 8.025 0.135 18517 2704 1 3 . 1 1 48 48 LYS N N 116 114.710 114.710 117.017 -2.307 18517 2705 1 3 . 1 1 48 48 LYS HA H 116 3.810 3.810 3.989 -0.179 18517 2706 1 3 . 1 1 48 48 LYS C C 116 176.510 176.510 175.737 0.773 18517 2707 1 3 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.876 0.324 18517 2708 1 3 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.663 -0.643 18517 2709 1 3 . 1 1 48 48 LYS H H 116 7.580 7.580 7.804 -0.224 18517 2710 1 3 . 1 1 49 49 VAL N N 117 119.050 119.050 119.886 -0.836 18517 2711 1 3 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.139 -0.529 18517 2712 1 3 . 1 1 49 49 VAL C C 117 175.860 175.860 175.587 0.273 18517 2713 1 3 . 1 1 49 49 VAL CA C 117 63.510 63.510 60.717 2.793 18517 2714 1 3 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.600 -0.251 18517 2715 1 3 . 1 1 49 49 VAL H H 117 7.980 7.980 8.197 -0.217 18517 2716 1 3 . 1 1 50 50 ASP N N 118 126.900 126.900 122.492 4.408 18517 2717 1 3 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.507 -0.257 18517 2718 1 3 . 1 1 50 50 ASP C C 118 177.700 177.700 176.945 0.755 18517 2719 1 3 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.381 0.669 18517 2720 1 3 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.272 1.308 18517 2721 1 3 . 1 1 50 50 ASP H H 118 8.930 8.930 8.529 0.401 18517 2722 1 3 . 1 1 51 51 SER N N 119 124.790 124.790 120.443 4.347 18517 2723 1 3 . 1 1 51 51 SER HA H 119 4.070 4.070 4.226 -0.156 18517 2724 1 3 . 1 1 51 51 SER C C 119 177.220 177.220 176.375 0.845 18517 2725 1 3 . 1 1 51 51 SER CA C 119 61.640 61.640 61.712 -0.072 18517 2726 1 3 . 1 1 51 51 SER CB C 119 63.510 63.510 63.260 0.250 18517 2727 1 3 . 1 1 51 51 SER H H 119 8.560 8.560 8.768 -0.208 18517 2728 1 3 . 1 1 52 52 THR N N 120 119.880 119.880 117.898 1.982 18517 2729 1 3 . 1 1 52 52 THR HA H 120 4.190 4.190 4.223 -0.033 18517 2730 1 3 . 1 1 52 52 THR C C 120 177.120 177.120 176.356 0.764 18517 2731 1 3 . 1 1 52 52 THR CA C 120 66.280 66.280 65.561 0.719 18517 2732 1 3 . 1 1 52 52 THR CB C 120 68.420 68.420 68.564 -0.144 18517 2733 1 3 . 1 1 52 52 THR H H 120 8.310 8.310 8.316 -0.006 18517 2734 1 3 . 1 1 53 53 LYS N N 121 122.270 122.270 123.040 -0.770 18517 2735 1 3 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.141 -0.021 18517 2736 1 3 . 1 1 53 53 LYS C C 121 178.970 178.970 178.358 0.612 18517 2737 1 3 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.761 -0.181 18517 2738 1 3 . 1 1 53 53 LYS CB C 121 34.250 34.250 32.330 1.920 18517 2739 1 3 . 1 1 53 53 LYS H H 121 7.700 7.700 7.602 0.098 18517 2740 1 3 . 1 1 54 54 VAL N N 122 120.070 120.070 120.765 -0.695 18517 2741 1 3 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.836 -0.406 18517 2742 1 3 . 1 1 54 54 VAL C C 122 179.860 179.860 177.100 2.760 18517 2743 1 3 . 1 1 54 54 VAL CA C 122 68.580 68.580 66.050 2.530 18517 2744 1 3 . 1 1 54 54 VAL CB C 122 32.820 32.820 32.034 0.786 18517 2745 1 3 . 1 1 54 54 VAL H H 122 7.890 7.890 8.196 -0.306 18517 2746 1 3 . 1 1 55 55 ASP N N 123 122.270 122.270 119.812 2.458 18517 2747 1 3 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.294 0.176 18517 2748 1 3 . 1 1 55 55 ASP C C 123 178.630 178.630 178.438 0.192 18517 2749 1 3 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.881 -0.081 18517 2750 1 3 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.814 1.206 18517 2751 1 3 . 1 1 55 55 ASP H H 123 8.270 8.270 8.018 0.252 18517 2752 1 3 . 1 1 56 56 GLU N N 124 119.600 119.600 119.170 0.430 18517 2753 1 3 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.012 -0.042 18517 2754 1 3 . 1 1 56 56 GLU C C 124 179.920 179.920 178.969 0.951 18517 2755 1 3 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.219 0.841 18517 2756 1 3 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.508 0.462 18517 2757 1 3 . 1 1 56 56 GLU H H 124 8.610 8.610 8.045 0.565 18517 2758 1 3 . 1 1 57 57 ALA N N 125 120.070 120.070 122.400 -2.330 18517 2759 1 3 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.001 -0.171 18517 2760 1 3 . 1 1 57 57 ALA C C 125 178.760 178.760 179.701 -0.941 18517 2761 1 3 . 1 1 57 57 ALA CA C 125 55.380 55.380 55.121 0.259 18517 2762 1 3 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.490 1.650 18517 2763 1 3 . 1 1 57 57 ALA H H 125 8.420 8.420 8.464 -0.044 18517 2764 1 3 . 1 1 58 58 GLY N N 126 106.740 106.740 106.204 0.536 18517 2765 1 3 . 1 1 58 58 GLY C C 126 175.740 175.740 176.005 -0.265 18517 2766 1 3 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.743 0.547 18517 2767 1 3 . 1 1 58 58 GLY H H 126 8.200 8.200 8.698 -0.498 18517 2768 1 3 . 1 1 59 59 LYS N N 127 120.920 120.920 121.794 -0.874 18517 2769 1 3 . 1 1 59 59 LYS HA H 127 3.930 3.930 3.995 -0.065 18517 2770 1 3 . 1 1 59 59 LYS C C 127 180.320 180.320 178.701 1.619 18517 2771 1 3 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.322 0.888 18517 2772 1 3 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.382 0.598 18517 2773 1 3 . 1 1 59 59 LYS H H 127 8.000 8.000 8.104 -0.104 18517 2774 1 3 . 1 1 60 60 LYS N N 128 118.400 118.400 119.528 -1.128 18517 2775 1 3 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.154 0.016 18517 2776 1 3 . 1 1 60 60 LYS C C 128 180.030 180.030 179.178 0.852 18517 2777 1 3 . 1 1 60 60 LYS CA C 128 58.750 58.750 59.188 -0.438 18517 2778 1 3 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.082 0.188 18517 2779 1 3 . 1 1 60 60 LYS H H 128 7.170 7.170 7.834 -0.664 18517 2780 1 3 . 1 1 61 61 VAL N N 129 121.050 121.050 120.398 0.652 18517 2781 1 3 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.253 0.027 18517 2782 1 3 . 1 1 61 61 VAL C C 129 177.120 177.120 177.610 -0.490 18517 2783 1 3 . 1 1 61 61 VAL CA C 129 67.350 67.350 67.021 0.329 18517 2784 1 3 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.279 0.351 18517 2785 1 3 . 1 1 61 61 VAL H H 129 7.980 7.980 8.030 -0.050 18517 2786 1 3 . 1 1 62 62 LYS N N 130 120.040 120.040 120.161 -0.121 18517 2787 1 3 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.926 -0.226 18517 2788 1 3 . 1 1 62 62 LYS C C 130 178.550 178.550 178.595 -0.045 18517 2789 1 3 . 1 1 62 62 LYS CA C 130 60.330 60.330 59.935 0.395 18517 2790 1 3 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.279 1.491 18517 2791 1 3 . 1 1 62 62 LYS H H 130 8.910 8.910 8.487 0.423 18517 2792 1 3 . 1 1 63 63 ALA N N 131 119.570 119.570 123.022 -3.452 18517 2793 1 3 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.055 0.165 18517 2794 1 3 . 1 1 63 63 ALA C C 131 180.520 180.520 179.399 1.121 18517 2795 1 3 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.146 0.074 18517 2796 1 3 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.205 0.265 18517 2797 1 3 . 1 1 63 63 ALA H H 131 7.920 7.920 8.167 -0.247 18517 2798 1 3 . 1 1 64 64 TYR N N 132 120.510 120.510 120.635 -0.125 18517 2799 1 3 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.199 0.261 18517 2800 1 3 . 1 1 64 64 TYR C C 132 176.510 176.510 177.696 -1.186 18517 2801 1 3 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.599 0.042 18517 2802 1 3 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.751 -0.061 18517 2803 1 3 . 1 1 64 64 TYR H H 132 7.930 7.930 8.102 -0.172 18517 2804 1 3 . 1 1 65 65 LEU N N 133 117.290 117.290 120.155 -2.865 18517 2805 1 3 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.678 0.162 18517 2806 1 3 . 1 1 65 65 LEU C C 133 178.610 178.610 178.867 -0.257 18517 2807 1 3 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.525 -0.805 18517 2808 1 3 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.927 -1.497 18517 2809 1 3 . 1 1 65 65 LEU H H 133 8.240 8.240 8.790 -0.550 18517 2810 1 3 . 1 1 66 66 GLU N N 134 119.140 119.140 116.939 2.201 18517 2811 1 3 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.278 -0.418 18517 2812 1 3 . 1 1 66 66 GLU C C 134 180.200 180.200 179.074 1.126 18517 2813 1 3 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.430 1.510 18517 2814 1 3 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.443 0.367 18517 2815 1 3 . 1 1 66 66 GLU H H 134 8.370 8.370 8.435 -0.065 18517 2816 1 3 . 1 1 67 67 LYS N N 135 121.390 121.390 120.832 0.558 18517 2817 1 3 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.088 -0.088 18517 2818 1 3 . 1 1 67 67 LYS C C 135 179.080 179.080 178.472 0.608 18517 2819 1 3 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.707 0.913 18517 2820 1 3 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.361 -0.091 18517 2821 1 3 . 1 1 67 67 LYS H H 135 7.820 7.820 7.655 0.165 18517 2822 1 3 . 1 1 68 68 ILE N N 136 110.310 110.310 111.419 -1.109 18517 2823 1 3 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.008 0.292 18517 2824 1 3 . 1 1 68 68 ILE C C 136 175.520 175.520 176.218 -0.698 18517 2825 1 3 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.920 0.510 18517 2826 1 3 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.537 -0.557 18517 2827 1 3 . 1 1 68 68 ILE H H 136 7.380 7.380 7.691 -0.311 18517 2828 1 3 . 1 1 69 69 GLY N N 137 106.680 106.680 107.594 -0.914 18517 2829 1 3 . 1 1 69 69 GLY C C 137 174.160 174.160 173.855 0.305 18517 2830 1 3 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.412 1.058 18517 2831 1 3 . 1 1 69 69 GLY H H 137 7.470 7.470 7.716 -0.246 18517 2832 1 3 . 1 1 70 70 ILE N N 138 124.310 124.310 121.215 3.095 18517 2833 1 3 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.594 -0.394 18517 2834 1 3 . 1 1 70 70 ILE C C 138 174.190 174.190 175.110 -0.920 18517 2835 1 3 . 1 1 70 70 ILE CA C 138 59.380 59.380 58.954 0.426 18517 2836 1 3 . 1 1 70 70 ILE CB C 138 37.340 37.340 39.027 -1.687 18517 2837 1 3 . 1 1 70 70 ILE H H 138 8.530 8.530 8.115 0.415 18517 2838 1 3 . 1 1 71 71 ARG N N 139 125.490 125.490 126.928 -1.438 18517 2839 1 3 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.650 -0.030 18517 2840 1 3 . 1 1 71 71 ARG C C 139 175.750 175.750 175.163 0.587 18517 2841 1 3 . 1 1 71 71 ARG CA C 139 54.660 54.660 54.443 0.217 18517 2842 1 3 . 1 1 71 71 ARG CB C 139 33.140 33.140 31.690 1.450 18517 2843 1 3 . 1 1 71 71 ARG H H 139 8.240 8.240 8.197 0.043 18517 2844 1 3 . 1 1 72 72 GLY N N 140 104.750 104.750 109.777 -5.027 18517 2845 1 3 . 1 1 72 72 GLY C C 140 172.920 172.920 173.176 -0.256 18517 2846 1 3 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.915 0.515 18517 2847 1 3 . 1 1 72 72 GLY H H 140 7.900 7.900 8.395 -0.495 18517 2848 1 3 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.694 -0.184 18517 2849 1 3 . 1 1 73 73 ASP C C 141 175.060 175.060 176.381 -1.321 18517 2850 1 3 . 1 1 73 73 ASP CA C 141 56.170 56.170 55.349 0.820 18517 2851 1 3 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.444 -0.614 18517 2852 1 3 . 1 1 74 74 SER N N 142 110.240 110.240 113.480 -3.240 18517 2853 1 3 . 1 1 74 74 SER HA H 142 4.740 4.740 4.708 0.032 18517 2854 1 3 . 1 1 74 74 SER C C 142 175.110 175.110 175.660 -0.550 18517 2855 1 3 . 1 1 74 74 SER CA C 142 55.700 55.700 56.804 -1.105 18517 2856 1 3 . 1 1 74 74 SER CB C 142 67.390 67.390 66.260 1.130 18517 2857 1 3 . 1 1 74 74 SER H H 142 7.560 7.560 7.731 -0.171 18517 2858 1 3 . 1 1 75 75 VAL N N 143 122.950 122.950 121.808 1.142 18517 2859 1 3 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.808 -0.078 18517 2860 1 3 . 1 1 75 75 VAL C C 143 176.230 176.230 177.377 -1.147 18517 2861 1 3 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.497 1.143 18517 2862 1 3 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.481 -0.241 18517 2863 1 3 . 1 1 75 75 VAL H H 143 9.470 9.470 8.817 0.653 18517 2864 1 3 . 1 1 76 76 GLU N N 144 121.390 121.390 120.150 1.240 18517 2865 1 3 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.059 -0.419 18517 2866 1 3 . 1 1 76 76 GLU C C 144 176.880 176.880 178.264 -1.384 18517 2867 1 3 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.439 3.871 18517 2868 1 3 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.565 -0.495 18517 2869 1 3 . 1 1 76 76 GLU H H 144 9.640 9.640 8.917 0.723 18517 2870 1 3 . 1 1 77 77 ALA N N 145 118.770 118.770 122.192 -3.422 18517 2871 1 3 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.232 0.028 18517 2872 1 3 . 1 1 77 77 ALA C C 145 180.350 180.350 179.638 0.712 18517 2873 1 3 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.394 0.386 18517 2874 1 3 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.204 0.986 18517 2875 1 3 . 1 1 77 77 ALA H H 145 7.860 7.860 7.493 0.367 18517 2876 1 3 . 1 1 78 78 ALA N N 146 120.920 120.920 122.861 -1.941 18517 2877 1 3 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.021 0.119 18517 2878 1 3 . 1 1 78 78 ALA C C 146 179.150 179.150 179.368 -0.218 18517 2879 1 3 . 1 1 78 78 ALA CA C 146 55.260 55.260 54.953 0.307 18517 2880 1 3 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.555 0.235 18517 2881 1 3 . 1 1 78 78 ALA H H 146 8.110 8.110 8.415 -0.305 18517 2882 1 3 . 1 1 79 79 LEU N N 147 118.810 118.810 119.016 -0.206 18517 2883 1 3 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.025 -0.145 18517 2884 1 3 . 1 1 79 79 LEU C C 147 179.080 179.080 178.893 0.187 18517 2885 1 3 . 1 1 79 79 LEU CA C 147 58.390 58.390 58.115 0.275 18517 2886 1 3 . 1 1 79 79 LEU CB C 147 42.260 42.260 41.349 0.911 18517 2887 1 3 . 1 1 79 79 LEU H H 147 8.360 8.360 8.481 -0.121 18517 2888 1 3 . 1 1 80 80 ASP N N 148 121.620 121.620 119.669 1.951 18517 2889 1 3 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.255 0.265 18517 2890 1 3 . 1 1 80 80 ASP C C 148 178.800 178.800 178.042 0.758 18517 2891 1 3 . 1 1 80 80 ASP CA C 148 58.390 58.390 57.982 0.408 18517 2892 1 3 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.936 -0.186 18517 2893 1 3 . 1 1 80 80 ASP H H 148 8.770 8.770 8.318 0.452 18517 2894 1 3 . 1 1 81 81 ASN N N 149 118.630 118.630 118.466 0.164 18517 2895 1 3 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.513 0.057 18517 2896 1 3 . 1 1 81 81 ASN C C 149 177.970 177.970 177.880 0.090 18517 2897 1 3 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.056 -0.046 18517 2898 1 3 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.519 0.091 18517 2899 1 3 . 1 1 81 81 ASN H H 149 7.960 7.960 7.991 -0.031 18517 2900 1 3 . 1 1 82 82 LEU N N 150 120.030 120.030 120.622 -0.592 18517 2901 1 3 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.892 0.168 18517 2902 1 3 . 1 1 82 82 LEU C C 150 177.790 177.790 179.130 -1.340 18517 2903 1 3 . 1 1 82 82 LEU CA C 150 58.870 58.870 57.912 0.958 18517 2904 1 3 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.780 0.080 18517 2905 1 3 . 1 1 82 82 LEU H H 150 8.230 8.230 8.326 -0.096 18517 2906 1 3 . 1 1 83 83 MET N N 151 115.820 115.820 119.228 -3.408 18517 2907 1 3 . 1 1 83 83 MET HA H 151 4.390 4.390 4.163 0.227 18517 2908 1 3 . 1 1 83 83 MET C C 151 179.760 179.760 178.449 1.311 18517 2909 1 3 . 1 1 83 83 MET CA C 151 57.400 57.400 58.518 -1.118 18517 2910 1 3 . 1 1 83 83 MET CB C 151 31.080 31.080 32.250 -1.170 18517 2911 1 3 . 1 1 83 83 MET H H 151 8.800 8.800 8.407 0.393 18517 2912 1 3 . 1 1 84 84 ILE N N 152 120.330 120.330 119.759 0.571 18517 2913 1 3 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.616 0.224 18517 2914 1 3 . 1 1 84 84 ILE C C 152 178.660 178.660 178.087 0.573 18517 2915 1 3 . 1 1 84 84 ILE CA C 152 65.800 65.800 65.579 0.221 18517 2916 1 3 . 1 1 84 84 ILE CB C 152 38.450 38.450 37.342 1.108 18517 2917 1 3 . 1 1 84 84 ILE H H 152 8.540 8.540 8.352 0.188 18517 2918 1 3 . 1 1 85 85 LYS N N 153 118.930 118.930 119.529 -0.599 18517 2919 1 3 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.029 0.171 18517 2920 1 3 . 1 1 85 85 LYS C C 153 179.650 179.650 179.409 0.241 18517 2921 1 3 . 1 1 85 85 LYS CA C 153 59.980 59.980 59.006 0.974 18517 2922 1 3 . 1 1 85 85 LYS CB C 153 33.540 33.540 32.074 1.466 18517 2923 1 3 . 1 1 85 85 LYS H H 153 7.510 7.510 7.998 -0.488 18517 2924 1 3 . 1 1 86 86 VAL N N 154 119.810 119.810 119.971 -0.161 18517 2925 1 3 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.574 0.056 18517 2926 1 3 . 1 1 86 86 VAL C C 154 178.350 178.350 177.917 0.433 18517 2927 1 3 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.883 0.347 18517 2928 1 3 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.765 0.975 18517 2929 1 3 . 1 1 86 86 VAL H H 154 8.740 8.740 8.293 0.447 18517 2930 1 3 . 1 1 87 87 TYR N N 155 118.370 118.370 117.763 0.607 18517 2931 1 3 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.182 0.088 18517 2932 1 3 . 1 1 87 87 TYR C C 155 178.580 178.580 178.431 0.149 18517 2933 1 3 . 1 1 87 87 TYR CA C 155 62.910 62.910 61.112 1.798 18517 2934 1 3 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.444 0.536 18517 2935 1 3 . 1 1 87 87 TYR H H 155 8.520 8.520 8.290 0.230 18517 2936 1 3 . 1 1 88 88 GLU N N 156 119.900 119.900 121.344 -1.444 18517 2937 1 3 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.191 -0.011 18517 2938 1 3 . 1 1 88 88 GLU C C 156 179.270 179.270 178.458 0.812 18517 2939 1 3 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.776 -0.396 18517 2940 1 3 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.567 0.643 18517 2941 1 3 . 1 1 88 88 GLU H H 156 8.250 8.250 8.453 -0.203 18517 2942 1 3 . 1 1 89 89 ILE N N 157 119.510 119.510 117.836 1.674 18517 2943 1 3 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.894 0.186 18517 2944 1 3 . 1 1 89 89 ILE C C 157 177.890 177.890 178.502 -0.612 18517 2945 1 3 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.888 -0.578 18517 2946 1 3 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.316 0.893 18517 2947 1 3 . 1 1 89 89 ILE H H 157 7.630 7.630 7.772 -0.142 18517 2948 1 3 . 1 1 90 90 THR N N 158 114.240 114.240 114.718 -0.478 18517 2949 1 3 . 1 1 90 90 THR HA H 158 4.130 4.130 4.063 0.067 18517 2950 1 3 . 1 1 90 90 THR C C 158 175.530 175.530 175.667 -0.137 18517 2951 1 3 . 1 1 90 90 THR CA C 158 64.460 64.460 65.771 -1.311 18517 2952 1 3 . 1 1 90 90 THR CB C 158 69.610 69.610 69.019 0.591 18517 2953 1 3 . 1 1 90 90 THR H H 158 7.770 7.770 8.325 -0.555 18517 2954 1 3 . 1 1 91 91 LYS N N 159 120.280 120.280 119.167 1.113 18517 2955 1 3 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.505 -0.195 18517 2956 1 3 . 1 1 91 91 LYS C C 159 177.420 177.420 176.795 0.625 18517 2957 1 3 . 1 1 91 91 LYS CA C 159 57.400 57.400 55.602 1.798 18517 2958 1 3 . 1 1 91 91 LYS CB C 159 33.220 33.220 34.016 -0.796 18517 2959 1 3 . 1 1 91 91 LYS H H 159 7.890 7.890 8.008 -0.118 18517 2960 1 3 . 1 1 92 92 GLY N N 160 107.910 107.910 109.691 -1.781 18517 2961 1 3 . 1 1 92 92 GLY C C 160 174.430 174.430 174.827 -0.397 18517 2962 1 3 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.419 0.561 18517 2963 1 3 . 1 1 92 92 GLY H H 160 7.930 7.930 7.848 0.082 18517 2964 1 3 . 1 1 93 93 THR N N 161 113.570 113.570 118.767 -5.197 18517 2965 1 3 . 1 1 93 93 THR HA H 161 4.390 4.390 4.496 -0.106 18517 2966 1 3 . 1 1 93 93 THR C C 161 174.790 174.790 173.955 0.835 18517 2967 1 3 . 1 1 93 93 THR CA C 161 61.960 61.960 62.689 -0.729 18517 2968 1 3 . 1 1 93 93 THR CB C 161 70.010 70.010 69.064 0.947 18517 2969 1 3 . 1 1 93 93 THR H H 161 7.970 7.970 7.767 0.203 18517 2970 1 3 . 1 1 94 94 VAL N N 162 121.980 121.980 121.835 0.145 18517 2971 1 3 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.580 -0.460 18517 2972 1 3 . 1 1 94 94 VAL C C 162 176.300 176.300 174.986 1.314 18517 2973 1 3 . 1 1 94 94 VAL CA C 162 62.830 62.830 61.060 1.770 18517 2974 1 3 . 1 1 94 94 VAL CB C 162 33.060 33.060 32.621 0.439 18517 2975 1 3 . 1 1 94 94 VAL H H 162 8.130 8.130 8.196 -0.066 18517 2976 1 3 . 1 1 95 95 GLU N N 163 124.140 124.140 126.443 -2.303 18517 2977 1 3 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.433 -0.123 18517 2978 1 3 . 1 1 95 95 GLU C C 163 176.870 176.870 175.557 1.313 18517 2979 1 3 . 1 1 95 95 GLU CA C 163 57.080 57.080 56.716 0.364 18517 2980 1 3 . 1 1 95 95 GLU CB C 163 30.440 30.440 30.705 -0.265 18517 2981 1 3 . 1 1 95 95 GLU H H 163 8.490 8.490 9.058 -0.568 18517 2982 1 3 . 1 1 96 96 SER N N 164 116.800 116.800 114.162 2.638 18517 2983 1 3 . 1 1 96 96 SER HA H 164 4.430 4.430 4.729 -0.299 18517 2984 1 3 . 1 1 96 96 SER C C 164 174.940 174.940 174.342 0.598 18517 2985 1 3 . 1 1 96 96 SER CA C 164 59.070 59.070 57.795 1.275 18517 2986 1 3 . 1 1 96 96 SER CB C 164 64.220 64.220 64.659 -0.439 18517 2987 1 3 . 1 1 96 96 SER H H 164 8.300 8.300 7.722 0.578 18517 2988 1 3 . 1 1 97 97 SER C C 165 174.660 174.660 175.587 -0.927 18517 2989 1 3 . 1 1 97 97 SER CA C 165 58.870 58.870 59.031 -0.161 18517 2990 1 3 . 1 1 97 97 SER CB C 165 64.060 64.060 63.612 0.448 18517 2991 1 3 . 1 1 98 98 ALA N N 166 125.490 125.490 124.547 0.943 18517 2992 1 3 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.027 0.323 18517 2993 1 3 . 1 1 98 98 ALA C C 166 177.780 177.780 176.707 1.073 18517 2994 1 3 . 1 1 98 98 ALA CA C 166 53.000 53.000 54.016 -1.016 18517 2995 1 3 . 1 1 98 98 ALA CB C 166 19.340 19.340 17.614 1.726 18517 2996 1 3 . 1 1 98 98 ALA H H 166 8.180 8.180 8.258 -0.078 18517 2997 1 3 . 1 1 99 99 GLN N N 167 118.690 118.690 119.649 -0.959 18517 2998 1 3 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.493 -0.153 18517 2999 1 3 . 1 1 99 99 GLN C C 167 176.680 176.680 176.112 0.568 18517 3000 1 3 . 1 1 99 99 GLN CA C 167 56.250 56.250 55.157 1.093 18517 3001 1 3 . 1 1 99 99 GLN CB C 167 29.650 29.650 30.643 -0.993 18517 3002 1 3 . 1 1 99 99 GLN H H 167 8.170 8.170 7.955 0.215 18517 3003 1 3 . 1 1 100 100 GLY N N 168 109.670 109.670 113.212 -3.542 18517 3004 1 3 . 1 1 100 100 GLY C C 168 174.460 174.460 174.458 0.002 18517 3005 1 3 . 1 1 100 100 GLY CA C 168 45.670 45.670 46.407 -0.737 18517 3006 1 3 . 1 1 100 100 GLY H H 168 8.250 8.250 8.500 -0.250 18517 3007 1 3 . 1 1 101 101 THR N N 169 112.660 112.660 115.895 -3.235 18517 3008 1 3 . 1 1 101 101 THR HA H 169 4.360 4.360 4.350 0.010 18517 3009 1 3 . 1 1 101 101 THR C C 169 174.720 174.720 173.288 1.432 18517 3010 1 3 . 1 1 101 101 THR CA C 169 62.080 62.080 60.925 1.155 18517 3011 1 3 . 1 1 101 101 THR CB C 169 69.930 69.930 67.827 2.103 18517 3012 1 3 . 1 1 101 101 THR H H 169 8.070 8.070 7.818 0.252 18517 3013 1 3 . 1 1 102 102 ASP N N 170 123.090 123.090 124.019 -0.929 18517 3014 1 3 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.713 -0.013 18517 3015 1 3 . 1 1 102 102 ASP C C 170 176.130 176.130 175.734 0.396 18517 3016 1 3 . 1 1 102 102 ASP CA C 170 54.780 54.780 53.299 1.481 18517 3017 1 3 . 1 1 102 102 ASP CB C 170 42.260 42.260 42.285 -0.025 18517 3018 1 3 . 1 1 102 102 ASP H H 170 8.170 8.170 7.965 0.205 18517 3019 1 3 . 1 1 103 103 SER N N 171 117.110 117.110 116.927 0.183 18517 3020 1 3 . 1 1 103 103 SER HA H 171 4.430 4.430 4.519 -0.089 18517 3021 1 3 . 1 1 103 103 SER C C 171 174.770 174.770 175.759 -0.989 18517 3022 1 3 . 1 1 103 103 SER CA C 171 57.960 57.960 57.040 0.920 18517 3023 1 3 . 1 1 103 103 SER CB C 171 64.940 64.940 64.639 0.301 18517 3024 1 3 . 1 1 103 103 SER H H 171 8.450 8.450 8.451 -0.001 18517 3025 1 3 . 1 1 104 104 GLU N N 172 122.970 122.970 121.916 1.054 18517 3026 1 3 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.944 0.086 18517 3027 1 3 . 1 1 104 104 GLU C C 172 178.860 178.860 178.336 0.524 18517 3028 1 3 . 1 1 104 104 GLU CA C 172 59.700 59.700 59.526 0.174 18517 3029 1 3 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.143 0.506 18517 3030 1 3 . 1 1 104 104 GLU H H 172 8.830 8.830 8.981 -0.151 18517 3031 1 3 . 1 1 105 105 GLU N N 173 119.750 119.750 119.182 0.568 18517 3032 1 3 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.030 -0.050 18517 3033 1 3 . 1 1 105 105 GLU C C 173 178.920 178.920 178.700 0.220 18517 3034 1 3 . 1 1 105 105 GLU CA C 173 60.060 60.060 58.970 1.090 18517 3035 1 3 . 1 1 105 105 GLU CB C 173 29.730 29.730 29.080 0.650 18517 3036 1 3 . 1 1 105 105 GLU H H 173 8.580 8.580 8.713 -0.133 18517 3037 1 3 . 1 1 106 106 LEU N N 174 121.860 121.860 120.856 1.004 18517 3038 1 3 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.034 0.146 18517 3039 1 3 . 1 1 106 106 LEU C C 174 178.210 178.210 178.039 0.171 18517 3040 1 3 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.711 0.169 18517 3041 1 3 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.938 -0.788 18517 3042 1 3 . 1 1 106 106 LEU H H 174 7.920 7.920 7.838 0.082 18517 3043 1 3 . 1 1 107 107 LYS N N 175 118.740 118.740 119.011 -0.271 18517 3044 1 3 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.887 -0.107 18517 3045 1 3 . 1 1 107 107 LYS C C 175 178.700 178.700 178.977 -0.277 18517 3046 1 3 . 1 1 107 107 LYS CA C 175 61.170 61.170 60.388 0.782 18517 3047 1 3 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.208 0.222 18517 3048 1 3 . 1 1 107 107 LYS H H 175 8.340 8.340 8.172 0.168 18517 3049 1 3 . 1 1 108 108 THR N N 176 113.820 113.820 117.271 -3.451 18517 3050 1 3 . 1 1 108 108 THR HA H 176 3.840 3.840 4.039 -0.199 18517 3051 1 3 . 1 1 108 108 THR C C 176 176.620 176.620 176.414 0.206 18517 3052 1 3 . 1 1 108 108 THR CA C 176 66.910 66.910 67.043 -0.133 18517 3053 1 3 . 1 1 108 108 THR CB C 176 69.610 69.610 68.552 1.058 18517 3054 1 3 . 1 1 108 108 THR H H 176 7.950 7.950 8.418 -0.468 18517 3055 1 3 . 1 1 109 109 LEU N N 177 124.380 124.380 121.955 2.425 18517 3056 1 3 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.133 -0.303 18517 3057 1 3 . 1 1 109 109 LEU C C 177 177.790 177.790 178.586 -0.796 18517 3058 1 3 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.730 0.260 18517 3059 1 3 . 1 1 109 109 LEU CB C 177 42.580 42.580 40.802 1.778 18517 3060 1 3 . 1 1 109 109 LEU H H 177 7.480 7.480 7.940 -0.460 18517 3061 1 3 . 1 1 110 110 LEU N N 178 117.230 117.230 119.810 -2.580 18517 3062 1 3 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.882 -0.042 18517 3063 1 3 . 1 1 110 110 LEU C C 178 179.540 179.540 179.627 -0.087 18517 3064 1 3 . 1 1 110 110 LEU CA C 178 58.390 58.390 58.208 0.182 18517 3065 1 3 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.431 0.909 18517 3066 1 3 . 1 1 110 110 LEU H H 178 8.670 8.670 8.507 0.163 18517 3067 1 3 . 1 1 111 111 LEU N N 179 119.230 119.230 120.786 -1.556 18517 3068 1 3 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.216 -0.136 18517 3069 1 3 . 1 1 111 111 LEU C C 179 179.310 179.310 179.507 -0.197 18517 3070 1 3 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.422 0.967 18517 3071 1 3 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.746 1.274 18517 3072 1 3 . 1 1 111 111 LEU H H 179 7.940 7.940 8.481 -0.541 18517 3073 1 3 . 1 1 112 112 LYS N N 180 121.910 121.910 120.682 1.228 18517 3074 1 3 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.021 0.169 18517 3075 1 3 . 1 1 112 112 LYS C C 180 178.740 178.740 178.802 -0.062 18517 3076 1 3 . 1 1 112 112 LYS CA C 180 59.180 59.180 60.051 -0.871 18517 3077 1 3 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.559 -0.689 18517 3078 1 3 . 1 1 112 112 LYS H H 180 7.420 7.420 8.338 -0.918 18517 3079 1 3 . 1 1 113 113 PHE N N 181 118.220 118.220 118.656 -0.436 18517 3080 1 3 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.222 0.528 18517 3081 1 3 . 1 1 113 113 PHE C C 181 178.520 178.520 178.146 0.374 18517 3082 1 3 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.232 -3.152 18517 3083 1 3 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.371 -0.391 18517 3084 1 3 . 1 1 113 113 PHE H H 181 9.000 9.000 8.934 0.066 18517 3085 1 3 . 1 1 114 114 SER N N 182 113.300 113.300 114.732 -1.432 18517 3086 1 3 . 1 1 114 114 SER HA H 182 3.930 3.930 4.130 -0.200 18517 3087 1 3 . 1 1 114 114 SER C C 182 177.080 177.080 177.198 -0.118 18517 3088 1 3 . 1 1 114 114 SER CA C 182 62.000 62.000 62.279 -0.279 18517 3089 1 3 . 1 1 114 114 SER CB C 182 63.510 63.510 62.724 0.786 18517 3090 1 3 . 1 1 114 114 SER H H 182 8.620 8.620 8.664 -0.044 18517 3091 1 3 . 1 1 115 115 GLU N N 183 121.540 121.540 122.103 -0.563 18517 3092 1 3 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.128 -0.058 18517 3093 1 3 . 1 1 115 115 GLU C C 183 179.860 179.860 178.939 0.921 18517 3094 1 3 . 1 1 115 115 GLU CA C 183 59.780 59.780 58.339 1.441 18517 3095 1 3 . 1 1 115 115 GLU CB C 183 29.890 29.890 28.997 0.893 18517 3096 1 3 . 1 1 115 115 GLU H H 183 8.250 8.250 8.093 0.157 18517 3097 1 3 . 1 1 116 116 ASP N N 184 121.740 121.740 121.759 -0.019 18517 3098 1 3 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.379 0.131 18517 3099 1 3 . 1 1 116 116 ASP C C 184 179.570 179.570 178.241 1.329 18517 3100 1 3 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.919 -0.358 18517 3101 1 3 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.947 0.043 18517 3102 1 3 . 1 1 116 116 ASP H H 184 8.840 8.840 8.658 0.182 18517 3103 1 3 . 1 1 117 117 LEU N N 185 121.420 121.420 120.972 0.448 18517 3104 1 3 . 1 1 117 117 LEU HA H 185 4.130 4.130 3.920 0.210 18517 3105 1 3 . 1 1 117 117 LEU C C 185 178.840 178.840 178.200 0.640 18517 3106 1 3 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.072 0.158 18517 3107 1 3 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.998 0.652 18517 3108 1 3 . 1 1 117 117 LEU H H 185 8.350 8.350 8.243 0.107 18517 3109 1 3 . 1 1 118 118 LYS N N 186 119.640 119.640 118.895 0.745 18517 3110 1 3 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.842 0.278 18517 3111 1 3 . 1 1 118 118 LYS C C 186 178.820 178.820 179.014 -0.194 18517 3112 1 3 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.854 -0.114 18517 3113 1 3 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.401 0.108 18517 3114 1 3 . 1 1 118 118 LYS H H 186 8.220 8.220 8.081 0.139 18517 3115 1 3 . 1 1 119 119 ALA N N 187 120.160 120.160 120.344 -0.184 18517 3116 1 3 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.032 0.128 18517 3117 1 3 . 1 1 119 119 ALA C C 187 180.450 180.450 179.352 1.098 18517 3118 1 3 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.288 -0.148 18517 3119 1 3 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.443 0.027 18517 3120 1 3 . 1 1 119 119 ALA H H 187 8.010 8.010 8.100 -0.090 18517 3121 1 3 . 1 1 120 120 GLU N N 188 117.930 117.930 118.841 -0.911 18517 3122 1 3 . 1 1 120 120 GLU HA H 188 4.180 4.180 4.077 0.102 18517 3123 1 3 . 1 1 120 120 GLU C C 188 178.780 178.780 178.861 -0.081 18517 3124 1 3 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.022 -0.192 18517 3125 1 3 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.661 0.309 18517 3126 1 3 . 1 1 120 120 GLU H H 188 7.640 7.640 8.168 -0.528 18517 3127 1 3 . 1 1 121 121 GLN N N 189 117.230 117.230 119.613 -2.383 18517 3128 1 3 . 1 1 121 121 GLN HA H 189 4.230 4.230 4.292 -0.062 18517 3129 1 3 . 1 1 121 121 GLN C C 189 179.190 179.190 177.999 1.191 18517 3130 1 3 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.097 1.643 18517 3131 1 3 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.858 0.792 18517 3132 1 3 . 1 1 121 121 GLN H H 189 8.280 8.280 8.357 -0.077 18517 3133 1 3 . 1 1 122 122 GLU N N 190 118.340 118.340 121.068 -2.728 18517 3134 1 3 . 1 1 122 122 GLU HA H 190 4.120 4.120 4.075 0.045 18517 3135 1 3 . 1 1 122 122 GLU C C 190 178.210 178.210 178.799 -0.589 18517 3136 1 3 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.213 0.537 18517 3137 1 3 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.251 0.719 18517 3138 1 3 . 1 1 122 122 GLU H H 190 8.250 8.250 8.375 -0.125 18517 3139 1 3 . 1 1 123 123 LEU N N 191 118.930 118.930 122.292 -3.362 18517 3140 1 3 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.928 0.162 18517 3141 1 3 . 1 1 123 123 LEU C C 191 178.500 178.500 178.336 0.164 18517 3142 1 3 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.007 -1.007 18517 3143 1 3 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.747 0.753 18517 3144 1 3 . 1 1 123 123 LEU H H 191 7.530 7.530 8.061 -0.531 18517 3145 1 3 . 1 1 124 124 HIS N N 192 115.650 115.650 117.688 -2.038 18517 3146 1 3 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.202 0.518 18517 3147 1 3 . 1 1 124 124 HIS C C 192 176.090 176.090 177.013 -0.923 18517 3148 1 3 . 1 1 124 124 HIS CA C 192 56.690 56.690 59.850 -3.160 18517 3149 1 3 . 1 1 124 124 HIS CB C 192 30.760 30.760 30.426 0.334 18517 3150 1 3 . 1 1 124 124 HIS H H 192 7.450 7.450 8.270 -0.820 18517 3151 1 3 . 1 1 125 125 SER N N 193 115.480 115.480 115.801 -0.321 18517 3152 1 3 . 1 1 125 125 SER HA H 193 4.310 4.310 3.536 0.774 18517 3153 1 3 . 1 1 125 125 SER CA C 193 60.180 60.180 60.906 -0.726 18517 3154 1 3 . 1 1 125 125 SER CB C 193 64.060 64.060 62.256 1.804 18517 3155 1 3 . 1 1 125 125 SER H H 193 8.020 8.020 8.278 -0.258 18517 3156 1 3 . 1 1 126 126 GLU C C 194 177.410 177.410 179.031 -1.621 18517 3157 1 3 . 1 1 126 126 GLU CA C 194 57.840 57.840 58.514 -0.674 18517 3158 1 3 . 1 1 126 126 GLU CB C 194 29.890 29.890 28.799 1.091 18517 3159 1 3 . 1 1 127 127 ALA N N 195 122.910 122.910 123.466 -0.556 18517 3160 1 3 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.121 0.069 18517 3161 1 3 . 1 1 127 127 ALA C C 195 178.610 178.610 179.264 -0.654 18517 3162 1 3 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.717 -0.926 18517 3163 1 3 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.630 0.630 18517 3164 1 3 . 1 1 127 127 ALA H H 195 8.020 8.020 7.602 0.418 18517 3165 1 3 . 1 1 128 128 LYS N N 196 117.770 117.770 116.495 1.275 18517 3166 1 3 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.373 -0.113 18517 3167 1 3 . 1 1 128 128 LYS C C 196 177.400 177.400 175.956 1.444 18517 3168 1 3 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.363 2.637 18517 3169 1 3 . 1 1 128 128 LYS CB C 196 32.740 32.740 32.191 0.549 18517 3170 1 3 . 1 1 128 128 LYS H H 196 7.990 7.990 7.752 0.238 18517 3171 1 3 . 1 1 129 129 GLY N N 197 109.010 109.010 108.124 0.886 18517 3172 1 3 . 1 1 129 129 GLY C C 197 175.770 175.770 175.514 0.256 18517 3173 1 3 . 1 1 129 129 GLY CA C 197 46.100 46.100 44.978 1.122 18517 3174 1 3 . 1 1 129 129 GLY H H 197 8.220 8.220 7.520 0.700 18517 3175 1 3 . 1 1 130 130 GLY N N 198 109.150 109.150 110.073 -0.923 18517 3176 1 3 . 1 1 130 130 GLY C C 198 174.760 174.760 175.404 -0.644 18517 3177 1 3 . 1 1 130 130 GLY CA C 198 46.930 46.930 46.775 0.155 18517 3178 1 3 . 1 1 130 130 GLY H H 198 8.210 8.210 8.252 -0.042 18517 3179 1 3 . 1 1 131 131 GLU N N 199 121.560 121.560 121.772 -0.212 18517 3180 1 3 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.059 -0.039 18517 3181 1 3 . 1 1 131 131 GLU C C 199 178.500 178.500 178.857 -0.357 18517 3182 1 3 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.405 0.495 18517 3183 1 3 . 1 1 131 131 GLU CB C 199 29.570 29.570 29.338 0.232 18517 3184 1 3 . 1 1 131 131 GLU H H 199 8.510 8.510 8.794 -0.284 18517 3185 1 3 . 1 1 132 132 ALA N N 200 122.390 122.390 123.004 -0.614 18517 3186 1 3 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.144 0.056 18517 3187 1 3 . 1 1 132 132 ALA C C 200 180.360 180.360 179.644 0.716 18517 3188 1 3 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.811 -0.031 18517 3189 1 3 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.013 0.377 18517 3190 1 3 . 1 1 132 132 ALA H H 200 8.190 8.190 7.574 0.616 18517 3191 1 3 . 1 1 133 133 LEU N N 201 120.800 120.800 120.555 0.245 18517 3192 1 3 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.224 -0.014 18517 3193 1 3 . 1 1 133 133 LEU C C 201 179.270 179.270 178.965 0.305 18517 3194 1 3 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.407 0.273 18517 3195 1 3 . 1 1 133 133 LEU CB C 201 42.180 42.180 42.327 -0.147 18517 3196 1 3 . 1 1 133 133 LEU H H 201 7.720 7.720 8.432 -0.712 18517 3197 1 3 . 1 1 134 134 LEU N N 202 120.680 120.680 120.483 0.197 18517 3198 1 3 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.908 0.072 18517 3199 1 3 . 1 1 134 134 LEU C C 202 179.030 179.030 178.260 0.770 18517 3200 1 3 . 1 1 134 134 LEU CA C 202 58.430 58.430 58.082 0.348 18517 3201 1 3 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.505 0.115 18517 3202 1 3 . 1 1 134 134 LEU H H 202 8.470 8.470 8.427 0.043 18517 3203 1 3 . 1 1 135 135 SER N N 203 113.290 113.290 115.225 -1.935 18517 3204 1 3 . 1 1 135 135 SER HA H 203 4.180 4.180 4.068 0.112 18517 3205 1 3 . 1 1 135 135 SER C C 203 177.300 177.300 176.842 0.458 18517 3206 1 3 . 1 1 135 135 SER CA C 203 62.080 62.080 62.888 -0.808 18517 3207 1 3 . 1 1 135 135 SER CB C 203 63.030 63.030 62.850 0.180 18517 3208 1 3 . 1 1 135 135 SER H H 203 8.210 8.210 8.513 -0.303 18517 3209 1 3 . 1 1 136 136 SER N N 204 117.500 117.500 118.495 -0.995 18517 3210 1 3 . 1 1 136 136 SER HA H 204 4.050 4.050 4.118 -0.068 18517 3211 1 3 . 1 1 136 136 SER C C 204 177.570 177.570 176.504 1.066 18517 3212 1 3 . 1 1 136 136 SER CA C 204 61.880 61.880 61.443 0.438 18517 3213 1 3 . 1 1 136 136 SER CB C 204 63.510 63.510 63.002 0.508 18517 3214 1 3 . 1 1 136 136 SER H H 204 7.730 7.730 8.220 -0.490 18517 3215 1 3 . 1 1 137 137 MET N N 205 122.500 122.500 123.670 -1.170 18517 3216 1 3 . 1 1 137 137 MET HA H 205 4.140 4.140 4.125 0.015 18517 3217 1 3 . 1 1 137 137 MET C C 205 177.680 177.680 177.994 -0.314 18517 3218 1 3 . 1 1 137 137 MET CA C 205 60.140 60.140 58.937 1.203 18517 3219 1 3 . 1 1 137 137 MET CB C 205 33.460 33.460 32.739 0.721 18517 3220 1 3 . 1 1 137 137 MET H H 205 8.170 8.170 8.434 -0.264 18517 3221 1 3 . 1 1 138 138 LYS N N 206 121.410 121.410 118.191 3.219 18517 3222 1 3 . 1 1 138 138 LYS HA H 206 3.750 3.750 4.020 -0.270 18517 3223 1 3 . 1 1 138 138 LYS C C 206 178.780 178.780 179.525 -0.745 18517 3224 1 3 . 1 1 138 138 LYS CA C 206 60.330 60.330 59.279 1.051 18517 3225 1 3 . 1 1 138 138 LYS CB C 206 32.270 32.270 31.818 0.452 18517 3226 1 3 . 1 1 138 138 LYS H H 206 8.810 8.810 8.506 0.304 18517 3227 1 3 . 1 1 139 139 THR N N 207 116.580 116.580 117.489 -0.909 18517 3228 1 3 . 1 1 139 139 THR HA H 207 4.060 4.060 3.984 0.076 18517 3229 1 3 . 1 1 139 139 THR C C 207 176.730 176.730 176.956 -0.226 18517 3230 1 3 . 1 1 139 139 THR CA C 207 67.150 67.150 66.895 0.255 18517 3231 1 3 . 1 1 139 139 THR CB C 207 69.220 69.220 68.658 0.562 18517 3232 1 3 . 1 1 139 139 THR H H 207 7.930 7.930 8.215 -0.285 18517 3233 1 3 . 1 1 140 140 GLN N N 208 121.390 121.390 119.833 1.557 18517 3234 1 3 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.000 0.060 18517 3235 1 3 . 1 1 140 140 GLN C C 208 178.550 178.550 178.023 0.527 18517 3236 1 3 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.383 -0.083 18517 3237 1 3 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.781 0.079 18517 3238 1 3 . 1 1 140 140 GLN H H 208 7.600 7.600 8.198 -0.598 18517 3239 1 3 . 1 1 141 141 HIS N N 209 122.360 122.360 119.656 2.704 18517 3240 1 3 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.343 -0.513 18517 3241 1 3 . 1 1 141 141 HIS C C 209 176.390 176.390 177.189 -0.799 18517 3242 1 3 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.133 1.587 18517 3243 1 3 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.301 -1.201 18517 3244 1 3 . 1 1 141 141 HIS H H 209 8.980 8.980 8.384 0.596 18517 3245 1 3 . 1 1 142 142 ASP N N 210 120.740 120.740 120.665 0.075 18517 3246 1 3 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.360 -0.010 18517 3247 1 3 . 1 1 142 142 ASP C C 210 179.490 179.490 178.254 1.236 18517 3248 1 3 . 1 1 142 142 ASP CA C 210 57.920 57.920 58.037 -0.117 18517 3249 1 3 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.797 -0.207 18517 3250 1 3 . 1 1 142 142 ASP H H 210 8.770 8.770 8.508 0.262 18517 3251 1 3 . 1 1 143 143 GLU N N 211 119.010 119.010 120.488 -1.478 18517 3252 1 3 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.055 -0.085 18517 3253 1 3 . 1 1 143 143 GLU C C 211 179.070 179.070 178.922 0.148 18517 3254 1 3 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.071 0.229 18517 3255 1 3 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.378 0.112 18517 3256 1 3 . 1 1 143 143 GLU H H 211 7.850 7.850 8.095 -0.245 18517 3257 1 3 . 1 1 144 144 LEU N N 212 122.500 122.500 120.119 2.381 18517 3258 1 3 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.040 0.030 18517 3259 1 3 . 1 1 144 144 LEU C C 212 179.340 179.340 179.395 -0.055 18517 3260 1 3 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.211 0.179 18517 3261 1 3 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.945 0.235 18517 3262 1 3 . 1 1 144 144 LEU H H 212 8.070 8.070 8.019 0.051 18517 3263 1 3 . 1 1 145 145 LEU N N 213 118.110 118.110 118.129 -0.019 18517 3264 1 3 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.804 0.396 18517 3265 1 3 . 1 1 145 145 LEU C C 213 179.610 179.610 179.070 0.540 18517 3266 1 3 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.789 0.961 18517 3267 1 3 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.223 0.007 18517 3268 1 3 . 1 1 145 145 LEU H H 213 8.370 8.370 8.404 -0.034 18517 3269 1 3 . 1 1 146 146 LYS N N 214 117.290 117.290 120.518 -3.228 18517 3270 1 3 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.918 -0.088 18517 3271 1 3 . 1 1 146 146 LYS C C 214 179.900 179.900 178.937 0.963 18517 3272 1 3 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.942 0.388 18517 3273 1 3 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.264 0.086 18517 3274 1 3 . 1 1 146 146 LYS H H 214 7.560 7.560 8.391 -0.831 18517 3275 1 3 . 1 1 147 147 LYS N N 215 120.330 120.330 118.951 1.379 18517 3276 1 3 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.055 -0.035 18517 3277 1 3 . 1 1 147 147 LYS C C 215 180.550 180.550 179.460 1.090 18517 3278 1 3 . 1 1 147 147 LYS CA C 215 60.100 60.100 58.748 1.351 18517 3279 1 3 . 1 1 147 147 LYS CB C 215 32.740 32.740 31.898 0.843 18517 3280 1 3 . 1 1 147 147 LYS H H 215 7.830 7.830 7.843 -0.013 18517 3281 1 3 . 1 1 148 148 PHE N N 216 117.370 117.370 118.167 -0.797 18517 3282 1 3 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.228 -0.148 18517 3283 1 3 . 1 1 148 148 PHE C C 216 178.200 178.200 176.867 1.333 18517 3284 1 3 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.143 0.977 18517 3285 1 3 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.627 1.093 18517 3286 1 3 . 1 1 148 148 PHE H H 216 8.010 8.010 8.268 -0.258 18517 3287 1 3 . 1 1 149 149 ALA N N 217 118.990 118.990 120.285 -1.295 18517 3288 1 3 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.197 -0.088 18517 3289 1 3 . 1 1 149 149 ALA C C 217 177.330 177.330 177.976 -0.646 18517 3290 1 3 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.256 0.494 18517 3291 1 3 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.842 -1.242 18517 3292 1 3 . 1 1 149 149 ALA H H 217 7.720 7.720 7.968 -0.248 18517 3293 1 3 . 1 1 150 150 ALA N N 218 118.690 118.690 120.330 -1.640 18517 3294 1 3 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.355 0.005 18517 3295 1 3 . 1 1 150 150 ALA C C 218 177.930 177.930 177.781 0.149 18517 3296 1 3 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.719 -0.629 18517 3297 1 3 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.548 0.192 18517 3298 1 3 . 1 1 150 150 ALA H H 218 7.280 7.280 7.741 -0.461 18517 3299 1 3 . 1 1 151 151 LEU N N 219 119.980 119.980 120.551 -0.571 18517 3300 1 3 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.268 0.002 18517 3301 1 3 . 1 1 151 151 LEU C C 219 176.150 176.150 175.235 0.915 18517 3302 1 3 . 1 1 151 151 LEU CA C 219 56.170 56.170 55.300 0.870 18517 3303 1 3 . 1 1 151 151 LEU CB C 219 42.810 42.810 42.772 0.038 18517 3304 1 3 . 1 1 151 151 LEU H H 219 7.050 7.050 7.459 -0.409 18517 3305 1 3 . 1 1 152 152 THR N N 220 112.070 112.070 116.630 -4.560 18517 3306 1 3 . 1 1 152 152 THR HA H 220 4.700 4.700 4.872 -0.172 18517 3307 1 3 . 1 1 152 152 THR C C 220 173.400 173.400 173.518 -0.118 18517 3308 1 3 . 1 1 152 152 THR CA C 220 58.190 58.190 58.353 -0.163 18517 3309 1 3 . 1 1 152 152 THR CB C 220 70.960 70.960 69.551 1.409 18517 3310 1 3 . 1 1 152 152 THR H H 220 8.040 8.040 8.205 -0.165 18517 3311 1 3 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.596 0.114 18517 3312 1 3 . 1 1 153 153 PRO C C 221 176.720 176.720 176.619 0.101 18517 3313 1 3 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.503 0.407 18517 3314 1 3 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.573 1.677 18517 3315 1 3 . 1 1 154 154 THR N N 222 120.460 120.460 117.451 3.009 18517 3316 1 3 . 1 1 154 154 THR HA H 222 4.250 4.250 4.390 -0.140 18517 3317 1 3 . 1 1 154 154 THR C C 222 175.190 175.190 175.294 -0.104 18517 3318 1 3 . 1 1 154 154 THR CA C 222 64.650 64.650 62.917 1.733 18517 3319 1 3 . 1 1 154 154 THR CB C 222 70.410 70.410 68.127 2.283 18517 3320 1 3 . 1 1 154 154 THR H H 222 8.530 8.530 8.441 0.089 18517 3321 1 3 . 1 1 155 155 PHE N N 223 122.260 122.260 125.269 -3.009 18517 3322 1 3 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.659 0.331 18517 3323 1 3 . 1 1 155 155 PHE C C 223 172.560 172.560 174.559 -1.999 18517 3324 1 3 . 1 1 155 155 PHE CA C 223 56.770 56.770 57.588 -0.818 18517 3325 1 3 . 1 1 155 155 PHE CB C 223 40.590 40.590 38.786 1.804 18517 3326 1 3 . 1 1 155 155 PHE H H 223 8.950 8.950 7.682 1.268 18517 3327 1 3 . 1 1 156 156 LEU N N 224 123.440 123.440 119.083 4.357 18517 3328 1 3 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.510 0.160 18517 3329 1 3 . 1 1 156 156 LEU C C 224 175.090 175.090 176.486 -1.396 18517 3330 1 3 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.001 0.029 18517 3331 1 3 . 1 1 156 156 LEU CB C 224 46.300 46.300 43.245 3.055 18517 3332 1 3 . 1 1 156 156 LEU H H 224 7.210 7.210 7.263 -0.053 18517 3333 1 3 . 1 1 157 157 THR N N 225 113.010 113.010 113.281 -0.271 18517 3334 1 3 . 1 1 157 157 THR HA H 225 4.790 4.790 4.531 0.259 18517 3335 1 3 . 1 1 157 157 THR C C 225 176.130 176.130 173.735 2.395 18517 3336 1 3 . 1 1 157 157 THR CA C 225 59.860 59.860 61.318 -1.458 18517 3337 1 3 . 1 1 157 157 THR CB C 225 72.860 72.860 71.165 1.695 18517 3338 1 3 . 1 1 157 157 THR H H 225 9.200 9.200 8.256 0.944 18517 3339 1 3 . 1 1 158 158 SER N N 226 115.350 115.350 118.782 -3.432 18517 3340 1 3 . 1 1 158 158 SER C C 226 177.410 177.410 175.888 1.522 18517 3341 1 3 . 1 1 158 158 SER CA C 226 57.400 57.400 57.798 -0.398 18517 3342 1 3 . 1 1 158 158 SER CB C 226 66.200 66.200 63.951 2.249 18517 3343 1 3 . 1 1 158 158 SER H H 226 8.830 8.830 8.399 0.431 18517 3344 1 3 . 1 1 159 159 GLU N N 227 121.200 121.200 121.229 -0.029 18517 3345 1 3 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.931 0.089 18517 3346 1 3 . 1 1 159 159 GLU C C 227 177.680 177.680 177.173 0.507 18517 3347 1 3 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.870 0.630 18517 3348 1 3 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.524 0.045 18517 3349 1 3 . 1 1 159 159 GLU H H 227 8.320 8.320 8.836 -0.516 18517 3350 1 3 . 1 1 160 160 ASP N N 228 115.350 115.350 117.322 -1.972 18517 3351 1 3 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.371 0.179 18517 3352 1 3 . 1 1 160 160 ASP C C 228 177.640 177.640 177.557 0.083 18517 3353 1 3 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.950 0.450 18517 3354 1 3 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.373 2.677 18517 3355 1 3 . 1 1 160 160 ASP H H 228 7.570 7.570 8.358 -0.788 18517 3356 1 3 . 1 1 161 161 ILE N N 229 108.150 108.150 112.973 -4.823 18517 3357 1 3 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.343 0.167 18517 3358 1 3 . 1 1 161 161 ILE C C 229 173.130 173.130 176.650 -3.520 18517 3359 1 3 . 1 1 161 161 ILE CA C 229 61.290 61.290 61.991 -0.701 18517 3360 1 3 . 1 1 161 161 ILE CB C 229 39.400 39.400 39.348 0.052 18517 3361 1 3 . 1 1 161 161 ILE H H 229 7.190 7.190 7.668 -0.478 18517 3362 1 3 . 1 1 162 162 SER N N 230 115.290 115.290 118.247 -2.957 18517 3363 1 3 . 1 1 162 162 SER HA H 230 4.760 4.760 3.879 0.881 18517 3364 1 3 . 1 1 162 162 SER C C 230 176.060 176.060 174.296 1.764 18517 3365 1 3 . 1 1 162 162 SER CA C 230 57.920 57.920 58.045 -0.126 18517 3366 1 3 . 1 1 162 162 SER CB C 230 66.120 66.120 61.377 4.743 18517 3367 1 3 . 1 1 162 162 SER H H 230 7.460 7.460 8.054 -0.594 18517 3368 1 3 . 1 1 163 163 GLY C C 231 173.260 173.260 172.883 0.377 18517 3369 1 3 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.721 0.829 18517 3370 1 3 . 1 1 164 164 TYR N N 232 115.290 115.290 116.780 -1.490 18517 3371 1 3 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.696 0.004 18517 3372 1 3 . 1 1 164 164 TYR C C 232 172.820 172.820 173.664 -0.844 18517 3373 1 3 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.165 -0.065 18517 3374 1 3 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.586 0.214 18517 3375 1 3 . 1 1 164 164 TYR H H 232 7.370 7.370 7.131 0.239 18517 3376 1 3 . 1 1 165 165 LEU N N 233 120.980 120.980 122.538 -1.558 18517 3377 1 3 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.577 -0.147 18517 3378 1 3 . 1 1 165 165 LEU C C 233 176.360 176.360 177.360 -1.000 18517 3379 1 3 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.047 1.613 18517 3380 1 3 . 1 1 165 165 LEU CB C 233 40.430 40.430 42.310 -1.880 18517 3381 1 3 . 1 1 165 165 LEU H H 233 8.830 8.830 8.140 0.690 18517 3382 1 3 . 1 1 166 166 THR N N 234 116.170 116.170 113.972 2.198 18517 3383 1 3 . 1 1 166 166 THR HA H 234 4.010 4.010 3.458 0.552 18517 3384 1 3 . 1 1 166 166 THR C C 234 173.070 173.070 173.805 -0.735 18517 3385 1 3 . 1 1 166 166 THR CA C 234 62.910 62.910 63.895 -0.985 18517 3386 1 3 . 1 1 166 166 THR CB C 234 70.170 70.170 69.164 1.006 18517 3387 1 3 . 1 1 166 166 THR H H 234 8.050 8.050 8.437 -0.387 18517 3388 1 3 . 1 1 167 167 VAL N N 235 117.640 117.640 114.824 2.816 18517 3389 1 3 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.322 -0.112 18517 3390 1 3 . 1 1 167 167 VAL C C 235 172.330 172.330 174.000 -1.670 18517 3391 1 3 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.024 1.726 18517 3392 1 3 . 1 1 167 167 VAL CB C 235 35.880 35.880 31.591 4.289 18517 3393 1 3 . 1 1 167 167 VAL H H 235 7.160 7.160 7.353 -0.193 18517 3394 1 3 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.475 -0.285 18517 3395 1 3 . 1 1 168 168 PRO C C 236 173.710 173.710 175.965 -2.255 18517 3396 1 3 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.435 1.395 18517 3397 1 3 . 1 1 168 168 PRO CB C 236 32.270 32.270 32.793 -0.523 18517 3398 1 3 . 1 1 169 169 GLU N N 237 113.540 113.540 118.098 -4.558 18517 3399 1 3 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.071 0.309 18517 3400 1 3 . 1 1 169 169 GLU C C 237 176.690 176.690 178.002 -1.312 18517 3401 1 3 . 1 1 169 169 GLU CA C 237 53.750 53.750 55.096 -1.346 18517 3402 1 3 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.462 2.758 18517 3403 1 3 . 1 1 169 169 GLU H H 237 7.930 7.930 8.280 -0.350 18517 3404 1 3 . 1 1 170 170 TYR N N 238 119.400 119.400 121.021 -1.621 18517 3405 1 3 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.261 -0.261 18517 3406 1 3 . 1 1 170 170 TYR C C 238 177.610 177.610 176.159 1.451 18517 3407 1 3 . 1 1 170 170 TYR CA C 238 62.630 62.630 59.892 2.738 18517 3408 1 3 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.507 -0.767 18517 3409 1 3 . 1 1 170 170 TYR H H 238 8.490 8.490 8.369 0.121 18517 3410 1 3 . 1 1 171 171 GLY N N 239 104.160 104.160 103.925 0.235 18517 3411 1 3 . 1 1 171 171 GLY C C 239 173.350 173.350 172.917 0.433 18517 3412 1 3 . 1 1 171 171 GLY CA C 239 45.270 45.270 45.070 0.200 18517 3413 1 3 . 1 1 171 171 GLY H H 239 7.960 7.960 7.755 0.205 18517 3414 1 3 . 1 1 172 172 ALA N N 240 121.860 121.860 123.650 -1.790 18517 3415 1 3 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.929 -0.759 18517 3416 1 3 . 1 1 172 172 ALA C C 240 172.160 172.160 174.551 -2.391 18517 3417 1 3 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.669 0.441 18517 3418 1 3 . 1 1 172 172 ALA CB C 240 20.930 20.930 19.995 0.935 18517 3419 1 3 . 1 1 172 172 ALA H H 240 6.910 6.910 7.821 -0.911 18517 3420 1 3 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.852 0.698 18517 3421 1 3 . 1 1 173 173 PRO C C 241 176.610 176.610 174.915 1.695 18517 3422 1 3 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.153 -0.633 18517 3423 1 3 . 1 1 173 173 PRO CB C 241 33.300 33.300 32.599 0.701 18517 3424 1 3 . 1 1 174 174 MET N N 242 114.000 114.000 119.484 -5.484 18517 3425 1 3 . 1 1 174 174 MET HA H 242 4.390 4.390 4.649 -0.259 18517 3426 1 3 . 1 1 174 174 MET C C 242 173.960 173.960 174.681 -0.721 18517 3427 1 3 . 1 1 174 174 MET CA C 242 54.660 54.660 53.371 1.289 18517 3428 1 3 . 1 1 174 174 MET CB C 242 34.170 34.170 36.443 -2.273 18517 3429 1 3 . 1 1 174 174 MET H H 242 8.040 8.040 7.891 0.149 18517 3430 1 3 . 1 1 175 175 ASN N N 243 119.570 119.570 122.521 -2.951 18517 3431 1 3 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.868 0.072 18517 3432 1 3 . 1 1 175 175 ASN C C 243 174.320 174.320 175.229 -0.909 18517 3433 1 3 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.167 0.913 18517 3434 1 3 . 1 1 175 175 ASN CB C 243 38.850 38.850 39.064 -0.214 18517 3435 1 3 . 1 1 175 175 ASN H H 243 7.960 7.960 8.382 -0.422 18517 3436 1 3 . 1 1 176 176 ALA N N 244 132.250 132.250 130.072 2.178 18517 3437 1 3 . 1 1 176 176 ALA C C 244 181.580 181.580 178.681 2.899 18517 3438 1 3 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.524 0.246 18517 3439 1 3 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.720 0.310 18517 3440 1 3 . 1 1 176 176 ALA H H 244 12.110 12.110 8.769 3.341 18517 3441 1 3 . 1 1 177 177 ALA N N 245 125.780 125.780 120.447 5.333 18517 3442 1 3 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.938 -0.068 18517 3443 1 3 . 1 1 177 177 ALA C C 245 180.640 180.640 179.146 1.494 18517 3444 1 3 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.100 0.560 18517 3445 1 3 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.188 -0.348 18517 3446 1 3 . 1 1 177 177 ALA H H 245 10.240 10.240 8.641 1.599 18517 3447 1 3 . 1 1 178 178 LYS N N 246 119.810 119.810 119.584 0.226 18517 3448 1 3 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.035 -0.205 18517 3449 1 3 . 1 1 178 178 LYS C C 246 180.500 180.500 178.312 2.188 18517 3450 1 3 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.399 0.501 18517 3451 1 3 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.383 -1.063 18517 3452 1 3 . 1 1 178 178 LYS H H 246 8.470 8.470 7.993 0.477 18517 3453 1 3 . 1 1 179 179 TRP N N 247 121.170 121.170 121.011 0.159 18517 3454 1 3 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.238 0.382 18517 3455 1 3 . 1 1 179 179 TRP C C 247 176.510 176.510 177.806 -1.296 18517 3456 1 3 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.559 0.260 18517 3457 1 3 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.538 0.032 18517 3458 1 3 . 1 1 179 179 TRP H H 247 8.330 8.330 8.321 0.009 18517 3459 1 3 . 1 1 180 180 ALA N N 248 119.130 119.130 120.850 -1.720 18517 3460 1 3 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.773 0.767 18517 3461 1 3 . 1 1 180 180 ALA C C 248 182.110 182.110 179.888 2.222 18517 3462 1 3 . 1 1 180 180 ALA CA C 248 54.190 54.190 54.975 -0.785 18517 3463 1 3 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.197 0.513 18517 3464 1 3 . 1 1 180 180 ALA H H 248 7.990 7.990 8.325 -0.335 18517 3465 1 3 . 1 1 181 181 LYS N N 249 116.000 116.000 118.974 -2.974 18517 3466 1 3 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.047 -0.077 18517 3467 1 3 . 1 1 181 181 LYS C C 249 179.380 179.380 179.051 0.329 18517 3468 1 3 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.369 -0.659 18517 3469 1 3 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.339 0.171 18517 3470 1 3 . 1 1 181 181 LYS H H 249 6.900 6.900 7.931 -1.031 18517 3471 1 3 . 1 1 182 182 VAL N N 250 122.270 122.270 116.422 5.848 18517 3472 1 3 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.674 -0.334 18517 3473 1 3 . 1 1 182 182 VAL C C 250 178.160 178.160 177.560 0.600 18517 3474 1 3 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.407 0.353 18517 3475 1 3 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.429 -0.589 18517 3476 1 3 . 1 1 182 182 VAL H H 250 7.050 7.050 8.128 -1.078 18517 3477 1 3 . 1 1 183 183 GLU N N 251 120.520 120.520 120.029 0.491 18517 3478 1 3 . 1 1 183 183 GLU HA H 251 3.180 3.180 4.024 -0.844 18517 3479 1 3 . 1 1 183 183 GLU C C 251 179.480 179.480 179.219 0.261 18517 3480 1 3 . 1 1 183 183 GLU CA C 251 60.690 60.690 58.717 1.973 18517 3481 1 3 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.679 -0.609 18517 3482 1 3 . 1 1 183 183 GLU H H 251 8.020 8.020 8.642 -0.622 18517 3483 1 3 . 1 1 184 184 GLY N N 252 102.930 102.930 108.944 -6.014 18517 3484 1 3 . 1 1 184 184 GLY C C 252 176.920 176.920 176.117 0.803 18517 3485 1 3 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.275 0.135 18517 3486 1 3 . 1 1 184 184 GLY H H 252 7.830 7.830 8.196 -0.366 18517 3487 1 3 . 1 1 185 185 MET N N 253 123.200 123.200 121.619 1.581 18517 3488 1 3 . 1 1 185 185 MET HA H 253 4.250 4.250 4.071 0.179 18517 3489 1 3 . 1 1 185 185 MET C C 253 179.370 179.370 178.492 0.878 18517 3490 1 3 . 1 1 185 185 MET CA C 253 59.300 59.300 59.397 -0.097 18517 3491 1 3 . 1 1 185 185 MET CB C 253 33.930 33.930 32.530 1.400 18517 3492 1 3 . 1 1 185 185 MET H H 253 7.890 7.890 7.903 -0.013 18517 3493 1 3 . 1 1 186 186 ILE N N 254 120.150 120.150 120.188 -0.038 18517 3494 1 3 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.672 -0.112 18517 3495 1 3 . 1 1 186 186 ILE C C 254 177.250 177.250 177.971 -0.721 18517 3496 1 3 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.638 0.882 18517 3497 1 3 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.556 0.734 18517 3498 1 3 . 1 1 186 186 ILE H H 254 8.260 8.260 8.118 0.142 18517 3499 1 3 . 1 1 187 187 HIS N N 255 119.810 119.810 119.277 0.533 18517 3500 1 3 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.176 -0.176 18517 3501 1 3 . 1 1 187 187 HIS C C 255 176.460 176.460 177.480 -1.020 18517 3502 1 3 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.900 0.430 18517 3503 1 3 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.586 2.044 18517 3504 1 3 . 1 1 187 187 HIS H H 255 8.900 8.900 8.790 0.110 18517 3505 1 3 . 1 1 188 188 GLY N N 256 103.160 103.160 107.200 -4.040 18517 3506 1 3 . 1 1 188 188 GLY C C 256 176.320 176.320 176.301 0.019 18517 3507 1 3 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.847 0.043 18517 3508 1 3 . 1 1 188 188 GLY H H 256 8.030 8.030 8.387 -0.357 18517 3509 1 3 . 1 1 189 189 LYS N N 257 119.510 119.510 122.262 -2.752 18517 3510 1 3 . 1 1 189 189 LYS HA H 257 4.000 4.000 3.907 0.093 18517 3511 1 3 . 1 1 189 189 LYS C C 257 178.660 178.660 179.419 -0.759 18517 3512 1 3 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.607 -1.117 18517 3513 1 3 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.529 0.021 18517 3514 1 3 . 1 1 189 189 LYS H H 257 7.120 7.120 7.868 -0.748 18517 3515 1 3 . 1 1 190 190 LEU N N 258 120.570 120.570 120.137 0.433 18517 3516 1 3 . 1 1 190 190 LEU HA H 258 3.930 3.930 3.965 -0.035 18517 3517 1 3 . 1 1 190 190 LEU C C 258 177.230 177.230 178.266 -1.036 18517 3518 1 3 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.445 0.075 18517 3519 1 3 . 1 1 190 190 LEU CB C 258 42.970 42.970 42.014 0.956 18517 3520 1 3 . 1 1 190 190 LEU H H 258 8.060 8.060 8.377 -0.317 18517 3521 1 3 . 1 1 191 191 GLU N N 259 114.590 114.590 117.581 -2.991 18517 3522 1 3 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.203 0.077 18517 3523 1 3 . 1 1 191 191 GLU C C 259 176.230 176.230 176.285 -0.055 18517 3524 1 3 . 1 1 191 191 GLU CA C 259 55.340 55.340 57.798 -2.458 18517 3525 1 3 . 1 1 191 191 GLU CB C 259 29.330 29.330 30.395 -1.065 18517 3526 1 3 . 1 1 191 191 GLU H H 259 7.330 7.330 7.828 -0.498 18517 3527 1 3 . 1 1 192 192 SER N N 260 115.240 115.240 114.026 1.214 18517 3528 1 3 . 1 1 192 192 SER HA H 260 4.490 4.490 4.667 -0.177 18517 3529 1 3 . 1 1 192 192 SER C C 260 173.770 173.770 173.657 0.113 18517 3530 1 3 . 1 1 192 192 SER CA C 260 58.350 58.350 58.165 0.185 18517 3531 1 3 . 1 1 192 192 SER CB C 260 65.090 65.090 63.867 1.223 18517 3532 1 3 . 1 1 192 192 SER H H 260 7.130 7.130 7.451 -0.321 18517 3533 1 3 . 1 1 193 193 SER C C 261 174.600 174.600 173.600 1.000 18517 3534 1 3 . 1 1 193 193 SER CA C 261 59.980 59.980 58.828 1.152 18517 3535 1 3 . 1 1 193 193 SER CB C 261 63.750 63.750 64.177 -0.427 18517 3536 1 3 . 1 1 194 194 GLU N N 262 121.800 121.800 120.101 1.699 18517 3537 1 3 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.408 0.062 18517 3538 1 3 . 1 1 194 194 GLU C C 262 174.650 174.650 174.455 0.195 18517 3539 1 3 . 1 1 194 194 GLU CA C 262 55.620 55.620 56.304 -0.684 18517 3540 1 3 . 1 1 194 194 GLU CB C 262 30.210 30.210 32.366 -2.156 18517 3541 1 3 . 1 1 194 194 GLU H H 262 7.840 7.840 8.101 -0.261 18517 3542 1 3 . 1 1 195 195 VAL N N 263 124.080 124.080 123.683 0.397 18517 3543 1 3 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.174 0.076 18517 3544 1 3 . 1 1 195 195 VAL C C 263 174.460 174.460 174.684 -0.224 18517 3545 1 3 . 1 1 195 195 VAL CA C 263 59.820 59.820 60.676 -0.856 18517 3546 1 3 . 1 1 195 195 VAL CB C 263 33.620 33.620 32.571 1.049 18517 3547 1 3 . 1 1 195 195 VAL H H 263 8.020 8.020 8.358 -0.338 18517 3548 1 3 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.183 0.337 18517 3549 1 3 . 1 1 198 198 ASN C C 266 176.490 176.490 177.666 -1.176 18517 3550 1 3 . 1 1 198 198 ASN CA C 266 54.780 54.780 56.242 -1.462 18517 3551 1 3 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.839 0.221 18517 3552 1 3 . 1 1 199 199 LEU N N 267 120.680 120.680 118.985 1.695 18517 3553 1 3 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.949 0.061 18517 3554 1 3 . 1 1 199 199 LEU C C 267 178.050 178.050 178.547 -0.497 18517 3555 1 3 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.187 0.643 18517 3556 1 3 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.036 1.304 18517 3557 1 3 . 1 1 199 199 LEU H H 267 7.660 7.660 7.841 -0.181 18517 3558 1 3 . 1 1 200 200 LYS N N 268 116.740 116.740 120.068 -3.328 18517 3559 1 3 . 1 1 200 200 LYS HA H 268 3.730 3.730 4.022 -0.292 18517 3560 1 3 . 1 1 200 200 LYS C C 268 178.520 178.520 178.387 0.133 18517 3561 1 3 . 1 1 200 200 LYS CA C 268 61.800 61.800 58.304 3.496 18517 3562 1 3 . 1 1 200 200 LYS CB C 268 32.110 32.110 31.613 0.497 18517 3563 1 3 . 1 1 200 200 LYS H H 268 8.280 8.280 7.406 0.874 18517 3564 1 3 . 1 1 201 201 ALA N N 269 121.270 121.270 122.245 -0.975 18517 3565 1 3 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.046 0.194 18517 3566 1 3 . 1 1 201 201 ALA C C 269 180.890 180.890 179.619 1.271 18517 3567 1 3 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.185 -0.005 18517 3568 1 3 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.348 0.122 18517 3569 1 3 . 1 1 201 201 ALA H H 269 7.710 7.710 7.884 -0.174 18517 3570 1 3 . 1 1 202 202 LEU N N 270 119.980 119.980 119.061 0.919 18517 3571 1 3 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.894 0.196 18517 3572 1 3 . 1 1 202 202 LEU C C 270 179.330 179.330 179.221 0.109 18517 3573 1 3 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.812 0.258 18517 3574 1 3 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.341 1.079 18517 3575 1 3 . 1 1 202 202 LEU H H 270 7.750 7.750 8.414 -0.664 18517 3576 1 3 . 1 1 203 203 VAL N N 271 118.450 118.450 119.691 -1.241 18517 3577 1 3 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.851 -0.021 18517 3578 1 3 . 1 1 203 203 VAL C C 271 177.110 177.110 177.851 -0.741 18517 3579 1 3 . 1 1 203 203 VAL CA C 271 67.710 67.710 67.155 0.555 18517 3580 1 3 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.487 0.223 18517 3581 1 3 . 1 1 203 203 VAL H H 271 8.560 8.560 8.250 0.310 18517 3582 1 3 . 1 1 204 204 ALA N N 272 122.560 122.560 121.732 0.828 18517 3583 1 3 . 1 1 204 204 ALA HA H 272 3.880 3.880 4.034 -0.154 18517 3584 1 3 . 1 1 204 204 ALA C C 272 178.700 178.700 179.713 -1.013 18517 3585 1 3 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.720 0.410 18517 3586 1 3 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.096 0.294 18517 3587 1 3 . 1 1 204 204 ALA H H 272 8.120 8.120 8.636 -0.516 18517 3588 1 3 . 1 1 205 205 GLU N N 273 117.290 117.290 118.666 -1.376 18517 3589 1 3 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.183 -0.193 18517 3590 1 3 . 1 1 205 205 GLU C C 273 178.630 178.630 179.080 -0.450 18517 3591 1 3 . 1 1 205 205 GLU CA C 273 60.140 60.140 58.644 1.496 18517 3592 1 3 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.433 0.536 18517 3593 1 3 . 1 1 205 205 GLU H H 273 7.670 7.670 8.037 -0.367 18517 3594 1 3 . 1 1 206 206 LEU N N 274 120.450 120.450 122.711 -2.261 18517 3595 1 3 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.071 -0.071 18517 3596 1 3 . 1 1 206 206 LEU C C 274 178.400 178.400 178.611 -0.211 18517 3597 1 3 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.244 0.666 18517 3598 1 3 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.867 1.663 18517 3599 1 3 . 1 1 206 206 LEU H H 274 8.420 8.420 8.403 0.017 18517 3600 1 3 . 1 1 207 207 ILE N N 275 117.580 117.580 120.339 -2.759 18517 3601 1 3 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.517 0.013 18517 3602 1 3 . 1 1 207 207 ILE C C 275 178.850 178.850 178.247 0.603 18517 3603 1 3 . 1 1 207 207 ILE CA C 275 66.080 66.080 66.138 -0.058 18517 3604 1 3 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.592 1.178 18517 3605 1 3 . 1 1 207 207 ILE H H 275 8.700 8.700 8.667 0.033 18517 3606 1 3 . 1 1 208 208 GLU N N 276 119.100 119.100 119.551 -0.451 18517 3607 1 3 . 1 1 208 208 GLU HA H 276 4.000 4.000 4.006 -0.006 18517 3608 1 3 . 1 1 208 208 GLU C C 276 178.540 178.540 179.071 -0.531 18517 3609 1 3 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.735 0.715 18517 3610 1 3 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.350 1.170 18517 3611 1 3 . 1 1 208 208 GLU H H 276 7.950 7.950 8.311 -0.361 18517 3612 1 3 . 1 1 209 209 LEU N N 277 120.590 120.590 120.273 0.317 18517 3613 1 3 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.072 0.148 18517 3614 1 3 . 1 1 209 209 LEU C C 277 179.520 179.520 178.801 0.719 18517 3615 1 3 . 1 1 209 209 LEU CA C 277 58.350 58.350 57.968 0.382 18517 3616 1 3 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.539 1.751 18517 3617 1 3 . 1 1 209 209 LEU H H 277 8.550 8.550 8.377 0.173 18517 3618 1 3 . 1 1 210 210 ARG N N 278 116.470 116.470 120.077 -3.607 18517 3619 1 3 . 1 1 210 210 ARG HA H 278 3.740 3.740 3.935 -0.195 18517 3620 1 3 . 1 1 210 210 ARG C C 278 179.190 179.190 178.646 0.544 18517 3621 1 3 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.053 2.627 18517 3622 1 3 . 1 1 210 210 ARG CB C 278 31.400 31.400 29.583 1.817 18517 3623 1 3 . 1 1 210 210 ARG H H 278 8.590 8.590 8.866 -0.276 18517 3624 1 3 . 1 1 211 211 ALA N N 279 120.470 120.470 120.815 -0.345 18517 3625 1 3 . 1 1 211 211 ALA HA H 279 3.910 3.910 3.999 -0.089 18517 3626 1 3 . 1 1 211 211 ALA C C 279 181.350 181.350 179.808 1.542 18517 3627 1 3 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.222 0.478 18517 3628 1 3 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.447 -1.167 18517 3629 1 3 . 1 1 211 211 ALA H H 279 8.050 8.050 8.422 -0.372 18517 3630 1 3 . 1 1 212 212 GLN N N 280 120.070 120.070 118.303 1.767 18517 3631 1 3 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.944 0.076 18517 3632 1 3 . 1 1 212 212 GLN C C 280 179.490 179.490 178.783 0.707 18517 3633 1 3 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.748 0.552 18517 3634 1 3 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.774 0.406 18517 3635 1 3 . 1 1 212 212 GLN H H 280 8.300 8.300 8.049 0.251 18517 3636 1 3 . 1 1 213 213 MET N N 281 119.810 119.810 120.111 -0.301 18517 3637 1 3 . 1 1 213 213 MET HA H 281 3.730 3.730 4.254 -0.524 18517 3638 1 3 . 1 1 213 213 MET C C 281 177.490 177.490 178.275 -0.785 18517 3639 1 3 . 1 1 213 213 MET CA C 281 60.690 60.690 57.781 2.909 18517 3640 1 3 . 1 1 213 213 MET CB C 281 33.930 33.930 32.598 1.332 18517 3641 1 3 . 1 1 213 213 MET H H 281 8.420 8.420 8.711 -0.291 18517 3642 1 3 . 1 1 214 214 MET N N 282 114.000 114.000 118.356 -4.356 18517 3643 1 3 . 1 1 214 214 MET HA H 282 3.880 3.880 4.322 -0.442 18517 3644 1 3 . 1 1 214 214 MET C C 282 177.650 177.650 178.587 -0.937 18517 3645 1 3 . 1 1 214 214 MET CA C 282 58.670 58.670 57.491 1.179 18517 3646 1 3 . 1 1 214 214 MET CB C 282 33.300 33.300 31.645 1.655 18517 3647 1 3 . 1 1 214 214 MET H H 282 7.890 7.890 8.326 -0.436 18517 3648 1 3 . 1 1 215 215 ALA N N 283 119.970 119.970 122.960 -2.990 18517 3649 1 3 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.002 0.138 18517 3650 1 3 . 1 1 215 215 ALA C C 283 180.580 180.580 179.111 1.469 18517 3651 1 3 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.055 -0.945 18517 3652 1 3 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.151 -0.471 18517 3653 1 3 . 1 1 215 215 ALA H H 283 7.580 7.580 8.231 -0.651 18517 3654 1 3 . 1 1 216 216 LEU N N 284 120.920 120.920 117.862 3.058 18517 3655 1 3 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.076 -0.116 18517 3656 1 3 . 1 1 216 216 LEU C C 284 177.910 177.910 179.631 -1.721 18517 3657 1 3 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.132 0.788 18517 3658 1 3 . 1 1 216 216 LEU CB C 284 42.500 42.500 41.959 0.541 18517 3659 1 3 . 1 1 216 216 LEU H H 284 7.460 7.460 7.998 -0.538 18517 3660 1 3 . 1 1 217 217 LEU N N 285 116.470 116.470 121.530 -5.060 18517 3661 1 3 . 1 1 217 217 LEU HA H 285 3.680 3.680 4.027 -0.347 18517 3662 1 3 . 1 1 217 217 LEU C C 285 178.310 178.310 177.433 0.877 18517 3663 1 3 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.861 -0.421 18517 3664 1 3 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.762 1.288 18517 3665 1 3 . 1 1 217 217 LEU H H 285 6.980 6.980 8.269 -1.289 18517 3666 1 3 . 1 1 218 218 TYR N N 286 111.080 111.080 113.407 -2.327 18517 3667 1 3 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.624 0.276 18517 3668 1 3 . 1 1 218 218 TYR C C 286 176.090 176.090 176.148 -0.058 18517 3669 1 3 . 1 1 218 218 TYR CA C 286 56.050 56.050 56.560 -0.510 18517 3670 1 3 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.032 2.878 18517 3671 1 3 . 1 1 218 218 TYR H H 286 7.660 7.660 7.954 -0.294 18517 3672 1 3 . 1 1 219 219 GLY N N 287 108.260 108.260 110.943 -2.683 18517 3673 1 3 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.998 0.322 18517 3674 1 3 . 1 1 219 219 GLY H H 287 7.750 7.750 7.497 0.253 18517 3675 1 3 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.809 -0.319 18517 3676 1 3 . 1 1 221 221 ILE CA C 289 63.580 63.580 62.325 1.255 18517 3677 1 3 . 1 1 221 221 ILE CB C 289 38.280 38.280 37.544 0.736 18517 3678 1 3 . 1 1 222 222 GLY CA C 290 45.740 45.740 44.766 0.974 18517 3679 1 4 . 1 1 2 2 LYS N N 70 126.600 126.600 126.288 0.312 18517 3680 1 4 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.654 -0.294 18517 3681 1 4 . 1 1 2 2 LYS C C 70 176.000 176.000 175.272 0.728 18517 3682 1 4 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.542 0.908 18517 3683 1 4 . 1 1 2 2 LYS CB C 70 33.850 33.850 32.079 1.771 18517 3684 1 4 . 1 1 2 2 LYS H H 70 8.530 8.530 8.369 0.161 18517 3685 1 4 . 1 1 3 3 THR N N 71 111.030 111.030 116.992 -5.962 18517 3686 1 4 . 1 1 3 3 THR HA H 71 4.400 4.400 4.398 0.002 18517 3687 1 4 . 1 1 3 3 THR C C 71 175.650 175.650 175.552 0.098 18517 3688 1 4 . 1 1 3 3 THR CA C 71 60.610 60.610 60.797 -0.187 18517 3689 1 4 . 1 1 3 3 THR CB C 71 71.520 71.520 71.166 0.354 18517 3690 1 4 . 1 1 3 3 THR H H 71 7.390 7.390 7.986 -0.596 18517 3691 1 4 . 1 1 4 4 LEU N N 72 121.560 121.560 123.105 -1.545 18517 3692 1 4 . 1 1 4 4 LEU C C 72 177.870 177.870 177.782 0.088 18517 3693 1 4 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.588 -0.108 18517 3694 1 4 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.900 0.280 18517 3695 1 4 . 1 1 4 4 LEU H H 72 8.980 8.980 8.604 0.376 18517 3696 1 4 . 1 1 5 5 ASP N N 73 115.530 115.530 116.734 -1.204 18517 3697 1 4 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.391 -0.061 18517 3698 1 4 . 1 1 5 5 ASP C C 73 179.290 179.290 178.242 1.048 18517 3699 1 4 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.346 0.493 18517 3700 1 4 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.501 0.329 18517 3701 1 4 . 1 1 5 5 ASP H H 73 8.270 8.270 8.665 -0.395 18517 3702 1 4 . 1 1 6 6 VAL N N 74 122.330 122.330 120.061 2.269 18517 3703 1 4 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.765 -0.025 18517 3704 1 4 . 1 1 6 6 VAL C C 74 178.970 178.970 178.049 0.921 18517 3705 1 4 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.702 0.658 18517 3706 1 4 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.515 0.435 18517 3707 1 4 . 1 1 6 6 VAL H H 74 7.400 7.400 7.497 -0.097 18517 3708 1 4 . 1 1 7 7 LEU N N 75 121.360 121.360 120.919 0.441 18517 3709 1 4 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.930 0.100 18517 3710 1 4 . 1 1 7 7 LEU C C 75 179.240 179.240 179.187 0.053 18517 3711 1 4 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.331 -0.101 18517 3712 1 4 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.132 1.758 18517 3713 1 4 . 1 1 7 7 LEU H H 75 8.300 8.300 8.667 -0.367 18517 3714 1 4 . 1 1 8 8 ARG N N 76 117.230 117.230 119.616 -2.386 18517 3715 1 4 . 1 1 8 8 ARG HA H 76 3.920 3.920 3.852 0.068 18517 3716 1 4 . 1 1 8 8 ARG C C 76 178.290 178.290 178.625 -0.335 18517 3717 1 4 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.895 0.875 18517 3718 1 4 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.942 0.268 18517 3719 1 4 . 1 1 8 8 ARG H H 76 8.520 8.520 8.725 -0.204 18517 3720 1 4 . 1 1 9 9 GLY N N 77 104.570 104.570 106.775 -2.205 18517 3721 1 4 . 1 1 9 9 GLY C C 77 176.180 176.180 176.171 0.009 18517 3722 1 4 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.767 0.403 18517 3723 1 4 . 1 1 9 9 GLY H H 77 7.620 7.620 8.347 -0.727 18517 3724 1 4 . 1 1 10 10 GLU N N 78 120.270 120.270 123.154 -2.884 18517 3725 1 4 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.010 0.260 18517 3726 1 4 . 1 1 10 10 GLU C C 78 179.030 179.030 179.191 -0.161 18517 3727 1 4 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.364 -0.494 18517 3728 1 4 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.536 1.864 18517 3729 1 4 . 1 1 10 10 GLU H H 78 8.100 8.100 8.193 -0.093 18517 3730 1 4 . 1 1 11 11 LEU N N 79 116.000 116.000 120.089 -4.089 18517 3731 1 4 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.937 0.573 18517 3732 1 4 . 1 1 11 11 LEU C C 79 179.630 179.630 178.694 0.936 18517 3733 1 4 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.021 -1.331 18517 3734 1 4 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.488 3.312 18517 3735 1 4 . 1 1 11 11 LEU H H 79 8.230 8.230 8.643 -0.413 18517 3736 1 4 . 1 1 12 12 ARG N N 80 120.020 120.020 119.901 0.119 18517 3737 1 4 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.860 -0.110 18517 3738 1 4 . 1 1 12 12 ARG C C 80 178.490 178.490 178.658 -0.168 18517 3739 1 4 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.941 2.059 18517 3740 1 4 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.958 1.282 18517 3741 1 4 . 1 1 12 12 ARG H H 80 8.210 8.210 8.529 -0.319 18517 3742 1 4 . 1 1 13 13 GLY N N 81 108.090 108.090 106.802 1.288 18517 3743 1 4 . 1 1 13 13 GLY C C 81 173.540 173.540 176.731 -3.191 18517 3744 1 4 . 1 1 13 13 GLY CA C 81 48.000 48.000 47.226 0.774 18517 3745 1 4 . 1 1 13 13 GLY H H 81 8.890 8.890 8.563 0.327 18517 3746 1 4 . 1 1 14 14 GLN C C 82 179.540 179.540 179.020 0.520 18517 3747 1 4 . 1 1 14 14 GLN CA C 82 58.710 58.710 58.699 0.011 18517 3748 1 4 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.322 0.778 18517 3749 1 4 . 1 1 15 15 ARG N N 83 118.220 118.220 119.002 -0.782 18517 3750 1 4 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.040 -0.090 18517 3751 1 4 . 1 1 15 15 ARG C C 83 177.710 177.710 178.681 -0.971 18517 3752 1 4 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.641 0.259 18517 3753 1 4 . 1 1 15 15 ARG CB C 83 29.650 29.650 29.656 -0.006 18517 3754 1 4 . 1 1 15 15 ARG H H 83 7.320 7.320 8.692 -1.372 18517 3755 1 4 . 1 1 16 16 GLU N N 84 118.810 118.810 120.184 -1.374 18517 3756 1 4 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.228 -0.378 18517 3757 1 4 . 1 1 16 16 GLU C C 84 178.750 178.750 178.543 0.207 18517 3758 1 4 . 1 1 16 16 GLU CA C 84 61.010 61.010 58.862 2.148 18517 3759 1 4 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.833 -0.423 18517 3760 1 4 . 1 1 16 16 GLU H H 84 8.450 8.450 8.701 -0.251 18517 3761 1 4 . 1 1 17 17 ALA N N 85 122.790 122.790 123.344 -0.554 18517 3762 1 4 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.263 -0.073 18517 3763 1 4 . 1 1 17 17 ALA C C 85 180.360 180.360 180.045 0.315 18517 3764 1 4 . 1 1 17 17 ALA CA C 85 55.460 55.460 54.858 0.602 18517 3765 1 4 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.531 -0.451 18517 3766 1 4 . 1 1 17 17 ALA H H 85 8.420 8.420 8.096 0.324 18517 3767 1 4 . 1 1 18 18 PHE N N 86 119.400 119.400 120.571 -1.171 18517 3768 1 4 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.226 0.064 18517 3769 1 4 . 1 1 18 18 PHE C C 86 177.560 177.560 177.282 0.278 18517 3770 1 4 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.295 0.345 18517 3771 1 4 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.287 0.353 18517 3772 1 4 . 1 1 18 18 PHE H H 86 7.490 7.490 8.192 -0.702 18517 3773 1 4 . 1 1 19 19 LEU N N 87 117.470 117.470 120.270 -2.800 18517 3774 1 4 . 1 1 19 19 LEU HA H 87 4.070 4.070 3.986 0.084 18517 3775 1 4 . 1 1 19 19 LEU C C 87 178.880 178.880 178.424 0.456 18517 3776 1 4 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.287 -0.327 18517 3777 1 4 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.632 0.468 18517 3778 1 4 . 1 1 19 19 LEU H H 87 8.010 8.010 8.771 -0.761 18517 3779 1 4 . 1 1 20 20 SER N N 88 113.770 113.770 114.964 -1.194 18517 3780 1 4 . 1 1 20 20 SER HA H 88 4.070 4.070 4.119 -0.049 18517 3781 1 4 . 1 1 20 20 SER C C 88 175.680 175.680 177.049 -1.369 18517 3782 1 4 . 1 1 20 20 SER CA C 88 63.070 63.070 61.606 1.464 18517 3783 1 4 . 1 1 20 20 SER H H 88 8.100 8.100 8.246 -0.146 18517 3784 1 4 . 1 1 21 21 GLU N N 89 120.570 120.570 121.976 -1.406 18517 3785 1 4 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.041 -0.071 18517 3786 1 4 . 1 1 21 21 GLU C C 89 178.940 178.940 178.936 0.004 18517 3787 1 4 . 1 1 21 21 GLU CA C 89 59.260 59.260 58.829 0.431 18517 3788 1 4 . 1 1 21 21 GLU CB C 89 29.330 29.330 28.952 0.378 18517 3789 1 4 . 1 1 21 21 GLU H H 89 7.400 7.400 7.868 -0.468 18517 3790 1 4 . 1 1 22 22 ILE N N 90 119.350 119.350 119.049 0.301 18517 3791 1 4 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.954 -0.264 18517 3792 1 4 . 1 1 22 22 ILE C C 90 177.230 177.230 178.659 -1.429 18517 3793 1 4 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.275 1.196 18517 3794 1 4 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.577 -0.187 18517 3795 1 4 . 1 1 22 22 ILE H H 90 7.250 7.250 7.995 -0.745 18517 3796 1 4 . 1 1 23 23 ILE N N 91 116.350 116.350 119.444 -3.094 18517 3797 1 4 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.887 -0.487 18517 3798 1 4 . 1 1 23 23 ILE C C 91 176.690 176.690 176.945 -0.255 18517 3799 1 4 . 1 1 23 23 ILE CA C 91 65.730 65.730 62.822 2.908 18517 3800 1 4 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.382 0.388 18517 3801 1 4 . 1 1 23 23 ILE H H 91 7.860 7.860 8.383 -0.523 18517 3802 1 4 . 1 1 24 24 LYS N N 92 116.000 116.000 117.463 -1.463 18517 3803 1 4 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.338 -0.198 18517 3804 1 4 . 1 1 24 24 LYS C C 92 176.270 176.270 176.547 -0.277 18517 3805 1 4 . 1 1 24 24 LYS CA C 92 57.480 57.480 55.906 1.574 18517 3806 1 4 . 1 1 24 24 LYS CB C 92 33.300 33.300 33.209 0.091 18517 3807 1 4 . 1 1 24 24 LYS H H 92 7.170 7.170 7.818 -0.648 18517 3808 1 4 . 1 1 25 25 SER N N 93 114.650 114.650 116.614 -1.964 18517 3809 1 4 . 1 1 25 25 SER HA H 93 4.550 4.550 4.393 0.157 18517 3810 1 4 . 1 1 25 25 SER C C 93 173.370 173.370 173.387 -0.017 18517 3811 1 4 . 1 1 25 25 SER CA C 93 57.240 57.240 59.056 -1.816 18517 3812 1 4 . 1 1 25 25 SER CB C 93 65.650 65.650 63.869 1.781 18517 3813 1 4 . 1 1 25 25 SER H H 93 7.730 7.730 7.845 -0.115 18517 3814 1 4 . 1 1 26 26 ASP N N 94 121.230 121.230 124.016 -2.786 18517 3815 1 4 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.831 0.099 18517 3816 1 4 . 1 1 26 26 ASP C C 94 176.560 176.560 175.298 1.262 18517 3817 1 4 . 1 1 26 26 ASP CA C 94 54.510 54.510 54.226 0.284 18517 3818 1 4 . 1 1 26 26 ASP CB C 94 42.650 42.650 42.606 0.044 18517 3819 1 4 . 1 1 26 26 ASP H H 94 8.280 8.280 8.523 -0.243 18517 3820 1 4 . 1 1 27 27 GLY N N 95 109.310 109.310 108.017 1.293 18517 3821 1 4 . 1 1 27 27 GLY C C 95 171.080 171.080 171.608 -0.528 18517 3822 1 4 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.116 -0.346 18517 3823 1 4 . 1 1 27 27 GLY H H 95 8.160 8.160 7.435 0.725 18517 3824 1 4 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.818 0.322 18517 3825 1 4 . 1 1 29 29 PHE C C 97 175.230 175.230 176.269 -1.039 18517 3826 1 4 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.071 0.419 18517 3827 1 4 . 1 1 29 29 PHE CB C 97 41.620 41.620 42.430 -0.810 18517 3828 1 4 . 1 1 30 30 THR N N 98 112.600 112.600 116.904 -4.304 18517 3829 1 4 . 1 1 30 30 THR HA H 98 4.570 4.570 4.248 0.322 18517 3830 1 4 . 1 1 30 30 THR C C 98 176.690 176.690 175.174 1.516 18517 3831 1 4 . 1 1 30 30 THR CA C 98 60.290 60.290 61.111 -0.821 18517 3832 1 4 . 1 1 30 30 THR CB C 98 71.600 71.600 70.758 0.842 18517 3833 1 4 . 1 1 30 30 THR H H 98 8.990 8.990 8.528 0.462 18517 3834 1 4 . 1 1 31 31 ILE N N 99 119.240 119.240 125.959 -6.719 18517 3835 1 4 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.719 0.101 18517 3836 1 4 . 1 1 31 31 ILE C C 99 176.090 176.090 176.740 -0.650 18517 3837 1 4 . 1 1 31 31 ILE CA C 99 60.140 60.140 64.157 -4.017 18517 3838 1 4 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.786 -0.836 18517 3839 1 4 . 1 1 31 31 ILE H H 99 9.230 9.230 7.998 1.232 18517 3840 1 4 . 1 1 32 32 LEU N N 100 119.660 119.660 118.895 0.765 18517 3841 1 4 . 1 1 32 32 LEU HA H 100 4.030 4.030 3.950 0.080 18517 3842 1 4 . 1 1 32 32 LEU C C 100 181.050 181.050 178.788 2.262 18517 3843 1 4 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.841 -0.281 18517 3844 1 4 . 1 1 32 32 LEU CB C 100 40.120 40.120 41.368 -1.248 18517 3845 1 4 . 1 1 32 32 LEU H H 100 7.310 7.310 7.844 -0.534 18517 3846 1 4 . 1 1 33 33 GLN N N 101 121.450 121.450 118.947 2.503 18517 3847 1 4 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.405 -0.155 18517 3848 1 4 . 1 1 33 33 GLN CA C 101 59.700 59.700 59.109 0.591 18517 3849 1 4 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.531 3.259 18517 3850 1 4 . 1 1 33 33 GLN H H 101 7.790 7.790 8.381 -0.591 18517 3851 1 4 . 1 1 34 34 LEU C C 102 178.590 178.590 179.089 -0.499 18517 3852 1 4 . 1 1 34 34 LEU CA C 102 58.630 58.630 57.786 0.844 18517 3853 1 4 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.469 -0.159 18517 3854 1 4 . 1 1 35 35 VAL N N 103 118.520 118.520 118.140 0.380 18517 3855 1 4 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.625 -0.205 18517 3856 1 4 . 1 1 35 35 VAL C C 103 177.930 177.930 178.339 -0.409 18517 3857 1 4 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.162 -0.122 18517 3858 1 4 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.123 1.507 18517 3859 1 4 . 1 1 35 35 VAL H H 103 8.670 8.670 8.308 0.362 18517 3860 1 4 . 1 1 36 36 GLY N N 104 109.430 109.430 108.656 0.774 18517 3861 1 4 . 1 1 36 36 GLY C C 104 174.600 174.600 175.792 -1.192 18517 3862 1 4 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.239 0.801 18517 3863 1 4 . 1 1 36 36 GLY H H 104 7.880 7.880 8.135 -0.255 18517 3864 1 4 . 1 1 37 37 TYR N N 105 122.270 122.270 124.220 -1.950 18517 3865 1 4 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.403 -0.523 18517 3866 1 4 . 1 1 37 37 TYR C C 105 176.310 176.310 177.135 -0.825 18517 3867 1 4 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.191 3.909 18517 3868 1 4 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.511 -0.141 18517 3869 1 4 . 1 1 37 37 TYR H H 105 8.170 8.170 8.294 -0.124 18517 3870 1 4 . 1 1 38 38 LEU N N 106 120.100 120.100 120.690 -0.590 18517 3871 1 4 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.682 0.058 18517 3872 1 4 . 1 1 38 38 LEU C C 106 178.280 178.280 178.440 -0.160 18517 3873 1 4 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.404 0.226 18517 3874 1 4 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.777 0.953 18517 3875 1 4 . 1 1 38 38 LEU H H 106 7.610 7.610 8.308 -0.698 18517 3876 1 4 . 1 1 39 39 ARG N N 107 116.670 116.670 118.858 -2.188 18517 3877 1 4 . 1 1 39 39 ARG HA H 107 3.680 3.680 3.890 -0.210 18517 3878 1 4 . 1 1 39 39 ARG C C 107 179.480 179.480 178.477 1.003 18517 3879 1 4 . 1 1 39 39 ARG CA C 107 59.580 59.580 58.523 1.057 18517 3880 1 4 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.562 1.678 18517 3881 1 4 . 1 1 39 39 ARG H H 107 8.240 8.240 7.811 0.429 18517 3882 1 4 . 1 1 40 40 VAL N N 108 121.970 121.970 120.494 1.476 18517 3883 1 4 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.576 -0.176 18517 3884 1 4 . 1 1 40 40 VAL C C 108 178.440 178.440 177.654 0.786 18517 3885 1 4 . 1 1 40 40 VAL CA C 108 67.950 67.950 67.318 0.632 18517 3886 1 4 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.883 -1.443 18517 3887 1 4 . 1 1 40 40 VAL H H 108 8.200 8.200 8.003 0.197 18517 3888 1 4 . 1 1 41 41 VAL N N 109 108.940 108.940 116.055 -7.115 18517 3889 1 4 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.383 0.857 18517 3890 1 4 . 1 1 41 41 VAL C C 109 175.070 175.070 177.122 -2.052 18517 3891 1 4 . 1 1 41 41 VAL CA C 109 62.590 62.590 66.045 -3.455 18517 3892 1 4 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.925 -1.275 18517 3893 1 4 . 1 1 41 41 VAL H H 109 7.760 7.760 7.988 -0.228 18517 3894 1 4 . 1 1 42 42 ASP N N 110 124.670 124.670 120.598 4.072 18517 3895 1 4 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.158 0.462 18517 3896 1 4 . 1 1 42 42 ASP C C 110 177.310 177.310 177.972 -0.662 18517 3897 1 4 . 1 1 42 42 ASP CA C 110 59.980 59.980 57.645 2.335 18517 3898 1 4 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.688 4.262 18517 3899 1 4 . 1 1 42 42 ASP H H 110 7.360 7.360 8.129 -0.769 18517 3900 1 4 . 1 1 43 43 THR N N 111 102.340 102.340 113.849 -11.509 18517 3901 1 4 . 1 1 43 43 THR HA H 111 5.100 5.100 4.118 0.982 18517 3902 1 4 . 1 1 43 43 THR C C 111 174.940 174.940 176.241 -1.301 18517 3903 1 4 . 1 1 43 43 THR CA C 111 60.650 60.650 64.899 -4.249 18517 3904 1 4 . 1 1 43 43 THR CB C 111 69.610 69.610 68.709 0.901 18517 3905 1 4 . 1 1 43 43 THR H H 111 6.380 6.380 7.743 -1.363 18517 3906 1 4 . 1 1 44 44 ASP N N 112 119.750 119.750 122.598 -2.848 18517 3907 1 4 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.401 -0.541 18517 3908 1 4 . 1 1 44 44 ASP C C 112 178.850 178.850 178.076 0.774 18517 3909 1 4 . 1 1 44 44 ASP CA C 112 58.230 58.230 58.085 0.145 18517 3910 1 4 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.489 -1.089 18517 3911 1 4 . 1 1 44 44 ASP H H 112 9.050 9.050 8.597 0.453 18517 3912 1 4 . 1 1 45 45 LEU N N 113 123.910 123.910 121.442 2.468 18517 3913 1 4 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.965 -0.155 18517 3914 1 4 . 1 1 45 45 LEU C C 113 182.040 182.040 177.983 4.057 18517 3915 1 4 . 1 1 45 45 LEU CA C 113 57.320 57.320 58.249 -0.930 18517 3916 1 4 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.785 -1.036 18517 3917 1 4 . 1 1 45 45 LEU H H 113 9.710 9.710 7.952 1.758 18517 3918 1 4 . 1 1 46 46 LEU N N 114 117.640 117.640 117.379 0.261 18517 3919 1 4 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.219 -0.109 18517 3920 1 4 . 1 1 46 46 LEU C C 114 179.540 179.540 178.900 0.640 18517 3921 1 4 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.582 -0.022 18517 3922 1 4 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.628 -0.158 18517 3923 1 4 . 1 1 46 46 LEU H H 114 8.270 8.270 7.362 0.908 18517 3924 1 4 . 1 1 47 47 LEU N N 115 116.520 116.520 116.411 0.109 18517 3925 1 4 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.310 -0.170 18517 3926 1 4 . 1 1 47 47 LEU C C 115 173.850 173.850 176.582 -2.732 18517 3927 1 4 . 1 1 47 47 LEU CA C 115 55.420 55.420 55.152 0.268 18517 3928 1 4 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.546 3.174 18517 3929 1 4 . 1 1 47 47 LEU H H 115 8.160 8.160 8.014 0.146 18517 3930 1 4 . 1 1 48 48 LYS N N 116 114.710 114.710 115.086 -0.376 18517 3931 1 4 . 1 1 48 48 LYS HA H 116 3.810 3.810 4.103 -0.293 18517 3932 1 4 . 1 1 48 48 LYS C C 116 176.510 176.510 176.308 0.202 18517 3933 1 4 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.701 0.499 18517 3934 1 4 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.459 -0.439 18517 3935 1 4 . 1 1 48 48 LYS H H 116 7.580 7.580 7.810 -0.230 18517 3936 1 4 . 1 1 49 49 VAL N N 117 119.050 119.050 114.731 4.319 18517 3937 1 4 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.118 -0.508 18517 3938 1 4 . 1 1 49 49 VAL C C 117 175.860 175.860 175.845 0.015 18517 3939 1 4 . 1 1 49 49 VAL CA C 117 63.510 63.510 61.996 1.514 18517 3940 1 4 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.621 -0.271 18517 3941 1 4 . 1 1 49 49 VAL H H 117 7.980 7.980 7.950 0.030 18517 3942 1 4 . 1 1 50 50 ASP N N 118 126.900 126.900 121.838 5.062 18517 3943 1 4 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.572 -0.322 18517 3944 1 4 . 1 1 50 50 ASP C C 118 177.700 177.700 177.342 0.358 18517 3945 1 4 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.668 0.382 18517 3946 1 4 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.160 1.421 18517 3947 1 4 . 1 1 50 50 ASP H H 118 8.930 8.930 8.558 0.372 18517 3948 1 4 . 1 1 51 51 SER N N 119 124.790 124.790 120.668 4.122 18517 3949 1 4 . 1 1 51 51 SER HA H 119 4.070 4.070 4.182 -0.112 18517 3950 1 4 . 1 1 51 51 SER C C 119 177.220 177.220 176.368 0.852 18517 3951 1 4 . 1 1 51 51 SER CA C 119 61.640 61.640 62.167 -0.527 18517 3952 1 4 . 1 1 51 51 SER CB C 119 63.510 63.510 63.087 0.422 18517 3953 1 4 . 1 1 51 51 SER H H 119 8.560 8.560 8.876 -0.316 18517 3954 1 4 . 1 1 52 52 THR N N 120 119.880 119.880 116.647 3.233 18517 3955 1 4 . 1 1 52 52 THR HA H 120 4.190 4.190 4.130 0.060 18517 3956 1 4 . 1 1 52 52 THR C C 120 177.120 177.120 176.361 0.759 18517 3957 1 4 . 1 1 52 52 THR CA C 120 66.280 66.280 66.226 0.054 18517 3958 1 4 . 1 1 52 52 THR CB C 120 68.420 68.420 68.361 0.059 18517 3959 1 4 . 1 1 52 52 THR H H 120 8.310 8.310 8.324 -0.014 18517 3960 1 4 . 1 1 53 53 LYS N N 121 122.270 122.270 122.852 -0.582 18517 3961 1 4 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.097 0.023 18517 3962 1 4 . 1 1 53 53 LYS C C 121 178.970 178.970 178.672 0.298 18517 3963 1 4 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.808 -0.228 18517 3964 1 4 . 1 1 53 53 LYS CB C 121 34.250 34.250 32.114 2.136 18517 3965 1 4 . 1 1 53 53 LYS H H 121 7.700 7.700 7.362 0.338 18517 3966 1 4 . 1 1 54 54 VAL N N 122 120.070 120.070 120.529 -0.459 18517 3967 1 4 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.856 -0.426 18517 3968 1 4 . 1 1 54 54 VAL C C 122 179.860 179.860 177.413 2.447 18517 3969 1 4 . 1 1 54 54 VAL CA C 122 68.580 68.580 66.021 2.559 18517 3970 1 4 . 1 1 54 54 VAL CB C 122 32.820 32.820 32.044 0.776 18517 3971 1 4 . 1 1 54 54 VAL H H 122 7.890 7.890 8.168 -0.278 18517 3972 1 4 . 1 1 55 55 ASP N N 123 122.270 122.270 119.432 2.838 18517 3973 1 4 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.375 0.095 18517 3974 1 4 . 1 1 55 55 ASP C C 123 178.630 178.630 178.984 -0.354 18517 3975 1 4 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.802 -0.002 18517 3976 1 4 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.906 1.114 18517 3977 1 4 . 1 1 55 55 ASP H H 123 8.270 8.270 8.238 0.032 18517 3978 1 4 . 1 1 56 56 GLU N N 124 119.600 119.600 119.436 0.164 18517 3979 1 4 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.117 -0.147 18517 3980 1 4 . 1 1 56 56 GLU C C 124 179.920 179.920 178.861 1.059 18517 3981 1 4 . 1 1 56 56 GLU CA C 124 60.060 60.060 58.916 1.144 18517 3982 1 4 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.488 0.481 18517 3983 1 4 . 1 1 56 56 GLU H H 124 8.610 8.610 8.225 0.385 18517 3984 1 4 . 1 1 57 57 ALA N N 125 120.070 120.070 122.294 -2.224 18517 3985 1 4 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.121 -0.291 18517 3986 1 4 . 1 1 57 57 ALA C C 125 178.760 178.760 179.647 -0.887 18517 3987 1 4 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.943 0.437 18517 3988 1 4 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.492 1.648 18517 3989 1 4 . 1 1 57 57 ALA H H 125 8.420 8.420 8.373 0.047 18517 3990 1 4 . 1 1 58 58 GLY N N 126 106.740 106.740 106.125 0.615 18517 3991 1 4 . 1 1 58 58 GLY C C 126 175.740 175.740 175.912 -0.172 18517 3992 1 4 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.788 0.502 18517 3993 1 4 . 1 1 58 58 GLY H H 126 8.200 8.200 8.740 -0.540 18517 3994 1 4 . 1 1 59 59 LYS N N 127 120.920 120.920 122.072 -1.152 18517 3995 1 4 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.096 -0.166 18517 3996 1 4 . 1 1 59 59 LYS C C 127 180.320 180.320 178.798 1.522 18517 3997 1 4 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.176 1.034 18517 3998 1 4 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.381 0.599 18517 3999 1 4 . 1 1 59 59 LYS H H 127 8.000 8.000 7.923 0.077 18517 4000 1 4 . 1 1 60 60 LYS N N 128 118.400 118.400 119.668 -1.268 18517 4001 1 4 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.161 0.009 18517 4002 1 4 . 1 1 60 60 LYS C C 128 180.030 180.030 178.963 1.067 18517 4003 1 4 . 1 1 60 60 LYS CA C 128 58.750 58.750 59.540 -0.790 18517 4004 1 4 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.469 -0.199 18517 4005 1 4 . 1 1 60 60 LYS H H 128 7.170 7.170 7.918 -0.748 18517 4006 1 4 . 1 1 61 61 VAL N N 129 121.050 121.050 121.110 -0.060 18517 4007 1 4 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.318 -0.038 18517 4008 1 4 . 1 1 61 61 VAL C C 129 177.120 177.120 177.570 -0.450 18517 4009 1 4 . 1 1 61 61 VAL CA C 129 67.350 67.350 67.413 -0.063 18517 4010 1 4 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.377 0.253 18517 4011 1 4 . 1 1 61 61 VAL H H 129 7.980 7.980 8.041 -0.061 18517 4012 1 4 . 1 1 62 62 LYS N N 130 120.040 120.040 119.949 0.091 18517 4013 1 4 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.899 -0.199 18517 4014 1 4 . 1 1 62 62 LYS C C 130 178.550 178.550 178.631 -0.081 18517 4015 1 4 . 1 1 62 62 LYS CA C 130 60.330 60.330 60.035 0.295 18517 4016 1 4 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.303 1.467 18517 4017 1 4 . 1 1 62 62 LYS H H 130 8.910 8.910 8.366 0.544 18517 4018 1 4 . 1 1 63 63 ALA N N 131 119.570 119.570 122.105 -2.535 18517 4019 1 4 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.035 0.185 18517 4020 1 4 . 1 1 63 63 ALA C C 131 180.520 180.520 179.318 1.202 18517 4021 1 4 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.181 0.039 18517 4022 1 4 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.144 0.326 18517 4023 1 4 . 1 1 63 63 ALA H H 131 7.920 7.920 8.115 -0.195 18517 4024 1 4 . 1 1 64 64 TYR N N 132 120.510 120.510 120.465 0.045 18517 4025 1 4 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.176 0.284 18517 4026 1 4 . 1 1 64 64 TYR C C 132 176.510 176.510 177.853 -1.343 18517 4027 1 4 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.809 -0.169 18517 4028 1 4 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.618 0.072 18517 4029 1 4 . 1 1 64 64 TYR H H 132 7.930 7.930 8.216 -0.286 18517 4030 1 4 . 1 1 65 65 LEU N N 133 117.290 117.290 118.755 -1.465 18517 4031 1 4 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.562 0.278 18517 4032 1 4 . 1 1 65 65 LEU C C 133 178.610 178.610 179.304 -0.694 18517 4033 1 4 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.020 -0.300 18517 4034 1 4 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.692 -1.262 18517 4035 1 4 . 1 1 65 65 LEU H H 133 8.240 8.240 8.447 -0.207 18517 4036 1 4 . 1 1 66 66 GLU N N 134 119.140 119.140 118.136 1.004 18517 4037 1 4 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.040 -0.180 18517 4038 1 4 . 1 1 66 66 GLU C C 134 180.200 180.200 178.355 1.845 18517 4039 1 4 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.636 1.304 18517 4040 1 4 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.418 0.392 18517 4041 1 4 . 1 1 66 66 GLU H H 134 8.370 8.370 8.767 -0.397 18517 4042 1 4 . 1 1 67 67 LYS N N 135 121.390 121.390 120.381 1.009 18517 4043 1 4 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.092 -0.092 18517 4044 1 4 . 1 1 67 67 LYS C C 135 179.080 179.080 178.384 0.696 18517 4045 1 4 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.930 0.690 18517 4046 1 4 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.601 -0.331 18517 4047 1 4 . 1 1 67 67 LYS H H 135 7.820 7.820 7.689 0.131 18517 4048 1 4 . 1 1 68 68 ILE N N 136 110.310 110.310 111.955 -1.645 18517 4049 1 4 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.101 0.199 18517 4050 1 4 . 1 1 68 68 ILE C C 136 175.520 175.520 176.834 -1.314 18517 4051 1 4 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.994 0.436 18517 4052 1 4 . 1 1 68 68 ILE CB C 136 37.980 37.980 39.041 -1.061 18517 4053 1 4 . 1 1 68 68 ILE H H 136 7.380 7.380 7.669 -0.289 18517 4054 1 4 . 1 1 69 69 GLY N N 137 106.680 106.680 108.442 -1.762 18517 4055 1 4 . 1 1 69 69 GLY C C 137 174.160 174.160 173.549 0.611 18517 4056 1 4 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.495 0.975 18517 4057 1 4 . 1 1 69 69 GLY H H 137 7.470 7.470 8.028 -0.558 18517 4058 1 4 . 1 1 70 70 ILE N N 138 124.310 124.310 121.500 2.810 18517 4059 1 4 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.414 -0.214 18517 4060 1 4 . 1 1 70 70 ILE C C 138 174.190 174.190 174.714 -0.524 18517 4061 1 4 . 1 1 70 70 ILE CA C 138 59.380 59.380 59.285 0.095 18517 4062 1 4 . 1 1 70 70 ILE CB C 138 37.340 37.340 38.155 -0.815 18517 4063 1 4 . 1 1 70 70 ILE H H 138 8.530 8.530 8.168 0.362 18517 4064 1 4 . 1 1 71 71 ARG N N 139 125.490 125.490 126.679 -1.189 18517 4065 1 4 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.534 0.086 18517 4066 1 4 . 1 1 71 71 ARG C C 139 175.750 175.750 175.116 0.634 18517 4067 1 4 . 1 1 71 71 ARG CA C 139 54.660 54.660 54.728 -0.068 18517 4068 1 4 . 1 1 71 71 ARG CB C 139 33.140 33.140 32.248 0.892 18517 4069 1 4 . 1 1 71 71 ARG H H 139 8.240 8.240 8.317 -0.077 18517 4070 1 4 . 1 1 72 72 GLY N N 140 104.750 104.750 110.418 -5.668 18517 4071 1 4 . 1 1 72 72 GLY C C 140 172.920 172.920 173.283 -0.363 18517 4072 1 4 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.354 1.076 18517 4073 1 4 . 1 1 72 72 GLY H H 140 7.900 7.900 8.519 -0.619 18517 4074 1 4 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.494 0.016 18517 4075 1 4 . 1 1 73 73 ASP C C 141 175.060 175.060 176.739 -1.679 18517 4076 1 4 . 1 1 73 73 ASP CA C 141 56.170 56.170 55.558 0.612 18517 4077 1 4 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.264 -0.434 18517 4078 1 4 . 1 1 74 74 SER N N 142 110.240 110.240 113.258 -3.018 18517 4079 1 4 . 1 1 74 74 SER HA H 142 4.740 4.740 4.697 0.043 18517 4080 1 4 . 1 1 74 74 SER C C 142 175.110 175.110 174.545 0.565 18517 4081 1 4 . 1 1 74 74 SER CA C 142 55.700 55.700 56.447 -0.747 18517 4082 1 4 . 1 1 74 74 SER CB C 142 67.390 67.390 65.407 1.983 18517 4083 1 4 . 1 1 74 74 SER H H 142 7.560 7.560 7.540 0.020 18517 4084 1 4 . 1 1 75 75 VAL N N 143 122.950 122.950 120.656 2.294 18517 4085 1 4 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.855 -0.125 18517 4086 1 4 . 1 1 75 75 VAL C C 143 176.230 176.230 177.350 -1.120 18517 4087 1 4 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.639 1.001 18517 4088 1 4 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.397 -0.157 18517 4089 1 4 . 1 1 75 75 VAL H H 143 9.470 9.470 8.914 0.556 18517 4090 1 4 . 1 1 76 76 GLU N N 144 121.390 121.390 121.174 0.216 18517 4091 1 4 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.187 -0.547 18517 4092 1 4 . 1 1 76 76 GLU C C 144 176.880 176.880 178.569 -1.689 18517 4093 1 4 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.359 3.951 18517 4094 1 4 . 1 1 76 76 GLU CB C 144 28.070 28.070 27.873 0.196 18517 4095 1 4 . 1 1 76 76 GLU H H 144 9.640 9.640 8.916 0.724 18517 4096 1 4 . 1 1 77 77 ALA N N 145 118.770 118.770 122.774 -4.004 18517 4097 1 4 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.290 -0.030 18517 4098 1 4 . 1 1 77 77 ALA C C 145 180.350 180.350 179.548 0.802 18517 4099 1 4 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.334 0.446 18517 4100 1 4 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.276 0.914 18517 4101 1 4 . 1 1 77 77 ALA H H 145 7.860 7.860 8.219 -0.359 18517 4102 1 4 . 1 1 78 78 ALA N N 146 120.920 120.920 122.715 -1.795 18517 4103 1 4 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.013 0.127 18517 4104 1 4 . 1 1 78 78 ALA C C 146 179.150 179.150 179.250 -0.100 18517 4105 1 4 . 1 1 78 78 ALA CA C 146 55.260 55.260 54.892 0.368 18517 4106 1 4 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.459 0.331 18517 4107 1 4 . 1 1 78 78 ALA H H 146 8.110 8.110 8.012 0.098 18517 4108 1 4 . 1 1 79 79 LEU N N 147 118.810 118.810 119.604 -0.794 18517 4109 1 4 . 1 1 79 79 LEU HA H 147 3.880 3.880 3.945 -0.065 18517 4110 1 4 . 1 1 79 79 LEU C C 147 179.080 179.080 179.069 0.011 18517 4111 1 4 . 1 1 79 79 LEU CA C 147 58.390 58.390 58.440 -0.050 18517 4112 1 4 . 1 1 79 79 LEU CB C 147 42.260 42.260 41.105 1.155 18517 4113 1 4 . 1 1 79 79 LEU H H 147 8.360 8.360 8.256 0.104 18517 4114 1 4 . 1 1 80 80 ASP N N 148 121.620 121.620 119.488 2.132 18517 4115 1 4 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.273 0.247 18517 4116 1 4 . 1 1 80 80 ASP C C 148 178.800 178.800 178.602 0.198 18517 4117 1 4 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.222 0.168 18517 4118 1 4 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.406 0.344 18517 4119 1 4 . 1 1 80 80 ASP H H 148 8.770 8.770 8.407 0.363 18517 4120 1 4 . 1 1 81 81 ASN N N 149 118.630 118.630 119.231 -0.601 18517 4121 1 4 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.557 0.013 18517 4122 1 4 . 1 1 81 81 ASN C C 149 177.970 177.970 177.942 0.028 18517 4123 1 4 . 1 1 81 81 ASN CA C 149 56.010 56.010 55.978 0.031 18517 4124 1 4 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.492 0.118 18517 4125 1 4 . 1 1 81 81 ASN H H 149 7.960 7.960 7.914 0.046 18517 4126 1 4 . 1 1 82 82 LEU N N 150 120.030 120.030 120.937 -0.907 18517 4127 1 4 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.908 0.152 18517 4128 1 4 . 1 1 82 82 LEU C C 150 177.790 177.790 179.228 -1.438 18517 4129 1 4 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.025 0.845 18517 4130 1 4 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.786 0.074 18517 4131 1 4 . 1 1 82 82 LEU H H 150 8.230 8.230 8.528 -0.298 18517 4132 1 4 . 1 1 83 83 MET N N 151 115.820 115.820 118.426 -2.606 18517 4133 1 4 . 1 1 83 83 MET HA H 151 4.390 4.390 3.969 0.421 18517 4134 1 4 . 1 1 83 83 MET C C 151 179.760 179.760 178.895 0.865 18517 4135 1 4 . 1 1 83 83 MET CA C 151 57.400 57.400 57.958 -0.558 18517 4136 1 4 . 1 1 83 83 MET CB C 151 31.080 31.080 31.498 -0.418 18517 4137 1 4 . 1 1 83 83 MET H H 151 8.800 8.800 8.443 0.357 18517 4138 1 4 . 1 1 84 84 ILE N N 152 120.330 120.330 119.725 0.605 18517 4139 1 4 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.847 -0.007 18517 4140 1 4 . 1 1 84 84 ILE C C 152 178.660 178.660 178.395 0.265 18517 4141 1 4 . 1 1 84 84 ILE CA C 152 65.800 65.800 64.325 1.476 18517 4142 1 4 . 1 1 84 84 ILE CB C 152 38.450 38.450 36.251 2.199 18517 4143 1 4 . 1 1 84 84 ILE H H 152 8.540 8.540 8.644 -0.104 18517 4144 1 4 . 1 1 85 85 LYS N N 153 118.930 118.930 120.005 -1.075 18517 4145 1 4 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.332 -0.132 18517 4146 1 4 . 1 1 85 85 LYS C C 153 179.650 179.650 179.801 -0.151 18517 4147 1 4 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.749 1.231 18517 4148 1 4 . 1 1 85 85 LYS CB C 153 33.540 33.540 31.945 1.595 18517 4149 1 4 . 1 1 85 85 LYS H H 153 7.510 7.510 8.319 -0.809 18517 4150 1 4 . 1 1 86 86 VAL N N 154 119.810 119.810 120.049 -0.239 18517 4151 1 4 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.650 -0.020 18517 4152 1 4 . 1 1 86 86 VAL C C 154 178.350 178.350 178.085 0.265 18517 4153 1 4 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.516 0.714 18517 4154 1 4 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.789 0.951 18517 4155 1 4 . 1 1 86 86 VAL H H 154 8.740 8.740 8.060 0.680 18517 4156 1 4 . 1 1 87 87 TYR N N 155 118.370 118.370 118.856 -0.486 18517 4157 1 4 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.206 0.064 18517 4158 1 4 . 1 1 87 87 TYR C C 155 178.580 178.580 178.331 0.249 18517 4159 1 4 . 1 1 87 87 TYR CA C 155 62.910 62.910 60.910 2.000 18517 4160 1 4 . 1 1 87 87 TYR CB C 155 37.980 37.980 36.904 1.076 18517 4161 1 4 . 1 1 87 87 TYR H H 155 8.520 8.520 8.422 0.098 18517 4162 1 4 . 1 1 88 88 GLU N N 156 119.900 119.900 120.388 -0.488 18517 4163 1 4 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.073 0.107 18517 4164 1 4 . 1 1 88 88 GLU C C 156 179.270 179.270 178.923 0.347 18517 4165 1 4 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.675 -0.295 18517 4166 1 4 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.526 0.684 18517 4167 1 4 . 1 1 88 88 GLU H H 156 8.250 8.250 8.799 -0.549 18517 4168 1 4 . 1 1 89 89 ILE N N 157 119.510 119.510 118.887 0.623 18517 4169 1 4 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.940 0.140 18517 4170 1 4 . 1 1 89 89 ILE C C 157 177.890 177.890 178.597 -0.707 18517 4171 1 4 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.061 0.249 18517 4172 1 4 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.124 1.086 18517 4173 1 4 . 1 1 89 89 ILE H H 157 7.630 7.630 7.827 -0.197 18517 4174 1 4 . 1 1 90 90 THR N N 158 114.240 114.240 115.393 -1.153 18517 4175 1 4 . 1 1 90 90 THR HA H 158 4.130 4.130 4.070 0.060 18517 4176 1 4 . 1 1 90 90 THR C C 158 175.530 175.530 176.207 -0.677 18517 4177 1 4 . 1 1 90 90 THR CA C 158 64.460 64.460 65.770 -1.310 18517 4178 1 4 . 1 1 90 90 THR CB C 158 69.610 69.610 69.048 0.562 18517 4179 1 4 . 1 1 90 90 THR H H 158 7.770 7.770 8.149 -0.379 18517 4180 1 4 . 1 1 91 91 LYS N N 159 120.280 120.280 117.843 2.437 18517 4181 1 4 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.300 0.010 18517 4182 1 4 . 1 1 91 91 LYS C C 159 177.420 177.420 177.475 -0.055 18517 4183 1 4 . 1 1 91 91 LYS CA C 159 57.400 57.400 57.746 -0.346 18517 4184 1 4 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.440 -0.220 18517 4185 1 4 . 1 1 91 91 LYS H H 159 7.890 7.890 8.089 -0.199 18517 4186 1 4 . 1 1 92 92 GLY N N 160 107.910 107.910 107.315 0.595 18517 4187 1 4 . 1 1 92 92 GLY C C 160 174.430 174.430 172.841 1.589 18517 4188 1 4 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.197 0.783 18517 4189 1 4 . 1 1 92 92 GLY H H 160 7.930 7.930 8.521 -0.591 18517 4190 1 4 . 1 1 93 93 THR N N 161 113.570 113.570 116.612 -3.042 18517 4191 1 4 . 1 1 93 93 THR HA H 161 4.390 4.390 4.669 -0.279 18517 4192 1 4 . 1 1 93 93 THR C C 161 174.790 174.790 172.876 1.914 18517 4193 1 4 . 1 1 93 93 THR CA C 161 61.960 61.960 62.806 -0.846 18517 4194 1 4 . 1 1 93 93 THR CB C 161 70.010 70.010 70.290 -0.279 18517 4195 1 4 . 1 1 93 93 THR H H 161 7.970 7.970 7.995 -0.025 18517 4196 1 4 . 1 1 94 94 VAL N N 162 121.980 121.980 123.843 -1.863 18517 4197 1 4 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.261 -0.141 18517 4198 1 4 . 1 1 94 94 VAL C C 162 176.300 176.300 174.452 1.848 18517 4199 1 4 . 1 1 94 94 VAL CA C 162 62.830 62.830 62.194 0.636 18517 4200 1 4 . 1 1 94 94 VAL CB C 162 33.060 33.060 34.021 -0.961 18517 4201 1 4 . 1 1 94 94 VAL H H 162 8.130 8.130 8.259 -0.129 18517 4202 1 4 . 1 1 95 95 GLU N N 163 124.140 124.140 127.007 -2.867 18517 4203 1 4 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.493 -0.183 18517 4204 1 4 . 1 1 95 95 GLU C C 163 176.870 176.870 175.967 0.903 18517 4205 1 4 . 1 1 95 95 GLU CA C 163 57.080 57.080 55.223 1.857 18517 4206 1 4 . 1 1 95 95 GLU CB C 163 30.440 30.440 28.998 1.442 18517 4207 1 4 . 1 1 95 95 GLU H H 163 8.490 8.490 8.747 -0.257 18517 4208 1 4 . 1 1 96 96 SER N N 164 116.800 116.800 122.668 -5.868 18517 4209 1 4 . 1 1 96 96 SER HA H 164 4.430 4.430 4.380 0.050 18517 4210 1 4 . 1 1 96 96 SER C C 164 174.940 174.940 174.180 0.760 18517 4211 1 4 . 1 1 96 96 SER CA C 164 59.070 59.070 60.321 -1.251 18517 4212 1 4 . 1 1 96 96 SER CB C 164 64.220 64.220 63.649 0.571 18517 4213 1 4 . 1 1 96 96 SER H H 164 8.300 8.300 8.068 0.232 18517 4214 1 4 . 1 1 97 97 SER C C 165 174.660 174.660 172.779 1.881 18517 4215 1 4 . 1 1 97 97 SER CA C 165 58.870 58.870 58.323 0.547 18517 4216 1 4 . 1 1 97 97 SER CB C 165 64.060 64.060 63.763 0.297 18517 4217 1 4 . 1 1 98 98 ALA N N 166 125.490 125.490 126.093 -0.603 18517 4218 1 4 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.503 -0.153 18517 4219 1 4 . 1 1 98 98 ALA C C 166 177.780 177.780 175.968 1.812 18517 4220 1 4 . 1 1 98 98 ALA CA C 166 53.000 53.000 52.175 0.826 18517 4221 1 4 . 1 1 98 98 ALA CB C 166 19.340 19.340 21.291 -1.951 18517 4222 1 4 . 1 1 98 98 ALA H H 166 8.180 8.180 8.895 -0.715 18517 4223 1 4 . 1 1 99 99 GLN N N 167 118.690 118.690 119.670 -0.980 18517 4224 1 4 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.094 0.246 18517 4225 1 4 . 1 1 99 99 GLN C C 167 176.680 176.680 174.484 2.196 18517 4226 1 4 . 1 1 99 99 GLN CA C 167 56.250 56.250 55.812 0.438 18517 4227 1 4 . 1 1 99 99 GLN CB C 167 29.650 29.650 27.624 2.026 18517 4228 1 4 . 1 1 99 99 GLN H H 167 8.170 8.170 8.459 -0.289 18517 4229 1 4 . 1 1 100 100 GLY N N 168 109.670 109.670 111.928 -2.258 18517 4230 1 4 . 1 1 100 100 GLY C C 168 174.460 174.460 173.375 1.085 18517 4231 1 4 . 1 1 100 100 GLY CA C 168 45.670 45.670 44.272 1.398 18517 4232 1 4 . 1 1 100 100 GLY H H 168 8.250 8.250 8.166 0.084 18517 4233 1 4 . 1 1 101 101 THR N N 169 112.660 112.660 116.278 -3.618 18517 4234 1 4 . 1 1 101 101 THR HA H 169 4.360 4.360 4.542 -0.182 18517 4235 1 4 . 1 1 101 101 THR C C 169 174.720 174.720 173.575 1.145 18517 4236 1 4 . 1 1 101 101 THR CA C 169 62.080 62.080 61.083 0.997 18517 4237 1 4 . 1 1 101 101 THR CB C 169 69.930 69.930 69.705 0.225 18517 4238 1 4 . 1 1 101 101 THR H H 169 8.070 8.070 8.358 -0.288 18517 4239 1 4 . 1 1 102 102 ASP N N 170 123.090 123.090 121.606 1.484 18517 4240 1 4 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.891 -0.191 18517 4241 1 4 . 1 1 102 102 ASP C C 170 176.130 176.130 175.149 0.981 18517 4242 1 4 . 1 1 102 102 ASP CA C 170 54.780 54.780 52.912 1.868 18517 4243 1 4 . 1 1 102 102 ASP CB C 170 42.260 42.260 43.683 -1.423 18517 4244 1 4 . 1 1 102 102 ASP H H 170 8.170 8.170 8.438 -0.268 18517 4245 1 4 . 1 1 103 103 SER N N 171 117.110 117.110 114.446 2.664 18517 4246 1 4 . 1 1 103 103 SER HA H 171 4.430 4.430 4.550 -0.120 18517 4247 1 4 . 1 1 103 103 SER C C 171 174.770 174.770 175.287 -0.517 18517 4248 1 4 . 1 1 103 103 SER CA C 171 57.960 57.960 55.808 2.152 18517 4249 1 4 . 1 1 103 103 SER CB C 171 64.940 64.940 65.365 -0.425 18517 4250 1 4 . 1 1 103 103 SER H H 171 8.450 8.450 8.156 0.294 18517 4251 1 4 . 1 1 104 104 GLU N N 172 122.970 122.970 121.751 1.219 18517 4252 1 4 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.932 0.098 18517 4253 1 4 . 1 1 104 104 GLU C C 172 178.860 178.860 178.197 0.663 18517 4254 1 4 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.381 -0.681 18517 4255 1 4 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.730 -0.080 18517 4256 1 4 . 1 1 104 104 GLU H H 172 8.830 8.830 8.990 -0.160 18517 4257 1 4 . 1 1 105 105 GLU N N 173 119.750 119.750 118.693 1.057 18517 4258 1 4 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.044 -0.064 18517 4259 1 4 . 1 1 105 105 GLU C C 173 178.920 178.920 179.072 -0.152 18517 4260 1 4 . 1 1 105 105 GLU CA C 173 60.060 60.060 58.907 1.153 18517 4261 1 4 . 1 1 105 105 GLU CB C 173 29.730 29.730 29.178 0.552 18517 4262 1 4 . 1 1 105 105 GLU H H 173 8.580 8.580 8.711 -0.131 18517 4263 1 4 . 1 1 106 106 LEU N N 174 121.860 121.860 119.991 1.869 18517 4264 1 4 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.052 0.128 18517 4265 1 4 . 1 1 106 106 LEU C C 174 178.210 178.210 178.855 -0.645 18517 4266 1 4 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.249 0.631 18517 4267 1 4 . 1 1 106 106 LEU CB C 174 41.150 41.150 40.969 0.181 18517 4268 1 4 . 1 1 106 106 LEU H H 174 7.920 7.920 7.546 0.374 18517 4269 1 4 . 1 1 107 107 LYS N N 175 118.740 118.740 119.720 -0.980 18517 4270 1 4 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.886 -0.106 18517 4271 1 4 . 1 1 107 107 LYS C C 175 178.700 178.700 179.212 -0.512 18517 4272 1 4 . 1 1 107 107 LYS CA C 175 61.170 61.170 60.364 0.806 18517 4273 1 4 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.225 0.205 18517 4274 1 4 . 1 1 107 107 LYS H H 175 8.340 8.340 8.494 -0.154 18517 4275 1 4 . 1 1 108 108 THR N N 176 113.820 113.820 117.329 -3.509 18517 4276 1 4 . 1 1 108 108 THR HA H 176 3.840 3.840 3.961 -0.121 18517 4277 1 4 . 1 1 108 108 THR C C 176 176.620 176.620 176.463 0.157 18517 4278 1 4 . 1 1 108 108 THR CA C 176 66.910 66.910 66.540 0.370 18517 4279 1 4 . 1 1 108 108 THR CB C 176 69.610 69.610 68.733 0.877 18517 4280 1 4 . 1 1 108 108 THR H H 176 7.950 7.950 8.506 -0.556 18517 4281 1 4 . 1 1 109 109 LEU N N 177 124.380 124.380 122.820 1.560 18517 4282 1 4 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.042 -0.212 18517 4283 1 4 . 1 1 109 109 LEU C C 177 177.790 177.790 178.023 -0.233 18517 4284 1 4 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.946 0.044 18517 4285 1 4 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.175 1.405 18517 4286 1 4 . 1 1 109 109 LEU H H 177 7.480 7.480 7.912 -0.432 18517 4287 1 4 . 1 1 110 110 LEU N N 178 117.230 117.230 118.925 -1.695 18517 4288 1 4 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.836 0.004 18517 4289 1 4 . 1 1 110 110 LEU C C 178 179.540 179.540 179.498 0.042 18517 4290 1 4 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.837 0.554 18517 4291 1 4 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.386 0.954 18517 4292 1 4 . 1 1 110 110 LEU H H 178 8.670 8.670 7.910 0.760 18517 4293 1 4 . 1 1 111 111 LEU N N 179 119.230 119.230 120.640 -1.410 18517 4294 1 4 . 1 1 111 111 LEU HA H 179 4.080 4.080 3.999 0.081 18517 4295 1 4 . 1 1 111 111 LEU C C 179 179.310 179.310 178.935 0.375 18517 4296 1 4 . 1 1 111 111 LEU CA C 179 58.390 58.390 58.307 0.083 18517 4297 1 4 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.614 1.406 18517 4298 1 4 . 1 1 111 111 LEU H H 179 7.940 7.940 8.630 -0.690 18517 4299 1 4 . 1 1 112 112 LYS N N 180 121.910 121.910 119.840 2.070 18517 4300 1 4 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.150 0.040 18517 4301 1 4 . 1 1 112 112 LYS C C 180 178.740 178.740 179.440 -0.700 18517 4302 1 4 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.290 -0.110 18517 4303 1 4 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.138 -0.268 18517 4304 1 4 . 1 1 112 112 LYS H H 180 7.420 7.420 8.115 -0.695 18517 4305 1 4 . 1 1 113 113 PHE N N 181 118.220 118.220 120.230 -2.010 18517 4306 1 4 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.293 0.457 18517 4307 1 4 . 1 1 113 113 PHE C C 181 178.520 178.520 178.187 0.333 18517 4308 1 4 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.736 -3.656 18517 4309 1 4 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.279 -0.299 18517 4310 1 4 . 1 1 113 113 PHE H H 181 9.000 9.000 8.607 0.393 18517 4311 1 4 . 1 1 114 114 SER N N 182 113.300 113.300 114.305 -1.005 18517 4312 1 4 . 1 1 114 114 SER HA H 182 3.930 3.930 4.210 -0.280 18517 4313 1 4 . 1 1 114 114 SER C C 182 177.080 177.080 177.108 -0.028 18517 4314 1 4 . 1 1 114 114 SER CA C 182 62.000 62.000 61.757 0.243 18517 4315 1 4 . 1 1 114 114 SER CB C 182 63.510 63.510 62.794 0.716 18517 4316 1 4 . 1 1 114 114 SER H H 182 8.620 8.620 8.626 -0.006 18517 4317 1 4 . 1 1 115 115 GLU N N 183 121.540 121.540 122.249 -0.709 18517 4318 1 4 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.003 0.067 18517 4319 1 4 . 1 1 115 115 GLU C C 183 179.860 179.860 178.278 1.582 18517 4320 1 4 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.643 0.137 18517 4321 1 4 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.613 0.277 18517 4322 1 4 . 1 1 115 115 GLU H H 183 8.250 8.250 8.636 -0.386 18517 4323 1 4 . 1 1 116 116 ASP N N 184 121.740 121.740 121.038 0.702 18517 4324 1 4 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.379 0.131 18517 4325 1 4 . 1 1 116 116 ASP C C 184 179.570 179.570 178.253 1.317 18517 4326 1 4 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.569 -0.008 18517 4327 1 4 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.989 0.001 18517 4328 1 4 . 1 1 116 116 ASP H H 184 8.840 8.840 8.419 0.421 18517 4329 1 4 . 1 1 117 117 LEU N N 185 121.420 121.420 121.045 0.375 18517 4330 1 4 . 1 1 117 117 LEU HA H 185 4.130 4.130 3.989 0.141 18517 4331 1 4 . 1 1 117 117 LEU C C 185 178.840 178.840 178.347 0.493 18517 4332 1 4 . 1 1 117 117 LEU CA C 185 58.230 58.230 57.748 0.482 18517 4333 1 4 . 1 1 117 117 LEU CB C 185 42.650 42.650 42.080 0.570 18517 4334 1 4 . 1 1 117 117 LEU H H 185 8.350 8.350 8.145 0.205 18517 4335 1 4 . 1 1 118 118 LYS N N 186 119.640 119.640 119.382 0.258 18517 4336 1 4 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.805 0.315 18517 4337 1 4 . 1 1 118 118 LYS C C 186 178.820 178.820 178.317 0.503 18517 4338 1 4 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.758 -0.018 18517 4339 1 4 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.319 0.191 18517 4340 1 4 . 1 1 118 118 LYS H H 186 8.220 8.220 8.200 0.020 18517 4341 1 4 . 1 1 119 119 ALA N N 187 120.160 120.160 121.709 -1.549 18517 4342 1 4 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.041 0.119 18517 4343 1 4 . 1 1 119 119 ALA C C 187 180.450 180.450 179.991 0.459 18517 4344 1 4 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.321 -0.181 18517 4345 1 4 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.025 0.445 18517 4346 1 4 . 1 1 119 119 ALA H H 187 8.010 8.010 8.225 -0.215 18517 4347 1 4 . 1 1 120 120 GLU N N 188 117.930 117.930 117.882 0.048 18517 4348 1 4 . 1 1 120 120 GLU HA H 188 4.180 4.180 3.972 0.208 18517 4349 1 4 . 1 1 120 120 GLU C C 188 178.780 178.780 179.173 -0.393 18517 4350 1 4 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.169 -0.339 18517 4351 1 4 . 1 1 120 120 GLU CB C 188 29.970 29.970 28.987 0.983 18517 4352 1 4 . 1 1 120 120 GLU H H 188 7.640 7.640 8.055 -0.415 18517 4353 1 4 . 1 1 121 121 GLN N N 189 117.230 117.230 120.630 -3.400 18517 4354 1 4 . 1 1 121 121 GLN HA H 189 4.230 4.230 4.037 0.193 18517 4355 1 4 . 1 1 121 121 GLN C C 189 179.190 179.190 178.162 1.028 18517 4356 1 4 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.953 0.787 18517 4357 1 4 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.871 0.779 18517 4358 1 4 . 1 1 121 121 GLN H H 189 8.280 8.280 8.268 0.012 18517 4359 1 4 . 1 1 122 122 GLU N N 190 118.340 118.340 119.255 -0.915 18517 4360 1 4 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.952 0.168 18517 4361 1 4 . 1 1 122 122 GLU C C 190 178.210 178.210 179.302 -1.092 18517 4362 1 4 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.505 0.245 18517 4363 1 4 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.368 0.602 18517 4364 1 4 . 1 1 122 122 GLU H H 190 8.250 8.250 8.281 -0.031 18517 4365 1 4 . 1 1 123 123 LEU N N 191 118.930 118.930 122.140 -3.210 18517 4366 1 4 . 1 1 123 123 LEU HA H 191 4.090 4.090 4.091 -0.001 18517 4367 1 4 . 1 1 123 123 LEU C C 191 178.500 178.500 178.399 0.101 18517 4368 1 4 . 1 1 123 123 LEU CA C 191 57.000 57.000 57.440 -0.440 18517 4369 1 4 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.255 1.244 18517 4370 1 4 . 1 1 123 123 LEU H H 191 7.530 7.530 8.207 -0.677 18517 4371 1 4 . 1 1 124 124 HIS N N 192 115.650 115.650 119.611 -3.961 18517 4372 1 4 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.223 0.497 18517 4373 1 4 . 1 1 124 124 HIS C C 192 176.090 176.090 177.359 -1.269 18517 4374 1 4 . 1 1 124 124 HIS CA C 192 56.690 56.690 60.230 -3.540 18517 4375 1 4 . 1 1 124 124 HIS CB C 192 30.760 30.760 30.009 0.751 18517 4376 1 4 . 1 1 124 124 HIS H H 192 7.450 7.450 8.689 -1.239 18517 4377 1 4 . 1 1 125 125 SER N N 193 115.480 115.480 115.113 0.367 18517 4378 1 4 . 1 1 125 125 SER HA H 193 4.310 4.310 4.255 0.055 18517 4379 1 4 . 1 1 125 125 SER CA C 193 60.180 60.180 61.779 -1.599 18517 4380 1 4 . 1 1 125 125 SER CB C 193 64.060 64.060 62.889 1.171 18517 4381 1 4 . 1 1 125 125 SER H H 193 8.020 8.020 8.518 -0.498 18517 4382 1 4 . 1 1 126 126 GLU C C 194 177.410 177.410 178.791 -1.381 18517 4383 1 4 . 1 1 126 126 GLU CA C 194 57.840 57.840 58.982 -1.142 18517 4384 1 4 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.594 0.296 18517 4385 1 4 . 1 1 127 127 ALA N N 195 122.910 122.910 123.647 -0.737 18517 4386 1 4 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.009 0.181 18517 4387 1 4 . 1 1 127 127 ALA C C 195 178.610 178.610 179.462 -0.852 18517 4388 1 4 . 1 1 127 127 ALA CA C 195 53.790 53.790 55.179 -1.389 18517 4389 1 4 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.344 0.916 18517 4390 1 4 . 1 1 127 127 ALA H H 195 8.020 8.020 8.289 -0.269 18517 4391 1 4 . 1 1 128 128 LYS N N 196 117.770 117.770 117.050 0.720 18517 4392 1 4 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.044 0.216 18517 4393 1 4 . 1 1 128 128 LYS C C 196 177.400 177.400 176.536 0.864 18517 4394 1 4 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.723 2.277 18517 4395 1 4 . 1 1 128 128 LYS CB C 196 32.740 32.740 33.223 -0.483 18517 4396 1 4 . 1 1 128 128 LYS H H 196 7.990 7.990 7.702 0.288 18517 4397 1 4 . 1 1 129 129 GLY N N 197 109.010 109.010 108.158 0.852 18517 4398 1 4 . 1 1 129 129 GLY C C 197 175.770 175.770 175.155 0.615 18517 4399 1 4 . 1 1 129 129 GLY CA C 197 46.100 46.100 44.798 1.302 18517 4400 1 4 . 1 1 129 129 GLY H H 197 8.220 8.220 7.491 0.729 18517 4401 1 4 . 1 1 130 130 GLY N N 198 109.150 109.150 111.430 -2.280 18517 4402 1 4 . 1 1 130 130 GLY C C 198 174.760 174.760 175.530 -0.770 18517 4403 1 4 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.078 -0.148 18517 4404 1 4 . 1 1 130 130 GLY H H 198 8.210 8.210 9.013 -0.803 18517 4405 1 4 . 1 1 131 131 GLU N N 199 121.560 121.560 121.489 0.071 18517 4406 1 4 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.070 -0.050 18517 4407 1 4 . 1 1 131 131 GLU C C 199 178.500 178.500 178.325 0.175 18517 4408 1 4 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.167 0.733 18517 4409 1 4 . 1 1 131 131 GLU CB C 199 29.570 29.570 28.007 1.563 18517 4410 1 4 . 1 1 131 131 GLU H H 199 8.510 8.510 8.502 0.008 18517 4411 1 4 . 1 1 132 132 ALA N N 200 122.390 122.390 123.701 -1.311 18517 4412 1 4 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.102 0.098 18517 4413 1 4 . 1 1 132 132 ALA C C 200 180.360 180.360 179.401 0.959 18517 4414 1 4 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.678 0.102 18517 4415 1 4 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.185 0.205 18517 4416 1 4 . 1 1 132 132 ALA H H 200 8.190 8.190 7.847 0.343 18517 4417 1 4 . 1 1 133 133 LEU N N 201 120.800 120.800 120.742 0.058 18517 4418 1 4 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.079 0.131 18517 4419 1 4 . 1 1 133 133 LEU C C 201 179.270 179.270 178.573 0.697 18517 4420 1 4 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.798 -0.118 18517 4421 1 4 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.833 0.347 18517 4422 1 4 . 1 1 133 133 LEU H H 201 7.720 7.720 8.387 -0.667 18517 4423 1 4 . 1 1 134 134 LEU N N 202 120.680 120.680 119.308 1.372 18517 4424 1 4 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.969 0.011 18517 4425 1 4 . 1 1 134 134 LEU C C 202 179.030 179.030 178.282 0.748 18517 4426 1 4 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.910 0.520 18517 4427 1 4 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.131 0.489 18517 4428 1 4 . 1 1 134 134 LEU H H 202 8.470 8.470 8.628 -0.158 18517 4429 1 4 . 1 1 135 135 SER N N 203 113.290 113.290 115.954 -2.664 18517 4430 1 4 . 1 1 135 135 SER HA H 203 4.180 4.180 4.105 0.075 18517 4431 1 4 . 1 1 135 135 SER C C 203 177.300 177.300 176.894 0.406 18517 4432 1 4 . 1 1 135 135 SER CA C 203 62.080 62.080 62.569 -0.489 18517 4433 1 4 . 1 1 135 135 SER CB C 203 63.030 63.030 62.681 0.349 18517 4434 1 4 . 1 1 135 135 SER H H 203 8.210 8.210 8.306 -0.096 18517 4435 1 4 . 1 1 136 136 SER N N 204 117.500 117.500 118.734 -1.234 18517 4436 1 4 . 1 1 136 136 SER HA H 204 4.050 4.050 4.146 -0.096 18517 4437 1 4 . 1 1 136 136 SER C C 204 177.570 177.570 176.450 1.120 18517 4438 1 4 . 1 1 136 136 SER CA C 204 61.880 61.880 61.709 0.171 18517 4439 1 4 . 1 1 136 136 SER CB C 204 63.510 63.510 62.904 0.606 18517 4440 1 4 . 1 1 136 136 SER H H 204 7.730 7.730 8.135 -0.405 18517 4441 1 4 . 1 1 137 137 MET N N 205 122.500 122.500 122.766 -0.266 18517 4442 1 4 . 1 1 137 137 MET HA H 205 4.140 4.140 4.001 0.139 18517 4443 1 4 . 1 1 137 137 MET C C 205 177.680 177.680 177.790 -0.110 18517 4444 1 4 . 1 1 137 137 MET CA C 205 60.140 60.140 59.619 0.521 18517 4445 1 4 . 1 1 137 137 MET CB C 205 33.460 33.460 32.600 0.860 18517 4446 1 4 . 1 1 137 137 MET H H 205 8.170 8.170 8.665 -0.495 18517 4447 1 4 . 1 1 138 138 LYS N N 206 121.410 121.410 119.001 2.409 18517 4448 1 4 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.965 -0.215 18517 4449 1 4 . 1 1 138 138 LYS C C 206 178.780 178.780 179.001 -0.221 18517 4450 1 4 . 1 1 138 138 LYS CA C 206 60.330 60.330 60.080 0.250 18517 4451 1 4 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.511 -0.241 18517 4452 1 4 . 1 1 138 138 LYS H H 206 8.810 8.810 8.488 0.322 18517 4453 1 4 . 1 1 139 139 THR N N 207 116.580 116.580 117.077 -0.497 18517 4454 1 4 . 1 1 139 139 THR HA H 207 4.060 4.060 3.946 0.114 18517 4455 1 4 . 1 1 139 139 THR C C 207 176.730 176.730 177.132 -0.402 18517 4456 1 4 . 1 1 139 139 THR CA C 207 67.150 67.150 66.920 0.230 18517 4457 1 4 . 1 1 139 139 THR CB C 207 69.220 69.220 68.681 0.538 18517 4458 1 4 . 1 1 139 139 THR H H 207 7.930 7.930 8.136 -0.206 18517 4459 1 4 . 1 1 140 140 GLN N N 208 121.390 121.390 120.302 1.088 18517 4460 1 4 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.069 -0.009 18517 4461 1 4 . 1 1 140 140 GLN C C 208 178.550 178.550 178.208 0.342 18517 4462 1 4 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.279 0.021 18517 4463 1 4 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.826 0.034 18517 4464 1 4 . 1 1 140 140 GLN H H 208 7.600 7.600 8.471 -0.871 18517 4465 1 4 . 1 1 141 141 HIS N N 209 122.360 122.360 119.900 2.460 18517 4466 1 4 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.332 -0.502 18517 4467 1 4 . 1 1 141 141 HIS C C 209 176.390 176.390 177.218 -0.828 18517 4468 1 4 . 1 1 141 141 HIS CA C 209 61.720 61.720 59.925 1.795 18517 4469 1 4 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.347 -1.247 18517 4470 1 4 . 1 1 141 141 HIS H H 209 8.980 8.980 8.346 0.634 18517 4471 1 4 . 1 1 142 142 ASP N N 210 120.740 120.740 120.949 -0.209 18517 4472 1 4 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.337 0.013 18517 4473 1 4 . 1 1 142 142 ASP C C 210 179.490 179.490 178.061 1.429 18517 4474 1 4 . 1 1 142 142 ASP CA C 210 57.920 57.920 58.089 -0.169 18517 4475 1 4 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.795 -0.205 18517 4476 1 4 . 1 1 142 142 ASP H H 210 8.770 8.770 8.674 0.096 18517 4477 1 4 . 1 1 143 143 GLU N N 211 119.010 119.010 120.524 -1.514 18517 4478 1 4 . 1 1 143 143 GLU HA H 211 3.970 3.970 3.984 -0.014 18517 4479 1 4 . 1 1 143 143 GLU C C 211 179.070 179.070 178.915 0.155 18517 4480 1 4 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.588 -0.288 18517 4481 1 4 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.709 -0.219 18517 4482 1 4 . 1 1 143 143 GLU H H 211 7.850 7.850 8.155 -0.304 18517 4483 1 4 . 1 1 144 144 LEU N N 212 122.500 122.500 120.247 2.253 18517 4484 1 4 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.027 0.043 18517 4485 1 4 . 1 1 144 144 LEU C C 212 179.340 179.340 179.586 -0.246 18517 4486 1 4 . 1 1 144 144 LEU CA C 212 58.390 58.390 57.969 0.421 18517 4487 1 4 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.899 0.281 18517 4488 1 4 . 1 1 144 144 LEU H H 212 8.070 8.070 8.091 -0.021 18517 4489 1 4 . 1 1 145 145 LEU N N 213 118.110 118.110 118.939 -0.829 18517 4490 1 4 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.835 0.365 18517 4491 1 4 . 1 1 145 145 LEU C C 213 179.610 179.610 179.039 0.571 18517 4492 1 4 . 1 1 145 145 LEU CA C 213 58.750 58.750 58.316 0.434 18517 4493 1 4 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.084 0.145 18517 4494 1 4 . 1 1 145 145 LEU H H 213 8.370 8.370 8.190 0.180 18517 4495 1 4 . 1 1 146 146 LYS N N 214 117.290 117.290 119.853 -2.563 18517 4496 1 4 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.864 -0.034 18517 4497 1 4 . 1 1 146 146 LYS C C 214 179.900 179.900 178.963 0.937 18517 4498 1 4 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.888 0.442 18517 4499 1 4 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.335 0.015 18517 4500 1 4 . 1 1 146 146 LYS H H 214 7.560 7.560 8.449 -0.889 18517 4501 1 4 . 1 1 147 147 LYS N N 215 120.330 120.330 119.116 1.214 18517 4502 1 4 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.047 -0.027 18517 4503 1 4 . 1 1 147 147 LYS C C 215 180.550 180.550 179.432 1.118 18517 4504 1 4 . 1 1 147 147 LYS CA C 215 60.100 60.100 58.877 1.223 18517 4505 1 4 . 1 1 147 147 LYS CB C 215 32.740 32.740 31.904 0.836 18517 4506 1 4 . 1 1 147 147 LYS H H 215 7.830 7.830 8.104 -0.274 18517 4507 1 4 . 1 1 148 148 PHE N N 216 117.370 117.370 117.707 -0.337 18517 4508 1 4 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.337 -0.257 18517 4509 1 4 . 1 1 148 148 PHE C C 216 178.200 178.200 177.614 0.586 18517 4510 1 4 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.506 0.614 18517 4511 1 4 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.558 1.162 18517 4512 1 4 . 1 1 148 148 PHE H H 216 8.010 8.010 8.511 -0.501 18517 4513 1 4 . 1 1 149 149 ALA N N 217 118.990 118.990 121.448 -2.458 18517 4514 1 4 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.432 -0.322 18517 4515 1 4 . 1 1 149 149 ALA C C 217 177.330 177.330 178.201 -0.871 18517 4516 1 4 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.410 0.340 18517 4517 1 4 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.661 -1.061 18517 4518 1 4 . 1 1 149 149 ALA H H 217 7.720 7.720 7.953 -0.233 18517 4519 1 4 . 1 1 150 150 ALA N N 218 118.690 118.690 120.632 -1.942 18517 4520 1 4 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.298 0.062 18517 4521 1 4 . 1 1 150 150 ALA C C 218 177.930 177.930 177.997 -0.067 18517 4522 1 4 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.954 -0.864 18517 4523 1 4 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.360 0.380 18517 4524 1 4 . 1 1 150 150 ALA H H 218 7.280 7.280 7.761 -0.481 18517 4525 1 4 . 1 1 151 151 LEU N N 219 119.980 119.980 120.788 -0.808 18517 4526 1 4 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.426 -0.156 18517 4527 1 4 . 1 1 151 151 LEU C C 219 176.150 176.150 175.129 1.021 18517 4528 1 4 . 1 1 151 151 LEU CA C 219 56.170 56.170 54.935 1.235 18517 4529 1 4 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.805 -0.995 18517 4530 1 4 . 1 1 151 151 LEU H H 219 7.050 7.050 7.619 -0.569 18517 4531 1 4 . 1 1 152 152 THR N N 220 112.070 112.070 115.336 -3.266 18517 4532 1 4 . 1 1 152 152 THR HA H 220 4.700 4.700 4.673 0.027 18517 4533 1 4 . 1 1 152 152 THR C C 220 173.400 173.400 173.625 -0.225 18517 4534 1 4 . 1 1 152 152 THR CA C 220 58.190 58.190 58.311 -0.121 18517 4535 1 4 . 1 1 152 152 THR CB C 220 70.960 70.960 69.261 1.699 18517 4536 1 4 . 1 1 152 152 THR H H 220 8.040 8.040 8.136 -0.096 18517 4537 1 4 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.563 0.147 18517 4538 1 4 . 1 1 153 153 PRO C C 221 176.720 176.720 176.634 0.086 18517 4539 1 4 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.006 0.904 18517 4540 1 4 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.853 1.397 18517 4541 1 4 . 1 1 154 154 THR N N 222 120.460 120.460 115.775 4.685 18517 4542 1 4 . 1 1 154 154 THR HA H 222 4.250 4.250 4.720 -0.470 18517 4543 1 4 . 1 1 154 154 THR C C 222 175.190 175.190 174.642 0.548 18517 4544 1 4 . 1 1 154 154 THR CA C 222 64.650 64.650 62.998 1.652 18517 4545 1 4 . 1 1 154 154 THR CB C 222 70.410 70.410 68.435 1.975 18517 4546 1 4 . 1 1 154 154 THR H H 222 8.530 8.530 8.412 0.118 18517 4547 1 4 . 1 1 155 155 PHE N N 223 122.260 122.260 127.620 -5.360 18517 4548 1 4 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.546 0.444 18517 4549 1 4 . 1 1 155 155 PHE C C 223 172.560 172.560 174.733 -2.173 18517 4550 1 4 . 1 1 155 155 PHE CA C 223 56.770 56.770 58.876 -2.106 18517 4551 1 4 . 1 1 155 155 PHE CB C 223 40.590 40.590 40.112 0.478 18517 4552 1 4 . 1 1 155 155 PHE H H 223 8.950 8.950 8.106 0.844 18517 4553 1 4 . 1 1 156 156 LEU N N 224 123.440 123.440 118.473 4.967 18517 4554 1 4 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.310 0.360 18517 4555 1 4 . 1 1 156 156 LEU C C 224 175.090 175.090 176.350 -1.260 18517 4556 1 4 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.238 -0.208 18517 4557 1 4 . 1 1 156 156 LEU CB C 224 46.300 46.300 43.192 3.108 18517 4558 1 4 . 1 1 156 156 LEU H H 224 7.210 7.210 7.516 -0.306 18517 4559 1 4 . 1 1 157 157 THR N N 225 113.010 113.010 112.667 0.343 18517 4560 1 4 . 1 1 157 157 THR HA H 225 4.790 4.790 4.437 0.353 18517 4561 1 4 . 1 1 157 157 THR C C 225 176.130 176.130 174.622 1.508 18517 4562 1 4 . 1 1 157 157 THR CA C 225 59.860 59.860 61.434 -1.574 18517 4563 1 4 . 1 1 157 157 THR CB C 225 72.860 72.860 69.280 3.580 18517 4564 1 4 . 1 1 157 157 THR H H 225 9.200 9.200 8.186 1.014 18517 4565 1 4 . 1 1 158 158 SER N N 226 115.350 115.350 121.925 -6.575 18517 4566 1 4 . 1 1 158 158 SER C C 226 177.410 177.410 175.478 1.932 18517 4567 1 4 . 1 1 158 158 SER CA C 226 57.400 57.400 58.593 -1.193 18517 4568 1 4 . 1 1 158 158 SER CB C 226 66.200 66.200 63.834 2.366 18517 4569 1 4 . 1 1 158 158 SER H H 226 8.830 8.830 8.814 0.016 18517 4570 1 4 . 1 1 159 159 GLU N N 227 121.200 121.200 122.253 -1.053 18517 4571 1 4 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.934 0.086 18517 4572 1 4 . 1 1 159 159 GLU C C 227 177.680 177.680 177.780 -0.100 18517 4573 1 4 . 1 1 159 159 GLU CA C 227 59.500 59.500 59.153 0.347 18517 4574 1 4 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.652 -0.082 18517 4575 1 4 . 1 1 159 159 GLU H H 227 8.320 8.320 8.935 -0.615 18517 4576 1 4 . 1 1 160 160 ASP N N 228 115.350 115.350 116.923 -1.573 18517 4577 1 4 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.472 0.078 18517 4578 1 4 . 1 1 160 160 ASP C C 228 177.640 177.640 177.656 -0.016 18517 4579 1 4 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.456 0.944 18517 4580 1 4 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.844 2.206 18517 4581 1 4 . 1 1 160 160 ASP H H 228 7.570 7.570 8.386 -0.816 18517 4582 1 4 . 1 1 161 161 ILE N N 229 108.150 108.150 113.863 -5.713 18517 4583 1 4 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.346 0.164 18517 4584 1 4 . 1 1 161 161 ILE C C 229 173.130 173.130 176.061 -2.931 18517 4585 1 4 . 1 1 161 161 ILE CA C 229 61.290 61.290 61.880 -0.590 18517 4586 1 4 . 1 1 161 161 ILE CB C 229 39.400 39.400 39.781 -0.381 18517 4587 1 4 . 1 1 161 161 ILE H H 229 7.190 7.190 7.479 -0.289 18517 4588 1 4 . 1 1 162 162 SER N N 230 115.290 115.290 117.487 -2.197 18517 4589 1 4 . 1 1 162 162 SER HA H 230 4.760 4.760 4.636 0.124 18517 4590 1 4 . 1 1 162 162 SER C C 230 176.060 176.060 174.899 1.161 18517 4591 1 4 . 1 1 162 162 SER CA C 230 57.920 57.920 58.107 -0.187 18517 4592 1 4 . 1 1 162 162 SER CB C 230 66.120 66.120 61.698 4.422 18517 4593 1 4 . 1 1 162 162 SER H H 230 7.460 7.460 8.361 -0.901 18517 4594 1 4 . 1 1 163 163 GLY C C 231 173.260 173.260 173.184 0.076 18517 4595 1 4 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.978 0.572 18517 4596 1 4 . 1 1 164 164 TYR N N 232 115.290 115.290 115.851 -0.561 18517 4597 1 4 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.821 -0.121 18517 4598 1 4 . 1 1 164 164 TYR C C 232 172.820 172.820 174.065 -1.245 18517 4599 1 4 . 1 1 164 164 TYR CA C 232 55.100 55.100 54.722 0.378 18517 4600 1 4 . 1 1 164 164 TYR CB C 232 39.800 39.800 40.078 -0.278 18517 4601 1 4 . 1 1 164 164 TYR H H 232 7.370 7.370 7.578 -0.208 18517 4602 1 4 . 1 1 165 165 LEU N N 233 120.980 120.980 123.650 -2.670 18517 4603 1 4 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.379 0.051 18517 4604 1 4 . 1 1 165 165 LEU C C 233 176.360 176.360 177.207 -0.847 18517 4605 1 4 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.559 1.101 18517 4606 1 4 . 1 1 165 165 LEU CB C 233 40.430 40.430 41.122 -0.692 18517 4607 1 4 . 1 1 165 165 LEU H H 233 8.830 8.830 8.731 0.099 18517 4608 1 4 . 1 1 166 166 THR N N 234 116.170 116.170 115.109 1.061 18517 4609 1 4 . 1 1 166 166 THR HA H 234 4.010 4.010 3.871 0.139 18517 4610 1 4 . 1 1 166 166 THR C C 234 173.070 173.070 174.476 -1.406 18517 4611 1 4 . 1 1 166 166 THR CA C 234 62.910 62.910 63.822 -0.912 18517 4612 1 4 . 1 1 166 166 THR CB C 234 70.170 70.170 69.146 1.024 18517 4613 1 4 . 1 1 166 166 THR H H 234 8.050 8.050 7.728 0.322 18517 4614 1 4 . 1 1 167 167 VAL N N 235 117.640 117.640 122.262 -4.622 18517 4615 1 4 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.216 -0.006 18517 4616 1 4 . 1 1 167 167 VAL C C 235 172.330 172.330 174.025 -1.695 18517 4617 1 4 . 1 1 167 167 VAL CA C 235 58.750 58.750 58.185 0.565 18517 4618 1 4 . 1 1 167 167 VAL CB C 235 35.880 35.880 31.766 4.114 18517 4619 1 4 . 1 1 167 167 VAL H H 235 7.160 7.160 7.722 -0.562 18517 4620 1 4 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.733 -0.543 18517 4621 1 4 . 1 1 168 168 PRO C C 236 173.710 173.710 175.434 -1.724 18517 4622 1 4 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.726 1.104 18517 4623 1 4 . 1 1 168 168 PRO CB C 236 32.270 32.270 33.426 -1.156 18517 4624 1 4 . 1 1 169 169 GLU N N 237 113.540 113.540 118.009 -4.469 18517 4625 1 4 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.117 0.263 18517 4626 1 4 . 1 1 169 169 GLU C C 237 176.690 176.690 178.055 -1.365 18517 4627 1 4 . 1 1 169 169 GLU CA C 237 53.750 53.750 54.121 -0.371 18517 4628 1 4 . 1 1 169 169 GLU CB C 237 33.220 33.220 31.880 1.340 18517 4629 1 4 . 1 1 169 169 GLU H H 237 7.930 7.930 8.316 -0.386 18517 4630 1 4 . 1 1 170 170 TYR N N 238 119.400 119.400 121.104 -1.704 18517 4631 1 4 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.316 -0.316 18517 4632 1 4 . 1 1 170 170 TYR C C 238 177.610 177.610 176.614 0.996 18517 4633 1 4 . 1 1 170 170 TYR CA C 238 62.630 62.630 59.756 2.874 18517 4634 1 4 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.267 -0.527 18517 4635 1 4 . 1 1 170 170 TYR H H 238 8.490 8.490 8.479 0.011 18517 4636 1 4 . 1 1 171 171 GLY N N 239 104.160 104.160 105.115 -0.955 18517 4637 1 4 . 1 1 171 171 GLY C C 239 173.350 173.350 172.759 0.591 18517 4638 1 4 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.422 0.848 18517 4639 1 4 . 1 1 171 171 GLY H H 239 7.960 7.960 7.952 0.008 18517 4640 1 4 . 1 1 172 172 ALA N N 240 121.860 121.860 122.952 -1.092 18517 4641 1 4 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.789 -0.619 18517 4642 1 4 . 1 1 172 172 ALA C C 240 172.160 172.160 174.534 -2.374 18517 4643 1 4 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.052 1.058 18517 4644 1 4 . 1 1 172 172 ALA CB C 240 20.930 20.930 20.334 0.596 18517 4645 1 4 . 1 1 172 172 ALA H H 240 6.910 6.910 7.799 -0.889 18517 4646 1 4 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.484 1.066 18517 4647 1 4 . 1 1 173 173 PRO C C 241 176.610 176.610 175.606 1.004 18517 4648 1 4 . 1 1 173 173 PRO CA C 241 61.520 61.520 61.954 -0.434 18517 4649 1 4 . 1 1 173 173 PRO CB C 241 33.300 33.300 31.620 1.680 18517 4650 1 4 . 1 1 174 174 MET N N 242 114.000 114.000 124.464 -10.464 18517 4651 1 4 . 1 1 174 174 MET HA H 242 4.390 4.390 4.698 -0.308 18517 4652 1 4 . 1 1 174 174 MET C C 242 173.960 173.960 175.598 -1.638 18517 4653 1 4 . 1 1 174 174 MET CA C 242 54.660 54.660 53.832 0.828 18517 4654 1 4 . 1 1 174 174 MET CB C 242 34.170 34.170 31.797 2.373 18517 4655 1 4 . 1 1 174 174 MET H H 242 8.040 8.040 8.673 -0.633 18517 4656 1 4 . 1 1 175 175 ASN N N 243 119.570 119.570 123.507 -3.937 18517 4657 1 4 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.434 0.506 18517 4658 1 4 . 1 1 175 175 ASN C C 243 174.320 174.320 175.285 -0.965 18517 4659 1 4 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.760 0.320 18517 4660 1 4 . 1 1 175 175 ASN CB C 243 38.850 38.850 38.582 0.268 18517 4661 1 4 . 1 1 175 175 ASN H H 243 7.960 7.960 8.134 -0.174 18517 4662 1 4 . 1 1 176 176 ALA N N 244 132.250 132.250 130.861 1.389 18517 4663 1 4 . 1 1 176 176 ALA C C 244 181.580 181.580 178.711 2.869 18517 4664 1 4 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.479 0.291 18517 4665 1 4 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.729 0.301 18517 4666 1 4 . 1 1 176 176 ALA H H 244 12.110 12.110 8.383 3.727 18517 4667 1 4 . 1 1 177 177 ALA N N 245 125.780 125.780 120.389 5.391 18517 4668 1 4 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.987 -0.117 18517 4669 1 4 . 1 1 177 177 ALA C C 245 180.640 180.640 179.234 1.406 18517 4670 1 4 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.060 0.600 18517 4671 1 4 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.332 -0.492 18517 4672 1 4 . 1 1 177 177 ALA H H 245 10.240 10.240 7.978 2.262 18517 4673 1 4 . 1 1 178 178 LYS N N 246 119.810 119.810 118.956 0.854 18517 4674 1 4 . 1 1 178 178 LYS HA H 246 3.830 3.830 3.953 -0.123 18517 4675 1 4 . 1 1 178 178 LYS C C 246 180.500 180.500 178.418 2.082 18517 4676 1 4 . 1 1 178 178 LYS CA C 246 59.900 59.900 58.788 1.112 18517 4677 1 4 . 1 1 178 178 LYS CB C 246 31.320 31.320 31.986 -0.666 18517 4678 1 4 . 1 1 178 178 LYS H H 246 8.470 8.470 8.028 0.442 18517 4679 1 4 . 1 1 179 179 TRP N N 247 121.170 121.170 121.223 -0.053 18517 4680 1 4 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.342 0.278 18517 4681 1 4 . 1 1 179 179 TRP C C 247 176.510 176.510 178.517 -2.007 18517 4682 1 4 . 1 1 179 179 TRP CA C 247 59.820 59.820 60.025 -0.205 18517 4683 1 4 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.297 0.273 18517 4684 1 4 . 1 1 179 179 TRP H H 247 8.330 8.330 8.230 0.100 18517 4685 1 4 . 1 1 180 180 ALA N N 248 119.130 119.130 119.999 -0.869 18517 4686 1 4 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.964 0.576 18517 4687 1 4 . 1 1 180 180 ALA C C 248 182.110 182.110 178.900 3.210 18517 4688 1 4 . 1 1 180 180 ALA CA C 248 54.190 54.190 55.019 -0.829 18517 4689 1 4 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.119 0.591 18517 4690 1 4 . 1 1 180 180 ALA H H 248 7.990 7.990 8.596 -0.606 18517 4691 1 4 . 1 1 181 181 LYS N N 249 116.000 116.000 118.766 -2.766 18517 4692 1 4 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.116 -0.146 18517 4693 1 4 . 1 1 181 181 LYS C C 249 179.380 179.380 178.976 0.404 18517 4694 1 4 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.346 -0.636 18517 4695 1 4 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.675 -0.165 18517 4696 1 4 . 1 1 181 181 LYS H H 249 6.900 6.900 7.793 -0.893 18517 4697 1 4 . 1 1 182 182 VAL N N 250 122.270 122.270 116.551 5.719 18517 4698 1 4 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.683 -0.343 18517 4699 1 4 . 1 1 182 182 VAL C C 250 178.160 178.160 177.969 0.191 18517 4700 1 4 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.486 0.274 18517 4701 1 4 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.670 -0.830 18517 4702 1 4 . 1 1 182 182 VAL H H 250 7.050 7.050 8.363 -1.313 18517 4703 1 4 . 1 1 183 183 GLU N N 251 120.520 120.520 119.854 0.666 18517 4704 1 4 . 1 1 183 183 GLU HA H 251 3.180 3.180 4.272 -1.092 18517 4705 1 4 . 1 1 183 183 GLU C C 251 179.480 179.480 179.479 0.001 18517 4706 1 4 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.079 1.611 18517 4707 1 4 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.630 -0.560 18517 4708 1 4 . 1 1 183 183 GLU H H 251 8.020 8.020 9.144 -1.124 18517 4709 1 4 . 1 1 184 184 GLY N N 252 102.930 102.930 108.380 -5.450 18517 4710 1 4 . 1 1 184 184 GLY C C 252 176.920 176.920 176.435 0.485 18517 4711 1 4 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.207 0.203 18517 4712 1 4 . 1 1 184 184 GLY H H 252 7.830 7.830 8.190 -0.360 18517 4713 1 4 . 1 1 185 185 MET N N 253 123.200 123.200 121.822 1.378 18517 4714 1 4 . 1 1 185 185 MET HA H 253 4.250 4.250 4.225 0.025 18517 4715 1 4 . 1 1 185 185 MET C C 253 179.370 179.370 178.785 0.585 18517 4716 1 4 . 1 1 185 185 MET CA C 253 59.300 59.300 59.553 -0.254 18517 4717 1 4 . 1 1 185 185 MET CB C 253 33.930 33.930 32.507 1.423 18517 4718 1 4 . 1 1 185 185 MET H H 253 7.890 7.890 8.003 -0.113 18517 4719 1 4 . 1 1 186 186 ILE N N 254 120.150 120.150 119.588 0.562 18517 4720 1 4 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.755 -0.195 18517 4721 1 4 . 1 1 186 186 ILE C C 254 177.250 177.250 178.384 -1.134 18517 4722 1 4 . 1 1 186 186 ILE CA C 254 66.520 66.520 64.687 1.833 18517 4723 1 4 . 1 1 186 186 ILE CB C 254 38.290 38.290 36.615 1.675 18517 4724 1 4 . 1 1 186 186 ILE H H 254 8.260 8.260 8.310 -0.050 18517 4725 1 4 . 1 1 187 187 HIS N N 255 119.810 119.810 119.902 -0.092 18517 4726 1 4 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.245 -0.245 18517 4727 1 4 . 1 1 187 187 HIS C C 255 176.460 176.460 177.668 -1.208 18517 4728 1 4 . 1 1 187 187 HIS CA C 255 60.330 60.330 60.136 0.194 18517 4729 1 4 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.830 1.800 18517 4730 1 4 . 1 1 187 187 HIS H H 255 8.900 8.900 8.997 -0.097 18517 4731 1 4 . 1 1 188 188 GLY N N 256 103.160 103.160 107.044 -3.884 18517 4732 1 4 . 1 1 188 188 GLY C C 256 176.320 176.320 175.957 0.363 18517 4733 1 4 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.731 0.159 18517 4734 1 4 . 1 1 188 188 GLY H H 256 8.030 8.030 8.523 -0.493 18517 4735 1 4 . 1 1 189 189 LYS N N 257 119.510 119.510 120.938 -1.428 18517 4736 1 4 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.252 -0.252 18517 4737 1 4 . 1 1 189 189 LYS C C 257 178.660 178.660 179.027 -0.367 18517 4738 1 4 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.440 -0.950 18517 4739 1 4 . 1 1 189 189 LYS CB C 257 31.550 31.550 32.545 -0.995 18517 4740 1 4 . 1 1 189 189 LYS H H 257 7.120 7.120 7.907 -0.787 18517 4741 1 4 . 1 1 190 190 LEU N N 258 120.570 120.570 119.616 0.954 18517 4742 1 4 . 1 1 190 190 LEU HA H 258 3.930 3.930 4.030 -0.100 18517 4743 1 4 . 1 1 190 190 LEU C C 258 177.230 177.230 178.178 -0.948 18517 4744 1 4 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.488 0.032 18517 4745 1 4 . 1 1 190 190 LEU CB C 258 42.970 42.970 41.795 1.175 18517 4746 1 4 . 1 1 190 190 LEU H H 258 8.060 8.060 8.518 -0.458 18517 4747 1 4 . 1 1 191 191 GLU N N 259 114.590 114.590 115.073 -0.483 18517 4748 1 4 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.259 0.021 18517 4749 1 4 . 1 1 191 191 GLU C C 259 176.230 176.230 176.447 -0.217 18517 4750 1 4 . 1 1 191 191 GLU CA C 259 55.340 55.340 55.988 -0.648 18517 4751 1 4 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.540 -0.210 18517 4752 1 4 . 1 1 191 191 GLU H H 259 7.330 7.330 7.993 -0.663 18517 4753 1 4 . 1 1 192 192 SER N N 260 115.240 115.240 116.210 -0.970 18517 4754 1 4 . 1 1 192 192 SER HA H 260 4.490 4.490 4.551 -0.061 18517 4755 1 4 . 1 1 192 192 SER C C 260 173.770 173.770 174.196 -0.426 18517 4756 1 4 . 1 1 192 192 SER CA C 260 58.350 58.350 57.135 1.216 18517 4757 1 4 . 1 1 192 192 SER CB C 260 65.090 65.090 64.524 0.566 18517 4758 1 4 . 1 1 192 192 SER H H 260 7.130 7.130 7.617 -0.487 18517 4759 1 4 . 1 1 193 193 SER C C 261 174.600 174.600 174.984 -0.384 18517 4760 1 4 . 1 1 193 193 SER CA C 261 59.980 59.980 58.700 1.280 18517 4761 1 4 . 1 1 193 193 SER CB C 261 63.750 63.750 62.677 1.073 18517 4762 1 4 . 1 1 194 194 GLU N N 262 121.800 121.800 122.598 -0.798 18517 4763 1 4 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.232 0.238 18517 4764 1 4 . 1 1 194 194 GLU C C 262 174.650 174.650 176.038 -1.388 18517 4765 1 4 . 1 1 194 194 GLU CA C 262 55.620 55.620 56.541 -0.921 18517 4766 1 4 . 1 1 194 194 GLU CB C 262 30.210 30.210 30.374 -0.164 18517 4767 1 4 . 1 1 194 194 GLU H H 262 7.840 7.840 7.937 -0.097 18517 4768 1 4 . 1 1 195 195 VAL N N 263 124.080 124.080 123.983 0.097 18517 4769 1 4 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.426 -0.176 18517 4770 1 4 . 1 1 195 195 VAL C C 263 174.460 174.460 174.581 -0.121 18517 4771 1 4 . 1 1 195 195 VAL CA C 263 59.820 59.820 58.532 1.288 18517 4772 1 4 . 1 1 195 195 VAL CB C 263 33.620 33.620 33.006 0.614 18517 4773 1 4 . 1 1 195 195 VAL H H 263 8.020 8.020 8.418 -0.398 18517 4774 1 4 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.645 -0.125 18517 4775 1 4 . 1 1 198 198 ASN C C 266 176.490 176.490 177.392 -0.902 18517 4776 1 4 . 1 1 198 198 ASN CA C 266 54.780 54.780 55.861 -1.081 18517 4777 1 4 . 1 1 198 198 ASN CB C 266 38.060 38.060 38.138 -0.077 18517 4778 1 4 . 1 1 199 199 LEU N N 267 120.680 120.680 120.596 0.084 18517 4779 1 4 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.738 0.272 18517 4780 1 4 . 1 1 199 199 LEU C C 267 178.050 178.050 177.945 0.105 18517 4781 1 4 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.200 0.630 18517 4782 1 4 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.490 0.850 18517 4783 1 4 . 1 1 199 199 LEU H H 267 7.660 7.660 8.306 -0.646 18517 4784 1 4 . 1 1 200 200 LYS N N 268 116.740 116.740 119.094 -2.354 18517 4785 1 4 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.830 -0.100 18517 4786 1 4 . 1 1 200 200 LYS C C 268 178.520 178.520 178.309 0.211 18517 4787 1 4 . 1 1 200 200 LYS CA C 268 61.800 61.800 59.666 2.134 18517 4788 1 4 . 1 1 200 200 LYS CB C 268 32.110 32.110 32.006 0.104 18517 4789 1 4 . 1 1 200 200 LYS H H 268 8.280 8.280 8.009 0.271 18517 4790 1 4 . 1 1 201 201 ALA N N 269 121.270 121.270 121.960 -0.690 18517 4791 1 4 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.034 0.206 18517 4792 1 4 . 1 1 201 201 ALA C C 269 180.890 180.890 179.956 0.934 18517 4793 1 4 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.090 0.090 18517 4794 1 4 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.053 0.417 18517 4795 1 4 . 1 1 201 201 ALA H H 269 7.710 7.710 7.759 -0.049 18517 4796 1 4 . 1 1 202 202 LEU N N 270 119.980 119.980 118.518 1.462 18517 4797 1 4 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.790 0.300 18517 4798 1 4 . 1 1 202 202 LEU C C 270 179.330 179.330 179.450 -0.120 18517 4799 1 4 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.831 0.239 18517 4800 1 4 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.249 1.171 18517 4801 1 4 . 1 1 202 202 LEU H H 270 7.750 7.750 7.911 -0.161 18517 4802 1 4 . 1 1 203 203 VAL N N 271 118.450 118.450 119.605 -1.155 18517 4803 1 4 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.775 0.055 18517 4804 1 4 . 1 1 203 203 VAL C C 271 177.110 177.110 177.858 -0.748 18517 4805 1 4 . 1 1 203 203 VAL CA C 271 67.710 67.710 67.118 0.592 18517 4806 1 4 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.438 0.272 18517 4807 1 4 . 1 1 203 203 VAL H H 271 8.560 8.560 8.514 0.046 18517 4808 1 4 . 1 1 204 204 ALA N N 272 122.560 122.560 121.826 0.734 18517 4809 1 4 . 1 1 204 204 ALA HA H 272 3.880 3.880 3.998 -0.118 18517 4810 1 4 . 1 1 204 204 ALA C C 272 178.700 178.700 179.611 -0.911 18517 4811 1 4 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.585 0.545 18517 4812 1 4 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.053 0.337 18517 4813 1 4 . 1 1 204 204 ALA H H 272 8.120 8.120 8.542 -0.422 18517 4814 1 4 . 1 1 205 205 GLU N N 273 117.290 117.290 119.208 -1.918 18517 4815 1 4 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.085 -0.095 18517 4816 1 4 . 1 1 205 205 GLU C C 273 178.630 178.630 179.014 -0.384 18517 4817 1 4 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.015 1.125 18517 4818 1 4 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.654 0.316 18517 4819 1 4 . 1 1 205 205 GLU H H 273 7.670 7.670 8.153 -0.483 18517 4820 1 4 . 1 1 206 206 LEU N N 274 120.450 120.450 122.499 -2.049 18517 4821 1 4 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.097 -0.097 18517 4822 1 4 . 1 1 206 206 LEU C C 274 178.400 178.400 178.373 0.027 18517 4823 1 4 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.190 0.720 18517 4824 1 4 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.859 1.671 18517 4825 1 4 . 1 1 206 206 LEU H H 274 8.420 8.420 8.405 0.015 18517 4826 1 4 . 1 1 207 207 ILE N N 275 117.580 117.580 120.051 -2.471 18517 4827 1 4 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.461 0.069 18517 4828 1 4 . 1 1 207 207 ILE C C 275 178.850 178.850 178.101 0.749 18517 4829 1 4 . 1 1 207 207 ILE CA C 275 66.080 66.080 66.121 -0.040 18517 4830 1 4 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.541 1.229 18517 4831 1 4 . 1 1 207 207 ILE H H 275 8.700 8.700 8.640 0.060 18517 4832 1 4 . 1 1 208 208 GLU N N 276 119.100 119.100 119.187 -0.087 18517 4833 1 4 . 1 1 208 208 GLU HA H 276 4.000 4.000 3.990 0.010 18517 4834 1 4 . 1 1 208 208 GLU C C 276 178.540 178.540 179.170 -0.630 18517 4835 1 4 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.530 0.920 18517 4836 1 4 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.644 0.876 18517 4837 1 4 . 1 1 208 208 GLU H H 276 7.950 7.950 8.169 -0.219 18517 4838 1 4 . 1 1 209 209 LEU N N 277 120.590 120.590 120.543 0.047 18517 4839 1 4 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.147 0.073 18517 4840 1 4 . 1 1 209 209 LEU C C 277 179.520 179.520 178.934 0.586 18517 4841 1 4 . 1 1 209 209 LEU CA C 277 58.350 58.350 57.906 0.444 18517 4842 1 4 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.644 1.647 18517 4843 1 4 . 1 1 209 209 LEU H H 277 8.550 8.550 8.462 0.088 18517 4844 1 4 . 1 1 210 210 ARG N N 278 116.470 116.470 119.477 -3.007 18517 4845 1 4 . 1 1 210 210 ARG HA H 278 3.740 3.740 3.948 -0.208 18517 4846 1 4 . 1 1 210 210 ARG C C 278 179.190 179.190 178.543 0.647 18517 4847 1 4 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.572 2.108 18517 4848 1 4 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.182 1.218 18517 4849 1 4 . 1 1 210 210 ARG H H 278 8.590 8.590 8.564 0.026 18517 4850 1 4 . 1 1 211 211 ALA N N 279 120.470 120.470 123.082 -2.612 18517 4851 1 4 . 1 1 211 211 ALA HA H 279 3.910 3.910 3.885 0.025 18517 4852 1 4 . 1 1 211 211 ALA C C 279 181.350 181.350 179.558 1.792 18517 4853 1 4 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.256 0.444 18517 4854 1 4 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.310 -1.030 18517 4855 1 4 . 1 1 211 211 ALA H H 279 8.050 8.050 8.220 -0.170 18517 4856 1 4 . 1 1 212 212 GLN N N 280 120.070 120.070 118.270 1.800 18517 4857 1 4 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.899 0.121 18517 4858 1 4 . 1 1 212 212 GLN C C 280 179.490 179.490 178.764 0.726 18517 4859 1 4 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.909 0.391 18517 4860 1 4 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.667 0.513 18517 4861 1 4 . 1 1 212 212 GLN H H 280 8.300 8.300 8.088 0.212 18517 4862 1 4 . 1 1 213 213 MET N N 281 119.810 119.810 118.048 1.762 18517 4863 1 4 . 1 1 213 213 MET HA H 281 3.730 3.730 4.193 -0.463 18517 4864 1 4 . 1 1 213 213 MET C C 281 177.490 177.490 178.783 -1.293 18517 4865 1 4 . 1 1 213 213 MET CA C 281 60.690 60.690 57.466 3.224 18517 4866 1 4 . 1 1 213 213 MET CB C 281 33.930 33.930 32.020 1.910 18517 4867 1 4 . 1 1 213 213 MET H H 281 8.420 8.420 8.513 -0.093 18517 4868 1 4 . 1 1 214 214 MET N N 282 114.000 114.000 118.916 -4.916 18517 4869 1 4 . 1 1 214 214 MET HA H 282 3.880 3.880 4.220 -0.340 18517 4870 1 4 . 1 1 214 214 MET C C 282 177.650 177.650 178.064 -0.414 18517 4871 1 4 . 1 1 214 214 MET CA C 282 58.670 58.670 57.882 0.788 18517 4872 1 4 . 1 1 214 214 MET CB C 282 33.300 33.300 31.986 1.314 18517 4873 1 4 . 1 1 214 214 MET H H 282 7.890 7.890 8.358 -0.468 18517 4874 1 4 . 1 1 215 215 ALA N N 283 119.970 119.970 122.279 -2.309 18517 4875 1 4 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.049 0.091 18517 4876 1 4 . 1 1 215 215 ALA C C 283 180.580 180.580 179.143 1.437 18517 4877 1 4 . 1 1 215 215 ALA CA C 283 54.110 54.110 54.685 -0.576 18517 4878 1 4 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.144 -0.464 18517 4879 1 4 . 1 1 215 215 ALA H H 283 7.580 7.580 8.226 -0.646 18517 4880 1 4 . 1 1 216 216 LEU N N 284 120.920 120.920 117.874 3.046 18517 4881 1 4 . 1 1 216 216 LEU HA H 284 3.960 3.960 3.889 0.071 18517 4882 1 4 . 1 1 216 216 LEU C C 284 177.910 177.910 179.071 -1.161 18517 4883 1 4 . 1 1 216 216 LEU CA C 284 57.920 57.920 56.889 1.031 18517 4884 1 4 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.098 0.402 18517 4885 1 4 . 1 1 216 216 LEU H H 284 7.460 7.460 8.028 -0.568 18517 4886 1 4 . 1 1 217 217 LEU N N 285 116.470 116.470 120.877 -4.407 18517 4887 1 4 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.840 -0.160 18517 4888 1 4 . 1 1 217 217 LEU C C 285 178.310 178.310 176.494 1.816 18517 4889 1 4 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.198 0.242 18517 4890 1 4 . 1 1 217 217 LEU CB C 285 43.050 43.050 42.099 0.951 18517 4891 1 4 . 1 1 217 217 LEU H H 285 6.980 6.980 8.110 -1.130 18517 4892 1 4 . 1 1 218 218 TYR N N 286 111.080 111.080 112.856 -1.776 18517 4893 1 4 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.583 0.317 18517 4894 1 4 . 1 1 218 218 TYR C C 286 176.090 176.090 176.100 -0.010 18517 4895 1 4 . 1 1 218 218 TYR CA C 286 56.050 56.050 56.334 -0.284 18517 4896 1 4 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.387 2.523 18517 4897 1 4 . 1 1 218 218 TYR H H 286 7.660 7.660 7.823 -0.163 18517 4898 1 4 . 1 1 219 219 GLY N N 287 108.260 108.260 109.627 -1.367 18517 4899 1 4 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.584 0.736 18517 4900 1 4 . 1 1 219 219 GLY H H 287 7.750 7.750 7.388 0.362 18517 4901 1 4 . 1 1 221 221 ILE HA H 289 3.490 3.490 4.201 -0.711 18517 4902 1 4 . 1 1 221 221 ILE CA C 289 63.580 63.580 60.966 2.614 18517 4903 1 4 . 1 1 221 221 ILE CB C 289 38.280 38.280 35.511 2.769 18517 4904 1 4 . 1 1 222 222 GLY CA C 290 45.740 45.740 45.624 0.116 18517 4905 1 5 . 1 1 2 2 LYS N N 70 126.600 126.600 122.057 4.543 18517 4906 1 5 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.232 0.128 18517 4907 1 5 . 1 1 2 2 LYS C C 70 176.000 176.000 174.782 1.218 18517 4908 1 5 . 1 1 2 2 LYS CA C 70 56.450 56.450 56.912 -0.462 18517 4909 1 5 . 1 1 2 2 LYS CB C 70 33.850 33.850 32.449 1.401 18517 4910 1 5 . 1 1 2 2 LYS H H 70 8.530 8.530 8.381 0.149 18517 4911 1 5 . 1 1 3 3 THR N N 71 111.030 111.030 115.013 -3.983 18517 4912 1 5 . 1 1 3 3 THR HA H 71 4.400 4.400 4.499 -0.099 18517 4913 1 5 . 1 1 3 3 THR C C 71 175.650 175.650 175.001 0.649 18517 4914 1 5 . 1 1 3 3 THR CA C 71 60.610 60.610 59.852 0.758 18517 4915 1 5 . 1 1 3 3 THR CB C 71 71.520 71.520 70.237 1.283 18517 4916 1 5 . 1 1 3 3 THR H H 71 7.390 7.390 7.929 -0.539 18517 4917 1 5 . 1 1 4 4 LEU N N 72 121.560 121.560 121.652 -0.092 18517 4918 1 5 . 1 1 4 4 LEU C C 72 177.870 177.870 178.502 -0.632 18517 4919 1 5 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.369 0.111 18517 4920 1 5 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.734 0.446 18517 4921 1 5 . 1 1 4 4 LEU H H 72 8.980 8.980 8.624 0.356 18517 4922 1 5 . 1 1 5 5 ASP N N 73 115.530 115.530 117.527 -1.997 18517 4923 1 5 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.385 -0.055 18517 4924 1 5 . 1 1 5 5 ASP C C 73 179.290 179.290 178.322 0.968 18517 4925 1 5 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.448 0.392 18517 4926 1 5 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.709 0.121 18517 4927 1 5 . 1 1 5 5 ASP H H 73 8.270 8.270 8.547 -0.277 18517 4928 1 5 . 1 1 6 6 VAL N N 74 122.330 122.330 119.845 2.485 18517 4929 1 5 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.798 -0.058 18517 4930 1 5 . 1 1 6 6 VAL C C 74 178.970 178.970 177.962 1.008 18517 4931 1 5 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.672 0.688 18517 4932 1 5 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.618 0.332 18517 4933 1 5 . 1 1 6 6 VAL H H 74 7.400 7.400 7.555 -0.155 18517 4934 1 5 . 1 1 7 7 LEU N N 75 121.360 121.360 121.521 -0.161 18517 4935 1 5 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.985 0.045 18517 4936 1 5 . 1 1 7 7 LEU C C 75 179.240 179.240 179.475 -0.235 18517 4937 1 5 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.289 -0.060 18517 4938 1 5 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.166 1.724 18517 4939 1 5 . 1 1 7 7 LEU H H 75 8.300 8.300 8.742 -0.442 18517 4940 1 5 . 1 1 8 8 ARG N N 76 117.230 117.230 119.617 -2.387 18517 4941 1 5 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.140 -0.220 18517 4942 1 5 . 1 1 8 8 ARG C C 76 178.290 178.290 178.958 -0.668 18517 4943 1 5 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.585 1.185 18517 4944 1 5 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.974 0.236 18517 4945 1 5 . 1 1 8 8 ARG H H 76 8.520 8.520 8.876 -0.356 18517 4946 1 5 . 1 1 9 9 GLY N N 77 104.570 104.570 106.883 -2.313 18517 4947 1 5 . 1 1 9 9 GLY C C 77 176.180 176.180 176.198 -0.018 18517 4948 1 5 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.822 0.348 18517 4949 1 5 . 1 1 9 9 GLY H H 77 7.620 7.620 8.131 -0.511 18517 4950 1 5 . 1 1 10 10 GLU N N 78 120.270 120.270 123.108 -2.838 18517 4951 1 5 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.028 0.242 18517 4952 1 5 . 1 1 10 10 GLU C C 78 179.030 179.030 179.244 -0.214 18517 4953 1 5 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.326 -0.456 18517 4954 1 5 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.570 1.830 18517 4955 1 5 . 1 1 10 10 GLU H H 78 8.100 8.100 8.213 -0.113 18517 4956 1 5 . 1 1 11 11 LEU N N 79 116.000 116.000 120.278 -4.278 18517 4957 1 5 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.956 0.554 18517 4958 1 5 . 1 1 11 11 LEU C C 79 179.630 179.630 179.088 0.542 18517 4959 1 5 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.075 -1.385 18517 4960 1 5 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.427 3.373 18517 4961 1 5 . 1 1 11 11 LEU H H 79 8.230 8.230 8.716 -0.486 18517 4962 1 5 . 1 1 12 12 ARG N N 80 120.020 120.020 119.287 0.733 18517 4963 1 5 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.939 -0.189 18517 4964 1 5 . 1 1 12 12 ARG C C 80 178.490 178.490 178.877 -0.387 18517 4965 1 5 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.210 2.790 18517 4966 1 5 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.314 1.926 18517 4967 1 5 . 1 1 12 12 ARG H H 80 8.210 8.210 8.742 -0.532 18517 4968 1 5 . 1 1 13 13 GLY N N 81 108.090 108.090 107.047 1.043 18517 4969 1 5 . 1 1 13 13 GLY C C 81 173.540 173.540 176.380 -2.840 18517 4970 1 5 . 1 1 13 13 GLY CA C 81 48.000 48.000 47.043 0.957 18517 4971 1 5 . 1 1 13 13 GLY H H 81 8.890 8.890 8.421 0.469 18517 4972 1 5 . 1 1 14 14 GLN C C 82 179.540 179.540 178.485 1.055 18517 4973 1 5 . 1 1 14 14 GLN CA C 82 58.710 58.710 58.961 -0.251 18517 4974 1 5 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.485 0.615 18517 4975 1 5 . 1 1 15 15 ARG N N 83 118.220 118.220 119.241 -1.021 18517 4976 1 5 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.000 -0.050 18517 4977 1 5 . 1 1 15 15 ARG C C 83 177.710 177.710 179.111 -1.401 18517 4978 1 5 . 1 1 15 15 ARG CA C 83 59.900 59.900 60.233 -0.333 18517 4979 1 5 . 1 1 15 15 ARG CB C 83 29.650 29.650 30.351 -0.701 18517 4980 1 5 . 1 1 15 15 ARG H H 83 7.320 7.320 8.688 -1.368 18517 4981 1 5 . 1 1 16 16 GLU N N 84 118.810 118.810 119.928 -1.118 18517 4982 1 5 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.158 -0.308 18517 4983 1 5 . 1 1 16 16 GLU C C 84 178.750 178.750 179.022 -0.272 18517 4984 1 5 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.234 1.776 18517 4985 1 5 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.392 0.018 18517 4986 1 5 . 1 1 16 16 GLU H H 84 8.450 8.450 8.698 -0.248 18517 4987 1 5 . 1 1 17 17 ALA N N 85 122.790 122.790 123.856 -1.066 18517 4988 1 5 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.122 0.068 18517 4989 1 5 . 1 1 17 17 ALA C C 85 180.360 180.360 179.302 1.058 18517 4990 1 5 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.195 0.265 18517 4991 1 5 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.430 -0.350 18517 4992 1 5 . 1 1 17 17 ALA H H 85 8.420 8.420 8.117 0.303 18517 4993 1 5 . 1 1 18 18 PHE N N 86 119.400 119.400 119.645 -0.245 18517 4994 1 5 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.208 0.082 18517 4995 1 5 . 1 1 18 18 PHE C C 86 177.560 177.560 177.559 0.001 18517 4996 1 5 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.685 -0.045 18517 4997 1 5 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.033 0.607 18517 4998 1 5 . 1 1 18 18 PHE H H 86 7.490 7.490 8.384 -0.894 18517 4999 1 5 . 1 1 19 19 LEU N N 87 117.470 117.470 119.485 -2.015 18517 5000 1 5 . 1 1 19 19 LEU HA H 87 4.070 4.070 3.981 0.089 18517 5001 1 5 . 1 1 19 19 LEU C C 87 178.880 178.880 178.648 0.232 18517 5002 1 5 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.468 -0.508 18517 5003 1 5 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.662 0.438 18517 5004 1 5 . 1 1 19 19 LEU H H 87 8.010 8.010 8.724 -0.714 18517 5005 1 5 . 1 1 20 20 SER N N 88 113.770 113.770 115.229 -1.459 18517 5006 1 5 . 1 1 20 20 SER HA H 88 4.070 4.070 4.111 -0.041 18517 5007 1 5 . 1 1 20 20 SER C C 88 175.680 175.680 176.905 -1.225 18517 5008 1 5 . 1 1 20 20 SER CA C 88 63.070 63.070 62.513 0.557 18517 5009 1 5 . 1 1 20 20 SER H H 88 8.100 8.100 8.321 -0.221 18517 5010 1 5 . 1 1 21 21 GLU N N 89 120.570 120.570 120.855 -0.285 18517 5011 1 5 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.095 -0.125 18517 5012 1 5 . 1 1 21 21 GLU C C 89 178.940 178.940 178.863 0.077 18517 5013 1 5 . 1 1 21 21 GLU CA C 89 59.260 59.260 58.590 0.670 18517 5014 1 5 . 1 1 21 21 GLU CB C 89 29.330 29.330 28.970 0.360 18517 5015 1 5 . 1 1 21 21 GLU H H 89 7.400 7.400 7.980 -0.580 18517 5016 1 5 . 1 1 22 22 ILE N N 90 119.350 119.350 119.477 -0.127 18517 5017 1 5 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.991 -0.301 18517 5018 1 5 . 1 1 22 22 ILE C C 90 177.230 177.230 178.450 -1.220 18517 5019 1 5 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.426 1.044 18517 5020 1 5 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.700 -0.310 18517 5021 1 5 . 1 1 22 22 ILE H H 90 7.250 7.250 8.224 -0.974 18517 5022 1 5 . 1 1 23 23 ILE N N 91 116.350 116.350 119.431 -3.081 18517 5023 1 5 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.874 -0.474 18517 5024 1 5 . 1 1 23 23 ILE C C 91 176.690 176.690 177.272 -0.582 18517 5025 1 5 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.049 2.681 18517 5026 1 5 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.509 0.261 18517 5027 1 5 . 1 1 23 23 ILE H H 91 7.860 7.860 8.334 -0.474 18517 5028 1 5 . 1 1 24 24 LYS N N 92 116.000 116.000 118.666 -2.666 18517 5029 1 5 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.212 -0.072 18517 5030 1 5 . 1 1 24 24 LYS C C 92 176.270 176.270 177.013 -0.743 18517 5031 1 5 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.343 0.137 18517 5032 1 5 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.770 0.530 18517 5033 1 5 . 1 1 24 24 LYS H H 92 7.170 7.170 7.872 -0.702 18517 5034 1 5 . 1 1 25 25 SER N N 93 114.650 114.650 115.358 -0.708 18517 5035 1 5 . 1 1 25 25 SER HA H 93 4.550 4.550 4.378 0.172 18517 5036 1 5 . 1 1 25 25 SER C C 93 173.370 173.370 173.346 0.024 18517 5037 1 5 . 1 1 25 25 SER CA C 93 57.240 57.240 59.297 -2.057 18517 5038 1 5 . 1 1 25 25 SER CB C 93 65.650 65.650 63.833 1.817 18517 5039 1 5 . 1 1 25 25 SER H H 93 7.730 7.730 7.918 -0.188 18517 5040 1 5 . 1 1 26 26 ASP N N 94 121.230 121.230 124.048 -2.818 18517 5041 1 5 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.812 0.118 18517 5042 1 5 . 1 1 26 26 ASP C C 94 176.560 176.560 175.084 1.476 18517 5043 1 5 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.413 1.097 18517 5044 1 5 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.901 0.749 18517 5045 1 5 . 1 1 26 26 ASP H H 94 8.280 8.280 8.564 -0.284 18517 5046 1 5 . 1 1 27 27 GLY N N 95 109.310 109.310 108.788 0.522 18517 5047 1 5 . 1 1 27 27 GLY C C 95 171.080 171.080 171.430 -0.350 18517 5048 1 5 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.401 -0.631 18517 5049 1 5 . 1 1 27 27 GLY H H 95 8.160 8.160 7.674 0.486 18517 5050 1 5 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.584 0.556 18517 5051 1 5 . 1 1 29 29 PHE C C 97 175.230 175.230 174.942 0.288 18517 5052 1 5 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.498 -0.008 18517 5053 1 5 . 1 1 29 29 PHE CB C 97 41.620 41.620 41.874 -0.254 18517 5054 1 5 . 1 1 30 30 THR N N 98 112.600 112.600 115.291 -2.691 18517 5055 1 5 . 1 1 30 30 THR HA H 98 4.570 4.570 4.213 0.357 18517 5056 1 5 . 1 1 30 30 THR C C 98 176.690 176.690 174.847 1.843 18517 5057 1 5 . 1 1 30 30 THR CA C 98 60.290 60.290 61.014 -0.724 18517 5058 1 5 . 1 1 30 30 THR CB C 98 71.600 71.600 70.475 1.125 18517 5059 1 5 . 1 1 30 30 THR H H 98 8.990 8.990 8.320 0.670 18517 5060 1 5 . 1 1 31 31 ILE N N 99 119.240 119.240 125.295 -6.055 18517 5061 1 5 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.459 0.361 18517 5062 1 5 . 1 1 31 31 ILE C C 99 176.090 176.090 176.457 -0.367 18517 5063 1 5 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.557 -3.417 18517 5064 1 5 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.744 -0.794 18517 5065 1 5 . 1 1 31 31 ILE H H 99 9.230 9.230 7.996 1.234 18517 5066 1 5 . 1 1 32 32 LEU N N 100 119.660 119.660 117.994 1.666 18517 5067 1 5 . 1 1 32 32 LEU HA H 100 4.030 4.030 4.003 0.027 18517 5068 1 5 . 1 1 32 32 LEU C C 100 181.050 181.050 179.328 1.722 18517 5069 1 5 . 1 1 32 32 LEU CA C 100 57.560 57.560 58.131 -0.571 18517 5070 1 5 . 1 1 32 32 LEU CB C 100 40.120 40.120 41.314 -1.194 18517 5071 1 5 . 1 1 32 32 LEU H H 100 7.310 7.310 7.919 -0.609 18517 5072 1 5 . 1 1 33 33 GLN N N 101 121.450 121.450 117.127 4.323 18517 5073 1 5 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.406 -0.156 18517 5074 1 5 . 1 1 33 33 GLN CA C 101 59.700 59.700 58.660 1.040 18517 5075 1 5 . 1 1 33 33 GLN CB C 101 31.790 31.790 27.903 3.887 18517 5076 1 5 . 1 1 33 33 GLN H H 101 7.790 7.790 7.485 0.305 18517 5077 1 5 . 1 1 34 34 LEU C C 102 178.590 178.590 178.660 -0.070 18517 5078 1 5 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.090 0.540 18517 5079 1 5 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.609 -0.299 18517 5080 1 5 . 1 1 35 35 VAL N N 103 118.520 118.520 117.843 0.677 18517 5081 1 5 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.653 -0.233 18517 5082 1 5 . 1 1 35 35 VAL C C 103 177.930 177.930 178.101 -0.171 18517 5083 1 5 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.316 -0.276 18517 5084 1 5 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.413 1.217 18517 5085 1 5 . 1 1 35 35 VAL H H 103 8.670 8.670 8.252 0.418 18517 5086 1 5 . 1 1 36 36 GLY N N 104 109.430 109.430 108.761 0.669 18517 5087 1 5 . 1 1 36 36 GLY C C 104 174.600 174.600 175.644 -1.044 18517 5088 1 5 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.328 0.712 18517 5089 1 5 . 1 1 36 36 GLY H H 104 7.880 7.880 8.076 -0.196 18517 5090 1 5 . 1 1 37 37 TYR N N 105 122.270 122.270 124.096 -1.826 18517 5091 1 5 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.409 -0.529 18517 5092 1 5 . 1 1 37 37 TYR C C 105 176.310 176.310 176.997 -0.687 18517 5093 1 5 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.205 3.896 18517 5094 1 5 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.741 -0.371 18517 5095 1 5 . 1 1 37 37 TYR H H 105 8.170 8.170 8.118 0.052 18517 5096 1 5 . 1 1 38 38 LEU N N 106 120.100 120.100 121.695 -1.595 18517 5097 1 5 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.834 -0.094 18517 5098 1 5 . 1 1 38 38 LEU C C 106 178.280 178.280 178.559 -0.279 18517 5099 1 5 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.135 0.495 18517 5100 1 5 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.582 1.148 18517 5101 1 5 . 1 1 38 38 LEU H H 106 7.610 7.610 8.183 -0.573 18517 5102 1 5 . 1 1 39 39 ARG N N 107 116.670 116.670 118.952 -2.282 18517 5103 1 5 . 1 1 39 39 ARG HA H 107 3.680 3.680 4.339 -0.659 18517 5104 1 5 . 1 1 39 39 ARG C C 107 179.480 179.480 178.601 0.879 18517 5105 1 5 . 1 1 39 39 ARG CA C 107 59.580 59.580 58.542 1.038 18517 5106 1 5 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.136 2.104 18517 5107 1 5 . 1 1 39 39 ARG H H 107 8.240 8.240 7.919 0.321 18517 5108 1 5 . 1 1 40 40 VAL N N 108 121.970 121.970 118.266 3.704 18517 5109 1 5 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.676 -0.276 18517 5110 1 5 . 1 1 40 40 VAL C C 108 178.440 178.440 177.967 0.473 18517 5111 1 5 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.589 1.361 18517 5112 1 5 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.077 -0.637 18517 5113 1 5 . 1 1 40 40 VAL H H 108 8.200 8.200 7.984 0.216 18517 5114 1 5 . 1 1 41 41 VAL N N 109 108.940 108.940 114.729 -5.789 18517 5115 1 5 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.704 0.536 18517 5116 1 5 . 1 1 41 41 VAL C C 109 175.070 175.070 176.943 -1.873 18517 5117 1 5 . 1 1 41 41 VAL CA C 109 62.590 62.590 64.754 -2.164 18517 5118 1 5 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.505 -0.855 18517 5119 1 5 . 1 1 41 41 VAL H H 109 7.760 7.760 7.868 -0.108 18517 5120 1 5 . 1 1 42 42 ASP N N 110 124.670 124.670 121.543 3.127 18517 5121 1 5 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.323 0.297 18517 5122 1 5 . 1 1 42 42 ASP C C 110 177.310 177.310 177.668 -0.358 18517 5123 1 5 . 1 1 42 42 ASP CA C 110 59.980 59.980 57.911 2.069 18517 5124 1 5 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.255 4.695 18517 5125 1 5 . 1 1 42 42 ASP H H 110 7.360 7.360 8.223 -0.863 18517 5126 1 5 . 1 1 43 43 THR N N 111 102.340 102.340 114.025 -11.685 18517 5127 1 5 . 1 1 43 43 THR HA H 111 5.100 5.100 4.022 1.078 18517 5128 1 5 . 1 1 43 43 THR C C 111 174.940 174.940 176.470 -1.530 18517 5129 1 5 . 1 1 43 43 THR CA C 111 60.650 60.650 65.809 -5.159 18517 5130 1 5 . 1 1 43 43 THR CB C 111 69.610 69.610 68.858 0.752 18517 5131 1 5 . 1 1 43 43 THR H H 111 6.380 6.380 7.963 -1.583 18517 5132 1 5 . 1 1 44 44 ASP N N 112 119.750 119.750 122.428 -2.678 18517 5133 1 5 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.321 -0.461 18517 5134 1 5 . 1 1 44 44 ASP C C 112 178.850 178.850 178.084 0.766 18517 5135 1 5 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.529 0.701 18517 5136 1 5 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.741 -1.341 18517 5137 1 5 . 1 1 44 44 ASP H H 112 9.050 9.050 7.958 1.092 18517 5138 1 5 . 1 1 45 45 LEU N N 113 123.910 123.910 120.869 3.041 18517 5139 1 5 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.938 -0.128 18517 5140 1 5 . 1 1 45 45 LEU C C 113 182.040 182.040 178.591 3.449 18517 5141 1 5 . 1 1 45 45 LEU CA C 113 57.320 57.320 57.924 -0.604 18517 5142 1 5 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.824 -1.074 18517 5143 1 5 . 1 1 45 45 LEU H H 113 9.710 9.710 7.709 2.001 18517 5144 1 5 . 1 1 46 46 LEU N N 114 117.640 117.640 119.530 -1.890 18517 5145 1 5 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.071 0.039 18517 5146 1 5 . 1 1 46 46 LEU C C 114 179.540 179.540 178.243 1.297 18517 5147 1 5 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.924 -0.364 18517 5148 1 5 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.217 0.253 18517 5149 1 5 . 1 1 46 46 LEU H H 114 8.270 8.270 8.140 0.130 18517 5150 1 5 . 1 1 47 47 LEU N N 115 116.520 116.520 115.053 1.467 18517 5151 1 5 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.416 -0.276 18517 5152 1 5 . 1 1 47 47 LEU C C 115 173.850 173.850 176.159 -2.309 18517 5153 1 5 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.758 0.662 18517 5154 1 5 . 1 1 47 47 LEU CB C 115 44.720 44.720 42.909 1.811 18517 5155 1 5 . 1 1 47 47 LEU H H 115 8.160 8.160 7.978 0.182 18517 5156 1 5 . 1 1 48 48 LYS N N 116 114.710 114.710 118.164 -3.454 18517 5157 1 5 . 1 1 48 48 LYS HA H 116 3.810 3.810 4.087 -0.277 18517 5158 1 5 . 1 1 48 48 LYS C C 116 176.510 176.510 175.801 0.709 18517 5159 1 5 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.683 0.517 18517 5160 1 5 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.446 -0.426 18517 5161 1 5 . 1 1 48 48 LYS H H 116 7.580 7.580 7.762 -0.182 18517 5162 1 5 . 1 1 49 49 VAL N N 117 119.050 119.050 119.629 -0.579 18517 5163 1 5 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.041 -0.431 18517 5164 1 5 . 1 1 49 49 VAL C C 117 175.860 175.860 175.412 0.448 18517 5165 1 5 . 1 1 49 49 VAL CA C 117 63.510 63.510 61.068 2.442 18517 5166 1 5 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.357 -0.007 18517 5167 1 5 . 1 1 49 49 VAL H H 117 7.980 7.980 8.109 -0.129 18517 5168 1 5 . 1 1 50 50 ASP N N 118 126.900 126.900 122.210 4.690 18517 5169 1 5 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.482 -0.232 18517 5170 1 5 . 1 1 50 50 ASP C C 118 177.700 177.700 177.503 0.197 18517 5171 1 5 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.215 0.835 18517 5172 1 5 . 1 1 50 50 ASP CB C 118 42.580 42.580 40.919 1.661 18517 5173 1 5 . 1 1 50 50 ASP H H 118 8.930 8.930 8.471 0.459 18517 5174 1 5 . 1 1 51 51 SER N N 119 124.790 124.790 120.245 4.545 18517 5175 1 5 . 1 1 51 51 SER HA H 119 4.070 4.070 4.197 -0.127 18517 5176 1 5 . 1 1 51 51 SER C C 119 177.220 177.220 176.352 0.868 18517 5177 1 5 . 1 1 51 51 SER CA C 119 61.640 61.640 62.259 -0.619 18517 5178 1 5 . 1 1 51 51 SER CB C 119 63.510 63.510 63.274 0.236 18517 5179 1 5 . 1 1 51 51 SER H H 119 8.560 8.560 8.781 -0.221 18517 5180 1 5 . 1 1 52 52 THR N N 120 119.880 119.880 116.484 3.396 18517 5181 1 5 . 1 1 52 52 THR HA H 120 4.190 4.190 4.157 0.033 18517 5182 1 5 . 1 1 52 52 THR C C 120 177.120 177.120 176.127 0.993 18517 5183 1 5 . 1 1 52 52 THR CA C 120 66.280 66.280 66.090 0.190 18517 5184 1 5 . 1 1 52 52 THR CB C 120 68.420 68.420 68.304 0.116 18517 5185 1 5 . 1 1 52 52 THR H H 120 8.310 8.310 8.263 0.047 18517 5186 1 5 . 1 1 53 53 LYS N N 121 122.270 122.270 122.408 -0.138 18517 5187 1 5 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.226 -0.106 18517 5188 1 5 . 1 1 53 53 LYS C C 121 178.970 178.970 178.914 0.056 18517 5189 1 5 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.225 0.355 18517 5190 1 5 . 1 1 53 53 LYS CB C 121 34.250 34.250 31.803 2.447 18517 5191 1 5 . 1 1 53 53 LYS H H 121 7.700 7.700 7.656 0.044 18517 5192 1 5 . 1 1 54 54 VAL N N 122 120.070 120.070 116.349 3.721 18517 5193 1 5 . 1 1 54 54 VAL HA H 122 3.430 3.430 4.117 -0.687 18517 5194 1 5 . 1 1 54 54 VAL C C 122 179.860 179.860 178.143 1.717 18517 5195 1 5 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.354 3.226 18517 5196 1 5 . 1 1 54 54 VAL CB C 122 32.820 32.820 30.803 2.017 18517 5197 1 5 . 1 1 54 54 VAL H H 122 7.890 7.890 8.115 -0.225 18517 5198 1 5 . 1 1 55 55 ASP N N 123 122.270 122.270 121.166 1.104 18517 5199 1 5 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.341 0.129 18517 5200 1 5 . 1 1 55 55 ASP C C 123 178.630 178.630 178.425 0.205 18517 5201 1 5 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.919 -0.119 18517 5202 1 5 . 1 1 55 55 ASP CB C 123 42.020 42.020 41.037 0.983 18517 5203 1 5 . 1 1 55 55 ASP H H 123 8.270 8.270 8.178 0.092 18517 5204 1 5 . 1 1 56 56 GLU N N 124 119.600 119.600 119.194 0.406 18517 5205 1 5 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.049 -0.079 18517 5206 1 5 . 1 1 56 56 GLU C C 124 179.920 179.920 179.040 0.880 18517 5207 1 5 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.193 0.868 18517 5208 1 5 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.513 0.457 18517 5209 1 5 . 1 1 56 56 GLU H H 124 8.610 8.610 8.243 0.367 18517 5210 1 5 . 1 1 57 57 ALA N N 125 120.070 120.070 121.549 -1.479 18517 5211 1 5 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.121 -0.291 18517 5212 1 5 . 1 1 57 57 ALA C C 125 178.760 178.760 179.701 -0.941 18517 5213 1 5 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.941 0.439 18517 5214 1 5 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.462 1.678 18517 5215 1 5 . 1 1 57 57 ALA H H 125 8.420 8.420 8.606 -0.186 18517 5216 1 5 . 1 1 58 58 GLY N N 126 106.740 106.740 106.273 0.467 18517 5217 1 5 . 1 1 58 58 GLY C C 126 175.740 175.740 175.914 -0.174 18517 5218 1 5 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.770 0.520 18517 5219 1 5 . 1 1 58 58 GLY H H 126 8.200 8.200 8.668 -0.468 18517 5220 1 5 . 1 1 59 59 LYS N N 127 120.920 120.920 122.256 -1.336 18517 5221 1 5 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.047 -0.117 18517 5222 1 5 . 1 1 59 59 LYS C C 127 180.320 180.320 178.939 1.381 18517 5223 1 5 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.488 0.722 18517 5224 1 5 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.504 0.476 18517 5225 1 5 . 1 1 59 59 LYS H H 127 8.000 8.000 8.016 -0.016 18517 5226 1 5 . 1 1 60 60 LYS N N 128 118.400 118.400 119.752 -1.352 18517 5227 1 5 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.146 0.024 18517 5228 1 5 . 1 1 60 60 LYS C C 128 180.030 180.030 179.171 0.859 18517 5229 1 5 . 1 1 60 60 LYS CA C 128 58.750 58.750 59.238 -0.488 18517 5230 1 5 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.051 0.219 18517 5231 1 5 . 1 1 60 60 LYS H H 128 7.170 7.170 7.897 -0.727 18517 5232 1 5 . 1 1 61 61 VAL N N 129 121.050 121.050 120.661 0.389 18517 5233 1 5 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.501 -0.221 18517 5234 1 5 . 1 1 61 61 VAL C C 129 177.120 177.120 177.727 -0.607 18517 5235 1 5 . 1 1 61 61 VAL CA C 129 67.350 67.350 66.948 0.402 18517 5236 1 5 . 1 1 61 61 VAL CB C 129 31.630 31.630 30.948 0.682 18517 5237 1 5 . 1 1 61 61 VAL H H 129 7.980 7.980 8.078 -0.098 18517 5238 1 5 . 1 1 62 62 LYS N N 130 120.040 120.040 119.971 0.069 18517 5239 1 5 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.899 -0.199 18517 5240 1 5 . 1 1 62 62 LYS C C 130 178.550 178.550 178.865 -0.315 18517 5241 1 5 . 1 1 62 62 LYS CA C 130 60.330 60.330 60.137 0.193 18517 5242 1 5 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.327 1.443 18517 5243 1 5 . 1 1 62 62 LYS H H 130 8.910 8.910 8.646 0.264 18517 5244 1 5 . 1 1 63 63 ALA N N 131 119.570 119.570 122.172 -2.602 18517 5245 1 5 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.040 0.180 18517 5246 1 5 . 1 1 63 63 ALA C C 131 180.520 180.520 179.217 1.303 18517 5247 1 5 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.154 0.066 18517 5248 1 5 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.079 0.391 18517 5249 1 5 . 1 1 63 63 ALA H H 131 7.920 7.920 8.088 -0.168 18517 5250 1 5 . 1 1 64 64 TYR N N 132 120.510 120.510 120.417 0.093 18517 5251 1 5 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.156 0.304 18517 5252 1 5 . 1 1 64 64 TYR C C 132 176.510 176.510 177.655 -1.145 18517 5253 1 5 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.823 -0.183 18517 5254 1 5 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.692 -0.002 18517 5255 1 5 . 1 1 64 64 TYR H H 132 7.930 7.930 8.041 -0.111 18517 5256 1 5 . 1 1 65 65 LEU N N 133 117.290 117.290 118.630 -1.340 18517 5257 1 5 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.701 0.139 18517 5258 1 5 . 1 1 65 65 LEU C C 133 178.610 178.610 179.484 -0.874 18517 5259 1 5 . 1 1 65 65 LEU CA C 133 57.720 57.720 57.641 0.079 18517 5260 1 5 . 1 1 65 65 LEU CB C 133 40.430 40.430 40.526 -0.096 18517 5261 1 5 . 1 1 65 65 LEU H H 133 8.240 8.240 8.376 -0.136 18517 5262 1 5 . 1 1 66 66 GLU N N 134 119.140 119.140 119.694 -0.554 18517 5263 1 5 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.101 -0.241 18517 5264 1 5 . 1 1 66 66 GLU C C 134 180.200 180.200 179.148 1.052 18517 5265 1 5 . 1 1 66 66 GLU CA C 134 59.940 59.940 59.137 0.803 18517 5266 1 5 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.439 0.371 18517 5267 1 5 . 1 1 66 66 GLU H H 134 8.370 8.370 8.625 -0.255 18517 5268 1 5 . 1 1 67 67 LYS N N 135 121.390 121.390 119.090 2.300 18517 5269 1 5 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.054 -0.054 18517 5270 1 5 . 1 1 67 67 LYS C C 135 179.080 179.080 178.722 0.358 18517 5271 1 5 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.849 0.771 18517 5272 1 5 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.566 -0.295 18517 5273 1 5 . 1 1 67 67 LYS H H 135 7.820 7.820 7.808 0.012 18517 5274 1 5 . 1 1 68 68 ILE N N 136 110.310 110.310 112.110 -1.800 18517 5275 1 5 . 1 1 68 68 ILE HA H 136 4.300 4.300 3.970 0.330 18517 5276 1 5 . 1 1 68 68 ILE C C 136 175.520 175.520 175.964 -0.444 18517 5277 1 5 . 1 1 68 68 ILE CA C 136 62.430 62.430 62.056 0.374 18517 5278 1 5 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.536 -0.556 18517 5279 1 5 . 1 1 68 68 ILE H H 136 7.380 7.380 7.533 -0.153 18517 5280 1 5 . 1 1 69 69 GLY N N 137 106.680 106.680 107.380 -0.700 18517 5281 1 5 . 1 1 69 69 GLY C C 137 174.160 174.160 173.868 0.292 18517 5282 1 5 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.429 1.041 18517 5283 1 5 . 1 1 69 69 GLY H H 137 7.470 7.470 7.958 -0.488 18517 5284 1 5 . 1 1 70 70 ILE N N 138 124.310 124.310 122.638 1.672 18517 5285 1 5 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.297 -0.097 18517 5286 1 5 . 1 1 70 70 ILE C C 138 174.190 174.190 175.095 -0.905 18517 5287 1 5 . 1 1 70 70 ILE CA C 138 59.380 59.380 59.393 -0.013 18517 5288 1 5 . 1 1 70 70 ILE CB C 138 37.340 37.340 38.272 -0.932 18517 5289 1 5 . 1 1 70 70 ILE H H 138 8.530 8.530 8.305 0.225 18517 5290 1 5 . 1 1 71 71 ARG N N 139 125.490 125.490 127.888 -2.398 18517 5291 1 5 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.559 0.061 18517 5292 1 5 . 1 1 71 71 ARG C C 139 175.750 175.750 175.287 0.463 18517 5293 1 5 . 1 1 71 71 ARG CA C 139 54.660 54.660 55.462 -0.802 18517 5294 1 5 . 1 1 71 71 ARG CB C 139 33.140 33.140 31.376 1.764 18517 5295 1 5 . 1 1 71 71 ARG H H 139 8.240 8.240 8.461 -0.221 18517 5296 1 5 . 1 1 72 72 GLY N N 140 104.750 104.750 109.911 -5.161 18517 5297 1 5 . 1 1 72 72 GLY C C 140 172.920 172.920 173.022 -0.102 18517 5298 1 5 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.154 1.276 18517 5299 1 5 . 1 1 72 72 GLY H H 140 7.900 7.900 8.306 -0.406 18517 5300 1 5 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.584 -0.074 18517 5301 1 5 . 1 1 73 73 ASP C C 141 175.060 175.060 176.180 -1.120 18517 5302 1 5 . 1 1 73 73 ASP CA C 141 56.170 56.170 56.011 0.158 18517 5303 1 5 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.704 -0.874 18517 5304 1 5 . 1 1 74 74 SER N N 142 110.240 110.240 112.406 -2.166 18517 5305 1 5 . 1 1 74 74 SER HA H 142 4.740 4.740 4.801 -0.061 18517 5306 1 5 . 1 1 74 74 SER C C 142 175.110 175.110 175.260 -0.150 18517 5307 1 5 . 1 1 74 74 SER CA C 142 55.700 55.700 57.134 -1.434 18517 5308 1 5 . 1 1 74 74 SER CB C 142 67.390 67.390 65.808 1.581 18517 5309 1 5 . 1 1 74 74 SER H H 142 7.560 7.560 7.726 -0.166 18517 5310 1 5 . 1 1 75 75 VAL N N 143 122.950 122.950 121.094 1.856 18517 5311 1 5 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.821 -0.091 18517 5312 1 5 . 1 1 75 75 VAL C C 143 176.230 176.230 177.358 -1.128 18517 5313 1 5 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.665 0.975 18517 5314 1 5 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.871 -0.631 18517 5315 1 5 . 1 1 75 75 VAL H H 143 9.470 9.470 8.807 0.663 18517 5316 1 5 . 1 1 76 76 GLU N N 144 121.390 121.390 121.711 -0.321 18517 5317 1 5 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.035 -0.395 18517 5318 1 5 . 1 1 76 76 GLU C C 144 176.880 176.880 178.083 -1.203 18517 5319 1 5 . 1 1 76 76 GLU CA C 144 63.310 63.310 60.114 3.196 18517 5320 1 5 . 1 1 76 76 GLU CB C 144 28.070 28.070 27.916 0.154 18517 5321 1 5 . 1 1 76 76 GLU H H 144 9.640 9.640 8.637 1.003 18517 5322 1 5 . 1 1 77 77 ALA N N 145 118.770 118.770 122.193 -3.423 18517 5323 1 5 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.312 -0.052 18517 5324 1 5 . 1 1 77 77 ALA C C 145 180.350 180.350 179.374 0.976 18517 5325 1 5 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.170 0.610 18517 5326 1 5 . 1 1 77 77 ALA CB C 145 19.190 19.190 17.969 1.221 18517 5327 1 5 . 1 1 77 77 ALA H H 145 7.860 7.860 7.802 0.058 18517 5328 1 5 . 1 1 78 78 ALA N N 146 120.920 120.920 122.842 -1.922 18517 5329 1 5 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.015 0.125 18517 5330 1 5 . 1 1 78 78 ALA C C 146 179.150 179.150 178.934 0.216 18517 5331 1 5 . 1 1 78 78 ALA CA C 146 55.260 55.260 55.035 0.225 18517 5332 1 5 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.454 0.336 18517 5333 1 5 . 1 1 78 78 ALA H H 146 8.110 8.110 8.386 -0.276 18517 5334 1 5 . 1 1 79 79 LEU N N 147 118.810 118.810 119.626 -0.816 18517 5335 1 5 . 1 1 79 79 LEU HA H 147 3.880 3.880 3.982 -0.102 18517 5336 1 5 . 1 1 79 79 LEU C C 147 179.080 179.080 178.319 0.761 18517 5337 1 5 . 1 1 79 79 LEU CA C 147 58.390 58.390 58.069 0.321 18517 5338 1 5 . 1 1 79 79 LEU CB C 147 42.260 42.260 40.923 1.337 18517 5339 1 5 . 1 1 79 79 LEU H H 147 8.360 8.360 8.327 0.033 18517 5340 1 5 . 1 1 80 80 ASP N N 148 121.620 121.620 119.679 1.941 18517 5341 1 5 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.243 0.277 18517 5342 1 5 . 1 1 80 80 ASP C C 148 178.800 178.800 177.956 0.844 18517 5343 1 5 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.050 0.340 18517 5344 1 5 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.855 -0.105 18517 5345 1 5 . 1 1 80 80 ASP H H 148 8.770 8.770 8.287 0.483 18517 5346 1 5 . 1 1 81 81 ASN N N 149 118.630 118.630 118.448 0.182 18517 5347 1 5 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.490 0.080 18517 5348 1 5 . 1 1 81 81 ASN C C 149 177.970 177.970 178.012 -0.042 18517 5349 1 5 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.074 -0.064 18517 5350 1 5 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.531 0.079 18517 5351 1 5 . 1 1 81 81 ASN H H 149 7.960 7.960 8.103 -0.143 18517 5352 1 5 . 1 1 82 82 LEU N N 150 120.030 120.030 120.669 -0.639 18517 5353 1 5 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.916 0.144 18517 5354 1 5 . 1 1 82 82 LEU C C 150 177.790 177.790 179.026 -1.236 18517 5355 1 5 . 1 1 82 82 LEU CA C 150 58.870 58.870 57.935 0.935 18517 5356 1 5 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.777 0.083 18517 5357 1 5 . 1 1 82 82 LEU H H 150 8.230 8.230 8.427 -0.197 18517 5358 1 5 . 1 1 83 83 MET N N 151 115.820 115.820 118.714 -2.894 18517 5359 1 5 . 1 1 83 83 MET HA H 151 4.390 4.390 3.843 0.547 18517 5360 1 5 . 1 1 83 83 MET C C 151 179.760 179.760 178.799 0.961 18517 5361 1 5 . 1 1 83 83 MET CA C 151 57.400 57.400 58.010 -0.610 18517 5362 1 5 . 1 1 83 83 MET CB C 151 31.080 31.080 31.353 -0.273 18517 5363 1 5 . 1 1 83 83 MET H H 151 8.800 8.800 8.324 0.476 18517 5364 1 5 . 1 1 84 84 ILE N N 152 120.330 120.330 119.231 1.099 18517 5365 1 5 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.804 0.036 18517 5366 1 5 . 1 1 84 84 ILE C C 152 178.660 178.660 178.332 0.328 18517 5367 1 5 . 1 1 84 84 ILE CA C 152 65.800 65.800 64.650 1.151 18517 5368 1 5 . 1 1 84 84 ILE CB C 152 38.450 38.450 36.135 2.315 18517 5369 1 5 . 1 1 84 84 ILE H H 152 8.540 8.540 8.869 -0.329 18517 5370 1 5 . 1 1 85 85 LYS N N 153 118.930 118.930 119.057 -0.127 18517 5371 1 5 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.109 0.091 18517 5372 1 5 . 1 1 85 85 LYS C C 153 179.650 179.650 179.626 0.024 18517 5373 1 5 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.203 1.777 18517 5374 1 5 . 1 1 85 85 LYS CB C 153 33.540 33.540 32.137 1.403 18517 5375 1 5 . 1 1 85 85 LYS H H 153 7.510 7.510 7.935 -0.425 18517 5376 1 5 . 1 1 86 86 VAL N N 154 119.810 119.810 120.531 -0.721 18517 5377 1 5 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.623 0.007 18517 5378 1 5 . 1 1 86 86 VAL C C 154 178.350 178.350 178.509 -0.159 18517 5379 1 5 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.740 0.490 18517 5380 1 5 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.685 1.055 18517 5381 1 5 . 1 1 86 86 VAL H H 154 8.740 8.740 8.292 0.448 18517 5382 1 5 . 1 1 87 87 TYR N N 155 118.370 118.370 119.171 -0.801 18517 5383 1 5 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.148 0.122 18517 5384 1 5 . 1 1 87 87 TYR C C 155 178.580 178.580 177.789 0.791 18517 5385 1 5 . 1 1 87 87 TYR CA C 155 62.910 62.910 60.618 2.292 18517 5386 1 5 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.185 0.795 18517 5387 1 5 . 1 1 87 87 TYR H H 155 8.520 8.520 8.627 -0.107 18517 5388 1 5 . 1 1 88 88 GLU N N 156 119.900 119.900 120.683 -0.783 18517 5389 1 5 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.200 -0.020 18517 5390 1 5 . 1 1 88 88 GLU C C 156 179.270 179.270 179.085 0.185 18517 5391 1 5 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.248 0.132 18517 5392 1 5 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.556 0.654 18517 5393 1 5 . 1 1 88 88 GLU H H 156 8.250 8.250 8.516 -0.266 18517 5394 1 5 . 1 1 89 89 ILE N N 157 119.510 119.510 118.533 0.977 18517 5395 1 5 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.956 0.124 18517 5396 1 5 . 1 1 89 89 ILE C C 157 177.890 177.890 178.310 -0.420 18517 5397 1 5 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.452 -0.142 18517 5398 1 5 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.230 0.980 18517 5399 1 5 . 1 1 89 89 ILE H H 157 7.630 7.630 7.784 -0.154 18517 5400 1 5 . 1 1 90 90 THR N N 158 114.240 114.240 115.578 -1.338 18517 5401 1 5 . 1 1 90 90 THR HA H 158 4.130 4.130 4.125 0.005 18517 5402 1 5 . 1 1 90 90 THR C C 158 175.530 175.530 176.165 -0.635 18517 5403 1 5 . 1 1 90 90 THR CA C 158 64.460 64.460 65.360 -0.900 18517 5404 1 5 . 1 1 90 90 THR CB C 158 69.610 69.610 69.038 0.572 18517 5405 1 5 . 1 1 90 90 THR H H 158 7.770 7.770 8.226 -0.456 18517 5406 1 5 . 1 1 91 91 LYS N N 159 120.280 120.280 118.132 2.148 18517 5407 1 5 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.271 0.039 18517 5408 1 5 . 1 1 91 91 LYS C C 159 177.420 177.420 177.691 -0.271 18517 5409 1 5 . 1 1 91 91 LYS CA C 159 57.400 57.400 57.354 0.046 18517 5410 1 5 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.359 -0.140 18517 5411 1 5 . 1 1 91 91 LYS H H 159 7.890 7.890 8.421 -0.531 18517 5412 1 5 . 1 1 92 92 GLY N N 160 107.910 107.910 108.314 -0.404 18517 5413 1 5 . 1 1 92 92 GLY C C 160 174.430 174.430 174.190 0.240 18517 5414 1 5 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.463 0.517 18517 5415 1 5 . 1 1 92 92 GLY H H 160 7.930 7.930 7.883 0.047 18517 5416 1 5 . 1 1 93 93 THR N N 161 113.570 113.570 113.839 -0.269 18517 5417 1 5 . 1 1 93 93 THR HA H 161 4.390 4.390 4.568 -0.178 18517 5418 1 5 . 1 1 93 93 THR C C 161 174.790 174.790 172.744 2.046 18517 5419 1 5 . 1 1 93 93 THR CA C 161 61.960 61.960 61.111 0.849 18517 5420 1 5 . 1 1 93 93 THR CB C 161 70.010 70.010 71.108 -1.098 18517 5421 1 5 . 1 1 93 93 THR H H 161 7.970 7.970 7.649 0.321 18517 5422 1 5 . 1 1 94 94 VAL N N 162 121.980 121.980 120.197 1.783 18517 5423 1 5 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.248 -0.128 18517 5424 1 5 . 1 1 94 94 VAL C C 162 176.300 176.300 175.290 1.010 18517 5425 1 5 . 1 1 94 94 VAL CA C 162 62.830 62.830 62.353 0.477 18517 5426 1 5 . 1 1 94 94 VAL CB C 162 33.060 33.060 32.022 1.038 18517 5427 1 5 . 1 1 94 94 VAL H H 162 8.130 8.130 8.418 -0.288 18517 5428 1 5 . 1 1 95 95 GLU N N 163 124.140 124.140 126.266 -2.126 18517 5429 1 5 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.540 -0.230 18517 5430 1 5 . 1 1 95 95 GLU C C 163 176.870 176.870 176.534 0.336 18517 5431 1 5 . 1 1 95 95 GLU CA C 163 57.080 57.080 54.228 2.852 18517 5432 1 5 . 1 1 95 95 GLU CB C 163 30.440 30.440 31.326 -0.886 18517 5433 1 5 . 1 1 95 95 GLU H H 163 8.490 8.490 8.750 -0.260 18517 5434 1 5 . 1 1 96 96 SER N N 164 116.800 116.800 118.560 -1.760 18517 5435 1 5 . 1 1 96 96 SER HA H 164 4.430 4.430 4.585 -0.155 18517 5436 1 5 . 1 1 96 96 SER C C 164 174.940 174.940 173.832 1.108 18517 5437 1 5 . 1 1 96 96 SER CA C 164 59.070 59.070 58.991 0.079 18517 5438 1 5 . 1 1 96 96 SER CB C 164 64.220 64.220 62.624 1.596 18517 5439 1 5 . 1 1 96 96 SER H H 164 8.300 8.300 8.540 -0.240 18517 5440 1 5 . 1 1 97 97 SER C C 165 174.660 174.660 173.304 1.356 18517 5441 1 5 . 1 1 97 97 SER CA C 165 58.870 58.870 58.572 0.298 18517 5442 1 5 . 1 1 97 97 SER CB C 165 64.060 64.060 64.946 -0.886 18517 5443 1 5 . 1 1 98 98 ALA N N 166 125.490 125.490 127.705 -2.215 18517 5444 1 5 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.469 -0.119 18517 5445 1 5 . 1 1 98 98 ALA C C 166 177.780 177.780 177.053 0.727 18517 5446 1 5 . 1 1 98 98 ALA CA C 166 53.000 53.000 51.731 1.269 18517 5447 1 5 . 1 1 98 98 ALA CB C 166 19.340 19.340 18.355 0.985 18517 5448 1 5 . 1 1 98 98 ALA H H 166 8.180 8.180 8.483 -0.303 18517 5449 1 5 . 1 1 99 99 GLN N N 167 118.690 118.690 124.613 -5.923 18517 5450 1 5 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.265 0.075 18517 5451 1 5 . 1 1 99 99 GLN C C 167 176.680 176.680 176.801 -0.121 18517 5452 1 5 . 1 1 99 99 GLN CA C 167 56.250 56.250 56.590 -0.340 18517 5453 1 5 . 1 1 99 99 GLN CB C 167 29.650 29.650 30.255 -0.605 18517 5454 1 5 . 1 1 99 99 GLN H H 167 8.170 8.170 8.309 -0.139 18517 5455 1 5 . 1 1 100 100 GLY N N 168 109.670 109.670 106.075 3.595 18517 5456 1 5 . 1 1 100 100 GLY C C 168 174.460 174.460 174.212 0.248 18517 5457 1 5 . 1 1 100 100 GLY CA C 168 45.670 45.670 44.968 0.702 18517 5458 1 5 . 1 1 100 100 GLY H H 168 8.250 8.250 8.588 -0.338 18517 5459 1 5 . 1 1 101 101 THR N N 169 112.660 112.660 113.709 -1.049 18517 5460 1 5 . 1 1 101 101 THR HA H 169 4.360 4.360 4.427 -0.067 18517 5461 1 5 . 1 1 101 101 THR C C 169 174.720 174.720 172.050 2.670 18517 5462 1 5 . 1 1 101 101 THR CA C 169 62.080 62.080 60.772 1.308 18517 5463 1 5 . 1 1 101 101 THR CB C 169 69.930 69.930 69.810 0.120 18517 5464 1 5 . 1 1 101 101 THR H H 169 8.070 8.070 7.696 0.374 18517 5465 1 5 . 1 1 102 102 ASP N N 170 123.090 123.090 119.089 4.001 18517 5466 1 5 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.874 -0.174 18517 5467 1 5 . 1 1 102 102 ASP C C 170 176.130 176.130 174.991 1.139 18517 5468 1 5 . 1 1 102 102 ASP CA C 170 54.780 54.780 53.517 1.263 18517 5469 1 5 . 1 1 102 102 ASP CB C 170 42.260 42.260 42.491 -0.231 18517 5470 1 5 . 1 1 102 102 ASP H H 170 8.170 8.170 8.316 -0.146 18517 5471 1 5 . 1 1 103 103 SER N N 171 117.110 117.110 117.357 -0.247 18517 5472 1 5 . 1 1 103 103 SER HA H 171 4.430 4.430 4.453 -0.023 18517 5473 1 5 . 1 1 103 103 SER C C 171 174.770 174.770 175.626 -0.856 18517 5474 1 5 . 1 1 103 103 SER CA C 171 57.960 57.960 56.449 1.511 18517 5475 1 5 . 1 1 103 103 SER CB C 171 64.940 64.940 64.747 0.193 18517 5476 1 5 . 1 1 103 103 SER H H 171 8.450 8.450 8.452 -0.002 18517 5477 1 5 . 1 1 104 104 GLU N N 172 122.970 122.970 125.231 -2.261 18517 5478 1 5 . 1 1 104 104 GLU HA H 172 4.030 4.030 4.043 -0.013 18517 5479 1 5 . 1 1 104 104 GLU C C 172 178.860 178.860 178.280 0.580 18517 5480 1 5 . 1 1 104 104 GLU CA C 172 59.700 59.700 59.295 0.405 18517 5481 1 5 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.775 -0.125 18517 5482 1 5 . 1 1 104 104 GLU H H 172 8.830 8.830 9.065 -0.235 18517 5483 1 5 . 1 1 105 105 GLU N N 173 119.750 119.750 118.660 1.090 18517 5484 1 5 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.055 -0.075 18517 5485 1 5 . 1 1 105 105 GLU C C 173 178.920 178.920 178.770 0.150 18517 5486 1 5 . 1 1 105 105 GLU CA C 173 60.060 60.060 59.112 0.948 18517 5487 1 5 . 1 1 105 105 GLU CB C 173 29.730 29.730 28.939 0.791 18517 5488 1 5 . 1 1 105 105 GLU H H 173 8.580 8.580 7.846 0.734 18517 5489 1 5 . 1 1 106 106 LEU N N 174 121.860 121.860 120.554 1.306 18517 5490 1 5 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.034 0.146 18517 5491 1 5 . 1 1 106 106 LEU C C 174 178.210 178.210 178.100 0.110 18517 5492 1 5 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.621 0.259 18517 5493 1 5 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.804 -0.654 18517 5494 1 5 . 1 1 106 106 LEU H H 174 7.920 7.920 7.291 0.629 18517 5495 1 5 . 1 1 107 107 LYS N N 175 118.740 118.740 117.889 0.851 18517 5496 1 5 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.976 -0.196 18517 5497 1 5 . 1 1 107 107 LYS C C 175 178.700 178.700 178.973 -0.273 18517 5498 1 5 . 1 1 107 107 LYS CA C 175 61.170 61.170 59.544 1.626 18517 5499 1 5 . 1 1 107 107 LYS CB C 175 32.430 32.430 31.708 0.722 18517 5500 1 5 . 1 1 107 107 LYS H H 175 8.340 8.340 8.473 -0.133 18517 5501 1 5 . 1 1 108 108 THR N N 176 113.820 113.820 117.670 -3.850 18517 5502 1 5 . 1 1 108 108 THR HA H 176 3.840 3.840 4.083 -0.243 18517 5503 1 5 . 1 1 108 108 THR C C 176 176.620 176.620 176.834 -0.214 18517 5504 1 5 . 1 1 108 108 THR CA C 176 66.910 66.910 66.368 0.542 18517 5505 1 5 . 1 1 108 108 THR CB C 176 69.610 69.610 68.556 1.054 18517 5506 1 5 . 1 1 108 108 THR H H 176 7.950 7.950 8.243 -0.293 18517 5507 1 5 . 1 1 109 109 LEU N N 177 124.380 124.380 121.891 2.489 18517 5508 1 5 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.224 -0.394 18517 5509 1 5 . 1 1 109 109 LEU C C 177 177.790 177.790 178.850 -1.060 18517 5510 1 5 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.353 0.637 18517 5511 1 5 . 1 1 109 109 LEU CB C 177 42.580 42.580 40.813 1.767 18517 5512 1 5 . 1 1 109 109 LEU H H 177 7.480 7.480 8.163 -0.683 18517 5513 1 5 . 1 1 110 110 LEU N N 178 117.230 117.230 120.097 -2.867 18517 5514 1 5 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.908 -0.068 18517 5515 1 5 . 1 1 110 110 LEU C C 178 179.540 179.540 179.642 -0.102 18517 5516 1 5 . 1 1 110 110 LEU CA C 178 58.390 58.390 58.214 0.176 18517 5517 1 5 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.499 0.841 18517 5518 1 5 . 1 1 110 110 LEU H H 178 8.670 8.670 8.351 0.319 18517 5519 1 5 . 1 1 111 111 LEU N N 179 119.230 119.230 120.883 -1.653 18517 5520 1 5 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.275 -0.195 18517 5521 1 5 . 1 1 111 111 LEU C C 179 179.310 179.310 179.470 -0.160 18517 5522 1 5 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.245 1.145 18517 5523 1 5 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.779 1.241 18517 5524 1 5 . 1 1 111 111 LEU H H 179 7.940 7.940 8.494 -0.554 18517 5525 1 5 . 1 1 112 112 LYS N N 180 121.910 121.910 120.907 1.003 18517 5526 1 5 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.069 0.121 18517 5527 1 5 . 1 1 112 112 LYS C C 180 178.740 178.740 179.355 -0.615 18517 5528 1 5 . 1 1 112 112 LYS CA C 180 59.180 59.180 60.029 -0.849 18517 5529 1 5 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.426 -0.556 18517 5530 1 5 . 1 1 112 112 LYS H H 180 7.420 7.420 8.134 -0.714 18517 5531 1 5 . 1 1 113 113 PHE N N 181 118.220 118.220 119.023 -0.803 18517 5532 1 5 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.256 0.494 18517 5533 1 5 . 1 1 113 113 PHE C C 181 178.520 178.520 177.991 0.529 18517 5534 1 5 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.386 -3.306 18517 5535 1 5 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.530 -0.550 18517 5536 1 5 . 1 1 113 113 PHE H H 181 9.000 9.000 8.821 0.179 18517 5537 1 5 . 1 1 114 114 SER N N 182 113.300 113.300 115.018 -1.718 18517 5538 1 5 . 1 1 114 114 SER HA H 182 3.930 3.930 4.138 -0.208 18517 5539 1 5 . 1 1 114 114 SER C C 182 177.080 177.080 176.893 0.187 18517 5540 1 5 . 1 1 114 114 SER CA C 182 62.000 62.000 62.457 -0.457 18517 5541 1 5 . 1 1 114 114 SER CB C 182 63.510 63.510 62.756 0.754 18517 5542 1 5 . 1 1 114 114 SER H H 182 8.620 8.620 8.758 -0.138 18517 5543 1 5 . 1 1 115 115 GLU N N 183 121.540 121.540 121.778 -0.238 18517 5544 1 5 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.092 -0.022 18517 5545 1 5 . 1 1 115 115 GLU C C 183 179.860 179.860 178.703 1.157 18517 5546 1 5 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.212 0.568 18517 5547 1 5 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.096 0.794 18517 5548 1 5 . 1 1 115 115 GLU H H 183 8.250 8.250 8.491 -0.241 18517 5549 1 5 . 1 1 116 116 ASP N N 184 121.740 121.740 121.101 0.639 18517 5550 1 5 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.428 0.082 18517 5551 1 5 . 1 1 116 116 ASP C C 184 179.570 179.570 178.424 1.146 18517 5552 1 5 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.312 0.248 18517 5553 1 5 . 1 1 116 116 ASP CB C 184 40.990 40.990 41.208 -0.218 18517 5554 1 5 . 1 1 116 116 ASP H H 184 8.840 8.840 8.308 0.532 18517 5555 1 5 . 1 1 117 117 LEU N N 185 121.420 121.420 121.455 -0.035 18517 5556 1 5 . 1 1 117 117 LEU HA H 185 4.130 4.130 3.943 0.187 18517 5557 1 5 . 1 1 117 117 LEU C C 185 178.840 178.840 178.350 0.490 18517 5558 1 5 . 1 1 117 117 LEU CA C 185 58.230 58.230 57.927 0.303 18517 5559 1 5 . 1 1 117 117 LEU CB C 185 42.650 42.650 42.103 0.547 18517 5560 1 5 . 1 1 117 117 LEU H H 185 8.350 8.350 8.140 0.210 18517 5561 1 5 . 1 1 118 118 LYS N N 186 119.640 119.640 118.981 0.659 18517 5562 1 5 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.840 0.280 18517 5563 1 5 . 1 1 118 118 LYS C C 186 178.820 178.820 178.580 0.240 18517 5564 1 5 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.694 0.046 18517 5565 1 5 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.350 0.160 18517 5566 1 5 . 1 1 118 118 LYS H H 186 8.220 8.220 8.332 -0.112 18517 5567 1 5 . 1 1 119 119 ALA N N 187 120.160 120.160 121.395 -1.235 18517 5568 1 5 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.071 0.089 18517 5569 1 5 . 1 1 119 119 ALA C C 187 180.450 180.450 179.790 0.660 18517 5570 1 5 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.276 -0.136 18517 5571 1 5 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.090 0.380 18517 5572 1 5 . 1 1 119 119 ALA H H 187 8.010 8.010 8.069 -0.059 18517 5573 1 5 . 1 1 120 120 GLU N N 188 117.930 117.930 118.598 -0.668 18517 5574 1 5 . 1 1 120 120 GLU HA H 188 4.180 4.180 4.073 0.107 18517 5575 1 5 . 1 1 120 120 GLU C C 188 178.780 178.780 178.573 0.207 18517 5576 1 5 . 1 1 120 120 GLU CA C 188 58.830 58.830 58.623 0.207 18517 5577 1 5 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.393 0.577 18517 5578 1 5 . 1 1 120 120 GLU H H 188 7.640 7.640 8.028 -0.388 18517 5579 1 5 . 1 1 121 121 GLN N N 189 117.230 117.230 121.038 -3.808 18517 5580 1 5 . 1 1 121 121 GLN HA H 189 4.230 4.230 3.855 0.375 18517 5581 1 5 . 1 1 121 121 GLN C C 189 179.190 179.190 177.891 1.299 18517 5582 1 5 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.952 0.788 18517 5583 1 5 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.468 1.181 18517 5584 1 5 . 1 1 121 121 GLN H H 189 8.280 8.280 8.233 0.047 18517 5585 1 5 . 1 1 122 122 GLU N N 190 118.340 118.340 119.441 -1.101 18517 5586 1 5 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.853 0.267 18517 5587 1 5 . 1 1 122 122 GLU C C 190 178.210 178.210 178.959 -0.749 18517 5588 1 5 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.790 -0.040 18517 5589 1 5 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.067 0.903 18517 5590 1 5 . 1 1 122 122 GLU H H 190 8.250 8.250 8.218 0.032 18517 5591 1 5 . 1 1 123 123 LEU N N 191 118.930 118.930 122.437 -3.507 18517 5592 1 5 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.943 0.147 18517 5593 1 5 . 1 1 123 123 LEU C C 191 178.500 178.500 178.300 0.200 18517 5594 1 5 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.196 -1.196 18517 5595 1 5 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.839 0.661 18517 5596 1 5 . 1 1 123 123 LEU H H 191 7.530 7.530 7.989 -0.460 18517 5597 1 5 . 1 1 124 124 HIS N N 192 115.650 115.650 117.959 -2.309 18517 5598 1 5 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.093 0.627 18517 5599 1 5 . 1 1 124 124 HIS C C 192 176.090 176.090 177.523 -1.433 18517 5600 1 5 . 1 1 124 124 HIS CA C 192 56.690 56.690 59.859 -3.169 18517 5601 1 5 . 1 1 124 124 HIS CB C 192 30.760 30.760 30.234 0.526 18517 5602 1 5 . 1 1 124 124 HIS H H 192 7.450 7.450 8.554 -1.104 18517 5603 1 5 . 1 1 125 125 SER N N 193 115.480 115.480 114.921 0.559 18517 5604 1 5 . 1 1 125 125 SER HA H 193 4.310 4.310 4.168 0.142 18517 5605 1 5 . 1 1 125 125 SER CA C 193 60.180 60.180 62.009 -1.829 18517 5606 1 5 . 1 1 125 125 SER CB C 193 64.060 64.060 62.596 1.464 18517 5607 1 5 . 1 1 125 125 SER H H 193 8.020 8.020 8.471 -0.451 18517 5608 1 5 . 1 1 126 126 GLU C C 194 177.410 177.410 179.349 -1.939 18517 5609 1 5 . 1 1 126 126 GLU CA C 194 57.840 57.840 59.052 -1.212 18517 5610 1 5 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.631 0.259 18517 5611 1 5 . 1 1 127 127 ALA N N 195 122.910 122.910 122.676 0.234 18517 5612 1 5 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.085 0.105 18517 5613 1 5 . 1 1 127 127 ALA C C 195 178.610 178.610 179.206 -0.596 18517 5614 1 5 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.953 -1.163 18517 5615 1 5 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.571 0.689 18517 5616 1 5 . 1 1 127 127 ALA H H 195 8.020 8.020 7.626 0.394 18517 5617 1 5 . 1 1 128 128 LYS N N 196 117.770 117.770 117.533 0.237 18517 5618 1 5 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.352 -0.092 18517 5619 1 5 . 1 1 128 128 LYS C C 196 177.400 177.400 176.384 1.016 18517 5620 1 5 . 1 1 128 128 LYS CA C 196 57.000 57.000 55.396 1.604 18517 5621 1 5 . 1 1 128 128 LYS CB C 196 32.740 32.740 33.681 -0.941 18517 5622 1 5 . 1 1 128 128 LYS H H 196 7.990 7.990 8.135 -0.145 18517 5623 1 5 . 1 1 129 129 GLY N N 197 109.010 109.010 108.141 0.869 18517 5624 1 5 . 1 1 129 129 GLY C C 197 175.770 175.770 175.164 0.606 18517 5625 1 5 . 1 1 129 129 GLY CA C 197 46.100 46.100 44.797 1.303 18517 5626 1 5 . 1 1 129 129 GLY H H 197 8.220 8.220 7.534 0.686 18517 5627 1 5 . 1 1 130 130 GLY N N 198 109.150 109.150 111.160 -2.010 18517 5628 1 5 . 1 1 130 130 GLY C C 198 174.760 174.760 175.269 -0.509 18517 5629 1 5 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.089 -0.159 18517 5630 1 5 . 1 1 130 130 GLY H H 198 8.210 8.210 8.771 -0.561 18517 5631 1 5 . 1 1 131 131 GLU N N 199 121.560 121.560 121.508 0.052 18517 5632 1 5 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.052 -0.032 18517 5633 1 5 . 1 1 131 131 GLU C C 199 178.500 178.500 178.508 -0.008 18517 5634 1 5 . 1 1 131 131 GLU CA C 199 59.900 59.900 58.810 1.090 18517 5635 1 5 . 1 1 131 131 GLU CB C 199 29.570 29.570 28.028 1.542 18517 5636 1 5 . 1 1 131 131 GLU H H 199 8.510 8.510 8.582 -0.072 18517 5637 1 5 . 1 1 132 132 ALA N N 200 122.390 122.390 122.261 0.129 18517 5638 1 5 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.209 -0.009 18517 5639 1 5 . 1 1 132 132 ALA C C 200 180.360 180.360 179.591 0.769 18517 5640 1 5 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.410 0.370 18517 5641 1 5 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.188 0.202 18517 5642 1 5 . 1 1 132 132 ALA H H 200 8.190 8.190 7.537 0.653 18517 5643 1 5 . 1 1 133 133 LEU N N 201 120.800 120.800 120.938 -0.138 18517 5644 1 5 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.048 0.162 18517 5645 1 5 . 1 1 133 133 LEU C C 201 179.270 179.270 178.360 0.910 18517 5646 1 5 . 1 1 133 133 LEU CA C 201 57.680 57.680 58.161 -0.481 18517 5647 1 5 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.939 0.241 18517 5648 1 5 . 1 1 133 133 LEU H H 201 7.720 7.720 8.101 -0.381 18517 5649 1 5 . 1 1 134 134 LEU N N 202 120.680 120.680 118.924 1.756 18517 5650 1 5 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.982 -0.002 18517 5651 1 5 . 1 1 134 134 LEU C C 202 179.030 179.030 178.708 0.322 18517 5652 1 5 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.250 1.180 18517 5653 1 5 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.210 0.410 18517 5654 1 5 . 1 1 134 134 LEU H H 202 8.470 8.470 8.319 0.151 18517 5655 1 5 . 1 1 135 135 SER N N 203 113.290 113.290 114.596 -1.306 18517 5656 1 5 . 1 1 135 135 SER HA H 203 4.180 4.180 4.125 0.055 18517 5657 1 5 . 1 1 135 135 SER C C 203 177.300 177.300 176.831 0.469 18517 5658 1 5 . 1 1 135 135 SER CA C 203 62.080 62.080 61.676 0.404 18517 5659 1 5 . 1 1 135 135 SER CB C 203 63.030 63.030 62.864 0.166 18517 5660 1 5 . 1 1 135 135 SER H H 203 8.210 8.210 8.265 -0.055 18517 5661 1 5 . 1 1 136 136 SER N N 204 117.500 117.500 118.255 -0.755 18517 5662 1 5 . 1 1 136 136 SER HA H 204 4.050 4.050 4.242 -0.192 18517 5663 1 5 . 1 1 136 136 SER C C 204 177.570 177.570 176.733 0.837 18517 5664 1 5 . 1 1 136 136 SER CA C 204 61.880 61.880 61.103 0.777 18517 5665 1 5 . 1 1 136 136 SER CB C 204 63.510 63.510 62.891 0.619 18517 5666 1 5 . 1 1 136 136 SER H H 204 7.730 7.730 8.078 -0.348 18517 5667 1 5 . 1 1 137 137 MET N N 205 122.500 122.500 119.975 2.525 18517 5668 1 5 . 1 1 137 137 MET HA H 205 4.140 4.140 4.143 -0.003 18517 5669 1 5 . 1 1 137 137 MET C C 205 177.680 177.680 178.112 -0.432 18517 5670 1 5 . 1 1 137 137 MET CA C 205 60.140 60.140 59.401 0.739 18517 5671 1 5 . 1 1 137 137 MET CB C 205 33.460 33.460 32.108 1.352 18517 5672 1 5 . 1 1 137 137 MET H H 205 8.170 8.170 8.253 -0.083 18517 5673 1 5 . 1 1 138 138 LYS N N 206 121.410 121.410 120.012 1.398 18517 5674 1 5 . 1 1 138 138 LYS HA H 206 3.750 3.750 4.064 -0.314 18517 5675 1 5 . 1 1 138 138 LYS C C 206 178.780 178.780 179.306 -0.526 18517 5676 1 5 . 1 1 138 138 LYS CA C 206 60.330 60.330 59.721 0.609 18517 5677 1 5 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.417 -0.147 18517 5678 1 5 . 1 1 138 138 LYS H H 206 8.810 8.810 8.218 0.592 18517 5679 1 5 . 1 1 139 139 THR N N 207 116.580 116.580 116.326 0.254 18517 5680 1 5 . 1 1 139 139 THR HA H 207 4.060 4.060 4.007 0.053 18517 5681 1 5 . 1 1 139 139 THR C C 207 176.730 176.730 176.860 -0.130 18517 5682 1 5 . 1 1 139 139 THR CA C 207 67.150 67.150 66.792 0.358 18517 5683 1 5 . 1 1 139 139 THR CB C 207 69.220 69.220 68.330 0.890 18517 5684 1 5 . 1 1 139 139 THR H H 207 7.930 7.930 8.204 -0.274 18517 5685 1 5 . 1 1 140 140 GLN N N 208 121.390 121.390 121.745 -0.355 18517 5686 1 5 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.041 0.019 18517 5687 1 5 . 1 1 140 140 GLN C C 208 178.550 178.550 177.785 0.765 18517 5688 1 5 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.204 0.096 18517 5689 1 5 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.734 0.126 18517 5690 1 5 . 1 1 140 140 GLN H H 208 7.600 7.600 8.168 -0.568 18517 5691 1 5 . 1 1 141 141 HIS N N 209 122.360 122.360 119.738 2.622 18517 5692 1 5 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.281 -0.451 18517 5693 1 5 . 1 1 141 141 HIS C C 209 176.390 176.390 177.373 -0.983 18517 5694 1 5 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.564 1.156 18517 5695 1 5 . 1 1 141 141 HIS CB C 209 29.100 29.100 29.919 -0.819 18517 5696 1 5 . 1 1 141 141 HIS H H 209 8.980 8.980 8.226 0.753 18517 5697 1 5 . 1 1 142 142 ASP N N 210 120.740 120.740 120.224 0.516 18517 5698 1 5 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.471 -0.121 18517 5699 1 5 . 1 1 142 142 ASP C C 210 179.490 179.490 178.489 1.001 18517 5700 1 5 . 1 1 142 142 ASP CA C 210 57.920 57.920 58.677 -0.757 18517 5701 1 5 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.702 -0.112 18517 5702 1 5 . 1 1 142 142 ASP H H 210 8.770 8.770 8.951 -0.181 18517 5703 1 5 . 1 1 143 143 GLU N N 211 119.010 119.010 121.274 -2.264 18517 5704 1 5 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.076 -0.106 18517 5705 1 5 . 1 1 143 143 GLU C C 211 179.070 179.070 178.878 0.192 18517 5706 1 5 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.369 -0.069 18517 5707 1 5 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.777 -0.287 18517 5708 1 5 . 1 1 143 143 GLU H H 211 7.850 7.850 7.814 0.036 18517 5709 1 5 . 1 1 144 144 LEU N N 212 122.500 122.500 120.542 1.958 18517 5710 1 5 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.084 -0.014 18517 5711 1 5 . 1 1 144 144 LEU C C 212 179.340 179.340 179.229 0.111 18517 5712 1 5 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.136 0.254 18517 5713 1 5 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.195 0.985 18517 5714 1 5 . 1 1 144 144 LEU H H 212 8.070 8.070 8.388 -0.318 18517 5715 1 5 . 1 1 145 145 LEU N N 213 118.110 118.110 118.611 -0.501 18517 5716 1 5 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.776 0.424 18517 5717 1 5 . 1 1 145 145 LEU C C 213 179.610 179.610 179.139 0.471 18517 5718 1 5 . 1 1 145 145 LEU CA C 213 58.750 58.750 58.011 0.739 18517 5719 1 5 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.195 0.035 18517 5720 1 5 . 1 1 145 145 LEU H H 213 8.370 8.370 8.232 0.138 18517 5721 1 5 . 1 1 146 146 LYS N N 214 117.290 117.290 119.979 -2.689 18517 5722 1 5 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.964 -0.134 18517 5723 1 5 . 1 1 146 146 LYS C C 214 179.900 179.900 178.844 1.056 18517 5724 1 5 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.071 1.259 18517 5725 1 5 . 1 1 146 146 LYS CB C 214 32.350 32.350 31.890 0.460 18517 5726 1 5 . 1 1 146 146 LYS H H 214 7.560 7.560 8.089 -0.529 18517 5727 1 5 . 1 1 147 147 LYS N N 215 120.330 120.330 119.448 0.882 18517 5728 1 5 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.028 -0.008 18517 5729 1 5 . 1 1 147 147 LYS C C 215 180.550 180.550 179.348 1.202 18517 5730 1 5 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.239 0.861 18517 5731 1 5 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.007 0.733 18517 5732 1 5 . 1 1 147 147 LYS H H 215 7.830 7.830 8.110 -0.280 18517 5733 1 5 . 1 1 148 148 PHE N N 216 117.370 117.370 117.742 -0.372 18517 5734 1 5 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.194 -0.114 18517 5735 1 5 . 1 1 148 148 PHE C C 216 178.200 178.200 177.262 0.938 18517 5736 1 5 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.151 0.969 18517 5737 1 5 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.539 1.181 18517 5738 1 5 . 1 1 148 148 PHE H H 216 8.010 8.010 8.347 -0.337 18517 5739 1 5 . 1 1 149 149 ALA N N 217 118.990 118.990 120.356 -1.366 18517 5740 1 5 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.221 -0.111 18517 5741 1 5 . 1 1 149 149 ALA C C 217 177.330 177.330 177.818 -0.488 18517 5742 1 5 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.130 0.620 18517 5743 1 5 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.785 -1.185 18517 5744 1 5 . 1 1 149 149 ALA H H 217 7.720 7.720 7.886 -0.166 18517 5745 1 5 . 1 1 150 150 ALA N N 218 118.690 118.690 120.918 -2.228 18517 5746 1 5 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.350 0.010 18517 5747 1 5 . 1 1 150 150 ALA C C 218 177.930 177.930 177.865 0.065 18517 5748 1 5 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.824 -0.734 18517 5749 1 5 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.694 0.046 18517 5750 1 5 . 1 1 150 150 ALA H H 218 7.280 7.280 7.734 -0.454 18517 5751 1 5 . 1 1 151 151 LEU N N 219 119.980 119.980 121.292 -1.312 18517 5752 1 5 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.461 -0.191 18517 5753 1 5 . 1 1 151 151 LEU C C 219 176.150 176.150 175.335 0.815 18517 5754 1 5 . 1 1 151 151 LEU CA C 219 56.170 56.170 54.789 1.381 18517 5755 1 5 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.625 -0.815 18517 5756 1 5 . 1 1 151 151 LEU H H 219 7.050 7.050 7.789 -0.739 18517 5757 1 5 . 1 1 152 152 THR N N 220 112.070 112.070 117.283 -5.213 18517 5758 1 5 . 1 1 152 152 THR HA H 220 4.700 4.700 4.817 -0.117 18517 5759 1 5 . 1 1 152 152 THR C C 220 173.400 173.400 173.250 0.150 18517 5760 1 5 . 1 1 152 152 THR CA C 220 58.190 58.190 58.578 -0.388 18517 5761 1 5 . 1 1 152 152 THR CB C 220 70.960 70.960 69.144 1.815 18517 5762 1 5 . 1 1 152 152 THR H H 220 8.040 8.040 8.191 -0.151 18517 5763 1 5 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.559 0.151 18517 5764 1 5 . 1 1 153 153 PRO C C 221 176.720 176.720 176.414 0.306 18517 5765 1 5 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.319 0.591 18517 5766 1 5 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.562 1.688 18517 5767 1 5 . 1 1 154 154 THR N N 222 120.460 120.460 118.480 1.980 18517 5768 1 5 . 1 1 154 154 THR HA H 222 4.250 4.250 4.313 -0.063 18517 5769 1 5 . 1 1 154 154 THR C C 222 175.190 175.190 174.996 0.194 18517 5770 1 5 . 1 1 154 154 THR CA C 222 64.650 64.650 62.431 2.219 18517 5771 1 5 . 1 1 154 154 THR CB C 222 70.410 70.410 68.559 1.851 18517 5772 1 5 . 1 1 154 154 THR H H 222 8.530 8.530 8.397 0.133 18517 5773 1 5 . 1 1 155 155 PHE N N 223 122.260 122.260 122.573 -0.313 18517 5774 1 5 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.783 0.207 18517 5775 1 5 . 1 1 155 155 PHE C C 223 172.560 172.560 175.053 -2.493 18517 5776 1 5 . 1 1 155 155 PHE CA C 223 56.770 56.770 57.089 -0.319 18517 5777 1 5 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.548 1.042 18517 5778 1 5 . 1 1 155 155 PHE H H 223 8.950 8.950 7.176 1.774 18517 5779 1 5 . 1 1 156 156 LEU N N 224 123.440 123.440 121.830 1.610 18517 5780 1 5 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.417 0.253 18517 5781 1 5 . 1 1 156 156 LEU C C 224 175.090 175.090 177.712 -2.622 18517 5782 1 5 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.631 -0.601 18517 5783 1 5 . 1 1 156 156 LEU CB C 224 46.300 46.300 42.557 3.743 18517 5784 1 5 . 1 1 156 156 LEU H H 224 7.210 7.210 7.371 -0.161 18517 5785 1 5 . 1 1 157 157 THR N N 225 113.010 113.010 113.561 -0.551 18517 5786 1 5 . 1 1 157 157 THR HA H 225 4.790 4.790 4.557 0.233 18517 5787 1 5 . 1 1 157 157 THR C C 225 176.130 176.130 174.846 1.284 18517 5788 1 5 . 1 1 157 157 THR CA C 225 59.860 59.860 60.968 -1.108 18517 5789 1 5 . 1 1 157 157 THR CB C 225 72.860 72.860 69.579 3.281 18517 5790 1 5 . 1 1 157 157 THR H H 225 9.200 9.200 8.262 0.938 18517 5791 1 5 . 1 1 158 158 SER N N 226 115.350 115.350 116.589 -1.239 18517 5792 1 5 . 1 1 158 158 SER C C 226 177.410 177.410 175.816 1.594 18517 5793 1 5 . 1 1 158 158 SER CA C 226 57.400 57.400 56.936 0.464 18517 5794 1 5 . 1 1 158 158 SER CB C 226 66.200 66.200 64.049 2.151 18517 5795 1 5 . 1 1 158 158 SER H H 226 8.830 8.830 8.420 0.410 18517 5796 1 5 . 1 1 159 159 GLU N N 227 121.200 121.200 122.753 -1.553 18517 5797 1 5 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.878 0.142 18517 5798 1 5 . 1 1 159 159 GLU C C 227 177.680 177.680 177.651 0.029 18517 5799 1 5 . 1 1 159 159 GLU CA C 227 59.500 59.500 59.051 0.449 18517 5800 1 5 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.608 -0.038 18517 5801 1 5 . 1 1 159 159 GLU H H 227 8.320 8.320 8.942 -0.622 18517 5802 1 5 . 1 1 160 160 ASP N N 228 115.350 115.350 117.543 -2.193 18517 5803 1 5 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.397 0.153 18517 5804 1 5 . 1 1 160 160 ASP C C 228 177.640 177.640 177.893 -0.253 18517 5805 1 5 . 1 1 160 160 ASP CA C 228 57.400 57.400 57.282 0.118 18517 5806 1 5 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.438 2.612 18517 5807 1 5 . 1 1 160 160 ASP H H 228 7.570 7.570 8.320 -0.750 18517 5808 1 5 . 1 1 161 161 ILE N N 229 108.150 108.150 115.275 -7.125 18517 5809 1 5 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.294 0.216 18517 5810 1 5 . 1 1 161 161 ILE C C 229 173.130 173.130 177.149 -4.019 18517 5811 1 5 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.723 -1.433 18517 5812 1 5 . 1 1 161 161 ILE CB C 229 39.400 39.400 38.995 0.405 18517 5813 1 5 . 1 1 161 161 ILE H H 229 7.190 7.190 7.585 -0.395 18517 5814 1 5 . 1 1 162 162 SER N N 230 115.290 115.290 117.697 -2.407 18517 5815 1 5 . 1 1 162 162 SER HA H 230 4.760 4.760 4.127 0.633 18517 5816 1 5 . 1 1 162 162 SER C C 230 176.060 176.060 174.070 1.990 18517 5817 1 5 . 1 1 162 162 SER CA C 230 57.920 57.920 57.582 0.338 18517 5818 1 5 . 1 1 162 162 SER CB C 230 66.120 66.120 62.090 4.029 18517 5819 1 5 . 1 1 162 162 SER H H 230 7.460 7.460 8.301 -0.841 18517 5820 1 5 . 1 1 163 163 GLY C C 231 173.260 173.260 173.113 0.147 18517 5821 1 5 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.838 0.712 18517 5822 1 5 . 1 1 164 164 TYR N N 232 115.290 115.290 118.634 -3.344 18517 5823 1 5 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.775 -0.075 18517 5824 1 5 . 1 1 164 164 TYR C C 232 172.820 172.820 173.678 -0.858 18517 5825 1 5 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.256 -0.156 18517 5826 1 5 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.854 -0.054 18517 5827 1 5 . 1 1 164 164 TYR H H 232 7.370 7.370 7.358 0.012 18517 5828 1 5 . 1 1 165 165 LEU N N 233 120.980 120.980 122.905 -1.925 18517 5829 1 5 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.523 -0.093 18517 5830 1 5 . 1 1 165 165 LEU C C 233 176.360 176.360 177.404 -1.044 18517 5831 1 5 . 1 1 165 165 LEU CA C 233 55.660 55.660 53.986 1.674 18517 5832 1 5 . 1 1 165 165 LEU CB C 233 40.430 40.430 42.586 -2.156 18517 5833 1 5 . 1 1 165 165 LEU H H 233 8.830 8.830 8.612 0.218 18517 5834 1 5 . 1 1 166 166 THR N N 234 116.170 116.170 114.233 1.937 18517 5835 1 5 . 1 1 166 166 THR HA H 234 4.010 4.010 3.569 0.441 18517 5836 1 5 . 1 1 166 166 THR C C 234 173.070 173.070 173.839 -0.769 18517 5837 1 5 . 1 1 166 166 THR CA C 234 62.910 62.910 63.901 -0.991 18517 5838 1 5 . 1 1 166 166 THR CB C 234 70.170 70.170 68.845 1.325 18517 5839 1 5 . 1 1 166 166 THR H H 234 8.050 8.050 8.420 -0.370 18517 5840 1 5 . 1 1 167 167 VAL N N 235 117.640 117.640 115.236 2.404 18517 5841 1 5 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.432 -0.222 18517 5842 1 5 . 1 1 167 167 VAL C C 235 172.330 172.330 173.191 -0.861 18517 5843 1 5 . 1 1 167 167 VAL CA C 235 58.750 58.750 58.111 0.639 18517 5844 1 5 . 1 1 167 167 VAL CB C 235 35.880 35.880 33.023 2.857 18517 5845 1 5 . 1 1 167 167 VAL H H 235 7.160 7.160 7.132 0.028 18517 5846 1 5 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.479 -0.289 18517 5847 1 5 . 1 1 168 168 PRO C C 236 173.710 173.710 175.399 -1.689 18517 5848 1 5 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.923 0.907 18517 5849 1 5 . 1 1 168 168 PRO CB C 236 32.270 32.270 33.029 -0.759 18517 5850 1 5 . 1 1 169 169 GLU N N 237 113.540 113.540 118.539 -4.999 18517 5851 1 5 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.005 0.375 18517 5852 1 5 . 1 1 169 169 GLU C C 237 176.690 176.690 178.096 -1.406 18517 5853 1 5 . 1 1 169 169 GLU CA C 237 53.750 53.750 54.687 -0.937 18517 5854 1 5 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.990 2.230 18517 5855 1 5 . 1 1 169 169 GLU H H 237 7.930 7.930 8.290 -0.360 18517 5856 1 5 . 1 1 170 170 TYR N N 238 119.400 119.400 121.352 -1.952 18517 5857 1 5 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.291 -0.291 18517 5858 1 5 . 1 1 170 170 TYR C C 238 177.610 177.610 177.030 0.580 18517 5859 1 5 . 1 1 170 170 TYR CA C 238 62.630 62.630 59.513 3.117 18517 5860 1 5 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.175 -0.435 18517 5861 1 5 . 1 1 170 170 TYR H H 238 8.490 8.490 8.178 0.312 18517 5862 1 5 . 1 1 171 171 GLY N N 239 104.160 104.160 104.961 -0.801 18517 5863 1 5 . 1 1 171 171 GLY C C 239 173.350 173.350 173.303 0.047 18517 5864 1 5 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.532 0.738 18517 5865 1 5 . 1 1 171 171 GLY H H 239 7.960 7.960 7.969 -0.009 18517 5866 1 5 . 1 1 172 172 ALA N N 240 121.860 121.860 123.062 -1.202 18517 5867 1 5 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.792 -0.622 18517 5868 1 5 . 1 1 172 172 ALA C C 240 172.160 172.160 174.357 -2.197 18517 5869 1 5 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.295 0.815 18517 5870 1 5 . 1 1 172 172 ALA CB C 240 20.930 20.930 20.453 0.477 18517 5871 1 5 . 1 1 172 172 ALA H H 240 6.910 6.910 7.781 -0.871 18517 5872 1 5 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.447 1.103 18517 5873 1 5 . 1 1 173 173 PRO C C 241 176.610 176.610 175.124 1.486 18517 5874 1 5 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.167 -0.647 18517 5875 1 5 . 1 1 173 173 PRO CB C 241 33.300 33.300 32.674 0.626 18517 5876 1 5 . 1 1 174 174 MET N N 242 114.000 114.000 120.230 -6.230 18517 5877 1 5 . 1 1 174 174 MET HA H 242 4.390 4.390 4.508 -0.118 18517 5878 1 5 . 1 1 174 174 MET C C 242 173.960 173.960 174.073 -0.113 18517 5879 1 5 . 1 1 174 174 MET CA C 242 54.660 54.660 54.219 0.441 18517 5880 1 5 . 1 1 174 174 MET CB C 242 34.170 34.170 35.636 -1.466 18517 5881 1 5 . 1 1 174 174 MET H H 242 8.040 8.040 7.680 0.360 18517 5882 1 5 . 1 1 175 175 ASN N N 243 119.570 119.570 121.840 -2.270 18517 5883 1 5 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.857 0.083 18517 5884 1 5 . 1 1 175 175 ASN C C 243 174.320 174.320 175.461 -1.141 18517 5885 1 5 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.530 0.550 18517 5886 1 5 . 1 1 175 175 ASN CB C 243 38.850 38.850 38.239 0.611 18517 5887 1 5 . 1 1 175 175 ASN H H 243 7.960 7.960 8.315 -0.355 18517 5888 1 5 . 1 1 176 176 ALA N N 244 132.250 132.250 129.322 2.928 18517 5889 1 5 . 1 1 176 176 ALA C C 244 181.580 181.580 178.643 2.937 18517 5890 1 5 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.532 0.238 18517 5891 1 5 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.741 0.289 18517 5892 1 5 . 1 1 176 176 ALA H H 244 12.110 12.110 8.629 3.481 18517 5893 1 5 . 1 1 177 177 ALA N N 245 125.780 125.780 120.832 4.948 18517 5894 1 5 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.999 -0.129 18517 5895 1 5 . 1 1 177 177 ALA C C 245 180.640 180.640 179.529 1.111 18517 5896 1 5 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.146 0.514 18517 5897 1 5 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.046 -0.206 18517 5898 1 5 . 1 1 177 177 ALA H H 245 10.240 10.240 8.036 2.204 18517 5899 1 5 . 1 1 178 178 LYS N N 246 119.810 119.810 119.169 0.641 18517 5900 1 5 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.070 -0.240 18517 5901 1 5 . 1 1 178 178 LYS C C 246 180.500 180.500 178.256 2.244 18517 5902 1 5 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.281 0.619 18517 5903 1 5 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.364 -1.044 18517 5904 1 5 . 1 1 178 178 LYS H H 246 8.470 8.470 7.768 0.702 18517 5905 1 5 . 1 1 179 179 TRP N N 247 121.170 121.170 121.589 -0.419 18517 5906 1 5 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.347 0.273 18517 5907 1 5 . 1 1 179 179 TRP C C 247 176.510 176.510 177.783 -1.273 18517 5908 1 5 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.680 0.140 18517 5909 1 5 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.627 -0.057 18517 5910 1 5 . 1 1 179 179 TRP H H 247 8.330 8.330 8.411 -0.081 18517 5911 1 5 . 1 1 180 180 ALA N N 248 119.130 119.130 120.418 -1.288 18517 5912 1 5 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.794 0.746 18517 5913 1 5 . 1 1 180 180 ALA C C 248 182.110 182.110 179.688 2.422 18517 5914 1 5 . 1 1 180 180 ALA CA C 248 54.190 54.190 55.139 -0.949 18517 5915 1 5 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.047 0.663 18517 5916 1 5 . 1 1 180 180 ALA H H 248 7.990 7.990 8.478 -0.488 18517 5917 1 5 . 1 1 181 181 LYS N N 249 116.000 116.000 119.316 -3.316 18517 5918 1 5 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.028 -0.058 18517 5919 1 5 . 1 1 181 181 LYS C C 249 179.380 179.380 178.938 0.442 18517 5920 1 5 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.452 -0.742 18517 5921 1 5 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.583 -0.073 18517 5922 1 5 . 1 1 181 181 LYS H H 249 6.900 6.900 7.822 -0.922 18517 5923 1 5 . 1 1 182 182 VAL N N 250 122.270 122.270 116.445 5.825 18517 5924 1 5 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.676 -0.336 18517 5925 1 5 . 1 1 182 182 VAL C C 250 178.160 178.160 177.573 0.587 18517 5926 1 5 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.193 0.567 18517 5927 1 5 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.401 -0.561 18517 5928 1 5 . 1 1 182 182 VAL H H 250 7.050 7.050 7.992 -0.942 18517 5929 1 5 . 1 1 183 183 GLU N N 251 120.520 120.520 120.841 -0.321 18517 5930 1 5 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.783 -0.603 18517 5931 1 5 . 1 1 183 183 GLU C C 251 179.480 179.480 178.952 0.528 18517 5932 1 5 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.912 0.778 18517 5933 1 5 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.868 -0.798 18517 5934 1 5 . 1 1 183 183 GLU H H 251 8.020 8.020 8.652 -0.632 18517 5935 1 5 . 1 1 184 184 GLY N N 252 102.930 102.930 106.919 -3.989 18517 5936 1 5 . 1 1 184 184 GLY C C 252 176.920 176.920 176.443 0.477 18517 5937 1 5 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.141 0.269 18517 5938 1 5 . 1 1 184 184 GLY H H 252 7.830 7.830 8.094 -0.264 18517 5939 1 5 . 1 1 185 185 MET N N 253 123.200 123.200 121.683 1.517 18517 5940 1 5 . 1 1 185 185 MET HA H 253 4.250 4.250 4.070 0.180 18517 5941 1 5 . 1 1 185 185 MET C C 253 179.370 179.370 178.414 0.956 18517 5942 1 5 . 1 1 185 185 MET CA C 253 59.300 59.300 59.344 -0.044 18517 5943 1 5 . 1 1 185 185 MET CB C 253 33.930 33.930 32.484 1.446 18517 5944 1 5 . 1 1 185 185 MET H H 253 7.890 7.890 7.807 0.083 18517 5945 1 5 . 1 1 186 186 ILE N N 254 120.150 120.150 119.876 0.274 18517 5946 1 5 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.619 -0.059 18517 5947 1 5 . 1 1 186 186 ILE C C 254 177.250 177.250 178.212 -0.962 18517 5948 1 5 . 1 1 186 186 ILE CA C 254 66.520 66.520 64.621 1.899 18517 5949 1 5 . 1 1 186 186 ILE CB C 254 38.290 38.290 36.582 1.708 18517 5950 1 5 . 1 1 186 186 ILE H H 254 8.260 8.260 8.136 0.124 18517 5951 1 5 . 1 1 187 187 HIS N N 255 119.810 119.810 119.873 -0.063 18517 5952 1 5 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.208 -0.208 18517 5953 1 5 . 1 1 187 187 HIS C C 255 176.460 176.460 177.645 -1.185 18517 5954 1 5 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.805 0.525 18517 5955 1 5 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.641 1.989 18517 5956 1 5 . 1 1 187 187 HIS H H 255 8.900 8.900 8.802 0.098 18517 5957 1 5 . 1 1 188 188 GLY N N 256 103.160 103.160 106.815 -3.655 18517 5958 1 5 . 1 1 188 188 GLY C C 256 176.320 176.320 176.262 0.058 18517 5959 1 5 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.734 0.156 18517 5960 1 5 . 1 1 188 188 GLY H H 256 8.030 8.030 8.429 -0.399 18517 5961 1 5 . 1 1 189 189 LYS N N 257 119.510 119.510 121.771 -2.261 18517 5962 1 5 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.030 -0.030 18517 5963 1 5 . 1 1 189 189 LYS C C 257 178.660 178.660 178.621 0.039 18517 5964 1 5 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.783 -1.294 18517 5965 1 5 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.663 -0.113 18517 5966 1 5 . 1 1 189 189 LYS H H 257 7.120 7.120 7.680 -0.560 18517 5967 1 5 . 1 1 190 190 LEU N N 258 120.570 120.570 119.443 1.127 18517 5968 1 5 . 1 1 190 190 LEU HA H 258 3.930 3.930 4.104 -0.174 18517 5969 1 5 . 1 1 190 190 LEU C C 258 177.230 177.230 178.903 -1.673 18517 5970 1 5 . 1 1 190 190 LEU CA C 258 57.520 57.520 56.863 0.657 18517 5971 1 5 . 1 1 190 190 LEU CB C 258 42.970 42.970 41.161 1.809 18517 5972 1 5 . 1 1 190 190 LEU H H 258 8.060 8.060 8.390 -0.330 18517 5973 1 5 . 1 1 191 191 GLU N N 259 114.590 114.590 117.340 -2.750 18517 5974 1 5 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.162 0.118 18517 5975 1 5 . 1 1 191 191 GLU C C 259 176.230 176.230 176.638 -0.408 18517 5976 1 5 . 1 1 191 191 GLU CA C 259 55.340 55.340 57.135 -1.795 18517 5977 1 5 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.511 -0.181 18517 5978 1 5 . 1 1 191 191 GLU H H 259 7.330 7.330 7.727 -0.397 18517 5979 1 5 . 1 1 192 192 SER N N 260 115.240 115.240 114.181 1.059 18517 5980 1 5 . 1 1 192 192 SER HA H 260 4.490 4.490 4.418 0.072 18517 5981 1 5 . 1 1 192 192 SER C C 260 173.770 173.770 175.756 -1.986 18517 5982 1 5 . 1 1 192 192 SER CA C 260 58.350 58.350 58.060 0.290 18517 5983 1 5 . 1 1 192 192 SER CB C 260 65.090 65.090 64.068 1.022 18517 5984 1 5 . 1 1 192 192 SER H H 260 7.130 7.130 7.181 -0.051 18517 5985 1 5 . 1 1 193 193 SER C C 261 174.600 174.600 173.489 1.111 18517 5986 1 5 . 1 1 193 193 SER CA C 261 59.980 59.980 58.602 1.378 18517 5987 1 5 . 1 1 193 193 SER CB C 261 63.750 63.750 62.320 1.430 18517 5988 1 5 . 1 1 194 194 GLU N N 262 121.800 121.800 122.097 -0.297 18517 5989 1 5 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.242 0.228 18517 5990 1 5 . 1 1 194 194 GLU C C 262 174.650 174.650 175.997 -1.347 18517 5991 1 5 . 1 1 194 194 GLU CA C 262 55.620 55.620 56.301 -0.681 18517 5992 1 5 . 1 1 194 194 GLU CB C 262 30.210 30.210 29.907 0.302 18517 5993 1 5 . 1 1 194 194 GLU H H 262 7.840 7.840 7.399 0.441 18517 5994 1 5 . 1 1 195 195 VAL N N 263 124.080 124.080 125.360 -1.280 18517 5995 1 5 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.383 -0.133 18517 5996 1 5 . 1 1 195 195 VAL C C 263 174.460 174.460 174.182 0.278 18517 5997 1 5 . 1 1 195 195 VAL CA C 263 59.820 59.820 58.735 1.085 18517 5998 1 5 . 1 1 195 195 VAL CB C 263 33.620 33.620 33.413 0.207 18517 5999 1 5 . 1 1 195 195 VAL H H 263 8.020 8.020 8.127 -0.107 18517 6000 1 5 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.335 0.185 18517 6001 1 5 . 1 1 198 198 ASN C C 266 176.490 176.490 177.095 -0.605 18517 6002 1 5 . 1 1 198 198 ASN CA C 266 54.780 54.780 56.005 -1.225 18517 6003 1 5 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.897 0.163 18517 6004 1 5 . 1 1 199 199 LEU N N 267 120.680 120.680 120.925 -0.245 18517 6005 1 5 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.759 0.252 18517 6006 1 5 . 1 1 199 199 LEU C C 267 178.050 178.050 178.314 -0.264 18517 6007 1 5 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.161 0.669 18517 6008 1 5 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.581 0.759 18517 6009 1 5 . 1 1 199 199 LEU H H 267 7.660 7.660 8.147 -0.487 18517 6010 1 5 . 1 1 200 200 LYS N N 268 116.740 116.740 118.941 -2.201 18517 6011 1 5 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.998 -0.268 18517 6012 1 5 . 1 1 200 200 LYS C C 268 178.520 178.520 178.459 0.061 18517 6013 1 5 . 1 1 200 200 LYS CA C 268 61.800 61.800 58.739 3.061 18517 6014 1 5 . 1 1 200 200 LYS CB C 268 32.110 32.110 31.555 0.555 18517 6015 1 5 . 1 1 200 200 LYS H H 268 8.280 8.280 8.160 0.120 18517 6016 1 5 . 1 1 201 201 ALA N N 269 121.270 121.270 122.506 -1.236 18517 6017 1 5 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.159 0.081 18517 6018 1 5 . 1 1 201 201 ALA C C 269 180.890 180.890 179.810 1.080 18517 6019 1 5 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.030 0.150 18517 6020 1 5 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.083 0.387 18517 6021 1 5 . 1 1 201 201 ALA H H 269 7.710 7.710 7.975 -0.265 18517 6022 1 5 . 1 1 202 202 LEU N N 270 119.980 119.980 119.524 0.456 18517 6023 1 5 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.931 0.159 18517 6024 1 5 . 1 1 202 202 LEU C C 270 179.330 179.330 179.551 -0.221 18517 6025 1 5 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.851 0.219 18517 6026 1 5 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.389 1.031 18517 6027 1 5 . 1 1 202 202 LEU H H 270 7.750 7.750 8.363 -0.613 18517 6028 1 5 . 1 1 203 203 VAL N N 271 118.450 118.450 119.528 -1.078 18517 6029 1 5 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.762 0.068 18517 6030 1 5 . 1 1 203 203 VAL C C 271 177.110 177.110 177.870 -0.760 18517 6031 1 5 . 1 1 203 203 VAL CA C 271 67.710 67.710 66.982 0.728 18517 6032 1 5 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.504 0.206 18517 6033 1 5 . 1 1 203 203 VAL H H 271 8.560 8.560 8.314 0.246 18517 6034 1 5 . 1 1 204 204 ALA N N 272 122.560 122.560 122.278 0.282 18517 6035 1 5 . 1 1 204 204 ALA HA H 272 3.880 3.880 3.994 -0.114 18517 6036 1 5 . 1 1 204 204 ALA C C 272 178.700 178.700 179.627 -0.927 18517 6037 1 5 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.434 0.696 18517 6038 1 5 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.231 0.159 18517 6039 1 5 . 1 1 204 204 ALA H H 272 8.120 8.120 8.307 -0.187 18517 6040 1 5 . 1 1 205 205 GLU N N 273 117.290 117.290 119.119 -1.829 18517 6041 1 5 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.026 -0.036 18517 6042 1 5 . 1 1 205 205 GLU C C 273 178.630 178.630 179.115 -0.485 18517 6043 1 5 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.311 0.829 18517 6044 1 5 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.635 0.335 18517 6045 1 5 . 1 1 205 205 GLU H H 273 7.670 7.670 8.118 -0.448 18517 6046 1 5 . 1 1 206 206 LEU N N 274 120.450 120.450 121.548 -1.098 18517 6047 1 5 . 1 1 206 206 LEU HA H 274 4.000 4.000 3.990 0.010 18517 6048 1 5 . 1 1 206 206 LEU C C 274 178.400 178.400 178.452 -0.052 18517 6049 1 5 . 1 1 206 206 LEU CA C 274 58.910 58.910 57.944 0.966 18517 6050 1 5 . 1 1 206 206 LEU CB C 274 43.530 43.530 42.017 1.513 18517 6051 1 5 . 1 1 206 206 LEU H H 274 8.420 8.420 8.196 0.224 18517 6052 1 5 . 1 1 207 207 ILE N N 275 117.580 117.580 121.012 -3.432 18517 6053 1 5 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.558 -0.028 18517 6054 1 5 . 1 1 207 207 ILE C C 275 178.850 178.850 178.368 0.482 18517 6055 1 5 . 1 1 207 207 ILE CA C 275 66.080 66.080 65.868 0.212 18517 6056 1 5 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.730 1.040 18517 6057 1 5 . 1 1 207 207 ILE H H 275 8.700 8.700 8.402 0.298 18517 6058 1 5 . 1 1 208 208 GLU N N 276 119.100 119.100 118.930 0.170 18517 6059 1 5 . 1 1 208 208 GLU HA H 276 4.000 4.000 4.083 -0.083 18517 6060 1 5 . 1 1 208 208 GLU C C 276 178.540 178.540 179.134 -0.594 18517 6061 1 5 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.286 1.164 18517 6062 1 5 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.215 1.305 18517 6063 1 5 . 1 1 208 208 GLU H H 276 7.950 7.950 7.994 -0.044 18517 6064 1 5 . 1 1 209 209 LEU N N 277 120.590 120.590 122.253 -1.663 18517 6065 1 5 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.041 0.179 18517 6066 1 5 . 1 1 209 209 LEU C C 277 179.520 179.520 178.076 1.444 18517 6067 1 5 . 1 1 209 209 LEU CA C 277 58.350 58.350 58.554 -0.204 18517 6068 1 5 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.925 1.365 18517 6069 1 5 . 1 1 209 209 LEU H H 277 8.550 8.550 8.449 0.101 18517 6070 1 5 . 1 1 210 210 ARG N N 278 116.470 116.470 119.436 -2.966 18517 6071 1 5 . 1 1 210 210 ARG HA H 278 3.740 3.740 3.984 -0.244 18517 6072 1 5 . 1 1 210 210 ARG C C 278 179.190 179.190 178.500 0.690 18517 6073 1 5 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.556 2.124 18517 6074 1 5 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.215 1.185 18517 6075 1 5 . 1 1 210 210 ARG H H 278 8.590 8.590 8.556 0.034 18517 6076 1 5 . 1 1 211 211 ALA N N 279 120.470 120.470 122.031 -1.561 18517 6077 1 5 . 1 1 211 211 ALA HA H 279 3.910 3.910 3.998 -0.088 18517 6078 1 5 . 1 1 211 211 ALA C C 279 181.350 181.350 179.683 1.667 18517 6079 1 5 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.153 0.547 18517 6080 1 5 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.410 -1.130 18517 6081 1 5 . 1 1 211 211 ALA H H 279 8.050 8.050 8.196 -0.146 18517 6082 1 5 . 1 1 212 212 GLN N N 280 120.070 120.070 118.364 1.706 18517 6083 1 5 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.978 0.042 18517 6084 1 5 . 1 1 212 212 GLN C C 280 179.490 179.490 178.856 0.634 18517 6085 1 5 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.896 0.404 18517 6086 1 5 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.782 0.398 18517 6087 1 5 . 1 1 212 212 GLN H H 280 8.300 8.300 8.004 0.296 18517 6088 1 5 . 1 1 213 213 MET N N 281 119.810 119.810 118.294 1.516 18517 6089 1 5 . 1 1 213 213 MET HA H 281 3.730 3.730 4.258 -0.528 18517 6090 1 5 . 1 1 213 213 MET C C 281 177.490 177.490 178.789 -1.299 18517 6091 1 5 . 1 1 213 213 MET CA C 281 60.690 60.690 57.007 3.683 18517 6092 1 5 . 1 1 213 213 MET CB C 281 33.930 33.930 31.852 2.078 18517 6093 1 5 . 1 1 213 213 MET H H 281 8.420 8.420 8.803 -0.383 18517 6094 1 5 . 1 1 214 214 MET N N 282 114.000 114.000 119.032 -5.032 18517 6095 1 5 . 1 1 214 214 MET HA H 282 3.880 3.880 4.195 -0.315 18517 6096 1 5 . 1 1 214 214 MET C C 282 177.650 177.650 178.324 -0.674 18517 6097 1 5 . 1 1 214 214 MET CA C 282 58.670 58.670 57.576 1.094 18517 6098 1 5 . 1 1 214 214 MET CB C 282 33.300 33.300 31.552 1.748 18517 6099 1 5 . 1 1 214 214 MET H H 282 7.890 7.890 8.359 -0.469 18517 6100 1 5 . 1 1 215 215 ALA N N 283 119.970 119.970 122.621 -2.651 18517 6101 1 5 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.066 0.074 18517 6102 1 5 . 1 1 215 215 ALA C C 283 180.580 180.580 179.249 1.331 18517 6103 1 5 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.060 -0.950 18517 6104 1 5 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.167 -0.487 18517 6105 1 5 . 1 1 215 215 ALA H H 283 7.580 7.580 8.178 -0.598 18517 6106 1 5 . 1 1 216 216 LEU N N 284 120.920 120.920 118.581 2.339 18517 6107 1 5 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.172 -0.212 18517 6108 1 5 . 1 1 216 216 LEU C C 284 177.910 177.910 179.564 -1.654 18517 6109 1 5 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.264 0.656 18517 6110 1 5 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.006 0.494 18517 6111 1 5 . 1 1 216 216 LEU H H 284 7.460 7.460 8.086 -0.626 18517 6112 1 5 . 1 1 217 217 LEU N N 285 116.470 116.470 120.787 -4.317 18517 6113 1 5 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.744 -0.064 18517 6114 1 5 . 1 1 217 217 LEU C C 285 178.310 178.310 176.658 1.652 18517 6115 1 5 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.119 0.321 18517 6116 1 5 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.980 1.070 18517 6117 1 5 . 1 1 217 217 LEU H H 285 6.980 6.980 8.256 -1.276 18517 6118 1 5 . 1 1 218 218 TYR N N 286 111.080 111.080 113.581 -2.501 18517 6119 1 5 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.695 0.205 18517 6120 1 5 . 1 1 218 218 TYR C C 286 176.090 176.090 175.613 0.477 18517 6121 1 5 . 1 1 218 218 TYR CA C 286 56.050 56.050 56.786 -0.737 18517 6122 1 5 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.855 2.055 18517 6123 1 5 . 1 1 218 218 TYR H H 286 7.660 7.660 7.607 0.053 18517 6124 1 5 . 1 1 219 219 GLY N N 287 108.260 108.260 109.266 -1.006 18517 6125 1 5 . 1 1 219 219 GLY CA C 287 44.320 44.320 42.550 1.770 18517 6126 1 5 . 1 1 219 219 GLY H H 287 7.750 7.750 7.775 -0.025 18517 6127 1 5 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.207 0.283 18517 6128 1 5 . 1 1 221 221 ILE CA C 289 63.580 63.580 62.913 0.667 18517 6129 1 5 . 1 1 221 221 ILE CB C 289 38.280 38.280 38.031 0.249 18517 6130 1 5 . 1 1 222 222 GLY CA C 290 45.740 45.740 44.709 1.031 18517 6131 1 6 . 1 1 2 2 LYS N N 70 126.600 126.600 121.899 4.701 18517 6132 1 6 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.131 0.229 18517 6133 1 6 . 1 1 2 2 LYS C C 70 176.000 176.000 175.007 0.993 18517 6134 1 6 . 1 1 2 2 LYS CA C 70 56.450 56.450 56.873 -0.423 18517 6135 1 6 . 1 1 2 2 LYS CB C 70 33.850 33.850 32.526 1.324 18517 6136 1 6 . 1 1 2 2 LYS H H 70 8.530 8.530 8.419 0.111 18517 6137 1 6 . 1 1 3 3 THR N N 71 111.030 111.030 115.256 -4.226 18517 6138 1 6 . 1 1 3 3 THR HA H 71 4.400 4.400 4.417 -0.017 18517 6139 1 6 . 1 1 3 3 THR C C 71 175.650 175.650 175.208 0.442 18517 6140 1 6 . 1 1 3 3 THR CA C 71 60.610 60.610 60.779 -0.169 18517 6141 1 6 . 1 1 3 3 THR CB C 71 71.520 71.520 69.911 1.609 18517 6142 1 6 . 1 1 3 3 THR H H 71 7.390 7.390 7.917 -0.527 18517 6143 1 6 . 1 1 4 4 LEU N N 72 121.560 121.560 122.356 -0.796 18517 6144 1 6 . 1 1 4 4 LEU C C 72 177.870 177.870 178.787 -0.917 18517 6145 1 6 . 1 1 4 4 LEU CA C 72 58.480 58.480 59.176 -0.696 18517 6146 1 6 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.529 0.651 18517 6147 1 6 . 1 1 4 4 LEU H H 72 8.980 8.980 8.559 0.421 18517 6148 1 6 . 1 1 5 5 ASP N N 73 115.530 115.530 117.636 -2.106 18517 6149 1 6 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.331 -0.001 18517 6150 1 6 . 1 1 5 5 ASP C C 73 179.290 179.290 178.281 1.009 18517 6151 1 6 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.306 0.534 18517 6152 1 6 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.625 0.205 18517 6153 1 6 . 1 1 5 5 ASP H H 73 8.270 8.270 8.647 -0.377 18517 6154 1 6 . 1 1 6 6 VAL N N 74 122.330 122.330 119.497 2.833 18517 6155 1 6 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.681 0.059 18517 6156 1 6 . 1 1 6 6 VAL C C 74 178.970 178.970 177.793 1.177 18517 6157 1 6 . 1 1 6 6 VAL CA C 74 66.360 66.360 66.234 0.126 18517 6158 1 6 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.888 0.062 18517 6159 1 6 . 1 1 6 6 VAL H H 74 7.400 7.400 7.176 0.224 18517 6160 1 6 . 1 1 7 7 LEU N N 75 121.360 121.360 120.118 1.242 18517 6161 1 6 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.856 0.174 18517 6162 1 6 . 1 1 7 7 LEU C C 75 179.240 179.240 178.985 0.255 18517 6163 1 6 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.608 -0.378 18517 6164 1 6 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.168 1.722 18517 6165 1 6 . 1 1 7 7 LEU H H 75 8.300 8.300 8.643 -0.343 18517 6166 1 6 . 1 1 8 8 ARG N N 76 117.230 117.230 119.421 -2.191 18517 6167 1 6 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.018 -0.098 18517 6168 1 6 . 1 1 8 8 ARG C C 76 178.290 178.290 178.910 -0.620 18517 6169 1 6 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.783 0.987 18517 6170 1 6 . 1 1 8 8 ARG CB C 76 30.210 30.210 30.033 0.177 18517 6171 1 6 . 1 1 8 8 ARG H H 76 8.520 8.520 8.828 -0.308 18517 6172 1 6 . 1 1 9 9 GLY N N 77 104.570 104.570 107.453 -2.883 18517 6173 1 6 . 1 1 9 9 GLY C C 77 176.180 176.180 176.337 -0.157 18517 6174 1 6 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.923 0.247 18517 6175 1 6 . 1 1 9 9 GLY H H 77 7.620 7.620 8.416 -0.796 18517 6176 1 6 . 1 1 10 10 GLU N N 78 120.270 120.270 123.143 -2.873 18517 6177 1 6 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.055 0.215 18517 6178 1 6 . 1 1 10 10 GLU C C 78 179.030 179.030 179.219 -0.189 18517 6179 1 6 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.198 -0.328 18517 6180 1 6 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.160 2.240 18517 6181 1 6 . 1 1 10 10 GLU H H 78 8.100 8.100 8.303 -0.203 18517 6182 1 6 . 1 1 11 11 LEU N N 79 116.000 116.000 120.092 -4.092 18517 6183 1 6 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.991 0.519 18517 6184 1 6 . 1 1 11 11 LEU C C 79 179.630 179.630 179.076 0.554 18517 6185 1 6 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.137 -1.447 18517 6186 1 6 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.547 3.253 18517 6187 1 6 . 1 1 11 11 LEU H H 79 8.230 8.230 8.499 -0.269 18517 6188 1 6 . 1 1 12 12 ARG N N 80 120.020 120.020 119.629 0.391 18517 6189 1 6 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.871 -0.121 18517 6190 1 6 . 1 1 12 12 ARG C C 80 178.490 178.490 178.705 -0.215 18517 6191 1 6 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.778 2.222 18517 6192 1 6 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.982 1.258 18517 6193 1 6 . 1 1 12 12 ARG H H 80 8.210 8.210 8.577 -0.367 18517 6194 1 6 . 1 1 13 13 GLY N N 81 108.090 108.090 106.666 1.424 18517 6195 1 6 . 1 1 13 13 GLY C C 81 173.540 173.540 175.730 -2.190 18517 6196 1 6 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.807 1.193 18517 6197 1 6 . 1 1 13 13 GLY H H 81 8.890 8.890 8.545 0.345 18517 6198 1 6 . 1 1 14 14 GLN C C 82 179.540 179.540 178.189 1.351 18517 6199 1 6 . 1 1 14 14 GLN CA C 82 58.710 58.710 59.130 -0.420 18517 6200 1 6 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.680 0.420 18517 6201 1 6 . 1 1 15 15 ARG N N 83 118.220 118.220 119.745 -1.525 18517 6202 1 6 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.072 -0.122 18517 6203 1 6 . 1 1 15 15 ARG C C 83 177.710 177.710 178.536 -0.826 18517 6204 1 6 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.032 0.868 18517 6205 1 6 . 1 1 15 15 ARG CB C 83 29.650 29.650 29.791 -0.141 18517 6206 1 6 . 1 1 15 15 ARG H H 83 7.320 7.320 8.560 -1.240 18517 6207 1 6 . 1 1 16 16 GLU N N 84 118.810 118.810 120.442 -1.632 18517 6208 1 6 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.137 -0.287 18517 6209 1 6 . 1 1 16 16 GLU C C 84 178.750 178.750 178.645 0.105 18517 6210 1 6 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.696 1.315 18517 6211 1 6 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.519 -0.109 18517 6212 1 6 . 1 1 16 16 GLU H H 84 8.450 8.450 8.547 -0.097 18517 6213 1 6 . 1 1 17 17 ALA N N 85 122.790 122.790 121.968 0.822 18517 6214 1 6 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.125 0.065 18517 6215 1 6 . 1 1 17 17 ALA C C 85 180.360 180.360 179.949 0.411 18517 6216 1 6 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.012 0.448 18517 6217 1 6 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.224 -0.144 18517 6218 1 6 . 1 1 17 17 ALA H H 85 8.420 8.420 8.106 0.314 18517 6219 1 6 . 1 1 18 18 PHE N N 86 119.400 119.400 119.840 -0.440 18517 6220 1 6 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.218 0.072 18517 6221 1 6 . 1 1 18 18 PHE C C 86 177.560 177.560 177.269 0.291 18517 6222 1 6 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.934 -0.294 18517 6223 1 6 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.434 0.206 18517 6224 1 6 . 1 1 18 18 PHE H H 86 7.490 7.490 8.257 -0.767 18517 6225 1 6 . 1 1 19 19 LEU N N 87 117.470 117.470 120.632 -3.162 18517 6226 1 6 . 1 1 19 19 LEU HA H 87 4.070 4.070 4.047 0.023 18517 6227 1 6 . 1 1 19 19 LEU C C 87 178.880 178.880 178.367 0.513 18517 6228 1 6 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.512 -0.552 18517 6229 1 6 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.712 0.388 18517 6230 1 6 . 1 1 19 19 LEU H H 87 8.010 8.010 8.705 -0.695 18517 6231 1 6 . 1 1 20 20 SER N N 88 113.770 113.770 114.706 -0.936 18517 6232 1 6 . 1 1 20 20 SER HA H 88 4.070 4.070 4.065 0.005 18517 6233 1 6 . 1 1 20 20 SER C C 88 175.680 175.680 176.670 -0.990 18517 6234 1 6 . 1 1 20 20 SER CA C 88 63.070 63.070 62.405 0.665 18517 6235 1 6 . 1 1 20 20 SER H H 88 8.100 8.100 8.485 -0.385 18517 6236 1 6 . 1 1 21 21 GLU N N 89 120.570 120.570 122.574 -2.004 18517 6237 1 6 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.017 -0.047 18517 6238 1 6 . 1 1 21 21 GLU C C 89 178.940 178.940 178.776 0.164 18517 6239 1 6 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.355 -0.095 18517 6240 1 6 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.401 -0.072 18517 6241 1 6 . 1 1 21 21 GLU H H 89 7.400 7.400 7.836 -0.436 18517 6242 1 6 . 1 1 22 22 ILE N N 90 119.350 119.350 119.053 0.297 18517 6243 1 6 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.931 -0.241 18517 6244 1 6 . 1 1 22 22 ILE C C 90 177.230 177.230 178.413 -1.183 18517 6245 1 6 . 1 1 22 22 ILE CA C 90 63.470 63.470 63.045 0.424 18517 6246 1 6 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.742 -0.352 18517 6247 1 6 . 1 1 22 22 ILE H H 90 7.250 7.250 7.963 -0.713 18517 6248 1 6 . 1 1 23 23 ILE N N 91 116.350 116.350 119.354 -3.004 18517 6249 1 6 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.878 -0.478 18517 6250 1 6 . 1 1 23 23 ILE C C 91 176.690 176.690 177.233 -0.543 18517 6251 1 6 . 1 1 23 23 ILE CA C 91 65.730 65.730 62.866 2.864 18517 6252 1 6 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.441 0.329 18517 6253 1 6 . 1 1 23 23 ILE H H 91 7.860 7.860 8.244 -0.384 18517 6254 1 6 . 1 1 24 24 LYS N N 92 116.000 116.000 119.474 -3.474 18517 6255 1 6 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.115 0.025 18517 6256 1 6 . 1 1 24 24 LYS C C 92 176.270 176.270 177.172 -0.902 18517 6257 1 6 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.866 -0.386 18517 6258 1 6 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.991 0.309 18517 6259 1 6 . 1 1 24 24 LYS H H 92 7.170 7.170 7.749 -0.579 18517 6260 1 6 . 1 1 25 25 SER N N 93 114.650 114.650 113.569 1.081 18517 6261 1 6 . 1 1 25 25 SER HA H 93 4.550 4.550 4.290 0.260 18517 6262 1 6 . 1 1 25 25 SER C C 93 173.370 173.370 173.130 0.240 18517 6263 1 6 . 1 1 25 25 SER CA C 93 57.240 57.240 59.887 -2.647 18517 6264 1 6 . 1 1 25 25 SER CB C 93 65.650 65.650 63.806 1.843 18517 6265 1 6 . 1 1 25 25 SER H H 93 7.730 7.730 7.783 -0.053 18517 6266 1 6 . 1 1 26 26 ASP N N 94 121.230 121.230 116.805 4.425 18517 6267 1 6 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.692 0.238 18517 6268 1 6 . 1 1 26 26 ASP C C 94 176.560 176.560 176.568 -0.008 18517 6269 1 6 . 1 1 26 26 ASP CA C 94 54.510 54.510 55.229 -0.719 18517 6270 1 6 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.200 1.450 18517 6271 1 6 . 1 1 26 26 ASP H H 94 8.280 8.280 8.363 -0.083 18517 6272 1 6 . 1 1 27 27 GLY N N 95 109.310 109.310 108.234 1.076 18517 6273 1 6 . 1 1 27 27 GLY C C 95 171.080 171.080 172.460 -1.380 18517 6274 1 6 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.781 -1.011 18517 6275 1 6 . 1 1 27 27 GLY H H 95 8.160 8.160 7.859 0.301 18517 6276 1 6 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.479 0.661 18517 6277 1 6 . 1 1 29 29 PHE C C 97 175.230 175.230 175.062 0.168 18517 6278 1 6 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.803 -0.313 18517 6279 1 6 . 1 1 29 29 PHE CB C 97 41.620 41.620 42.173 -0.553 18517 6280 1 6 . 1 1 30 30 THR N N 98 112.600 112.600 115.624 -3.024 18517 6281 1 6 . 1 1 30 30 THR HA H 98 4.570 4.570 4.319 0.251 18517 6282 1 6 . 1 1 30 30 THR C C 98 176.690 176.690 175.001 1.689 18517 6283 1 6 . 1 1 30 30 THR CA C 98 60.290 60.290 60.874 -0.584 18517 6284 1 6 . 1 1 30 30 THR CB C 98 71.600 71.600 71.569 0.031 18517 6285 1 6 . 1 1 30 30 THR H H 98 8.990 8.990 8.268 0.722 18517 6286 1 6 . 1 1 31 31 ILE N N 99 119.240 119.240 125.260 -6.020 18517 6287 1 6 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.741 0.079 18517 6288 1 6 . 1 1 31 31 ILE C C 99 176.090 176.090 176.337 -0.247 18517 6289 1 6 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.564 -3.424 18517 6290 1 6 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.890 -0.940 18517 6291 1 6 . 1 1 31 31 ILE H H 99 9.230 9.230 8.103 1.127 18517 6292 1 6 . 1 1 32 32 LEU N N 100 119.660 119.660 119.499 0.161 18517 6293 1 6 . 1 1 32 32 LEU HA H 100 4.030 4.030 3.919 0.111 18517 6294 1 6 . 1 1 32 32 LEU C C 100 181.050 181.050 179.080 1.970 18517 6295 1 6 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.997 -0.437 18517 6296 1 6 . 1 1 32 32 LEU CB C 100 40.120 40.120 41.132 -1.012 18517 6297 1 6 . 1 1 32 32 LEU H H 100 7.310 7.310 8.137 -0.827 18517 6298 1 6 . 1 1 33 33 GLN N N 101 121.450 121.450 118.363 3.087 18517 6299 1 6 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.370 -0.120 18517 6300 1 6 . 1 1 33 33 GLN CA C 101 59.700 59.700 59.269 0.431 18517 6301 1 6 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.545 3.245 18517 6302 1 6 . 1 1 33 33 GLN H H 101 7.790 7.790 7.862 -0.072 18517 6303 1 6 . 1 1 34 34 LEU C C 102 178.590 178.590 179.103 -0.513 18517 6304 1 6 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.251 0.380 18517 6305 1 6 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.539 -0.229 18517 6306 1 6 . 1 1 35 35 VAL N N 103 118.520 118.520 118.523 -0.003 18517 6307 1 6 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.573 -0.153 18517 6308 1 6 . 1 1 35 35 VAL C C 103 177.930 177.930 177.749 0.181 18517 6309 1 6 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.572 -0.532 18517 6310 1 6 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.716 0.914 18517 6311 1 6 . 1 1 35 35 VAL H H 103 8.670 8.670 8.274 0.396 18517 6312 1 6 . 1 1 36 36 GLY N N 104 109.430 109.430 108.513 0.917 18517 6313 1 6 . 1 1 36 36 GLY C C 104 174.600 174.600 175.539 -0.939 18517 6314 1 6 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.130 0.910 18517 6315 1 6 . 1 1 36 36 GLY H H 104 7.880 7.880 8.140 -0.260 18517 6316 1 6 . 1 1 37 37 TYR N N 105 122.270 122.270 124.158 -1.888 18517 6317 1 6 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.438 -0.558 18517 6318 1 6 . 1 1 37 37 TYR C C 105 176.310 176.310 177.072 -0.762 18517 6319 1 6 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.144 3.956 18517 6320 1 6 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.763 -0.393 18517 6321 1 6 . 1 1 37 37 TYR H H 105 8.170 8.170 8.363 -0.193 18517 6322 1 6 . 1 1 38 38 LEU N N 106 120.100 120.100 121.263 -1.163 18517 6323 1 6 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.796 -0.056 18517 6324 1 6 . 1 1 38 38 LEU C C 106 178.280 178.280 178.498 -0.218 18517 6325 1 6 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.219 0.411 18517 6326 1 6 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.629 1.101 18517 6327 1 6 . 1 1 38 38 LEU H H 106 7.610 7.610 8.429 -0.819 18517 6328 1 6 . 1 1 39 39 ARG N N 107 116.670 116.670 118.877 -2.207 18517 6329 1 6 . 1 1 39 39 ARG HA H 107 3.680 3.680 3.954 -0.274 18517 6330 1 6 . 1 1 39 39 ARG C C 107 179.480 179.480 178.493 0.987 18517 6331 1 6 . 1 1 39 39 ARG CA C 107 59.580 59.580 58.906 0.674 18517 6332 1 6 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.566 1.674 18517 6333 1 6 . 1 1 39 39 ARG H H 107 8.240 8.240 7.829 0.411 18517 6334 1 6 . 1 1 40 40 VAL N N 108 121.970 121.970 119.745 2.225 18517 6335 1 6 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.584 -0.184 18517 6336 1 6 . 1 1 40 40 VAL C C 108 178.440 178.440 177.866 0.574 18517 6337 1 6 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.808 1.142 18517 6338 1 6 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.705 -1.265 18517 6339 1 6 . 1 1 40 40 VAL H H 108 8.200 8.200 7.961 0.239 18517 6340 1 6 . 1 1 41 41 VAL N N 109 108.940 108.940 116.142 -7.202 18517 6341 1 6 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.760 0.480 18517 6342 1 6 . 1 1 41 41 VAL C C 109 175.070 175.070 177.802 -2.732 18517 6343 1 6 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.081 -2.491 18517 6344 1 6 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.138 -0.488 18517 6345 1 6 . 1 1 41 41 VAL H H 109 7.760 7.760 8.071 -0.311 18517 6346 1 6 . 1 1 42 42 ASP N N 110 124.670 124.670 121.301 3.369 18517 6347 1 6 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.260 0.360 18517 6348 1 6 . 1 1 42 42 ASP C C 110 177.310 177.310 178.025 -0.715 18517 6349 1 6 . 1 1 42 42 ASP CA C 110 59.980 59.980 58.346 1.634 18517 6350 1 6 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.869 4.081 18517 6351 1 6 . 1 1 42 42 ASP H H 110 7.360 7.360 8.300 -0.940 18517 6352 1 6 . 1 1 43 43 THR N N 111 102.340 102.340 114.784 -12.444 18517 6353 1 6 . 1 1 43 43 THR HA H 111 5.100 5.100 4.085 1.015 18517 6354 1 6 . 1 1 43 43 THR C C 111 174.940 174.940 176.328 -1.388 18517 6355 1 6 . 1 1 43 43 THR CA C 111 60.650 60.650 65.023 -4.373 18517 6356 1 6 . 1 1 43 43 THR CB C 111 69.610 69.610 68.705 0.905 18517 6357 1 6 . 1 1 43 43 THR H H 111 6.380 6.380 7.864 -1.484 18517 6358 1 6 . 1 1 44 44 ASP N N 112 119.750 119.750 122.254 -2.504 18517 6359 1 6 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.320 -0.460 18517 6360 1 6 . 1 1 44 44 ASP C C 112 178.850 178.850 178.236 0.614 18517 6361 1 6 . 1 1 44 44 ASP CA C 112 58.230 58.230 58.002 0.228 18517 6362 1 6 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.629 -1.229 18517 6363 1 6 . 1 1 44 44 ASP H H 112 9.050 9.050 8.297 0.753 18517 6364 1 6 . 1 1 45 45 LEU N N 113 123.910 123.910 121.300 2.610 18517 6365 1 6 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.862 -0.052 18517 6366 1 6 . 1 1 45 45 LEU C C 113 182.040 182.040 178.337 3.703 18517 6367 1 6 . 1 1 45 45 LEU CA C 113 57.320 57.320 58.080 -0.760 18517 6368 1 6 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.653 -0.903 18517 6369 1 6 . 1 1 45 45 LEU H H 113 9.710 9.710 7.861 1.849 18517 6370 1 6 . 1 1 46 46 LEU N N 114 117.640 117.640 116.269 1.371 18517 6371 1 6 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.319 -0.209 18517 6372 1 6 . 1 1 46 46 LEU C C 114 179.540 179.540 179.470 0.070 18517 6373 1 6 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.675 -0.115 18517 6374 1 6 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.203 0.267 18517 6375 1 6 . 1 1 46 46 LEU H H 114 8.270 8.270 7.545 0.725 18517 6376 1 6 . 1 1 47 47 LEU N N 115 116.520 116.520 118.147 -1.627 18517 6377 1 6 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.398 -0.258 18517 6378 1 6 . 1 1 47 47 LEU C C 115 173.850 173.850 176.306 -2.456 18517 6379 1 6 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.264 1.156 18517 6380 1 6 . 1 1 47 47 LEU CB C 115 44.720 44.720 40.988 3.732 18517 6381 1 6 . 1 1 47 47 LEU H H 115 8.160 8.160 7.929 0.231 18517 6382 1 6 . 1 1 48 48 LYS N N 116 114.710 114.710 116.937 -2.227 18517 6383 1 6 . 1 1 48 48 LYS HA H 116 3.810 3.810 3.907 -0.097 18517 6384 1 6 . 1 1 48 48 LYS C C 116 176.510 176.510 175.945 0.565 18517 6385 1 6 . 1 1 48 48 LYS CA C 116 57.200 57.200 57.110 0.090 18517 6386 1 6 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.265 -0.245 18517 6387 1 6 . 1 1 48 48 LYS H H 116 7.580 7.580 7.844 -0.264 18517 6388 1 6 . 1 1 49 49 VAL N N 117 119.050 119.050 118.117 0.933 18517 6389 1 6 . 1 1 49 49 VAL HA H 117 3.610 3.610 3.967 -0.357 18517 6390 1 6 . 1 1 49 49 VAL C C 117 175.860 175.860 176.130 -0.270 18517 6391 1 6 . 1 1 49 49 VAL CA C 117 63.510 63.510 62.072 1.438 18517 6392 1 6 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.833 -0.483 18517 6393 1 6 . 1 1 49 49 VAL H H 117 7.980 7.980 7.914 0.066 18517 6394 1 6 . 1 1 50 50 ASP N N 118 126.900 126.900 122.130 4.770 18517 6395 1 6 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.503 -0.253 18517 6396 1 6 . 1 1 50 50 ASP C C 118 177.700 177.700 177.525 0.175 18517 6397 1 6 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.666 0.384 18517 6398 1 6 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.193 1.387 18517 6399 1 6 . 1 1 50 50 ASP H H 118 8.930 8.930 8.533 0.397 18517 6400 1 6 . 1 1 51 51 SER N N 119 124.790 124.790 120.866 3.924 18517 6401 1 6 . 1 1 51 51 SER HA H 119 4.070 4.070 4.159 -0.089 18517 6402 1 6 . 1 1 51 51 SER C C 119 177.220 177.220 176.130 1.090 18517 6403 1 6 . 1 1 51 51 SER CA C 119 61.640 61.640 61.907 -0.267 18517 6404 1 6 . 1 1 51 51 SER CB C 119 63.510 63.510 63.203 0.307 18517 6405 1 6 . 1 1 51 51 SER H H 119 8.560 8.560 8.775 -0.215 18517 6406 1 6 . 1 1 52 52 THR N N 120 119.880 119.880 117.260 2.620 18517 6407 1 6 . 1 1 52 52 THR HA H 120 4.190 4.190 4.275 -0.085 18517 6408 1 6 . 1 1 52 52 THR C C 120 177.120 177.120 176.605 0.515 18517 6409 1 6 . 1 1 52 52 THR CA C 120 66.280 66.280 65.382 0.897 18517 6410 1 6 . 1 1 52 52 THR CB C 120 68.420 68.420 68.307 0.113 18517 6411 1 6 . 1 1 52 52 THR H H 120 8.310 8.310 8.399 -0.089 18517 6412 1 6 . 1 1 53 53 LYS N N 121 122.270 122.270 122.946 -0.676 18517 6413 1 6 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.208 -0.088 18517 6414 1 6 . 1 1 53 53 LYS C C 121 178.970 178.970 178.753 0.217 18517 6415 1 6 . 1 1 53 53 LYS CA C 121 59.580 59.580 58.812 0.768 18517 6416 1 6 . 1 1 53 53 LYS CB C 121 34.250 34.250 31.834 2.417 18517 6417 1 6 . 1 1 53 53 LYS H H 121 7.700 7.700 7.567 0.133 18517 6418 1 6 . 1 1 54 54 VAL N N 122 120.070 120.070 120.748 -0.678 18517 6419 1 6 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.829 -0.399 18517 6420 1 6 . 1 1 54 54 VAL C C 122 179.860 179.860 177.766 2.094 18517 6421 1 6 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.895 2.685 18517 6422 1 6 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.899 0.921 18517 6423 1 6 . 1 1 54 54 VAL H H 122 7.890 7.890 8.221 -0.331 18517 6424 1 6 . 1 1 55 55 ASP N N 123 122.270 122.270 120.352 1.918 18517 6425 1 6 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.328 0.142 18517 6426 1 6 . 1 1 55 55 ASP C C 123 178.630 178.630 178.274 0.356 18517 6427 1 6 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.796 0.004 18517 6428 1 6 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.886 1.134 18517 6429 1 6 . 1 1 55 55 ASP H H 123 8.270 8.270 8.263 0.007 18517 6430 1 6 . 1 1 56 56 GLU N N 124 119.600 119.600 119.408 0.192 18517 6431 1 6 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.028 -0.058 18517 6432 1 6 . 1 1 56 56 GLU C C 124 179.920 179.920 179.031 0.889 18517 6433 1 6 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.305 0.755 18517 6434 1 6 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.554 0.416 18517 6435 1 6 . 1 1 56 56 GLU H H 124 8.610 8.610 8.146 0.464 18517 6436 1 6 . 1 1 57 57 ALA N N 125 120.070 120.070 121.078 -1.008 18517 6437 1 6 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.135 -0.305 18517 6438 1 6 . 1 1 57 57 ALA C C 125 178.760 178.760 179.593 -0.833 18517 6439 1 6 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.846 0.534 18517 6440 1 6 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.448 1.692 18517 6441 1 6 . 1 1 57 57 ALA H H 125 8.420 8.420 8.466 -0.046 18517 6442 1 6 . 1 1 58 58 GLY N N 126 106.740 106.740 106.856 -0.116 18517 6443 1 6 . 1 1 58 58 GLY C C 126 175.740 175.740 176.332 -0.592 18517 6444 1 6 . 1 1 58 58 GLY CA C 126 47.290 47.290 47.232 0.058 18517 6445 1 6 . 1 1 58 58 GLY H H 126 8.200 8.200 8.449 -0.249 18517 6446 1 6 . 1 1 59 59 LYS N N 127 120.920 120.920 122.043 -1.123 18517 6447 1 6 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.040 -0.110 18517 6448 1 6 . 1 1 59 59 LYS C C 127 180.320 180.320 179.334 0.986 18517 6449 1 6 . 1 1 59 59 LYS CA C 127 60.210 60.210 58.844 1.366 18517 6450 1 6 . 1 1 59 59 LYS CB C 127 32.980 32.980 31.820 1.160 18517 6451 1 6 . 1 1 59 59 LYS H H 127 8.000 8.000 8.287 -0.287 18517 6452 1 6 . 1 1 60 60 LYS N N 128 118.400 118.400 119.634 -1.234 18517 6453 1 6 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.142 0.028 18517 6454 1 6 . 1 1 60 60 LYS C C 128 180.030 180.030 179.188 0.842 18517 6455 1 6 . 1 1 60 60 LYS CA C 128 58.750 58.750 59.167 -0.417 18517 6456 1 6 . 1 1 60 60 LYS CB C 128 32.270 32.270 31.917 0.353 18517 6457 1 6 . 1 1 60 60 LYS H H 128 7.170 7.170 7.986 -0.816 18517 6458 1 6 . 1 1 61 61 VAL N N 129 121.050 121.050 120.125 0.925 18517 6459 1 6 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.194 0.086 18517 6460 1 6 . 1 1 61 61 VAL C C 129 177.120 177.120 177.632 -0.512 18517 6461 1 6 . 1 1 61 61 VAL CA C 129 67.350 67.350 66.742 0.608 18517 6462 1 6 . 1 1 61 61 VAL CB C 129 31.630 31.630 30.861 0.769 18517 6463 1 6 . 1 1 61 61 VAL H H 129 7.980 7.980 8.092 -0.112 18517 6464 1 6 . 1 1 62 62 LYS N N 130 120.040 120.040 120.138 -0.098 18517 6465 1 6 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.959 -0.259 18517 6466 1 6 . 1 1 62 62 LYS C C 130 178.550 178.550 179.040 -0.490 18517 6467 1 6 . 1 1 62 62 LYS CA C 130 60.330 60.330 59.822 0.508 18517 6468 1 6 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.390 1.380 18517 6469 1 6 . 1 1 62 62 LYS H H 130 8.910 8.910 8.372 0.538 18517 6470 1 6 . 1 1 63 63 ALA N N 131 119.570 119.570 122.494 -2.924 18517 6471 1 6 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.053 0.167 18517 6472 1 6 . 1 1 63 63 ALA C C 131 180.520 180.520 179.381 1.139 18517 6473 1 6 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.252 -0.031 18517 6474 1 6 . 1 1 63 63 ALA CB C 131 18.470 18.470 17.829 0.641 18517 6475 1 6 . 1 1 63 63 ALA H H 131 7.920 7.920 8.408 -0.488 18517 6476 1 6 . 1 1 64 64 TYR N N 132 120.510 120.510 120.437 0.073 18517 6477 1 6 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.205 0.255 18517 6478 1 6 . 1 1 64 64 TYR C C 132 176.510 176.510 177.984 -1.474 18517 6479 1 6 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.835 -0.195 18517 6480 1 6 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.537 0.153 18517 6481 1 6 . 1 1 64 64 TYR H H 132 7.930 7.930 8.088 -0.158 18517 6482 1 6 . 1 1 65 65 LEU N N 133 117.290 117.290 118.604 -1.314 18517 6483 1 6 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.488 0.352 18517 6484 1 6 . 1 1 65 65 LEU C C 133 178.610 178.610 179.183 -0.573 18517 6485 1 6 . 1 1 65 65 LEU CA C 133 57.720 57.720 57.936 -0.216 18517 6486 1 6 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.571 -1.141 18517 6487 1 6 . 1 1 65 65 LEU H H 133 8.240 8.240 8.420 -0.180 18517 6488 1 6 . 1 1 66 66 GLU N N 134 119.140 119.140 119.255 -0.115 18517 6489 1 6 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.080 -0.220 18517 6490 1 6 . 1 1 66 66 GLU C C 134 180.200 180.200 178.989 1.211 18517 6491 1 6 . 1 1 66 66 GLU CA C 134 59.940 59.940 59.151 0.789 18517 6492 1 6 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.407 0.403 18517 6493 1 6 . 1 1 66 66 GLU H H 134 8.370 8.370 8.642 -0.272 18517 6494 1 6 . 1 1 67 67 LYS N N 135 121.390 121.390 119.567 1.823 18517 6495 1 6 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.041 -0.041 18517 6496 1 6 . 1 1 67 67 LYS C C 135 179.080 179.080 178.719 0.361 18517 6497 1 6 . 1 1 67 67 LYS CA C 135 59.620 59.620 59.032 0.588 18517 6498 1 6 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.532 -0.262 18517 6499 1 6 . 1 1 67 67 LYS H H 135 7.820 7.820 7.813 0.007 18517 6500 1 6 . 1 1 68 68 ILE N N 136 110.310 110.310 112.268 -1.958 18517 6501 1 6 . 1 1 68 68 ILE HA H 136 4.300 4.300 3.951 0.349 18517 6502 1 6 . 1 1 68 68 ILE C C 136 175.520 175.520 176.616 -1.096 18517 6503 1 6 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.996 0.434 18517 6504 1 6 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.316 -0.336 18517 6505 1 6 . 1 1 68 68 ILE H H 136 7.380 7.380 7.639 -0.259 18517 6506 1 6 . 1 1 69 69 GLY N N 137 106.680 106.680 107.411 -0.731 18517 6507 1 6 . 1 1 69 69 GLY C C 137 174.160 174.160 173.998 0.162 18517 6508 1 6 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.405 1.065 18517 6509 1 6 . 1 1 69 69 GLY H H 137 7.470 7.470 7.965 -0.495 18517 6510 1 6 . 1 1 70 70 ILE N N 138 124.310 124.310 122.592 1.718 18517 6511 1 6 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.160 0.040 18517 6512 1 6 . 1 1 70 70 ILE C C 138 174.190 174.190 174.906 -0.716 18517 6513 1 6 . 1 1 70 70 ILE CA C 138 59.380 59.380 59.336 0.044 18517 6514 1 6 . 1 1 70 70 ILE CB C 138 37.340 37.340 37.088 0.252 18517 6515 1 6 . 1 1 70 70 ILE H H 138 8.530 8.530 8.300 0.230 18517 6516 1 6 . 1 1 71 71 ARG N N 139 125.490 125.490 125.310 0.180 18517 6517 1 6 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.378 0.242 18517 6518 1 6 . 1 1 71 71 ARG C C 139 175.750 175.750 175.480 0.270 18517 6519 1 6 . 1 1 71 71 ARG CA C 139 54.660 54.660 55.233 -0.572 18517 6520 1 6 . 1 1 71 71 ARG CB C 139 33.140 33.140 32.178 0.962 18517 6521 1 6 . 1 1 71 71 ARG H H 139 8.240 8.240 8.476 -0.236 18517 6522 1 6 . 1 1 72 72 GLY N N 140 104.750 104.750 106.476 -1.726 18517 6523 1 6 . 1 1 72 72 GLY C C 140 172.920 172.920 171.722 1.198 18517 6524 1 6 . 1 1 72 72 GLY CA C 140 45.430 45.430 45.012 0.418 18517 6525 1 6 . 1 1 72 72 GLY H H 140 7.900 7.900 8.196 -0.296 18517 6526 1 6 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.753 -0.243 18517 6527 1 6 . 1 1 73 73 ASP C C 141 175.060 175.060 175.406 -0.346 18517 6528 1 6 . 1 1 73 73 ASP CA C 141 56.170 56.170 54.821 1.349 18517 6529 1 6 . 1 1 73 73 ASP CB C 141 40.830 40.830 42.447 -1.617 18517 6530 1 6 . 1 1 74 74 SER N N 142 110.240 110.240 112.396 -2.156 18517 6531 1 6 . 1 1 74 74 SER HA H 142 4.740 4.740 4.762 -0.022 18517 6532 1 6 . 1 1 74 74 SER C C 142 175.110 175.110 174.647 0.463 18517 6533 1 6 . 1 1 74 74 SER CA C 142 55.700 55.700 55.287 0.413 18517 6534 1 6 . 1 1 74 74 SER CB C 142 67.390 67.390 65.105 2.285 18517 6535 1 6 . 1 1 74 74 SER H H 142 7.560 7.560 7.481 0.079 18517 6536 1 6 . 1 1 75 75 VAL N N 143 122.950 122.950 124.368 -1.418 18517 6537 1 6 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.824 -0.094 18517 6538 1 6 . 1 1 75 75 VAL C C 143 176.230 176.230 177.152 -0.922 18517 6539 1 6 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.353 1.287 18517 6540 1 6 . 1 1 75 75 VAL CB C 143 31.240 31.240 32.074 -0.834 18517 6541 1 6 . 1 1 75 75 VAL H H 143 9.470 9.470 8.966 0.504 18517 6542 1 6 . 1 1 76 76 GLU N N 144 121.390 121.390 119.613 1.777 18517 6543 1 6 . 1 1 76 76 GLU HA H 144 3.640 3.640 3.983 -0.343 18517 6544 1 6 . 1 1 76 76 GLU C C 144 176.880 176.880 178.678 -1.798 18517 6545 1 6 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.761 3.549 18517 6546 1 6 . 1 1 76 76 GLU CB C 144 28.070 28.070 29.064 -0.994 18517 6547 1 6 . 1 1 76 76 GLU H H 144 9.640 9.640 7.892 1.748 18517 6548 1 6 . 1 1 77 77 ALA N N 145 118.770 118.770 121.619 -2.849 18517 6549 1 6 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.297 -0.037 18517 6550 1 6 . 1 1 77 77 ALA C C 145 180.350 180.350 179.563 0.787 18517 6551 1 6 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.392 0.388 18517 6552 1 6 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.077 1.113 18517 6553 1 6 . 1 1 77 77 ALA H H 145 7.860 7.860 7.547 0.313 18517 6554 1 6 . 1 1 78 78 ALA N N 146 120.920 120.920 123.009 -2.089 18517 6555 1 6 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.077 0.063 18517 6556 1 6 . 1 1 78 78 ALA C C 146 179.150 179.150 179.333 -0.183 18517 6557 1 6 . 1 1 78 78 ALA CA C 146 55.260 55.260 54.827 0.433 18517 6558 1 6 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.618 0.172 18517 6559 1 6 . 1 1 78 78 ALA H H 146 8.110 8.110 8.359 -0.249 18517 6560 1 6 . 1 1 79 79 LEU N N 147 118.810 118.810 119.160 -0.350 18517 6561 1 6 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.003 -0.123 18517 6562 1 6 . 1 1 79 79 LEU C C 147 179.080 179.080 178.842 0.238 18517 6563 1 6 . 1 1 79 79 LEU CA C 147 58.390 58.390 58.046 0.344 18517 6564 1 6 . 1 1 79 79 LEU CB C 147 42.260 42.260 41.294 0.966 18517 6565 1 6 . 1 1 79 79 LEU H H 147 8.360 8.360 8.518 -0.158 18517 6566 1 6 . 1 1 80 80 ASP N N 148 121.620 121.620 119.469 2.151 18517 6567 1 6 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.212 0.308 18517 6568 1 6 . 1 1 80 80 ASP C C 148 178.800 178.800 178.524 0.276 18517 6569 1 6 . 1 1 80 80 ASP CA C 148 58.390 58.390 57.892 0.499 18517 6570 1 6 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.879 -0.129 18517 6571 1 6 . 1 1 80 80 ASP H H 148 8.770 8.770 8.288 0.482 18517 6572 1 6 . 1 1 81 81 ASN N N 149 118.630 118.630 118.224 0.406 18517 6573 1 6 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.543 0.027 18517 6574 1 6 . 1 1 81 81 ASN C C 149 177.970 177.970 177.948 0.022 18517 6575 1 6 . 1 1 81 81 ASN CA C 149 56.010 56.010 55.904 0.106 18517 6576 1 6 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.523 0.087 18517 6577 1 6 . 1 1 81 81 ASN H H 149 7.960 7.960 7.863 0.097 18517 6578 1 6 . 1 1 82 82 LEU N N 150 120.030 120.030 120.937 -0.907 18517 6579 1 6 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.921 0.139 18517 6580 1 6 . 1 1 82 82 LEU C C 150 177.790 177.790 179.141 -1.351 18517 6581 1 6 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.038 0.832 18517 6582 1 6 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.759 0.101 18517 6583 1 6 . 1 1 82 82 LEU H H 150 8.230 8.230 8.391 -0.161 18517 6584 1 6 . 1 1 83 83 MET N N 151 115.820 115.820 118.059 -2.239 18517 6585 1 6 . 1 1 83 83 MET HA H 151 4.390 4.390 4.206 0.184 18517 6586 1 6 . 1 1 83 83 MET C C 151 179.760 179.760 178.993 0.767 18517 6587 1 6 . 1 1 83 83 MET CA C 151 57.400 57.400 58.041 -0.641 18517 6588 1 6 . 1 1 83 83 MET CB C 151 31.080 31.080 31.489 -0.409 18517 6589 1 6 . 1 1 83 83 MET H H 151 8.800 8.800 8.382 0.418 18517 6590 1 6 . 1 1 84 84 ILE N N 152 120.330 120.330 120.617 -0.287 18517 6591 1 6 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.568 0.272 18517 6592 1 6 . 1 1 84 84 ILE C C 152 178.660 178.660 178.155 0.505 18517 6593 1 6 . 1 1 84 84 ILE CA C 152 65.800 65.800 65.813 -0.013 18517 6594 1 6 . 1 1 84 84 ILE CB C 152 38.450 38.450 37.307 1.143 18517 6595 1 6 . 1 1 84 84 ILE H H 152 8.540 8.540 8.474 0.066 18517 6596 1 6 . 1 1 85 85 LYS N N 153 118.930 118.930 119.447 -0.517 18517 6597 1 6 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.250 -0.050 18517 6598 1 6 . 1 1 85 85 LYS C C 153 179.650 179.650 179.575 0.075 18517 6599 1 6 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.805 1.175 18517 6600 1 6 . 1 1 85 85 LYS CB C 153 33.540 33.540 31.972 1.568 18517 6601 1 6 . 1 1 85 85 LYS H H 153 7.510 7.510 8.193 -0.683 18517 6602 1 6 . 1 1 86 86 VAL N N 154 119.810 119.810 119.641 0.169 18517 6603 1 6 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.701 -0.071 18517 6604 1 6 . 1 1 86 86 VAL C C 154 178.350 178.350 178.099 0.251 18517 6605 1 6 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.038 1.192 18517 6606 1 6 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.316 1.424 18517 6607 1 6 . 1 1 86 86 VAL H H 154 8.740 8.740 8.385 0.355 18517 6608 1 6 . 1 1 87 87 TYR N N 155 118.370 118.370 118.456 -0.086 18517 6609 1 6 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.351 -0.081 18517 6610 1 6 . 1 1 87 87 TYR C C 155 178.580 178.580 178.558 0.022 18517 6611 1 6 . 1 1 87 87 TYR CA C 155 62.910 62.910 60.505 2.405 18517 6612 1 6 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.242 0.738 18517 6613 1 6 . 1 1 87 87 TYR H H 155 8.520 8.520 8.331 0.189 18517 6614 1 6 . 1 1 88 88 GLU N N 156 119.900 119.900 121.422 -1.522 18517 6615 1 6 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.028 0.152 18517 6616 1 6 . 1 1 88 88 GLU C C 156 179.270 179.270 179.080 0.190 18517 6617 1 6 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.885 -0.505 18517 6618 1 6 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.466 0.744 18517 6619 1 6 . 1 1 88 88 GLU H H 156 8.250 8.250 8.633 -0.383 18517 6620 1 6 . 1 1 89 89 ILE N N 157 119.510 119.510 118.560 0.950 18517 6621 1 6 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.926 0.154 18517 6622 1 6 . 1 1 89 89 ILE C C 157 177.890 177.890 178.243 -0.353 18517 6623 1 6 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.039 0.271 18517 6624 1 6 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.122 1.088 18517 6625 1 6 . 1 1 89 89 ILE H H 157 7.630 7.630 7.759 -0.129 18517 6626 1 6 . 1 1 90 90 THR N N 158 114.240 114.240 115.752 -1.512 18517 6627 1 6 . 1 1 90 90 THR HA H 158 4.130 4.130 3.989 0.141 18517 6628 1 6 . 1 1 90 90 THR C C 158 175.530 175.530 176.339 -0.809 18517 6629 1 6 . 1 1 90 90 THR CA C 158 64.460 64.460 65.733 -1.273 18517 6630 1 6 . 1 1 90 90 THR CB C 158 69.610 69.610 68.922 0.688 18517 6631 1 6 . 1 1 90 90 THR H H 158 7.770 7.770 7.969 -0.199 18517 6632 1 6 . 1 1 91 91 LYS N N 159 120.280 120.280 118.333 1.947 18517 6633 1 6 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.329 -0.019 18517 6634 1 6 . 1 1 91 91 LYS C C 159 177.420 177.420 177.349 0.071 18517 6635 1 6 . 1 1 91 91 LYS CA C 159 57.400 57.400 57.060 0.340 18517 6636 1 6 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.457 -0.237 18517 6637 1 6 . 1 1 91 91 LYS H H 159 7.890 7.890 8.344 -0.454 18517 6638 1 6 . 1 1 92 92 GLY N N 160 107.910 107.910 106.896 1.014 18517 6639 1 6 . 1 1 92 92 GLY C C 160 174.430 174.430 174.025 0.405 18517 6640 1 6 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.376 0.604 18517 6641 1 6 . 1 1 92 92 GLY H H 160 7.930 7.930 8.150 -0.220 18517 6642 1 6 . 1 1 93 93 THR N N 161 113.570 113.570 115.775 -2.205 18517 6643 1 6 . 1 1 93 93 THR HA H 161 4.390 4.390 4.633 -0.243 18517 6644 1 6 . 1 1 93 93 THR C C 161 174.790 174.790 173.062 1.728 18517 6645 1 6 . 1 1 93 93 THR CA C 161 61.960 61.960 61.980 -0.020 18517 6646 1 6 . 1 1 93 93 THR CB C 161 70.010 70.010 70.948 -0.938 18517 6647 1 6 . 1 1 93 93 THR H H 161 7.970 7.970 7.921 0.049 18517 6648 1 6 . 1 1 94 94 VAL N N 162 121.980 121.980 124.171 -2.191 18517 6649 1 6 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.203 -0.083 18517 6650 1 6 . 1 1 94 94 VAL C C 162 176.300 176.300 174.410 1.890 18517 6651 1 6 . 1 1 94 94 VAL CA C 162 62.830 62.830 61.358 1.472 18517 6652 1 6 . 1 1 94 94 VAL CB C 162 33.060 33.060 34.276 -1.216 18517 6653 1 6 . 1 1 94 94 VAL H H 162 8.130 8.130 8.143 -0.013 18517 6654 1 6 . 1 1 95 95 GLU N N 163 124.140 124.140 126.706 -2.566 18517 6655 1 6 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.575 -0.265 18517 6656 1 6 . 1 1 95 95 GLU C C 163 176.870 176.870 176.062 0.808 18517 6657 1 6 . 1 1 95 95 GLU CA C 163 57.080 57.080 56.205 0.875 18517 6658 1 6 . 1 1 95 95 GLU CB C 163 30.440 30.440 30.499 -0.059 18517 6659 1 6 . 1 1 95 95 GLU H H 163 8.490 8.490 8.572 -0.082 18517 6660 1 6 . 1 1 96 96 SER N N 164 116.800 116.800 120.146 -3.346 18517 6661 1 6 . 1 1 96 96 SER HA H 164 4.430 4.430 4.598 -0.168 18517 6662 1 6 . 1 1 96 96 SER C C 164 174.940 174.940 174.765 0.175 18517 6663 1 6 . 1 1 96 96 SER CA C 164 59.070 59.070 57.869 1.201 18517 6664 1 6 . 1 1 96 96 SER CB C 164 64.220 64.220 62.848 1.372 18517 6665 1 6 . 1 1 96 96 SER H H 164 8.300 8.300 8.677 -0.377 18517 6666 1 6 . 1 1 97 97 SER C C 165 174.660 174.660 174.741 -0.081 18517 6667 1 6 . 1 1 97 97 SER CA C 165 58.870 58.870 59.217 -0.347 18517 6668 1 6 . 1 1 97 97 SER CB C 165 64.060 64.060 63.272 0.788 18517 6669 1 6 . 1 1 98 98 ALA N N 166 125.490 125.490 124.275 1.215 18517 6670 1 6 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.477 -0.127 18517 6671 1 6 . 1 1 98 98 ALA C C 166 177.780 177.780 176.163 1.617 18517 6672 1 6 . 1 1 98 98 ALA CA C 166 53.000 53.000 51.128 1.872 18517 6673 1 6 . 1 1 98 98 ALA CB C 166 19.340 19.340 19.880 -0.540 18517 6674 1 6 . 1 1 98 98 ALA H H 166 8.180 8.180 7.351 0.829 18517 6675 1 6 . 1 1 99 99 GLN N N 167 118.690 118.690 120.688 -1.998 18517 6676 1 6 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.177 0.163 18517 6677 1 6 . 1 1 99 99 GLN C C 167 176.680 176.680 175.354 1.326 18517 6678 1 6 . 1 1 99 99 GLN CA C 167 56.250 56.250 55.998 0.252 18517 6679 1 6 . 1 1 99 99 GLN CB C 167 29.650 29.650 28.256 1.394 18517 6680 1 6 . 1 1 99 99 GLN H H 167 8.170 8.170 8.605 -0.435 18517 6681 1 6 . 1 1 100 100 GLY N N 168 109.670 109.670 113.082 -3.412 18517 6682 1 6 . 1 1 100 100 GLY C C 168 174.460 174.460 173.440 1.020 18517 6683 1 6 . 1 1 100 100 GLY CA C 168 45.670 45.670 45.022 0.648 18517 6684 1 6 . 1 1 100 100 GLY H H 168 8.250 8.250 7.810 0.440 18517 6685 1 6 . 1 1 101 101 THR N N 169 112.660 112.660 114.896 -2.236 18517 6686 1 6 . 1 1 101 101 THR HA H 169 4.360 4.360 4.365 -0.005 18517 6687 1 6 . 1 1 101 101 THR C C 169 174.720 174.720 174.101 0.619 18517 6688 1 6 . 1 1 101 101 THR CA C 169 62.080 62.080 61.433 0.647 18517 6689 1 6 . 1 1 101 101 THR CB C 169 69.930 69.930 68.313 1.617 18517 6690 1 6 . 1 1 101 101 THR H H 169 8.070 8.070 7.822 0.248 18517 6691 1 6 . 1 1 102 102 ASP N N 170 123.090 123.090 124.675 -1.585 18517 6692 1 6 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.810 -0.110 18517 6693 1 6 . 1 1 102 102 ASP C C 170 176.130 176.130 175.669 0.461 18517 6694 1 6 . 1 1 102 102 ASP CA C 170 54.780 54.780 53.314 1.466 18517 6695 1 6 . 1 1 102 102 ASP CB C 170 42.260 42.260 42.251 0.009 18517 6696 1 6 . 1 1 102 102 ASP H H 170 8.170 8.170 7.749 0.421 18517 6697 1 6 . 1 1 103 103 SER N N 171 117.110 117.110 112.551 4.559 18517 6698 1 6 . 1 1 103 103 SER HA H 171 4.430 4.430 4.547 -0.117 18517 6699 1 6 . 1 1 103 103 SER C C 171 174.770 174.770 174.702 0.068 18517 6700 1 6 . 1 1 103 103 SER CA C 171 57.960 57.960 57.096 0.864 18517 6701 1 6 . 1 1 103 103 SER CB C 171 64.940 64.940 66.226 -1.286 18517 6702 1 6 . 1 1 103 103 SER H H 171 8.450 8.450 8.111 0.339 18517 6703 1 6 . 1 1 104 104 GLU N N 172 122.970 122.970 123.185 -0.215 18517 6704 1 6 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.956 0.074 18517 6705 1 6 . 1 1 104 104 GLU C C 172 178.860 178.860 178.400 0.460 18517 6706 1 6 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.253 -0.553 18517 6707 1 6 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.541 0.109 18517 6708 1 6 . 1 1 104 104 GLU H H 172 8.830 8.830 8.979 -0.149 18517 6709 1 6 . 1 1 105 105 GLU N N 173 119.750 119.750 117.143 2.607 18517 6710 1 6 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.041 -0.061 18517 6711 1 6 . 1 1 105 105 GLU C C 173 178.920 178.920 178.900 0.020 18517 6712 1 6 . 1 1 105 105 GLU CA C 173 60.060 60.060 59.164 0.896 18517 6713 1 6 . 1 1 105 105 GLU CB C 173 29.730 29.730 29.199 0.531 18517 6714 1 6 . 1 1 105 105 GLU H H 173 8.580 8.580 8.737 -0.157 18517 6715 1 6 . 1 1 106 106 LEU N N 174 121.860 121.860 120.314 1.546 18517 6716 1 6 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.009 0.171 18517 6717 1 6 . 1 1 106 106 LEU C C 174 178.210 178.210 178.838 -0.628 18517 6718 1 6 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.845 0.035 18517 6719 1 6 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.432 -0.282 18517 6720 1 6 . 1 1 106 106 LEU H H 174 7.920 7.920 7.504 0.416 18517 6721 1 6 . 1 1 107 107 LYS N N 175 118.740 118.740 119.985 -1.245 18517 6722 1 6 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.971 -0.191 18517 6723 1 6 . 1 1 107 107 LYS C C 175 178.700 178.700 179.318 -0.618 18517 6724 1 6 . 1 1 107 107 LYS CA C 175 61.170 61.170 59.365 1.805 18517 6725 1 6 . 1 1 107 107 LYS CB C 175 32.430 32.430 31.625 0.805 18517 6726 1 6 . 1 1 107 107 LYS H H 175 8.340 8.340 8.583 -0.243 18517 6727 1 6 . 1 1 108 108 THR N N 176 113.820 113.820 116.739 -2.919 18517 6728 1 6 . 1 1 108 108 THR HA H 176 3.840 3.840 4.041 -0.201 18517 6729 1 6 . 1 1 108 108 THR C C 176 176.620 176.620 176.473 0.147 18517 6730 1 6 . 1 1 108 108 THR CA C 176 66.910 66.910 67.202 -0.292 18517 6731 1 6 . 1 1 108 108 THR CB C 176 69.610 69.610 68.606 1.004 18517 6732 1 6 . 1 1 108 108 THR H H 176 7.950 7.950 8.489 -0.539 18517 6733 1 6 . 1 1 109 109 LEU N N 177 124.380 124.380 122.328 2.052 18517 6734 1 6 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.233 -0.403 18517 6735 1 6 . 1 1 109 109 LEU C C 177 177.790 177.790 177.807 -0.017 18517 6736 1 6 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.568 0.422 18517 6737 1 6 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.581 1.000 18517 6738 1 6 . 1 1 109 109 LEU H H 177 7.480 7.480 7.829 -0.349 18517 6739 1 6 . 1 1 110 110 LEU N N 178 117.230 117.230 120.043 -2.813 18517 6740 1 6 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.860 -0.020 18517 6741 1 6 . 1 1 110 110 LEU C C 178 179.540 179.540 179.188 0.352 18517 6742 1 6 . 1 1 110 110 LEU CA C 178 58.390 58.390 58.051 0.339 18517 6743 1 6 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.345 0.995 18517 6744 1 6 . 1 1 110 110 LEU H H 178 8.670 8.670 8.215 0.455 18517 6745 1 6 . 1 1 111 111 LEU N N 179 119.230 119.230 121.066 -1.836 18517 6746 1 6 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.319 -0.239 18517 6747 1 6 . 1 1 111 111 LEU C C 179 179.310 179.310 179.632 -0.322 18517 6748 1 6 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.253 1.137 18517 6749 1 6 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.682 1.338 18517 6750 1 6 . 1 1 111 111 LEU H H 179 7.940 7.940 8.631 -0.691 18517 6751 1 6 . 1 1 112 112 LYS N N 180 121.910 121.910 121.040 0.870 18517 6752 1 6 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.114 0.076 18517 6753 1 6 . 1 1 112 112 LYS C C 180 178.740 178.740 179.191 -0.451 18517 6754 1 6 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.038 0.142 18517 6755 1 6 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.013 -0.143 18517 6756 1 6 . 1 1 112 112 LYS H H 180 7.420 7.420 8.100 -0.680 18517 6757 1 6 . 1 1 113 113 PHE N N 181 118.220 118.220 119.143 -0.923 18517 6758 1 6 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.248 0.502 18517 6759 1 6 . 1 1 113 113 PHE C C 181 178.520 178.520 177.882 0.638 18517 6760 1 6 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.685 -3.605 18517 6761 1 6 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.465 -0.485 18517 6762 1 6 . 1 1 113 113 PHE H H 181 9.000 9.000 8.703 0.297 18517 6763 1 6 . 1 1 114 114 SER N N 182 113.300 113.300 114.519 -1.219 18517 6764 1 6 . 1 1 114 114 SER HA H 182 3.930 3.930 4.120 -0.190 18517 6765 1 6 . 1 1 114 114 SER C C 182 177.080 177.080 177.208 -0.128 18517 6766 1 6 . 1 1 114 114 SER CA C 182 62.000 62.000 62.277 -0.277 18517 6767 1 6 . 1 1 114 114 SER CB C 182 63.510 63.510 62.745 0.765 18517 6768 1 6 . 1 1 114 114 SER H H 182 8.620 8.620 8.723 -0.103 18517 6769 1 6 . 1 1 115 115 GLU N N 183 121.540 121.540 121.503 0.037 18517 6770 1 6 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.125 -0.055 18517 6771 1 6 . 1 1 115 115 GLU C C 183 179.860 179.860 178.764 1.096 18517 6772 1 6 . 1 1 115 115 GLU CA C 183 59.780 59.780 58.424 1.356 18517 6773 1 6 . 1 1 115 115 GLU CB C 183 29.890 29.890 28.906 0.984 18517 6774 1 6 . 1 1 115 115 GLU H H 183 8.250 8.250 8.338 -0.088 18517 6775 1 6 . 1 1 116 116 ASP N N 184 121.740 121.740 121.661 0.079 18517 6776 1 6 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.366 0.144 18517 6777 1 6 . 1 1 116 116 ASP C C 184 179.570 179.570 178.215 1.355 18517 6778 1 6 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.758 -0.198 18517 6779 1 6 . 1 1 116 116 ASP CB C 184 40.990 40.990 41.142 -0.152 18517 6780 1 6 . 1 1 116 116 ASP H H 184 8.840 8.840 8.490 0.350 18517 6781 1 6 . 1 1 117 117 LEU N N 185 121.420 121.420 121.695 -0.275 18517 6782 1 6 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.016 0.114 18517 6783 1 6 . 1 1 117 117 LEU C C 185 178.840 178.840 178.499 0.341 18517 6784 1 6 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.040 0.190 18517 6785 1 6 . 1 1 117 117 LEU CB C 185 42.650 42.650 42.075 0.575 18517 6786 1 6 . 1 1 117 117 LEU H H 185 8.350 8.350 8.138 0.212 18517 6787 1 6 . 1 1 118 118 LYS N N 186 119.640 119.640 119.030 0.610 18517 6788 1 6 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.912 0.208 18517 6789 1 6 . 1 1 118 118 LYS C C 186 178.820 178.820 179.022 -0.202 18517 6790 1 6 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.519 0.221 18517 6791 1 6 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.189 0.321 18517 6792 1 6 . 1 1 118 118 LYS H H 186 8.220 8.220 8.335 -0.115 18517 6793 1 6 . 1 1 119 119 ALA N N 187 120.160 120.160 121.166 -1.006 18517 6794 1 6 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.351 -0.191 18517 6795 1 6 . 1 1 119 119 ALA C C 187 180.450 180.450 180.031 0.419 18517 6796 1 6 . 1 1 119 119 ALA CA C 187 55.140 55.140 54.797 0.343 18517 6797 1 6 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.494 -0.024 18517 6798 1 6 . 1 1 119 119 ALA H H 187 8.010 8.010 8.169 -0.159 18517 6799 1 6 . 1 1 120 120 GLU N N 188 117.930 117.930 118.405 -0.475 18517 6800 1 6 . 1 1 120 120 GLU HA H 188 4.180 4.180 3.900 0.280 18517 6801 1 6 . 1 1 120 120 GLU C C 188 178.780 178.780 179.266 -0.486 18517 6802 1 6 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.302 -0.472 18517 6803 1 6 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.156 0.814 18517 6804 1 6 . 1 1 120 120 GLU H H 188 7.640 7.640 8.135 -0.495 18517 6805 1 6 . 1 1 121 121 GLN N N 189 117.230 117.230 117.907 -0.677 18517 6806 1 6 . 1 1 121 121 GLN HA H 189 4.230 4.230 4.292 -0.062 18517 6807 1 6 . 1 1 121 121 GLN C C 189 179.190 179.190 178.337 0.853 18517 6808 1 6 . 1 1 121 121 GLN CA C 189 59.740 59.740 57.771 1.969 18517 6809 1 6 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.807 0.843 18517 6810 1 6 . 1 1 121 121 GLN H H 189 8.280 8.280 8.554 -0.274 18517 6811 1 6 . 1 1 122 122 GLU N N 190 118.340 118.340 120.931 -2.591 18517 6812 1 6 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.830 0.290 18517 6813 1 6 . 1 1 122 122 GLU C C 190 178.210 178.210 178.588 -0.378 18517 6814 1 6 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.724 0.026 18517 6815 1 6 . 1 1 122 122 GLU CB C 190 29.970 29.970 28.948 1.022 18517 6816 1 6 . 1 1 122 122 GLU H H 190 8.250 8.250 8.117 0.133 18517 6817 1 6 . 1 1 123 123 LEU N N 191 118.930 118.930 122.132 -3.202 18517 6818 1 6 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.760 0.330 18517 6819 1 6 . 1 1 123 123 LEU C C 191 178.500 178.500 178.632 -0.132 18517 6820 1 6 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.295 -1.295 18517 6821 1 6 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.834 0.666 18517 6822 1 6 . 1 1 123 123 LEU H H 191 7.530 7.530 7.966 -0.436 18517 6823 1 6 . 1 1 124 124 HIS N N 192 115.650 115.650 117.121 -1.471 18517 6824 1 6 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.148 0.572 18517 6825 1 6 . 1 1 124 124 HIS C C 192 176.090 176.090 177.920 -1.830 18517 6826 1 6 . 1 1 124 124 HIS CA C 192 56.690 56.690 59.376 -2.686 18517 6827 1 6 . 1 1 124 124 HIS CB C 192 30.760 30.760 29.630 1.131 18517 6828 1 6 . 1 1 124 124 HIS H H 192 7.450 7.450 7.940 -0.490 18517 6829 1 6 . 1 1 125 125 SER N N 193 115.480 115.480 114.911 0.569 18517 6830 1 6 . 1 1 125 125 SER HA H 193 4.310 4.310 4.078 0.232 18517 6831 1 6 . 1 1 125 125 SER CA C 193 60.180 60.180 61.736 -1.556 18517 6832 1 6 . 1 1 125 125 SER CB C 193 64.060 64.060 62.431 1.629 18517 6833 1 6 . 1 1 125 125 SER H H 193 8.020 8.020 8.097 -0.077 18517 6834 1 6 . 1 1 126 126 GLU C C 194 177.410 177.410 179.100 -1.690 18517 6835 1 6 . 1 1 126 126 GLU CA C 194 57.840 57.840 59.237 -1.397 18517 6836 1 6 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.678 0.212 18517 6837 1 6 . 1 1 127 127 ALA N N 195 122.910 122.910 122.486 0.424 18517 6838 1 6 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.140 0.050 18517 6839 1 6 . 1 1 127 127 ALA C C 195 178.610 178.610 179.255 -0.645 18517 6840 1 6 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.783 -0.993 18517 6841 1 6 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.833 0.427 18517 6842 1 6 . 1 1 127 127 ALA H H 195 8.020 8.020 7.907 0.113 18517 6843 1 6 . 1 1 128 128 LYS N N 196 117.770 117.770 117.340 0.430 18517 6844 1 6 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.393 -0.133 18517 6845 1 6 . 1 1 128 128 LYS C C 196 177.400 177.400 176.676 0.724 18517 6846 1 6 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.409 2.591 18517 6847 1 6 . 1 1 128 128 LYS CB C 196 32.740 32.740 33.510 -0.769 18517 6848 1 6 . 1 1 128 128 LYS H H 196 7.990 7.990 8.029 -0.039 18517 6849 1 6 . 1 1 129 129 GLY N N 197 109.010 109.010 109.028 -0.018 18517 6850 1 6 . 1 1 129 129 GLY C C 197 175.770 175.770 175.514 0.256 18517 6851 1 6 . 1 1 129 129 GLY CA C 197 46.100 46.100 45.150 0.950 18517 6852 1 6 . 1 1 129 129 GLY H H 197 8.220 8.220 7.606 0.614 18517 6853 1 6 . 1 1 130 130 GLY N N 198 109.150 109.150 110.021 -0.871 18517 6854 1 6 . 1 1 130 130 GLY C C 198 174.760 174.760 175.379 -0.619 18517 6855 1 6 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.265 -0.335 18517 6856 1 6 . 1 1 130 130 GLY H H 198 8.210 8.210 8.880 -0.670 18517 6857 1 6 . 1 1 131 131 GLU N N 199 121.560 121.560 121.645 -0.085 18517 6858 1 6 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.062 -0.042 18517 6859 1 6 . 1 1 131 131 GLU C C 199 178.500 178.500 178.256 0.244 18517 6860 1 6 . 1 1 131 131 GLU CA C 199 59.900 59.900 58.556 1.344 18517 6861 1 6 . 1 1 131 131 GLU CB C 199 29.570 29.570 27.841 1.729 18517 6862 1 6 . 1 1 131 131 GLU H H 199 8.510 8.510 8.695 -0.185 18517 6863 1 6 . 1 1 132 132 ALA N N 200 122.390 122.390 122.412 -0.022 18517 6864 1 6 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.224 -0.024 18517 6865 1 6 . 1 1 132 132 ALA C C 200 180.360 180.360 179.509 0.851 18517 6866 1 6 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.486 0.293 18517 6867 1 6 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.394 -0.004 18517 6868 1 6 . 1 1 132 132 ALA H H 200 8.190 8.190 7.516 0.674 18517 6869 1 6 . 1 1 133 133 LEU N N 201 120.800 120.800 120.872 -0.072 18517 6870 1 6 . 1 1 133 133 LEU HA H 201 4.210 4.210 3.973 0.237 18517 6871 1 6 . 1 1 133 133 LEU C C 201 179.270 179.270 178.565 0.705 18517 6872 1 6 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.894 -0.214 18517 6873 1 6 . 1 1 133 133 LEU CB C 201 42.180 42.180 42.223 -0.043 18517 6874 1 6 . 1 1 133 133 LEU H H 201 7.720 7.720 8.210 -0.490 18517 6875 1 6 . 1 1 134 134 LEU N N 202 120.680 120.680 119.644 1.036 18517 6876 1 6 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.868 0.112 18517 6877 1 6 . 1 1 134 134 LEU C C 202 179.030 179.030 178.352 0.678 18517 6878 1 6 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.885 0.545 18517 6879 1 6 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.388 0.232 18517 6880 1 6 . 1 1 134 134 LEU H H 202 8.470 8.470 8.466 0.004 18517 6881 1 6 . 1 1 135 135 SER N N 203 113.290 113.290 114.004 -0.714 18517 6882 1 6 . 1 1 135 135 SER HA H 203 4.180 4.180 4.037 0.143 18517 6883 1 6 . 1 1 135 135 SER C C 203 177.300 177.300 176.848 0.452 18517 6884 1 6 . 1 1 135 135 SER CA C 203 62.080 62.080 61.993 0.087 18517 6885 1 6 . 1 1 135 135 SER CB C 203 63.030 63.030 62.668 0.362 18517 6886 1 6 . 1 1 135 135 SER H H 203 8.210 8.210 8.207 0.003 18517 6887 1 6 . 1 1 136 136 SER N N 204 117.500 117.500 118.047 -0.547 18517 6888 1 6 . 1 1 136 136 SER HA H 204 4.050 4.050 4.239 -0.189 18517 6889 1 6 . 1 1 136 136 SER C C 204 177.570 177.570 176.668 0.902 18517 6890 1 6 . 1 1 136 136 SER CA C 204 61.880 61.880 61.324 0.556 18517 6891 1 6 . 1 1 136 136 SER CB C 204 63.510 63.510 62.910 0.600 18517 6892 1 6 . 1 1 136 136 SER H H 204 7.730 7.730 7.984 -0.254 18517 6893 1 6 . 1 1 137 137 MET N N 205 122.500 122.500 120.316 2.184 18517 6894 1 6 . 1 1 137 137 MET HA H 205 4.140 4.140 4.373 -0.233 18517 6895 1 6 . 1 1 137 137 MET C C 205 177.680 177.680 178.227 -0.547 18517 6896 1 6 . 1 1 137 137 MET CA C 205 60.140 60.140 58.867 1.273 18517 6897 1 6 . 1 1 137 137 MET CB C 205 33.460 33.460 32.379 1.081 18517 6898 1 6 . 1 1 137 137 MET H H 205 8.170 8.170 8.369 -0.199 18517 6899 1 6 . 1 1 138 138 LYS N N 206 121.410 121.410 120.040 1.370 18517 6900 1 6 . 1 1 138 138 LYS HA H 206 3.750 3.750 4.039 -0.289 18517 6901 1 6 . 1 1 138 138 LYS C C 206 178.780 178.780 179.189 -0.409 18517 6902 1 6 . 1 1 138 138 LYS CA C 206 60.330 60.330 59.720 0.610 18517 6903 1 6 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.408 -0.138 18517 6904 1 6 . 1 1 138 138 LYS H H 206 8.810 8.810 8.655 0.155 18517 6905 1 6 . 1 1 139 139 THR N N 207 116.580 116.580 117.156 -0.576 18517 6906 1 6 . 1 1 139 139 THR HA H 207 4.060 4.060 4.020 0.040 18517 6907 1 6 . 1 1 139 139 THR C C 207 176.730 176.730 176.978 -0.248 18517 6908 1 6 . 1 1 139 139 THR CA C 207 67.150 67.150 66.941 0.209 18517 6909 1 6 . 1 1 139 139 THR CB C 207 69.220 69.220 68.468 0.752 18517 6910 1 6 . 1 1 139 139 THR H H 207 7.930 7.930 8.051 -0.121 18517 6911 1 6 . 1 1 140 140 GLN N N 208 121.390 121.390 120.524 0.866 18517 6912 1 6 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.027 0.033 18517 6913 1 6 . 1 1 140 140 GLN C C 208 178.550 178.550 178.507 0.043 18517 6914 1 6 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.376 -0.076 18517 6915 1 6 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.685 0.175 18517 6916 1 6 . 1 1 140 140 GLN H H 208 7.600 7.600 8.256 -0.656 18517 6917 1 6 . 1 1 141 141 HIS N N 209 122.360 122.360 119.316 3.044 18517 6918 1 6 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.254 -0.424 18517 6919 1 6 . 1 1 141 141 HIS C C 209 176.390 176.390 176.730 -0.340 18517 6920 1 6 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.251 1.469 18517 6921 1 6 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.125 -1.025 18517 6922 1 6 . 1 1 141 141 HIS H H 209 8.980 8.980 8.363 0.617 18517 6923 1 6 . 1 1 142 142 ASP N N 210 120.740 120.740 120.331 0.409 18517 6924 1 6 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.354 -0.004 18517 6925 1 6 . 1 1 142 142 ASP C C 210 179.490 179.490 178.207 1.283 18517 6926 1 6 . 1 1 142 142 ASP CA C 210 57.920 57.920 58.181 -0.262 18517 6927 1 6 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.890 -0.300 18517 6928 1 6 . 1 1 142 142 ASP H H 210 8.770 8.770 8.303 0.467 18517 6929 1 6 . 1 1 143 143 GLU N N 211 119.010 119.010 120.568 -1.558 18517 6930 1 6 . 1 1 143 143 GLU HA H 211 3.970 3.970 3.987 -0.017 18517 6931 1 6 . 1 1 143 143 GLU C C 211 179.070 179.070 179.063 0.007 18517 6932 1 6 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.524 -0.224 18517 6933 1 6 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.639 -0.148 18517 6934 1 6 . 1 1 143 143 GLU H H 211 7.850 7.850 8.276 -0.426 18517 6935 1 6 . 1 1 144 144 LEU N N 212 122.500 122.500 120.028 2.472 18517 6936 1 6 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.020 0.050 18517 6937 1 6 . 1 1 144 144 LEU C C 212 179.340 179.340 179.367 -0.027 18517 6938 1 6 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.023 0.367 18517 6939 1 6 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.920 0.260 18517 6940 1 6 . 1 1 144 144 LEU H H 212 8.070 8.070 7.951 0.119 18517 6941 1 6 . 1 1 145 145 LEU N N 213 118.110 118.110 118.222 -0.112 18517 6942 1 6 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.666 0.534 18517 6943 1 6 . 1 1 145 145 LEU C C 213 179.610 179.610 179.158 0.452 18517 6944 1 6 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.784 0.966 18517 6945 1 6 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.228 0.002 18517 6946 1 6 . 1 1 145 145 LEU H H 213 8.370 8.370 8.227 0.143 18517 6947 1 6 . 1 1 146 146 LYS N N 214 117.290 117.290 119.973 -2.683 18517 6948 1 6 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.859 -0.029 18517 6949 1 6 . 1 1 146 146 LYS C C 214 179.900 179.900 178.836 1.064 18517 6950 1 6 . 1 1 146 146 LYS CA C 214 60.330 60.330 60.148 0.182 18517 6951 1 6 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.284 0.066 18517 6952 1 6 . 1 1 146 146 LYS H H 214 7.560 7.560 8.588 -1.028 18517 6953 1 6 . 1 1 147 147 LYS N N 215 120.330 120.330 119.389 0.941 18517 6954 1 6 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.087 -0.067 18517 6955 1 6 . 1 1 147 147 LYS C C 215 180.550 180.550 179.181 1.369 18517 6956 1 6 . 1 1 147 147 LYS CA C 215 60.100 60.100 58.854 1.246 18517 6957 1 6 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.014 0.726 18517 6958 1 6 . 1 1 147 147 LYS H H 215 7.830 7.830 7.920 -0.090 18517 6959 1 6 . 1 1 148 148 PHE N N 216 117.370 117.370 117.510 -0.140 18517 6960 1 6 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.224 -0.144 18517 6961 1 6 . 1 1 148 148 PHE C C 216 178.200 178.200 177.654 0.546 18517 6962 1 6 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.791 0.329 18517 6963 1 6 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.519 1.201 18517 6964 1 6 . 1 1 148 148 PHE H H 216 8.010 8.010 8.449 -0.439 18517 6965 1 6 . 1 1 149 149 ALA N N 217 118.990 118.990 121.416 -2.426 18517 6966 1 6 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.279 -0.169 18517 6967 1 6 . 1 1 149 149 ALA C C 217 177.330 177.330 178.612 -1.282 18517 6968 1 6 . 1 1 149 149 ALA CA C 217 53.750 53.750 54.255 -0.505 18517 6969 1 6 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.444 -0.844 18517 6970 1 6 . 1 1 149 149 ALA H H 217 7.720 7.720 8.236 -0.516 18517 6971 1 6 . 1 1 150 150 ALA N N 218 118.690 118.690 120.341 -1.651 18517 6972 1 6 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.285 0.075 18517 6973 1 6 . 1 1 150 150 ALA C C 218 177.930 177.930 177.707 0.223 18517 6974 1 6 . 1 1 150 150 ALA CA C 218 52.090 52.090 53.060 -0.971 18517 6975 1 6 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.379 0.361 18517 6976 1 6 . 1 1 150 150 ALA H H 218 7.280 7.280 7.877 -0.597 18517 6977 1 6 . 1 1 151 151 LEU N N 219 119.980 119.980 120.209 -0.229 18517 6978 1 6 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.434 -0.164 18517 6979 1 6 . 1 1 151 151 LEU C C 219 176.150 176.150 175.163 0.987 18517 6980 1 6 . 1 1 151 151 LEU CA C 219 56.170 56.170 54.510 1.660 18517 6981 1 6 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.672 -0.862 18517 6982 1 6 . 1 1 151 151 LEU H H 219 7.050 7.050 7.957 -0.907 18517 6983 1 6 . 1 1 152 152 THR N N 220 112.070 112.070 113.076 -1.006 18517 6984 1 6 . 1 1 152 152 THR HA H 220 4.700 4.700 4.665 0.035 18517 6985 1 6 . 1 1 152 152 THR C C 220 173.400 173.400 173.450 -0.050 18517 6986 1 6 . 1 1 152 152 THR CA C 220 58.190 58.190 58.553 -0.363 18517 6987 1 6 . 1 1 152 152 THR CB C 220 70.960 70.960 69.055 1.905 18517 6988 1 6 . 1 1 152 152 THR H H 220 8.040 8.040 8.101 -0.061 18517 6989 1 6 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.604 0.106 18517 6990 1 6 . 1 1 153 153 PRO C C 221 176.720 176.720 176.186 0.534 18517 6991 1 6 . 1 1 153 153 PRO CA C 221 62.910 62.910 61.848 1.062 18517 6992 1 6 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.444 1.806 18517 6993 1 6 . 1 1 154 154 THR N N 222 120.460 120.460 116.477 3.983 18517 6994 1 6 . 1 1 154 154 THR HA H 222 4.250 4.250 4.418 -0.168 18517 6995 1 6 . 1 1 154 154 THR C C 222 175.190 175.190 174.669 0.521 18517 6996 1 6 . 1 1 154 154 THR CA C 222 64.650 64.650 63.600 1.050 18517 6997 1 6 . 1 1 154 154 THR CB C 222 70.410 70.410 68.680 1.730 18517 6998 1 6 . 1 1 154 154 THR H H 222 8.530 8.530 8.210 0.320 18517 6999 1 6 . 1 1 155 155 PHE N N 223 122.260 122.260 129.473 -7.213 18517 7000 1 6 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.445 0.545 18517 7001 1 6 . 1 1 155 155 PHE C C 223 172.560 172.560 174.828 -2.268 18517 7002 1 6 . 1 1 155 155 PHE CA C 223 56.770 56.770 59.553 -2.783 18517 7003 1 6 . 1 1 155 155 PHE CB C 223 40.590 40.590 40.116 0.474 18517 7004 1 6 . 1 1 155 155 PHE H H 223 8.950 8.950 8.422 0.528 18517 7005 1 6 . 1 1 156 156 LEU N N 224 123.440 123.440 116.750 6.690 18517 7006 1 6 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.587 0.083 18517 7007 1 6 . 1 1 156 156 LEU C C 224 175.090 175.090 176.966 -1.876 18517 7008 1 6 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.292 -0.262 18517 7009 1 6 . 1 1 156 156 LEU CB C 224 46.300 46.300 43.480 2.820 18517 7010 1 6 . 1 1 156 156 LEU H H 224 7.210 7.210 7.775 -0.565 18517 7011 1 6 . 1 1 157 157 THR N N 225 113.010 113.010 114.868 -1.858 18517 7012 1 6 . 1 1 157 157 THR HA H 225 4.790 4.790 4.655 0.135 18517 7013 1 6 . 1 1 157 157 THR C C 225 176.130 176.130 173.803 2.327 18517 7014 1 6 . 1 1 157 157 THR CA C 225 59.860 59.860 61.332 -1.472 18517 7015 1 6 . 1 1 157 157 THR CB C 225 72.860 72.860 71.345 1.515 18517 7016 1 6 . 1 1 157 157 THR H H 225 9.200 9.200 8.433 0.767 18517 7017 1 6 . 1 1 158 158 SER N N 226 115.350 115.350 118.893 -3.543 18517 7018 1 6 . 1 1 158 158 SER C C 226 177.410 177.410 175.848 1.562 18517 7019 1 6 . 1 1 158 158 SER CA C 226 57.400 57.400 58.561 -1.161 18517 7020 1 6 . 1 1 158 158 SER CB C 226 66.200 66.200 63.683 2.517 18517 7021 1 6 . 1 1 158 158 SER H H 226 8.830 8.830 8.510 0.320 18517 7022 1 6 . 1 1 159 159 GLU N N 227 121.200 121.200 123.770 -2.570 18517 7023 1 6 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.961 0.059 18517 7024 1 6 . 1 1 159 159 GLU C C 227 177.680 177.680 177.943 -0.263 18517 7025 1 6 . 1 1 159 159 GLU CA C 227 59.500 59.500 59.389 0.112 18517 7026 1 6 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.404 0.166 18517 7027 1 6 . 1 1 159 159 GLU H H 227 8.320 8.320 9.012 -0.692 18517 7028 1 6 . 1 1 160 160 ASP N N 228 115.350 115.350 117.434 -2.084 18517 7029 1 6 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.415 0.135 18517 7030 1 6 . 1 1 160 160 ASP C C 228 177.640 177.640 177.979 -0.339 18517 7031 1 6 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.859 0.541 18517 7032 1 6 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.587 2.463 18517 7033 1 6 . 1 1 160 160 ASP H H 228 7.570 7.570 8.319 -0.749 18517 7034 1 6 . 1 1 161 161 ILE N N 229 108.150 108.150 115.320 -7.170 18517 7035 1 6 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.263 0.247 18517 7036 1 6 . 1 1 161 161 ILE C C 229 173.130 173.130 176.666 -3.536 18517 7037 1 6 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.847 -1.557 18517 7038 1 6 . 1 1 161 161 ILE CB C 229 39.400 39.400 38.588 0.812 18517 7039 1 6 . 1 1 161 161 ILE H H 229 7.190 7.190 7.561 -0.371 18517 7040 1 6 . 1 1 162 162 SER N N 230 115.290 115.290 117.428 -2.138 18517 7041 1 6 . 1 1 162 162 SER HA H 230 4.760 4.760 4.724 0.036 18517 7042 1 6 . 1 1 162 162 SER C C 230 176.060 176.060 174.282 1.778 18517 7043 1 6 . 1 1 162 162 SER CA C 230 57.920 57.920 58.048 -0.128 18517 7044 1 6 . 1 1 162 162 SER CB C 230 66.120 66.120 62.017 4.103 18517 7045 1 6 . 1 1 162 162 SER H H 230 7.460 7.460 8.148 -0.688 18517 7046 1 6 . 1 1 163 163 GLY C C 231 173.260 173.260 173.247 0.013 18517 7047 1 6 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.841 0.709 18517 7048 1 6 . 1 1 164 164 TYR N N 232 115.290 115.290 119.506 -4.216 18517 7049 1 6 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.716 -0.016 18517 7050 1 6 . 1 1 164 164 TYR C C 232 172.820 172.820 173.633 -0.813 18517 7051 1 6 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.301 -0.201 18517 7052 1 6 . 1 1 164 164 TYR CB C 232 39.800 39.800 40.113 -0.313 18517 7053 1 6 . 1 1 164 164 TYR H H 232 7.370 7.370 7.534 -0.164 18517 7054 1 6 . 1 1 165 165 LEU N N 233 120.980 120.980 122.759 -1.779 18517 7055 1 6 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.573 -0.143 18517 7056 1 6 . 1 1 165 165 LEU C C 233 176.360 176.360 177.773 -1.413 18517 7057 1 6 . 1 1 165 165 LEU CA C 233 55.660 55.660 53.509 2.151 18517 7058 1 6 . 1 1 165 165 LEU CB C 233 40.430 40.430 40.423 0.007 18517 7059 1 6 . 1 1 165 165 LEU H H 233 8.830 8.830 8.165 0.665 18517 7060 1 6 . 1 1 166 166 THR N N 234 116.170 116.170 114.613 1.557 18517 7061 1 6 . 1 1 166 166 THR HA H 234 4.010 4.010 3.392 0.618 18517 7062 1 6 . 1 1 166 166 THR C C 234 173.070 173.070 173.981 -0.911 18517 7063 1 6 . 1 1 166 166 THR CA C 234 62.910 62.910 64.318 -1.408 18517 7064 1 6 . 1 1 166 166 THR CB C 234 70.170 70.170 68.876 1.294 18517 7065 1 6 . 1 1 166 166 THR H H 234 8.050 8.050 8.040 0.010 18517 7066 1 6 . 1 1 167 167 VAL N N 235 117.640 117.640 115.140 2.500 18517 7067 1 6 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.324 -0.114 18517 7068 1 6 . 1 1 167 167 VAL C C 235 172.330 172.330 173.972 -1.642 18517 7069 1 6 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.731 1.019 18517 7070 1 6 . 1 1 167 167 VAL CB C 235 35.880 35.880 31.292 4.588 18517 7071 1 6 . 1 1 167 167 VAL H H 235 7.160 7.160 7.396 -0.236 18517 7072 1 6 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.527 -0.337 18517 7073 1 6 . 1 1 168 168 PRO C C 236 173.710 173.710 176.134 -2.424 18517 7074 1 6 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.273 1.556 18517 7075 1 6 . 1 1 168 168 PRO CB C 236 32.270 32.270 33.144 -0.874 18517 7076 1 6 . 1 1 169 169 GLU N N 237 113.540 113.540 119.426 -5.886 18517 7077 1 6 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.038 0.342 18517 7078 1 6 . 1 1 169 169 GLU C C 237 176.690 176.690 177.888 -1.198 18517 7079 1 6 . 1 1 169 169 GLU CA C 237 53.750 53.750 55.105 -1.355 18517 7080 1 6 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.951 2.269 18517 7081 1 6 . 1 1 169 169 GLU H H 237 7.930 7.930 8.496 -0.566 18517 7082 1 6 . 1 1 170 170 TYR N N 238 119.400 119.400 120.103 -0.703 18517 7083 1 6 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.329 -0.329 18517 7084 1 6 . 1 1 170 170 TYR C C 238 177.610 177.610 176.099 1.511 18517 7085 1 6 . 1 1 170 170 TYR CA C 238 62.630 62.630 59.740 2.890 18517 7086 1 6 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.344 -0.604 18517 7087 1 6 . 1 1 170 170 TYR H H 238 8.490 8.490 8.654 -0.164 18517 7088 1 6 . 1 1 171 171 GLY N N 239 104.160 104.160 103.343 0.817 18517 7089 1 6 . 1 1 171 171 GLY C C 239 173.350 173.350 173.064 0.286 18517 7090 1 6 . 1 1 171 171 GLY CA C 239 45.270 45.270 45.125 0.145 18517 7091 1 6 . 1 1 171 171 GLY H H 239 7.960 7.960 7.846 0.114 18517 7092 1 6 . 1 1 172 172 ALA N N 240 121.860 121.860 124.037 -2.177 18517 7093 1 6 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.842 -0.672 18517 7094 1 6 . 1 1 172 172 ALA C C 240 172.160 172.160 174.757 -2.597 18517 7095 1 6 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.072 1.038 18517 7096 1 6 . 1 1 172 172 ALA CB C 240 20.930 20.930 19.505 1.425 18517 7097 1 6 . 1 1 172 172 ALA H H 240 6.910 6.910 7.893 -0.983 18517 7098 1 6 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.431 1.119 18517 7099 1 6 . 1 1 173 173 PRO C C 241 176.610 176.610 175.046 1.564 18517 7100 1 6 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.364 -0.844 18517 7101 1 6 . 1 1 173 173 PRO CB C 241 33.300 33.300 32.228 1.072 18517 7102 1 6 . 1 1 174 174 MET N N 242 114.000 114.000 120.421 -6.421 18517 7103 1 6 . 1 1 174 174 MET HA H 242 4.390 4.390 4.589 -0.199 18517 7104 1 6 . 1 1 174 174 MET C C 242 173.960 173.960 174.549 -0.589 18517 7105 1 6 . 1 1 174 174 MET CA C 242 54.660 54.660 53.657 1.003 18517 7106 1 6 . 1 1 174 174 MET CB C 242 34.170 34.170 36.123 -1.953 18517 7107 1 6 . 1 1 174 174 MET H H 242 8.040 8.040 7.807 0.233 18517 7108 1 6 . 1 1 175 175 ASN N N 243 119.570 119.570 122.347 -2.777 18517 7109 1 6 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.781 0.159 18517 7110 1 6 . 1 1 175 175 ASN C C 243 174.320 174.320 175.157 -0.837 18517 7111 1 6 . 1 1 175 175 ASN CA C 243 53.080 53.080 51.971 1.109 18517 7112 1 6 . 1 1 175 175 ASN CB C 243 38.850 38.850 39.337 -0.487 18517 7113 1 6 . 1 1 175 175 ASN H H 243 7.960 7.960 8.611 -0.651 18517 7114 1 6 . 1 1 176 176 ALA N N 244 132.250 132.250 128.950 3.300 18517 7115 1 6 . 1 1 176 176 ALA C C 244 181.580 181.580 178.581 2.999 18517 7116 1 6 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.288 0.482 18517 7117 1 6 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.708 0.322 18517 7118 1 6 . 1 1 176 176 ALA H H 244 12.110 12.110 8.445 3.665 18517 7119 1 6 . 1 1 177 177 ALA N N 245 125.780 125.780 121.581 4.199 18517 7120 1 6 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.957 -0.087 18517 7121 1 6 . 1 1 177 177 ALA C C 245 180.640 180.640 179.623 1.017 18517 7122 1 6 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.178 0.482 18517 7123 1 6 . 1 1 177 177 ALA CB C 245 17.840 17.840 17.713 0.127 18517 7124 1 6 . 1 1 177 177 ALA H H 245 10.240 10.240 8.098 2.142 18517 7125 1 6 . 1 1 178 178 LYS N N 246 119.810 119.810 119.082 0.728 18517 7126 1 6 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.037 -0.207 18517 7127 1 6 . 1 1 178 178 LYS C C 246 180.500 180.500 178.292 2.208 18517 7128 1 6 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.088 0.812 18517 7129 1 6 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.285 -0.965 18517 7130 1 6 . 1 1 178 178 LYS H H 246 8.470 8.470 7.652 0.818 18517 7131 1 6 . 1 1 179 179 TRP N N 247 121.170 121.170 121.661 -0.491 18517 7132 1 6 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.284 0.336 18517 7133 1 6 . 1 1 179 179 TRP C C 247 176.510 176.510 177.772 -1.262 18517 7134 1 6 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.860 -0.040 18517 7135 1 6 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.710 -0.141 18517 7136 1 6 . 1 1 179 179 TRP H H 247 8.330 8.330 8.544 -0.214 18517 7137 1 6 . 1 1 180 180 ALA N N 248 119.130 119.130 120.257 -1.127 18517 7138 1 6 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.738 0.802 18517 7139 1 6 . 1 1 180 180 ALA C C 248 182.110 182.110 179.391 2.719 18517 7140 1 6 . 1 1 180 180 ALA CA C 248 54.190 54.190 55.198 -1.008 18517 7141 1 6 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.149 0.561 18517 7142 1 6 . 1 1 180 180 ALA H H 248 7.990 7.990 8.632 -0.642 18517 7143 1 6 . 1 1 181 181 LYS N N 249 116.000 116.000 119.493 -3.493 18517 7144 1 6 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.050 -0.080 18517 7145 1 6 . 1 1 181 181 LYS C C 249 179.380 179.380 178.780 0.600 18517 7146 1 6 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.429 -0.719 18517 7147 1 6 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.651 -0.142 18517 7148 1 6 . 1 1 181 181 LYS H H 249 6.900 6.900 7.804 -0.904 18517 7149 1 6 . 1 1 182 182 VAL N N 250 122.270 122.270 115.995 6.275 18517 7150 1 6 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.679 -0.339 18517 7151 1 6 . 1 1 182 182 VAL C C 250 178.160 178.160 177.843 0.317 18517 7152 1 6 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.311 0.449 18517 7153 1 6 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.612 -0.772 18517 7154 1 6 . 1 1 182 182 VAL H H 250 7.050 7.050 8.033 -0.983 18517 7155 1 6 . 1 1 183 183 GLU N N 251 120.520 120.520 120.645 -0.125 18517 7156 1 6 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.896 -0.716 18517 7157 1 6 . 1 1 183 183 GLU C C 251 179.480 179.480 178.850 0.630 18517 7158 1 6 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.199 1.491 18517 7159 1 6 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.582 -0.512 18517 7160 1 6 . 1 1 183 183 GLU H H 251 8.020 8.020 8.660 -0.640 18517 7161 1 6 . 1 1 184 184 GLY N N 252 102.930 102.930 107.369 -4.439 18517 7162 1 6 . 1 1 184 184 GLY C C 252 176.920 176.920 176.570 0.350 18517 7163 1 6 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.229 0.181 18517 7164 1 6 . 1 1 184 184 GLY H H 252 7.830 7.830 8.035 -0.205 18517 7165 1 6 . 1 1 185 185 MET N N 253 123.200 123.200 121.775 1.425 18517 7166 1 6 . 1 1 185 185 MET HA H 253 4.250 4.250 4.116 0.134 18517 7167 1 6 . 1 1 185 185 MET C C 253 179.370 179.370 178.688 0.682 18517 7168 1 6 . 1 1 185 185 MET CA C 253 59.300 59.300 59.369 -0.069 18517 7169 1 6 . 1 1 185 185 MET CB C 253 33.930 33.930 32.438 1.492 18517 7170 1 6 . 1 1 185 185 MET H H 253 7.890 7.890 7.834 0.056 18517 7171 1 6 . 1 1 186 186 ILE N N 254 120.150 120.150 120.424 -0.274 18517 7172 1 6 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.509 0.051 18517 7173 1 6 . 1 1 186 186 ILE C C 254 177.250 177.250 178.112 -0.862 18517 7174 1 6 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.657 0.863 18517 7175 1 6 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.486 0.804 18517 7176 1 6 . 1 1 186 186 ILE H H 254 8.260 8.260 8.605 -0.345 18517 7177 1 6 . 1 1 187 187 HIS N N 255 119.810 119.810 119.228 0.582 18517 7178 1 6 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.227 -0.227 18517 7179 1 6 . 1 1 187 187 HIS C C 255 176.460 176.460 177.529 -1.069 18517 7180 1 6 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.731 0.599 18517 7181 1 6 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.544 2.086 18517 7182 1 6 . 1 1 187 187 HIS H H 255 8.900 8.900 8.831 0.069 18517 7183 1 6 . 1 1 188 188 GLY N N 256 103.160 103.160 106.540 -3.380 18517 7184 1 6 . 1 1 188 188 GLY C C 256 176.320 176.320 175.913 0.407 18517 7185 1 6 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.775 0.115 18517 7186 1 6 . 1 1 188 188 GLY H H 256 8.030 8.030 8.108 -0.078 18517 7187 1 6 . 1 1 189 189 LYS N N 257 119.510 119.510 120.072 -0.562 18517 7188 1 6 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.304 -0.304 18517 7189 1 6 . 1 1 189 189 LYS C C 257 178.660 178.660 178.956 -0.296 18517 7190 1 6 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.153 -0.663 18517 7191 1 6 . 1 1 189 189 LYS CB C 257 31.550 31.550 32.546 -0.996 18517 7192 1 6 . 1 1 189 189 LYS H H 257 7.120 7.120 7.869 -0.749 18517 7193 1 6 . 1 1 190 190 LEU N N 258 120.570 120.570 122.374 -1.804 18517 7194 1 6 . 1 1 190 190 LEU HA H 258 3.930 3.930 3.966 -0.036 18517 7195 1 6 . 1 1 190 190 LEU C C 258 177.230 177.230 176.993 0.237 18517 7196 1 6 . 1 1 190 190 LEU CA C 258 57.520 57.520 58.067 -0.547 18517 7197 1 6 . 1 1 190 190 LEU CB C 258 42.970 42.970 42.148 0.822 18517 7198 1 6 . 1 1 190 190 LEU H H 258 8.060 8.060 8.524 -0.464 18517 7199 1 6 . 1 1 191 191 GLU N N 259 114.590 114.590 113.893 0.697 18517 7200 1 6 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.279 0.001 18517 7201 1 6 . 1 1 191 191 GLU C C 259 176.230 176.230 176.539 -0.309 18517 7202 1 6 . 1 1 191 191 GLU CA C 259 55.340 55.340 55.800 -0.460 18517 7203 1 6 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.221 0.108 18517 7204 1 6 . 1 1 191 191 GLU H H 259 7.330 7.330 7.958 -0.628 18517 7205 1 6 . 1 1 192 192 SER N N 260 115.240 115.240 116.059 -0.819 18517 7206 1 6 . 1 1 192 192 SER HA H 260 4.490 4.490 4.530 -0.040 18517 7207 1 6 . 1 1 192 192 SER C C 260 173.770 173.770 174.715 -0.945 18517 7208 1 6 . 1 1 192 192 SER CA C 260 58.350 58.350 57.441 0.909 18517 7209 1 6 . 1 1 192 192 SER CB C 260 65.090 65.090 64.356 0.734 18517 7210 1 6 . 1 1 192 192 SER H H 260 7.130 7.130 7.677 -0.547 18517 7211 1 6 . 1 1 193 193 SER C C 261 174.600 174.600 174.416 0.184 18517 7212 1 6 . 1 1 193 193 SER CA C 261 59.980 59.980 58.855 1.125 18517 7213 1 6 . 1 1 193 193 SER CB C 261 63.750 63.750 62.230 1.520 18517 7214 1 6 . 1 1 194 194 GLU N N 262 121.800 121.800 122.152 -0.352 18517 7215 1 6 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.365 0.105 18517 7216 1 6 . 1 1 194 194 GLU C C 262 174.650 174.650 175.471 -0.821 18517 7217 1 6 . 1 1 194 194 GLU CA C 262 55.620 55.620 55.234 0.386 18517 7218 1 6 . 1 1 194 194 GLU CB C 262 30.210 30.210 29.607 0.603 18517 7219 1 6 . 1 1 194 194 GLU H H 262 7.840 7.840 7.760 0.080 18517 7220 1 6 . 1 1 195 195 VAL N N 263 124.080 124.080 125.898 -1.818 18517 7221 1 6 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.145 0.105 18517 7222 1 6 . 1 1 195 195 VAL C C 263 174.460 174.460 174.127 0.333 18517 7223 1 6 . 1 1 195 195 VAL CA C 263 59.820 59.820 59.406 0.414 18517 7224 1 6 . 1 1 195 195 VAL CB C 263 33.620 33.620 33.160 0.459 18517 7225 1 6 . 1 1 195 195 VAL H H 263 8.020 8.020 8.445 -0.425 18517 7226 1 6 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.399 0.121 18517 7227 1 6 . 1 1 198 198 ASN C C 266 176.490 176.490 177.015 -0.525 18517 7228 1 6 . 1 1 198 198 ASN CA C 266 54.780 54.780 56.357 -1.577 18517 7229 1 6 . 1 1 198 198 ASN CB C 266 38.060 38.060 38.201 -0.141 18517 7230 1 6 . 1 1 199 199 LEU N N 267 120.680 120.680 118.507 2.173 18517 7231 1 6 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.793 0.217 18517 7232 1 6 . 1 1 199 199 LEU C C 267 178.050 178.050 178.436 -0.386 18517 7233 1 6 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.095 0.735 18517 7234 1 6 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.107 1.233 18517 7235 1 6 . 1 1 199 199 LEU H H 267 7.660 7.660 7.848 -0.188 18517 7236 1 6 . 1 1 200 200 LYS N N 268 116.740 116.740 119.607 -2.867 18517 7237 1 6 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.999 -0.269 18517 7238 1 6 . 1 1 200 200 LYS C C 268 178.520 178.520 178.475 0.045 18517 7239 1 6 . 1 1 200 200 LYS CA C 268 61.800 61.800 58.393 3.407 18517 7240 1 6 . 1 1 200 200 LYS CB C 268 32.110 32.110 32.260 -0.150 18517 7241 1 6 . 1 1 200 200 LYS H H 268 8.280 8.280 7.618 0.662 18517 7242 1 6 . 1 1 201 201 ALA N N 269 121.270 121.270 123.360 -2.090 18517 7243 1 6 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.056 0.184 18517 7244 1 6 . 1 1 201 201 ALA C C 269 180.890 180.890 179.298 1.592 18517 7245 1 6 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.045 0.135 18517 7246 1 6 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.405 0.065 18517 7247 1 6 . 1 1 201 201 ALA H H 269 7.710 7.710 8.031 -0.321 18517 7248 1 6 . 1 1 202 202 LEU N N 270 119.980 119.980 119.395 0.585 18517 7249 1 6 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.857 0.233 18517 7250 1 6 . 1 1 202 202 LEU C C 270 179.330 179.330 179.084 0.246 18517 7251 1 6 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.830 0.240 18517 7252 1 6 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.311 1.109 18517 7253 1 6 . 1 1 202 202 LEU H H 270 7.750 7.750 8.313 -0.563 18517 7254 1 6 . 1 1 203 203 VAL N N 271 118.450 118.450 119.596 -1.146 18517 7255 1 6 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.655 0.175 18517 7256 1 6 . 1 1 203 203 VAL C C 271 177.110 177.110 177.778 -0.668 18517 7257 1 6 . 1 1 203 203 VAL CA C 271 67.710 67.710 67.088 0.622 18517 7258 1 6 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.408 0.302 18517 7259 1 6 . 1 1 203 203 VAL H H 271 8.560 8.560 7.948 0.612 18517 7260 1 6 . 1 1 204 204 ALA N N 272 122.560 122.560 120.888 1.672 18517 7261 1 6 . 1 1 204 204 ALA HA H 272 3.880 3.880 3.963 -0.083 18517 7262 1 6 . 1 1 204 204 ALA C C 272 178.700 178.700 179.788 -1.088 18517 7263 1 6 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.458 0.672 18517 7264 1 6 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.012 0.378 18517 7265 1 6 . 1 1 204 204 ALA H H 272 8.120 8.120 8.120 0.000 18517 7266 1 6 . 1 1 205 205 GLU N N 273 117.290 117.290 119.241 -1.951 18517 7267 1 6 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.056 -0.066 18517 7268 1 6 . 1 1 205 205 GLU C C 273 178.630 178.630 179.154 -0.524 18517 7269 1 6 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.397 0.743 18517 7270 1 6 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.425 0.545 18517 7271 1 6 . 1 1 205 205 GLU H H 273 7.670 7.670 8.161 -0.491 18517 7272 1 6 . 1 1 206 206 LEU N N 274 120.450 120.450 121.562 -1.112 18517 7273 1 6 . 1 1 206 206 LEU HA H 274 4.000 4.000 3.993 0.007 18517 7274 1 6 . 1 1 206 206 LEU C C 274 178.400 178.400 178.869 -0.469 18517 7275 1 6 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.108 0.802 18517 7276 1 6 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.999 1.531 18517 7277 1 6 . 1 1 206 206 LEU H H 274 8.420 8.420 8.427 -0.007 18517 7278 1 6 . 1 1 207 207 ILE N N 275 117.580 117.580 120.330 -2.750 18517 7279 1 6 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.545 -0.015 18517 7280 1 6 . 1 1 207 207 ILE C C 275 178.850 178.850 178.160 0.690 18517 7281 1 6 . 1 1 207 207 ILE CA C 275 66.080 66.080 66.089 -0.009 18517 7282 1 6 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.822 0.948 18517 7283 1 6 . 1 1 207 207 ILE H H 275 8.700 8.700 8.610 0.090 18517 7284 1 6 . 1 1 208 208 GLU N N 276 119.100 119.100 119.868 -0.768 18517 7285 1 6 . 1 1 208 208 GLU HA H 276 4.000 4.000 4.032 -0.032 18517 7286 1 6 . 1 1 208 208 GLU C C 276 178.540 178.540 179.238 -0.698 18517 7287 1 6 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.649 0.801 18517 7288 1 6 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.951 0.569 18517 7289 1 6 . 1 1 208 208 GLU H H 276 7.950 7.950 8.068 -0.118 18517 7290 1 6 . 1 1 209 209 LEU N N 277 120.590 120.590 121.250 -0.660 18517 7291 1 6 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.117 0.103 18517 7292 1 6 . 1 1 209 209 LEU C C 277 179.520 179.520 178.586 0.934 18517 7293 1 6 . 1 1 209 209 LEU CA C 277 58.350 58.350 57.948 0.402 18517 7294 1 6 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.397 1.893 18517 7295 1 6 . 1 1 209 209 LEU H H 277 8.550 8.550 8.460 0.090 18517 7296 1 6 . 1 1 210 210 ARG N N 278 116.470 116.470 119.691 -3.221 18517 7297 1 6 . 1 1 210 210 ARG HA H 278 3.740 3.740 3.937 -0.197 18517 7298 1 6 . 1 1 210 210 ARG C C 278 179.190 179.190 178.641 0.549 18517 7299 1 6 . 1 1 210 210 ARG CA C 278 61.680 61.680 60.113 1.567 18517 7300 1 6 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.381 1.020 18517 7301 1 6 . 1 1 210 210 ARG H H 278 8.590 8.590 8.762 -0.172 18517 7302 1 6 . 1 1 211 211 ALA N N 279 120.470 120.470 121.347 -0.877 18517 7303 1 6 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.036 -0.126 18517 7304 1 6 . 1 1 211 211 ALA C C 279 181.350 181.350 179.824 1.526 18517 7305 1 6 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.100 0.600 18517 7306 1 6 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.008 -0.728 18517 7307 1 6 . 1 1 211 211 ALA H H 279 8.050 8.050 8.179 -0.129 18517 7308 1 6 . 1 1 212 212 GLN N N 280 120.070 120.070 117.966 2.104 18517 7309 1 6 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.870 0.150 18517 7310 1 6 . 1 1 212 212 GLN C C 280 179.490 179.490 178.820 0.670 18517 7311 1 6 . 1 1 212 212 GLN CA C 280 59.300 59.300 59.173 0.127 18517 7312 1 6 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.698 0.482 18517 7313 1 6 . 1 1 212 212 GLN H H 280 8.300 8.300 8.033 0.267 18517 7314 1 6 . 1 1 213 213 MET N N 281 119.810 119.810 117.820 1.990 18517 7315 1 6 . 1 1 213 213 MET HA H 281 3.730 3.730 4.213 -0.483 18517 7316 1 6 . 1 1 213 213 MET C C 281 177.490 177.490 178.676 -1.186 18517 7317 1 6 . 1 1 213 213 MET CA C 281 60.690 60.690 57.996 2.694 18517 7318 1 6 . 1 1 213 213 MET CB C 281 33.930 33.930 32.425 1.504 18517 7319 1 6 . 1 1 213 213 MET H H 281 8.420 8.420 8.260 0.160 18517 7320 1 6 . 1 1 214 214 MET N N 282 114.000 114.000 119.792 -5.792 18517 7321 1 6 . 1 1 214 214 MET HA H 282 3.880 3.880 4.199 -0.319 18517 7322 1 6 . 1 1 214 214 MET C C 282 177.650 177.650 177.760 -0.110 18517 7323 1 6 . 1 1 214 214 MET CA C 282 58.670 58.670 58.925 -0.255 18517 7324 1 6 . 1 1 214 214 MET CB C 282 33.300 33.300 32.831 0.469 18517 7325 1 6 . 1 1 214 214 MET H H 282 7.890 7.890 8.383 -0.493 18517 7326 1 6 . 1 1 215 215 ALA N N 283 119.970 119.970 123.187 -3.217 18517 7327 1 6 . 1 1 215 215 ALA HA H 283 4.140 4.140 3.964 0.176 18517 7328 1 6 . 1 1 215 215 ALA C C 283 180.580 180.580 178.914 1.666 18517 7329 1 6 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.210 -1.100 18517 7330 1 6 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.488 -0.808 18517 7331 1 6 . 1 1 215 215 ALA H H 283 7.580 7.580 8.601 -1.021 18517 7332 1 6 . 1 1 216 216 LEU N N 284 120.920 120.920 118.760 2.160 18517 7333 1 6 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.075 -0.115 18517 7334 1 6 . 1 1 216 216 LEU C C 284 177.910 177.910 179.866 -1.956 18517 7335 1 6 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.129 0.791 18517 7336 1 6 . 1 1 216 216 LEU CB C 284 42.500 42.500 41.908 0.592 18517 7337 1 6 . 1 1 216 216 LEU H H 284 7.460 7.460 8.130 -0.670 18517 7338 1 6 . 1 1 217 217 LEU N N 285 116.470 116.470 121.392 -4.922 18517 7339 1 6 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.876 -0.196 18517 7340 1 6 . 1 1 217 217 LEU C C 285 178.310 178.310 177.040 1.270 18517 7341 1 6 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.634 -0.194 18517 7342 1 6 . 1 1 217 217 LEU CB C 285 43.050 43.050 42.054 0.996 18517 7343 1 6 . 1 1 217 217 LEU H H 285 6.980 6.980 7.968 -0.988 18517 7344 1 6 . 1 1 218 218 TYR N N 286 111.080 111.080 112.431 -1.351 18517 7345 1 6 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.627 0.273 18517 7346 1 6 . 1 1 218 218 TYR C C 286 176.090 176.090 175.563 0.527 18517 7347 1 6 . 1 1 218 218 TYR CA C 286 56.050 56.050 57.700 -1.650 18517 7348 1 6 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.453 2.458 18517 7349 1 6 . 1 1 218 218 TYR H H 286 7.660 7.660 7.879 -0.219 18517 7350 1 6 . 1 1 219 219 GLY N N 287 108.260 108.260 108.167 0.093 18517 7351 1 6 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.499 0.820 18517 7352 1 6 . 1 1 219 219 GLY H H 287 7.750 7.750 7.649 0.101 18517 7353 1 6 . 1 1 221 221 ILE HA H 289 3.490 3.490 4.238 -0.748 18517 7354 1 6 . 1 1 221 221 ILE CA C 289 63.580 63.580 61.318 2.263 18517 7355 1 6 . 1 1 221 221 ILE CB C 289 38.280 38.280 40.412 -2.132 18517 7356 1 6 . 1 1 222 222 GLY CA C 290 45.740 45.740 45.363 0.377 18517 7357 1 7 . 1 1 2 2 LYS N N 70 126.600 126.600 121.820 4.780 18517 7358 1 7 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.232 0.128 18517 7359 1 7 . 1 1 2 2 LYS C C 70 176.000 176.000 174.630 1.370 18517 7360 1 7 . 1 1 2 2 LYS CA C 70 56.450 56.450 56.642 -0.192 18517 7361 1 7 . 1 1 2 2 LYS CB C 70 33.850 33.850 32.679 1.171 18517 7362 1 7 . 1 1 2 2 LYS H H 70 8.530 8.530 8.397 0.133 18517 7363 1 7 . 1 1 3 3 THR N N 71 111.030 111.030 115.583 -4.553 18517 7364 1 7 . 1 1 3 3 THR HA H 71 4.400 4.400 4.567 -0.167 18517 7365 1 7 . 1 1 3 3 THR C C 71 175.650 175.650 174.170 1.480 18517 7366 1 7 . 1 1 3 3 THR CA C 71 60.610 60.610 60.619 -0.009 18517 7367 1 7 . 1 1 3 3 THR CB C 71 71.520 71.520 70.481 1.040 18517 7368 1 7 . 1 1 3 3 THR H H 71 7.390 7.390 8.022 -0.632 18517 7369 1 7 . 1 1 4 4 LEU N N 72 121.560 121.560 123.021 -1.461 18517 7370 1 7 . 1 1 4 4 LEU C C 72 177.870 177.870 177.825 0.045 18517 7371 1 7 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.710 -0.230 18517 7372 1 7 . 1 1 4 4 LEU CB C 72 42.180 42.180 42.038 0.142 18517 7373 1 7 . 1 1 4 4 LEU H H 72 8.980 8.980 8.491 0.489 18517 7374 1 7 . 1 1 5 5 ASP N N 73 115.530 115.530 116.603 -1.073 18517 7375 1 7 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.400 -0.070 18517 7376 1 7 . 1 1 5 5 ASP C C 73 179.290 179.290 178.189 1.101 18517 7377 1 7 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.125 0.715 18517 7378 1 7 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.502 0.328 18517 7379 1 7 . 1 1 5 5 ASP H H 73 8.270 8.270 8.667 -0.397 18517 7380 1 7 . 1 1 6 6 VAL N N 74 122.330 122.330 120.040 2.290 18517 7381 1 7 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.690 0.050 18517 7382 1 7 . 1 1 6 6 VAL C C 74 178.970 178.970 177.607 1.363 18517 7383 1 7 . 1 1 6 6 VAL CA C 74 66.360 66.360 66.256 0.104 18517 7384 1 7 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.920 0.030 18517 7385 1 7 . 1 1 6 6 VAL H H 74 7.400 7.400 7.368 0.032 18517 7386 1 7 . 1 1 7 7 LEU N N 75 121.360 121.360 120.269 1.091 18517 7387 1 7 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.896 0.134 18517 7388 1 7 . 1 1 7 7 LEU C C 75 179.240 179.240 179.173 0.067 18517 7389 1 7 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.517 -0.288 18517 7390 1 7 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.163 1.727 18517 7391 1 7 . 1 1 7 7 LEU H H 75 8.300 8.300 8.315 -0.015 18517 7392 1 7 . 1 1 8 8 ARG N N 76 117.230 117.230 117.829 -0.599 18517 7393 1 7 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.098 -0.178 18517 7394 1 7 . 1 1 8 8 ARG C C 76 178.290 178.290 179.301 -1.011 18517 7395 1 7 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.599 1.171 18517 7396 1 7 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.840 0.369 18517 7397 1 7 . 1 1 8 8 ARG H H 76 8.520 8.520 8.408 0.112 18517 7398 1 7 . 1 1 9 9 GLY N N 77 104.570 104.570 108.276 -3.706 18517 7399 1 7 . 1 1 9 9 GLY C C 77 176.180 176.180 176.179 0.001 18517 7400 1 7 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.756 0.414 18517 7401 1 7 . 1 1 9 9 GLY H H 77 7.620 7.620 8.297 -0.677 18517 7402 1 7 . 1 1 10 10 GLU N N 78 120.270 120.270 123.181 -2.911 18517 7403 1 7 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.133 0.137 18517 7404 1 7 . 1 1 10 10 GLU C C 78 179.030 179.030 179.186 -0.156 18517 7405 1 7 . 1 1 10 10 GLU CA C 78 58.870 58.870 58.923 -0.053 18517 7406 1 7 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.179 2.221 18517 7407 1 7 . 1 1 10 10 GLU H H 78 8.100 8.100 8.276 -0.176 18517 7408 1 7 . 1 1 11 11 LEU N N 79 116.000 116.000 120.435 -4.435 18517 7409 1 7 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.978 0.532 18517 7410 1 7 . 1 1 11 11 LEU C C 79 179.630 179.630 179.100 0.530 18517 7411 1 7 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.036 -1.346 18517 7412 1 7 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.407 3.393 18517 7413 1 7 . 1 1 11 11 LEU H H 79 8.230 8.230 8.415 -0.185 18517 7414 1 7 . 1 1 12 12 ARG N N 80 120.020 120.020 119.743 0.277 18517 7415 1 7 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.981 -0.231 18517 7416 1 7 . 1 1 12 12 ARG C C 80 178.490 178.490 178.788 -0.298 18517 7417 1 7 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.151 2.849 18517 7418 1 7 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.564 1.676 18517 7419 1 7 . 1 1 12 12 ARG H H 80 8.210 8.210 8.133 0.076 18517 7420 1 7 . 1 1 13 13 GLY N N 81 108.090 108.090 107.122 0.968 18517 7421 1 7 . 1 1 13 13 GLY C C 81 173.540 173.540 176.287 -2.747 18517 7422 1 7 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.938 1.062 18517 7423 1 7 . 1 1 13 13 GLY H H 81 8.890 8.890 8.516 0.374 18517 7424 1 7 . 1 1 14 14 GLN C C 82 179.540 179.540 178.488 1.052 18517 7425 1 7 . 1 1 14 14 GLN CA C 82 58.710 58.710 59.123 -0.413 18517 7426 1 7 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.689 0.411 18517 7427 1 7 . 1 1 15 15 ARG N N 83 118.220 118.220 117.917 0.303 18517 7428 1 7 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.169 -0.219 18517 7429 1 7 . 1 1 15 15 ARG C C 83 177.710 177.710 178.634 -0.924 18517 7430 1 7 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.525 0.375 18517 7431 1 7 . 1 1 15 15 ARG CB C 83 29.650 29.650 29.827 -0.177 18517 7432 1 7 . 1 1 15 15 ARG H H 83 7.320 7.320 8.386 -1.066 18517 7433 1 7 . 1 1 16 16 GLU N N 84 118.810 118.810 121.084 -2.274 18517 7434 1 7 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.206 -0.356 18517 7435 1 7 . 1 1 16 16 GLU C C 84 178.750 178.750 178.556 0.194 18517 7436 1 7 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.372 1.638 18517 7437 1 7 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.738 -0.328 18517 7438 1 7 . 1 1 16 16 GLU H H 84 8.450 8.450 8.544 -0.094 18517 7439 1 7 . 1 1 17 17 ALA N N 85 122.790 122.790 122.525 0.265 18517 7440 1 7 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.135 0.055 18517 7441 1 7 . 1 1 17 17 ALA C C 85 180.360 180.360 179.650 0.710 18517 7442 1 7 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.081 0.378 18517 7443 1 7 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.297 -0.218 18517 7444 1 7 . 1 1 17 17 ALA H H 85 8.420 8.420 8.229 0.191 18517 7445 1 7 . 1 1 18 18 PHE N N 86 119.400 119.400 119.982 -0.582 18517 7446 1 7 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.239 0.051 18517 7447 1 7 . 1 1 18 18 PHE C C 86 177.560 177.560 177.296 0.264 18517 7448 1 7 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.415 0.225 18517 7449 1 7 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.474 0.166 18517 7450 1 7 . 1 1 18 18 PHE H H 86 7.490 7.490 8.199 -0.709 18517 7451 1 7 . 1 1 19 19 LEU N N 87 117.470 117.470 120.078 -2.608 18517 7452 1 7 . 1 1 19 19 LEU HA H 87 4.070 4.070 4.009 0.061 18517 7453 1 7 . 1 1 19 19 LEU C C 87 178.880 178.880 178.456 0.424 18517 7454 1 7 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.261 -0.301 18517 7455 1 7 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.679 0.421 18517 7456 1 7 . 1 1 19 19 LEU H H 87 8.010 8.010 8.864 -0.854 18517 7457 1 7 . 1 1 20 20 SER N N 88 113.770 113.770 115.155 -1.385 18517 7458 1 7 . 1 1 20 20 SER HA H 88 4.070 4.070 4.099 -0.029 18517 7459 1 7 . 1 1 20 20 SER C C 88 175.680 175.680 176.821 -1.141 18517 7460 1 7 . 1 1 20 20 SER CA C 88 63.070 63.070 62.511 0.559 18517 7461 1 7 . 1 1 20 20 SER H H 88 8.100 8.100 8.394 -0.294 18517 7462 1 7 . 1 1 21 21 GLU N N 89 120.570 120.570 121.243 -0.673 18517 7463 1 7 . 1 1 21 21 GLU HA H 89 3.970 3.970 3.990 -0.020 18517 7464 1 7 . 1 1 21 21 GLU C C 89 178.940 178.940 178.763 0.177 18517 7465 1 7 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.005 0.255 18517 7466 1 7 . 1 1 21 21 GLU CB C 89 29.330 29.330 28.963 0.367 18517 7467 1 7 . 1 1 21 21 GLU H H 89 7.400 7.400 7.829 -0.429 18517 7468 1 7 . 1 1 22 22 ILE N N 90 119.350 119.350 119.519 -0.169 18517 7469 1 7 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.898 -0.208 18517 7470 1 7 . 1 1 22 22 ILE C C 90 177.230 177.230 178.375 -1.145 18517 7471 1 7 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.699 0.771 18517 7472 1 7 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.476 -0.086 18517 7473 1 7 . 1 1 22 22 ILE H H 90 7.250 7.250 7.991 -0.741 18517 7474 1 7 . 1 1 23 23 ILE N N 91 116.350 116.350 119.557 -3.207 18517 7475 1 7 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.836 -0.436 18517 7476 1 7 . 1 1 23 23 ILE C C 91 176.690 176.690 177.368 -0.678 18517 7477 1 7 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.173 2.557 18517 7478 1 7 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.359 0.411 18517 7479 1 7 . 1 1 23 23 ILE H H 91 7.860 7.860 8.195 -0.335 18517 7480 1 7 . 1 1 24 24 LYS N N 92 116.000 116.000 118.754 -2.754 18517 7481 1 7 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.194 -0.054 18517 7482 1 7 . 1 1 24 24 LYS C C 92 176.270 176.270 177.125 -0.855 18517 7483 1 7 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.919 -0.439 18517 7484 1 7 . 1 1 24 24 LYS CB C 92 33.300 33.300 33.313 -0.013 18517 7485 1 7 . 1 1 24 24 LYS H H 92 7.170 7.170 7.807 -0.637 18517 7486 1 7 . 1 1 25 25 SER N N 93 114.650 114.650 115.384 -0.734 18517 7487 1 7 . 1 1 25 25 SER HA H 93 4.550 4.550 4.351 0.199 18517 7488 1 7 . 1 1 25 25 SER C C 93 173.370 173.370 173.294 0.076 18517 7489 1 7 . 1 1 25 25 SER CA C 93 57.240 57.240 59.724 -2.484 18517 7490 1 7 . 1 1 25 25 SER CB C 93 65.650 65.650 63.560 2.090 18517 7491 1 7 . 1 1 25 25 SER H H 93 7.730 7.730 7.840 -0.110 18517 7492 1 7 . 1 1 26 26 ASP N N 94 121.230 121.230 125.664 -4.434 18517 7493 1 7 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.720 0.210 18517 7494 1 7 . 1 1 26 26 ASP C C 94 176.560 176.560 175.685 0.875 18517 7495 1 7 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.186 1.324 18517 7496 1 7 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.630 1.020 18517 7497 1 7 . 1 1 26 26 ASP H H 94 8.280 8.280 8.347 -0.067 18517 7498 1 7 . 1 1 27 27 GLY N N 95 109.310 109.310 108.052 1.258 18517 7499 1 7 . 1 1 27 27 GLY C C 95 171.080 171.080 171.622 -0.542 18517 7500 1 7 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.124 -0.354 18517 7501 1 7 . 1 1 27 27 GLY H H 95 8.160 8.160 7.623 0.537 18517 7502 1 7 . 1 1 29 29 PHE HA H 97 5.140 5.140 5.047 0.093 18517 7503 1 7 . 1 1 29 29 PHE C C 97 175.230 175.230 175.937 -0.707 18517 7504 1 7 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.002 0.489 18517 7505 1 7 . 1 1 29 29 PHE CB C 97 41.620 41.620 42.368 -0.748 18517 7506 1 7 . 1 1 30 30 THR N N 98 112.600 112.600 113.549 -0.949 18517 7507 1 7 . 1 1 30 30 THR HA H 98 4.570 4.570 4.144 0.426 18517 7508 1 7 . 1 1 30 30 THR C C 98 176.690 176.690 174.822 1.868 18517 7509 1 7 . 1 1 30 30 THR CA C 98 60.290 60.290 59.581 0.709 18517 7510 1 7 . 1 1 30 30 THR CB C 98 71.600 71.600 71.001 0.599 18517 7511 1 7 . 1 1 30 30 THR H H 98 8.990 8.990 8.814 0.176 18517 7512 1 7 . 1 1 31 31 ILE N N 99 119.240 119.240 122.209 -2.969 18517 7513 1 7 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.671 0.149 18517 7514 1 7 . 1 1 31 31 ILE C C 99 176.090 176.090 176.750 -0.660 18517 7515 1 7 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.740 -3.600 18517 7516 1 7 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.916 -0.966 18517 7517 1 7 . 1 1 31 31 ILE H H 99 9.230 9.230 7.859 1.371 18517 7518 1 7 . 1 1 32 32 LEU N N 100 119.660 119.660 118.070 1.590 18517 7519 1 7 . 1 1 32 32 LEU HA H 100 4.030 4.030 3.910 0.120 18517 7520 1 7 . 1 1 32 32 LEU C C 100 181.050 181.050 179.078 1.972 18517 7521 1 7 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.609 -0.049 18517 7522 1 7 . 1 1 32 32 LEU CB C 100 40.120 40.120 40.163 -0.043 18517 7523 1 7 . 1 1 32 32 LEU H H 100 7.310 7.310 8.119 -0.809 18517 7524 1 7 . 1 1 33 33 GLN N N 101 121.450 121.450 119.383 2.067 18517 7525 1 7 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.327 -0.077 18517 7526 1 7 . 1 1 33 33 GLN CA C 101 59.700 59.700 59.214 0.486 18517 7527 1 7 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.958 2.832 18517 7528 1 7 . 1 1 33 33 GLN H H 101 7.790 7.790 7.638 0.152 18517 7529 1 7 . 1 1 34 34 LEU C C 102 178.590 178.590 178.849 -0.259 18517 7530 1 7 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.013 0.617 18517 7531 1 7 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.706 -0.396 18517 7532 1 7 . 1 1 35 35 VAL N N 103 118.520 118.520 118.098 0.422 18517 7533 1 7 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.517 -0.097 18517 7534 1 7 . 1 1 35 35 VAL C C 103 177.930 177.930 178.120 -0.190 18517 7535 1 7 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.368 -0.328 18517 7536 1 7 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.873 0.757 18517 7537 1 7 . 1 1 35 35 VAL H H 103 8.670 8.670 8.455 0.215 18517 7538 1 7 . 1 1 36 36 GLY N N 104 109.430 109.430 108.586 0.844 18517 7539 1 7 . 1 1 36 36 GLY C C 104 174.600 174.600 175.550 -0.950 18517 7540 1 7 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.111 0.929 18517 7541 1 7 . 1 1 36 36 GLY H H 104 7.880 7.880 8.230 -0.350 18517 7542 1 7 . 1 1 37 37 TYR N N 105 122.270 122.270 124.226 -1.956 18517 7543 1 7 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.447 -0.567 18517 7544 1 7 . 1 1 37 37 TYR C C 105 176.310 176.310 177.108 -0.798 18517 7545 1 7 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.242 3.858 18517 7546 1 7 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.685 -0.315 18517 7547 1 7 . 1 1 37 37 TYR H H 105 8.170 8.170 8.278 -0.108 18517 7548 1 7 . 1 1 38 38 LEU N N 106 120.100 120.100 120.695 -0.595 18517 7549 1 7 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.690 0.050 18517 7550 1 7 . 1 1 38 38 LEU C C 106 178.280 178.280 178.709 -0.429 18517 7551 1 7 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.178 0.452 18517 7552 1 7 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.724 1.006 18517 7553 1 7 . 1 1 38 38 LEU H H 106 7.610 7.610 8.574 -0.964 18517 7554 1 7 . 1 1 39 39 ARG N N 107 116.670 116.670 118.084 -1.414 18517 7555 1 7 . 1 1 39 39 ARG HA H 107 3.680 3.680 3.916 -0.236 18517 7556 1 7 . 1 1 39 39 ARG C C 107 179.480 179.480 178.765 0.715 18517 7557 1 7 . 1 1 39 39 ARG CA C 107 59.580 59.580 58.950 0.630 18517 7558 1 7 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.649 1.591 18517 7559 1 7 . 1 1 39 39 ARG H H 107 8.240 8.240 8.021 0.219 18517 7560 1 7 . 1 1 40 40 VAL N N 108 121.970 121.970 119.647 2.323 18517 7561 1 7 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.646 -0.246 18517 7562 1 7 . 1 1 40 40 VAL C C 108 178.440 178.440 178.034 0.406 18517 7563 1 7 . 1 1 40 40 VAL CA C 108 67.950 67.950 67.231 0.719 18517 7564 1 7 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.404 -0.964 18517 7565 1 7 . 1 1 40 40 VAL H H 108 8.200 8.200 8.038 0.162 18517 7566 1 7 . 1 1 41 41 VAL N N 109 108.940 108.940 116.658 -7.718 18517 7567 1 7 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.542 0.698 18517 7568 1 7 . 1 1 41 41 VAL C C 109 175.070 175.070 177.882 -2.812 18517 7569 1 7 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.640 -3.050 18517 7570 1 7 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.381 -0.731 18517 7571 1 7 . 1 1 41 41 VAL H H 109 7.760 7.760 7.908 -0.148 18517 7572 1 7 . 1 1 42 42 ASP N N 110 124.670 124.670 120.916 3.754 18517 7573 1 7 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.319 0.301 18517 7574 1 7 . 1 1 42 42 ASP C C 110 177.310 177.310 178.295 -0.985 18517 7575 1 7 . 1 1 42 42 ASP CA C 110 59.980 59.980 57.783 2.197 18517 7576 1 7 . 1 1 42 42 ASP CB C 110 44.950 44.950 41.162 3.788 18517 7577 1 7 . 1 1 42 42 ASP H H 110 7.360 7.360 8.449 -1.089 18517 7578 1 7 . 1 1 43 43 THR N N 111 102.340 102.340 113.313 -10.973 18517 7579 1 7 . 1 1 43 43 THR HA H 111 5.100 5.100 4.134 0.966 18517 7580 1 7 . 1 1 43 43 THR C C 111 174.940 174.940 176.719 -1.779 18517 7581 1 7 . 1 1 43 43 THR CA C 111 60.650 60.650 66.322 -5.672 18517 7582 1 7 . 1 1 43 43 THR CB C 111 69.610 69.610 68.442 1.168 18517 7583 1 7 . 1 1 43 43 THR H H 111 6.380 6.380 7.917 -1.537 18517 7584 1 7 . 1 1 44 44 ASP N N 112 119.750 119.750 123.402 -3.652 18517 7585 1 7 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.441 -0.581 18517 7586 1 7 . 1 1 44 44 ASP C C 112 178.850 178.850 178.232 0.618 18517 7587 1 7 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.707 0.523 18517 7588 1 7 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.521 -1.121 18517 7589 1 7 . 1 1 44 44 ASP H H 112 9.050 9.050 8.494 0.556 18517 7590 1 7 . 1 1 45 45 LEU N N 113 123.910 123.910 121.836 2.074 18517 7591 1 7 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.931 -0.121 18517 7592 1 7 . 1 1 45 45 LEU C C 113 182.040 182.040 178.655 3.385 18517 7593 1 7 . 1 1 45 45 LEU CA C 113 57.320 57.320 58.149 -0.829 18517 7594 1 7 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.778 -1.028 18517 7595 1 7 . 1 1 45 45 LEU H H 113 9.710 9.710 7.974 1.736 18517 7596 1 7 . 1 1 46 46 LEU N N 114 117.640 117.640 117.566 0.074 18517 7597 1 7 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.147 -0.037 18517 7598 1 7 . 1 1 46 46 LEU C C 114 179.540 179.540 178.517 1.023 18517 7599 1 7 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.412 0.148 18517 7600 1 7 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.864 -0.394 18517 7601 1 7 . 1 1 46 46 LEU H H 114 8.270 8.270 7.363 0.907 18517 7602 1 7 . 1 1 47 47 LEU N N 115 116.520 116.520 116.323 0.197 18517 7603 1 7 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.375 -0.235 18517 7604 1 7 . 1 1 47 47 LEU C C 115 173.850 173.850 176.397 -2.547 18517 7605 1 7 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.788 0.632 18517 7606 1 7 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.150 3.570 18517 7607 1 7 . 1 1 47 47 LEU H H 115 8.160 8.160 8.159 0.001 18517 7608 1 7 . 1 1 48 48 LYS N N 116 114.710 114.710 114.953 -0.243 18517 7609 1 7 . 1 1 48 48 LYS HA H 116 3.810 3.810 4.057 -0.247 18517 7610 1 7 . 1 1 48 48 LYS C C 116 176.510 176.510 176.054 0.456 18517 7611 1 7 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.849 0.351 18517 7612 1 7 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.316 -0.296 18517 7613 1 7 . 1 1 48 48 LYS H H 116 7.580 7.580 7.855 -0.275 18517 7614 1 7 . 1 1 49 49 VAL N N 117 119.050 119.050 118.040 1.010 18517 7615 1 7 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.036 -0.426 18517 7616 1 7 . 1 1 49 49 VAL C C 117 175.860 175.860 176.471 -0.611 18517 7617 1 7 . 1 1 49 49 VAL CA C 117 63.510 63.510 61.684 1.826 18517 7618 1 7 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.388 -0.038 18517 7619 1 7 . 1 1 49 49 VAL H H 117 7.980 7.980 8.112 -0.132 18517 7620 1 7 . 1 1 50 50 ASP N N 118 126.900 126.900 121.943 4.957 18517 7621 1 7 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.432 -0.182 18517 7622 1 7 . 1 1 50 50 ASP C C 118 177.700 177.700 177.238 0.462 18517 7623 1 7 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.568 0.482 18517 7624 1 7 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.676 0.904 18517 7625 1 7 . 1 1 50 50 ASP H H 118 8.930 8.930 8.592 0.338 18517 7626 1 7 . 1 1 51 51 SER N N 119 124.790 124.790 122.003 2.787 18517 7627 1 7 . 1 1 51 51 SER HA H 119 4.070 4.070 4.216 -0.146 18517 7628 1 7 . 1 1 51 51 SER C C 119 177.220 177.220 176.190 1.030 18517 7629 1 7 . 1 1 51 51 SER CA C 119 61.640 61.640 60.846 0.794 18517 7630 1 7 . 1 1 51 51 SER CB C 119 63.510 63.510 63.516 -0.006 18517 7631 1 7 . 1 1 51 51 SER H H 119 8.560 8.560 8.885 -0.325 18517 7632 1 7 . 1 1 52 52 THR N N 120 119.880 119.880 116.005 3.875 18517 7633 1 7 . 1 1 52 52 THR HA H 120 4.190 4.190 4.183 0.007 18517 7634 1 7 . 1 1 52 52 THR C C 120 177.120 177.120 176.482 0.638 18517 7635 1 7 . 1 1 52 52 THR CA C 120 66.280 66.280 65.639 0.641 18517 7636 1 7 . 1 1 52 52 THR CB C 120 68.420 68.420 68.347 0.073 18517 7637 1 7 . 1 1 52 52 THR H H 120 8.310 8.310 8.066 0.244 18517 7638 1 7 . 1 1 53 53 LYS N N 121 122.270 122.270 122.568 -0.298 18517 7639 1 7 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.163 -0.043 18517 7640 1 7 . 1 1 53 53 LYS C C 121 178.970 178.970 179.159 -0.189 18517 7641 1 7 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.059 0.521 18517 7642 1 7 . 1 1 53 53 LYS CB C 121 34.250 34.250 31.934 2.316 18517 7643 1 7 . 1 1 53 53 LYS H H 121 7.700 7.700 9.132 -1.432 18517 7644 1 7 . 1 1 54 54 VAL N N 122 120.070 120.070 115.984 4.086 18517 7645 1 7 . 1 1 54 54 VAL HA H 122 3.430 3.430 4.071 -0.641 18517 7646 1 7 . 1 1 54 54 VAL C C 122 179.860 179.860 178.278 1.582 18517 7647 1 7 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.544 3.036 18517 7648 1 7 . 1 1 54 54 VAL CB C 122 32.820 32.820 30.839 1.981 18517 7649 1 7 . 1 1 54 54 VAL H H 122 7.890 7.890 8.045 -0.155 18517 7650 1 7 . 1 1 55 55 ASP N N 123 122.270 122.270 121.205 1.065 18517 7651 1 7 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.387 0.083 18517 7652 1 7 . 1 1 55 55 ASP C C 123 178.630 178.630 178.368 0.262 18517 7653 1 7 . 1 1 55 55 ASP CA C 123 57.800 57.800 58.079 -0.279 18517 7654 1 7 . 1 1 55 55 ASP CB C 123 42.020 42.020 41.192 0.828 18517 7655 1 7 . 1 1 55 55 ASP H H 123 8.270 8.270 8.234 0.036 18517 7656 1 7 . 1 1 56 56 GLU N N 124 119.600 119.600 119.583 0.017 18517 7657 1 7 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.061 -0.091 18517 7658 1 7 . 1 1 56 56 GLU C C 124 179.920 179.920 178.997 0.923 18517 7659 1 7 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.129 0.931 18517 7660 1 7 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.366 0.604 18517 7661 1 7 . 1 1 56 56 GLU H H 124 8.610 8.610 8.457 0.153 18517 7662 1 7 . 1 1 57 57 ALA N N 125 120.070 120.070 121.437 -1.367 18517 7663 1 7 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.101 -0.271 18517 7664 1 7 . 1 1 57 57 ALA C C 125 178.760 178.760 179.540 -0.780 18517 7665 1 7 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.849 0.531 18517 7666 1 7 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.350 1.790 18517 7667 1 7 . 1 1 57 57 ALA H H 125 8.420 8.420 8.349 0.071 18517 7668 1 7 . 1 1 58 58 GLY N N 126 106.740 106.740 106.449 0.291 18517 7669 1 7 . 1 1 58 58 GLY C C 126 175.740 175.740 176.203 -0.463 18517 7670 1 7 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.927 0.363 18517 7671 1 7 . 1 1 58 58 GLY H H 126 8.200 8.200 8.289 -0.089 18517 7672 1 7 . 1 1 59 59 LYS N N 127 120.920 120.920 122.009 -1.089 18517 7673 1 7 . 1 1 59 59 LYS HA H 127 3.930 3.930 3.920 0.011 18517 7674 1 7 . 1 1 59 59 LYS C C 127 180.320 180.320 179.016 1.304 18517 7675 1 7 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.868 0.342 18517 7676 1 7 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.330 0.650 18517 7677 1 7 . 1 1 59 59 LYS H H 127 8.000 8.000 8.229 -0.229 18517 7678 1 7 . 1 1 60 60 LYS N N 128 118.400 118.400 119.445 -1.045 18517 7679 1 7 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.104 0.066 18517 7680 1 7 . 1 1 60 60 LYS C C 128 180.030 180.030 178.983 1.047 18517 7681 1 7 . 1 1 60 60 LYS CA C 128 58.750 58.750 59.725 -0.975 18517 7682 1 7 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.362 -0.092 18517 7683 1 7 . 1 1 60 60 LYS H H 128 7.170 7.170 7.895 -0.725 18517 7684 1 7 . 1 1 61 61 VAL N N 129 121.050 121.050 120.583 0.467 18517 7685 1 7 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.398 -0.118 18517 7686 1 7 . 1 1 61 61 VAL C C 129 177.120 177.120 177.770 -0.650 18517 7687 1 7 . 1 1 61 61 VAL CA C 129 67.350 67.350 66.874 0.476 18517 7688 1 7 . 1 1 61 61 VAL CB C 129 31.630 31.630 30.980 0.650 18517 7689 1 7 . 1 1 61 61 VAL H H 129 7.980 7.980 8.062 -0.082 18517 7690 1 7 . 1 1 62 62 LYS N N 130 120.040 120.040 119.719 0.321 18517 7691 1 7 . 1 1 62 62 LYS HA H 130 3.700 3.700 4.005 -0.305 18517 7692 1 7 . 1 1 62 62 LYS C C 130 178.550 178.550 178.955 -0.405 18517 7693 1 7 . 1 1 62 62 LYS CA C 130 60.330 60.330 59.630 0.700 18517 7694 1 7 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.337 1.433 18517 7695 1 7 . 1 1 62 62 LYS H H 130 8.910 8.910 8.466 0.444 18517 7696 1 7 . 1 1 63 63 ALA N N 131 119.570 119.570 122.854 -3.284 18517 7697 1 7 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.048 0.172 18517 7698 1 7 . 1 1 63 63 ALA C C 131 180.520 180.520 179.183 1.337 18517 7699 1 7 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.229 -0.009 18517 7700 1 7 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.015 0.455 18517 7701 1 7 . 1 1 63 63 ALA H H 131 7.920 7.920 8.375 -0.455 18517 7702 1 7 . 1 1 64 64 TYR N N 132 120.510 120.510 120.342 0.168 18517 7703 1 7 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.159 0.301 18517 7704 1 7 . 1 1 64 64 TYR C C 132 176.510 176.510 177.793 -1.283 18517 7705 1 7 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.715 -0.076 18517 7706 1 7 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.484 0.205 18517 7707 1 7 . 1 1 64 64 TYR H H 132 7.930 7.930 8.218 -0.288 18517 7708 1 7 . 1 1 65 65 LEU N N 133 117.290 117.290 118.163 -0.873 18517 7709 1 7 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.522 0.318 18517 7710 1 7 . 1 1 65 65 LEU C C 133 178.610 178.610 179.233 -0.623 18517 7711 1 7 . 1 1 65 65 LEU CA C 133 57.720 57.720 57.840 -0.119 18517 7712 1 7 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.655 -1.225 18517 7713 1 7 . 1 1 65 65 LEU H H 133 8.240 8.240 8.383 -0.143 18517 7714 1 7 . 1 1 66 66 GLU N N 134 119.140 119.140 118.282 0.858 18517 7715 1 7 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.200 -0.340 18517 7716 1 7 . 1 1 66 66 GLU C C 134 180.200 180.200 179.069 1.131 18517 7717 1 7 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.857 1.083 18517 7718 1 7 . 1 1 66 66 GLU CB C 134 29.810 29.810 28.978 0.832 18517 7719 1 7 . 1 1 66 66 GLU H H 134 8.370 8.370 8.744 -0.374 18517 7720 1 7 . 1 1 67 67 LYS N N 135 121.390 121.390 120.219 1.171 18517 7721 1 7 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.064 -0.064 18517 7722 1 7 . 1 1 67 67 LYS C C 135 179.080 179.080 178.634 0.446 18517 7723 1 7 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.916 0.704 18517 7724 1 7 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.508 -0.238 18517 7725 1 7 . 1 1 67 67 LYS H H 135 7.820 7.820 7.948 -0.128 18517 7726 1 7 . 1 1 68 68 ILE N N 136 110.310 110.310 112.603 -2.293 18517 7727 1 7 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.035 0.265 18517 7728 1 7 . 1 1 68 68 ILE C C 136 175.520 175.520 176.958 -1.438 18517 7729 1 7 . 1 1 68 68 ILE CA C 136 62.430 62.430 62.212 0.218 18517 7730 1 7 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.797 -0.817 18517 7731 1 7 . 1 1 68 68 ILE H H 136 7.380 7.380 7.634 -0.254 18517 7732 1 7 . 1 1 69 69 GLY N N 137 106.680 106.680 108.340 -1.660 18517 7733 1 7 . 1 1 69 69 GLY C C 137 174.160 174.160 172.658 1.502 18517 7734 1 7 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.712 0.758 18517 7735 1 7 . 1 1 69 69 GLY H H 137 7.470 7.470 8.105 -0.635 18517 7736 1 7 . 1 1 70 70 ILE N N 138 124.310 124.310 120.717 3.593 18517 7737 1 7 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.336 -0.136 18517 7738 1 7 . 1 1 70 70 ILE C C 138 174.190 174.190 174.868 -0.678 18517 7739 1 7 . 1 1 70 70 ILE CA C 138 59.380 59.380 59.125 0.255 18517 7740 1 7 . 1 1 70 70 ILE CB C 138 37.340 37.340 39.137 -1.797 18517 7741 1 7 . 1 1 70 70 ILE H H 138 8.530 8.530 8.221 0.309 18517 7742 1 7 . 1 1 71 71 ARG N N 139 125.490 125.490 125.002 0.488 18517 7743 1 7 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.595 0.025 18517 7744 1 7 . 1 1 71 71 ARG C C 139 175.750 175.750 174.706 1.044 18517 7745 1 7 . 1 1 71 71 ARG CA C 139 54.660 54.660 54.206 0.454 18517 7746 1 7 . 1 1 71 71 ARG CB C 139 33.140 33.140 34.350 -1.210 18517 7747 1 7 . 1 1 71 71 ARG H H 139 8.240 8.240 8.410 -0.170 18517 7748 1 7 . 1 1 72 72 GLY N N 140 104.750 104.750 106.520 -1.770 18517 7749 1 7 . 1 1 72 72 GLY C C 140 172.920 172.920 172.828 0.092 18517 7750 1 7 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.358 1.072 18517 7751 1 7 . 1 1 72 72 GLY H H 140 7.900 7.900 8.030 -0.130 18517 7752 1 7 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.537 -0.027 18517 7753 1 7 . 1 1 73 73 ASP C C 141 175.060 175.060 176.658 -1.598 18517 7754 1 7 . 1 1 73 73 ASP CA C 141 56.170 56.170 57.098 -0.928 18517 7755 1 7 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.710 -0.880 18517 7756 1 7 . 1 1 74 74 SER N N 142 110.240 110.240 112.813 -2.573 18517 7757 1 7 . 1 1 74 74 SER HA H 142 4.740 4.740 4.789 -0.049 18517 7758 1 7 . 1 1 74 74 SER C C 142 175.110 175.110 175.488 -0.378 18517 7759 1 7 . 1 1 74 74 SER CA C 142 55.700 55.700 55.901 -0.201 18517 7760 1 7 . 1 1 74 74 SER CB C 142 67.390 67.390 64.729 2.661 18517 7761 1 7 . 1 1 74 74 SER H H 142 7.560 7.560 7.899 -0.339 18517 7762 1 7 . 1 1 75 75 VAL N N 143 122.950 122.950 118.072 4.878 18517 7763 1 7 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.914 -0.184 18517 7764 1 7 . 1 1 75 75 VAL C C 143 176.230 176.230 177.208 -0.978 18517 7765 1 7 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.593 1.047 18517 7766 1 7 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.893 -0.653 18517 7767 1 7 . 1 1 75 75 VAL H H 143 9.470 9.470 8.959 0.511 18517 7768 1 7 . 1 1 76 76 GLU N N 144 121.390 121.390 120.667 0.723 18517 7769 1 7 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.169 -0.529 18517 7770 1 7 . 1 1 76 76 GLU C C 144 176.880 176.880 178.291 -1.411 18517 7771 1 7 . 1 1 76 76 GLU CA C 144 63.310 63.310 58.812 4.498 18517 7772 1 7 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.432 -0.362 18517 7773 1 7 . 1 1 76 76 GLU H H 144 9.640 9.640 8.577 1.063 18517 7774 1 7 . 1 1 77 77 ALA N N 145 118.770 118.770 122.504 -3.734 18517 7775 1 7 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.203 0.057 18517 7776 1 7 . 1 1 77 77 ALA C C 145 180.350 180.350 179.537 0.813 18517 7777 1 7 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.636 0.144 18517 7778 1 7 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.035 1.155 18517 7779 1 7 . 1 1 77 77 ALA H H 145 7.860 7.860 8.138 -0.278 18517 7780 1 7 . 1 1 78 78 ALA N N 146 120.920 120.920 122.295 -1.375 18517 7781 1 7 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.026 0.114 18517 7782 1 7 . 1 1 78 78 ALA C C 146 179.150 179.150 179.446 -0.296 18517 7783 1 7 . 1 1 78 78 ALA CA C 146 55.260 55.260 55.185 0.074 18517 7784 1 7 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.678 0.112 18517 7785 1 7 . 1 1 78 78 ALA H H 146 8.110 8.110 8.305 -0.195 18517 7786 1 7 . 1 1 79 79 LEU N N 147 118.810 118.810 116.455 2.355 18517 7787 1 7 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.065 -0.185 18517 7788 1 7 . 1 1 79 79 LEU C C 147 179.080 179.080 178.574 0.506 18517 7789 1 7 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.916 0.474 18517 7790 1 7 . 1 1 79 79 LEU CB C 147 42.260 42.260 41.021 1.239 18517 7791 1 7 . 1 1 79 79 LEU H H 147 8.360 8.360 8.079 0.281 18517 7792 1 7 . 1 1 80 80 ASP N N 148 121.620 121.620 120.613 1.007 18517 7793 1 7 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.254 0.266 18517 7794 1 7 . 1 1 80 80 ASP C C 148 178.800 178.800 178.095 0.705 18517 7795 1 7 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.214 0.176 18517 7796 1 7 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.900 -0.150 18517 7797 1 7 . 1 1 80 80 ASP H H 148 8.770 8.770 8.327 0.443 18517 7798 1 7 . 1 1 81 81 ASN N N 149 118.630 118.630 118.521 0.109 18517 7799 1 7 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.387 0.183 18517 7800 1 7 . 1 1 81 81 ASN C C 149 177.970 177.970 177.777 0.193 18517 7801 1 7 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.324 -0.314 18517 7802 1 7 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.809 -0.199 18517 7803 1 7 . 1 1 81 81 ASN H H 149 7.960 7.960 8.452 -0.492 18517 7804 1 7 . 1 1 82 82 LEU N N 150 120.030 120.030 118.814 1.216 18517 7805 1 7 . 1 1 82 82 LEU HA H 150 4.060 4.060 4.280 -0.220 18517 7806 1 7 . 1 1 82 82 LEU C C 150 177.790 177.790 178.641 -0.851 18517 7807 1 7 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.134 0.736 18517 7808 1 7 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.496 0.364 18517 7809 1 7 . 1 1 82 82 LEU H H 150 8.230 8.230 8.116 0.114 18517 7810 1 7 . 1 1 83 83 MET N N 151 115.820 115.820 120.038 -4.218 18517 7811 1 7 . 1 1 83 83 MET HA H 151 4.390 4.390 4.050 0.340 18517 7812 1 7 . 1 1 83 83 MET C C 151 179.760 179.760 178.868 0.892 18517 7813 1 7 . 1 1 83 83 MET CA C 151 57.400 57.400 58.200 -0.800 18517 7814 1 7 . 1 1 83 83 MET CB C 151 31.080 31.080 31.535 -0.455 18517 7815 1 7 . 1 1 83 83 MET H H 151 8.800 8.800 8.157 0.643 18517 7816 1 7 . 1 1 84 84 ILE N N 152 120.330 120.330 120.527 -0.197 18517 7817 1 7 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.659 0.181 18517 7818 1 7 . 1 1 84 84 ILE C C 152 178.660 178.660 178.432 0.228 18517 7819 1 7 . 1 1 84 84 ILE CA C 152 65.800 65.800 65.771 0.029 18517 7820 1 7 . 1 1 84 84 ILE CB C 152 38.450 38.450 37.334 1.116 18517 7821 1 7 . 1 1 84 84 ILE H H 152 8.540 8.540 8.831 -0.291 18517 7822 1 7 . 1 1 85 85 LYS N N 153 118.930 118.930 119.698 -0.768 18517 7823 1 7 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.022 0.178 18517 7824 1 7 . 1 1 85 85 LYS C C 153 179.650 179.650 179.362 0.288 18517 7825 1 7 . 1 1 85 85 LYS CA C 153 59.980 59.980 59.080 0.900 18517 7826 1 7 . 1 1 85 85 LYS CB C 153 33.540 33.540 31.911 1.629 18517 7827 1 7 . 1 1 85 85 LYS H H 153 7.510 7.510 7.954 -0.444 18517 7828 1 7 . 1 1 86 86 VAL N N 154 119.810 119.810 119.698 0.112 18517 7829 1 7 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.564 0.066 18517 7830 1 7 . 1 1 86 86 VAL C C 154 178.350 178.350 178.577 -0.227 18517 7831 1 7 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.683 0.547 18517 7832 1 7 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.640 1.100 18517 7833 1 7 . 1 1 86 86 VAL H H 154 8.740 8.740 8.136 0.604 18517 7834 1 7 . 1 1 87 87 TYR N N 155 118.370 118.370 118.656 -0.286 18517 7835 1 7 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.327 -0.057 18517 7836 1 7 . 1 1 87 87 TYR C C 155 178.580 178.580 178.101 0.479 18517 7837 1 7 . 1 1 87 87 TYR CA C 155 62.910 62.910 59.576 3.334 18517 7838 1 7 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.089 0.891 18517 7839 1 7 . 1 1 87 87 TYR H H 155 8.520 8.520 8.156 0.364 18517 7840 1 7 . 1 1 88 88 GLU N N 156 119.900 119.900 120.798 -0.898 18517 7841 1 7 . 1 1 88 88 GLU HA H 156 4.180 4.180 3.989 0.191 18517 7842 1 7 . 1 1 88 88 GLU C C 156 179.270 179.270 178.552 0.718 18517 7843 1 7 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.819 -0.439 18517 7844 1 7 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.484 0.726 18517 7845 1 7 . 1 1 88 88 GLU H H 156 8.250 8.250 8.596 -0.346 18517 7846 1 7 . 1 1 89 89 ILE N N 157 119.510 119.510 117.510 2.000 18517 7847 1 7 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.964 0.116 18517 7848 1 7 . 1 1 89 89 ILE C C 157 177.890 177.890 177.958 -0.068 18517 7849 1 7 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.017 0.294 18517 7850 1 7 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.259 0.951 18517 7851 1 7 . 1 1 89 89 ILE H H 157 7.630 7.630 7.718 -0.088 18517 7852 1 7 . 1 1 90 90 THR N N 158 114.240 114.240 114.695 -0.455 18517 7853 1 7 . 1 1 90 90 THR HA H 158 4.130 4.130 4.097 0.033 18517 7854 1 7 . 1 1 90 90 THR C C 158 175.530 175.530 176.177 -0.647 18517 7855 1 7 . 1 1 90 90 THR CA C 158 64.460 64.460 65.301 -0.841 18517 7856 1 7 . 1 1 90 90 THR CB C 158 69.610 69.610 69.154 0.455 18517 7857 1 7 . 1 1 90 90 THR H H 158 7.770 7.770 8.006 -0.236 18517 7858 1 7 . 1 1 91 91 LYS N N 159 120.280 120.280 118.274 2.006 18517 7859 1 7 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.446 -0.136 18517 7860 1 7 . 1 1 91 91 LYS C C 159 177.420 177.420 177.128 0.292 18517 7861 1 7 . 1 1 91 91 LYS CA C 159 57.400 57.400 56.400 1.000 18517 7862 1 7 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.728 -0.508 18517 7863 1 7 . 1 1 91 91 LYS H H 159 7.890 7.890 8.083 -0.193 18517 7864 1 7 . 1 1 92 92 GLY N N 160 107.910 107.910 111.235 -3.325 18517 7865 1 7 . 1 1 92 92 GLY C C 160 174.430 174.430 174.366 0.064 18517 7866 1 7 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.403 0.577 18517 7867 1 7 . 1 1 92 92 GLY H H 160 7.930 7.930 8.113 -0.183 18517 7868 1 7 . 1 1 93 93 THR N N 161 113.570 113.570 116.753 -3.183 18517 7869 1 7 . 1 1 93 93 THR HA H 161 4.390 4.390 4.639 -0.249 18517 7870 1 7 . 1 1 93 93 THR C C 161 174.790 174.790 175.136 -0.346 18517 7871 1 7 . 1 1 93 93 THR CA C 161 61.960 61.960 60.332 1.628 18517 7872 1 7 . 1 1 93 93 THR CB C 161 70.010 70.010 70.956 -0.946 18517 7873 1 7 . 1 1 93 93 THR H H 161 7.970 7.970 7.951 0.019 18517 7874 1 7 . 1 1 94 94 VAL N N 162 121.980 121.980 116.049 5.931 18517 7875 1 7 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.305 -0.185 18517 7876 1 7 . 1 1 94 94 VAL C C 162 176.300 176.300 175.042 1.258 18517 7877 1 7 . 1 1 94 94 VAL CA C 162 62.830 62.830 62.597 0.233 18517 7878 1 7 . 1 1 94 94 VAL CB C 162 33.060 33.060 32.580 0.481 18517 7879 1 7 . 1 1 94 94 VAL H H 162 8.130 8.130 8.196 -0.066 18517 7880 1 7 . 1 1 95 95 GLU N N 163 124.140 124.140 122.030 2.110 18517 7881 1 7 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.600 -0.290 18517 7882 1 7 . 1 1 95 95 GLU C C 163 176.870 176.870 175.976 0.894 18517 7883 1 7 . 1 1 95 95 GLU CA C 163 57.080 57.080 56.152 0.928 18517 7884 1 7 . 1 1 95 95 GLU CB C 163 30.440 30.440 30.843 -0.404 18517 7885 1 7 . 1 1 95 95 GLU H H 163 8.490 8.490 7.963 0.527 18517 7886 1 7 . 1 1 96 96 SER N N 164 116.800 116.800 119.029 -2.229 18517 7887 1 7 . 1 1 96 96 SER HA H 164 4.430 4.430 4.506 -0.076 18517 7888 1 7 . 1 1 96 96 SER C C 164 174.940 174.940 175.168 -0.228 18517 7889 1 7 . 1 1 96 96 SER CA C 164 59.070 59.070 58.417 0.652 18517 7890 1 7 . 1 1 96 96 SER CB C 164 64.220 64.220 64.223 -0.003 18517 7891 1 7 . 1 1 96 96 SER H H 164 8.300 8.300 8.527 -0.227 18517 7892 1 7 . 1 1 97 97 SER C C 165 174.660 174.660 173.786 0.874 18517 7893 1 7 . 1 1 97 97 SER CA C 165 58.870 58.870 60.664 -1.794 18517 7894 1 7 . 1 1 97 97 SER CB C 165 64.060 64.060 62.248 1.812 18517 7895 1 7 . 1 1 98 98 ALA N N 166 125.490 125.490 122.947 2.543 18517 7896 1 7 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.133 0.217 18517 7897 1 7 . 1 1 98 98 ALA C C 166 177.780 177.780 176.787 0.993 18517 7898 1 7 . 1 1 98 98 ALA CA C 166 53.000 53.000 52.938 0.062 18517 7899 1 7 . 1 1 98 98 ALA CB C 166 19.340 19.340 18.515 0.826 18517 7900 1 7 . 1 1 98 98 ALA H H 166 8.180 8.180 7.945 0.235 18517 7901 1 7 . 1 1 99 99 GLN N N 167 118.690 118.690 121.831 -3.141 18517 7902 1 7 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.339 0.001 18517 7903 1 7 . 1 1 99 99 GLN C C 167 176.680 176.680 175.430 1.250 18517 7904 1 7 . 1 1 99 99 GLN CA C 167 56.250 56.250 55.697 0.553 18517 7905 1 7 . 1 1 99 99 GLN CB C 167 29.650 29.650 28.963 0.687 18517 7906 1 7 . 1 1 99 99 GLN H H 167 8.170 8.170 8.710 -0.540 18517 7907 1 7 . 1 1 100 100 GLY N N 168 109.670 109.670 106.987 2.683 18517 7908 1 7 . 1 1 100 100 GLY C C 168 174.460 174.460 173.601 0.859 18517 7909 1 7 . 1 1 100 100 GLY CA C 168 45.670 45.670 44.282 1.388 18517 7910 1 7 . 1 1 100 100 GLY H H 168 8.250 8.250 7.442 0.808 18517 7911 1 7 . 1 1 101 101 THR N N 169 112.660 112.660 118.441 -5.781 18517 7912 1 7 . 1 1 101 101 THR HA H 169 4.360 4.360 4.533 -0.173 18517 7913 1 7 . 1 1 101 101 THR C C 169 174.720 174.720 173.932 0.788 18517 7914 1 7 . 1 1 101 101 THR CA C 169 62.080 62.080 61.047 1.033 18517 7915 1 7 . 1 1 101 101 THR CB C 169 69.930 69.930 69.573 0.357 18517 7916 1 7 . 1 1 101 101 THR H H 169 8.070 8.070 8.262 -0.192 18517 7917 1 7 . 1 1 102 102 ASP N N 170 123.090 123.090 125.256 -2.166 18517 7918 1 7 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.650 0.050 18517 7919 1 7 . 1 1 102 102 ASP C C 170 176.130 176.130 175.232 0.898 18517 7920 1 7 . 1 1 102 102 ASP CA C 170 54.780 54.780 53.296 1.484 18517 7921 1 7 . 1 1 102 102 ASP CB C 170 42.260 42.260 41.833 0.427 18517 7922 1 7 . 1 1 102 102 ASP H H 170 8.170 8.170 8.318 -0.148 18517 7923 1 7 . 1 1 103 103 SER N N 171 117.110 117.110 112.075 5.035 18517 7924 1 7 . 1 1 103 103 SER HA H 171 4.430 4.430 4.570 -0.140 18517 7925 1 7 . 1 1 103 103 SER C C 171 174.770 174.770 173.981 0.789 18517 7926 1 7 . 1 1 103 103 SER CA C 171 57.960 57.960 57.343 0.617 18517 7927 1 7 . 1 1 103 103 SER CB C 171 64.940 64.940 65.467 -0.527 18517 7928 1 7 . 1 1 103 103 SER H H 171 8.450 8.450 7.898 0.552 18517 7929 1 7 . 1 1 104 104 GLU N N 172 122.970 122.970 123.622 -0.652 18517 7930 1 7 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.999 0.031 18517 7931 1 7 . 1 1 104 104 GLU C C 172 178.860 178.860 178.104 0.756 18517 7932 1 7 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.015 -0.315 18517 7933 1 7 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.725 -0.075 18517 7934 1 7 . 1 1 104 104 GLU H H 172 8.830 8.830 9.016 -0.186 18517 7935 1 7 . 1 1 105 105 GLU N N 173 119.750 119.750 119.739 0.011 18517 7936 1 7 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.095 -0.115 18517 7937 1 7 . 1 1 105 105 GLU C C 173 178.920 178.920 178.767 0.153 18517 7938 1 7 . 1 1 105 105 GLU CA C 173 60.060 60.060 58.829 1.231 18517 7939 1 7 . 1 1 105 105 GLU CB C 173 29.730 29.730 29.271 0.459 18517 7940 1 7 . 1 1 105 105 GLU H H 173 8.580 8.580 8.314 0.266 18517 7941 1 7 . 1 1 106 106 LEU N N 174 121.860 121.860 119.563 2.297 18517 7942 1 7 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.056 0.124 18517 7943 1 7 . 1 1 106 106 LEU C C 174 178.210 178.210 178.653 -0.443 18517 7944 1 7 . 1 1 106 106 LEU CA C 174 57.880 57.880 56.853 1.027 18517 7945 1 7 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.757 -0.607 18517 7946 1 7 . 1 1 106 106 LEU H H 174 7.920 7.920 7.707 0.213 18517 7947 1 7 . 1 1 107 107 LYS N N 175 118.740 118.740 120.572 -1.832 18517 7948 1 7 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.790 -0.010 18517 7949 1 7 . 1 1 107 107 LYS C C 175 178.700 178.700 178.848 -0.148 18517 7950 1 7 . 1 1 107 107 LYS CA C 175 61.170 61.170 60.467 0.703 18517 7951 1 7 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.331 0.098 18517 7952 1 7 . 1 1 107 107 LYS H H 175 8.340 8.340 8.622 -0.282 18517 7953 1 7 . 1 1 108 108 THR N N 176 113.820 113.820 115.767 -1.947 18517 7954 1 7 . 1 1 108 108 THR HA H 176 3.840 3.840 4.048 -0.208 18517 7955 1 7 . 1 1 108 108 THR C C 176 176.620 176.620 176.215 0.405 18517 7956 1 7 . 1 1 108 108 THR CA C 176 66.910 66.910 66.665 0.245 18517 7957 1 7 . 1 1 108 108 THR CB C 176 69.610 69.610 68.624 0.986 18517 7958 1 7 . 1 1 108 108 THR H H 176 7.950 7.950 8.495 -0.545 18517 7959 1 7 . 1 1 109 109 LEU N N 177 124.380 124.380 122.913 1.467 18517 7960 1 7 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.215 -0.385 18517 7961 1 7 . 1 1 109 109 LEU C C 177 177.790 177.790 178.048 -0.258 18517 7962 1 7 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.559 0.431 18517 7963 1 7 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.515 1.065 18517 7964 1 7 . 1 1 109 109 LEU H H 177 7.480 7.480 7.763 -0.283 18517 7965 1 7 . 1 1 110 110 LEU N N 178 117.230 117.230 119.666 -2.436 18517 7966 1 7 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.791 0.049 18517 7967 1 7 . 1 1 110 110 LEU C C 178 179.540 179.540 179.162 0.378 18517 7968 1 7 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.918 0.472 18517 7969 1 7 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.276 1.064 18517 7970 1 7 . 1 1 110 110 LEU H H 178 8.670 8.670 7.958 0.712 18517 7971 1 7 . 1 1 111 111 LEU N N 179 119.230 119.230 120.460 -1.230 18517 7972 1 7 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.375 -0.295 18517 7973 1 7 . 1 1 111 111 LEU C C 179 179.310 179.310 179.680 -0.370 18517 7974 1 7 . 1 1 111 111 LEU CA C 179 58.390 58.390 56.856 1.534 18517 7975 1 7 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.659 1.361 18517 7976 1 7 . 1 1 111 111 LEU H H 179 7.940 7.940 8.297 -0.357 18517 7977 1 7 . 1 1 112 112 LYS N N 180 121.910 121.910 121.120 0.790 18517 7978 1 7 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.157 0.033 18517 7979 1 7 . 1 1 112 112 LYS C C 180 178.740 178.740 179.446 -0.706 18517 7980 1 7 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.794 -0.614 18517 7981 1 7 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.454 -0.584 18517 7982 1 7 . 1 1 112 112 LYS H H 180 7.420 7.420 8.150 -0.730 18517 7983 1 7 . 1 1 113 113 PHE N N 181 118.220 118.220 120.220 -2.000 18517 7984 1 7 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.241 0.509 18517 7985 1 7 . 1 1 113 113 PHE C C 181 178.520 178.520 177.800 0.720 18517 7986 1 7 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.625 -3.545 18517 7987 1 7 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.501 -0.520 18517 7988 1 7 . 1 1 113 113 PHE H H 181 9.000 9.000 8.795 0.205 18517 7989 1 7 . 1 1 114 114 SER N N 182 113.300 113.300 114.716 -1.416 18517 7990 1 7 . 1 1 114 114 SER HA H 182 3.930 3.930 4.067 -0.137 18517 7991 1 7 . 1 1 114 114 SER C C 182 177.080 177.080 176.700 0.380 18517 7992 1 7 . 1 1 114 114 SER CA C 182 62.000 62.000 62.506 -0.506 18517 7993 1 7 . 1 1 114 114 SER CB C 182 63.510 63.510 62.670 0.840 18517 7994 1 7 . 1 1 114 114 SER H H 182 8.620 8.620 8.770 -0.150 18517 7995 1 7 . 1 1 115 115 GLU N N 183 121.540 121.540 123.125 -1.585 18517 7996 1 7 . 1 1 115 115 GLU HA H 183 4.070 4.070 3.964 0.106 18517 7997 1 7 . 1 1 115 115 GLU C C 183 179.860 179.860 178.424 1.436 18517 7998 1 7 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.556 0.224 18517 7999 1 7 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.595 0.295 18517 8000 1 7 . 1 1 115 115 GLU H H 183 8.250 8.250 8.251 -0.001 18517 8001 1 7 . 1 1 116 116 ASP N N 184 121.740 121.740 120.816 0.924 18517 8002 1 7 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.373 0.137 18517 8003 1 7 . 1 1 116 116 ASP C C 184 179.570 179.570 178.525 1.045 18517 8004 1 7 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.795 -0.235 18517 8005 1 7 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.926 0.064 18517 8006 1 7 . 1 1 116 116 ASP H H 184 8.840 8.840 8.373 0.467 18517 8007 1 7 . 1 1 117 117 LEU N N 185 121.420 121.420 121.005 0.415 18517 8008 1 7 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.031 0.099 18517 8009 1 7 . 1 1 117 117 LEU C C 185 178.840 178.840 178.335 0.505 18517 8010 1 7 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.166 0.064 18517 8011 1 7 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.980 0.670 18517 8012 1 7 . 1 1 117 117 LEU H H 185 8.350 8.350 8.367 -0.017 18517 8013 1 7 . 1 1 118 118 LYS N N 186 119.640 119.640 119.213 0.427 18517 8014 1 7 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.865 0.255 18517 8015 1 7 . 1 1 118 118 LYS C C 186 178.820 178.820 178.644 0.176 18517 8016 1 7 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.847 -0.107 18517 8017 1 7 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.411 0.099 18517 8018 1 7 . 1 1 118 118 LYS H H 186 8.220 8.220 8.315 -0.095 18517 8019 1 7 . 1 1 119 119 ALA N N 187 120.160 120.160 121.486 -1.326 18517 8020 1 7 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.111 0.049 18517 8021 1 7 . 1 1 119 119 ALA C C 187 180.450 180.450 180.010 0.440 18517 8022 1 7 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.160 -0.020 18517 8023 1 7 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.324 0.146 18517 8024 1 7 . 1 1 119 119 ALA H H 187 8.010 8.010 8.325 -0.315 18517 8025 1 7 . 1 1 120 120 GLU N N 188 117.930 117.930 118.213 -0.283 18517 8026 1 7 . 1 1 120 120 GLU HA H 188 4.180 4.180 4.050 0.130 18517 8027 1 7 . 1 1 120 120 GLU C C 188 178.780 178.780 179.308 -0.528 18517 8028 1 7 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.023 -0.193 18517 8029 1 7 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.155 0.815 18517 8030 1 7 . 1 1 120 120 GLU H H 188 7.640 7.640 8.179 -0.539 18517 8031 1 7 . 1 1 121 121 GLN N N 189 117.230 117.230 119.559 -2.329 18517 8032 1 7 . 1 1 121 121 GLN HA H 189 4.230 4.230 3.940 0.290 18517 8033 1 7 . 1 1 121 121 GLN C C 189 179.190 179.190 178.119 1.071 18517 8034 1 7 . 1 1 121 121 GLN CA C 189 59.740 59.740 59.304 0.436 18517 8035 1 7 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.775 0.875 18517 8036 1 7 . 1 1 121 121 GLN H H 189 8.280 8.280 8.427 -0.147 18517 8037 1 7 . 1 1 122 122 GLU N N 190 118.340 118.340 119.574 -1.234 18517 8038 1 7 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.876 0.244 18517 8039 1 7 . 1 1 122 122 GLU C C 190 178.210 178.210 178.919 -0.709 18517 8040 1 7 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.839 -0.089 18517 8041 1 7 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.148 0.821 18517 8042 1 7 . 1 1 122 122 GLU H H 190 8.250 8.250 8.061 0.189 18517 8043 1 7 . 1 1 123 123 LEU N N 191 118.930 118.930 122.007 -3.077 18517 8044 1 7 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.830 0.260 18517 8045 1 7 . 1 1 123 123 LEU C C 191 178.500 178.500 178.463 0.037 18517 8046 1 7 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.335 -1.335 18517 8047 1 7 . 1 1 123 123 LEU CB C 191 42.500 42.500 42.015 0.485 18517 8048 1 7 . 1 1 123 123 LEU H H 191 7.530 7.530 8.110 -0.580 18517 8049 1 7 . 1 1 124 124 HIS N N 192 115.650 115.650 117.293 -1.643 18517 8050 1 7 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.156 0.564 18517 8051 1 7 . 1 1 124 124 HIS C C 192 176.090 176.090 177.408 -1.318 18517 8052 1 7 . 1 1 124 124 HIS CA C 192 56.690 56.690 59.664 -2.974 18517 8053 1 7 . 1 1 124 124 HIS CB C 192 30.760 30.760 30.200 0.560 18517 8054 1 7 . 1 1 124 124 HIS H H 192 7.450 7.450 8.294 -0.844 18517 8055 1 7 . 1 1 125 125 SER N N 193 115.480 115.480 115.176 0.304 18517 8056 1 7 . 1 1 125 125 SER HA H 193 4.310 4.310 3.722 0.588 18517 8057 1 7 . 1 1 125 125 SER CA C 193 60.180 60.180 61.342 -1.162 18517 8058 1 7 . 1 1 125 125 SER CB C 193 64.060 64.060 62.548 1.512 18517 8059 1 7 . 1 1 125 125 SER H H 193 8.020 8.020 8.222 -0.202 18517 8060 1 7 . 1 1 126 126 GLU C C 194 177.410 177.410 179.003 -1.593 18517 8061 1 7 . 1 1 126 126 GLU CA C 194 57.840 57.840 58.566 -0.727 18517 8062 1 7 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.480 0.410 18517 8063 1 7 . 1 1 127 127 ALA N N 195 122.910 122.910 123.023 -0.113 18517 8064 1 7 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.049 0.141 18517 8065 1 7 . 1 1 127 127 ALA C C 195 178.610 178.610 179.335 -0.725 18517 8066 1 7 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.846 -1.056 18517 8067 1 7 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.648 0.613 18517 8068 1 7 . 1 1 127 127 ALA H H 195 8.020 8.020 7.826 0.194 18517 8069 1 7 . 1 1 128 128 LYS N N 196 117.770 117.770 117.188 0.582 18517 8070 1 7 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.311 -0.051 18517 8071 1 7 . 1 1 128 128 LYS C C 196 177.400 177.400 176.239 1.161 18517 8072 1 7 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.026 2.974 18517 8073 1 7 . 1 1 128 128 LYS CB C 196 32.740 32.740 32.973 -0.233 18517 8074 1 7 . 1 1 128 128 LYS H H 196 7.990 7.990 7.806 0.184 18517 8075 1 7 . 1 1 129 129 GLY N N 197 109.010 109.010 108.247 0.763 18517 8076 1 7 . 1 1 129 129 GLY C C 197 175.770 175.770 175.394 0.376 18517 8077 1 7 . 1 1 129 129 GLY CA C 197 46.100 46.100 45.025 1.075 18517 8078 1 7 . 1 1 129 129 GLY H H 197 8.220 8.220 7.577 0.643 18517 8079 1 7 . 1 1 130 130 GLY N N 198 109.150 109.150 109.813 -0.663 18517 8080 1 7 . 1 1 130 130 GLY C C 198 174.760 174.760 175.319 -0.559 18517 8081 1 7 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.079 -0.149 18517 8082 1 7 . 1 1 130 130 GLY H H 198 8.210 8.210 8.859 -0.649 18517 8083 1 7 . 1 1 131 131 GLU N N 199 121.560 121.560 121.841 -0.281 18517 8084 1 7 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.074 -0.055 18517 8085 1 7 . 1 1 131 131 GLU C C 199 178.500 178.500 178.454 0.046 18517 8086 1 7 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.234 0.666 18517 8087 1 7 . 1 1 131 131 GLU CB C 199 29.570 29.570 29.371 0.199 18517 8088 1 7 . 1 1 131 131 GLU H H 199 8.510 8.510 8.610 -0.100 18517 8089 1 7 . 1 1 132 132 ALA N N 200 122.390 122.390 122.672 -0.282 18517 8090 1 7 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.153 0.047 18517 8091 1 7 . 1 1 132 132 ALA C C 200 180.360 180.360 179.663 0.697 18517 8092 1 7 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.828 -0.049 18517 8093 1 7 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.142 0.248 18517 8094 1 7 . 1 1 132 132 ALA H H 200 8.190 8.190 7.605 0.585 18517 8095 1 7 . 1 1 133 133 LEU N N 201 120.800 120.800 120.854 -0.054 18517 8096 1 7 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.034 0.176 18517 8097 1 7 . 1 1 133 133 LEU C C 201 179.270 179.270 178.526 0.744 18517 8098 1 7 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.967 -0.287 18517 8099 1 7 . 1 1 133 133 LEU CB C 201 42.180 42.180 42.267 -0.087 18517 8100 1 7 . 1 1 133 133 LEU H H 201 7.720 7.720 8.397 -0.677 18517 8101 1 7 . 1 1 134 134 LEU N N 202 120.680 120.680 120.203 0.477 18517 8102 1 7 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.897 0.083 18517 8103 1 7 . 1 1 134 134 LEU C C 202 179.030 179.030 178.385 0.645 18517 8104 1 7 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.927 0.503 18517 8105 1 7 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.469 0.151 18517 8106 1 7 . 1 1 134 134 LEU H H 202 8.470 8.470 8.627 -0.157 18517 8107 1 7 . 1 1 135 135 SER N N 203 113.290 113.290 113.803 -0.513 18517 8108 1 7 . 1 1 135 135 SER HA H 203 4.180 4.180 4.053 0.127 18517 8109 1 7 . 1 1 135 135 SER C C 203 177.300 177.300 176.704 0.596 18517 8110 1 7 . 1 1 135 135 SER CA C 203 62.080 62.080 61.880 0.200 18517 8111 1 7 . 1 1 135 135 SER CB C 203 63.030 63.030 62.771 0.259 18517 8112 1 7 . 1 1 135 135 SER H H 203 8.210 8.210 8.618 -0.408 18517 8113 1 7 . 1 1 136 136 SER N N 204 117.500 117.500 118.211 -0.711 18517 8114 1 7 . 1 1 136 136 SER HA H 204 4.050 4.050 4.200 -0.150 18517 8115 1 7 . 1 1 136 136 SER C C 204 177.570 177.570 176.513 1.057 18517 8116 1 7 . 1 1 136 136 SER CA C 204 61.880 61.880 62.352 -0.472 18517 8117 1 7 . 1 1 136 136 SER CB C 204 63.510 63.510 62.980 0.530 18517 8118 1 7 . 1 1 136 136 SER H H 204 7.730 7.730 8.143 -0.413 18517 8119 1 7 . 1 1 137 137 MET N N 205 122.500 122.500 120.152 2.348 18517 8120 1 7 . 1 1 137 137 MET HA H 205 4.140 4.140 4.265 -0.125 18517 8121 1 7 . 1 1 137 137 MET C C 205 177.680 177.680 178.014 -0.334 18517 8122 1 7 . 1 1 137 137 MET CA C 205 60.140 60.140 59.108 1.032 18517 8123 1 7 . 1 1 137 137 MET CB C 205 33.460 33.460 32.399 1.061 18517 8124 1 7 . 1 1 137 137 MET H H 205 8.170 8.170 8.558 -0.388 18517 8125 1 7 . 1 1 138 138 LYS N N 206 121.410 121.410 120.404 1.006 18517 8126 1 7 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.980 -0.230 18517 8127 1 7 . 1 1 138 138 LYS C C 206 178.780 178.780 178.967 -0.187 18517 8128 1 7 . 1 1 138 138 LYS CA C 206 60.330 60.330 60.081 0.249 18517 8129 1 7 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.483 -0.213 18517 8130 1 7 . 1 1 138 138 LYS H H 206 8.810 8.810 8.636 0.174 18517 8131 1 7 . 1 1 139 139 THR N N 207 116.580 116.580 117.316 -0.736 18517 8132 1 7 . 1 1 139 139 THR HA H 207 4.060 4.060 3.958 0.102 18517 8133 1 7 . 1 1 139 139 THR C C 207 176.730 176.730 176.970 -0.240 18517 8134 1 7 . 1 1 139 139 THR CA C 207 67.150 67.150 67.166 -0.016 18517 8135 1 7 . 1 1 139 139 THR CB C 207 69.220 69.220 68.486 0.734 18517 8136 1 7 . 1 1 139 139 THR H H 207 7.930 7.930 8.088 -0.158 18517 8137 1 7 . 1 1 140 140 GLN N N 208 121.390 121.390 120.514 0.876 18517 8138 1 7 . 1 1 140 140 GLN HA H 208 4.060 4.060 3.984 0.076 18517 8139 1 7 . 1 1 140 140 GLN C C 208 178.550 178.550 178.470 0.080 18517 8140 1 7 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.123 0.177 18517 8141 1 7 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.250 0.611 18517 8142 1 7 . 1 1 140 140 GLN H H 208 7.600 7.600 8.513 -0.913 18517 8143 1 7 . 1 1 141 141 HIS N N 209 122.360 122.360 118.805 3.555 18517 8144 1 7 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.318 -0.488 18517 8145 1 7 . 1 1 141 141 HIS C C 209 176.390 176.390 177.535 -1.145 18517 8146 1 7 . 1 1 141 141 HIS CA C 209 61.720 61.720 59.904 1.816 18517 8147 1 7 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.130 -1.030 18517 8148 1 7 . 1 1 141 141 HIS H H 209 8.980 8.980 8.339 0.641 18517 8149 1 7 . 1 1 142 142 ASP N N 210 120.740 120.740 121.047 -0.307 18517 8150 1 7 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.396 -0.046 18517 8151 1 7 . 1 1 142 142 ASP C C 210 179.490 179.490 178.104 1.386 18517 8152 1 7 . 1 1 142 142 ASP CA C 210 57.920 57.920 58.020 -0.101 18517 8153 1 7 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.888 -0.298 18517 8154 1 7 . 1 1 142 142 ASP H H 210 8.770 8.770 8.407 0.363 18517 8155 1 7 . 1 1 143 143 GLU N N 211 119.010 119.010 120.569 -1.559 18517 8156 1 7 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.005 -0.035 18517 8157 1 7 . 1 1 143 143 GLU C C 211 179.070 179.070 178.978 0.092 18517 8158 1 7 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.536 -0.236 18517 8159 1 7 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.723 -0.233 18517 8160 1 7 . 1 1 143 143 GLU H H 211 7.850 7.850 8.348 -0.498 18517 8161 1 7 . 1 1 144 144 LEU N N 212 122.500 122.500 120.383 2.117 18517 8162 1 7 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.003 0.067 18517 8163 1 7 . 1 1 144 144 LEU C C 212 179.340 179.340 179.390 -0.050 18517 8164 1 7 . 1 1 144 144 LEU CA C 212 58.390 58.390 57.941 0.449 18517 8165 1 7 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.778 0.402 18517 8166 1 7 . 1 1 144 144 LEU H H 212 8.070 8.070 8.325 -0.255 18517 8167 1 7 . 1 1 145 145 LEU N N 213 118.110 118.110 118.883 -0.773 18517 8168 1 7 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.667 0.533 18517 8169 1 7 . 1 1 145 145 LEU C C 213 179.610 179.610 178.911 0.699 18517 8170 1 7 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.984 0.766 18517 8171 1 7 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.196 0.034 18517 8172 1 7 . 1 1 145 145 LEU H H 213 8.370 8.370 8.088 0.282 18517 8173 1 7 . 1 1 146 146 LYS N N 214 117.290 117.290 120.110 -2.820 18517 8174 1 7 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.889 -0.059 18517 8175 1 7 . 1 1 146 146 LYS C C 214 179.900 179.900 178.968 0.932 18517 8176 1 7 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.829 0.501 18517 8177 1 7 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.322 0.028 18517 8178 1 7 . 1 1 146 146 LYS H H 214 7.560 7.560 8.432 -0.872 18517 8179 1 7 . 1 1 147 147 LYS N N 215 120.330 120.330 118.826 1.504 18517 8180 1 7 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.069 -0.049 18517 8181 1 7 . 1 1 147 147 LYS C C 215 180.550 180.550 179.422 1.128 18517 8182 1 7 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.057 1.043 18517 8183 1 7 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.013 0.727 18517 8184 1 7 . 1 1 147 147 LYS H H 215 7.830 7.830 8.117 -0.287 18517 8185 1 7 . 1 1 148 148 PHE N N 216 117.370 117.370 117.406 -0.036 18517 8186 1 7 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.299 -0.219 18517 8187 1 7 . 1 1 148 148 PHE C C 216 178.200 178.200 177.924 0.276 18517 8188 1 7 . 1 1 148 148 PHE CA C 216 62.120 62.120 60.865 1.255 18517 8189 1 7 . 1 1 148 148 PHE CB C 216 39.720 39.720 37.948 1.772 18517 8190 1 7 . 1 1 148 148 PHE H H 216 8.010 8.010 8.654 -0.644 18517 8191 1 7 . 1 1 149 149 ALA N N 217 118.990 118.990 120.972 -1.982 18517 8192 1 7 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.701 -0.591 18517 8193 1 7 . 1 1 149 149 ALA C C 217 177.330 177.330 178.230 -0.900 18517 8194 1 7 . 1 1 149 149 ALA CA C 217 53.750 53.750 52.770 0.980 18517 8195 1 7 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.811 -1.211 18517 8196 1 7 . 1 1 149 149 ALA H H 217 7.720 7.720 7.946 -0.226 18517 8197 1 7 . 1 1 150 150 ALA N N 218 118.690 118.690 120.977 -2.287 18517 8198 1 7 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.382 -0.022 18517 8199 1 7 . 1 1 150 150 ALA C C 218 177.930 177.930 177.814 0.116 18517 8200 1 7 . 1 1 150 150 ALA CA C 218 52.090 52.090 53.121 -1.032 18517 8201 1 7 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.732 0.008 18517 8202 1 7 . 1 1 150 150 ALA H H 218 7.280 7.280 7.843 -0.563 18517 8203 1 7 . 1 1 151 151 LEU N N 219 119.980 119.980 120.660 -0.680 18517 8204 1 7 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.630 -0.360 18517 8205 1 7 . 1 1 151 151 LEU C C 219 176.150 176.150 174.877 1.273 18517 8206 1 7 . 1 1 151 151 LEU CA C 219 56.170 56.170 54.048 2.122 18517 8207 1 7 . 1 1 151 151 LEU CB C 219 42.810 42.810 44.693 -1.883 18517 8208 1 7 . 1 1 151 151 LEU H H 219 7.050 7.050 7.917 -0.867 18517 8209 1 7 . 1 1 152 152 THR N N 220 112.070 112.070 114.540 -2.470 18517 8210 1 7 . 1 1 152 152 THR HA H 220 4.700 4.700 4.664 0.036 18517 8211 1 7 . 1 1 152 152 THR C C 220 173.400 173.400 173.322 0.078 18517 8212 1 7 . 1 1 152 152 THR CA C 220 58.190 58.190 58.513 -0.323 18517 8213 1 7 . 1 1 152 152 THR CB C 220 70.960 70.960 68.892 2.068 18517 8214 1 7 . 1 1 152 152 THR H H 220 8.040 8.040 8.133 -0.093 18517 8215 1 7 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.629 0.081 18517 8216 1 7 . 1 1 153 153 PRO C C 221 176.720 176.720 176.759 -0.039 18517 8217 1 7 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.042 0.868 18517 8218 1 7 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.994 1.256 18517 8219 1 7 . 1 1 154 154 THR N N 222 120.460 120.460 117.443 3.017 18517 8220 1 7 . 1 1 154 154 THR HA H 222 4.250 4.250 4.481 -0.231 18517 8221 1 7 . 1 1 154 154 THR C C 222 175.190 175.190 174.758 0.432 18517 8222 1 7 . 1 1 154 154 THR CA C 222 64.650 64.650 62.345 2.305 18517 8223 1 7 . 1 1 154 154 THR CB C 222 70.410 70.410 67.915 2.495 18517 8224 1 7 . 1 1 154 154 THR H H 222 8.530 8.530 8.468 0.062 18517 8225 1 7 . 1 1 155 155 PHE N N 223 122.260 122.260 121.886 0.374 18517 8226 1 7 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.674 0.316 18517 8227 1 7 . 1 1 155 155 PHE C C 223 172.560 172.560 174.590 -2.030 18517 8228 1 7 . 1 1 155 155 PHE CA C 223 56.770 56.770 57.222 -0.452 18517 8229 1 7 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.118 1.472 18517 8230 1 7 . 1 1 155 155 PHE H H 223 8.950 8.950 7.725 1.225 18517 8231 1 7 . 1 1 156 156 LEU N N 224 123.440 123.440 119.862 3.578 18517 8232 1 7 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.353 0.317 18517 8233 1 7 . 1 1 156 156 LEU C C 224 175.090 175.090 177.043 -1.953 18517 8234 1 7 . 1 1 156 156 LEU CA C 224 54.030 54.030 53.904 0.126 18517 8235 1 7 . 1 1 156 156 LEU CB C 224 46.300 46.300 43.064 3.236 18517 8236 1 7 . 1 1 156 156 LEU H H 224 7.210 7.210 7.254 -0.044 18517 8237 1 7 . 1 1 157 157 THR N N 225 113.010 113.010 111.682 1.328 18517 8238 1 7 . 1 1 157 157 THR HA H 225 4.790 4.790 4.515 0.275 18517 8239 1 7 . 1 1 157 157 THR C C 225 176.130 176.130 174.206 1.924 18517 8240 1 7 . 1 1 157 157 THR CA C 225 59.860 59.860 60.881 -1.021 18517 8241 1 7 . 1 1 157 157 THR CB C 225 72.860 72.860 69.876 2.984 18517 8242 1 7 . 1 1 157 157 THR H H 225 9.200 9.200 8.133 1.067 18517 8243 1 7 . 1 1 158 158 SER N N 226 115.350 115.350 116.871 -1.521 18517 8244 1 7 . 1 1 158 158 SER C C 226 177.410 177.410 175.855 1.555 18517 8245 1 7 . 1 1 158 158 SER CA C 226 57.400 57.400 58.464 -1.063 18517 8246 1 7 . 1 1 158 158 SER CB C 226 66.200 66.200 63.987 2.213 18517 8247 1 7 . 1 1 158 158 SER H H 226 8.830 8.830 8.447 0.383 18517 8248 1 7 . 1 1 159 159 GLU N N 227 121.200 121.200 124.168 -2.968 18517 8249 1 7 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.918 0.102 18517 8250 1 7 . 1 1 159 159 GLU C C 227 177.680 177.680 177.696 -0.016 18517 8251 1 7 . 1 1 159 159 GLU CA C 227 59.500 59.500 59.136 0.364 18517 8252 1 7 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.276 0.293 18517 8253 1 7 . 1 1 159 159 GLU H H 227 8.320 8.320 8.996 -0.676 18517 8254 1 7 . 1 1 160 160 ASP N N 228 115.350 115.350 117.930 -2.580 18517 8255 1 7 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.380 0.170 18517 8256 1 7 . 1 1 160 160 ASP C C 228 177.640 177.640 178.082 -0.442 18517 8257 1 7 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.679 0.721 18517 8258 1 7 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.672 2.378 18517 8259 1 7 . 1 1 160 160 ASP H H 228 7.570 7.570 8.375 -0.805 18517 8260 1 7 . 1 1 161 161 ILE N N 229 108.150 108.150 115.370 -7.220 18517 8261 1 7 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.273 0.237 18517 8262 1 7 . 1 1 161 161 ILE C C 229 173.130 173.130 177.638 -4.508 18517 8263 1 7 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.755 -1.465 18517 8264 1 7 . 1 1 161 161 ILE CB C 229 39.400 39.400 38.284 1.116 18517 8265 1 7 . 1 1 161 161 ILE H H 229 7.190 7.190 7.453 -0.263 18517 8266 1 7 . 1 1 162 162 SER N N 230 115.290 115.290 117.188 -1.898 18517 8267 1 7 . 1 1 162 162 SER HA H 230 4.760 4.760 3.888 0.872 18517 8268 1 7 . 1 1 162 162 SER C C 230 176.060 176.060 174.141 1.919 18517 8269 1 7 . 1 1 162 162 SER CA C 230 57.920 57.920 56.552 1.368 18517 8270 1 7 . 1 1 162 162 SER CB C 230 66.120 66.120 61.592 4.528 18517 8271 1 7 . 1 1 162 162 SER H H 230 7.460 7.460 8.167 -0.707 18517 8272 1 7 . 1 1 163 163 GLY C C 231 173.260 173.260 173.098 0.162 18517 8273 1 7 . 1 1 163 163 GLY CA C 231 45.550 45.550 45.054 0.496 18517 8274 1 7 . 1 1 164 164 TYR N N 232 115.290 115.290 117.038 -1.748 18517 8275 1 7 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.723 -0.023 18517 8276 1 7 . 1 1 164 164 TYR C C 232 172.820 172.820 173.596 -0.776 18517 8277 1 7 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.175 -0.075 18517 8278 1 7 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.450 0.350 18517 8279 1 7 . 1 1 164 164 TYR H H 232 7.370 7.370 7.380 -0.010 18517 8280 1 7 . 1 1 165 165 LEU N N 233 120.980 120.980 121.740 -0.760 18517 8281 1 7 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.536 -0.106 18517 8282 1 7 . 1 1 165 165 LEU C C 233 176.360 176.360 177.535 -1.175 18517 8283 1 7 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.486 1.173 18517 8284 1 7 . 1 1 165 165 LEU CB C 233 40.430 40.430 42.453 -2.023 18517 8285 1 7 . 1 1 165 165 LEU H H 233 8.830 8.830 8.577 0.253 18517 8286 1 7 . 1 1 166 166 THR N N 234 116.170 116.170 114.441 1.729 18517 8287 1 7 . 1 1 166 166 THR HA H 234 4.010 4.010 3.548 0.462 18517 8288 1 7 . 1 1 166 166 THR C C 234 173.070 173.070 173.909 -0.839 18517 8289 1 7 . 1 1 166 166 THR CA C 234 62.910 62.910 63.823 -0.913 18517 8290 1 7 . 1 1 166 166 THR CB C 234 70.170 70.170 68.702 1.468 18517 8291 1 7 . 1 1 166 166 THR H H 234 8.050 8.050 8.455 -0.405 18517 8292 1 7 . 1 1 167 167 VAL N N 235 117.640 117.640 115.454 2.186 18517 8293 1 7 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.336 -0.126 18517 8294 1 7 . 1 1 167 167 VAL C C 235 172.330 172.330 173.370 -1.040 18517 8295 1 7 . 1 1 167 167 VAL CA C 235 58.750 58.750 58.078 0.672 18517 8296 1 7 . 1 1 167 167 VAL CB C 235 35.880 35.880 32.626 3.254 18517 8297 1 7 . 1 1 167 167 VAL H H 235 7.160 7.160 7.248 -0.088 18517 8298 1 7 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.513 -0.323 18517 8299 1 7 . 1 1 168 168 PRO C C 236 173.710 173.710 175.846 -2.136 18517 8300 1 7 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.459 1.371 18517 8301 1 7 . 1 1 168 168 PRO CB C 236 32.270 32.270 32.782 -0.512 18517 8302 1 7 . 1 1 169 169 GLU N N 237 113.540 113.540 118.246 -4.706 18517 8303 1 7 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.120 0.260 18517 8304 1 7 . 1 1 169 169 GLU C C 237 176.690 176.690 178.191 -1.501 18517 8305 1 7 . 1 1 169 169 GLU CA C 237 53.750 53.750 55.111 -1.361 18517 8306 1 7 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.613 2.607 18517 8307 1 7 . 1 1 169 169 GLU H H 237 7.930 7.930 8.251 -0.321 18517 8308 1 7 . 1 1 170 170 TYR N N 238 119.400 119.400 119.555 -0.155 18517 8309 1 7 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.070 -0.070 18517 8310 1 7 . 1 1 170 170 TYR C C 238 177.610 177.610 176.535 1.075 18517 8311 1 7 . 1 1 170 170 TYR CA C 238 62.630 62.630 60.486 2.143 18517 8312 1 7 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.400 -0.660 18517 8313 1 7 . 1 1 170 170 TYR H H 238 8.490 8.490 8.675 -0.185 18517 8314 1 7 . 1 1 171 171 GLY N N 239 104.160 104.160 103.513 0.647 18517 8315 1 7 . 1 1 171 171 GLY C C 239 173.350 173.350 173.250 0.100 18517 8316 1 7 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.937 0.333 18517 8317 1 7 . 1 1 171 171 GLY H H 239 7.960 7.960 7.871 0.089 18517 8318 1 7 . 1 1 172 172 ALA N N 240 121.860 121.860 124.051 -2.191 18517 8319 1 7 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.777 -0.607 18517 8320 1 7 . 1 1 172 172 ALA C C 240 172.160 172.160 174.379 -2.219 18517 8321 1 7 . 1 1 172 172 ALA CA C 240 50.110 50.110 48.731 1.379 18517 8322 1 7 . 1 1 172 172 ALA CB C 240 20.930 20.930 20.068 0.862 18517 8323 1 7 . 1 1 172 172 ALA H H 240 6.910 6.910 7.859 -0.949 18517 8324 1 7 . 1 1 173 173 PRO HA H 241 4.550 4.550 2.818 1.732 18517 8325 1 7 . 1 1 173 173 PRO C C 241 176.610 176.610 174.799 1.811 18517 8326 1 7 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.338 -0.818 18517 8327 1 7 . 1 1 173 173 PRO CB C 241 33.300 33.300 32.720 0.580 18517 8328 1 7 . 1 1 174 174 MET N N 242 114.000 114.000 119.429 -5.429 18517 8329 1 7 . 1 1 174 174 MET HA H 242 4.390 4.390 4.411 -0.021 18517 8330 1 7 . 1 1 174 174 MET C C 242 173.960 173.960 173.874 0.086 18517 8331 1 7 . 1 1 174 174 MET CA C 242 54.660 54.660 54.277 0.383 18517 8332 1 7 . 1 1 174 174 MET CB C 242 34.170 34.170 36.975 -2.805 18517 8333 1 7 . 1 1 174 174 MET H H 242 8.040 8.040 7.652 0.388 18517 8334 1 7 . 1 1 175 175 ASN N N 243 119.570 119.570 119.643 -0.073 18517 8335 1 7 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.914 0.026 18517 8336 1 7 . 1 1 175 175 ASN C C 243 174.320 174.320 175.424 -1.104 18517 8337 1 7 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.558 0.522 18517 8338 1 7 . 1 1 175 175 ASN CB C 243 38.850 38.850 38.846 0.004 18517 8339 1 7 . 1 1 175 175 ASN H H 243 7.960 7.960 7.865 0.095 18517 8340 1 7 . 1 1 176 176 ALA N N 244 132.250 132.250 129.575 2.675 18517 8341 1 7 . 1 1 176 176 ALA C C 244 181.580 181.580 178.678 2.902 18517 8342 1 7 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.228 0.542 18517 8343 1 7 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.940 0.090 18517 8344 1 7 . 1 1 176 176 ALA H H 244 12.110 12.110 8.465 3.645 18517 8345 1 7 . 1 1 177 177 ALA N N 245 125.780 125.780 120.760 5.020 18517 8346 1 7 . 1 1 177 177 ALA HA H 245 3.870 3.870 4.035 -0.165 18517 8347 1 7 . 1 1 177 177 ALA C C 245 180.640 180.640 179.509 1.131 18517 8348 1 7 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.250 0.410 18517 8349 1 7 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.263 -0.423 18517 8350 1 7 . 1 1 177 177 ALA H H 245 10.240 10.240 8.829 1.411 18517 8351 1 7 . 1 1 178 178 LYS N N 246 119.810 119.810 119.130 0.680 18517 8352 1 7 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.150 -0.320 18517 8353 1 7 . 1 1 178 178 LYS C C 246 180.500 180.500 178.191 2.309 18517 8354 1 7 . 1 1 178 178 LYS CA C 246 59.900 59.900 58.694 1.206 18517 8355 1 7 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.209 -0.889 18517 8356 1 7 . 1 1 178 178 LYS H H 246 8.470 8.470 7.974 0.496 18517 8357 1 7 . 1 1 179 179 TRP N N 247 121.170 121.170 121.740 -0.570 18517 8358 1 7 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.440 0.180 18517 8359 1 7 . 1 1 179 179 TRP C C 247 176.510 176.510 178.057 -1.547 18517 8360 1 7 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.895 -0.075 18517 8361 1 7 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.762 -0.192 18517 8362 1 7 . 1 1 179 179 TRP H H 247 8.330 8.330 8.278 0.052 18517 8363 1 7 . 1 1 180 180 ALA N N 248 119.130 119.130 120.550 -1.420 18517 8364 1 7 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.855 0.685 18517 8365 1 7 . 1 1 180 180 ALA C C 248 182.110 182.110 178.680 3.430 18517 8366 1 7 . 1 1 180 180 ALA CA C 248 54.190 54.190 54.942 -0.752 18517 8367 1 7 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.078 0.632 18517 8368 1 7 . 1 1 180 180 ALA H H 248 7.990 7.990 8.672 -0.682 18517 8369 1 7 . 1 1 181 181 LYS N N 249 116.000 116.000 118.985 -2.985 18517 8370 1 7 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.106 -0.136 18517 8371 1 7 . 1 1 181 181 LYS C C 249 179.380 179.380 178.853 0.527 18517 8372 1 7 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.374 -0.665 18517 8373 1 7 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.640 -0.130 18517 8374 1 7 . 1 1 181 181 LYS H H 249 6.900 6.900 7.764 -0.864 18517 8375 1 7 . 1 1 182 182 VAL N N 250 122.270 122.270 116.012 6.258 18517 8376 1 7 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.632 -0.292 18517 8377 1 7 . 1 1 182 182 VAL C C 250 178.160 178.160 177.706 0.454 18517 8378 1 7 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.297 0.463 18517 8379 1 7 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.537 -0.697 18517 8380 1 7 . 1 1 182 182 VAL H H 250 7.050 7.050 8.016 -0.966 18517 8381 1 7 . 1 1 183 183 GLU N N 251 120.520 120.520 119.990 0.530 18517 8382 1 7 . 1 1 183 183 GLU HA H 251 3.180 3.180 4.091 -0.911 18517 8383 1 7 . 1 1 183 183 GLU C C 251 179.480 179.480 178.822 0.658 18517 8384 1 7 . 1 1 183 183 GLU CA C 251 60.690 60.690 58.153 2.537 18517 8385 1 7 . 1 1 183 183 GLU CB C 251 28.070 28.070 29.142 -1.072 18517 8386 1 7 . 1 1 183 183 GLU H H 251 8.020 8.020 8.703 -0.683 18517 8387 1 7 . 1 1 184 184 GLY N N 252 102.930 102.930 108.442 -5.512 18517 8388 1 7 . 1 1 184 184 GLY C C 252 176.920 176.920 176.354 0.566 18517 8389 1 7 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.259 0.151 18517 8390 1 7 . 1 1 184 184 GLY H H 252 7.830 7.830 7.987 -0.157 18517 8391 1 7 . 1 1 185 185 MET N N 253 123.200 123.200 121.790 1.410 18517 8392 1 7 . 1 1 185 185 MET HA H 253 4.250 4.250 4.124 0.126 18517 8393 1 7 . 1 1 185 185 MET C C 253 179.370 179.370 178.529 0.841 18517 8394 1 7 . 1 1 185 185 MET CA C 253 59.300 59.300 59.464 -0.164 18517 8395 1 7 . 1 1 185 185 MET CB C 253 33.930 33.930 32.574 1.356 18517 8396 1 7 . 1 1 185 185 MET H H 253 7.890 7.890 7.935 -0.045 18517 8397 1 7 . 1 1 186 186 ILE N N 254 120.150 120.150 120.336 -0.186 18517 8398 1 7 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.702 -0.142 18517 8399 1 7 . 1 1 186 186 ILE C C 254 177.250 177.250 178.078 -0.828 18517 8400 1 7 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.667 0.853 18517 8401 1 7 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.635 0.655 18517 8402 1 7 . 1 1 186 186 ILE H H 254 8.260 8.260 8.085 0.175 18517 8403 1 7 . 1 1 187 187 HIS N N 255 119.810 119.810 119.161 0.649 18517 8404 1 7 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.201 -0.201 18517 8405 1 7 . 1 1 187 187 HIS C C 255 176.460 176.460 177.524 -1.064 18517 8406 1 7 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.902 0.428 18517 8407 1 7 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.665 1.965 18517 8408 1 7 . 1 1 187 187 HIS H H 255 8.900 8.900 8.934 -0.034 18517 8409 1 7 . 1 1 188 188 GLY N N 256 103.160 103.160 107.375 -4.215 18517 8410 1 7 . 1 1 188 188 GLY C C 256 176.320 176.320 176.371 -0.051 18517 8411 1 7 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.971 -0.081 18517 8412 1 7 . 1 1 188 188 GLY H H 256 8.030 8.030 8.565 -0.535 18517 8413 1 7 . 1 1 189 189 LYS N N 257 119.510 119.510 122.867 -3.357 18517 8414 1 7 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.027 -0.027 18517 8415 1 7 . 1 1 189 189 LYS C C 257 178.660 178.660 179.556 -0.896 18517 8416 1 7 . 1 1 189 189 LYS CA C 257 56.490 56.490 58.163 -1.673 18517 8417 1 7 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.838 -0.288 18517 8418 1 7 . 1 1 189 189 LYS H H 257 7.120 7.120 8.088 -0.968 18517 8419 1 7 . 1 1 190 190 LEU N N 258 120.570 120.570 119.813 0.757 18517 8420 1 7 . 1 1 190 190 LEU HA H 258 3.930 3.930 4.023 -0.093 18517 8421 1 7 . 1 1 190 190 LEU C C 258 177.230 177.230 177.304 -0.074 18517 8422 1 7 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.337 0.183 18517 8423 1 7 . 1 1 190 190 LEU CB C 258 42.970 42.970 42.067 0.903 18517 8424 1 7 . 1 1 190 190 LEU H H 258 8.060 8.060 8.287 -0.227 18517 8425 1 7 . 1 1 191 191 GLU N N 259 114.590 114.590 116.012 -1.422 18517 8426 1 7 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.261 0.019 18517 8427 1 7 . 1 1 191 191 GLU C C 259 176.230 176.230 176.443 -0.213 18517 8428 1 7 . 1 1 191 191 GLU CA C 259 55.340 55.340 55.926 -0.586 18517 8429 1 7 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.662 -0.332 18517 8430 1 7 . 1 1 191 191 GLU H H 259 7.330 7.330 7.831 -0.501 18517 8431 1 7 . 1 1 192 192 SER N N 260 115.240 115.240 116.783 -1.543 18517 8432 1 7 . 1 1 192 192 SER HA H 260 4.490 4.490 4.529 -0.039 18517 8433 1 7 . 1 1 192 192 SER C C 260 173.770 173.770 173.825 -0.055 18517 8434 1 7 . 1 1 192 192 SER CA C 260 58.350 58.350 57.775 0.575 18517 8435 1 7 . 1 1 192 192 SER CB C 260 65.090 65.090 63.909 1.181 18517 8436 1 7 . 1 1 192 192 SER H H 260 7.130 7.130 7.446 -0.316 18517 8437 1 7 . 1 1 193 193 SER C C 261 174.600 174.600 174.495 0.105 18517 8438 1 7 . 1 1 193 193 SER CA C 261 59.980 59.980 59.055 0.925 18517 8439 1 7 . 1 1 193 193 SER CB C 261 63.750 63.750 62.879 0.871 18517 8440 1 7 . 1 1 194 194 GLU N N 262 121.800 121.800 122.072 -0.272 18517 8441 1 7 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.232 0.238 18517 8442 1 7 . 1 1 194 194 GLU C C 262 174.650 174.650 175.416 -0.766 18517 8443 1 7 . 1 1 194 194 GLU CA C 262 55.620 55.620 56.478 -0.858 18517 8444 1 7 . 1 1 194 194 GLU CB C 262 30.210 30.210 28.423 1.787 18517 8445 1 7 . 1 1 194 194 GLU H H 262 7.840 7.840 8.101 -0.261 18517 8446 1 7 . 1 1 195 195 VAL N N 263 124.080 124.080 125.909 -1.829 18517 8447 1 7 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.348 -0.098 18517 8448 1 7 . 1 1 195 195 VAL C C 263 174.460 174.460 174.816 -0.356 18517 8449 1 7 . 1 1 195 195 VAL CA C 263 59.820 59.820 59.917 -0.097 18517 8450 1 7 . 1 1 195 195 VAL CB C 263 33.620 33.620 32.623 0.997 18517 8451 1 7 . 1 1 195 195 VAL H H 263 8.020 8.020 7.845 0.175 18517 8452 1 7 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.621 -0.101 18517 8453 1 7 . 1 1 198 198 ASN C C 266 176.490 176.490 177.223 -0.733 18517 8454 1 7 . 1 1 198 198 ASN CA C 266 54.780 54.780 55.979 -1.199 18517 8455 1 7 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.609 0.451 18517 8456 1 7 . 1 1 199 199 LEU N N 267 120.680 120.680 120.719 -0.039 18517 8457 1 7 . 1 1 199 199 LEU HA H 267 4.010 4.010 4.008 0.002 18517 8458 1 7 . 1 1 199 199 LEU C C 267 178.050 178.050 178.149 -0.099 18517 8459 1 7 . 1 1 199 199 LEU CA C 267 58.830 58.830 57.429 1.401 18517 8460 1 7 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.607 0.733 18517 8461 1 7 . 1 1 199 199 LEU H H 267 7.660 7.660 7.888 -0.228 18517 8462 1 7 . 1 1 200 200 LYS N N 268 116.740 116.740 119.488 -2.748 18517 8463 1 7 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.901 -0.171 18517 8464 1 7 . 1 1 200 200 LYS C C 268 178.520 178.520 178.437 0.083 18517 8465 1 7 . 1 1 200 200 LYS CA C 268 61.800 61.800 59.864 1.936 18517 8466 1 7 . 1 1 200 200 LYS CB C 268 32.110 32.110 32.067 0.043 18517 8467 1 7 . 1 1 200 200 LYS H H 268 8.280 8.280 8.287 -0.007 18517 8468 1 7 . 1 1 201 201 ALA N N 269 121.270 121.270 121.745 -0.475 18517 8469 1 7 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.041 0.199 18517 8470 1 7 . 1 1 201 201 ALA C C 269 180.890 180.890 179.711 1.179 18517 8471 1 7 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.118 0.062 18517 8472 1 7 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.426 0.044 18517 8473 1 7 . 1 1 201 201 ALA H H 269 7.710 7.710 7.799 -0.089 18517 8474 1 7 . 1 1 202 202 LEU N N 270 119.980 119.980 119.258 0.722 18517 8475 1 7 . 1 1 202 202 LEU HA H 270 4.090 4.090 4.049 0.041 18517 8476 1 7 . 1 1 202 202 LEU C C 270 179.330 179.330 179.317 0.013 18517 8477 1 7 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.815 0.255 18517 8478 1 7 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.415 1.005 18517 8479 1 7 . 1 1 202 202 LEU H H 270 7.750 7.750 8.018 -0.268 18517 8480 1 7 . 1 1 203 203 VAL N N 271 118.450 118.450 116.753 1.697 18517 8481 1 7 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.971 -0.141 18517 8482 1 7 . 1 1 203 203 VAL C C 271 177.110 177.110 177.813 -0.703 18517 8483 1 7 . 1 1 203 203 VAL CA C 271 67.710 67.710 65.880 1.829 18517 8484 1 7 . 1 1 203 203 VAL CB C 271 31.710 31.710 30.330 1.380 18517 8485 1 7 . 1 1 203 203 VAL H H 271 8.560 8.560 8.476 0.084 18517 8486 1 7 . 1 1 204 204 ALA N N 272 122.560 122.560 123.123 -0.563 18517 8487 1 7 . 1 1 204 204 ALA HA H 272 3.880 3.880 4.035 -0.155 18517 8488 1 7 . 1 1 204 204 ALA C C 272 178.700 178.700 179.784 -1.084 18517 8489 1 7 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.544 0.586 18517 8490 1 7 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.218 0.172 18517 8491 1 7 . 1 1 204 204 ALA H H 272 8.120 8.120 8.350 -0.230 18517 8492 1 7 . 1 1 205 205 GLU N N 273 117.290 117.290 119.037 -1.747 18517 8493 1 7 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.115 -0.125 18517 8494 1 7 . 1 1 205 205 GLU C C 273 178.630 178.630 178.980 -0.350 18517 8495 1 7 . 1 1 205 205 GLU CA C 273 60.140 60.140 58.990 1.150 18517 8496 1 7 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.412 0.558 18517 8497 1 7 . 1 1 205 205 GLU H H 273 7.670 7.670 8.126 -0.456 18517 8498 1 7 . 1 1 206 206 LEU N N 274 120.450 120.450 122.172 -1.722 18517 8499 1 7 . 1 1 206 206 LEU HA H 274 4.000 4.000 3.985 0.015 18517 8500 1 7 . 1 1 206 206 LEU C C 274 178.400 178.400 178.748 -0.348 18517 8501 1 7 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.075 0.835 18517 8502 1 7 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.780 1.750 18517 8503 1 7 . 1 1 206 206 LEU H H 274 8.420 8.420 8.333 0.087 18517 8504 1 7 . 1 1 207 207 ILE N N 275 117.580 117.580 119.636 -2.056 18517 8505 1 7 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.517 0.013 18517 8506 1 7 . 1 1 207 207 ILE C C 275 178.850 178.850 178.089 0.761 18517 8507 1 7 . 1 1 207 207 ILE CA C 275 66.080 66.080 65.892 0.188 18517 8508 1 7 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.532 1.238 18517 8509 1 7 . 1 1 207 207 ILE H H 275 8.700 8.700 8.432 0.268 18517 8510 1 7 . 1 1 208 208 GLU N N 276 119.100 119.100 119.863 -0.763 18517 8511 1 7 . 1 1 208 208 GLU HA H 276 4.000 4.000 3.925 0.075 18517 8512 1 7 . 1 1 208 208 GLU C C 276 178.540 178.540 179.051 -0.511 18517 8513 1 7 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.699 0.751 18517 8514 1 7 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.488 1.032 18517 8515 1 7 . 1 1 208 208 GLU H H 276 7.950 7.950 8.177 -0.227 18517 8516 1 7 . 1 1 209 209 LEU N N 277 120.590 120.590 118.996 1.594 18517 8517 1 7 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.050 0.170 18517 8518 1 7 . 1 1 209 209 LEU C C 277 179.520 179.520 179.347 0.173 18517 8519 1 7 . 1 1 209 209 LEU CA C 277 58.350 58.350 57.858 0.492 18517 8520 1 7 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.784 1.506 18517 8521 1 7 . 1 1 209 209 LEU H H 277 8.550 8.550 8.349 0.201 18517 8522 1 7 . 1 1 210 210 ARG N N 278 116.470 116.470 119.516 -3.046 18517 8523 1 7 . 1 1 210 210 ARG HA H 278 3.740 3.740 4.066 -0.326 18517 8524 1 7 . 1 1 210 210 ARG C C 278 179.190 179.190 178.532 0.658 18517 8525 1 7 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.514 2.166 18517 8526 1 7 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.348 1.052 18517 8527 1 7 . 1 1 210 210 ARG H H 278 8.590 8.590 8.489 0.101 18517 8528 1 7 . 1 1 211 211 ALA N N 279 120.470 120.470 123.149 -2.679 18517 8529 1 7 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.067 -0.157 18517 8530 1 7 . 1 1 211 211 ALA C C 279 181.350 181.350 179.752 1.598 18517 8531 1 7 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.081 0.619 18517 8532 1 7 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.411 -1.131 18517 8533 1 7 . 1 1 211 211 ALA H H 279 8.050 8.050 8.213 -0.163 18517 8534 1 7 . 1 1 212 212 GLN N N 280 120.070 120.070 118.035 2.035 18517 8535 1 7 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.921 0.099 18517 8536 1 7 . 1 1 212 212 GLN C C 280 179.490 179.490 178.616 0.874 18517 8537 1 7 . 1 1 212 212 GLN CA C 280 59.300 59.300 59.059 0.241 18517 8538 1 7 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.754 0.426 18517 8539 1 7 . 1 1 212 212 GLN H H 280 8.300 8.300 8.102 0.198 18517 8540 1 7 . 1 1 213 213 MET N N 281 119.810 119.810 119.342 0.468 18517 8541 1 7 . 1 1 213 213 MET HA H 281 3.730 3.730 4.241 -0.511 18517 8542 1 7 . 1 1 213 213 MET C C 281 177.490 177.490 178.147 -0.657 18517 8543 1 7 . 1 1 213 213 MET CA C 281 60.690 60.690 57.657 3.033 18517 8544 1 7 . 1 1 213 213 MET CB C 281 33.930 33.930 32.615 1.315 18517 8545 1 7 . 1 1 213 213 MET H H 281 8.420 8.420 8.233 0.187 18517 8546 1 7 . 1 1 214 214 MET N N 282 114.000 114.000 119.800 -5.800 18517 8547 1 7 . 1 1 214 214 MET HA H 282 3.880 3.880 4.180 -0.300 18517 8548 1 7 . 1 1 214 214 MET C C 282 177.650 177.650 177.555 0.095 18517 8549 1 7 . 1 1 214 214 MET CA C 282 58.670 58.670 59.057 -0.388 18517 8550 1 7 . 1 1 214 214 MET CB C 282 33.300 33.300 32.649 0.651 18517 8551 1 7 . 1 1 214 214 MET H H 282 7.890 7.890 8.295 -0.405 18517 8552 1 7 . 1 1 215 215 ALA N N 283 119.970 119.970 123.313 -3.343 18517 8553 1 7 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.030 0.110 18517 8554 1 7 . 1 1 215 215 ALA C C 283 180.580 180.580 179.469 1.111 18517 8555 1 7 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.102 -0.992 18517 8556 1 7 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.188 -0.508 18517 8557 1 7 . 1 1 215 215 ALA H H 283 7.580 7.580 8.152 -0.572 18517 8558 1 7 . 1 1 216 216 LEU N N 284 120.920 120.920 118.442 2.478 18517 8559 1 7 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.035 -0.075 18517 8560 1 7 . 1 1 216 216 LEU C C 284 177.910 177.910 179.301 -1.391 18517 8561 1 7 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.170 0.750 18517 8562 1 7 . 1 1 216 216 LEU CB C 284 42.500 42.500 41.946 0.555 18517 8563 1 7 . 1 1 216 216 LEU H H 284 7.460 7.460 8.055 -0.595 18517 8564 1 7 . 1 1 217 217 LEU N N 285 116.470 116.470 120.447 -3.977 18517 8565 1 7 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.568 0.112 18517 8566 1 7 . 1 1 217 217 LEU C C 285 178.310 178.310 177.086 1.224 18517 8567 1 7 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.198 0.242 18517 8568 1 7 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.872 1.178 18517 8569 1 7 . 1 1 217 217 LEU H H 285 6.980 6.980 7.924 -0.944 18517 8570 1 7 . 1 1 218 218 TYR N N 286 111.080 111.080 114.947 -3.867 18517 8571 1 7 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.465 0.435 18517 8572 1 7 . 1 1 218 218 TYR C C 286 176.090 176.090 175.442 0.648 18517 8573 1 7 . 1 1 218 218 TYR CA C 286 56.050 56.050 57.509 -1.459 18517 8574 1 7 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.035 2.875 18517 8575 1 7 . 1 1 218 218 TYR H H 286 7.660 7.660 7.765 -0.105 18517 8576 1 7 . 1 1 219 219 GLY N N 287 108.260 108.260 110.239 -1.979 18517 8577 1 7 . 1 1 219 219 GLY CA C 287 44.320 44.320 42.699 1.621 18517 8578 1 7 . 1 1 219 219 GLY H H 287 7.750 7.750 7.733 0.017 18517 8579 1 7 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.952 -0.462 18517 8580 1 7 . 1 1 221 221 ILE CA C 289 63.580 63.580 61.722 1.858 18517 8581 1 7 . 1 1 221 221 ILE CB C 289 38.280 38.280 37.582 0.698 18517 8582 1 7 . 1 1 222 222 GLY CA C 290 45.740 45.740 45.258 0.482 18517 8583 1 8 . 1 1 2 2 LYS N N 70 126.600 126.600 125.377 1.223 18517 8584 1 8 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.770 -0.410 18517 8585 1 8 . 1 1 2 2 LYS C C 70 176.000 176.000 175.322 0.678 18517 8586 1 8 . 1 1 2 2 LYS CA C 70 56.450 56.450 56.019 0.431 18517 8587 1 8 . 1 1 2 2 LYS CB C 70 33.850 33.850 33.781 0.069 18517 8588 1 8 . 1 1 2 2 LYS H H 70 8.530 8.530 8.555 -0.025 18517 8589 1 8 . 1 1 3 3 THR N N 71 111.030 111.030 113.951 -2.921 18517 8590 1 8 . 1 1 3 3 THR HA H 71 4.400 4.400 4.626 -0.226 18517 8591 1 8 . 1 1 3 3 THR C C 71 175.650 175.650 175.623 0.027 18517 8592 1 8 . 1 1 3 3 THR CA C 71 60.610 60.610 59.731 0.879 18517 8593 1 8 . 1 1 3 3 THR CB C 71 71.520 71.520 70.540 0.980 18517 8594 1 8 . 1 1 3 3 THR H H 71 7.390 7.390 8.292 -0.902 18517 8595 1 8 . 1 1 4 4 LEU N N 72 121.560 121.560 121.677 -0.117 18517 8596 1 8 . 1 1 4 4 LEU C C 72 177.870 177.870 178.643 -0.773 18517 8597 1 8 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.809 -0.329 18517 8598 1 8 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.278 0.902 18517 8599 1 8 . 1 1 4 4 LEU H H 72 8.980 8.980 8.609 0.371 18517 8600 1 8 . 1 1 5 5 ASP N N 73 115.530 115.530 117.404 -1.874 18517 8601 1 8 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.414 -0.084 18517 8602 1 8 . 1 1 5 5 ASP C C 73 179.290 179.290 178.389 0.901 18517 8603 1 8 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.324 0.516 18517 8604 1 8 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.742 0.088 18517 8605 1 8 . 1 1 5 5 ASP H H 73 8.270 8.270 8.055 0.215 18517 8606 1 8 . 1 1 6 6 VAL N N 74 122.330 122.330 120.304 2.026 18517 8607 1 8 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.756 -0.016 18517 8608 1 8 . 1 1 6 6 VAL C C 74 178.970 178.970 177.978 0.992 18517 8609 1 8 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.883 0.477 18517 8610 1 8 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.491 0.459 18517 8611 1 8 . 1 1 6 6 VAL H H 74 7.400 7.400 7.366 0.034 18517 8612 1 8 . 1 1 7 7 LEU N N 75 121.360 121.360 121.624 -0.264 18517 8613 1 8 . 1 1 7 7 LEU HA H 75 4.030 4.030 4.166 -0.136 18517 8614 1 8 . 1 1 7 7 LEU C C 75 179.240 179.240 179.697 -0.457 18517 8615 1 8 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.301 -0.071 18517 8616 1 8 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.302 1.588 18517 8617 1 8 . 1 1 7 7 LEU H H 75 8.300 8.300 8.628 -0.328 18517 8618 1 8 . 1 1 8 8 ARG N N 76 117.230 117.230 117.676 -0.446 18517 8619 1 8 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.029 -0.109 18517 8620 1 8 . 1 1 8 8 ARG C C 76 178.290 178.290 178.916 -0.626 18517 8621 1 8 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.342 1.428 18517 8622 1 8 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.941 0.269 18517 8623 1 8 . 1 1 8 8 ARG H H 76 8.520 8.520 8.634 -0.114 18517 8624 1 8 . 1 1 9 9 GLY N N 77 104.570 104.570 108.689 -4.119 18517 8625 1 8 . 1 1 9 9 GLY C C 77 176.180 176.180 175.882 0.298 18517 8626 1 8 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.888 0.282 18517 8627 1 8 . 1 1 9 9 GLY H H 77 7.620 7.620 8.242 -0.622 18517 8628 1 8 . 1 1 10 10 GLU N N 78 120.270 120.270 123.250 -2.980 18517 8629 1 8 . 1 1 10 10 GLU HA H 78 4.270 4.270 3.996 0.274 18517 8630 1 8 . 1 1 10 10 GLU C C 78 179.030 179.030 179.174 -0.144 18517 8631 1 8 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.212 -0.343 18517 8632 1 8 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.490 1.910 18517 8633 1 8 . 1 1 10 10 GLU H H 78 8.100 8.100 8.300 -0.200 18517 8634 1 8 . 1 1 11 11 LEU N N 79 116.000 116.000 120.706 -4.706 18517 8635 1 8 . 1 1 11 11 LEU HA H 79 4.510 4.510 4.002 0.508 18517 8636 1 8 . 1 1 11 11 LEU C C 79 179.630 179.630 178.700 0.930 18517 8637 1 8 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.541 -1.851 18517 8638 1 8 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.291 3.509 18517 8639 1 8 . 1 1 11 11 LEU H H 79 8.230 8.230 8.266 -0.036 18517 8640 1 8 . 1 1 12 12 ARG N N 80 120.020 120.020 119.357 0.663 18517 8641 1 8 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.971 -0.221 18517 8642 1 8 . 1 1 12 12 ARG C C 80 178.490 178.490 178.753 -0.263 18517 8643 1 8 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.334 2.666 18517 8644 1 8 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.686 1.554 18517 8645 1 8 . 1 1 12 12 ARG H H 80 8.210 8.210 8.529 -0.319 18517 8646 1 8 . 1 1 13 13 GLY N N 81 108.090 108.090 106.636 1.454 18517 8647 1 8 . 1 1 13 13 GLY C C 81 173.540 173.540 175.944 -2.404 18517 8648 1 8 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.670 1.330 18517 8649 1 8 . 1 1 13 13 GLY H H 81 8.890 8.890 8.644 0.246 18517 8650 1 8 . 1 1 14 14 GLN C C 82 179.540 179.540 177.984 1.556 18517 8651 1 8 . 1 1 14 14 GLN CA C 82 58.710 58.710 59.025 -0.315 18517 8652 1 8 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.599 0.501 18517 8653 1 8 . 1 1 15 15 ARG N N 83 118.220 118.220 120.232 -2.012 18517 8654 1 8 . 1 1 15 15 ARG HA H 83 3.950 3.950 3.938 0.012 18517 8655 1 8 . 1 1 15 15 ARG C C 83 177.710 177.710 178.396 -0.686 18517 8656 1 8 . 1 1 15 15 ARG CA C 83 59.900 59.900 60.102 -0.202 18517 8657 1 8 . 1 1 15 15 ARG CB C 83 29.650 29.650 30.133 -0.483 18517 8658 1 8 . 1 1 15 15 ARG H H 83 7.320 7.320 8.547 -1.227 18517 8659 1 8 . 1 1 16 16 GLU N N 84 118.810 118.810 119.568 -0.758 18517 8660 1 8 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.103 -0.253 18517 8661 1 8 . 1 1 16 16 GLU C C 84 178.750 178.750 178.787 -0.037 18517 8662 1 8 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.510 1.500 18517 8663 1 8 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.585 -0.175 18517 8664 1 8 . 1 1 16 16 GLU H H 84 8.450 8.450 8.234 0.216 18517 8665 1 8 . 1 1 17 17 ALA N N 85 122.790 122.790 122.279 0.511 18517 8666 1 8 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.118 0.072 18517 8667 1 8 . 1 1 17 17 ALA C C 85 180.360 180.360 179.839 0.521 18517 8668 1 8 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.119 0.341 18517 8669 1 8 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.229 -0.149 18517 8670 1 8 . 1 1 17 17 ALA H H 85 8.420 8.420 8.213 0.207 18517 8671 1 8 . 1 1 18 18 PHE N N 86 119.400 119.400 120.367 -0.967 18517 8672 1 8 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.541 -0.251 18517 8673 1 8 . 1 1 18 18 PHE C C 86 177.560 177.560 177.939 -0.379 18517 8674 1 8 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.525 0.115 18517 8675 1 8 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.391 0.249 18517 8676 1 8 . 1 1 18 18 PHE H H 86 7.490 7.490 8.623 -1.133 18517 8677 1 8 . 1 1 19 19 LEU N N 87 117.470 117.470 119.732 -2.262 18517 8678 1 8 . 1 1 19 19 LEU HA H 87 4.070 4.070 4.065 0.005 18517 8679 1 8 . 1 1 19 19 LEU C C 87 178.880 178.880 178.643 0.237 18517 8680 1 8 . 1 1 19 19 LEU CA C 87 57.960 57.960 57.941 0.019 18517 8681 1 8 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.622 0.478 18517 8682 1 8 . 1 1 19 19 LEU H H 87 8.010 8.010 8.753 -0.743 18517 8683 1 8 . 1 1 20 20 SER N N 88 113.770 113.770 114.635 -0.865 18517 8684 1 8 . 1 1 20 20 SER HA H 88 4.070 4.070 4.095 -0.025 18517 8685 1 8 . 1 1 20 20 SER C C 88 175.680 175.680 176.668 -0.988 18517 8686 1 8 . 1 1 20 20 SER CA C 88 63.070 63.070 62.127 0.943 18517 8687 1 8 . 1 1 20 20 SER H H 88 8.100 8.100 8.421 -0.321 18517 8688 1 8 . 1 1 21 21 GLU N N 89 120.570 120.570 121.587 -1.017 18517 8689 1 8 . 1 1 21 21 GLU HA H 89 3.970 3.970 3.958 0.012 18517 8690 1 8 . 1 1 21 21 GLU C C 89 178.940 178.940 179.199 -0.259 18517 8691 1 8 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.426 -0.166 18517 8692 1 8 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.382 -0.052 18517 8693 1 8 . 1 1 21 21 GLU H H 89 7.400 7.400 7.895 -0.495 18517 8694 1 8 . 1 1 22 22 ILE N N 90 119.350 119.350 119.335 0.015 18517 8695 1 8 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.835 -0.145 18517 8696 1 8 . 1 1 22 22 ILE C C 90 177.230 177.230 178.545 -1.315 18517 8697 1 8 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.952 0.518 18517 8698 1 8 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.375 0.015 18517 8699 1 8 . 1 1 22 22 ILE H H 90 7.250 7.250 7.989 -0.739 18517 8700 1 8 . 1 1 23 23 ILE N N 91 116.350 116.350 119.903 -3.553 18517 8701 1 8 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.821 -0.421 18517 8702 1 8 . 1 1 23 23 ILE C C 91 176.690 176.690 176.880 -0.190 18517 8703 1 8 . 1 1 23 23 ILE CA C 91 65.730 65.730 62.959 2.771 18517 8704 1 8 . 1 1 23 23 ILE CB C 91 38.770 38.770 37.775 0.995 18517 8705 1 8 . 1 1 23 23 ILE H H 91 7.860 7.860 8.313 -0.453 18517 8706 1 8 . 1 1 24 24 LYS N N 92 116.000 116.000 118.381 -2.381 18517 8707 1 8 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.264 -0.124 18517 8708 1 8 . 1 1 24 24 LYS C C 92 176.270 176.270 176.880 -0.610 18517 8709 1 8 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.651 -0.171 18517 8710 1 8 . 1 1 24 24 LYS CB C 92 33.300 33.300 33.042 0.258 18517 8711 1 8 . 1 1 24 24 LYS H H 92 7.170 7.170 7.817 -0.647 18517 8712 1 8 . 1 1 25 25 SER N N 93 114.650 114.650 115.955 -1.305 18517 8713 1 8 . 1 1 25 25 SER HA H 93 4.550 4.550 4.450 0.100 18517 8714 1 8 . 1 1 25 25 SER C C 93 173.370 173.370 173.544 -0.174 18517 8715 1 8 . 1 1 25 25 SER CA C 93 57.240 57.240 59.341 -2.101 18517 8716 1 8 . 1 1 25 25 SER CB C 93 65.650 65.650 64.103 1.547 18517 8717 1 8 . 1 1 25 25 SER H H 93 7.730 7.730 7.834 -0.104 18517 8718 1 8 . 1 1 26 26 ASP N N 94 121.230 121.230 122.414 -1.184 18517 8719 1 8 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.786 0.144 18517 8720 1 8 . 1 1 26 26 ASP C C 94 176.560 176.560 176.093 0.467 18517 8721 1 8 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.879 0.631 18517 8722 1 8 . 1 1 26 26 ASP CB C 94 42.650 42.650 42.353 0.297 18517 8723 1 8 . 1 1 26 26 ASP H H 94 8.280 8.280 8.440 -0.160 18517 8724 1 8 . 1 1 27 27 GLY N N 95 109.310 109.310 108.804 0.506 18517 8725 1 8 . 1 1 27 27 GLY C C 95 171.080 171.080 171.642 -0.562 18517 8726 1 8 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.274 -0.504 18517 8727 1 8 . 1 1 27 27 GLY H H 95 8.160 8.160 7.676 0.484 18517 8728 1 8 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.533 0.607 18517 8729 1 8 . 1 1 29 29 PHE C C 97 175.230 175.230 175.017 0.213 18517 8730 1 8 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.498 -0.008 18517 8731 1 8 . 1 1 29 29 PHE CB C 97 41.620 41.620 41.027 0.593 18517 8732 1 8 . 1 1 30 30 THR N N 98 112.600 112.600 113.261 -0.661 18517 8733 1 8 . 1 1 30 30 THR HA H 98 4.570 4.570 4.167 0.403 18517 8734 1 8 . 1 1 30 30 THR C C 98 176.690 176.690 174.564 2.126 18517 8735 1 8 . 1 1 30 30 THR CA C 98 60.290 60.290 60.321 -0.030 18517 8736 1 8 . 1 1 30 30 THR CB C 98 71.600 71.600 69.879 1.721 18517 8737 1 8 . 1 1 30 30 THR H H 98 8.990 8.990 8.087 0.903 18517 8738 1 8 . 1 1 31 31 ILE N N 99 119.240 119.240 121.128 -1.888 18517 8739 1 8 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.860 -0.040 18517 8740 1 8 . 1 1 31 31 ILE C C 99 176.090 176.090 176.176 -0.086 18517 8741 1 8 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.037 -2.897 18517 8742 1 8 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.745 -0.795 18517 8743 1 8 . 1 1 31 31 ILE H H 99 9.230 9.230 7.848 1.382 18517 8744 1 8 . 1 1 32 32 LEU N N 100 119.660 119.660 118.920 0.740 18517 8745 1 8 . 1 1 32 32 LEU HA H 100 4.030 4.030 3.960 0.070 18517 8746 1 8 . 1 1 32 32 LEU C C 100 181.050 181.050 179.116 1.934 18517 8747 1 8 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.790 -0.230 18517 8748 1 8 . 1 1 32 32 LEU CB C 100 40.120 40.120 41.338 -1.218 18517 8749 1 8 . 1 1 32 32 LEU H H 100 7.310 7.310 7.966 -0.656 18517 8750 1 8 . 1 1 33 33 GLN N N 101 121.450 121.450 119.140 2.310 18517 8751 1 8 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.165 0.085 18517 8752 1 8 . 1 1 33 33 GLN CA C 101 59.700 59.700 58.625 1.075 18517 8753 1 8 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.279 3.510 18517 8754 1 8 . 1 1 33 33 GLN H H 101 7.790 7.790 7.656 0.134 18517 8755 1 8 . 1 1 34 34 LEU C C 102 178.590 178.590 178.793 -0.203 18517 8756 1 8 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.124 0.506 18517 8757 1 8 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.780 -0.470 18517 8758 1 8 . 1 1 35 35 VAL N N 103 118.520 118.520 114.537 3.983 18517 8759 1 8 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.677 -0.257 18517 8760 1 8 . 1 1 35 35 VAL C C 103 177.930 177.930 177.936 -0.006 18517 8761 1 8 . 1 1 35 35 VAL CA C 103 66.040 66.040 65.765 0.275 18517 8762 1 8 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.635 0.995 18517 8763 1 8 . 1 1 35 35 VAL H H 103 8.670 8.670 8.658 0.012 18517 8764 1 8 . 1 1 36 36 GLY N N 104 109.430 109.430 108.883 0.547 18517 8765 1 8 . 1 1 36 36 GLY C C 104 174.600 174.600 175.401 -0.801 18517 8766 1 8 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.078 0.962 18517 8767 1 8 . 1 1 36 36 GLY H H 104 7.880 7.880 8.261 -0.381 18517 8768 1 8 . 1 1 37 37 TYR N N 105 122.270 122.270 124.276 -2.006 18517 8769 1 8 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.371 -0.491 18517 8770 1 8 . 1 1 37 37 TYR C C 105 176.310 176.310 177.046 -0.736 18517 8771 1 8 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.259 3.841 18517 8772 1 8 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.694 -0.324 18517 8773 1 8 . 1 1 37 37 TYR H H 105 8.170 8.170 8.211 -0.041 18517 8774 1 8 . 1 1 38 38 LEU N N 106 120.100 120.100 121.279 -1.179 18517 8775 1 8 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.761 -0.021 18517 8776 1 8 . 1 1 38 38 LEU C C 106 178.280 178.280 178.382 -0.102 18517 8777 1 8 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.376 0.255 18517 8778 1 8 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.595 1.135 18517 8779 1 8 . 1 1 38 38 LEU H H 106 7.610 7.610 8.445 -0.835 18517 8780 1 8 . 1 1 39 39 ARG N N 107 116.670 116.670 118.250 -1.580 18517 8781 1 8 . 1 1 39 39 ARG HA H 107 3.680 3.680 4.221 -0.541 18517 8782 1 8 . 1 1 39 39 ARG C C 107 179.480 179.480 178.915 0.565 18517 8783 1 8 . 1 1 39 39 ARG CA C 107 59.580 59.580 59.163 0.417 18517 8784 1 8 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.832 1.408 18517 8785 1 8 . 1 1 39 39 ARG H H 107 8.240 8.240 7.798 0.442 18517 8786 1 8 . 1 1 40 40 VAL N N 108 121.970 121.970 119.824 2.146 18517 8787 1 8 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.664 -0.264 18517 8788 1 8 . 1 1 40 40 VAL C C 108 178.440 178.440 178.577 -0.137 18517 8789 1 8 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.801 1.149 18517 8790 1 8 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.642 -1.202 18517 8791 1 8 . 1 1 40 40 VAL H H 108 8.200 8.200 7.942 0.258 18517 8792 1 8 . 1 1 41 41 VAL N N 109 108.940 108.940 116.845 -7.905 18517 8793 1 8 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.501 0.739 18517 8794 1 8 . 1 1 41 41 VAL C C 109 175.070 175.070 177.459 -2.389 18517 8795 1 8 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.986 -3.396 18517 8796 1 8 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.831 -1.181 18517 8797 1 8 . 1 1 41 41 VAL H H 109 7.760 7.760 8.001 -0.241 18517 8798 1 8 . 1 1 42 42 ASP N N 110 124.670 124.670 122.335 2.335 18517 8799 1 8 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.267 0.353 18517 8800 1 8 . 1 1 42 42 ASP C C 110 177.310 177.310 178.621 -1.311 18517 8801 1 8 . 1 1 42 42 ASP CA C 110 59.980 59.980 58.533 1.447 18517 8802 1 8 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.732 4.218 18517 8803 1 8 . 1 1 42 42 ASP H H 110 7.360 7.360 8.445 -1.085 18517 8804 1 8 . 1 1 43 43 THR N N 111 102.340 102.340 112.906 -10.566 18517 8805 1 8 . 1 1 43 43 THR HA H 111 5.100 5.100 3.967 1.133 18517 8806 1 8 . 1 1 43 43 THR C C 111 174.940 174.940 176.708 -1.768 18517 8807 1 8 . 1 1 43 43 THR CA C 111 60.650 60.650 66.131 -5.481 18517 8808 1 8 . 1 1 43 43 THR CB C 111 69.610 69.610 68.570 1.040 18517 8809 1 8 . 1 1 43 43 THR H H 111 6.380 6.380 8.084 -1.704 18517 8810 1 8 . 1 1 44 44 ASP N N 112 119.750 119.750 123.211 -3.461 18517 8811 1 8 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.450 -0.590 18517 8812 1 8 . 1 1 44 44 ASP C C 112 178.850 178.850 178.478 0.372 18517 8813 1 8 . 1 1 44 44 ASP CA C 112 58.230 58.230 58.277 -0.047 18517 8814 1 8 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.557 -1.157 18517 8815 1 8 . 1 1 44 44 ASP H H 112 9.050 9.050 8.398 0.652 18517 8816 1 8 . 1 1 45 45 LEU N N 113 123.910 123.910 121.883 2.027 18517 8817 1 8 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.989 -0.179 18517 8818 1 8 . 1 1 45 45 LEU C C 113 182.040 182.040 177.946 4.094 18517 8819 1 8 . 1 1 45 45 LEU CA C 113 57.320 57.320 57.939 -0.619 18517 8820 1 8 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.801 -1.051 18517 8821 1 8 . 1 1 45 45 LEU H H 113 9.710 9.710 7.994 1.716 18517 8822 1 8 . 1 1 46 46 LEU N N 114 117.640 117.640 120.186 -2.546 18517 8823 1 8 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.102 0.008 18517 8824 1 8 . 1 1 46 46 LEU C C 114 179.540 179.540 178.698 0.842 18517 8825 1 8 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.965 -0.405 18517 8826 1 8 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.987 -0.517 18517 8827 1 8 . 1 1 46 46 LEU H H 114 8.270 8.270 8.186 0.084 18517 8828 1 8 . 1 1 47 47 LEU N N 115 116.520 116.520 115.127 1.393 18517 8829 1 8 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.441 -0.301 18517 8830 1 8 . 1 1 47 47 LEU C C 115 173.850 173.850 176.072 -2.222 18517 8831 1 8 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.398 1.022 18517 8832 1 8 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.244 3.476 18517 8833 1 8 . 1 1 47 47 LEU H H 115 8.160 8.160 8.105 0.055 18517 8834 1 8 . 1 1 48 48 LYS N N 116 114.710 114.710 116.400 -1.690 18517 8835 1 8 . 1 1 48 48 LYS HA H 116 3.810 3.810 4.085 -0.275 18517 8836 1 8 . 1 1 48 48 LYS C C 116 176.510 176.510 175.675 0.835 18517 8837 1 8 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.938 0.262 18517 8838 1 8 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.609 -0.589 18517 8839 1 8 . 1 1 48 48 LYS H H 116 7.580 7.580 7.845 -0.265 18517 8840 1 8 . 1 1 49 49 VAL N N 117 119.050 119.050 118.514 0.536 18517 8841 1 8 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.127 -0.517 18517 8842 1 8 . 1 1 49 49 VAL C C 117 175.860 175.860 176.069 -0.209 18517 8843 1 8 . 1 1 49 49 VAL CA C 117 63.510 63.510 60.920 2.590 18517 8844 1 8 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.800 -0.450 18517 8845 1 8 . 1 1 49 49 VAL H H 117 7.980 7.980 8.175 -0.195 18517 8846 1 8 . 1 1 50 50 ASP N N 118 126.900 126.900 122.137 4.763 18517 8847 1 8 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.398 -0.148 18517 8848 1 8 . 1 1 50 50 ASP C C 118 177.700 177.700 176.748 0.952 18517 8849 1 8 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.242 0.808 18517 8850 1 8 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.047 1.533 18517 8851 1 8 . 1 1 50 50 ASP H H 118 8.930 8.930 8.581 0.349 18517 8852 1 8 . 1 1 51 51 SER N N 119 124.790 124.790 121.550 3.240 18517 8853 1 8 . 1 1 51 51 SER HA H 119 4.070 4.070 4.283 -0.213 18517 8854 1 8 . 1 1 51 51 SER C C 119 177.220 177.220 176.104 1.116 18517 8855 1 8 . 1 1 51 51 SER CA C 119 61.640 61.640 61.250 0.390 18517 8856 1 8 . 1 1 51 51 SER CB C 119 63.510 63.510 63.332 0.178 18517 8857 1 8 . 1 1 51 51 SER H H 119 8.560 8.560 8.850 -0.290 18517 8858 1 8 . 1 1 52 52 THR N N 120 119.880 119.880 118.848 1.032 18517 8859 1 8 . 1 1 52 52 THR HA H 120 4.190 4.190 4.194 -0.004 18517 8860 1 8 . 1 1 52 52 THR C C 120 177.120 177.120 175.690 1.430 18517 8861 1 8 . 1 1 52 52 THR CA C 120 66.280 66.280 66.390 -0.110 18517 8862 1 8 . 1 1 52 52 THR CB C 120 68.420 68.420 68.466 -0.047 18517 8863 1 8 . 1 1 52 52 THR H H 120 8.310 8.310 8.649 -0.339 18517 8864 1 8 . 1 1 53 53 LYS N N 121 122.270 122.270 122.847 -0.577 18517 8865 1 8 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.164 -0.044 18517 8866 1 8 . 1 1 53 53 LYS C C 121 178.970 178.970 178.549 0.421 18517 8867 1 8 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.745 -0.164 18517 8868 1 8 . 1 1 53 53 LYS CB C 121 34.250 34.250 32.555 1.695 18517 8869 1 8 . 1 1 53 53 LYS H H 121 7.700 7.700 8.379 -0.679 18517 8870 1 8 . 1 1 54 54 VAL N N 122 120.070 120.070 115.805 4.265 18517 8871 1 8 . 1 1 54 54 VAL HA H 122 3.430 3.430 4.065 -0.635 18517 8872 1 8 . 1 1 54 54 VAL C C 122 179.860 179.860 177.974 1.886 18517 8873 1 8 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.266 3.314 18517 8874 1 8 . 1 1 54 54 VAL CB C 122 32.820 32.820 30.783 2.037 18517 8875 1 8 . 1 1 54 54 VAL H H 122 7.890 7.890 8.124 -0.234 18517 8876 1 8 . 1 1 55 55 ASP N N 123 122.270 122.270 121.903 0.367 18517 8877 1 8 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.315 0.155 18517 8878 1 8 . 1 1 55 55 ASP C C 123 178.630 178.630 178.221 0.409 18517 8879 1 8 . 1 1 55 55 ASP CA C 123 57.800 57.800 58.177 -0.377 18517 8880 1 8 . 1 1 55 55 ASP CB C 123 42.020 42.020 41.027 0.993 18517 8881 1 8 . 1 1 55 55 ASP H H 123 8.270 8.270 8.026 0.244 18517 8882 1 8 . 1 1 56 56 GLU N N 124 119.600 119.600 119.160 0.440 18517 8883 1 8 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.040 -0.070 18517 8884 1 8 . 1 1 56 56 GLU C C 124 179.920 179.920 179.076 0.844 18517 8885 1 8 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.156 0.904 18517 8886 1 8 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.434 0.535 18517 8887 1 8 . 1 1 56 56 GLU H H 124 8.610 8.610 8.294 0.316 18517 8888 1 8 . 1 1 57 57 ALA N N 125 120.070 120.070 121.476 -1.406 18517 8889 1 8 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.130 -0.300 18517 8890 1 8 . 1 1 57 57 ALA C C 125 178.760 178.760 179.619 -0.859 18517 8891 1 8 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.909 0.471 18517 8892 1 8 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.451 1.689 18517 8893 1 8 . 1 1 57 57 ALA H H 125 8.420 8.420 8.533 -0.113 18517 8894 1 8 . 1 1 58 58 GLY N N 126 106.740 106.740 106.264 0.476 18517 8895 1 8 . 1 1 58 58 GLY C C 126 175.740 175.740 175.936 -0.196 18517 8896 1 8 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.694 0.596 18517 8897 1 8 . 1 1 58 58 GLY H H 126 8.200 8.200 8.533 -0.333 18517 8898 1 8 . 1 1 59 59 LYS N N 127 120.920 120.920 122.112 -1.192 18517 8899 1 8 . 1 1 59 59 LYS HA H 127 3.930 3.930 3.991 -0.061 18517 8900 1 8 . 1 1 59 59 LYS C C 127 180.320 180.320 178.773 1.547 18517 8901 1 8 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.430 0.780 18517 8902 1 8 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.373 0.606 18517 8903 1 8 . 1 1 59 59 LYS H H 127 8.000 8.000 8.269 -0.269 18517 8904 1 8 . 1 1 60 60 LYS N N 128 118.400 118.400 118.914 -0.514 18517 8905 1 8 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.219 -0.049 18517 8906 1 8 . 1 1 60 60 LYS C C 128 180.030 180.030 179.063 0.967 18517 8907 1 8 . 1 1 60 60 LYS CA C 128 58.750 58.750 58.372 0.378 18517 8908 1 8 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.127 0.143 18517 8909 1 8 . 1 1 60 60 LYS H H 128 7.170 7.170 7.793 -0.623 18517 8910 1 8 . 1 1 61 61 VAL N N 129 121.050 121.050 120.983 0.067 18517 8911 1 8 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.522 -0.242 18517 8912 1 8 . 1 1 61 61 VAL C C 129 177.120 177.120 177.684 -0.564 18517 8913 1 8 . 1 1 61 61 VAL CA C 129 67.350 67.350 67.254 0.096 18517 8914 1 8 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.373 0.257 18517 8915 1 8 . 1 1 61 61 VAL H H 129 7.980 7.980 8.079 -0.099 18517 8916 1 8 . 1 1 62 62 LYS N N 130 120.040 120.040 119.913 0.127 18517 8917 1 8 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.929 -0.229 18517 8918 1 8 . 1 1 62 62 LYS C C 130 178.550 178.550 178.670 -0.120 18517 8919 1 8 . 1 1 62 62 LYS CA C 130 60.330 60.330 60.008 0.322 18517 8920 1 8 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.310 1.460 18517 8921 1 8 . 1 1 62 62 LYS H H 130 8.910 8.910 8.664 0.246 18517 8922 1 8 . 1 1 63 63 ALA N N 131 119.570 119.570 122.063 -2.493 18517 8923 1 8 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.075 0.145 18517 8924 1 8 . 1 1 63 63 ALA C C 131 180.520 180.520 179.629 0.891 18517 8925 1 8 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.072 0.148 18517 8926 1 8 . 1 1 63 63 ALA CB C 131 18.470 18.470 17.880 0.590 18517 8927 1 8 . 1 1 63 63 ALA H H 131 7.920 7.920 7.949 -0.029 18517 8928 1 8 . 1 1 64 64 TYR N N 132 120.510 120.510 120.467 0.043 18517 8929 1 8 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.156 0.304 18517 8930 1 8 . 1 1 64 64 TYR C C 132 176.510 176.510 177.802 -1.292 18517 8931 1 8 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.683 -0.043 18517 8932 1 8 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.671 0.019 18517 8933 1 8 . 1 1 64 64 TYR H H 132 7.930 7.930 8.150 -0.220 18517 8934 1 8 . 1 1 65 65 LEU N N 133 117.290 117.290 119.853 -2.563 18517 8935 1 8 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.655 0.185 18517 8936 1 8 . 1 1 65 65 LEU C C 133 178.610 178.610 178.674 -0.064 18517 8937 1 8 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.149 -0.429 18517 8938 1 8 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.866 -1.436 18517 8939 1 8 . 1 1 65 65 LEU H H 133 8.240 8.240 8.697 -0.457 18517 8940 1 8 . 1 1 66 66 GLU N N 134 119.140 119.140 118.194 0.946 18517 8941 1 8 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.158 -0.298 18517 8942 1 8 . 1 1 66 66 GLU C C 134 180.200 180.200 178.762 1.438 18517 8943 1 8 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.462 1.478 18517 8944 1 8 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.530 0.280 18517 8945 1 8 . 1 1 66 66 GLU H H 134 8.370 8.370 8.586 -0.216 18517 8946 1 8 . 1 1 67 67 LYS N N 135 121.390 121.390 120.776 0.614 18517 8947 1 8 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.083 -0.083 18517 8948 1 8 . 1 1 67 67 LYS C C 135 179.080 179.080 178.424 0.656 18517 8949 1 8 . 1 1 67 67 LYS CA C 135 59.620 59.620 59.026 0.594 18517 8950 1 8 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.455 -0.185 18517 8951 1 8 . 1 1 67 67 LYS H H 135 7.820 7.820 7.670 0.150 18517 8952 1 8 . 1 1 68 68 ILE N N 136 110.310 110.310 112.157 -1.847 18517 8953 1 8 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.034 0.266 18517 8954 1 8 . 1 1 68 68 ILE C C 136 175.520 175.520 176.876 -1.356 18517 8955 1 8 . 1 1 68 68 ILE CA C 136 62.430 62.430 62.176 0.254 18517 8956 1 8 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.779 -0.799 18517 8957 1 8 . 1 1 68 68 ILE H H 136 7.380 7.380 7.658 -0.278 18517 8958 1 8 . 1 1 69 69 GLY N N 137 106.680 106.680 108.021 -1.341 18517 8959 1 8 . 1 1 69 69 GLY C C 137 174.160 174.160 173.682 0.478 18517 8960 1 8 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.489 0.981 18517 8961 1 8 . 1 1 69 69 GLY H H 137 7.470 7.470 7.765 -0.295 18517 8962 1 8 . 1 1 70 70 ILE N N 138 124.310 124.310 122.186 2.124 18517 8963 1 8 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.402 -0.202 18517 8964 1 8 . 1 1 70 70 ILE C C 138 174.190 174.190 175.087 -0.897 18517 8965 1 8 . 1 1 70 70 ILE CA C 138 59.380 59.380 58.961 0.419 18517 8966 1 8 . 1 1 70 70 ILE CB C 138 37.340 37.340 37.832 -0.492 18517 8967 1 8 . 1 1 70 70 ILE H H 138 8.530 8.530 8.248 0.282 18517 8968 1 8 . 1 1 71 71 ARG N N 139 125.490 125.490 127.806 -2.316 18517 8969 1 8 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.492 0.128 18517 8970 1 8 . 1 1 71 71 ARG C C 139 175.750 175.750 175.280 0.470 18517 8971 1 8 . 1 1 71 71 ARG CA C 139 54.660 54.660 55.238 -0.578 18517 8972 1 8 . 1 1 71 71 ARG CB C 139 33.140 33.140 31.428 1.712 18517 8973 1 8 . 1 1 71 71 ARG H H 139 8.240 8.240 8.599 -0.359 18517 8974 1 8 . 1 1 72 72 GLY N N 140 104.750 104.750 110.275 -5.525 18517 8975 1 8 . 1 1 72 72 GLY C C 140 172.920 172.920 173.069 -0.149 18517 8976 1 8 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.879 0.551 18517 8977 1 8 . 1 1 72 72 GLY H H 140 7.900 7.900 8.411 -0.511 18517 8978 1 8 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.683 -0.173 18517 8979 1 8 . 1 1 73 73 ASP C C 141 175.060 175.060 175.933 -0.873 18517 8980 1 8 . 1 1 73 73 ASP CA C 141 56.170 56.170 55.194 0.976 18517 8981 1 8 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.525 -0.695 18517 8982 1 8 . 1 1 74 74 SER N N 142 110.240 110.240 114.550 -4.310 18517 8983 1 8 . 1 1 74 74 SER HA H 142 4.740 4.740 4.774 -0.034 18517 8984 1 8 . 1 1 74 74 SER C C 142 175.110 175.110 175.533 -0.423 18517 8985 1 8 . 1 1 74 74 SER CA C 142 55.700 55.700 56.828 -1.128 18517 8986 1 8 . 1 1 74 74 SER CB C 142 67.390 67.390 65.071 2.319 18517 8987 1 8 . 1 1 74 74 SER H H 142 7.560 7.560 7.951 -0.391 18517 8988 1 8 . 1 1 75 75 VAL N N 143 122.950 122.950 121.844 1.106 18517 8989 1 8 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.778 -0.048 18517 8990 1 8 . 1 1 75 75 VAL C C 143 176.230 176.230 176.826 -0.596 18517 8991 1 8 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.856 0.784 18517 8992 1 8 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.825 -0.585 18517 8993 1 8 . 1 1 75 75 VAL H H 143 9.470 9.470 8.788 0.682 18517 8994 1 8 . 1 1 76 76 GLU N N 144 121.390 121.390 121.319 0.071 18517 8995 1 8 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.106 -0.466 18517 8996 1 8 . 1 1 76 76 GLU C C 144 176.880 176.880 177.761 -0.881 18517 8997 1 8 . 1 1 76 76 GLU CA C 144 63.310 63.310 58.982 4.328 18517 8998 1 8 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.393 -0.324 18517 8999 1 8 . 1 1 76 76 GLU H H 144 9.640 9.640 8.368 1.272 18517 9000 1 8 . 1 1 77 77 ALA N N 145 118.770 118.770 122.013 -3.243 18517 9001 1 8 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.238 0.022 18517 9002 1 8 . 1 1 77 77 ALA C C 145 180.350 180.350 179.630 0.720 18517 9003 1 8 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.233 0.548 18517 9004 1 8 . 1 1 77 77 ALA CB C 145 19.190 19.190 17.985 1.205 18517 9005 1 8 . 1 1 77 77 ALA H H 145 7.860 7.860 8.149 -0.289 18517 9006 1 8 . 1 1 78 78 ALA N N 146 120.920 120.920 122.964 -2.044 18517 9007 1 8 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.038 0.102 18517 9008 1 8 . 1 1 78 78 ALA C C 146 179.150 179.150 179.242 -0.092 18517 9009 1 8 . 1 1 78 78 ALA CA C 146 55.260 55.260 55.188 0.072 18517 9010 1 8 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.799 -0.009 18517 9011 1 8 . 1 1 78 78 ALA H H 146 8.110 8.110 8.347 -0.237 18517 9012 1 8 . 1 1 79 79 LEU N N 147 118.810 118.810 115.903 2.907 18517 9013 1 8 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.140 -0.260 18517 9014 1 8 . 1 1 79 79 LEU C C 147 179.080 179.080 178.726 0.354 18517 9015 1 8 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.739 0.651 18517 9016 1 8 . 1 1 79 79 LEU CB C 147 42.260 42.260 40.978 1.282 18517 9017 1 8 . 1 1 79 79 LEU H H 147 8.360 8.360 8.077 0.283 18517 9018 1 8 . 1 1 80 80 ASP N N 148 121.620 121.620 120.200 1.420 18517 9019 1 8 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.320 0.200 18517 9020 1 8 . 1 1 80 80 ASP C C 148 178.800 178.800 178.180 0.620 18517 9021 1 8 . 1 1 80 80 ASP CA C 148 58.390 58.390 57.942 0.448 18517 9022 1 8 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.718 0.032 18517 9023 1 8 . 1 1 80 80 ASP H H 148 8.770 8.770 8.423 0.347 18517 9024 1 8 . 1 1 81 81 ASN N N 149 118.630 118.630 119.204 -0.574 18517 9025 1 8 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.505 0.065 18517 9026 1 8 . 1 1 81 81 ASN C C 149 177.970 177.970 177.917 0.053 18517 9027 1 8 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.144 -0.134 18517 9028 1 8 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.442 0.168 18517 9029 1 8 . 1 1 81 81 ASN H H 149 7.960 7.960 7.944 0.016 18517 9030 1 8 . 1 1 82 82 LEU N N 150 120.030 120.030 120.279 -0.249 18517 9031 1 8 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.928 0.132 18517 9032 1 8 . 1 1 82 82 LEU C C 150 177.790 177.790 178.988 -1.198 18517 9033 1 8 . 1 1 82 82 LEU CA C 150 58.870 58.870 57.765 1.105 18517 9034 1 8 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.718 0.142 18517 9035 1 8 . 1 1 82 82 LEU H H 150 8.230 8.230 8.176 0.054 18517 9036 1 8 . 1 1 83 83 MET N N 151 115.820 115.820 119.524 -3.704 18517 9037 1 8 . 1 1 83 83 MET HA H 151 4.390 4.390 3.967 0.423 18517 9038 1 8 . 1 1 83 83 MET C C 151 179.760 179.760 178.216 1.544 18517 9039 1 8 . 1 1 83 83 MET CA C 151 57.400 57.400 58.118 -0.718 18517 9040 1 8 . 1 1 83 83 MET CB C 151 31.080 31.080 32.153 -1.073 18517 9041 1 8 . 1 1 83 83 MET H H 151 8.800 8.800 8.036 0.764 18517 9042 1 8 . 1 1 84 84 ILE N N 152 120.330 120.330 120.270 0.060 18517 9043 1 8 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.625 0.215 18517 9044 1 8 . 1 1 84 84 ILE C C 152 178.660 178.660 177.939 0.721 18517 9045 1 8 . 1 1 84 84 ILE CA C 152 65.800 65.800 65.749 0.051 18517 9046 1 8 . 1 1 84 84 ILE CB C 152 38.450 38.450 37.324 1.126 18517 9047 1 8 . 1 1 84 84 ILE H H 152 8.540 8.540 8.635 -0.095 18517 9048 1 8 . 1 1 85 85 LYS N N 153 118.930 118.930 119.969 -1.039 18517 9049 1 8 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.280 -0.080 18517 9050 1 8 . 1 1 85 85 LYS C C 153 179.650 179.650 179.526 0.124 18517 9051 1 8 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.783 1.197 18517 9052 1 8 . 1 1 85 85 LYS CB C 153 33.540 33.540 31.726 1.814 18517 9053 1 8 . 1 1 85 85 LYS H H 153 7.510 7.510 8.182 -0.672 18517 9054 1 8 . 1 1 86 86 VAL N N 154 119.810 119.810 119.799 0.011 18517 9055 1 8 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.675 -0.045 18517 9056 1 8 . 1 1 86 86 VAL C C 154 178.350 178.350 178.220 0.130 18517 9057 1 8 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.284 0.946 18517 9058 1 8 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.116 1.624 18517 9059 1 8 . 1 1 86 86 VAL H H 154 8.740 8.740 8.074 0.666 18517 9060 1 8 . 1 1 87 87 TYR N N 155 118.370 118.370 118.612 -0.242 18517 9061 1 8 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.250 0.020 18517 9062 1 8 . 1 1 87 87 TYR C C 155 178.580 178.580 178.825 -0.245 18517 9063 1 8 . 1 1 87 87 TYR CA C 155 62.910 62.910 60.594 2.316 18517 9064 1 8 . 1 1 87 87 TYR CB C 155 37.980 37.980 36.898 1.083 18517 9065 1 8 . 1 1 87 87 TYR H H 155 8.520 8.520 8.139 0.381 18517 9066 1 8 . 1 1 88 88 GLU N N 156 119.900 119.900 120.269 -0.369 18517 9067 1 8 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.025 0.155 18517 9068 1 8 . 1 1 88 88 GLU C C 156 179.270 179.270 179.180 0.090 18517 9069 1 8 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.810 -0.430 18517 9070 1 8 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.454 0.756 18517 9071 1 8 . 1 1 88 88 GLU H H 156 8.250 8.250 8.833 -0.583 18517 9072 1 8 . 1 1 89 89 ILE N N 157 119.510 119.510 118.139 1.371 18517 9073 1 8 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.961 0.119 18517 9074 1 8 . 1 1 89 89 ILE C C 157 177.890 177.890 178.068 -0.178 18517 9075 1 8 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.191 0.119 18517 9076 1 8 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.381 0.829 18517 9077 1 8 . 1 1 89 89 ILE H H 157 7.630 7.630 7.827 -0.197 18517 9078 1 8 . 1 1 90 90 THR N N 158 114.240 114.240 114.047 0.193 18517 9079 1 8 . 1 1 90 90 THR HA H 158 4.130 4.130 4.128 0.002 18517 9080 1 8 . 1 1 90 90 THR C C 158 175.530 175.530 175.616 -0.086 18517 9081 1 8 . 1 1 90 90 THR CA C 158 64.460 64.460 65.603 -1.143 18517 9082 1 8 . 1 1 90 90 THR CB C 158 69.610 69.610 69.047 0.563 18517 9083 1 8 . 1 1 90 90 THR H H 158 7.770 7.770 8.198 -0.428 18517 9084 1 8 . 1 1 91 91 LYS N N 159 120.280 120.280 120.382 -0.102 18517 9085 1 8 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.403 -0.093 18517 9086 1 8 . 1 1 91 91 LYS C C 159 177.420 177.420 177.208 0.212 18517 9087 1 8 . 1 1 91 91 LYS CA C 159 57.400 57.400 56.370 1.030 18517 9088 1 8 . 1 1 91 91 LYS CB C 159 33.220 33.220 34.157 -0.937 18517 9089 1 8 . 1 1 91 91 LYS H H 159 7.890 7.890 8.077 -0.187 18517 9090 1 8 . 1 1 92 92 GLY N N 160 107.910 107.910 111.082 -3.172 18517 9091 1 8 . 1 1 92 92 GLY C C 160 174.430 174.430 174.142 0.288 18517 9092 1 8 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.110 0.870 18517 9093 1 8 . 1 1 92 92 GLY H H 160 7.930 7.930 7.889 0.041 18517 9094 1 8 . 1 1 93 93 THR N N 161 113.570 113.570 116.566 -2.996 18517 9095 1 8 . 1 1 93 93 THR HA H 161 4.390 4.390 4.497 -0.107 18517 9096 1 8 . 1 1 93 93 THR C C 161 174.790 174.790 173.153 1.637 18517 9097 1 8 . 1 1 93 93 THR CA C 161 61.960 61.960 61.473 0.487 18517 9098 1 8 . 1 1 93 93 THR CB C 161 70.010 70.010 72.381 -2.371 18517 9099 1 8 . 1 1 93 93 THR H H 161 7.970 7.970 8.124 -0.154 18517 9100 1 8 . 1 1 94 94 VAL N N 162 121.980 121.980 122.699 -0.719 18517 9101 1 8 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.649 -0.529 18517 9102 1 8 . 1 1 94 94 VAL C C 162 176.300 176.300 176.453 -0.153 18517 9103 1 8 . 1 1 94 94 VAL CA C 162 62.830 62.830 60.635 2.195 18517 9104 1 8 . 1 1 94 94 VAL CB C 162 33.060 33.060 34.148 -1.088 18517 9105 1 8 . 1 1 94 94 VAL H H 162 8.130 8.130 8.412 -0.282 18517 9106 1 8 . 1 1 95 95 GLU N N 163 124.140 124.140 126.352 -2.212 18517 9107 1 8 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.267 0.043 18517 9108 1 8 . 1 1 95 95 GLU C C 163 176.870 176.870 176.958 -0.088 18517 9109 1 8 . 1 1 95 95 GLU CA C 163 57.080 57.080 56.544 0.536 18517 9110 1 8 . 1 1 95 95 GLU CB C 163 30.440 30.440 29.796 0.644 18517 9111 1 8 . 1 1 95 95 GLU H H 163 8.490 8.490 9.664 -1.174 18517 9112 1 8 . 1 1 96 96 SER N N 164 116.800 116.800 114.532 2.268 18517 9113 1 8 . 1 1 96 96 SER HA H 164 4.430 4.430 4.175 0.255 18517 9114 1 8 . 1 1 96 96 SER C C 164 174.940 174.940 173.364 1.576 18517 9115 1 8 . 1 1 96 96 SER CA C 164 59.070 59.070 57.838 1.232 18517 9116 1 8 . 1 1 96 96 SER CB C 164 64.220 64.220 62.801 1.419 18517 9117 1 8 . 1 1 96 96 SER H H 164 8.300 8.300 8.248 0.052 18517 9118 1 8 . 1 1 97 97 SER C C 165 174.660 174.660 173.721 0.939 18517 9119 1 8 . 1 1 97 97 SER CA C 165 58.870 58.870 59.118 -0.248 18517 9120 1 8 . 1 1 97 97 SER CB C 165 64.060 64.060 63.255 0.805 18517 9121 1 8 . 1 1 98 98 ALA N N 166 125.490 125.490 128.390 -2.900 18517 9122 1 8 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.499 -0.149 18517 9123 1 8 . 1 1 98 98 ALA C C 166 177.780 177.780 177.912 -0.132 18517 9124 1 8 . 1 1 98 98 ALA CA C 166 53.000 53.000 52.058 0.942 18517 9125 1 8 . 1 1 98 98 ALA CB C 166 19.340 19.340 20.554 -1.214 18517 9126 1 8 . 1 1 98 98 ALA H H 166 8.180 8.180 8.346 -0.166 18517 9127 1 8 . 1 1 99 99 GLN N N 167 118.690 118.690 121.361 -2.671 18517 9128 1 8 . 1 1 99 99 GLN HA H 167 4.340 4.340 3.954 0.386 18517 9129 1 8 . 1 1 99 99 GLN C C 167 176.680 176.680 177.031 -0.351 18517 9130 1 8 . 1 1 99 99 GLN CA C 167 56.250 56.250 58.143 -1.893 18517 9131 1 8 . 1 1 99 99 GLN CB C 167 29.650 29.650 27.094 2.556 18517 9132 1 8 . 1 1 99 99 GLN H H 167 8.170 8.170 9.095 -0.925 18517 9133 1 8 . 1 1 100 100 GLY N N 168 109.670 109.670 108.919 0.751 18517 9134 1 8 . 1 1 100 100 GLY C C 168 174.460 174.460 173.727 0.733 18517 9135 1 8 . 1 1 100 100 GLY CA C 168 45.670 45.670 44.463 1.207 18517 9136 1 8 . 1 1 100 100 GLY H H 168 8.250 8.250 8.077 0.173 18517 9137 1 8 . 1 1 101 101 THR N N 169 112.660 112.660 115.478 -2.818 18517 9138 1 8 . 1 1 101 101 THR HA H 169 4.360 4.360 4.321 0.039 18517 9139 1 8 . 1 1 101 101 THR C C 169 174.720 174.720 174.248 0.472 18517 9140 1 8 . 1 1 101 101 THR CA C 169 62.080 62.080 61.999 0.081 18517 9141 1 8 . 1 1 101 101 THR CB C 169 69.930 69.930 69.696 0.234 18517 9142 1 8 . 1 1 101 101 THR H H 169 8.070 8.070 7.584 0.486 18517 9143 1 8 . 1 1 102 102 ASP N N 170 123.090 123.090 125.357 -2.267 18517 9144 1 8 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.760 -0.060 18517 9145 1 8 . 1 1 102 102 ASP C C 170 176.130 176.130 175.167 0.963 18517 9146 1 8 . 1 1 102 102 ASP CA C 170 54.780 54.780 52.846 1.934 18517 9147 1 8 . 1 1 102 102 ASP CB C 170 42.260 42.260 42.201 0.059 18517 9148 1 8 . 1 1 102 102 ASP H H 170 8.170 8.170 8.294 -0.124 18517 9149 1 8 . 1 1 103 103 SER N N 171 117.110 117.110 112.612 4.498 18517 9150 1 8 . 1 1 103 103 SER HA H 171 4.430 4.430 4.509 -0.079 18517 9151 1 8 . 1 1 103 103 SER C C 171 174.770 174.770 174.464 0.306 18517 9152 1 8 . 1 1 103 103 SER CA C 171 57.960 57.960 56.868 1.092 18517 9153 1 8 . 1 1 103 103 SER CB C 171 64.940 64.940 65.061 -0.121 18517 9154 1 8 . 1 1 103 103 SER H H 171 8.450 8.450 8.061 0.389 18517 9155 1 8 . 1 1 104 104 GLU N N 172 122.970 122.970 121.828 1.142 18517 9156 1 8 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.937 0.093 18517 9157 1 8 . 1 1 104 104 GLU C C 172 178.860 178.860 178.081 0.779 18517 9158 1 8 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.529 -0.829 18517 9159 1 8 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.712 -0.062 18517 9160 1 8 . 1 1 104 104 GLU H H 172 8.830 8.830 9.002 -0.172 18517 9161 1 8 . 1 1 105 105 GLU N N 173 119.750 119.750 118.789 0.961 18517 9162 1 8 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.056 -0.076 18517 9163 1 8 . 1 1 105 105 GLU C C 173 178.920 178.920 178.960 -0.040 18517 9164 1 8 . 1 1 105 105 GLU CA C 173 60.060 60.060 58.945 1.115 18517 9165 1 8 . 1 1 105 105 GLU CB C 173 29.730 29.730 29.180 0.550 18517 9166 1 8 . 1 1 105 105 GLU H H 173 8.580 8.580 8.723 -0.143 18517 9167 1 8 . 1 1 106 106 LEU N N 174 121.860 121.860 119.736 2.124 18517 9168 1 8 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.105 0.075 18517 9169 1 8 . 1 1 106 106 LEU C C 174 178.210 178.210 178.900 -0.690 18517 9170 1 8 . 1 1 106 106 LEU CA C 174 57.880 57.880 56.982 0.898 18517 9171 1 8 . 1 1 106 106 LEU CB C 174 41.150 41.150 40.933 0.217 18517 9172 1 8 . 1 1 106 106 LEU H H 174 7.920 7.920 7.647 0.273 18517 9173 1 8 . 1 1 107 107 LYS N N 175 118.740 118.740 120.215 -1.475 18517 9174 1 8 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.967 -0.187 18517 9175 1 8 . 1 1 107 107 LYS C C 175 178.700 178.700 179.048 -0.348 18517 9176 1 8 . 1 1 107 107 LYS CA C 175 61.170 61.170 60.360 0.810 18517 9177 1 8 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.217 0.213 18517 9178 1 8 . 1 1 107 107 LYS H H 175 8.340 8.340 8.690 -0.350 18517 9179 1 8 . 1 1 108 108 THR N N 176 113.820 113.820 117.368 -3.548 18517 9180 1 8 . 1 1 108 108 THR HA H 176 3.840 3.840 3.977 -0.137 18517 9181 1 8 . 1 1 108 108 THR C C 176 176.620 176.620 176.643 -0.023 18517 9182 1 8 . 1 1 108 108 THR CA C 176 66.910 66.910 66.528 0.382 18517 9183 1 8 . 1 1 108 108 THR CB C 176 69.610 69.610 68.755 0.855 18517 9184 1 8 . 1 1 108 108 THR H H 176 7.950 7.950 8.347 -0.397 18517 9185 1 8 . 1 1 109 109 LEU N N 177 124.380 124.380 122.968 1.412 18517 9186 1 8 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.125 -0.295 18517 9187 1 8 . 1 1 109 109 LEU C C 177 177.790 177.790 177.868 -0.078 18517 9188 1 8 . 1 1 109 109 LEU CA C 177 57.990 57.990 58.001 -0.010 18517 9189 1 8 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.233 1.347 18517 9190 1 8 . 1 1 109 109 LEU H H 177 7.480 7.480 7.971 -0.491 18517 9191 1 8 . 1 1 110 110 LEU N N 178 117.230 117.230 118.950 -1.720 18517 9192 1 8 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.826 0.014 18517 9193 1 8 . 1 1 110 110 LEU C C 178 179.540 179.540 179.802 -0.262 18517 9194 1 8 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.840 0.550 18517 9195 1 8 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.532 0.808 18517 9196 1 8 . 1 1 110 110 LEU H H 178 8.670 8.670 7.987 0.683 18517 9197 1 8 . 1 1 111 111 LEU N N 179 119.230 119.230 121.064 -1.834 18517 9198 1 8 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.414 -0.334 18517 9199 1 8 . 1 1 111 111 LEU C C 179 179.310 179.310 179.490 -0.180 18517 9200 1 8 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.042 1.348 18517 9201 1 8 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.724 1.296 18517 9202 1 8 . 1 1 111 111 LEU H H 179 7.940 7.940 8.810 -0.870 18517 9203 1 8 . 1 1 112 112 LYS N N 180 121.910 121.910 121.417 0.493 18517 9204 1 8 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.127 0.063 18517 9205 1 8 . 1 1 112 112 LYS C C 180 178.740 178.740 179.100 -0.360 18517 9206 1 8 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.036 0.144 18517 9207 1 8 . 1 1 112 112 LYS CB C 180 31.870 31.870 31.954 -0.084 18517 9208 1 8 . 1 1 112 112 LYS H H 180 7.420 7.420 8.099 -0.679 18517 9209 1 8 . 1 1 113 113 PHE N N 181 118.220 118.220 118.894 -0.674 18517 9210 1 8 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.240 0.510 18517 9211 1 8 . 1 1 113 113 PHE C C 181 178.520 178.520 177.962 0.558 18517 9212 1 8 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.599 -3.519 18517 9213 1 8 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.364 -0.384 18517 9214 1 8 . 1 1 113 113 PHE H H 181 9.000 9.000 8.651 0.349 18517 9215 1 8 . 1 1 114 114 SER N N 182 113.300 113.300 114.416 -1.116 18517 9216 1 8 . 1 1 114 114 SER HA H 182 3.930 3.930 4.142 -0.212 18517 9217 1 8 . 1 1 114 114 SER C C 182 177.080 177.080 177.088 -0.008 18517 9218 1 8 . 1 1 114 114 SER CA C 182 62.000 62.000 62.136 -0.136 18517 9219 1 8 . 1 1 114 114 SER CB C 182 63.510 63.510 62.831 0.679 18517 9220 1 8 . 1 1 114 114 SER H H 182 8.620 8.620 8.632 -0.012 18517 9221 1 8 . 1 1 115 115 GLU N N 183 121.540 121.540 122.353 -0.813 18517 9222 1 8 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.114 -0.044 18517 9223 1 8 . 1 1 115 115 GLU C C 183 179.860 179.860 178.490 1.370 18517 9224 1 8 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.166 0.613 18517 9225 1 8 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.411 0.479 18517 9226 1 8 . 1 1 115 115 GLU H H 183 8.250 8.250 8.373 -0.123 18517 9227 1 8 . 1 1 116 116 ASP N N 184 121.740 121.740 120.304 1.436 18517 9228 1 8 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.348 0.162 18517 9229 1 8 . 1 1 116 116 ASP C C 184 179.570 179.570 178.486 1.084 18517 9230 1 8 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.629 -0.069 18517 9231 1 8 . 1 1 116 116 ASP CB C 184 40.990 40.990 41.117 -0.127 18517 9232 1 8 . 1 1 116 116 ASP H H 184 8.840 8.840 8.486 0.354 18517 9233 1 8 . 1 1 117 117 LEU N N 185 121.420 121.420 121.245 0.175 18517 9234 1 8 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.091 0.039 18517 9235 1 8 . 1 1 117 117 LEU C C 185 178.840 178.840 178.702 0.138 18517 9236 1 8 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.043 0.187 18517 9237 1 8 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.944 0.706 18517 9238 1 8 . 1 1 117 117 LEU H H 185 8.350 8.350 8.089 0.261 18517 9239 1 8 . 1 1 118 118 LYS N N 186 119.640 119.640 118.936 0.704 18517 9240 1 8 . 1 1 118 118 LYS HA H 186 4.120 4.120 4.033 0.087 18517 9241 1 8 . 1 1 118 118 LYS C C 186 178.820 178.820 178.639 0.181 18517 9242 1 8 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.274 0.466 18517 9243 1 8 . 1 1 118 118 LYS CB C 186 32.510 32.510 31.872 0.638 18517 9244 1 8 . 1 1 118 118 LYS H H 186 8.220 8.220 8.485 -0.265 18517 9245 1 8 . 1 1 119 119 ALA N N 187 120.160 120.160 122.316 -2.156 18517 9246 1 8 . 1 1 119 119 ALA HA H 187 4.160 4.160 3.981 0.179 18517 9247 1 8 . 1 1 119 119 ALA C C 187 180.450 180.450 179.410 1.040 18517 9248 1 8 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.628 -0.488 18517 9249 1 8 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.436 0.034 18517 9250 1 8 . 1 1 119 119 ALA H H 187 8.010 8.010 8.291 -0.281 18517 9251 1 8 . 1 1 120 120 GLU N N 188 117.930 117.930 118.121 -0.191 18517 9252 1 8 . 1 1 120 120 GLU HA H 188 4.180 4.180 3.887 0.293 18517 9253 1 8 . 1 1 120 120 GLU C C 188 178.780 178.780 179.335 -0.555 18517 9254 1 8 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.281 -0.451 18517 9255 1 8 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.387 0.583 18517 9256 1 8 . 1 1 120 120 GLU H H 188 7.640 7.640 8.055 -0.415 18517 9257 1 8 . 1 1 121 121 GLN N N 189 117.230 117.230 119.244 -2.014 18517 9258 1 8 . 1 1 121 121 GLN HA H 189 4.230 4.230 3.739 0.491 18517 9259 1 8 . 1 1 121 121 GLN C C 189 179.190 179.190 178.104 1.086 18517 9260 1 8 . 1 1 121 121 GLN CA C 189 59.740 59.740 59.270 0.470 18517 9261 1 8 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.837 0.813 18517 9262 1 8 . 1 1 121 121 GLN H H 189 8.280 8.280 8.379 -0.099 18517 9263 1 8 . 1 1 122 122 GLU N N 190 118.340 118.340 119.902 -1.562 18517 9264 1 8 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.960 0.160 18517 9265 1 8 . 1 1 122 122 GLU C C 190 178.210 178.210 179.158 -0.948 18517 9266 1 8 . 1 1 122 122 GLU CA C 190 58.750 58.750 59.001 -0.251 18517 9267 1 8 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.289 0.681 18517 9268 1 8 . 1 1 122 122 GLU H H 190 8.250 8.250 8.023 0.227 18517 9269 1 8 . 1 1 123 123 LEU N N 191 118.930 118.930 120.593 -1.663 18517 9270 1 8 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.941 0.149 18517 9271 1 8 . 1 1 123 123 LEU C C 191 178.500 178.500 179.044 -0.544 18517 9272 1 8 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.365 -1.365 18517 9273 1 8 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.349 1.151 18517 9274 1 8 . 1 1 123 123 LEU H H 191 7.530 7.530 8.233 -0.703 18517 9275 1 8 . 1 1 124 124 HIS N N 192 115.650 115.650 118.781 -3.131 18517 9276 1 8 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.229 0.491 18517 9277 1 8 . 1 1 124 124 HIS C C 192 176.090 176.090 177.430 -1.340 18517 9278 1 8 . 1 1 124 124 HIS CA C 192 56.690 56.690 59.229 -2.539 18517 9279 1 8 . 1 1 124 124 HIS CB C 192 30.760 30.760 29.983 0.777 18517 9280 1 8 . 1 1 124 124 HIS H H 192 7.450 7.450 8.210 -0.760 18517 9281 1 8 . 1 1 125 125 SER N N 193 115.480 115.480 115.351 0.129 18517 9282 1 8 . 1 1 125 125 SER HA H 193 4.310 4.310 4.013 0.297 18517 9283 1 8 . 1 1 125 125 SER CA C 193 60.180 60.180 61.667 -1.487 18517 9284 1 8 . 1 1 125 125 SER CB C 193 64.060 64.060 62.480 1.580 18517 9285 1 8 . 1 1 125 125 SER H H 193 8.020 8.020 8.163 -0.143 18517 9286 1 8 . 1 1 126 126 GLU C C 194 177.410 177.410 179.124 -1.714 18517 9287 1 8 . 1 1 126 126 GLU CA C 194 57.840 57.840 59.121 -1.281 18517 9288 1 8 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.600 0.290 18517 9289 1 8 . 1 1 127 127 ALA N N 195 122.910 122.910 122.918 -0.008 18517 9290 1 8 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.060 0.130 18517 9291 1 8 . 1 1 127 127 ALA C C 195 178.610 178.610 179.218 -0.608 18517 9292 1 8 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.820 -1.030 18517 9293 1 8 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.657 0.603 18517 9294 1 8 . 1 1 127 127 ALA H H 195 8.020 8.020 7.854 0.166 18517 9295 1 8 . 1 1 128 128 LYS N N 196 117.770 117.770 117.820 -0.050 18517 9296 1 8 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.186 0.074 18517 9297 1 8 . 1 1 128 128 LYS C C 196 177.400 177.400 176.471 0.929 18517 9298 1 8 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.141 2.859 18517 9299 1 8 . 1 1 128 128 LYS CB C 196 32.740 32.740 32.597 0.143 18517 9300 1 8 . 1 1 128 128 LYS H H 196 7.990 7.990 7.838 0.152 18517 9301 1 8 . 1 1 129 129 GLY N N 197 109.010 109.010 107.923 1.087 18517 9302 1 8 . 1 1 129 129 GLY C C 197 175.770 175.770 175.396 0.374 18517 9303 1 8 . 1 1 129 129 GLY CA C 197 46.100 46.100 44.954 1.146 18517 9304 1 8 . 1 1 129 129 GLY H H 197 8.220 8.220 7.478 0.742 18517 9305 1 8 . 1 1 130 130 GLY N N 198 109.150 109.150 109.050 0.100 18517 9306 1 8 . 1 1 130 130 GLY C C 198 174.760 174.760 175.435 -0.675 18517 9307 1 8 . 1 1 130 130 GLY CA C 198 46.930 46.930 46.777 0.153 18517 9308 1 8 . 1 1 130 130 GLY H H 198 8.210 8.210 8.909 -0.699 18517 9309 1 8 . 1 1 131 131 GLU N N 199 121.560 121.560 122.133 -0.573 18517 9310 1 8 . 1 1 131 131 GLU HA H 199 4.020 4.020 3.932 0.088 18517 9311 1 8 . 1 1 131 131 GLU C C 199 178.500 178.500 178.948 -0.448 18517 9312 1 8 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.333 0.567 18517 9313 1 8 . 1 1 131 131 GLU CB C 199 29.570 29.570 29.319 0.251 18517 9314 1 8 . 1 1 131 131 GLU H H 199 8.510 8.510 8.483 0.027 18517 9315 1 8 . 1 1 132 132 ALA N N 200 122.390 122.390 122.711 -0.321 18517 9316 1 8 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.113 0.087 18517 9317 1 8 . 1 1 132 132 ALA C C 200 180.360 180.360 179.592 0.768 18517 9318 1 8 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.792 -0.012 18517 9319 1 8 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.472 -0.082 18517 9320 1 8 . 1 1 132 132 ALA H H 200 8.190 8.190 7.580 0.610 18517 9321 1 8 . 1 1 133 133 LEU N N 201 120.800 120.800 119.817 0.983 18517 9322 1 8 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.017 0.193 18517 9323 1 8 . 1 1 133 133 LEU C C 201 179.270 179.270 179.157 0.113 18517 9324 1 8 . 1 1 133 133 LEU CA C 201 57.680 57.680 58.600 -0.920 18517 9325 1 8 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.523 0.657 18517 9326 1 8 . 1 1 133 133 LEU H H 201 7.720 7.720 8.135 -0.415 18517 9327 1 8 . 1 1 134 134 LEU N N 202 120.680 120.680 120.306 0.374 18517 9328 1 8 . 1 1 134 134 LEU HA H 202 3.980 3.980 4.008 -0.028 18517 9329 1 8 . 1 1 134 134 LEU C C 202 179.030 179.030 178.581 0.449 18517 9330 1 8 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.615 0.815 18517 9331 1 8 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.234 0.385 18517 9332 1 8 . 1 1 134 134 LEU H H 202 8.470 8.470 8.654 -0.184 18517 9333 1 8 . 1 1 135 135 SER N N 203 113.290 113.290 115.419 -2.129 18517 9334 1 8 . 1 1 135 135 SER HA H 203 4.180 4.180 4.087 0.093 18517 9335 1 8 . 1 1 135 135 SER C C 203 177.300 177.300 176.742 0.558 18517 9336 1 8 . 1 1 135 135 SER CA C 203 62.080 62.080 62.631 -0.551 18517 9337 1 8 . 1 1 135 135 SER CB C 203 63.030 63.030 62.649 0.381 18517 9338 1 8 . 1 1 135 135 SER H H 203 8.210 8.210 8.248 -0.038 18517 9339 1 8 . 1 1 136 136 SER N N 204 117.500 117.500 118.744 -1.244 18517 9340 1 8 . 1 1 136 136 SER HA H 204 4.050 4.050 4.361 -0.311 18517 9341 1 8 . 1 1 136 136 SER C C 204 177.570 177.570 176.397 1.173 18517 9342 1 8 . 1 1 136 136 SER CA C 204 61.880 61.880 60.923 0.957 18517 9343 1 8 . 1 1 136 136 SER CB C 204 63.510 63.510 62.812 0.698 18517 9344 1 8 . 1 1 136 136 SER H H 204 7.730 7.730 8.049 -0.319 18517 9345 1 8 . 1 1 137 137 MET N N 205 122.500 122.500 122.261 0.239 18517 9346 1 8 . 1 1 137 137 MET HA H 205 4.140 4.140 3.983 0.157 18517 9347 1 8 . 1 1 137 137 MET C C 205 177.680 177.680 178.758 -1.078 18517 9348 1 8 . 1 1 137 137 MET CA C 205 60.140 60.140 59.666 0.474 18517 9349 1 8 . 1 1 137 137 MET CB C 205 33.460 33.460 32.336 1.124 18517 9350 1 8 . 1 1 137 137 MET H H 205 8.170 8.170 8.668 -0.498 18517 9351 1 8 . 1 1 138 138 LYS N N 206 121.410 121.410 118.413 2.997 18517 9352 1 8 . 1 1 138 138 LYS HA H 206 3.750 3.750 4.019 -0.269 18517 9353 1 8 . 1 1 138 138 LYS C C 206 178.780 178.780 179.656 -0.876 18517 9354 1 8 . 1 1 138 138 LYS CA C 206 60.330 60.330 59.490 0.840 18517 9355 1 8 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.032 0.238 18517 9356 1 8 . 1 1 138 138 LYS H H 206 8.810 8.810 8.339 0.471 18517 9357 1 8 . 1 1 139 139 THR N N 207 116.580 116.580 117.034 -0.454 18517 9358 1 8 . 1 1 139 139 THR HA H 207 4.060 4.060 4.016 0.044 18517 9359 1 8 . 1 1 139 139 THR C C 207 176.730 176.730 177.226 -0.496 18517 9360 1 8 . 1 1 139 139 THR CA C 207 67.150 67.150 66.810 0.340 18517 9361 1 8 . 1 1 139 139 THR CB C 207 69.220 69.220 68.525 0.695 18517 9362 1 8 . 1 1 139 139 THR H H 207 7.930 7.930 8.074 -0.144 18517 9363 1 8 . 1 1 140 140 GLN N N 208 121.390 121.390 120.111 1.279 18517 9364 1 8 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.042 0.018 18517 9365 1 8 . 1 1 140 140 GLN C C 208 178.550 178.550 178.102 0.448 18517 9366 1 8 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.086 0.214 18517 9367 1 8 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.182 0.678 18517 9368 1 8 . 1 1 140 140 GLN H H 208 7.600 7.600 8.782 -1.182 18517 9369 1 8 . 1 1 141 141 HIS N N 209 122.360 122.360 119.493 2.867 18517 9370 1 8 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.206 -0.376 18517 9371 1 8 . 1 1 141 141 HIS C C 209 176.390 176.390 177.422 -1.032 18517 9372 1 8 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.033 1.687 18517 9373 1 8 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.189 -1.089 18517 9374 1 8 . 1 1 141 141 HIS H H 209 8.980 8.980 8.545 0.435 18517 9375 1 8 . 1 1 142 142 ASP N N 210 120.740 120.740 120.111 0.629 18517 9376 1 8 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.370 -0.021 18517 9377 1 8 . 1 1 142 142 ASP C C 210 179.490 179.490 178.279 1.211 18517 9378 1 8 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.566 0.354 18517 9379 1 8 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.971 -0.381 18517 9380 1 8 . 1 1 142 142 ASP H H 210 8.770 8.770 8.405 0.365 18517 9381 1 8 . 1 1 143 143 GLU N N 211 119.010 119.010 120.898 -1.888 18517 9382 1 8 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.016 -0.046 18517 9383 1 8 . 1 1 143 143 GLU C C 211 179.070 179.070 179.001 0.069 18517 9384 1 8 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.296 0.004 18517 9385 1 8 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.426 0.064 18517 9386 1 8 . 1 1 143 143 GLU H H 211 7.850 7.850 8.031 -0.181 18517 9387 1 8 . 1 1 144 144 LEU N N 212 122.500 122.500 119.735 2.765 18517 9388 1 8 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.120 -0.050 18517 9389 1 8 . 1 1 144 144 LEU C C 212 179.340 179.340 179.384 -0.044 18517 9390 1 8 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.152 0.238 18517 9391 1 8 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.076 1.104 18517 9392 1 8 . 1 1 144 144 LEU H H 212 8.070 8.070 8.200 -0.130 18517 9393 1 8 . 1 1 145 145 LEU N N 213 118.110 118.110 118.101 0.009 18517 9394 1 8 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.624 0.576 18517 9395 1 8 . 1 1 145 145 LEU C C 213 179.610 179.610 179.165 0.445 18517 9396 1 8 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.752 0.998 18517 9397 1 8 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.105 0.125 18517 9398 1 8 . 1 1 145 145 LEU H H 213 8.370 8.370 8.021 0.349 18517 9399 1 8 . 1 1 146 146 LYS N N 214 117.290 117.290 120.294 -3.004 18517 9400 1 8 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.874 -0.044 18517 9401 1 8 . 1 1 146 146 LYS C C 214 179.900 179.900 178.773 1.127 18517 9402 1 8 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.857 0.473 18517 9403 1 8 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.322 0.028 18517 9404 1 8 . 1 1 146 146 LYS H H 214 7.560 7.560 8.499 -0.939 18517 9405 1 8 . 1 1 147 147 LYS N N 215 120.330 120.330 118.542 1.788 18517 9406 1 8 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.044 -0.024 18517 9407 1 8 . 1 1 147 147 LYS C C 215 180.550 180.550 179.451 1.099 18517 9408 1 8 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.367 0.733 18517 9409 1 8 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.341 0.399 18517 9410 1 8 . 1 1 147 147 LYS H H 215 7.830 7.830 7.838 -0.008 18517 9411 1 8 . 1 1 148 148 PHE N N 216 117.370 117.370 117.844 -0.474 18517 9412 1 8 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.216 -0.136 18517 9413 1 8 . 1 1 148 148 PHE C C 216 178.200 178.200 177.356 0.844 18517 9414 1 8 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.032 1.089 18517 9415 1 8 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.357 1.363 18517 9416 1 8 . 1 1 148 148 PHE H H 216 8.010 8.010 8.423 -0.413 18517 9417 1 8 . 1 1 149 149 ALA N N 217 118.990 118.990 119.856 -0.866 18517 9418 1 8 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.363 -0.253 18517 9419 1 8 . 1 1 149 149 ALA C C 217 177.330 177.330 178.001 -0.671 18517 9420 1 8 . 1 1 149 149 ALA CA C 217 53.750 53.750 52.723 1.027 18517 9421 1 8 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.627 -1.027 18517 9422 1 8 . 1 1 149 149 ALA H H 217 7.720 7.720 7.878 -0.158 18517 9423 1 8 . 1 1 150 150 ALA N N 218 118.690 118.690 121.034 -2.344 18517 9424 1 8 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.382 -0.022 18517 9425 1 8 . 1 1 150 150 ALA C C 218 177.930 177.930 177.867 0.063 18517 9426 1 8 . 1 1 150 150 ALA CA C 218 52.090 52.090 53.186 -1.096 18517 9427 1 8 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.647 0.093 18517 9428 1 8 . 1 1 150 150 ALA H H 218 7.280 7.280 7.710 -0.430 18517 9429 1 8 . 1 1 151 151 LEU N N 219 119.980 119.980 121.033 -1.053 18517 9430 1 8 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.496 -0.226 18517 9431 1 8 . 1 1 151 151 LEU C C 219 176.150 176.150 175.218 0.932 18517 9432 1 8 . 1 1 151 151 LEU CA C 219 56.170 56.170 54.915 1.255 18517 9433 1 8 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.824 -1.014 18517 9434 1 8 . 1 1 151 151 LEU H H 219 7.050 7.050 7.736 -0.686 18517 9435 1 8 . 1 1 152 152 THR N N 220 112.070 112.070 115.925 -3.855 18517 9436 1 8 . 1 1 152 152 THR HA H 220 4.700 4.700 4.872 -0.172 18517 9437 1 8 . 1 1 152 152 THR C C 220 173.400 173.400 173.069 0.331 18517 9438 1 8 . 1 1 152 152 THR CA C 220 58.190 58.190 58.207 -0.017 18517 9439 1 8 . 1 1 152 152 THR CB C 220 70.960 70.960 69.372 1.588 18517 9440 1 8 . 1 1 152 152 THR H H 220 8.040 8.040 8.095 -0.055 18517 9441 1 8 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.622 0.088 18517 9442 1 8 . 1 1 153 153 PRO C C 221 176.720 176.720 176.256 0.464 18517 9443 1 8 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.220 0.690 18517 9444 1 8 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.808 1.442 18517 9445 1 8 . 1 1 154 154 THR N N 222 120.460 120.460 118.775 1.685 18517 9446 1 8 . 1 1 154 154 THR HA H 222 4.250 4.250 4.558 -0.308 18517 9447 1 8 . 1 1 154 154 THR C C 222 175.190 175.190 175.009 0.181 18517 9448 1 8 . 1 1 154 154 THR CA C 222 64.650 64.650 62.356 2.294 18517 9449 1 8 . 1 1 154 154 THR CB C 222 70.410 70.410 67.704 2.706 18517 9450 1 8 . 1 1 154 154 THR H H 222 8.530 8.530 8.481 0.049 18517 9451 1 8 . 1 1 155 155 PHE N N 223 122.260 122.260 121.081 1.179 18517 9452 1 8 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.527 0.463 18517 9453 1 8 . 1 1 155 155 PHE C C 223 172.560 172.560 175.135 -2.575 18517 9454 1 8 . 1 1 155 155 PHE CA C 223 56.770 56.770 57.952 -1.182 18517 9455 1 8 . 1 1 155 155 PHE CB C 223 40.590 40.590 38.762 1.828 18517 9456 1 8 . 1 1 155 155 PHE H H 223 8.950 8.950 7.776 1.174 18517 9457 1 8 . 1 1 156 156 LEU N N 224 123.440 123.440 119.718 3.722 18517 9458 1 8 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.197 0.473 18517 9459 1 8 . 1 1 156 156 LEU C C 224 175.090 175.090 176.745 -1.655 18517 9460 1 8 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.178 -0.148 18517 9461 1 8 . 1 1 156 156 LEU CB C 224 46.300 46.300 42.177 4.123 18517 9462 1 8 . 1 1 156 156 LEU H H 224 7.210 7.210 7.176 0.034 18517 9463 1 8 . 1 1 157 157 THR N N 225 113.010 113.010 115.974 -2.964 18517 9464 1 8 . 1 1 157 157 THR HA H 225 4.790 4.790 4.503 0.287 18517 9465 1 8 . 1 1 157 157 THR C C 225 176.130 176.130 174.137 1.993 18517 9466 1 8 . 1 1 157 157 THR CA C 225 59.860 59.860 61.580 -1.720 18517 9467 1 8 . 1 1 157 157 THR CB C 225 72.860 72.860 69.769 3.091 18517 9468 1 8 . 1 1 157 157 THR H H 225 9.200 9.200 8.146 1.054 18517 9469 1 8 . 1 1 158 158 SER N N 226 115.350 115.350 117.898 -2.548 18517 9470 1 8 . 1 1 158 158 SER C C 226 177.410 177.410 176.034 1.376 18517 9471 1 8 . 1 1 158 158 SER CA C 226 57.400 57.400 57.391 0.009 18517 9472 1 8 . 1 1 158 158 SER CB C 226 66.200 66.200 64.330 1.870 18517 9473 1 8 . 1 1 158 158 SER H H 226 8.830 8.830 8.315 0.515 18517 9474 1 8 . 1 1 159 159 GLU N N 227 121.200 121.200 125.484 -4.284 18517 9475 1 8 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.952 0.068 18517 9476 1 8 . 1 1 159 159 GLU C C 227 177.680 177.680 177.129 0.551 18517 9477 1 8 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.611 0.889 18517 9478 1 8 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.404 0.166 18517 9479 1 8 . 1 1 159 159 GLU H H 227 8.320 8.320 8.843 -0.523 18517 9480 1 8 . 1 1 160 160 ASP N N 228 115.350 115.350 118.410 -3.060 18517 9481 1 8 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.419 0.131 18517 9482 1 8 . 1 1 160 160 ASP C C 228 177.640 177.640 177.777 -0.137 18517 9483 1 8 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.502 0.898 18517 9484 1 8 . 1 1 160 160 ASP CB C 228 43.050 43.050 41.288 1.762 18517 9485 1 8 . 1 1 160 160 ASP H H 228 7.570 7.570 7.761 -0.191 18517 9486 1 8 . 1 1 161 161 ILE N N 229 108.150 108.150 113.598 -5.448 18517 9487 1 8 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.254 0.256 18517 9488 1 8 . 1 1 161 161 ILE C C 229 173.130 173.130 176.250 -3.120 18517 9489 1 8 . 1 1 161 161 ILE CA C 229 61.290 61.290 61.685 -0.396 18517 9490 1 8 . 1 1 161 161 ILE CB C 229 39.400 39.400 38.631 0.769 18517 9491 1 8 . 1 1 161 161 ILE H H 229 7.190 7.190 7.365 -0.175 18517 9492 1 8 . 1 1 162 162 SER N N 230 115.290 115.290 119.089 -3.799 18517 9493 1 8 . 1 1 162 162 SER HA H 230 4.760 4.760 4.223 0.537 18517 9494 1 8 . 1 1 162 162 SER C C 230 176.060 176.060 175.267 0.793 18517 9495 1 8 . 1 1 162 162 SER CA C 230 57.920 57.920 59.401 -1.482 18517 9496 1 8 . 1 1 162 162 SER CB C 230 66.120 66.120 61.382 4.738 18517 9497 1 8 . 1 1 162 162 SER H H 230 7.460 7.460 7.905 -0.445 18517 9498 1 8 . 1 1 163 163 GLY C C 231 173.260 173.260 172.779 0.481 18517 9499 1 8 . 1 1 163 163 GLY CA C 231 45.550 45.550 45.053 0.497 18517 9500 1 8 . 1 1 164 164 TYR N N 232 115.290 115.290 115.361 -0.071 18517 9501 1 8 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.845 -0.145 18517 9502 1 8 . 1 1 164 164 TYR C C 232 172.820 172.820 173.599 -0.779 18517 9503 1 8 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.446 -0.346 18517 9504 1 8 . 1 1 164 164 TYR CB C 232 39.800 39.800 40.178 -0.378 18517 9505 1 8 . 1 1 164 164 TYR H H 232 7.370 7.370 7.268 0.102 18517 9506 1 8 . 1 1 165 165 LEU N N 233 120.980 120.980 122.245 -1.265 18517 9507 1 8 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.476 -0.046 18517 9508 1 8 . 1 1 165 165 LEU C C 233 176.360 176.360 177.977 -1.617 18517 9509 1 8 . 1 1 165 165 LEU CA C 233 55.660 55.660 53.897 1.763 18517 9510 1 8 . 1 1 165 165 LEU CB C 233 40.430 40.430 42.415 -1.985 18517 9511 1 8 . 1 1 165 165 LEU H H 233 8.830 8.830 8.100 0.730 18517 9512 1 8 . 1 1 166 166 THR N N 234 116.170 116.170 115.771 0.399 18517 9513 1 8 . 1 1 166 166 THR HA H 234 4.010 4.010 3.470 0.540 18517 9514 1 8 . 1 1 166 166 THR C C 234 173.070 173.070 174.000 -0.930 18517 9515 1 8 . 1 1 166 166 THR CA C 234 62.910 62.910 64.012 -1.102 18517 9516 1 8 . 1 1 166 166 THR CB C 234 70.170 70.170 68.996 1.174 18517 9517 1 8 . 1 1 166 166 THR H H 234 8.050 8.050 8.389 -0.339 18517 9518 1 8 . 1 1 167 167 VAL N N 235 117.640 117.640 113.868 3.772 18517 9519 1 8 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.424 -0.214 18517 9520 1 8 . 1 1 167 167 VAL C C 235 172.330 172.330 173.740 -1.410 18517 9521 1 8 . 1 1 167 167 VAL CA C 235 58.750 58.750 58.334 0.416 18517 9522 1 8 . 1 1 167 167 VAL CB C 235 35.880 35.880 31.834 4.046 18517 9523 1 8 . 1 1 167 167 VAL H H 235 7.160 7.160 7.336 -0.176 18517 9524 1 8 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.693 -0.503 18517 9525 1 8 . 1 1 168 168 PRO C C 236 173.710 173.710 175.578 -1.868 18517 9526 1 8 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.303 1.527 18517 9527 1 8 . 1 1 168 168 PRO CB C 236 32.270 32.270 33.103 -0.833 18517 9528 1 8 . 1 1 169 169 GLU N N 237 113.540 113.540 118.660 -5.120 18517 9529 1 8 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.166 0.214 18517 9530 1 8 . 1 1 169 169 GLU C C 237 176.690 176.690 178.597 -1.907 18517 9531 1 8 . 1 1 169 169 GLU CA C 237 53.750 53.750 56.089 -2.339 18517 9532 1 8 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.480 2.740 18517 9533 1 8 . 1 1 169 169 GLU H H 237 7.930 7.930 8.377 -0.447 18517 9534 1 8 . 1 1 170 170 TYR N N 238 119.400 119.400 121.215 -1.815 18517 9535 1 8 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.093 -0.093 18517 9536 1 8 . 1 1 170 170 TYR C C 238 177.610 177.610 176.224 1.386 18517 9537 1 8 . 1 1 170 170 TYR CA C 238 62.630 62.630 60.524 2.106 18517 9538 1 8 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.435 -0.695 18517 9539 1 8 . 1 1 170 170 TYR H H 238 8.490 8.490 9.177 -0.687 18517 9540 1 8 . 1 1 171 171 GLY N N 239 104.160 104.160 102.179 1.981 18517 9541 1 8 . 1 1 171 171 GLY C C 239 173.350 173.350 172.737 0.613 18517 9542 1 8 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.455 0.815 18517 9543 1 8 . 1 1 171 171 GLY H H 239 7.960 7.960 7.804 0.156 18517 9544 1 8 . 1 1 172 172 ALA N N 240 121.860 121.860 122.825 -0.965 18517 9545 1 8 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.884 -0.714 18517 9546 1 8 . 1 1 172 172 ALA C C 240 172.160 172.160 175.265 -3.105 18517 9547 1 8 . 1 1 172 172 ALA CA C 240 50.110 50.110 48.928 1.182 18517 9548 1 8 . 1 1 172 172 ALA CB C 240 20.930 20.930 18.784 2.146 18517 9549 1 8 . 1 1 172 172 ALA H H 240 6.910 6.910 7.838 -0.928 18517 9550 1 8 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.274 1.276 18517 9551 1 8 . 1 1 173 173 PRO C C 241 176.610 176.610 174.965 1.645 18517 9552 1 8 . 1 1 173 173 PRO CA C 241 61.520 61.520 63.569 -2.049 18517 9553 1 8 . 1 1 173 173 PRO CB C 241 33.300 33.300 31.366 1.934 18517 9554 1 8 . 1 1 174 174 MET N N 242 114.000 114.000 122.530 -8.530 18517 9555 1 8 . 1 1 174 174 MET HA H 242 4.390 4.390 4.563 -0.173 18517 9556 1 8 . 1 1 174 174 MET C C 242 173.960 173.960 174.488 -0.528 18517 9557 1 8 . 1 1 174 174 MET CA C 242 54.660 54.660 53.486 1.174 18517 9558 1 8 . 1 1 174 174 MET CB C 242 34.170 34.170 35.656 -1.486 18517 9559 1 8 . 1 1 174 174 MET H H 242 8.040 8.040 6.780 1.260 18517 9560 1 8 . 1 1 175 175 ASN N N 243 119.570 119.570 122.990 -3.420 18517 9561 1 8 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.686 0.254 18517 9562 1 8 . 1 1 175 175 ASN C C 243 174.320 174.320 174.769 -0.449 18517 9563 1 8 . 1 1 175 175 ASN CA C 243 53.080 53.080 51.627 1.453 18517 9564 1 8 . 1 1 175 175 ASN CB C 243 38.850 38.850 38.856 -0.006 18517 9565 1 8 . 1 1 175 175 ASN H H 243 7.960 7.960 8.249 -0.289 18517 9566 1 8 . 1 1 176 176 ALA N N 244 132.250 132.250 129.642 2.608 18517 9567 1 8 . 1 1 176 176 ALA C C 244 181.580 181.580 178.594 2.986 18517 9568 1 8 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.197 0.573 18517 9569 1 8 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.765 0.265 18517 9570 1 8 . 1 1 176 176 ALA H H 244 12.110 12.110 8.419 3.691 18517 9571 1 8 . 1 1 177 177 ALA N N 245 125.780 125.780 121.399 4.381 18517 9572 1 8 . 1 1 177 177 ALA HA H 245 3.870 3.870 4.070 -0.200 18517 9573 1 8 . 1 1 177 177 ALA C C 245 180.640 180.640 179.415 1.225 18517 9574 1 8 . 1 1 177 177 ALA CA C 245 55.660 55.660 54.897 0.763 18517 9575 1 8 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.354 -0.514 18517 9576 1 8 . 1 1 177 177 ALA H H 245 10.240 10.240 8.066 2.174 18517 9577 1 8 . 1 1 178 178 LYS N N 246 119.810 119.810 119.520 0.290 18517 9578 1 8 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.067 -0.237 18517 9579 1 8 . 1 1 178 178 LYS C C 246 180.500 180.500 178.374 2.126 18517 9580 1 8 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.261 0.639 18517 9581 1 8 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.461 -1.141 18517 9582 1 8 . 1 1 178 178 LYS H H 246 8.470 8.470 8.238 0.232 18517 9583 1 8 . 1 1 179 179 TRP N N 247 121.170 121.170 121.518 -0.348 18517 9584 1 8 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.391 0.229 18517 9585 1 8 . 1 1 179 179 TRP C C 247 176.510 176.510 177.786 -1.276 18517 9586 1 8 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.989 -0.169 18517 9587 1 8 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.777 -0.207 18517 9588 1 8 . 1 1 179 179 TRP H H 247 8.330 8.330 8.508 -0.178 18517 9589 1 8 . 1 1 180 180 ALA N N 248 119.130 119.130 120.768 -1.638 18517 9590 1 8 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.778 0.762 18517 9591 1 8 . 1 1 180 180 ALA C C 248 182.110 182.110 178.610 3.500 18517 9592 1 8 . 1 1 180 180 ALA CA C 248 54.190 54.190 54.788 -0.598 18517 9593 1 8 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.267 0.443 18517 9594 1 8 . 1 1 180 180 ALA H H 248 7.990 7.990 8.583 -0.593 18517 9595 1 8 . 1 1 181 181 LYS N N 249 116.000 116.000 118.761 -2.761 18517 9596 1 8 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.091 -0.121 18517 9597 1 8 . 1 1 181 181 LYS C C 249 179.380 179.380 178.975 0.405 18517 9598 1 8 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.519 -0.809 18517 9599 1 8 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.714 -0.204 18517 9600 1 8 . 1 1 181 181 LYS H H 249 6.900 6.900 7.755 -0.855 18517 9601 1 8 . 1 1 182 182 VAL N N 250 122.270 122.270 116.275 5.995 18517 9602 1 8 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.776 -0.436 18517 9603 1 8 . 1 1 182 182 VAL C C 250 178.160 178.160 177.871 0.289 18517 9604 1 8 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.191 0.569 18517 9605 1 8 . 1 1 182 182 VAL CB C 250 30.840 30.840 30.869 -0.029 18517 9606 1 8 . 1 1 182 182 VAL H H 250 7.050 7.050 8.040 -0.990 18517 9607 1 8 . 1 1 183 183 GLU N N 251 120.520 120.520 120.382 0.138 18517 9608 1 8 . 1 1 183 183 GLU HA H 251 3.180 3.180 4.039 -0.859 18517 9609 1 8 . 1 1 183 183 GLU C C 251 179.480 179.480 178.839 0.641 18517 9610 1 8 . 1 1 183 183 GLU CA C 251 60.690 60.690 58.444 2.246 18517 9611 1 8 . 1 1 183 183 GLU CB C 251 28.070 28.070 29.119 -1.048 18517 9612 1 8 . 1 1 183 183 GLU H H 251 8.020 8.020 8.646 -0.626 18517 9613 1 8 . 1 1 184 184 GLY N N 252 102.930 102.930 108.159 -5.229 18517 9614 1 8 . 1 1 184 184 GLY C C 252 176.920 176.920 176.323 0.597 18517 9615 1 8 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.152 0.258 18517 9616 1 8 . 1 1 184 184 GLY H H 252 7.830 7.830 7.983 -0.153 18517 9617 1 8 . 1 1 185 185 MET N N 253 123.200 123.200 121.651 1.549 18517 9618 1 8 . 1 1 185 185 MET HA H 253 4.250 4.250 4.072 0.178 18517 9619 1 8 . 1 1 185 185 MET C C 253 179.370 179.370 178.539 0.831 18517 9620 1 8 . 1 1 185 185 MET CA C 253 59.300 59.300 59.243 0.057 18517 9621 1 8 . 1 1 185 185 MET CB C 253 33.930 33.930 32.546 1.384 18517 9622 1 8 . 1 1 185 185 MET H H 253 7.890 7.890 7.880 0.010 18517 9623 1 8 . 1 1 186 186 ILE N N 254 120.150 120.150 119.795 0.355 18517 9624 1 8 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.675 -0.115 18517 9625 1 8 . 1 1 186 186 ILE C C 254 177.250 177.250 177.892 -0.642 18517 9626 1 8 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.505 1.015 18517 9627 1 8 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.571 0.719 18517 9628 1 8 . 1 1 186 186 ILE H H 254 8.260 8.260 8.082 0.178 18517 9629 1 8 . 1 1 187 187 HIS N N 255 119.810 119.810 119.842 -0.032 18517 9630 1 8 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.244 -0.244 18517 9631 1 8 . 1 1 187 187 HIS C C 255 176.460 176.460 177.565 -1.105 18517 9632 1 8 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.550 0.781 18517 9633 1 8 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.540 2.090 18517 9634 1 8 . 1 1 187 187 HIS H H 255 8.900 8.900 8.617 0.283 18517 9635 1 8 . 1 1 188 188 GLY N N 256 103.160 103.160 106.669 -3.509 18517 9636 1 8 . 1 1 188 188 GLY C C 256 176.320 176.320 175.756 0.564 18517 9637 1 8 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.556 0.334 18517 9638 1 8 . 1 1 188 188 GLY H H 256 8.030 8.030 8.381 -0.351 18517 9639 1 8 . 1 1 189 189 LYS N N 257 119.510 119.510 120.735 -1.225 18517 9640 1 8 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.181 -0.181 18517 9641 1 8 . 1 1 189 189 LYS C C 257 178.660 178.660 178.795 -0.135 18517 9642 1 8 . 1 1 189 189 LYS CA C 257 56.490 56.490 56.450 0.040 18517 9643 1 8 . 1 1 189 189 LYS CB C 257 31.550 31.550 32.195 -0.645 18517 9644 1 8 . 1 1 189 189 LYS H H 257 7.120 7.120 7.574 -0.454 18517 9645 1 8 . 1 1 190 190 LEU N N 258 120.570 120.570 121.381 -0.811 18517 9646 1 8 . 1 1 190 190 LEU HA H 258 3.930 3.930 4.022 -0.092 18517 9647 1 8 . 1 1 190 190 LEU C C 258 177.230 177.230 177.132 0.098 18517 9648 1 8 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.145 0.375 18517 9649 1 8 . 1 1 190 190 LEU CB C 258 42.970 42.970 42.148 0.822 18517 9650 1 8 . 1 1 190 190 LEU H H 258 8.060 8.060 8.321 -0.261 18517 9651 1 8 . 1 1 191 191 GLU N N 259 114.590 114.590 114.867 -0.277 18517 9652 1 8 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.112 0.168 18517 9653 1 8 . 1 1 191 191 GLU C C 259 176.230 176.230 176.838 -0.608 18517 9654 1 8 . 1 1 191 191 GLU CA C 259 55.340 55.340 56.647 -1.307 18517 9655 1 8 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.262 0.068 18517 9656 1 8 . 1 1 191 191 GLU H H 259 7.330 7.330 7.755 -0.425 18517 9657 1 8 . 1 1 192 192 SER N N 260 115.240 115.240 114.877 0.363 18517 9658 1 8 . 1 1 192 192 SER HA H 260 4.490 4.490 4.476 0.014 18517 9659 1 8 . 1 1 192 192 SER C C 260 173.770 173.770 174.379 -0.609 18517 9660 1 8 . 1 1 192 192 SER CA C 260 58.350 58.350 57.168 1.182 18517 9661 1 8 . 1 1 192 192 SER CB C 260 65.090 65.090 64.196 0.894 18517 9662 1 8 . 1 1 192 192 SER H H 260 7.130 7.130 7.557 -0.427 18517 9663 1 8 . 1 1 193 193 SER C C 261 174.600 174.600 174.758 -0.158 18517 9664 1 8 . 1 1 193 193 SER CA C 261 59.980 59.980 57.940 2.040 18517 9665 1 8 . 1 1 193 193 SER CB C 261 63.750 63.750 62.432 1.318 18517 9666 1 8 . 1 1 194 194 GLU N N 262 121.800 121.800 121.419 0.381 18517 9667 1 8 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.137 0.333 18517 9668 1 8 . 1 1 194 194 GLU C C 262 174.650 174.650 176.352 -1.702 18517 9669 1 8 . 1 1 194 194 GLU CA C 262 55.620 55.620 56.203 -0.583 18517 9670 1 8 . 1 1 194 194 GLU CB C 262 30.210 30.210 30.017 0.193 18517 9671 1 8 . 1 1 194 194 GLU H H 262 7.840 7.840 8.220 -0.380 18517 9672 1 8 . 1 1 195 195 VAL N N 263 124.080 124.080 122.248 1.832 18517 9673 1 8 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.074 0.176 18517 9674 1 8 . 1 1 195 195 VAL C C 263 174.460 174.460 175.463 -1.003 18517 9675 1 8 . 1 1 195 195 VAL CA C 263 59.820 59.820 60.939 -1.119 18517 9676 1 8 . 1 1 195 195 VAL CB C 263 33.620 33.620 31.246 2.374 18517 9677 1 8 . 1 1 195 195 VAL H H 263 8.020 8.020 8.414 -0.394 18517 9678 1 8 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.485 0.035 18517 9679 1 8 . 1 1 198 198 ASN C C 266 176.490 176.490 177.302 -0.812 18517 9680 1 8 . 1 1 198 198 ASN CA C 266 54.780 54.780 56.947 -2.167 18517 9681 1 8 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.828 0.233 18517 9682 1 8 . 1 1 199 199 LEU N N 267 120.680 120.680 121.624 -0.944 18517 9683 1 8 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.779 0.231 18517 9684 1 8 . 1 1 199 199 LEU C C 267 178.050 178.050 178.122 -0.072 18517 9685 1 8 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.290 0.540 18517 9686 1 8 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.610 0.730 18517 9687 1 8 . 1 1 199 199 LEU H H 267 7.660 7.660 8.020 -0.360 18517 9688 1 8 . 1 1 200 200 LYS N N 268 116.740 116.740 118.858 -2.118 18517 9689 1 8 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.963 -0.233 18517 9690 1 8 . 1 1 200 200 LYS C C 268 178.520 178.520 178.654 -0.134 18517 9691 1 8 . 1 1 200 200 LYS CA C 268 61.800 61.800 58.608 3.192 18517 9692 1 8 . 1 1 200 200 LYS CB C 268 32.110 32.110 31.721 0.389 18517 9693 1 8 . 1 1 200 200 LYS H H 268 8.280 8.280 7.721 0.559 18517 9694 1 8 . 1 1 201 201 ALA N N 269 121.270 121.270 122.548 -1.278 18517 9695 1 8 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.135 0.105 18517 9696 1 8 . 1 1 201 201 ALA C C 269 180.890 180.890 179.907 0.983 18517 9697 1 8 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.103 0.077 18517 9698 1 8 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.119 0.351 18517 9699 1 8 . 1 1 201 201 ALA H H 269 7.710 7.710 7.926 -0.216 18517 9700 1 8 . 1 1 202 202 LEU N N 270 119.980 119.980 119.158 0.822 18517 9701 1 8 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.932 0.158 18517 9702 1 8 . 1 1 202 202 LEU C C 270 179.330 179.330 179.348 -0.018 18517 9703 1 8 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.852 0.218 18517 9704 1 8 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.406 1.014 18517 9705 1 8 . 1 1 202 202 LEU H H 270 7.750 7.750 8.438 -0.688 18517 9706 1 8 . 1 1 203 203 VAL N N 271 118.450 118.450 119.916 -1.466 18517 9707 1 8 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.906 -0.076 18517 9708 1 8 . 1 1 203 203 VAL C C 271 177.110 177.110 177.800 -0.690 18517 9709 1 8 . 1 1 203 203 VAL CA C 271 67.710 67.710 67.324 0.386 18517 9710 1 8 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.083 0.627 18517 9711 1 8 . 1 1 203 203 VAL H H 271 8.560 8.560 8.341 0.219 18517 9712 1 8 . 1 1 204 204 ALA N N 272 122.560 122.560 121.446 1.114 18517 9713 1 8 . 1 1 204 204 ALA HA H 272 3.880 3.880 4.000 -0.120 18517 9714 1 8 . 1 1 204 204 ALA C C 272 178.700 178.700 179.933 -1.233 18517 9715 1 8 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.513 0.617 18517 9716 1 8 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.107 0.283 18517 9717 1 8 . 1 1 204 204 ALA H H 272 8.120 8.120 8.371 -0.251 18517 9718 1 8 . 1 1 205 205 GLU N N 273 117.290 117.290 119.080 -1.790 18517 9719 1 8 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.106 -0.116 18517 9720 1 8 . 1 1 205 205 GLU C C 273 178.630 178.630 179.084 -0.454 18517 9721 1 8 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.079 1.061 18517 9722 1 8 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.689 0.281 18517 9723 1 8 . 1 1 205 205 GLU H H 273 7.670 7.670 8.157 -0.487 18517 9724 1 8 . 1 1 206 206 LEU N N 274 120.450 120.450 122.241 -1.791 18517 9725 1 8 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.115 -0.115 18517 9726 1 8 . 1 1 206 206 LEU C C 274 178.400 178.400 178.326 0.074 18517 9727 1 8 . 1 1 206 206 LEU CA C 274 58.910 58.910 57.946 0.965 18517 9728 1 8 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.777 1.753 18517 9729 1 8 . 1 1 206 206 LEU H H 274 8.420 8.420 8.363 0.057 18517 9730 1 8 . 1 1 207 207 ILE N N 275 117.580 117.580 119.970 -2.390 18517 9731 1 8 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.496 0.034 18517 9732 1 8 . 1 1 207 207 ILE C C 275 178.850 178.850 177.837 1.013 18517 9733 1 8 . 1 1 207 207 ILE CA C 275 66.080 66.080 66.209 -0.129 18517 9734 1 8 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.564 1.206 18517 9735 1 8 . 1 1 207 207 ILE H H 275 8.700 8.700 8.680 0.020 18517 9736 1 8 . 1 1 208 208 GLU N N 276 119.100 119.100 119.684 -0.584 18517 9737 1 8 . 1 1 208 208 GLU HA H 276 4.000 4.000 3.908 0.092 18517 9738 1 8 . 1 1 208 208 GLU C C 276 178.540 178.540 178.912 -0.372 18517 9739 1 8 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.776 0.674 18517 9740 1 8 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.837 0.683 18517 9741 1 8 . 1 1 208 208 GLU H H 276 7.950 7.950 8.177 -0.227 18517 9742 1 8 . 1 1 209 209 LEU N N 277 120.590 120.590 121.114 -0.524 18517 9743 1 8 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.121 0.099 18517 9744 1 8 . 1 1 209 209 LEU C C 277 179.520 179.520 179.092 0.428 18517 9745 1 8 . 1 1 209 209 LEU CA C 277 58.350 58.350 58.149 0.201 18517 9746 1 8 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.494 1.796 18517 9747 1 8 . 1 1 209 209 LEU H H 277 8.550 8.550 8.467 0.083 18517 9748 1 8 . 1 1 210 210 ARG N N 278 116.470 116.470 119.073 -2.603 18517 9749 1 8 . 1 1 210 210 ARG HA H 278 3.740 3.740 4.062 -0.322 18517 9750 1 8 . 1 1 210 210 ARG C C 278 179.190 179.190 178.636 0.554 18517 9751 1 8 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.672 2.007 18517 9752 1 8 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.409 0.991 18517 9753 1 8 . 1 1 210 210 ARG H H 278 8.590 8.590 8.737 -0.147 18517 9754 1 8 . 1 1 211 211 ALA N N 279 120.470 120.470 122.144 -1.674 18517 9755 1 8 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.122 -0.212 18517 9756 1 8 . 1 1 211 211 ALA C C 279 181.350 181.350 180.025 1.325 18517 9757 1 8 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.105 0.595 18517 9758 1 8 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.144 -0.864 18517 9759 1 8 . 1 1 211 211 ALA H H 279 8.050 8.050 8.249 -0.199 18517 9760 1 8 . 1 1 212 212 GLN N N 280 120.070 120.070 118.254 1.816 18517 9761 1 8 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.938 0.082 18517 9762 1 8 . 1 1 212 212 GLN C C 280 179.490 179.490 178.453 1.037 18517 9763 1 8 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.985 0.315 18517 9764 1 8 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.738 0.442 18517 9765 1 8 . 1 1 212 212 GLN H H 280 8.300 8.300 8.477 -0.177 18517 9766 1 8 . 1 1 213 213 MET N N 281 119.810 119.810 120.584 -0.774 18517 9767 1 8 . 1 1 213 213 MET HA H 281 3.730 3.730 4.153 -0.423 18517 9768 1 8 . 1 1 213 213 MET C C 281 177.490 177.490 178.291 -0.801 18517 9769 1 8 . 1 1 213 213 MET CA C 281 60.690 60.690 58.225 2.465 18517 9770 1 8 . 1 1 213 213 MET CB C 281 33.930 33.930 32.442 1.488 18517 9771 1 8 . 1 1 213 213 MET H H 281 8.420 8.420 8.377 0.043 18517 9772 1 8 . 1 1 214 214 MET N N 282 114.000 114.000 118.066 -4.066 18517 9773 1 8 . 1 1 214 214 MET HA H 282 3.880 3.880 4.116 -0.236 18517 9774 1 8 . 1 1 214 214 MET C C 282 177.650 177.650 178.038 -0.388 18517 9775 1 8 . 1 1 214 214 MET CA C 282 58.670 58.670 57.610 1.060 18517 9776 1 8 . 1 1 214 214 MET CB C 282 33.300 33.300 31.740 1.560 18517 9777 1 8 . 1 1 214 214 MET H H 282 7.890 7.890 8.436 -0.546 18517 9778 1 8 . 1 1 215 215 ALA N N 283 119.970 119.970 122.772 -2.802 18517 9779 1 8 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.085 0.055 18517 9780 1 8 . 1 1 215 215 ALA C C 283 180.580 180.580 179.241 1.339 18517 9781 1 8 . 1 1 215 215 ALA CA C 283 54.110 54.110 54.686 -0.576 18517 9782 1 8 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.421 -0.740 18517 9783 1 8 . 1 1 215 215 ALA H H 283 7.580 7.580 7.703 -0.123 18517 9784 1 8 . 1 1 216 216 LEU N N 284 120.920 120.920 117.836 3.084 18517 9785 1 8 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.084 -0.124 18517 9786 1 8 . 1 1 216 216 LEU C C 284 177.910 177.910 179.414 -1.504 18517 9787 1 8 . 1 1 216 216 LEU CA C 284 57.920 57.920 56.901 1.019 18517 9788 1 8 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.213 0.287 18517 9789 1 8 . 1 1 216 216 LEU H H 284 7.460 7.460 8.101 -0.641 18517 9790 1 8 . 1 1 217 217 LEU N N 285 116.470 116.470 120.584 -4.114 18517 9791 1 8 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.745 -0.065 18517 9792 1 8 . 1 1 217 217 LEU C C 285 178.310 178.310 176.735 1.575 18517 9793 1 8 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.295 0.145 18517 9794 1 8 . 1 1 217 217 LEU CB C 285 43.050 43.050 42.028 1.022 18517 9795 1 8 . 1 1 217 217 LEU H H 285 6.980 6.980 8.189 -1.209 18517 9796 1 8 . 1 1 218 218 TYR N N 286 111.080 111.080 113.966 -2.886 18517 9797 1 8 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.617 0.283 18517 9798 1 8 . 1 1 218 218 TYR C C 286 176.090 176.090 175.317 0.773 18517 9799 1 8 . 1 1 218 218 TYR CA C 286 56.050 56.050 56.880 -0.830 18517 9800 1 8 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.203 2.707 18517 9801 1 8 . 1 1 218 218 TYR H H 286 7.660 7.660 7.595 0.065 18517 9802 1 8 . 1 1 219 219 GLY N N 287 108.260 108.260 108.789 -0.529 18517 9803 1 8 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.121 1.199 18517 9804 1 8 . 1 1 219 219 GLY H H 287 7.750 7.750 7.447 0.303 18517 9805 1 8 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.804 -0.315 18517 9806 1 8 . 1 1 221 221 ILE CA C 289 63.580 63.580 63.283 0.297 18517 9807 1 8 . 1 1 221 221 ILE CB C 289 38.280 38.280 37.808 0.472 18517 9808 1 8 . 1 1 222 222 GLY CA C 290 45.740 45.740 45.008 0.733 18517 9809 1 9 . 1 1 2 2 LYS N N 70 126.600 126.600 125.968 0.632 18517 9810 1 9 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.694 -0.334 18517 9811 1 9 . 1 1 2 2 LYS C C 70 176.000 176.000 175.991 0.009 18517 9812 1 9 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.691 0.759 18517 9813 1 9 . 1 1 2 2 LYS CB C 70 33.850 33.850 33.360 0.490 18517 9814 1 9 . 1 1 2 2 LYS H H 70 8.530 8.530 8.451 0.079 18517 9815 1 9 . 1 1 3 3 THR N N 71 111.030 111.030 114.099 -3.069 18517 9816 1 9 . 1 1 3 3 THR HA H 71 4.400 4.400 4.311 0.089 18517 9817 1 9 . 1 1 3 3 THR C C 71 175.650 175.650 176.166 -0.516 18517 9818 1 9 . 1 1 3 3 THR CA C 71 60.610 60.610 61.200 -0.590 18517 9819 1 9 . 1 1 3 3 THR CB C 71 71.520 71.520 70.234 1.286 18517 9820 1 9 . 1 1 3 3 THR H H 71 7.390 7.390 8.489 -1.099 18517 9821 1 9 . 1 1 4 4 LEU N N 72 121.560 121.560 122.132 -0.572 18517 9822 1 9 . 1 1 4 4 LEU C C 72 177.870 177.870 178.950 -1.080 18517 9823 1 9 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.717 -0.237 18517 9824 1 9 . 1 1 4 4 LEU CB C 72 42.180 42.180 40.669 1.511 18517 9825 1 9 . 1 1 4 4 LEU H H 72 8.980 8.980 8.674 0.306 18517 9826 1 9 . 1 1 5 5 ASP N N 73 115.530 115.530 119.032 -3.502 18517 9827 1 9 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.456 -0.126 18517 9828 1 9 . 1 1 5 5 ASP C C 73 179.290 179.290 178.675 0.615 18517 9829 1 9 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.592 0.248 18517 9830 1 9 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.739 0.091 18517 9831 1 9 . 1 1 5 5 ASP H H 73 8.270 8.270 8.446 -0.176 18517 9832 1 9 . 1 1 6 6 VAL N N 74 122.330 122.330 120.898 1.432 18517 9833 1 9 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.690 0.050 18517 9834 1 9 . 1 1 6 6 VAL C C 74 178.970 178.970 177.926 1.044 18517 9835 1 9 . 1 1 6 6 VAL CA C 74 66.360 66.360 66.536 -0.176 18517 9836 1 9 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.816 0.134 18517 9837 1 9 . 1 1 6 6 VAL H H 74 7.400 7.400 7.643 -0.243 18517 9838 1 9 . 1 1 7 7 LEU N N 75 121.360 121.360 120.366 0.994 18517 9839 1 9 . 1 1 7 7 LEU HA H 75 4.030 4.030 4.001 0.029 18517 9840 1 9 . 1 1 7 7 LEU C C 75 179.240 179.240 179.083 0.157 18517 9841 1 9 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.329 -0.099 18517 9842 1 9 . 1 1 7 7 LEU CB C 75 42.890 42.890 40.971 1.919 18517 9843 1 9 . 1 1 7 7 LEU H H 75 8.300 8.300 8.723 -0.423 18517 9844 1 9 . 1 1 8 8 ARG N N 76 117.230 117.230 118.588 -1.358 18517 9845 1 9 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.093 -0.173 18517 9846 1 9 . 1 1 8 8 ARG C C 76 178.290 178.290 179.234 -0.944 18517 9847 1 9 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.205 1.565 18517 9848 1 9 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.477 0.733 18517 9849 1 9 . 1 1 8 8 ARG H H 76 8.520 8.520 8.400 0.120 18517 9850 1 9 . 1 1 9 9 GLY N N 77 104.570 104.570 106.675 -2.105 18517 9851 1 9 . 1 1 9 9 GLY C C 77 176.180 176.180 176.047 0.133 18517 9852 1 9 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.739 0.431 18517 9853 1 9 . 1 1 9 9 GLY H H 77 7.620 7.620 8.494 -0.874 18517 9854 1 9 . 1 1 10 10 GLU N N 78 120.270 120.270 122.890 -2.620 18517 9855 1 9 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.089 0.181 18517 9856 1 9 . 1 1 10 10 GLU C C 78 179.030 179.030 178.843 0.187 18517 9857 1 9 . 1 1 10 10 GLU CA C 78 58.870 58.870 58.950 -0.080 18517 9858 1 9 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.255 2.145 18517 9859 1 9 . 1 1 10 10 GLU H H 78 8.100 8.100 8.353 -0.253 18517 9860 1 9 . 1 1 11 11 LEU N N 79 116.000 116.000 121.079 -5.079 18517 9861 1 9 . 1 1 11 11 LEU HA H 79 4.510 4.510 4.103 0.407 18517 9862 1 9 . 1 1 11 11 LEU C C 79 179.630 179.630 179.645 -0.015 18517 9863 1 9 . 1 1 11 11 LEU CA C 79 56.690 56.690 57.856 -1.166 18517 9864 1 9 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.812 2.988 18517 9865 1 9 . 1 1 11 11 LEU H H 79 8.230 8.230 8.486 -0.256 18517 9866 1 9 . 1 1 12 12 ARG N N 80 120.020 120.020 118.864 1.156 18517 9867 1 9 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.980 -0.230 18517 9868 1 9 . 1 1 12 12 ARG C C 80 178.490 178.490 178.885 -0.395 18517 9869 1 9 . 1 1 12 12 ARG CA C 80 62.000 62.000 60.047 1.953 18517 9870 1 9 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.860 1.380 18517 9871 1 9 . 1 1 12 12 ARG H H 80 8.210 8.210 8.583 -0.373 18517 9872 1 9 . 1 1 13 13 GLY N N 81 108.090 108.090 106.975 1.115 18517 9873 1 9 . 1 1 13 13 GLY C C 81 173.540 173.540 176.017 -2.477 18517 9874 1 9 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.714 1.286 18517 9875 1 9 . 1 1 13 13 GLY H H 81 8.890 8.890 8.287 0.603 18517 9876 1 9 . 1 1 14 14 GLN C C 82 179.540 179.540 178.076 1.464 18517 9877 1 9 . 1 1 14 14 GLN CA C 82 58.710 58.710 58.989 -0.279 18517 9878 1 9 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.637 0.463 18517 9879 1 9 . 1 1 15 15 ARG N N 83 118.220 118.220 119.686 -1.466 18517 9880 1 9 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.032 -0.082 18517 9881 1 9 . 1 1 15 15 ARG C C 83 177.710 177.710 178.660 -0.950 18517 9882 1 9 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.991 -0.091 18517 9883 1 9 . 1 1 15 15 ARG CB C 83 29.650 29.650 30.232 -0.582 18517 9884 1 9 . 1 1 15 15 ARG H H 83 7.320 7.320 8.595 -1.275 18517 9885 1 9 . 1 1 16 16 GLU N N 84 118.810 118.810 119.587 -0.777 18517 9886 1 9 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.139 -0.289 18517 9887 1 9 . 1 1 16 16 GLU C C 84 178.750 178.750 178.805 -0.055 18517 9888 1 9 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.091 1.919 18517 9889 1 9 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.228 0.182 18517 9890 1 9 . 1 1 16 16 GLU H H 84 8.450 8.450 8.564 -0.114 18517 9891 1 9 . 1 1 17 17 ALA N N 85 122.790 122.790 123.041 -0.251 18517 9892 1 9 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.097 0.093 18517 9893 1 9 . 1 1 17 17 ALA C C 85 180.360 180.360 179.304 1.056 18517 9894 1 9 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.271 0.189 18517 9895 1 9 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.307 -0.227 18517 9896 1 9 . 1 1 17 17 ALA H H 85 8.420 8.420 8.153 0.267 18517 9897 1 9 . 1 1 18 18 PHE N N 86 119.400 119.400 119.961 -0.561 18517 9898 1 9 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.251 0.039 18517 9899 1 9 . 1 1 18 18 PHE C C 86 177.560 177.560 177.359 0.201 18517 9900 1 9 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.088 0.552 18517 9901 1 9 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.331 0.309 18517 9902 1 9 . 1 1 18 18 PHE H H 86 7.490 7.490 8.358 -0.868 18517 9903 1 9 . 1 1 19 19 LEU N N 87 117.470 117.470 119.761 -2.291 18517 9904 1 9 . 1 1 19 19 LEU HA H 87 4.070 4.070 4.051 0.019 18517 9905 1 9 . 1 1 19 19 LEU C C 87 178.880 178.880 178.531 0.349 18517 9906 1 9 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.018 -0.058 18517 9907 1 9 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.667 0.433 18517 9908 1 9 . 1 1 19 19 LEU H H 87 8.010 8.010 8.746 -0.736 18517 9909 1 9 . 1 1 20 20 SER N N 88 113.770 113.770 115.437 -1.667 18517 9910 1 9 . 1 1 20 20 SER HA H 88 4.070 4.070 4.141 -0.071 18517 9911 1 9 . 1 1 20 20 SER C C 88 175.680 175.680 176.718 -1.038 18517 9912 1 9 . 1 1 20 20 SER CA C 88 63.070 63.070 62.646 0.424 18517 9913 1 9 . 1 1 20 20 SER H H 88 8.100 8.100 8.425 -0.325 18517 9914 1 9 . 1 1 21 21 GLU N N 89 120.570 120.570 121.864 -1.294 18517 9915 1 9 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.049 -0.079 18517 9916 1 9 . 1 1 21 21 GLU C C 89 178.940 178.940 178.744 0.196 18517 9917 1 9 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.000 0.260 18517 9918 1 9 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.157 0.173 18517 9919 1 9 . 1 1 21 21 GLU H H 89 7.400 7.400 7.907 -0.507 18517 9920 1 9 . 1 1 22 22 ILE N N 90 119.350 119.350 119.502 -0.152 18517 9921 1 9 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.828 -0.138 18517 9922 1 9 . 1 1 22 22 ILE C C 90 177.230 177.230 178.099 -0.869 18517 9923 1 9 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.952 0.518 18517 9924 1 9 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.682 -0.292 18517 9925 1 9 . 1 1 22 22 ILE H H 90 7.250 7.250 7.930 -0.680 18517 9926 1 9 . 1 1 23 23 ILE N N 91 116.350 116.350 117.881 -1.531 18517 9927 1 9 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.775 -0.375 18517 9928 1 9 . 1 1 23 23 ILE C C 91 176.690 176.690 176.903 -0.213 18517 9929 1 9 . 1 1 23 23 ILE CA C 91 65.730 65.730 62.887 2.843 18517 9930 1 9 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.323 0.447 18517 9931 1 9 . 1 1 23 23 ILE H H 91 7.860 7.860 8.116 -0.256 18517 9932 1 9 . 1 1 24 24 LYS N N 92 116.000 116.000 117.715 -1.715 18517 9933 1 9 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.183 -0.043 18517 9934 1 9 . 1 1 24 24 LYS C C 92 176.270 176.270 177.241 -0.971 18517 9935 1 9 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.678 -0.198 18517 9936 1 9 . 1 1 24 24 LYS CB C 92 33.300 33.300 33.013 0.287 18517 9937 1 9 . 1 1 24 24 LYS H H 92 7.170 7.170 7.996 -0.826 18517 9938 1 9 . 1 1 25 25 SER N N 93 114.650 114.650 114.701 -0.051 18517 9939 1 9 . 1 1 25 25 SER HA H 93 4.550 4.550 4.511 0.039 18517 9940 1 9 . 1 1 25 25 SER C C 93 173.370 173.370 173.130 0.240 18517 9941 1 9 . 1 1 25 25 SER CA C 93 57.240 57.240 58.627 -1.387 18517 9942 1 9 . 1 1 25 25 SER CB C 93 65.650 65.650 64.515 1.135 18517 9943 1 9 . 1 1 25 25 SER H H 93 7.730 7.730 7.756 -0.026 18517 9944 1 9 . 1 1 26 26 ASP N N 94 121.230 121.230 118.391 2.839 18517 9945 1 9 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.777 0.153 18517 9946 1 9 . 1 1 26 26 ASP C C 94 176.560 176.560 175.555 1.005 18517 9947 1 9 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.855 0.655 18517 9948 1 9 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.660 0.990 18517 9949 1 9 . 1 1 26 26 ASP H H 94 8.280 8.280 8.469 -0.189 18517 9950 1 9 . 1 1 27 27 GLY N N 95 109.310 109.310 108.540 0.770 18517 9951 1 9 . 1 1 27 27 GLY C C 95 171.080 171.080 171.590 -0.510 18517 9952 1 9 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.431 -0.661 18517 9953 1 9 . 1 1 27 27 GLY H H 95 8.160 8.160 7.752 0.408 18517 9954 1 9 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.606 0.534 18517 9955 1 9 . 1 1 29 29 PHE C C 97 175.230 175.230 174.951 0.279 18517 9956 1 9 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.477 0.013 18517 9957 1 9 . 1 1 29 29 PHE CB C 97 41.620 41.620 41.972 -0.352 18517 9958 1 9 . 1 1 30 30 THR N N 98 112.600 112.600 112.598 0.002 18517 9959 1 9 . 1 1 30 30 THR HA H 98 4.570 4.570 4.321 0.249 18517 9960 1 9 . 1 1 30 30 THR C C 98 176.690 176.690 173.665 3.025 18517 9961 1 9 . 1 1 30 30 THR CA C 98 60.290 60.290 60.072 0.218 18517 9962 1 9 . 1 1 30 30 THR CB C 98 71.600 71.600 72.355 -0.755 18517 9963 1 9 . 1 1 30 30 THR H H 98 8.990 8.990 8.336 0.654 18517 9964 1 9 . 1 1 31 31 ILE N N 99 119.240 119.240 122.618 -3.378 18517 9965 1 9 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.603 0.217 18517 9966 1 9 . 1 1 31 31 ILE C C 99 176.090 176.090 176.787 -0.697 18517 9967 1 9 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.155 -3.015 18517 9968 1 9 . 1 1 31 31 ILE CB C 99 36.950 36.950 38.001 -1.051 18517 9969 1 9 . 1 1 31 31 ILE H H 99 9.230 9.230 8.047 1.183 18517 9970 1 9 . 1 1 32 32 LEU N N 100 119.660 119.660 119.458 0.202 18517 9971 1 9 . 1 1 32 32 LEU HA H 100 4.030 4.030 3.783 0.247 18517 9972 1 9 . 1 1 32 32 LEU C C 100 181.050 181.050 178.804 2.246 18517 9973 1 9 . 1 1 32 32 LEU CA C 100 57.560 57.560 58.602 -1.042 18517 9974 1 9 . 1 1 32 32 LEU CB C 100 40.120 40.120 40.753 -0.633 18517 9975 1 9 . 1 1 32 32 LEU H H 100 7.310 7.310 8.341 -1.031 18517 9976 1 9 . 1 1 33 33 GLN N N 101 121.450 121.450 118.823 2.627 18517 9977 1 9 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.295 -0.045 18517 9978 1 9 . 1 1 33 33 GLN CA C 101 59.700 59.700 58.952 0.748 18517 9979 1 9 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.396 3.394 18517 9980 1 9 . 1 1 33 33 GLN H H 101 7.790 7.790 7.705 0.085 18517 9981 1 9 . 1 1 34 34 LEU C C 102 178.590 178.590 179.093 -0.503 18517 9982 1 9 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.166 0.464 18517 9983 1 9 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.579 -0.269 18517 9984 1 9 . 1 1 35 35 VAL N N 103 118.520 118.520 115.500 3.020 18517 9985 1 9 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.795 -0.375 18517 9986 1 9 . 1 1 35 35 VAL C C 103 177.930 177.930 177.798 0.132 18517 9987 1 9 . 1 1 35 35 VAL CA C 103 66.040 66.040 65.513 0.527 18517 9988 1 9 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.359 1.271 18517 9989 1 9 . 1 1 35 35 VAL H H 103 8.670 8.670 8.187 0.483 18517 9990 1 9 . 1 1 36 36 GLY N N 104 109.430 109.430 109.003 0.427 18517 9991 1 9 . 1 1 36 36 GLY C C 104 174.600 174.600 175.460 -0.860 18517 9992 1 9 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.176 0.864 18517 9993 1 9 . 1 1 36 36 GLY H H 104 7.880 7.880 7.933 -0.053 18517 9994 1 9 . 1 1 37 37 TYR N N 105 122.270 122.270 124.083 -1.813 18517 9995 1 9 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.446 -0.566 18517 9996 1 9 . 1 1 37 37 TYR C C 105 176.310 176.310 177.176 -0.866 18517 9997 1 9 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.454 3.646 18517 9998 1 9 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.653 -0.283 18517 9999 1 9 . 1 1 37 37 TYR H H 105 8.170 8.170 8.299 -0.129 18517 10000 1 9 . 1 1 38 38 LEU N N 106 120.100 120.100 120.538 -0.438 18517 10001 1 9 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.794 -0.054 18517 10002 1 9 . 1 1 38 38 LEU C C 106 178.280 178.280 178.729 -0.449 18517 10003 1 9 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.123 0.507 18517 10004 1 9 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.791 0.939 18517 10005 1 9 . 1 1 38 38 LEU H H 106 7.610 7.610 8.563 -0.953 18517 10006 1 9 . 1 1 39 39 ARG N N 107 116.670 116.670 117.674 -1.004 18517 10007 1 9 . 1 1 39 39 ARG HA H 107 3.680 3.680 3.991 -0.311 18517 10008 1 9 . 1 1 39 39 ARG C C 107 179.480 179.480 178.690 0.790 18517 10009 1 9 . 1 1 39 39 ARG CA C 107 59.580 59.580 58.053 1.527 18517 10010 1 9 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.618 1.622 18517 10011 1 9 . 1 1 39 39 ARG H H 107 8.240 8.240 8.016 0.224 18517 10012 1 9 . 1 1 40 40 VAL N N 108 121.970 121.970 120.480 1.490 18517 10013 1 9 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.730 -0.330 18517 10014 1 9 . 1 1 40 40 VAL C C 108 178.440 178.440 178.480 -0.040 18517 10015 1 9 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.980 0.970 18517 10016 1 9 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.576 -1.136 18517 10017 1 9 . 1 1 40 40 VAL H H 108 8.200 8.200 8.057 0.143 18517 10018 1 9 . 1 1 41 41 VAL N N 109 108.940 108.940 116.277 -7.337 18517 10019 1 9 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.545 0.695 18517 10020 1 9 . 1 1 41 41 VAL C C 109 175.070 175.070 177.354 -2.284 18517 10021 1 9 . 1 1 41 41 VAL CA C 109 62.590 62.590 66.141 -3.551 18517 10022 1 9 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.971 -1.321 18517 10023 1 9 . 1 1 41 41 VAL H H 109 7.760 7.760 7.936 -0.176 18517 10024 1 9 . 1 1 42 42 ASP N N 110 124.670 124.670 120.535 4.135 18517 10025 1 9 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.317 0.303 18517 10026 1 9 . 1 1 42 42 ASP C C 110 177.310 177.310 178.162 -0.852 18517 10027 1 9 . 1 1 42 42 ASP CA C 110 59.980 59.980 58.241 1.739 18517 10028 1 9 . 1 1 42 42 ASP CB C 110 44.950 44.950 41.115 3.835 18517 10029 1 9 . 1 1 42 42 ASP H H 110 7.360 7.360 8.524 -1.164 18517 10030 1 9 . 1 1 43 43 THR N N 111 102.340 102.340 112.228 -9.888 18517 10031 1 9 . 1 1 43 43 THR HA H 111 5.100 5.100 4.090 1.010 18517 10032 1 9 . 1 1 43 43 THR C C 111 174.940 174.940 176.526 -1.586 18517 10033 1 9 . 1 1 43 43 THR CA C 111 60.650 60.650 65.269 -4.619 18517 10034 1 9 . 1 1 43 43 THR CB C 111 69.610 69.610 68.541 1.069 18517 10035 1 9 . 1 1 43 43 THR H H 111 6.380 6.380 7.985 -1.605 18517 10036 1 9 . 1 1 44 44 ASP N N 112 119.750 119.750 123.644 -3.894 18517 10037 1 9 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.283 -0.423 18517 10038 1 9 . 1 1 44 44 ASP C C 112 178.850 178.850 177.804 1.046 18517 10039 1 9 . 1 1 44 44 ASP CA C 112 58.230 58.230 58.241 -0.011 18517 10040 1 9 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.882 -1.482 18517 10041 1 9 . 1 1 44 44 ASP H H 112 9.050 9.050 7.977 1.073 18517 10042 1 9 . 1 1 45 45 LEU N N 113 123.910 123.910 120.970 2.940 18517 10043 1 9 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.926 -0.116 18517 10044 1 9 . 1 1 45 45 LEU C C 113 182.040 182.040 178.195 3.845 18517 10045 1 9 . 1 1 45 45 LEU CA C 113 57.320 57.320 58.151 -0.831 18517 10046 1 9 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.487 -0.737 18517 10047 1 9 . 1 1 45 45 LEU H H 113 9.710 9.710 7.866 1.844 18517 10048 1 9 . 1 1 46 46 LEU N N 114 117.640 117.640 119.720 -2.080 18517 10049 1 9 . 1 1 46 46 LEU HA H 114 4.110 4.110 3.941 0.169 18517 10050 1 9 . 1 1 46 46 LEU C C 114 179.540 179.540 178.540 1.000 18517 10051 1 9 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.560 0.000 18517 10052 1 9 . 1 1 46 46 LEU CB C 114 41.470 41.470 42.027 -0.557 18517 10053 1 9 . 1 1 46 46 LEU H H 114 8.270 8.270 7.587 0.683 18517 10054 1 9 . 1 1 47 47 LEU N N 115 116.520 116.520 114.721 1.799 18517 10055 1 9 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.497 -0.357 18517 10056 1 9 . 1 1 47 47 LEU C C 115 173.850 173.850 176.144 -2.294 18517 10057 1 9 . 1 1 47 47 LEU CA C 115 55.420 55.420 53.747 1.673 18517 10058 1 9 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.012 3.708 18517 10059 1 9 . 1 1 47 47 LEU H H 115 8.160 8.160 7.841 0.319 18517 10060 1 9 . 1 1 48 48 LYS N N 116 114.710 114.710 117.968 -3.258 18517 10061 1 9 . 1 1 48 48 LYS HA H 116 3.810 3.810 3.921 -0.111 18517 10062 1 9 . 1 1 48 48 LYS C C 116 176.510 176.510 175.729 0.781 18517 10063 1 9 . 1 1 48 48 LYS CA C 116 57.200 57.200 57.057 0.143 18517 10064 1 9 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.897 -0.877 18517 10065 1 9 . 1 1 48 48 LYS H H 116 7.580 7.580 8.067 -0.487 18517 10066 1 9 . 1 1 49 49 VAL N N 117 119.050 119.050 118.857 0.193 18517 10067 1 9 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.146 -0.535 18517 10068 1 9 . 1 1 49 49 VAL C C 117 175.860 175.860 175.825 0.035 18517 10069 1 9 . 1 1 49 49 VAL CA C 117 63.510 63.510 60.253 3.257 18517 10070 1 9 . 1 1 49 49 VAL CB C 117 32.350 32.350 33.708 -1.357 18517 10071 1 9 . 1 1 49 49 VAL H H 117 7.980 7.980 8.291 -0.311 18517 10072 1 9 . 1 1 50 50 ASP N N 118 126.900 126.900 122.568 4.332 18517 10073 1 9 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.444 -0.194 18517 10074 1 9 . 1 1 50 50 ASP C C 118 177.700 177.700 176.935 0.765 18517 10075 1 9 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.754 0.296 18517 10076 1 9 . 1 1 50 50 ASP CB C 118 42.580 42.580 40.930 1.650 18517 10077 1 9 . 1 1 50 50 ASP H H 118 8.930 8.930 8.715 0.215 18517 10078 1 9 . 1 1 51 51 SER N N 119 124.790 124.790 120.183 4.607 18517 10079 1 9 . 1 1 51 51 SER HA H 119 4.070 4.070 4.289 -0.219 18517 10080 1 9 . 1 1 51 51 SER C C 119 177.220 177.220 176.307 0.913 18517 10081 1 9 . 1 1 51 51 SER CA C 119 61.640 61.640 61.795 -0.155 18517 10082 1 9 . 1 1 51 51 SER CB C 119 63.510 63.510 63.228 0.282 18517 10083 1 9 . 1 1 51 51 SER H H 119 8.560 8.560 8.704 -0.144 18517 10084 1 9 . 1 1 52 52 THR N N 120 119.880 119.880 116.971 2.909 18517 10085 1 9 . 1 1 52 52 THR HA H 120 4.190 4.190 4.164 0.026 18517 10086 1 9 . 1 1 52 52 THR C C 120 177.120 177.120 176.482 0.638 18517 10087 1 9 . 1 1 52 52 THR CA C 120 66.280 66.280 65.854 0.426 18517 10088 1 9 . 1 1 52 52 THR CB C 120 68.420 68.420 68.324 0.096 18517 10089 1 9 . 1 1 52 52 THR H H 120 8.310 8.310 8.342 -0.032 18517 10090 1 9 . 1 1 53 53 LYS N N 121 122.270 122.270 122.316 -0.046 18517 10091 1 9 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.128 -0.008 18517 10092 1 9 . 1 1 53 53 LYS C C 121 178.970 178.970 178.514 0.456 18517 10093 1 9 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.531 0.049 18517 10094 1 9 . 1 1 53 53 LYS CB C 121 34.250 34.250 32.123 2.127 18517 10095 1 9 . 1 1 53 53 LYS H H 121 7.700 7.700 8.136 -0.436 18517 10096 1 9 . 1 1 54 54 VAL N N 122 120.070 120.070 120.435 -0.365 18517 10097 1 9 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.916 -0.486 18517 10098 1 9 . 1 1 54 54 VAL C C 122 179.860 179.860 177.468 2.392 18517 10099 1 9 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.429 3.151 18517 10100 1 9 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.316 1.504 18517 10101 1 9 . 1 1 54 54 VAL H H 122 7.890 7.890 8.179 -0.289 18517 10102 1 9 . 1 1 55 55 ASP N N 123 122.270 122.270 120.809 1.461 18517 10103 1 9 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.352 0.118 18517 10104 1 9 . 1 1 55 55 ASP C C 123 178.630 178.630 178.383 0.247 18517 10105 1 9 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.849 -0.049 18517 10106 1 9 . 1 1 55 55 ASP CB C 123 42.020 42.020 41.008 1.012 18517 10107 1 9 . 1 1 55 55 ASP H H 123 8.270 8.270 8.093 0.177 18517 10108 1 9 . 1 1 56 56 GLU N N 124 119.600 119.600 119.172 0.428 18517 10109 1 9 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.007 -0.037 18517 10110 1 9 . 1 1 56 56 GLU C C 124 179.920 179.920 179.064 0.856 18517 10111 1 9 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.204 0.856 18517 10112 1 9 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.366 0.603 18517 10113 1 9 . 1 1 56 56 GLU H H 124 8.610 8.610 8.420 0.190 18517 10114 1 9 . 1 1 57 57 ALA N N 125 120.070 120.070 122.173 -2.103 18517 10115 1 9 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.052 -0.222 18517 10116 1 9 . 1 1 57 57 ALA C C 125 178.760 178.760 179.481 -0.721 18517 10117 1 9 . 1 1 57 57 ALA CA C 125 55.380 55.380 55.038 0.341 18517 10118 1 9 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.405 1.735 18517 10119 1 9 . 1 1 57 57 ALA H H 125 8.420 8.420 8.486 -0.066 18517 10120 1 9 . 1 1 58 58 GLY N N 126 106.740 106.740 106.068 0.672 18517 10121 1 9 . 1 1 58 58 GLY C C 126 175.740 175.740 175.928 -0.188 18517 10122 1 9 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.617 0.673 18517 10123 1 9 . 1 1 58 58 GLY H H 126 8.200 8.200 8.485 -0.285 18517 10124 1 9 . 1 1 59 59 LYS N N 127 120.920 120.920 122.161 -1.241 18517 10125 1 9 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.014 -0.084 18517 10126 1 9 . 1 1 59 59 LYS C C 127 180.320 180.320 178.585 1.735 18517 10127 1 9 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.203 1.006 18517 10128 1 9 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.322 0.658 18517 10129 1 9 . 1 1 59 59 LYS H H 127 8.000 8.000 8.242 -0.242 18517 10130 1 9 . 1 1 60 60 LYS N N 128 118.400 118.400 119.732 -1.332 18517 10131 1 9 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.103 0.067 18517 10132 1 9 . 1 1 60 60 LYS C C 128 180.030 180.030 179.081 0.949 18517 10133 1 9 . 1 1 60 60 LYS CA C 128 58.750 58.750 59.718 -0.968 18517 10134 1 9 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.538 -0.268 18517 10135 1 9 . 1 1 60 60 LYS H H 128 7.170 7.170 7.835 -0.665 18517 10136 1 9 . 1 1 61 61 VAL N N 129 121.050 121.050 120.558 0.492 18517 10137 1 9 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.225 0.055 18517 10138 1 9 . 1 1 61 61 VAL C C 129 177.120 177.120 177.512 -0.392 18517 10139 1 9 . 1 1 61 61 VAL CA C 129 67.350 67.350 66.931 0.419 18517 10140 1 9 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.252 0.378 18517 10141 1 9 . 1 1 61 61 VAL H H 129 7.980 7.980 7.948 0.032 18517 10142 1 9 . 1 1 62 62 LYS N N 130 120.040 120.040 119.791 0.249 18517 10143 1 9 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.886 -0.186 18517 10144 1 9 . 1 1 62 62 LYS C C 130 178.550 178.550 178.543 0.007 18517 10145 1 9 . 1 1 62 62 LYS CA C 130 60.330 60.330 59.904 0.426 18517 10146 1 9 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.330 1.440 18517 10147 1 9 . 1 1 62 62 LYS H H 130 8.910 8.910 8.488 0.422 18517 10148 1 9 . 1 1 63 63 ALA N N 131 119.570 119.570 121.973 -2.403 18517 10149 1 9 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.061 0.159 18517 10150 1 9 . 1 1 63 63 ALA C C 131 180.520 180.520 179.477 1.043 18517 10151 1 9 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.112 0.108 18517 10152 1 9 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.226 0.244 18517 10153 1 9 . 1 1 63 63 ALA H H 131 7.920 7.920 8.270 -0.350 18517 10154 1 9 . 1 1 64 64 TYR N N 132 120.510 120.510 120.142 0.368 18517 10155 1 9 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.163 0.297 18517 10156 1 9 . 1 1 64 64 TYR C C 132 176.510 176.510 177.762 -1.252 18517 10157 1 9 . 1 1 64 64 TYR CA C 132 61.640 61.640 62.091 -0.451 18517 10158 1 9 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.852 -0.162 18517 10159 1 9 . 1 1 64 64 TYR H H 132 7.930 7.930 7.999 -0.069 18517 10160 1 9 . 1 1 65 65 LEU N N 133 117.290 117.290 118.871 -1.581 18517 10161 1 9 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.898 -0.058 18517 10162 1 9 . 1 1 65 65 LEU C C 133 178.610 178.610 179.532 -0.922 18517 10163 1 9 . 1 1 65 65 LEU CA C 133 57.720 57.720 57.575 0.145 18517 10164 1 9 . 1 1 65 65 LEU CB C 133 40.430 40.430 40.404 0.026 18517 10165 1 9 . 1 1 65 65 LEU H H 133 8.240 8.240 8.472 -0.232 18517 10166 1 9 . 1 1 66 66 GLU N N 134 119.140 119.140 119.922 -0.782 18517 10167 1 9 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.171 -0.311 18517 10168 1 9 . 1 1 66 66 GLU C C 134 180.200 180.200 179.034 1.166 18517 10169 1 9 . 1 1 66 66 GLU CA C 134 59.940 59.940 59.175 0.765 18517 10170 1 9 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.190 0.620 18517 10171 1 9 . 1 1 66 66 GLU H H 134 8.370 8.370 8.695 -0.325 18517 10172 1 9 . 1 1 67 67 LYS N N 135 121.390 121.390 119.431 1.959 18517 10173 1 9 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.111 -0.111 18517 10174 1 9 . 1 1 67 67 LYS C C 135 179.080 179.080 178.736 0.344 18517 10175 1 9 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.738 0.882 18517 10176 1 9 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.486 -0.216 18517 10177 1 9 . 1 1 67 67 LYS H H 135 7.820 7.820 7.596 0.224 18517 10178 1 9 . 1 1 68 68 ILE N N 136 110.310 110.310 111.823 -1.513 18517 10179 1 9 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.233 0.067 18517 10180 1 9 . 1 1 68 68 ILE C C 136 175.520 175.520 176.034 -0.514 18517 10181 1 9 . 1 1 68 68 ILE CA C 136 62.430 62.430 62.300 0.130 18517 10182 1 9 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.856 -0.876 18517 10183 1 9 . 1 1 68 68 ILE H H 136 7.380 7.380 7.521 -0.141 18517 10184 1 9 . 1 1 69 69 GLY N N 137 106.680 106.680 107.330 -0.650 18517 10185 1 9 . 1 1 69 69 GLY C C 137 174.160 174.160 173.985 0.175 18517 10186 1 9 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.429 1.041 18517 10187 1 9 . 1 1 69 69 GLY H H 137 7.470 7.470 7.843 -0.373 18517 10188 1 9 . 1 1 70 70 ILE N N 138 124.310 124.310 122.129 2.181 18517 10189 1 9 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.244 -0.044 18517 10190 1 9 . 1 1 70 70 ILE C C 138 174.190 174.190 175.336 -1.146 18517 10191 1 9 . 1 1 70 70 ILE CA C 138 59.380 59.380 59.273 0.107 18517 10192 1 9 . 1 1 70 70 ILE CB C 138 37.340 37.340 37.682 -0.342 18517 10193 1 9 . 1 1 70 70 ILE H H 138 8.530 8.530 8.349 0.181 18517 10194 1 9 . 1 1 71 71 ARG N N 139 125.490 125.490 128.383 -2.893 18517 10195 1 9 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.521 0.099 18517 10196 1 9 . 1 1 71 71 ARG C C 139 175.750 175.750 175.790 -0.040 18517 10197 1 9 . 1 1 71 71 ARG CA C 139 54.660 54.660 55.452 -0.792 18517 10198 1 9 . 1 1 71 71 ARG CB C 139 33.140 33.140 31.414 1.726 18517 10199 1 9 . 1 1 71 71 ARG H H 139 8.240 8.240 8.629 -0.389 18517 10200 1 9 . 1 1 72 72 GLY N N 140 104.750 104.750 109.861 -5.111 18517 10201 1 9 . 1 1 72 72 GLY C C 140 172.920 172.920 172.442 0.478 18517 10202 1 9 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.956 0.473 18517 10203 1 9 . 1 1 72 72 GLY H H 140 7.900 7.900 8.316 -0.416 18517 10204 1 9 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.701 -0.191 18517 10205 1 9 . 1 1 73 73 ASP C C 141 175.060 175.060 175.929 -0.869 18517 10206 1 9 . 1 1 73 73 ASP CA C 141 56.170 56.170 54.453 1.718 18517 10207 1 9 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.696 -0.866 18517 10208 1 9 . 1 1 74 74 SER N N 142 110.240 110.240 115.449 -5.209 18517 10209 1 9 . 1 1 74 74 SER HA H 142 4.740 4.740 4.730 0.010 18517 10210 1 9 . 1 1 74 74 SER C C 142 175.110 175.110 175.642 -0.532 18517 10211 1 9 . 1 1 74 74 SER CA C 142 55.700 55.700 57.480 -1.780 18517 10212 1 9 . 1 1 74 74 SER CB C 142 67.390 67.390 65.429 1.961 18517 10213 1 9 . 1 1 74 74 SER H H 142 7.560 7.560 8.086 -0.526 18517 10214 1 9 . 1 1 75 75 VAL N N 143 122.950 122.950 122.754 0.196 18517 10215 1 9 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.791 -0.061 18517 10216 1 9 . 1 1 75 75 VAL C C 143 176.230 176.230 177.285 -1.055 18517 10217 1 9 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.830 0.810 18517 10218 1 9 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.341 -0.101 18517 10219 1 9 . 1 1 75 75 VAL H H 143 9.470 9.470 8.844 0.626 18517 10220 1 9 . 1 1 76 76 GLU N N 144 121.390 121.390 121.209 0.181 18517 10221 1 9 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.178 -0.538 18517 10222 1 9 . 1 1 76 76 GLU C C 144 176.880 176.880 178.606 -1.726 18517 10223 1 9 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.515 3.795 18517 10224 1 9 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.028 0.042 18517 10225 1 9 . 1 1 76 76 GLU H H 144 9.640 9.640 8.926 0.714 18517 10226 1 9 . 1 1 77 77 ALA N N 145 118.770 118.770 122.236 -3.466 18517 10227 1 9 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.263 -0.003 18517 10228 1 9 . 1 1 77 77 ALA C C 145 180.350 180.350 179.554 0.796 18517 10229 1 9 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.279 0.501 18517 10230 1 9 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.034 1.156 18517 10231 1 9 . 1 1 77 77 ALA H H 145 7.860 7.860 8.119 -0.259 18517 10232 1 9 . 1 1 78 78 ALA N N 146 120.920 120.920 122.830 -1.910 18517 10233 1 9 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.029 0.111 18517 10234 1 9 . 1 1 78 78 ALA C C 146 179.150 179.150 179.307 -0.157 18517 10235 1 9 . 1 1 78 78 ALA CA C 146 55.260 55.260 55.287 -0.027 18517 10236 1 9 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.712 0.078 18517 10237 1 9 . 1 1 78 78 ALA H H 146 8.110 8.110 8.418 -0.308 18517 10238 1 9 . 1 1 79 79 LEU N N 147 118.810 118.810 116.588 2.222 18517 10239 1 9 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.064 -0.184 18517 10240 1 9 . 1 1 79 79 LEU C C 147 179.080 179.080 178.474 0.606 18517 10241 1 9 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.881 0.509 18517 10242 1 9 . 1 1 79 79 LEU CB C 147 42.260 42.260 40.983 1.277 18517 10243 1 9 . 1 1 79 79 LEU H H 147 8.360 8.360 8.086 0.274 18517 10244 1 9 . 1 1 80 80 ASP N N 148 121.620 121.620 120.551 1.069 18517 10245 1 9 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.187 0.333 18517 10246 1 9 . 1 1 80 80 ASP C C 148 178.800 178.800 178.026 0.774 18517 10247 1 9 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.373 0.017 18517 10248 1 9 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.986 -0.236 18517 10249 1 9 . 1 1 80 80 ASP H H 148 8.770 8.770 8.299 0.471 18517 10250 1 9 . 1 1 81 81 ASN N N 149 118.630 118.630 118.348 0.282 18517 10251 1 9 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.485 0.085 18517 10252 1 9 . 1 1 81 81 ASN C C 149 177.970 177.970 177.915 0.055 18517 10253 1 9 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.024 -0.014 18517 10254 1 9 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.534 0.076 18517 10255 1 9 . 1 1 81 81 ASN H H 149 7.960 7.960 8.165 -0.205 18517 10256 1 9 . 1 1 82 82 LEU N N 150 120.030 120.030 119.571 0.459 18517 10257 1 9 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.823 0.237 18517 10258 1 9 . 1 1 82 82 LEU C C 150 177.790 177.790 179.080 -1.290 18517 10259 1 9 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.372 0.498 18517 10260 1 9 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.727 0.133 18517 10261 1 9 . 1 1 82 82 LEU H H 150 8.230 8.230 8.229 0.001 18517 10262 1 9 . 1 1 83 83 MET N N 151 115.820 115.820 116.943 -1.123 18517 10263 1 9 . 1 1 83 83 MET HA H 151 4.390 4.390 4.219 0.171 18517 10264 1 9 . 1 1 83 83 MET C C 151 179.760 179.760 178.715 1.045 18517 10265 1 9 . 1 1 83 83 MET CA C 151 57.400 57.400 58.998 -1.598 18517 10266 1 9 . 1 1 83 83 MET CB C 151 31.080 31.080 32.479 -1.399 18517 10267 1 9 . 1 1 83 83 MET H H 151 8.800 8.800 8.204 0.596 18517 10268 1 9 . 1 1 84 84 ILE N N 152 120.330 120.330 122.250 -1.920 18517 10269 1 9 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.691 0.149 18517 10270 1 9 . 1 1 84 84 ILE C C 152 178.660 178.660 178.313 0.347 18517 10271 1 9 . 1 1 84 84 ILE CA C 152 65.800 65.800 65.671 0.129 18517 10272 1 9 . 1 1 84 84 ILE CB C 152 38.450 38.450 37.569 0.881 18517 10273 1 9 . 1 1 84 84 ILE H H 152 8.540 8.540 8.501 0.039 18517 10274 1 9 . 1 1 85 85 LYS N N 153 118.930 118.930 119.508 -0.578 18517 10275 1 9 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.058 0.142 18517 10276 1 9 . 1 1 85 85 LYS C C 153 179.650 179.650 179.362 0.288 18517 10277 1 9 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.682 1.298 18517 10278 1 9 . 1 1 85 85 LYS CB C 153 33.540 33.540 32.034 1.506 18517 10279 1 9 . 1 1 85 85 LYS H H 153 7.510 7.510 8.105 -0.595 18517 10280 1 9 . 1 1 86 86 VAL N N 154 119.810 119.810 120.080 -0.270 18517 10281 1 9 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.610 0.020 18517 10282 1 9 . 1 1 86 86 VAL C C 154 178.350 178.350 178.085 0.265 18517 10283 1 9 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.542 0.688 18517 10284 1 9 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.028 1.712 18517 10285 1 9 . 1 1 86 86 VAL H H 154 8.740 8.740 8.401 0.339 18517 10286 1 9 . 1 1 87 87 TYR N N 155 118.370 118.370 117.587 0.783 18517 10287 1 9 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.246 0.024 18517 10288 1 9 . 1 1 87 87 TYR C C 155 178.580 178.580 178.339 0.241 18517 10289 1 9 . 1 1 87 87 TYR CA C 155 62.910 62.910 61.385 1.525 18517 10290 1 9 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.302 0.678 18517 10291 1 9 . 1 1 87 87 TYR H H 155 8.520 8.520 8.555 -0.035 18517 10292 1 9 . 1 1 88 88 GLU N N 156 119.900 119.900 120.758 -0.858 18517 10293 1 9 . 1 1 88 88 GLU HA H 156 4.180 4.180 3.997 0.183 18517 10294 1 9 . 1 1 88 88 GLU C C 156 179.270 179.270 178.076 1.194 18517 10295 1 9 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.655 -0.275 18517 10296 1 9 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.534 0.676 18517 10297 1 9 . 1 1 88 88 GLU H H 156 8.250 8.250 8.303 -0.053 18517 10298 1 9 . 1 1 89 89 ILE N N 157 119.510 119.510 117.741 1.769 18517 10299 1 9 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.879 0.201 18517 10300 1 9 . 1 1 89 89 ILE C C 157 177.890 177.890 178.175 -0.285 18517 10301 1 9 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.596 -0.286 18517 10302 1 9 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.432 0.778 18517 10303 1 9 . 1 1 89 89 ILE H H 157 7.630 7.630 7.782 -0.152 18517 10304 1 9 . 1 1 90 90 THR N N 158 114.240 114.240 113.703 0.537 18517 10305 1 9 . 1 1 90 90 THR HA H 158 4.130 4.130 4.170 -0.040 18517 10306 1 9 . 1 1 90 90 THR C C 158 175.530 175.530 176.048 -0.518 18517 10307 1 9 . 1 1 90 90 THR CA C 158 64.460 64.460 64.772 -0.312 18517 10308 1 9 . 1 1 90 90 THR CB C 158 69.610 69.610 69.186 0.423 18517 10309 1 9 . 1 1 90 90 THR H H 158 7.770 7.770 8.316 -0.546 18517 10310 1 9 . 1 1 91 91 LYS N N 159 120.280 120.280 119.040 1.240 18517 10311 1 9 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.335 -0.025 18517 10312 1 9 . 1 1 91 91 LYS C C 159 177.420 177.420 177.760 -0.340 18517 10313 1 9 . 1 1 91 91 LYS CA C 159 57.400 57.400 56.716 0.684 18517 10314 1 9 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.843 -0.622 18517 10315 1 9 . 1 1 91 91 LYS H H 159 7.890 7.890 8.229 -0.339 18517 10316 1 9 . 1 1 92 92 GLY N N 160 107.910 107.910 107.909 0.001 18517 10317 1 9 . 1 1 92 92 GLY C C 160 174.430 174.430 174.388 0.042 18517 10318 1 9 . 1 1 92 92 GLY CA C 160 45.980 45.980 46.288 -0.309 18517 10319 1 9 . 1 1 92 92 GLY H H 160 7.930 7.930 8.100 -0.170 18517 10320 1 9 . 1 1 93 93 THR N N 161 113.570 113.570 118.935 -5.365 18517 10321 1 9 . 1 1 93 93 THR HA H 161 4.390 4.390 4.475 -0.085 18517 10322 1 9 . 1 1 93 93 THR C C 161 174.790 174.790 174.560 0.230 18517 10323 1 9 . 1 1 93 93 THR CA C 161 61.960 61.960 62.142 -0.182 18517 10324 1 9 . 1 1 93 93 THR CB C 161 70.010 70.010 68.740 1.270 18517 10325 1 9 . 1 1 93 93 THR H H 161 7.970 7.970 7.805 0.165 18517 10326 1 9 . 1 1 94 94 VAL N N 162 121.980 121.980 120.940 1.040 18517 10327 1 9 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.541 -0.421 18517 10328 1 9 . 1 1 94 94 VAL C C 162 176.300 176.300 175.812 0.488 18517 10329 1 9 . 1 1 94 94 VAL CA C 162 62.830 62.830 60.969 1.861 18517 10330 1 9 . 1 1 94 94 VAL CB C 162 33.060 33.060 34.293 -1.233 18517 10331 1 9 . 1 1 94 94 VAL H H 162 8.130 8.130 8.115 0.015 18517 10332 1 9 . 1 1 95 95 GLU N N 163 124.140 124.140 122.240 1.900 18517 10333 1 9 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.367 -0.057 18517 10334 1 9 . 1 1 95 95 GLU C C 163 176.870 176.870 176.254 0.616 18517 10335 1 9 . 1 1 95 95 GLU CA C 163 57.080 57.080 57.523 -0.443 18517 10336 1 9 . 1 1 95 95 GLU CB C 163 30.440 30.440 30.065 0.375 18517 10337 1 9 . 1 1 95 95 GLU H H 163 8.490 8.490 8.842 -0.352 18517 10338 1 9 . 1 1 96 96 SER N N 164 116.800 116.800 115.342 1.458 18517 10339 1 9 . 1 1 96 96 SER HA H 164 4.430 4.430 4.786 -0.356 18517 10340 1 9 . 1 1 96 96 SER C C 164 174.940 174.940 172.907 2.033 18517 10341 1 9 . 1 1 96 96 SER CA C 164 59.070 59.070 57.732 1.338 18517 10342 1 9 . 1 1 96 96 SER CB C 164 64.220 64.220 64.626 -0.406 18517 10343 1 9 . 1 1 96 96 SER H H 164 8.300 8.300 7.886 0.414 18517 10344 1 9 . 1 1 97 97 SER C C 165 174.660 174.660 173.344 1.316 18517 10345 1 9 . 1 1 97 97 SER CA C 165 58.870 58.870 58.988 -0.118 18517 10346 1 9 . 1 1 97 97 SER CB C 165 64.060 64.060 63.901 0.159 18517 10347 1 9 . 1 1 98 98 ALA N N 166 125.490 125.490 128.829 -3.339 18517 10348 1 9 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.609 -0.259 18517 10349 1 9 . 1 1 98 98 ALA C C 166 177.780 177.780 177.950 -0.170 18517 10350 1 9 . 1 1 98 98 ALA CA C 166 53.000 53.000 52.344 0.656 18517 10351 1 9 . 1 1 98 98 ALA CB C 166 19.340 19.340 19.369 -0.029 18517 10352 1 9 . 1 1 98 98 ALA H H 166 8.180 8.180 8.572 -0.392 18517 10353 1 9 . 1 1 99 99 GLN N N 167 118.690 118.690 119.761 -1.071 18517 10354 1 9 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.147 0.193 18517 10355 1 9 . 1 1 99 99 GLN C C 167 176.680 176.680 178.111 -1.431 18517 10356 1 9 . 1 1 99 99 GLN CA C 167 56.250 56.250 57.601 -1.351 18517 10357 1 9 . 1 1 99 99 GLN CB C 167 29.650 29.650 29.372 0.279 18517 10358 1 9 . 1 1 99 99 GLN H H 167 8.170 8.170 8.085 0.085 18517 10359 1 9 . 1 1 100 100 GLY N N 168 109.670 109.670 107.291 2.379 18517 10360 1 9 . 1 1 100 100 GLY C C 168 174.460 174.460 174.530 -0.070 18517 10361 1 9 . 1 1 100 100 GLY CA C 168 45.670 45.670 45.522 0.148 18517 10362 1 9 . 1 1 100 100 GLY H H 168 8.250 8.250 8.753 -0.503 18517 10363 1 9 . 1 1 101 101 THR N N 169 112.660 112.660 118.844 -6.184 18517 10364 1 9 . 1 1 101 101 THR HA H 169 4.360 4.360 4.148 0.212 18517 10365 1 9 . 1 1 101 101 THR C C 169 174.720 174.720 172.959 1.761 18517 10366 1 9 . 1 1 101 101 THR CA C 169 62.080 62.080 63.198 -1.118 18517 10367 1 9 . 1 1 101 101 THR CB C 169 69.930 69.930 69.034 0.896 18517 10368 1 9 . 1 1 101 101 THR H H 169 8.070 8.070 7.648 0.422 18517 10369 1 9 . 1 1 102 102 ASP N N 170 123.090 123.090 122.825 0.265 18517 10370 1 9 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.708 -0.008 18517 10371 1 9 . 1 1 102 102 ASP C C 170 176.130 176.130 174.377 1.753 18517 10372 1 9 . 1 1 102 102 ASP CA C 170 54.780 54.780 52.738 2.042 18517 10373 1 9 . 1 1 102 102 ASP CB C 170 42.260 42.260 42.810 -0.550 18517 10374 1 9 . 1 1 102 102 ASP H H 170 8.170 8.170 7.914 0.256 18517 10375 1 9 . 1 1 103 103 SER N N 171 117.110 117.110 115.235 1.875 18517 10376 1 9 . 1 1 103 103 SER HA H 171 4.430 4.430 4.774 -0.344 18517 10377 1 9 . 1 1 103 103 SER C C 171 174.770 174.770 174.849 -0.079 18517 10378 1 9 . 1 1 103 103 SER CA C 171 57.960 57.960 56.338 1.622 18517 10379 1 9 . 1 1 103 103 SER CB C 171 64.940 64.940 66.810 -1.870 18517 10380 1 9 . 1 1 103 103 SER H H 171 8.450 8.450 8.258 0.192 18517 10381 1 9 . 1 1 104 104 GLU N N 172 122.970 122.970 121.777 1.193 18517 10382 1 9 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.969 0.061 18517 10383 1 9 . 1 1 104 104 GLU C C 172 178.860 178.860 178.139 0.721 18517 10384 1 9 . 1 1 104 104 GLU CA C 172 59.700 59.700 59.637 0.063 18517 10385 1 9 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.633 0.017 18517 10386 1 9 . 1 1 104 104 GLU H H 172 8.830 8.830 8.929 -0.099 18517 10387 1 9 . 1 1 105 105 GLU N N 173 119.750 119.750 119.265 0.485 18517 10388 1 9 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.077 -0.097 18517 10389 1 9 . 1 1 105 105 GLU C C 173 178.920 178.920 178.605 0.315 18517 10390 1 9 . 1 1 105 105 GLU CA C 173 60.060 60.060 58.980 1.081 18517 10391 1 9 . 1 1 105 105 GLU CB C 173 29.730 29.730 29.451 0.279 18517 10392 1 9 . 1 1 105 105 GLU H H 173 8.580 8.580 8.389 0.191 18517 10393 1 9 . 1 1 106 106 LEU N N 174 121.860 121.860 121.283 0.577 18517 10394 1 9 . 1 1 106 106 LEU HA H 174 4.180 4.180 3.977 0.203 18517 10395 1 9 . 1 1 106 106 LEU C C 174 178.210 178.210 178.372 -0.162 18517 10396 1 9 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.774 0.106 18517 10397 1 9 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.692 -0.542 18517 10398 1 9 . 1 1 106 106 LEU H H 174 7.920 7.920 7.369 0.551 18517 10399 1 9 . 1 1 107 107 LYS N N 175 118.740 118.740 119.452 -0.712 18517 10400 1 9 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.902 -0.122 18517 10401 1 9 . 1 1 107 107 LYS C C 175 178.700 178.700 179.244 -0.544 18517 10402 1 9 . 1 1 107 107 LYS CA C 175 61.170 61.170 59.376 1.794 18517 10403 1 9 . 1 1 107 107 LYS CB C 175 32.430 32.430 31.443 0.987 18517 10404 1 9 . 1 1 107 107 LYS H H 175 8.340 8.340 8.597 -0.257 18517 10405 1 9 . 1 1 108 108 THR N N 176 113.820 113.820 116.137 -2.317 18517 10406 1 9 . 1 1 108 108 THR HA H 176 3.840 3.840 4.009 -0.169 18517 10407 1 9 . 1 1 108 108 THR C C 176 176.620 176.620 176.816 -0.196 18517 10408 1 9 . 1 1 108 108 THR CA C 176 66.910 66.910 66.240 0.670 18517 10409 1 9 . 1 1 108 108 THR CB C 176 69.610 69.610 68.592 1.018 18517 10410 1 9 . 1 1 108 108 THR H H 176 7.950 7.950 8.030 -0.080 18517 10411 1 9 . 1 1 109 109 LEU N N 177 124.380 124.380 123.526 0.854 18517 10412 1 9 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.017 -0.187 18517 10413 1 9 . 1 1 109 109 LEU C C 177 177.790 177.790 177.899 -0.109 18517 10414 1 9 . 1 1 109 109 LEU CA C 177 57.990 57.990 58.043 -0.053 18517 10415 1 9 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.554 1.026 18517 10416 1 9 . 1 1 109 109 LEU H H 177 7.480 7.480 8.014 -0.534 18517 10417 1 9 . 1 1 110 110 LEU N N 178 117.230 117.230 119.051 -1.821 18517 10418 1 9 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.808 0.031 18517 10419 1 9 . 1 1 110 110 LEU C C 178 179.540 179.540 179.279 0.261 18517 10420 1 9 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.760 0.630 18517 10421 1 9 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.190 1.150 18517 10422 1 9 . 1 1 110 110 LEU H H 178 8.670 8.670 8.492 0.178 18517 10423 1 9 . 1 1 111 111 LEU N N 179 119.230 119.230 121.268 -2.038 18517 10424 1 9 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.008 0.072 18517 10425 1 9 . 1 1 111 111 LEU C C 179 179.310 179.310 178.969 0.341 18517 10426 1 9 . 1 1 111 111 LEU CA C 179 58.390 58.390 58.171 0.219 18517 10427 1 9 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.752 1.268 18517 10428 1 9 . 1 1 111 111 LEU H H 179 7.940 7.940 8.602 -0.662 18517 10429 1 9 . 1 1 112 112 LYS N N 180 121.910 121.910 120.414 1.496 18517 10430 1 9 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.047 0.143 18517 10431 1 9 . 1 1 112 112 LYS C C 180 178.740 178.740 179.403 -0.663 18517 10432 1 9 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.924 -0.744 18517 10433 1 9 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.370 -0.500 18517 10434 1 9 . 1 1 112 112 LYS H H 180 7.420 7.420 7.986 -0.566 18517 10435 1 9 . 1 1 113 113 PHE N N 181 118.220 118.220 119.069 -0.849 18517 10436 1 9 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.257 0.493 18517 10437 1 9 . 1 1 113 113 PHE C C 181 178.520 178.520 178.070 0.450 18517 10438 1 9 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.202 -3.122 18517 10439 1 9 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.325 -0.345 18517 10440 1 9 . 1 1 113 113 PHE H H 181 9.000 9.000 8.703 0.297 18517 10441 1 9 . 1 1 114 114 SER N N 182 113.300 113.300 114.592 -1.292 18517 10442 1 9 . 1 1 114 114 SER HA H 182 3.930 3.930 4.069 -0.139 18517 10443 1 9 . 1 1 114 114 SER C C 182 177.080 177.080 176.794 0.286 18517 10444 1 9 . 1 1 114 114 SER CA C 182 62.000 62.000 62.067 -0.067 18517 10445 1 9 . 1 1 114 114 SER CB C 182 63.510 63.510 62.967 0.543 18517 10446 1 9 . 1 1 114 114 SER H H 182 8.620 8.620 8.746 -0.126 18517 10447 1 9 . 1 1 115 115 GLU N N 183 121.540 121.540 121.304 0.236 18517 10448 1 9 . 1 1 115 115 GLU HA H 183 4.070 4.070 3.977 0.093 18517 10449 1 9 . 1 1 115 115 GLU C C 183 179.860 179.860 178.459 1.401 18517 10450 1 9 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.451 0.329 18517 10451 1 9 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.706 0.184 18517 10452 1 9 . 1 1 115 115 GLU H H 183 8.250 8.250 8.488 -0.238 18517 10453 1 9 . 1 1 116 116 ASP N N 184 121.740 121.740 120.664 1.076 18517 10454 1 9 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.402 0.108 18517 10455 1 9 . 1 1 116 116 ASP C C 184 179.570 179.570 178.244 1.326 18517 10456 1 9 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.459 0.101 18517 10457 1 9 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.898 0.092 18517 10458 1 9 . 1 1 116 116 ASP H H 184 8.840 8.840 8.339 0.501 18517 10459 1 9 . 1 1 117 117 LEU N N 185 121.420 121.420 120.986 0.434 18517 10460 1 9 . 1 1 117 117 LEU HA H 185 4.130 4.130 3.972 0.158 18517 10461 1 9 . 1 1 117 117 LEU C C 185 178.840 178.840 178.596 0.244 18517 10462 1 9 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.211 0.019 18517 10463 1 9 . 1 1 117 117 LEU CB C 185 42.650 42.650 42.034 0.616 18517 10464 1 9 . 1 1 117 117 LEU H H 185 8.350 8.350 8.365 -0.015 18517 10465 1 9 . 1 1 118 118 LYS N N 186 119.640 119.640 118.093 1.547 18517 10466 1 9 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.818 0.302 18517 10467 1 9 . 1 1 118 118 LYS C C 186 178.820 178.820 178.951 -0.131 18517 10468 1 9 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.772 -0.032 18517 10469 1 9 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.109 0.401 18517 10470 1 9 . 1 1 118 118 LYS H H 186 8.220 8.220 8.438 -0.218 18517 10471 1 9 . 1 1 119 119 ALA N N 187 120.160 120.160 122.497 -2.337 18517 10472 1 9 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.063 0.097 18517 10473 1 9 . 1 1 119 119 ALA C C 187 180.450 180.450 179.831 0.619 18517 10474 1 9 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.365 -0.226 18517 10475 1 9 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.062 0.408 18517 10476 1 9 . 1 1 119 119 ALA H H 187 8.010 8.010 8.122 -0.112 18517 10477 1 9 . 1 1 120 120 GLU N N 188 117.930 117.930 117.727 0.203 18517 10478 1 9 . 1 1 120 120 GLU HA H 188 4.180 4.180 4.065 0.115 18517 10479 1 9 . 1 1 120 120 GLU C C 188 178.780 178.780 179.130 -0.350 18517 10480 1 9 . 1 1 120 120 GLU CA C 188 58.830 58.830 58.965 -0.134 18517 10481 1 9 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.080 0.890 18517 10482 1 9 . 1 1 120 120 GLU H H 188 7.640 7.640 8.139 -0.499 18517 10483 1 9 . 1 1 121 121 GLN N N 189 117.230 117.230 120.490 -3.260 18517 10484 1 9 . 1 1 121 121 GLN HA H 189 4.230 4.230 3.464 0.766 18517 10485 1 9 . 1 1 121 121 GLN C C 189 179.190 179.190 177.900 1.290 18517 10486 1 9 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.982 0.758 18517 10487 1 9 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.567 1.083 18517 10488 1 9 . 1 1 121 121 GLN H H 189 8.280 8.280 8.256 0.024 18517 10489 1 9 . 1 1 122 122 GLU N N 190 118.340 118.340 119.554 -1.214 18517 10490 1 9 . 1 1 122 122 GLU HA H 190 4.120 4.120 4.054 0.066 18517 10491 1 9 . 1 1 122 122 GLU C C 190 178.210 178.210 179.176 -0.966 18517 10492 1 9 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.846 -0.096 18517 10493 1 9 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.218 0.752 18517 10494 1 9 . 1 1 122 122 GLU H H 190 8.250 8.250 7.992 0.258 18517 10495 1 9 . 1 1 123 123 LEU N N 191 118.930 118.930 120.612 -1.682 18517 10496 1 9 . 1 1 123 123 LEU HA H 191 4.090 4.090 4.224 -0.134 18517 10497 1 9 . 1 1 123 123 LEU C C 191 178.500 178.500 179.267 -0.767 18517 10498 1 9 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.048 -1.048 18517 10499 1 9 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.818 0.682 18517 10500 1 9 . 1 1 123 123 LEU H H 191 7.530 7.530 8.204 -0.674 18517 10501 1 9 . 1 1 124 124 HIS N N 192 115.650 115.650 118.729 -3.079 18517 10502 1 9 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.320 0.400 18517 10503 1 9 . 1 1 124 124 HIS C C 192 176.090 176.090 177.519 -1.429 18517 10504 1 9 . 1 1 124 124 HIS CA C 192 56.690 56.690 60.138 -3.448 18517 10505 1 9 . 1 1 124 124 HIS CB C 192 30.760 30.760 29.988 0.773 18517 10506 1 9 . 1 1 124 124 HIS H H 192 7.450 7.450 8.328 -0.878 18517 10507 1 9 . 1 1 125 125 SER N N 193 115.480 115.480 116.117 -0.637 18517 10508 1 9 . 1 1 125 125 SER HA H 193 4.310 4.310 4.330 -0.020 18517 10509 1 9 . 1 1 125 125 SER CA C 193 60.180 60.180 62.116 -1.936 18517 10510 1 9 . 1 1 125 125 SER CB C 193 64.060 64.060 62.739 1.321 18517 10511 1 9 . 1 1 125 125 SER H H 193 8.020 8.020 8.204 -0.184 18517 10512 1 9 . 1 1 126 126 GLU C C 194 177.410 177.410 179.157 -1.747 18517 10513 1 9 . 1 1 126 126 GLU CA C 194 57.840 57.840 59.010 -1.170 18517 10514 1 9 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.641 0.249 18517 10515 1 9 . 1 1 127 127 ALA N N 195 122.910 122.910 123.288 -0.378 18517 10516 1 9 . 1 1 127 127 ALA HA H 195 4.190 4.190 3.940 0.250 18517 10517 1 9 . 1 1 127 127 ALA C C 195 178.610 178.610 179.147 -0.537 18517 10518 1 9 . 1 1 127 127 ALA CA C 195 53.790 53.790 55.070 -1.280 18517 10519 1 9 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.494 0.766 18517 10520 1 9 . 1 1 127 127 ALA H H 195 8.020 8.020 8.261 -0.241 18517 10521 1 9 . 1 1 128 128 LYS N N 196 117.770 117.770 114.667 3.103 18517 10522 1 9 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.474 -0.214 18517 10523 1 9 . 1 1 128 128 LYS C C 196 177.400 177.400 176.211 1.189 18517 10524 1 9 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.759 2.241 18517 10525 1 9 . 1 1 128 128 LYS CB C 196 32.740 32.740 33.006 -0.266 18517 10526 1 9 . 1 1 128 128 LYS H H 196 7.990 7.990 8.006 -0.016 18517 10527 1 9 . 1 1 129 129 GLY N N 197 109.010 109.010 108.594 0.416 18517 10528 1 9 . 1 1 129 129 GLY C C 197 175.770 175.770 175.595 0.175 18517 10529 1 9 . 1 1 129 129 GLY CA C 197 46.100 46.100 44.965 1.135 18517 10530 1 9 . 1 1 129 129 GLY H H 197 8.220 8.220 7.553 0.667 18517 10531 1 9 . 1 1 130 130 GLY N N 198 109.150 109.150 112.610 -3.460 18517 10532 1 9 . 1 1 130 130 GLY C C 198 174.760 174.760 175.336 -0.576 18517 10533 1 9 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.189 -0.259 18517 10534 1 9 . 1 1 130 130 GLY H H 198 8.210 8.210 8.709 -0.499 18517 10535 1 9 . 1 1 131 131 GLU N N 199 121.560 121.560 121.149 0.411 18517 10536 1 9 . 1 1 131 131 GLU HA H 199 4.020 4.020 3.967 0.053 18517 10537 1 9 . 1 1 131 131 GLU C C 199 178.500 178.500 178.307 0.193 18517 10538 1 9 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.623 0.277 18517 10539 1 9 . 1 1 131 131 GLU CB C 199 29.570 29.570 29.375 0.195 18517 10540 1 9 . 1 1 131 131 GLU H H 199 8.510 8.510 8.756 -0.246 18517 10541 1 9 . 1 1 132 132 ALA N N 200 122.390 122.390 122.132 0.258 18517 10542 1 9 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.164 0.036 18517 10543 1 9 . 1 1 132 132 ALA C C 200 180.360 180.360 179.866 0.494 18517 10544 1 9 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.745 0.035 18517 10545 1 9 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.108 0.282 18517 10546 1 9 . 1 1 132 132 ALA H H 200 8.190 8.190 7.412 0.778 18517 10547 1 9 . 1 1 133 133 LEU N N 201 120.800 120.800 120.841 -0.041 18517 10548 1 9 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.037 0.173 18517 10549 1 9 . 1 1 133 133 LEU C C 201 179.270 179.270 178.520 0.750 18517 10550 1 9 . 1 1 133 133 LEU CA C 201 57.680 57.680 58.053 -0.373 18517 10551 1 9 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.946 0.234 18517 10552 1 9 . 1 1 133 133 LEU H H 201 7.720 7.720 8.402 -0.682 18517 10553 1 9 . 1 1 134 134 LEU N N 202 120.680 120.680 119.861 0.819 18517 10554 1 9 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.872 0.108 18517 10555 1 9 . 1 1 134 134 LEU C C 202 179.030 179.030 178.776 0.254 18517 10556 1 9 . 1 1 134 134 LEU CA C 202 58.430 58.430 58.253 0.177 18517 10557 1 9 . 1 1 134 134 LEU CB C 202 41.620 41.620 40.414 1.206 18517 10558 1 9 . 1 1 134 134 LEU H H 202 8.470 8.470 8.719 -0.249 18517 10559 1 9 . 1 1 135 135 SER N N 203 113.290 113.290 114.428 -1.138 18517 10560 1 9 . 1 1 135 135 SER HA H 203 4.180 4.180 4.057 0.123 18517 10561 1 9 . 1 1 135 135 SER C C 203 177.300 177.300 176.971 0.329 18517 10562 1 9 . 1 1 135 135 SER CA C 203 62.080 62.080 62.184 -0.104 18517 10563 1 9 . 1 1 135 135 SER CB C 203 63.030 63.030 62.742 0.288 18517 10564 1 9 . 1 1 135 135 SER H H 203 8.210 8.210 8.310 -0.100 18517 10565 1 9 . 1 1 136 136 SER N N 204 117.500 117.500 118.035 -0.535 18517 10566 1 9 . 1 1 136 136 SER HA H 204 4.050 4.050 4.100 -0.050 18517 10567 1 9 . 1 1 136 136 SER C C 204 177.570 177.570 176.574 0.996 18517 10568 1 9 . 1 1 136 136 SER CA C 204 61.880 61.880 61.539 0.341 18517 10569 1 9 . 1 1 136 136 SER CB C 204 63.510 63.510 62.962 0.548 18517 10570 1 9 . 1 1 136 136 SER H H 204 7.730 7.730 7.953 -0.223 18517 10571 1 9 . 1 1 137 137 MET N N 205 122.500 122.500 121.944 0.556 18517 10572 1 9 . 1 1 137 137 MET HA H 205 4.140 4.140 4.046 0.094 18517 10573 1 9 . 1 1 137 137 MET C C 205 177.680 177.680 178.614 -0.934 18517 10574 1 9 . 1 1 137 137 MET CA C 205 60.140 60.140 59.347 0.793 18517 10575 1 9 . 1 1 137 137 MET CB C 205 33.460 33.460 32.528 0.932 18517 10576 1 9 . 1 1 137 137 MET H H 205 8.170 8.170 8.649 -0.479 18517 10577 1 9 . 1 1 138 138 LYS N N 206 121.410 121.410 118.955 2.455 18517 10578 1 9 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.978 -0.228 18517 10579 1 9 . 1 1 138 138 LYS C C 206 178.780 178.780 179.251 -0.471 18517 10580 1 9 . 1 1 138 138 LYS CA C 206 60.330 60.330 59.432 0.898 18517 10581 1 9 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.216 0.054 18517 10582 1 9 . 1 1 138 138 LYS H H 206 8.810 8.810 8.158 0.652 18517 10583 1 9 . 1 1 139 139 THR N N 207 116.580 116.580 117.121 -0.541 18517 10584 1 9 . 1 1 139 139 THR HA H 207 4.060 4.060 3.925 0.135 18517 10585 1 9 . 1 1 139 139 THR C C 207 176.730 176.730 176.819 -0.089 18517 10586 1 9 . 1 1 139 139 THR CA C 207 67.150 67.150 66.734 0.417 18517 10587 1 9 . 1 1 139 139 THR CB C 207 69.220 69.220 68.671 0.549 18517 10588 1 9 . 1 1 139 139 THR H H 207 7.930 7.930 8.047 -0.117 18517 10589 1 9 . 1 1 140 140 GLN N N 208 121.390 121.390 121.022 0.368 18517 10590 1 9 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.043 0.017 18517 10591 1 9 . 1 1 140 140 GLN C C 208 178.550 178.550 177.957 0.593 18517 10592 1 9 . 1 1 140 140 GLN CA C 208 59.300 59.300 58.540 0.760 18517 10593 1 9 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.195 0.665 18517 10594 1 9 . 1 1 140 140 GLN H H 208 7.600 7.600 8.413 -0.813 18517 10595 1 9 . 1 1 141 141 HIS N N 209 122.360 122.360 119.308 3.052 18517 10596 1 9 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.180 -0.350 18517 10597 1 9 . 1 1 141 141 HIS C C 209 176.390 176.390 177.350 -0.960 18517 10598 1 9 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.140 1.580 18517 10599 1 9 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.052 -0.952 18517 10600 1 9 . 1 1 141 141 HIS H H 209 8.980 8.980 8.182 0.798 18517 10601 1 9 . 1 1 142 142 ASP N N 210 120.740 120.740 119.401 1.339 18517 10602 1 9 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.303 0.047 18517 10603 1 9 . 1 1 142 142 ASP C C 210 179.490 179.490 178.615 0.875 18517 10604 1 9 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.939 -0.019 18517 10605 1 9 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.921 -0.331 18517 10606 1 9 . 1 1 142 142 ASP H H 210 8.770 8.770 8.452 0.318 18517 10607 1 9 . 1 1 143 143 GLU N N 211 119.010 119.010 121.166 -2.156 18517 10608 1 9 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.062 -0.092 18517 10609 1 9 . 1 1 143 143 GLU C C 211 179.070 179.070 179.004 0.066 18517 10610 1 9 . 1 1 143 143 GLU CA C 211 59.300 59.300 58.794 0.506 18517 10611 1 9 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.342 0.148 18517 10612 1 9 . 1 1 143 143 GLU H H 211 7.850 7.850 8.086 -0.236 18517 10613 1 9 . 1 1 144 144 LEU N N 212 122.500 122.500 119.867 2.633 18517 10614 1 9 . 1 1 144 144 LEU HA H 212 4.070 4.070 3.993 0.077 18517 10615 1 9 . 1 1 144 144 LEU C C 212 179.340 179.340 178.975 0.365 18517 10616 1 9 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.036 0.354 18517 10617 1 9 . 1 1 144 144 LEU CB C 212 42.180 42.180 40.814 1.366 18517 10618 1 9 . 1 1 144 144 LEU H H 212 8.070 8.070 8.343 -0.273 18517 10619 1 9 . 1 1 145 145 LEU N N 213 118.110 118.110 119.463 -1.353 18517 10620 1 9 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.537 0.663 18517 10621 1 9 . 1 1 145 145 LEU C C 213 179.610 179.610 178.619 0.991 18517 10622 1 9 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.590 1.160 18517 10623 1 9 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.469 -0.239 18517 10624 1 9 . 1 1 145 145 LEU H H 213 8.370 8.370 8.062 0.308 18517 10625 1 9 . 1 1 146 146 LYS N N 214 117.290 117.290 119.763 -2.473 18517 10626 1 9 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.831 -0.001 18517 10627 1 9 . 1 1 146 146 LYS C C 214 179.900 179.900 178.722 1.178 18517 10628 1 9 . 1 1 146 146 LYS CA C 214 60.330 60.330 60.043 0.287 18517 10629 1 9 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.225 0.125 18517 10630 1 9 . 1 1 146 146 LYS H H 214 7.560 7.560 8.228 -0.668 18517 10631 1 9 . 1 1 147 147 LYS N N 215 120.330 120.330 119.378 0.952 18517 10632 1 9 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.071 -0.051 18517 10633 1 9 . 1 1 147 147 LYS C C 215 180.550 180.550 179.438 1.112 18517 10634 1 9 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.324 0.776 18517 10635 1 9 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.119 0.621 18517 10636 1 9 . 1 1 147 147 LYS H H 215 7.830 7.830 7.830 -0.000 18517 10637 1 9 . 1 1 148 148 PHE N N 216 117.370 117.370 117.394 -0.024 18517 10638 1 9 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.187 -0.107 18517 10639 1 9 . 1 1 148 148 PHE C C 216 178.200 178.200 177.269 0.931 18517 10640 1 9 . 1 1 148 148 PHE CA C 216 62.120 62.120 60.165 1.955 18517 10641 1 9 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.096 1.624 18517 10642 1 9 . 1 1 148 148 PHE H H 216 8.010 8.010 8.337 -0.327 18517 10643 1 9 . 1 1 149 149 ALA N N 217 118.990 118.990 120.836 -1.846 18517 10644 1 9 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.149 -0.039 18517 10645 1 9 . 1 1 149 149 ALA C C 217 177.330 177.330 178.112 -0.782 18517 10646 1 9 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.554 0.196 18517 10647 1 9 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.741 -1.141 18517 10648 1 9 . 1 1 149 149 ALA H H 217 7.720 7.720 7.834 -0.114 18517 10649 1 9 . 1 1 150 150 ALA N N 218 118.690 118.690 120.284 -1.594 18517 10650 1 9 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.320 0.040 18517 10651 1 9 . 1 1 150 150 ALA C C 218 177.930 177.930 177.964 -0.034 18517 10652 1 9 . 1 1 150 150 ALA CA C 218 52.090 52.090 53.070 -0.980 18517 10653 1 9 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.484 0.256 18517 10654 1 9 . 1 1 150 150 ALA H H 218 7.280 7.280 7.668 -0.388 18517 10655 1 9 . 1 1 151 151 LEU N N 219 119.980 119.980 120.730 -0.750 18517 10656 1 9 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.319 -0.049 18517 10657 1 9 . 1 1 151 151 LEU C C 219 176.150 176.150 175.087 1.063 18517 10658 1 9 . 1 1 151 151 LEU CA C 219 56.170 56.170 55.513 0.657 18517 10659 1 9 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.299 -0.489 18517 10660 1 9 . 1 1 151 151 LEU H H 219 7.050 7.050 7.669 -0.619 18517 10661 1 9 . 1 1 152 152 THR N N 220 112.070 112.070 116.251 -4.181 18517 10662 1 9 . 1 1 152 152 THR HA H 220 4.700 4.700 4.908 -0.208 18517 10663 1 9 . 1 1 152 152 THR C C 220 173.400 173.400 173.265 0.135 18517 10664 1 9 . 1 1 152 152 THR CA C 220 58.190 58.190 57.935 0.255 18517 10665 1 9 . 1 1 152 152 THR CB C 220 70.960 70.960 69.789 1.171 18517 10666 1 9 . 1 1 152 152 THR H H 220 8.040 8.040 8.052 -0.012 18517 10667 1 9 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.517 0.193 18517 10668 1 9 . 1 1 153 153 PRO C C 221 176.720 176.720 176.916 -0.196 18517 10669 1 9 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.383 0.527 18517 10670 1 9 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.532 1.718 18517 10671 1 9 . 1 1 154 154 THR N N 222 120.460 120.460 119.093 1.367 18517 10672 1 9 . 1 1 154 154 THR HA H 222 4.250 4.250 4.404 -0.154 18517 10673 1 9 . 1 1 154 154 THR C C 222 175.190 175.190 175.022 0.168 18517 10674 1 9 . 1 1 154 154 THR CA C 222 64.650 64.650 62.413 2.237 18517 10675 1 9 . 1 1 154 154 THR CB C 222 70.410 70.410 67.399 3.011 18517 10676 1 9 . 1 1 154 154 THR H H 222 8.530 8.530 8.440 0.090 18517 10677 1 9 . 1 1 155 155 PHE N N 223 122.260 122.260 123.737 -1.477 18517 10678 1 9 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.554 0.436 18517 10679 1 9 . 1 1 155 155 PHE C C 223 172.560 172.560 175.389 -2.829 18517 10680 1 9 . 1 1 155 155 PHE CA C 223 56.770 56.770 58.351 -1.581 18517 10681 1 9 . 1 1 155 155 PHE CB C 223 40.590 40.590 38.623 1.967 18517 10682 1 9 . 1 1 155 155 PHE H H 223 8.950 8.950 7.788 1.162 18517 10683 1 9 . 1 1 156 156 LEU N N 224 123.440 123.440 119.992 3.448 18517 10684 1 9 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.451 0.219 18517 10685 1 9 . 1 1 156 156 LEU C C 224 175.090 175.090 176.471 -1.381 18517 10686 1 9 . 1 1 156 156 LEU CA C 224 54.030 54.030 53.920 0.110 18517 10687 1 9 . 1 1 156 156 LEU CB C 224 46.300 46.300 42.855 3.445 18517 10688 1 9 . 1 1 156 156 LEU H H 224 7.210 7.210 7.104 0.106 18517 10689 1 9 . 1 1 157 157 THR N N 225 113.010 113.010 113.053 -0.043 18517 10690 1 9 . 1 1 157 157 THR HA H 225 4.790 4.790 4.552 0.238 18517 10691 1 9 . 1 1 157 157 THR C C 225 176.130 176.130 173.928 2.202 18517 10692 1 9 . 1 1 157 157 THR CA C 225 59.860 59.860 61.185 -1.325 18517 10693 1 9 . 1 1 157 157 THR CB C 225 72.860 72.860 70.884 1.976 18517 10694 1 9 . 1 1 157 157 THR H H 225 9.200 9.200 8.018 1.182 18517 10695 1 9 . 1 1 158 158 SER N N 226 115.350 115.350 117.407 -2.057 18517 10696 1 9 . 1 1 158 158 SER C C 226 177.410 177.410 176.083 1.327 18517 10697 1 9 . 1 1 158 158 SER CA C 226 57.400 57.400 58.575 -1.175 18517 10698 1 9 . 1 1 158 158 SER CB C 226 66.200 66.200 63.786 2.414 18517 10699 1 9 . 1 1 158 158 SER H H 226 8.830 8.830 8.547 0.283 18517 10700 1 9 . 1 1 159 159 GLU N N 227 121.200 121.200 120.402 0.798 18517 10701 1 9 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.863 0.157 18517 10702 1 9 . 1 1 159 159 GLU C C 227 177.680 177.680 177.361 0.319 18517 10703 1 9 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.969 0.531 18517 10704 1 9 . 1 1 159 159 GLU CB C 227 29.570 29.570 28.852 0.718 18517 10705 1 9 . 1 1 159 159 GLU H H 227 8.320 8.320 8.849 -0.529 18517 10706 1 9 . 1 1 160 160 ASP N N 228 115.350 115.350 118.766 -3.416 18517 10707 1 9 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.434 0.116 18517 10708 1 9 . 1 1 160 160 ASP C C 228 177.640 177.640 177.918 -0.278 18517 10709 1 9 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.641 0.759 18517 10710 1 9 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.833 2.217 18517 10711 1 9 . 1 1 160 160 ASP H H 228 7.570 7.570 8.195 -0.625 18517 10712 1 9 . 1 1 161 161 ILE N N 229 108.150 108.150 113.837 -5.687 18517 10713 1 9 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.432 0.078 18517 10714 1 9 . 1 1 161 161 ILE C C 229 173.130 173.130 176.898 -3.768 18517 10715 1 9 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.228 -0.938 18517 10716 1 9 . 1 1 161 161 ILE CB C 229 39.400 39.400 39.185 0.215 18517 10717 1 9 . 1 1 161 161 ILE H H 229 7.190 7.190 7.851 -0.661 18517 10718 1 9 . 1 1 162 162 SER N N 230 115.290 115.290 117.549 -2.259 18517 10719 1 9 . 1 1 162 162 SER HA H 230 4.760 4.760 4.262 0.498 18517 10720 1 9 . 1 1 162 162 SER C C 230 176.060 176.060 174.899 1.161 18517 10721 1 9 . 1 1 162 162 SER CA C 230 57.920 57.920 56.538 1.381 18517 10722 1 9 . 1 1 162 162 SER CB C 230 66.120 66.120 61.162 4.958 18517 10723 1 9 . 1 1 162 162 SER H H 230 7.460 7.460 8.094 -0.634 18517 10724 1 9 . 1 1 163 163 GLY C C 231 173.260 173.260 173.002 0.258 18517 10725 1 9 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.790 0.760 18517 10726 1 9 . 1 1 164 164 TYR N N 232 115.290 115.290 117.678 -2.388 18517 10727 1 9 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.766 -0.066 18517 10728 1 9 . 1 1 164 164 TYR C C 232 172.820 172.820 173.519 -0.699 18517 10729 1 9 . 1 1 164 164 TYR CA C 232 55.100 55.100 56.133 -1.033 18517 10730 1 9 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.324 0.476 18517 10731 1 9 . 1 1 164 164 TYR H H 232 7.370 7.370 7.586 -0.216 18517 10732 1 9 . 1 1 165 165 LEU N N 233 120.980 120.980 122.449 -1.469 18517 10733 1 9 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.523 -0.093 18517 10734 1 9 . 1 1 165 165 LEU C C 233 176.360 176.360 177.540 -1.180 18517 10735 1 9 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.159 1.501 18517 10736 1 9 . 1 1 165 165 LEU CB C 233 40.430 40.430 41.358 -0.927 18517 10737 1 9 . 1 1 165 165 LEU H H 233 8.830 8.830 8.928 -0.098 18517 10738 1 9 . 1 1 166 166 THR N N 234 116.170 116.170 116.255 -0.085 18517 10739 1 9 . 1 1 166 166 THR HA H 234 4.010 4.010 3.491 0.519 18517 10740 1 9 . 1 1 166 166 THR C C 234 173.070 173.070 174.042 -0.972 18517 10741 1 9 . 1 1 166 166 THR CA C 234 62.910 62.910 63.968 -1.058 18517 10742 1 9 . 1 1 166 166 THR CB C 234 70.170 70.170 68.704 1.466 18517 10743 1 9 . 1 1 166 166 THR H H 234 8.050 8.050 7.885 0.165 18517 10744 1 9 . 1 1 167 167 VAL N N 235 117.640 117.640 115.814 1.826 18517 10745 1 9 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.312 -0.102 18517 10746 1 9 . 1 1 167 167 VAL C C 235 172.330 172.330 174.212 -1.882 18517 10747 1 9 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.491 1.259 18517 10748 1 9 . 1 1 167 167 VAL CB C 235 35.880 35.880 31.219 4.661 18517 10749 1 9 . 1 1 167 167 VAL H H 235 7.160 7.160 7.420 -0.260 18517 10750 1 9 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.547 -0.357 18517 10751 1 9 . 1 1 168 168 PRO C C 236 173.710 173.710 175.730 -2.020 18517 10752 1 9 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.631 1.199 18517 10753 1 9 . 1 1 168 168 PRO CB C 236 32.270 32.270 32.868 -0.598 18517 10754 1 9 . 1 1 169 169 GLU N N 237 113.540 113.540 118.222 -4.682 18517 10755 1 9 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.024 0.356 18517 10756 1 9 . 1 1 169 169 GLU C C 237 176.690 176.690 178.550 -1.860 18517 10757 1 9 . 1 1 169 169 GLU CA C 237 53.750 53.750 56.031 -2.281 18517 10758 1 9 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.636 2.584 18517 10759 1 9 . 1 1 169 169 GLU H H 237 7.930 7.930 8.183 -0.253 18517 10760 1 9 . 1 1 170 170 TYR N N 238 119.400 119.400 121.491 -2.091 18517 10761 1 9 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.021 -0.021 18517 10762 1 9 . 1 1 170 170 TYR C C 238 177.610 177.610 176.961 0.649 18517 10763 1 9 . 1 1 170 170 TYR CA C 238 62.630 62.630 60.640 1.990 18517 10764 1 9 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.305 -0.565 18517 10765 1 9 . 1 1 170 170 TYR H H 238 8.490 8.490 8.669 -0.179 18517 10766 1 9 . 1 1 171 171 GLY N N 239 104.160 104.160 103.720 0.440 18517 10767 1 9 . 1 1 171 171 GLY C C 239 173.350 173.350 173.309 0.041 18517 10768 1 9 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.625 0.645 18517 10769 1 9 . 1 1 171 171 GLY H H 239 7.960 7.960 7.939 0.021 18517 10770 1 9 . 1 1 172 172 ALA N N 240 121.860 121.860 123.983 -2.123 18517 10771 1 9 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.771 -0.601 18517 10772 1 9 . 1 1 172 172 ALA C C 240 172.160 172.160 174.754 -2.594 18517 10773 1 9 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.059 1.051 18517 10774 1 9 . 1 1 172 172 ALA CB C 240 20.930 20.930 20.165 0.765 18517 10775 1 9 . 1 1 172 172 ALA H H 240 6.910 6.910 7.951 -1.041 18517 10776 1 9 . 1 1 173 173 PRO HA H 241 4.550 4.550 4.001 0.549 18517 10777 1 9 . 1 1 173 173 PRO C C 241 176.610 176.610 175.607 1.003 18517 10778 1 9 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.553 -1.033 18517 10779 1 9 . 1 1 173 173 PRO CB C 241 33.300 33.300 31.550 1.750 18517 10780 1 9 . 1 1 174 174 MET N N 242 114.000 114.000 123.903 -9.903 18517 10781 1 9 . 1 1 174 174 MET HA H 242 4.390 4.390 4.540 -0.150 18517 10782 1 9 . 1 1 174 174 MET C C 242 173.960 173.960 174.950 -0.990 18517 10783 1 9 . 1 1 174 174 MET CA C 242 54.660 54.660 54.706 -0.047 18517 10784 1 9 . 1 1 174 174 MET CB C 242 34.170 34.170 34.961 -0.791 18517 10785 1 9 . 1 1 174 174 MET H H 242 8.040 8.040 8.259 -0.219 18517 10786 1 9 . 1 1 175 175 ASN N N 243 119.570 119.570 120.995 -1.425 18517 10787 1 9 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.770 0.170 18517 10788 1 9 . 1 1 175 175 ASN C C 243 174.320 174.320 175.351 -1.031 18517 10789 1 9 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.782 0.298 18517 10790 1 9 . 1 1 175 175 ASN CB C 243 38.850 38.850 38.558 0.292 18517 10791 1 9 . 1 1 175 175 ASN H H 243 7.960 7.960 8.646 -0.686 18517 10792 1 9 . 1 1 176 176 ALA N N 244 132.250 132.250 129.331 2.919 18517 10793 1 9 . 1 1 176 176 ALA C C 244 181.580 181.580 178.352 3.228 18517 10794 1 9 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.054 0.716 18517 10795 1 9 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.743 0.287 18517 10796 1 9 . 1 1 176 176 ALA H H 244 12.110 12.110 8.664 3.446 18517 10797 1 9 . 1 1 177 177 ALA N N 245 125.780 125.780 121.302 4.478 18517 10798 1 9 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.983 -0.113 18517 10799 1 9 . 1 1 177 177 ALA C C 245 180.640 180.640 179.381 1.259 18517 10800 1 9 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.040 0.620 18517 10801 1 9 . 1 1 177 177 ALA CB C 245 17.840 17.840 17.856 -0.016 18517 10802 1 9 . 1 1 177 177 ALA H H 245 10.240 10.240 8.518 1.722 18517 10803 1 9 . 1 1 178 178 LYS N N 246 119.810 119.810 118.725 1.085 18517 10804 1 9 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.013 -0.183 18517 10805 1 9 . 1 1 178 178 LYS C C 246 180.500 180.500 178.309 2.191 18517 10806 1 9 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.160 0.740 18517 10807 1 9 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.177 -0.857 18517 10808 1 9 . 1 1 178 178 LYS H H 246 8.470 8.470 7.651 0.819 18517 10809 1 9 . 1 1 179 179 TRP N N 247 121.170 121.170 121.466 -0.296 18517 10810 1 9 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.395 0.225 18517 10811 1 9 . 1 1 179 179 TRP C C 247 176.510 176.510 177.941 -1.431 18517 10812 1 9 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.893 -0.073 18517 10813 1 9 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.741 -0.171 18517 10814 1 9 . 1 1 179 179 TRP H H 247 8.330 8.330 8.387 -0.057 18517 10815 1 9 . 1 1 180 180 ALA N N 248 119.130 119.130 120.420 -1.290 18517 10816 1 9 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.863 0.677 18517 10817 1 9 . 1 1 180 180 ALA C C 248 182.110 182.110 179.901 2.209 18517 10818 1 9 . 1 1 180 180 ALA CA C 248 54.190 54.190 55.390 -1.200 18517 10819 1 9 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.131 0.579 18517 10820 1 9 . 1 1 180 180 ALA H H 248 7.990 7.990 8.358 -0.368 18517 10821 1 9 . 1 1 181 181 LYS N N 249 116.000 116.000 118.966 -2.966 18517 10822 1 9 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.077 -0.107 18517 10823 1 9 . 1 1 181 181 LYS C C 249 179.380 179.380 179.237 0.143 18517 10824 1 9 . 1 1 181 181 LYS CA C 249 58.710 58.710 58.836 -0.126 18517 10825 1 9 . 1 1 181 181 LYS CB C 249 32.510 32.510 31.988 0.522 18517 10826 1 9 . 1 1 181 181 LYS H H 249 6.900 6.900 7.970 -1.070 18517 10827 1 9 . 1 1 182 182 VAL N N 250 122.270 122.270 115.509 6.761 18517 10828 1 9 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.977 -0.637 18517 10829 1 9 . 1 1 182 182 VAL C C 250 178.160 178.160 178.152 0.008 18517 10830 1 9 . 1 1 182 182 VAL CA C 250 66.760 66.760 65.832 0.928 18517 10831 1 9 . 1 1 182 182 VAL CB C 250 30.840 30.840 30.612 0.228 18517 10832 1 9 . 1 1 182 182 VAL H H 250 7.050 7.050 8.109 -1.059 18517 10833 1 9 . 1 1 183 183 GLU N N 251 120.520 120.520 121.051 -0.531 18517 10834 1 9 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.988 -0.808 18517 10835 1 9 . 1 1 183 183 GLU C C 251 179.480 179.480 178.875 0.605 18517 10836 1 9 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.189 1.501 18517 10837 1 9 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.711 -0.641 18517 10838 1 9 . 1 1 183 183 GLU H H 251 8.020 8.020 8.653 -0.633 18517 10839 1 9 . 1 1 184 184 GLY N N 252 102.930 102.930 107.394 -4.464 18517 10840 1 9 . 1 1 184 184 GLY C C 252 176.920 176.920 176.527 0.393 18517 10841 1 9 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.207 0.203 18517 10842 1 9 . 1 1 184 184 GLY H H 252 7.830 7.830 8.162 -0.332 18517 10843 1 9 . 1 1 185 185 MET N N 253 123.200 123.200 121.884 1.316 18517 10844 1 9 . 1 1 185 185 MET HA H 253 4.250 4.250 4.022 0.228 18517 10845 1 9 . 1 1 185 185 MET C C 253 179.370 179.370 178.385 0.985 18517 10846 1 9 . 1 1 185 185 MET CA C 253 59.300 59.300 59.362 -0.062 18517 10847 1 9 . 1 1 185 185 MET CB C 253 33.930 33.930 32.580 1.350 18517 10848 1 9 . 1 1 185 185 MET H H 253 7.890 7.890 7.853 0.037 18517 10849 1 9 . 1 1 186 186 ILE N N 254 120.150 120.150 119.766 0.384 18517 10850 1 9 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.562 -0.002 18517 10851 1 9 . 1 1 186 186 ILE C C 254 177.250 177.250 178.078 -0.828 18517 10852 1 9 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.703 0.817 18517 10853 1 9 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.669 0.622 18517 10854 1 9 . 1 1 186 186 ILE H H 254 8.260 8.260 8.629 -0.369 18517 10855 1 9 . 1 1 187 187 HIS N N 255 119.810 119.810 118.929 0.881 18517 10856 1 9 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.240 -0.240 18517 10857 1 9 . 1 1 187 187 HIS C C 255 176.460 176.460 177.538 -1.078 18517 10858 1 9 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.895 0.435 18517 10859 1 9 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.747 1.883 18517 10860 1 9 . 1 1 187 187 HIS H H 255 8.900 8.900 8.873 0.027 18517 10861 1 9 . 1 1 188 188 GLY N N 256 103.160 103.160 106.805 -3.645 18517 10862 1 9 . 1 1 188 188 GLY C C 256 176.320 176.320 176.202 0.118 18517 10863 1 9 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.750 0.140 18517 10864 1 9 . 1 1 188 188 GLY H H 256 8.030 8.030 8.198 -0.168 18517 10865 1 9 . 1 1 189 189 LYS N N 257 119.510 119.510 121.438 -1.928 18517 10866 1 9 . 1 1 189 189 LYS HA H 257 4.000 4.000 3.938 0.062 18517 10867 1 9 . 1 1 189 189 LYS C C 257 178.660 178.660 178.300 0.360 18517 10868 1 9 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.084 -0.594 18517 10869 1 9 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.642 -0.092 18517 10870 1 9 . 1 1 189 189 LYS H H 257 7.120 7.120 7.784 -0.664 18517 10871 1 9 . 1 1 190 190 LEU N N 258 120.570 120.570 119.486 1.084 18517 10872 1 9 . 1 1 190 190 LEU HA H 258 3.930 3.930 3.872 0.058 18517 10873 1 9 . 1 1 190 190 LEU C C 258 177.230 177.230 177.751 -0.521 18517 10874 1 9 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.597 -0.077 18517 10875 1 9 . 1 1 190 190 LEU CB C 258 42.970 42.970 42.044 0.926 18517 10876 1 9 . 1 1 190 190 LEU H H 258 8.060 8.060 8.217 -0.157 18517 10877 1 9 . 1 1 191 191 GLU N N 259 114.590 114.590 114.551 0.039 18517 10878 1 9 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.218 0.062 18517 10879 1 9 . 1 1 191 191 GLU C C 259 176.230 176.230 176.922 -0.692 18517 10880 1 9 . 1 1 191 191 GLU CA C 259 55.340 55.340 57.049 -1.709 18517 10881 1 9 . 1 1 191 191 GLU CB C 259 29.330 29.330 30.179 -0.849 18517 10882 1 9 . 1 1 191 191 GLU H H 259 7.330 7.330 7.821 -0.491 18517 10883 1 9 . 1 1 192 192 SER N N 260 115.240 115.240 114.605 0.635 18517 10884 1 9 . 1 1 192 192 SER HA H 260 4.490 4.490 4.661 -0.171 18517 10885 1 9 . 1 1 192 192 SER C C 260 173.770 173.770 173.299 0.471 18517 10886 1 9 . 1 1 192 192 SER CA C 260 58.350 58.350 58.115 0.235 18517 10887 1 9 . 1 1 192 192 SER CB C 260 65.090 65.090 64.219 0.871 18517 10888 1 9 . 1 1 192 192 SER H H 260 7.130 7.130 7.591 -0.461 18517 10889 1 9 . 1 1 193 193 SER C C 261 174.600 174.600 174.067 0.533 18517 10890 1 9 . 1 1 193 193 SER CA C 261 59.980 59.980 58.132 1.848 18517 10891 1 9 . 1 1 193 193 SER CB C 261 63.750 63.750 63.895 -0.145 18517 10892 1 9 . 1 1 194 194 GLU N N 262 121.800 121.800 119.473 2.327 18517 10893 1 9 . 1 1 194 194 GLU HA H 262 4.470 4.470 3.980 0.490 18517 10894 1 9 . 1 1 194 194 GLU C C 262 174.650 174.650 174.996 -0.346 18517 10895 1 9 . 1 1 194 194 GLU CA C 262 55.620 55.620 57.190 -1.570 18517 10896 1 9 . 1 1 194 194 GLU CB C 262 30.210 30.210 28.267 1.943 18517 10897 1 9 . 1 1 194 194 GLU H H 262 7.840 7.840 8.353 -0.513 18517 10898 1 9 . 1 1 195 195 VAL N N 263 124.080 124.080 123.738 0.342 18517 10899 1 9 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.146 0.104 18517 10900 1 9 . 1 1 195 195 VAL C C 263 174.460 174.460 174.834 -0.374 18517 10901 1 9 . 1 1 195 195 VAL CA C 263 59.820 59.820 60.797 -0.977 18517 10902 1 9 . 1 1 195 195 VAL CB C 263 33.620 33.620 32.630 0.990 18517 10903 1 9 . 1 1 195 195 VAL H H 263 8.020 8.020 8.232 -0.212 18517 10904 1 9 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.559 -0.039 18517 10905 1 9 . 1 1 198 198 ASN C C 266 176.490 176.490 177.267 -0.777 18517 10906 1 9 . 1 1 198 198 ASN CA C 266 54.780 54.780 55.967 -1.187 18517 10907 1 9 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.592 0.468 18517 10908 1 9 . 1 1 199 199 LEU N N 267 120.680 120.680 121.139 -0.459 18517 10909 1 9 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.932 0.078 18517 10910 1 9 . 1 1 199 199 LEU C C 267 178.050 178.050 178.356 -0.306 18517 10911 1 9 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.081 0.749 18517 10912 1 9 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.661 0.679 18517 10913 1 9 . 1 1 199 199 LEU H H 267 7.660 7.660 7.987 -0.327 18517 10914 1 9 . 1 1 200 200 LYS N N 268 116.740 116.740 118.847 -2.107 18517 10915 1 9 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.948 -0.218 18517 10916 1 9 . 1 1 200 200 LYS C C 268 178.520 178.520 178.527 -0.007 18517 10917 1 9 . 1 1 200 200 LYS CA C 268 61.800 61.800 59.757 2.043 18517 10918 1 9 . 1 1 200 200 LYS CB C 268 32.110 32.110 32.168 -0.058 18517 10919 1 9 . 1 1 200 200 LYS H H 268 8.280 8.280 8.185 0.095 18517 10920 1 9 . 1 1 201 201 ALA N N 269 121.270 121.270 121.948 -0.678 18517 10921 1 9 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.147 0.093 18517 10922 1 9 . 1 1 201 201 ALA C C 269 180.890 180.890 180.055 0.835 18517 10923 1 9 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.070 0.110 18517 10924 1 9 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.278 0.192 18517 10925 1 9 . 1 1 201 201 ALA H H 269 7.710 7.710 8.277 -0.567 18517 10926 1 9 . 1 1 202 202 LEU N N 270 119.980 119.980 119.412 0.568 18517 10927 1 9 . 1 1 202 202 LEU HA H 270 4.090 4.090 4.051 0.039 18517 10928 1 9 . 1 1 202 202 LEU C C 270 179.330 179.330 179.626 -0.296 18517 10929 1 9 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.893 0.177 18517 10930 1 9 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.731 0.689 18517 10931 1 9 . 1 1 202 202 LEU H H 270 7.750 7.750 8.479 -0.729 18517 10932 1 9 . 1 1 203 203 VAL N N 271 118.450 118.450 119.513 -1.063 18517 10933 1 9 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.788 0.042 18517 10934 1 9 . 1 1 203 203 VAL C C 271 177.110 177.110 177.847 -0.737 18517 10935 1 9 . 1 1 203 203 VAL CA C 271 67.710 67.710 66.976 0.734 18517 10936 1 9 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.446 0.264 18517 10937 1 9 . 1 1 203 203 VAL H H 271 8.560 8.560 8.135 0.425 18517 10938 1 9 . 1 1 204 204 ALA N N 272 122.560 122.560 122.168 0.392 18517 10939 1 9 . 1 1 204 204 ALA HA H 272 3.880 3.880 3.934 -0.054 18517 10940 1 9 . 1 1 204 204 ALA C C 272 178.700 178.700 179.366 -0.666 18517 10941 1 9 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.597 0.533 18517 10942 1 9 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.030 0.360 18517 10943 1 9 . 1 1 204 204 ALA H H 272 8.120 8.120 8.429 -0.309 18517 10944 1 9 . 1 1 205 205 GLU N N 273 117.290 117.290 118.816 -1.526 18517 10945 1 9 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.097 -0.107 18517 10946 1 9 . 1 1 205 205 GLU C C 273 178.630 178.630 179.204 -0.574 18517 10947 1 9 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.125 1.015 18517 10948 1 9 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.610 0.360 18517 10949 1 9 . 1 1 205 205 GLU H H 273 7.670 7.670 8.081 -0.411 18517 10950 1 9 . 1 1 206 206 LEU N N 274 120.450 120.450 121.775 -1.325 18517 10951 1 9 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.053 -0.053 18517 10952 1 9 . 1 1 206 206 LEU C C 274 178.400 178.400 178.720 -0.320 18517 10953 1 9 . 1 1 206 206 LEU CA C 274 58.910 58.910 57.727 1.183 18517 10954 1 9 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.434 2.096 18517 10955 1 9 . 1 1 206 206 LEU H H 274 8.420 8.420 8.179 0.241 18517 10956 1 9 . 1 1 207 207 ILE N N 275 117.580 117.580 121.062 -3.482 18517 10957 1 9 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.586 -0.056 18517 10958 1 9 . 1 1 207 207 ILE C C 275 178.850 178.850 178.165 0.685 18517 10959 1 9 . 1 1 207 207 ILE CA C 275 66.080 66.080 66.111 -0.031 18517 10960 1 9 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.734 1.036 18517 10961 1 9 . 1 1 207 207 ILE H H 275 8.700 8.700 8.663 0.037 18517 10962 1 9 . 1 1 208 208 GLU N N 276 119.100 119.100 118.729 0.371 18517 10963 1 9 . 1 1 208 208 GLU HA H 276 4.000 4.000 4.080 -0.080 18517 10964 1 9 . 1 1 208 208 GLU C C 276 178.540 178.540 179.525 -0.985 18517 10965 1 9 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.139 1.311 18517 10966 1 9 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.225 1.295 18517 10967 1 9 . 1 1 208 208 GLU H H 276 7.950 7.950 8.257 -0.307 18517 10968 1 9 . 1 1 209 209 LEU N N 277 120.590 120.590 121.737 -1.147 18517 10969 1 9 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.088 0.132 18517 10970 1 9 . 1 1 209 209 LEU C C 277 179.520 179.520 178.355 1.165 18517 10971 1 9 . 1 1 209 209 LEU CA C 277 58.350 58.350 57.862 0.487 18517 10972 1 9 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.446 1.844 18517 10973 1 9 . 1 1 209 209 LEU H H 277 8.550 8.550 8.339 0.211 18517 10974 1 9 . 1 1 210 210 ARG N N 278 116.470 116.470 119.478 -3.008 18517 10975 1 9 . 1 1 210 210 ARG HA H 278 3.740 3.740 4.018 -0.278 18517 10976 1 9 . 1 1 210 210 ARG C C 278 179.190 179.190 178.723 0.467 18517 10977 1 9 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.792 1.888 18517 10978 1 9 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.348 1.052 18517 10979 1 9 . 1 1 210 210 ARG H H 278 8.590 8.590 8.556 0.034 18517 10980 1 9 . 1 1 211 211 ALA N N 279 120.470 120.470 122.001 -1.531 18517 10981 1 9 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.133 -0.223 18517 10982 1 9 . 1 1 211 211 ALA C C 279 181.350 181.350 180.154 1.196 18517 10983 1 9 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.242 0.458 18517 10984 1 9 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.180 -0.899 18517 10985 1 9 . 1 1 211 211 ALA H H 279 8.050 8.050 8.284 -0.234 18517 10986 1 9 . 1 1 212 212 GLN N N 280 120.070 120.070 117.717 2.353 18517 10987 1 9 . 1 1 212 212 GLN HA H 280 4.020 4.020 4.080 -0.060 18517 10988 1 9 . 1 1 212 212 GLN C C 280 179.490 179.490 178.641 0.849 18517 10989 1 9 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.239 1.061 18517 10990 1 9 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.339 0.841 18517 10991 1 9 . 1 1 212 212 GLN H H 280 8.300 8.300 8.393 -0.093 18517 10992 1 9 . 1 1 213 213 MET N N 281 119.810 119.810 121.218 -1.408 18517 10993 1 9 . 1 1 213 213 MET HA H 281 3.730 3.730 4.149 -0.419 18517 10994 1 9 . 1 1 213 213 MET C C 281 177.490 177.490 178.239 -0.749 18517 10995 1 9 . 1 1 213 213 MET CA C 281 60.690 60.690 58.326 2.364 18517 10996 1 9 . 1 1 213 213 MET CB C 281 33.930 33.930 32.279 1.651 18517 10997 1 9 . 1 1 213 213 MET H H 281 8.420 8.420 8.501 -0.081 18517 10998 1 9 . 1 1 214 214 MET N N 282 114.000 114.000 118.516 -4.516 18517 10999 1 9 . 1 1 214 214 MET HA H 282 3.880 3.880 4.141 -0.261 18517 11000 1 9 . 1 1 214 214 MET C C 282 177.650 177.650 178.039 -0.389 18517 11001 1 9 . 1 1 214 214 MET CA C 282 58.670 58.670 57.789 0.881 18517 11002 1 9 . 1 1 214 214 MET CB C 282 33.300 33.300 31.928 1.372 18517 11003 1 9 . 1 1 214 214 MET H H 282 7.890 7.890 8.203 -0.313 18517 11004 1 9 . 1 1 215 215 ALA N N 283 119.970 119.970 123.068 -3.098 18517 11005 1 9 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.098 0.042 18517 11006 1 9 . 1 1 215 215 ALA C C 283 180.580 180.580 179.457 1.123 18517 11007 1 9 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.106 -0.996 18517 11008 1 9 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.216 -0.536 18517 11009 1 9 . 1 1 215 215 ALA H H 283 7.580 7.580 8.202 -0.622 18517 11010 1 9 . 1 1 216 216 LEU N N 284 120.920 120.920 118.154 2.766 18517 11011 1 9 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.089 -0.129 18517 11012 1 9 . 1 1 216 216 LEU C C 284 177.910 177.910 179.383 -1.473 18517 11013 1 9 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.148 0.772 18517 11014 1 9 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.063 0.437 18517 11015 1 9 . 1 1 216 216 LEU H H 284 7.460 7.460 8.048 -0.588 18517 11016 1 9 . 1 1 217 217 LEU N N 285 116.470 116.470 120.368 -3.898 18517 11017 1 9 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.593 0.087 18517 11018 1 9 . 1 1 217 217 LEU C C 285 178.310 178.310 176.760 1.550 18517 11019 1 9 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.194 0.246 18517 11020 1 9 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.911 1.139 18517 11021 1 9 . 1 1 217 217 LEU H H 285 6.980 6.980 8.088 -1.108 18517 11022 1 9 . 1 1 218 218 TYR N N 286 111.080 111.080 113.486 -2.406 18517 11023 1 9 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.531 0.369 18517 11024 1 9 . 1 1 218 218 TYR C C 286 176.090 176.090 175.990 0.100 18517 11025 1 9 . 1 1 218 218 TYR CA C 286 56.050 56.050 57.224 -1.174 18517 11026 1 9 . 1 1 218 218 TYR CB C 286 40.910 40.910 37.823 3.087 18517 11027 1 9 . 1 1 218 218 TYR H H 286 7.660 7.660 7.850 -0.190 18517 11028 1 9 . 1 1 219 219 GLY N N 287 108.260 108.260 109.372 -1.112 18517 11029 1 9 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.829 0.491 18517 11030 1 9 . 1 1 219 219 GLY H H 287 7.750 7.750 7.648 0.102 18517 11031 1 9 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.842 -0.352 18517 11032 1 9 . 1 1 221 221 ILE CA C 289 63.580 63.580 61.703 1.877 18517 11033 1 9 . 1 1 221 221 ILE CB C 289 38.280 38.280 37.623 0.657 18517 11034 1 9 . 1 1 222 222 GLY CA C 290 45.740 45.740 44.874 0.866 18517 11035 1 10 . 1 1 2 2 LYS N N 70 126.600 126.600 124.769 1.831 18517 11036 1 10 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.903 -0.543 18517 11037 1 10 . 1 1 2 2 LYS C C 70 176.000 176.000 174.670 1.330 18517 11038 1 10 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.292 1.158 18517 11039 1 10 . 1 1 2 2 LYS CB C 70 33.850 33.850 34.731 -0.881 18517 11040 1 10 . 1 1 2 2 LYS H H 70 8.530 8.530 8.254 0.276 18517 11041 1 10 . 1 1 3 3 THR N N 71 111.030 111.030 115.348 -4.318 18517 11042 1 10 . 1 1 3 3 THR HA H 71 4.400 4.400 4.424 -0.024 18517 11043 1 10 . 1 1 3 3 THR C C 71 175.650 175.650 174.619 1.031 18517 11044 1 10 . 1 1 3 3 THR CA C 71 60.610 60.610 60.838 -0.228 18517 11045 1 10 . 1 1 3 3 THR CB C 71 71.520 71.520 69.736 1.784 18517 11046 1 10 . 1 1 3 3 THR H H 71 7.390 7.390 8.209 -0.819 18517 11047 1 10 . 1 1 4 4 LEU N N 72 121.560 121.560 121.894 -0.334 18517 11048 1 10 . 1 1 4 4 LEU C C 72 177.870 177.870 178.398 -0.528 18517 11049 1 10 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.948 -0.468 18517 11050 1 10 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.774 0.406 18517 11051 1 10 . 1 1 4 4 LEU H H 72 8.980 8.980 8.530 0.450 18517 11052 1 10 . 1 1 5 5 ASP N N 73 115.530 115.530 117.504 -1.974 18517 11053 1 10 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.384 -0.054 18517 11054 1 10 . 1 1 5 5 ASP C C 73 179.290 179.290 178.517 0.773 18517 11055 1 10 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.101 0.739 18517 11056 1 10 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.571 0.260 18517 11057 1 10 . 1 1 5 5 ASP H H 73 8.270 8.270 8.613 -0.343 18517 11058 1 10 . 1 1 6 6 VAL N N 74 122.330 122.330 119.117 3.213 18517 11059 1 10 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.655 0.085 18517 11060 1 10 . 1 1 6 6 VAL C C 74 178.970 178.970 177.773 1.197 18517 11061 1 10 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.823 0.537 18517 11062 1 10 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.882 0.068 18517 11063 1 10 . 1 1 6 6 VAL H H 74 7.400 7.400 7.343 0.057 18517 11064 1 10 . 1 1 7 7 LEU N N 75 121.360 121.360 120.494 0.866 18517 11065 1 10 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.895 0.135 18517 11066 1 10 . 1 1 7 7 LEU C C 75 179.240 179.240 178.958 0.282 18517 11067 1 10 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.536 -0.306 18517 11068 1 10 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.146 1.744 18517 11069 1 10 . 1 1 7 7 LEU H H 75 8.300 8.300 8.431 -0.131 18517 11070 1 10 . 1 1 8 8 ARG N N 76 117.230 117.230 118.123 -0.893 18517 11071 1 10 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.069 -0.149 18517 11072 1 10 . 1 1 8 8 ARG C C 76 178.290 178.290 179.145 -0.855 18517 11073 1 10 . 1 1 8 8 ARG CA C 76 60.770 60.770 58.496 2.274 18517 11074 1 10 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.148 1.062 18517 11075 1 10 . 1 1 8 8 ARG H H 76 8.520 8.520 8.851 -0.331 18517 11076 1 10 . 1 1 9 9 GLY N N 77 104.570 104.570 107.493 -2.923 18517 11077 1 10 . 1 1 9 9 GLY C C 77 176.180 176.180 176.574 -0.394 18517 11078 1 10 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.827 0.343 18517 11079 1 10 . 1 1 9 9 GLY H H 77 7.620 7.620 8.368 -0.748 18517 11080 1 10 . 1 1 10 10 GLU N N 78 120.270 120.270 122.927 -2.657 18517 11081 1 10 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.226 0.044 18517 11082 1 10 . 1 1 10 10 GLU C C 78 179.030 179.030 179.212 -0.182 18517 11083 1 10 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.004 -0.134 18517 11084 1 10 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.473 1.927 18517 11085 1 10 . 1 1 10 10 GLU H H 78 8.100 8.100 8.209 -0.109 18517 11086 1 10 . 1 1 11 11 LEU N N 79 116.000 116.000 119.036 -3.036 18517 11087 1 10 . 1 1 11 11 LEU HA H 79 4.510 4.510 4.179 0.331 18517 11088 1 10 . 1 1 11 11 LEU C C 79 179.630 179.630 178.875 0.755 18517 11089 1 10 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.417 -1.728 18517 11090 1 10 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.074 3.726 18517 11091 1 10 . 1 1 11 11 LEU H H 79 8.230 8.230 8.649 -0.419 18517 11092 1 10 . 1 1 12 12 ARG N N 80 120.020 120.020 120.343 -0.323 18517 11093 1 10 . 1 1 12 12 ARG HA H 80 3.750 3.750 4.082 -0.332 18517 11094 1 10 . 1 1 12 12 ARG C C 80 178.490 178.490 178.519 -0.029 18517 11095 1 10 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.102 2.898 18517 11096 1 10 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.651 1.589 18517 11097 1 10 . 1 1 12 12 ARG H H 80 8.210 8.210 8.489 -0.279 18517 11098 1 10 . 1 1 13 13 GLY N N 81 108.090 108.090 107.973 0.117 18517 11099 1 10 . 1 1 13 13 GLY C C 81 173.540 173.540 176.695 -3.155 18517 11100 1 10 . 1 1 13 13 GLY CA C 81 48.000 48.000 47.162 0.838 18517 11101 1 10 . 1 1 13 13 GLY H H 81 8.890 8.890 8.420 0.470 18517 11102 1 10 . 1 1 14 14 GLN C C 82 179.540 179.540 179.116 0.424 18517 11103 1 10 . 1 1 14 14 GLN CA C 82 58.710 58.710 59.025 -0.315 18517 11104 1 10 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.331 0.770 18517 11105 1 10 . 1 1 15 15 ARG N N 83 118.220 118.220 117.940 0.280 18517 11106 1 10 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.109 -0.159 18517 11107 1 10 . 1 1 15 15 ARG C C 83 177.710 177.710 178.934 -1.224 18517 11108 1 10 . 1 1 15 15 ARG CA C 83 59.900 59.900 58.307 1.593 18517 11109 1 10 . 1 1 15 15 ARG CB C 83 29.650 29.650 29.706 -0.056 18517 11110 1 10 . 1 1 15 15 ARG H H 83 7.320 7.320 8.348 -1.028 18517 11111 1 10 . 1 1 16 16 GLU N N 84 118.810 118.810 120.611 -1.801 18517 11112 1 10 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.231 -0.381 18517 11113 1 10 . 1 1 16 16 GLU C C 84 178.750 178.750 178.881 -0.131 18517 11114 1 10 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.263 1.747 18517 11115 1 10 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.732 -0.322 18517 11116 1 10 . 1 1 16 16 GLU H H 84 8.450 8.450 8.434 0.016 18517 11117 1 10 . 1 1 17 17 ALA N N 85 122.790 122.790 123.206 -0.416 18517 11118 1 10 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.136 0.054 18517 11119 1 10 . 1 1 17 17 ALA C C 85 180.360 180.360 179.518 0.842 18517 11120 1 10 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.135 0.325 18517 11121 1 10 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.301 -0.221 18517 11122 1 10 . 1 1 17 17 ALA H H 85 8.420 8.420 8.405 0.015 18517 11123 1 10 . 1 1 18 18 PHE N N 86 119.400 119.400 120.234 -0.834 18517 11124 1 10 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.225 0.065 18517 11125 1 10 . 1 1 18 18 PHE C C 86 177.560 177.560 177.708 -0.148 18517 11126 1 10 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.708 -0.068 18517 11127 1 10 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.156 0.484 18517 11128 1 10 . 1 1 18 18 PHE H H 86 7.490 7.490 8.318 -0.828 18517 11129 1 10 . 1 1 19 19 LEU N N 87 117.470 117.470 119.594 -2.124 18517 11130 1 10 . 1 1 19 19 LEU HA H 87 4.070 4.070 4.055 0.015 18517 11131 1 10 . 1 1 19 19 LEU C C 87 178.880 178.880 178.604 0.276 18517 11132 1 10 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.389 -0.429 18517 11133 1 10 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.646 0.454 18517 11134 1 10 . 1 1 19 19 LEU H H 87 8.010 8.010 8.371 -0.361 18517 11135 1 10 . 1 1 20 20 SER N N 88 113.770 113.770 115.076 -1.306 18517 11136 1 10 . 1 1 20 20 SER HA H 88 4.070 4.070 4.144 -0.074 18517 11137 1 10 . 1 1 20 20 SER C C 88 175.680 175.680 177.025 -1.345 18517 11138 1 10 . 1 1 20 20 SER CA C 88 63.070 63.070 62.573 0.497 18517 11139 1 10 . 1 1 20 20 SER H H 88 8.100 8.100 8.384 -0.284 18517 11140 1 10 . 1 1 21 21 GLU N N 89 120.570 120.570 121.893 -1.323 18517 11141 1 10 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.028 -0.058 18517 11142 1 10 . 1 1 21 21 GLU C C 89 178.940 178.940 178.908 0.032 18517 11143 1 10 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.273 -0.013 18517 11144 1 10 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.439 -0.109 18517 11145 1 10 . 1 1 21 21 GLU H H 89 7.400 7.400 7.922 -0.522 18517 11146 1 10 . 1 1 22 22 ILE N N 90 119.350 119.350 119.392 -0.042 18517 11147 1 10 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.973 -0.283 18517 11148 1 10 . 1 1 22 22 ILE C C 90 177.230 177.230 178.364 -1.134 18517 11149 1 10 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.760 0.710 18517 11150 1 10 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.700 -0.310 18517 11151 1 10 . 1 1 22 22 ILE H H 90 7.250 7.250 8.004 -0.754 18517 11152 1 10 . 1 1 23 23 ILE N N 91 116.350 116.350 119.557 -3.207 18517 11153 1 10 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.878 -0.478 18517 11154 1 10 . 1 1 23 23 ILE C C 91 176.690 176.690 177.380 -0.690 18517 11155 1 10 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.297 2.433 18517 11156 1 10 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.566 0.205 18517 11157 1 10 . 1 1 23 23 ILE H H 91 7.860 7.860 8.149 -0.289 18517 11158 1 10 . 1 1 24 24 LYS N N 92 116.000 116.000 117.615 -1.615 18517 11159 1 10 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.169 -0.029 18517 11160 1 10 . 1 1 24 24 LYS C C 92 176.270 176.270 177.103 -0.833 18517 11161 1 10 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.866 -0.386 18517 11162 1 10 . 1 1 24 24 LYS CB C 92 33.300 33.300 33.225 0.075 18517 11163 1 10 . 1 1 24 24 LYS H H 92 7.170 7.170 7.933 -0.763 18517 11164 1 10 . 1 1 25 25 SER N N 93 114.650 114.650 115.299 -0.649 18517 11165 1 10 . 1 1 25 25 SER HA H 93 4.550 4.550 4.471 0.079 18517 11166 1 10 . 1 1 25 25 SER C C 93 173.370 173.370 173.265 0.105 18517 11167 1 10 . 1 1 25 25 SER CA C 93 57.240 57.240 59.249 -2.009 18517 11168 1 10 . 1 1 25 25 SER CB C 93 65.650 65.650 64.476 1.174 18517 11169 1 10 . 1 1 25 25 SER H H 93 7.730 7.730 7.719 0.011 18517 11170 1 10 . 1 1 26 26 ASP N N 94 121.230 121.230 121.620 -0.390 18517 11171 1 10 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.819 0.111 18517 11172 1 10 . 1 1 26 26 ASP C C 94 176.560 176.560 175.996 0.564 18517 11173 1 10 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.652 0.858 18517 11174 1 10 . 1 1 26 26 ASP CB C 94 42.650 42.650 42.160 0.490 18517 11175 1 10 . 1 1 26 26 ASP H H 94 8.280 8.280 8.407 -0.127 18517 11176 1 10 . 1 1 27 27 GLY N N 95 109.310 109.310 108.728 0.582 18517 11177 1 10 . 1 1 27 27 GLY C C 95 171.080 171.080 171.641 -0.561 18517 11178 1 10 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.250 -0.480 18517 11179 1 10 . 1 1 27 27 GLY H H 95 8.160 8.160 7.738 0.422 18517 11180 1 10 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.559 0.581 18517 11181 1 10 . 1 1 29 29 PHE C C 97 175.230 175.230 174.999 0.231 18517 11182 1 10 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.369 0.121 18517 11183 1 10 . 1 1 29 29 PHE CB C 97 41.620 41.620 41.752 -0.132 18517 11184 1 10 . 1 1 30 30 THR N N 98 112.600 112.600 112.716 -0.116 18517 11185 1 10 . 1 1 30 30 THR HA H 98 4.570 4.570 4.123 0.447 18517 11186 1 10 . 1 1 30 30 THR C C 98 176.690 176.690 174.197 2.493 18517 11187 1 10 . 1 1 30 30 THR CA C 98 60.290 60.290 59.675 0.615 18517 11188 1 10 . 1 1 30 30 THR CB C 98 71.600 71.600 71.215 0.385 18517 11189 1 10 . 1 1 30 30 THR H H 98 8.990 8.990 8.040 0.950 18517 11190 1 10 . 1 1 31 31 ILE N N 99 119.240 119.240 121.583 -2.343 18517 11191 1 10 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.793 0.027 18517 11192 1 10 . 1 1 31 31 ILE C C 99 176.090 176.090 176.707 -0.617 18517 11193 1 10 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.191 -3.051 18517 11194 1 10 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.897 -0.947 18517 11195 1 10 . 1 1 31 31 ILE H H 99 9.230 9.230 8.167 1.063 18517 11196 1 10 . 1 1 32 32 LEU N N 100 119.660 119.660 119.857 -0.197 18517 11197 1 10 . 1 1 32 32 LEU HA H 100 4.030 4.030 4.039 -0.009 18517 11198 1 10 . 1 1 32 32 LEU C C 100 181.050 181.050 178.529 2.521 18517 11199 1 10 . 1 1 32 32 LEU CA C 100 57.560 57.560 58.513 -0.953 18517 11200 1 10 . 1 1 32 32 LEU CB C 100 40.120 40.120 40.867 -0.747 18517 11201 1 10 . 1 1 32 32 LEU H H 100 7.310 7.310 8.216 -0.906 18517 11202 1 10 . 1 1 33 33 GLN N N 101 121.450 121.450 118.981 2.469 18517 11203 1 10 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.257 -0.007 18517 11204 1 10 . 1 1 33 33 GLN CA C 101 59.700 59.700 58.600 1.100 18517 11205 1 10 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.217 3.573 18517 11206 1 10 . 1 1 33 33 GLN H H 101 7.790 7.790 7.635 0.155 18517 11207 1 10 . 1 1 34 34 LEU C C 102 178.590 178.590 179.060 -0.470 18517 11208 1 10 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.106 0.524 18517 11209 1 10 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.665 -0.355 18517 11210 1 10 . 1 1 35 35 VAL N N 103 118.520 118.520 117.881 0.639 18517 11211 1 10 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.671 -0.252 18517 11212 1 10 . 1 1 35 35 VAL C C 103 177.930 177.930 178.276 -0.346 18517 11213 1 10 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.201 -0.161 18517 11214 1 10 . 1 1 35 35 VAL CB C 103 31.630 31.630 31.247 0.383 18517 11215 1 10 . 1 1 35 35 VAL H H 103 8.670 8.670 8.722 -0.052 18517 11216 1 10 . 1 1 36 36 GLY N N 104 109.430 109.430 108.579 0.851 18517 11217 1 10 . 1 1 36 36 GLY C C 104 174.600 174.600 175.781 -1.181 18517 11218 1 10 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.141 0.899 18517 11219 1 10 . 1 1 36 36 GLY H H 104 7.880 7.880 8.261 -0.381 18517 11220 1 10 . 1 1 37 37 TYR N N 105 122.270 122.270 123.835 -1.565 18517 11221 1 10 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.348 -0.468 18517 11222 1 10 . 1 1 37 37 TYR C C 105 176.310 176.310 177.281 -0.971 18517 11223 1 10 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.876 3.224 18517 11224 1 10 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.827 -0.457 18517 11225 1 10 . 1 1 37 37 TYR H H 105 8.170 8.170 8.531 -0.361 18517 11226 1 10 . 1 1 38 38 LEU N N 106 120.100 120.100 120.965 -0.865 18517 11227 1 10 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.888 -0.148 18517 11228 1 10 . 1 1 38 38 LEU C C 106 178.280 178.280 178.678 -0.398 18517 11229 1 10 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.027 0.603 18517 11230 1 10 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.738 0.992 18517 11231 1 10 . 1 1 38 38 LEU H H 106 7.610 7.610 8.354 -0.744 18517 11232 1 10 . 1 1 39 39 ARG N N 107 116.670 116.670 117.661 -0.991 18517 11233 1 10 . 1 1 39 39 ARG HA H 107 3.680 3.680 3.949 -0.269 18517 11234 1 10 . 1 1 39 39 ARG C C 107 179.480 179.480 178.768 0.712 18517 11235 1 10 . 1 1 39 39 ARG CA C 107 59.580 59.580 57.908 1.672 18517 11236 1 10 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.314 1.926 18517 11237 1 10 . 1 1 39 39 ARG H H 107 8.240 8.240 7.846 0.394 18517 11238 1 10 . 1 1 40 40 VAL N N 108 121.970 121.970 120.659 1.311 18517 11239 1 10 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.622 -0.222 18517 11240 1 10 . 1 1 40 40 VAL C C 108 178.440 178.440 177.488 0.952 18517 11241 1 10 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.073 1.877 18517 11242 1 10 . 1 1 40 40 VAL CB C 108 30.440 30.440 30.918 -0.478 18517 11243 1 10 . 1 1 40 40 VAL H H 108 8.200 8.200 7.904 0.296 18517 11244 1 10 . 1 1 41 41 VAL N N 109 108.940 108.940 116.073 -7.133 18517 11245 1 10 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.531 0.709 18517 11246 1 10 . 1 1 41 41 VAL C C 109 175.070 175.070 177.422 -2.352 18517 11247 1 10 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.563 -2.973 18517 11248 1 10 . 1 1 41 41 VAL CB C 109 29.650 29.650 29.936 -0.286 18517 11249 1 10 . 1 1 41 41 VAL H H 109 7.760 7.760 7.899 -0.139 18517 11250 1 10 . 1 1 42 42 ASP N N 110 124.670 124.670 121.263 3.407 18517 11251 1 10 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.232 0.388 18517 11252 1 10 . 1 1 42 42 ASP C C 110 177.310 177.310 178.177 -0.867 18517 11253 1 10 . 1 1 42 42 ASP CA C 110 59.980 59.980 58.069 1.911 18517 11254 1 10 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.945 4.005 18517 11255 1 10 . 1 1 42 42 ASP H H 110 7.360 7.360 8.329 -0.969 18517 11256 1 10 . 1 1 43 43 THR N N 111 102.340 102.340 114.790 -12.450 18517 11257 1 10 . 1 1 43 43 THR HA H 111 5.100 5.100 4.089 1.011 18517 11258 1 10 . 1 1 43 43 THR C C 111 174.940 174.940 176.184 -1.244 18517 11259 1 10 . 1 1 43 43 THR CA C 111 60.650 60.650 65.627 -4.978 18517 11260 1 10 . 1 1 43 43 THR CB C 111 69.610 69.610 68.767 0.843 18517 11261 1 10 . 1 1 43 43 THR H H 111 6.380 6.380 7.645 -1.265 18517 11262 1 10 . 1 1 44 44 ASP N N 112 119.750 119.750 123.447 -3.697 18517 11263 1 10 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.312 -0.452 18517 11264 1 10 . 1 1 44 44 ASP C C 112 178.850 178.850 178.207 0.643 18517 11265 1 10 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.463 0.767 18517 11266 1 10 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.789 -1.389 18517 11267 1 10 . 1 1 44 44 ASP H H 112 9.050 9.050 8.115 0.935 18517 11268 1 10 . 1 1 45 45 LEU N N 113 123.910 123.910 120.839 3.071 18517 11269 1 10 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.851 -0.041 18517 11270 1 10 . 1 1 45 45 LEU C C 113 182.040 182.040 178.765 3.275 18517 11271 1 10 . 1 1 45 45 LEU CA C 113 57.320 57.320 58.000 -0.680 18517 11272 1 10 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.813 -1.063 18517 11273 1 10 . 1 1 45 45 LEU H H 113 9.710 9.710 7.670 2.040 18517 11274 1 10 . 1 1 46 46 LEU N N 114 117.640 117.640 117.901 -0.261 18517 11275 1 10 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.042 0.068 18517 11276 1 10 . 1 1 46 46 LEU C C 114 179.540 179.540 178.769 0.771 18517 11277 1 10 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.575 -0.014 18517 11278 1 10 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.855 -0.385 18517 11279 1 10 . 1 1 46 46 LEU H H 114 8.270 8.270 7.520 0.750 18517 11280 1 10 . 1 1 47 47 LEU N N 115 116.520 116.520 115.031 1.489 18517 11281 1 10 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.464 -0.324 18517 11282 1 10 . 1 1 47 47 LEU C C 115 173.850 173.850 176.352 -2.502 18517 11283 1 10 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.347 1.073 18517 11284 1 10 . 1 1 47 47 LEU CB C 115 44.720 44.720 42.122 2.598 18517 11285 1 10 . 1 1 47 47 LEU H H 115 8.160 8.160 8.205 -0.045 18517 11286 1 10 . 1 1 48 48 LYS N N 116 114.710 114.710 117.444 -2.734 18517 11287 1 10 . 1 1 48 48 LYS HA H 116 3.810 3.810 4.098 -0.288 18517 11288 1 10 . 1 1 48 48 LYS C C 116 176.510 176.510 176.020 0.490 18517 11289 1 10 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.927 0.273 18517 11290 1 10 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.383 -0.363 18517 11291 1 10 . 1 1 48 48 LYS H H 116 7.580 7.580 7.826 -0.246 18517 11292 1 10 . 1 1 49 49 VAL N N 117 119.050 119.050 117.805 1.245 18517 11293 1 10 . 1 1 49 49 VAL HA H 117 3.610 3.610 3.973 -0.363 18517 11294 1 10 . 1 1 49 49 VAL C C 117 175.860 175.860 176.129 -0.269 18517 11295 1 10 . 1 1 49 49 VAL CA C 117 63.510 63.510 61.854 1.656 18517 11296 1 10 . 1 1 49 49 VAL CB C 117 32.350 32.350 33.140 -0.790 18517 11297 1 10 . 1 1 49 49 VAL H H 117 7.980 7.980 7.708 0.272 18517 11298 1 10 . 1 1 50 50 ASP N N 118 126.900 126.900 122.965 3.935 18517 11299 1 10 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.477 -0.227 18517 11300 1 10 . 1 1 50 50 ASP C C 118 177.700 177.700 176.482 1.218 18517 11301 1 10 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.786 0.264 18517 11302 1 10 . 1 1 50 50 ASP CB C 118 42.580 42.580 40.138 2.442 18517 11303 1 10 . 1 1 50 50 ASP H H 118 8.930 8.930 8.787 0.143 18517 11304 1 10 . 1 1 51 51 SER N N 119 124.790 124.790 119.738 5.052 18517 11305 1 10 . 1 1 51 51 SER HA H 119 4.070 4.070 4.570 -0.500 18517 11306 1 10 . 1 1 51 51 SER C C 119 177.220 177.220 175.988 1.232 18517 11307 1 10 . 1 1 51 51 SER CA C 119 61.640 61.640 61.261 0.379 18517 11308 1 10 . 1 1 51 51 SER CB C 119 63.510 63.510 63.363 0.147 18517 11309 1 10 . 1 1 51 51 SER H H 119 8.560 8.560 8.527 0.033 18517 11310 1 10 . 1 1 52 52 THR N N 120 119.880 119.880 116.500 3.380 18517 11311 1 10 . 1 1 52 52 THR HA H 120 4.190 4.190 4.139 0.051 18517 11312 1 10 . 1 1 52 52 THR C C 120 177.120 177.120 176.396 0.724 18517 11313 1 10 . 1 1 52 52 THR CA C 120 66.280 66.280 65.573 0.707 18517 11314 1 10 . 1 1 52 52 THR CB C 120 68.420 68.420 68.439 -0.019 18517 11315 1 10 . 1 1 52 52 THR H H 120 8.310 8.310 8.279 0.031 18517 11316 1 10 . 1 1 53 53 LYS N N 121 122.270 122.270 123.144 -0.874 18517 11317 1 10 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.225 -0.105 18517 11318 1 10 . 1 1 53 53 LYS C C 121 178.970 178.970 178.251 0.719 18517 11319 1 10 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.302 0.278 18517 11320 1 10 . 1 1 53 53 LYS CB C 121 34.250 34.250 32.203 2.047 18517 11321 1 10 . 1 1 53 53 LYS H H 121 7.700 7.700 7.709 -0.009 18517 11322 1 10 . 1 1 54 54 VAL N N 122 120.070 120.070 120.322 -0.252 18517 11323 1 10 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.868 -0.438 18517 11324 1 10 . 1 1 54 54 VAL C C 122 179.860 179.860 177.583 2.277 18517 11325 1 10 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.585 2.995 18517 11326 1 10 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.799 1.021 18517 11327 1 10 . 1 1 54 54 VAL H H 122 7.890 7.890 8.254 -0.364 18517 11328 1 10 . 1 1 55 55 ASP N N 123 122.270 122.270 120.560 1.710 18517 11329 1 10 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.373 0.097 18517 11330 1 10 . 1 1 55 55 ASP C C 123 178.630 178.630 178.299 0.331 18517 11331 1 10 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.812 -0.012 18517 11332 1 10 . 1 1 55 55 ASP CB C 123 42.020 42.020 41.014 1.006 18517 11333 1 10 . 1 1 55 55 ASP H H 123 8.270 8.270 8.126 0.144 18517 11334 1 10 . 1 1 56 56 GLU N N 124 119.600 119.600 119.496 0.104 18517 11335 1 10 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.048 -0.078 18517 11336 1 10 . 1 1 56 56 GLU C C 124 179.920 179.920 179.054 0.866 18517 11337 1 10 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.106 0.954 18517 11338 1 10 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.434 0.535 18517 11339 1 10 . 1 1 56 56 GLU H H 124 8.610 8.610 8.285 0.325 18517 11340 1 10 . 1 1 57 57 ALA N N 125 120.070 120.070 121.243 -1.173 18517 11341 1 10 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.168 -0.338 18517 11342 1 10 . 1 1 57 57 ALA C C 125 178.760 178.760 179.552 -0.792 18517 11343 1 10 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.829 0.551 18517 11344 1 10 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.454 1.686 18517 11345 1 10 . 1 1 57 57 ALA H H 125 8.420 8.420 8.727 -0.307 18517 11346 1 10 . 1 1 58 58 GLY N N 126 106.740 106.740 106.034 0.706 18517 11347 1 10 . 1 1 58 58 GLY C C 126 175.740 175.740 175.881 -0.141 18517 11348 1 10 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.774 0.516 18517 11349 1 10 . 1 1 58 58 GLY H H 126 8.200 8.200 8.427 -0.227 18517 11350 1 10 . 1 1 59 59 LYS N N 127 120.920 120.920 121.902 -0.982 18517 11351 1 10 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.199 -0.269 18517 11352 1 10 . 1 1 59 59 LYS C C 127 180.320 180.320 178.721 1.599 18517 11353 1 10 . 1 1 59 59 LYS CA C 127 60.210 60.210 58.892 1.318 18517 11354 1 10 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.441 0.539 18517 11355 1 10 . 1 1 59 59 LYS H H 127 8.000 8.000 7.919 0.081 18517 11356 1 10 . 1 1 60 60 LYS N N 128 118.400 118.400 120.252 -1.852 18517 11357 1 10 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.143 0.027 18517 11358 1 10 . 1 1 60 60 LYS C C 128 180.030 180.030 178.858 1.172 18517 11359 1 10 . 1 1 60 60 LYS CA C 128 58.750 58.750 58.811 -0.061 18517 11360 1 10 . 1 1 60 60 LYS CB C 128 32.270 32.270 31.967 0.303 18517 11361 1 10 . 1 1 60 60 LYS H H 128 7.170 7.170 7.900 -0.730 18517 11362 1 10 . 1 1 61 61 VAL N N 129 121.050 121.050 120.361 0.689 18517 11363 1 10 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.325 -0.045 18517 11364 1 10 . 1 1 61 61 VAL C C 129 177.120 177.120 177.634 -0.514 18517 11365 1 10 . 1 1 61 61 VAL CA C 129 67.350 67.350 66.644 0.706 18517 11366 1 10 . 1 1 61 61 VAL CB C 129 31.630 31.630 30.727 0.903 18517 11367 1 10 . 1 1 61 61 VAL H H 129 7.980 7.980 8.046 -0.066 18517 11368 1 10 . 1 1 62 62 LYS N N 130 120.040 120.040 119.895 0.145 18517 11369 1 10 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.871 -0.171 18517 11370 1 10 . 1 1 62 62 LYS C C 130 178.550 178.550 178.963 -0.413 18517 11371 1 10 . 1 1 62 62 LYS CA C 130 60.330 60.330 60.135 0.195 18517 11372 1 10 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.303 1.467 18517 11373 1 10 . 1 1 62 62 LYS H H 130 8.910 8.910 8.533 0.377 18517 11374 1 10 . 1 1 63 63 ALA N N 131 119.570 119.570 122.101 -2.531 18517 11375 1 10 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.069 0.151 18517 11376 1 10 . 1 1 63 63 ALA C C 131 180.520 180.520 179.396 1.124 18517 11377 1 10 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.072 0.148 18517 11378 1 10 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.156 0.314 18517 11379 1 10 . 1 1 63 63 ALA H H 131 7.920 7.920 8.236 -0.316 18517 11380 1 10 . 1 1 64 64 TYR N N 132 120.510 120.510 120.257 0.253 18517 11381 1 10 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.157 0.303 18517 11382 1 10 . 1 1 64 64 TYR C C 132 176.510 176.510 177.761 -1.251 18517 11383 1 10 . 1 1 64 64 TYR CA C 132 61.640 61.640 62.054 -0.414 18517 11384 1 10 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.794 -0.104 18517 11385 1 10 . 1 1 64 64 TYR H H 132 7.930 7.930 8.039 -0.109 18517 11386 1 10 . 1 1 65 65 LEU N N 133 117.290 117.290 118.650 -1.360 18517 11387 1 10 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.876 -0.036 18517 11388 1 10 . 1 1 65 65 LEU C C 133 178.610 178.610 179.519 -0.909 18517 11389 1 10 . 1 1 65 65 LEU CA C 133 57.720 57.720 57.765 -0.045 18517 11390 1 10 . 1 1 65 65 LEU CB C 133 40.430 40.430 40.575 -0.145 18517 11391 1 10 . 1 1 65 65 LEU H H 133 8.240 8.240 8.527 -0.287 18517 11392 1 10 . 1 1 66 66 GLU N N 134 119.140 119.140 119.829 -0.689 18517 11393 1 10 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.100 -0.240 18517 11394 1 10 . 1 1 66 66 GLU C C 134 180.200 180.200 178.917 1.283 18517 11395 1 10 . 1 1 66 66 GLU CA C 134 59.940 59.940 59.210 0.730 18517 11396 1 10 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.453 0.357 18517 11397 1 10 . 1 1 66 66 GLU H H 134 8.370 8.370 8.667 -0.297 18517 11398 1 10 . 1 1 67 67 LYS N N 135 121.390 121.390 120.282 1.108 18517 11399 1 10 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.065 -0.065 18517 11400 1 10 . 1 1 67 67 LYS C C 135 179.080 179.080 178.673 0.407 18517 11401 1 10 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.420 1.200 18517 11402 1 10 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.176 0.094 18517 11403 1 10 . 1 1 67 67 LYS H H 135 7.820 7.820 7.786 0.034 18517 11404 1 10 . 1 1 68 68 ILE N N 136 110.310 110.310 112.299 -1.989 18517 11405 1 10 . 1 1 68 68 ILE HA H 136 4.300 4.300 3.996 0.304 18517 11406 1 10 . 1 1 68 68 ILE C C 136 175.520 175.520 176.618 -1.098 18517 11407 1 10 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.839 0.591 18517 11408 1 10 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.361 -0.381 18517 11409 1 10 . 1 1 68 68 ILE H H 136 7.380 7.380 7.555 -0.175 18517 11410 1 10 . 1 1 69 69 GLY N N 137 106.680 106.680 107.921 -1.241 18517 11411 1 10 . 1 1 69 69 GLY C C 137 174.160 174.160 173.848 0.312 18517 11412 1 10 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.450 1.020 18517 11413 1 10 . 1 1 69 69 GLY H H 137 7.470 7.470 7.983 -0.513 18517 11414 1 10 . 1 1 70 70 ILE N N 138 124.310 124.310 122.283 2.027 18517 11415 1 10 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.436 -0.236 18517 11416 1 10 . 1 1 70 70 ILE C C 138 174.190 174.190 175.084 -0.894 18517 11417 1 10 . 1 1 70 70 ILE CA C 138 59.380 59.380 58.835 0.545 18517 11418 1 10 . 1 1 70 70 ILE CB C 138 37.340 37.340 38.161 -0.821 18517 11419 1 10 . 1 1 70 70 ILE H H 138 8.530 8.530 8.313 0.217 18517 11420 1 10 . 1 1 71 71 ARG N N 139 125.490 125.490 127.027 -1.537 18517 11421 1 10 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.616 0.004 18517 11422 1 10 . 1 1 71 71 ARG C C 139 175.750 175.750 175.091 0.659 18517 11423 1 10 . 1 1 71 71 ARG CA C 139 54.660 54.660 55.249 -0.590 18517 11424 1 10 . 1 1 71 71 ARG CB C 139 33.140 33.140 31.520 1.621 18517 11425 1 10 . 1 1 71 71 ARG H H 139 8.240 8.240 8.556 -0.316 18517 11426 1 10 . 1 1 72 72 GLY N N 140 104.750 104.750 108.330 -3.580 18517 11427 1 10 . 1 1 72 72 GLY C C 140 172.920 172.920 173.434 -0.514 18517 11428 1 10 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.516 0.914 18517 11429 1 10 . 1 1 72 72 GLY H H 140 7.900 7.900 8.209 -0.309 18517 11430 1 10 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.644 -0.134 18517 11431 1 10 . 1 1 73 73 ASP C C 141 175.060 175.060 176.648 -1.588 18517 11432 1 10 . 1 1 73 73 ASP CA C 141 56.170 56.170 55.399 0.771 18517 11433 1 10 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.529 -0.699 18517 11434 1 10 . 1 1 74 74 SER N N 142 110.240 110.240 116.017 -5.777 18517 11435 1 10 . 1 1 74 74 SER HA H 142 4.740 4.740 4.707 0.033 18517 11436 1 10 . 1 1 74 74 SER C C 142 175.110 175.110 175.563 -0.453 18517 11437 1 10 . 1 1 74 74 SER CA C 142 55.700 55.700 56.847 -1.147 18517 11438 1 10 . 1 1 74 74 SER CB C 142 67.390 67.390 66.054 1.336 18517 11439 1 10 . 1 1 74 74 SER H H 142 7.560 7.560 7.953 -0.393 18517 11440 1 10 . 1 1 75 75 VAL N N 143 122.950 122.950 122.084 0.866 18517 11441 1 10 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.812 -0.082 18517 11442 1 10 . 1 1 75 75 VAL C C 143 176.230 176.230 176.922 -0.692 18517 11443 1 10 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.516 1.124 18517 11444 1 10 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.584 -0.344 18517 11445 1 10 . 1 1 75 75 VAL H H 143 9.470 9.470 8.737 0.733 18517 11446 1 10 . 1 1 76 76 GLU N N 144 121.390 121.390 121.140 0.250 18517 11447 1 10 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.106 -0.466 18517 11448 1 10 . 1 1 76 76 GLU C C 144 176.880 176.880 177.984 -1.104 18517 11449 1 10 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.008 4.302 18517 11450 1 10 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.136 -0.066 18517 11451 1 10 . 1 1 76 76 GLU H H 144 9.640 9.640 8.469 1.171 18517 11452 1 10 . 1 1 77 77 ALA N N 145 118.770 118.770 122.419 -3.649 18517 11453 1 10 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.229 0.031 18517 11454 1 10 . 1 1 77 77 ALA C C 145 180.350 180.350 179.604 0.746 18517 11455 1 10 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.409 0.371 18517 11456 1 10 . 1 1 77 77 ALA CB C 145 19.190 19.190 17.988 1.202 18517 11457 1 10 . 1 1 77 77 ALA H H 145 7.860 7.860 8.153 -0.293 18517 11458 1 10 . 1 1 78 78 ALA N N 146 120.920 120.920 122.402 -1.482 18517 11459 1 10 . 1 1 78 78 ALA HA H 146 4.140 4.140 3.972 0.168 18517 11460 1 10 . 1 1 78 78 ALA C C 146 179.150 179.150 179.478 -0.328 18517 11461 1 10 . 1 1 78 78 ALA CA C 146 55.260 55.260 55.123 0.137 18517 11462 1 10 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.479 0.311 18517 11463 1 10 . 1 1 78 78 ALA H H 146 8.110 8.110 8.295 -0.185 18517 11464 1 10 . 1 1 79 79 LEU N N 147 118.810 118.810 118.648 0.162 18517 11465 1 10 . 1 1 79 79 LEU HA H 147 3.880 3.880 3.871 0.009 18517 11466 1 10 . 1 1 79 79 LEU C C 147 179.080 179.080 178.781 0.299 18517 11467 1 10 . 1 1 79 79 LEU CA C 147 58.390 58.390 58.030 0.360 18517 11468 1 10 . 1 1 79 79 LEU CB C 147 42.260 42.260 41.354 0.906 18517 11469 1 10 . 1 1 79 79 LEU H H 147 8.360 8.360 8.267 0.093 18517 11470 1 10 . 1 1 80 80 ASP N N 148 121.620 121.620 119.435 2.185 18517 11471 1 10 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.232 0.288 18517 11472 1 10 . 1 1 80 80 ASP C C 148 178.800 178.800 178.309 0.491 18517 11473 1 10 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.067 0.323 18517 11474 1 10 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.810 -0.060 18517 11475 1 10 . 1 1 80 80 ASP H H 148 8.770 8.770 8.438 0.332 18517 11476 1 10 . 1 1 81 81 ASN N N 149 118.630 118.630 117.879 0.751 18517 11477 1 10 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.463 0.107 18517 11478 1 10 . 1 1 81 81 ASN C C 149 177.970 177.970 177.852 0.118 18517 11479 1 10 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.731 -0.721 18517 11480 1 10 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.865 -0.255 18517 11481 1 10 . 1 1 81 81 ASN H H 149 7.960 7.960 8.009 -0.049 18517 11482 1 10 . 1 1 82 82 LEU N N 150 120.030 120.030 120.714 -0.684 18517 11483 1 10 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.887 0.173 18517 11484 1 10 . 1 1 82 82 LEU C C 150 177.790 177.790 179.063 -1.273 18517 11485 1 10 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.185 0.685 18517 11486 1 10 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.884 -0.024 18517 11487 1 10 . 1 1 82 82 LEU H H 150 8.230 8.230 8.282 -0.052 18517 11488 1 10 . 1 1 83 83 MET N N 151 115.820 115.820 117.198 -1.378 18517 11489 1 10 . 1 1 83 83 MET HA H 151 4.390 4.390 3.935 0.455 18517 11490 1 10 . 1 1 83 83 MET C C 151 179.760 179.760 178.415 1.345 18517 11491 1 10 . 1 1 83 83 MET CA C 151 57.400 57.400 58.950 -1.550 18517 11492 1 10 . 1 1 83 83 MET CB C 151 31.080 31.080 32.384 -1.304 18517 11493 1 10 . 1 1 83 83 MET H H 151 8.800 8.800 8.503 0.297 18517 11494 1 10 . 1 1 84 84 ILE N N 152 120.330 120.330 121.728 -1.398 18517 11495 1 10 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.788 0.052 18517 11496 1 10 . 1 1 84 84 ILE C C 152 178.660 178.660 178.095 0.565 18517 11497 1 10 . 1 1 84 84 ILE CA C 152 65.800 65.800 65.573 0.227 18517 11498 1 10 . 1 1 84 84 ILE CB C 152 38.450 38.450 37.569 0.881 18517 11499 1 10 . 1 1 84 84 ILE H H 152 8.540 8.540 8.516 0.024 18517 11500 1 10 . 1 1 85 85 LYS N N 153 118.930 118.930 119.676 -0.746 18517 11501 1 10 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.173 0.027 18517 11502 1 10 . 1 1 85 85 LYS C C 153 179.650 179.650 179.389 0.261 18517 11503 1 10 . 1 1 85 85 LYS CA C 153 59.980 59.980 59.035 0.945 18517 11504 1 10 . 1 1 85 85 LYS CB C 153 33.540 33.540 31.979 1.561 18517 11505 1 10 . 1 1 85 85 LYS H H 153 7.510 7.510 7.930 -0.420 18517 11506 1 10 . 1 1 86 86 VAL N N 154 119.810 119.810 120.421 -0.611 18517 11507 1 10 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.605 0.025 18517 11508 1 10 . 1 1 86 86 VAL C C 154 178.350 178.350 178.212 0.138 18517 11509 1 10 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.823 0.407 18517 11510 1 10 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.351 1.389 18517 11511 1 10 . 1 1 86 86 VAL H H 154 8.740 8.740 8.017 0.723 18517 11512 1 10 . 1 1 87 87 TYR N N 155 118.370 118.370 118.337 0.033 18517 11513 1 10 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.223 0.047 18517 11514 1 10 . 1 1 87 87 TYR C C 155 178.580 178.580 178.571 0.009 18517 11515 1 10 . 1 1 87 87 TYR CA C 155 62.910 62.910 60.307 2.603 18517 11516 1 10 . 1 1 87 87 TYR CB C 155 37.980 37.980 36.959 1.021 18517 11517 1 10 . 1 1 87 87 TYR H H 155 8.520 8.520 8.203 0.317 18517 11518 1 10 . 1 1 88 88 GLU N N 156 119.900 119.900 119.945 -0.045 18517 11519 1 10 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.062 0.118 18517 11520 1 10 . 1 1 88 88 GLU C C 156 179.270 179.270 178.856 0.414 18517 11521 1 10 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.379 0.001 18517 11522 1 10 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.432 0.778 18517 11523 1 10 . 1 1 88 88 GLU H H 156 8.250 8.250 8.705 -0.455 18517 11524 1 10 . 1 1 89 89 ILE N N 157 119.510 119.510 119.466 0.044 18517 11525 1 10 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.935 0.145 18517 11526 1 10 . 1 1 89 89 ILE C C 157 177.890 177.890 178.456 -0.566 18517 11527 1 10 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.374 -0.064 18517 11528 1 10 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.198 1.012 18517 11529 1 10 . 1 1 89 89 ILE H H 157 7.630 7.630 7.822 -0.192 18517 11530 1 10 . 1 1 90 90 THR N N 158 114.240 114.240 115.894 -1.654 18517 11531 1 10 . 1 1 90 90 THR HA H 158 4.130 4.130 4.144 -0.014 18517 11532 1 10 . 1 1 90 90 THR C C 158 175.530 175.530 176.005 -0.475 18517 11533 1 10 . 1 1 90 90 THR CA C 158 64.460 64.460 66.176 -1.716 18517 11534 1 10 . 1 1 90 90 THR CB C 158 69.610 69.610 69.057 0.553 18517 11535 1 10 . 1 1 90 90 THR H H 158 7.770 7.770 8.135 -0.365 18517 11536 1 10 . 1 1 91 91 LYS N N 159 120.280 120.280 119.228 1.052 18517 11537 1 10 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.388 -0.078 18517 11538 1 10 . 1 1 91 91 LYS C C 159 177.420 177.420 177.354 0.066 18517 11539 1 10 . 1 1 91 91 LYS CA C 159 57.400 57.400 56.754 0.646 18517 11540 1 10 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.771 -0.551 18517 11541 1 10 . 1 1 91 91 LYS H H 159 7.890 7.890 8.146 -0.256 18517 11542 1 10 . 1 1 92 92 GLY N N 160 107.910 107.910 109.948 -2.038 18517 11543 1 10 . 1 1 92 92 GLY C C 160 174.430 174.430 173.316 1.114 18517 11544 1 10 . 1 1 92 92 GLY CA C 160 45.980 45.980 44.385 1.595 18517 11545 1 10 . 1 1 92 92 GLY H H 160 7.930 7.930 7.995 -0.065 18517 11546 1 10 . 1 1 93 93 THR N N 161 113.570 113.570 114.610 -1.040 18517 11547 1 10 . 1 1 93 93 THR HA H 161 4.390 4.390 3.988 0.402 18517 11548 1 10 . 1 1 93 93 THR C C 161 174.790 174.790 174.172 0.618 18517 11549 1 10 . 1 1 93 93 THR CA C 161 61.960 61.960 62.910 -0.950 18517 11550 1 10 . 1 1 93 93 THR CB C 161 70.010 70.010 69.407 0.603 18517 11551 1 10 . 1 1 93 93 THR H H 161 7.970 7.970 8.206 -0.236 18517 11552 1 10 . 1 1 94 94 VAL N N 162 121.980 121.980 122.981 -1.001 18517 11553 1 10 . 1 1 94 94 VAL HA H 162 4.120 4.120 3.975 0.145 18517 11554 1 10 . 1 1 94 94 VAL C C 162 176.300 176.300 175.629 0.671 18517 11555 1 10 . 1 1 94 94 VAL CA C 162 62.830 62.830 63.086 -0.256 18517 11556 1 10 . 1 1 94 94 VAL CB C 162 33.060 33.060 32.564 0.496 18517 11557 1 10 . 1 1 94 94 VAL H H 162 8.130 8.130 8.504 -0.374 18517 11558 1 10 . 1 1 95 95 GLU N N 163 124.140 124.140 127.445 -3.305 18517 11559 1 10 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.590 -0.280 18517 11560 1 10 . 1 1 95 95 GLU C C 163 176.870 176.870 174.781 2.089 18517 11561 1 10 . 1 1 95 95 GLU CA C 163 57.080 57.080 55.048 2.032 18517 11562 1 10 . 1 1 95 95 GLU CB C 163 30.440 30.440 33.249 -2.809 18517 11563 1 10 . 1 1 95 95 GLU H H 163 8.490 8.490 9.592 -1.102 18517 11564 1 10 . 1 1 96 96 SER N N 164 116.800 116.800 113.955 2.845 18517 11565 1 10 . 1 1 96 96 SER HA H 164 4.430 4.430 4.218 0.212 18517 11566 1 10 . 1 1 96 96 SER C C 164 174.940 174.940 173.537 1.403 18517 11567 1 10 . 1 1 96 96 SER CA C 164 59.070 59.070 59.210 -0.140 18517 11568 1 10 . 1 1 96 96 SER CB C 164 64.220 64.220 62.759 1.461 18517 11569 1 10 . 1 1 96 96 SER H H 164 8.300 8.300 8.577 -0.277 18517 11570 1 10 . 1 1 97 97 SER C C 165 174.660 174.660 172.820 1.840 18517 11571 1 10 . 1 1 97 97 SER CA C 165 58.870 58.870 59.104 -0.234 18517 11572 1 10 . 1 1 97 97 SER CB C 165 64.060 64.060 64.762 -0.702 18517 11573 1 10 . 1 1 98 98 ALA N N 166 125.490 125.490 123.496 1.994 18517 11574 1 10 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.790 -0.440 18517 11575 1 10 . 1 1 98 98 ALA C C 166 177.780 177.780 177.181 0.599 18517 11576 1 10 . 1 1 98 98 ALA CA C 166 53.000 53.000 52.059 0.941 18517 11577 1 10 . 1 1 98 98 ALA CB C 166 19.340 19.340 20.145 -0.805 18517 11578 1 10 . 1 1 98 98 ALA H H 166 8.180 8.180 8.497 -0.317 18517 11579 1 10 . 1 1 99 99 GLN N N 167 118.690 118.690 121.113 -2.423 18517 11580 1 10 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.248 0.092 18517 11581 1 10 . 1 1 99 99 GLN C C 167 176.680 176.680 177.117 -0.437 18517 11582 1 10 . 1 1 99 99 GLN CA C 167 56.250 56.250 56.646 -0.396 18517 11583 1 10 . 1 1 99 99 GLN CB C 167 29.650 29.650 29.699 -0.049 18517 11584 1 10 . 1 1 99 99 GLN H H 167 8.170 8.170 9.066 -0.896 18517 11585 1 10 . 1 1 100 100 GLY N N 168 109.670 109.670 108.283 1.387 18517 11586 1 10 . 1 1 100 100 GLY C C 168 174.460 174.460 173.530 0.930 18517 11587 1 10 . 1 1 100 100 GLY CA C 168 45.670 45.670 44.152 1.518 18517 11588 1 10 . 1 1 100 100 GLY H H 168 8.250 8.250 7.636 0.614 18517 11589 1 10 . 1 1 101 101 THR N N 169 112.660 112.660 116.553 -3.893 18517 11590 1 10 . 1 1 101 101 THR HA H 169 4.360 4.360 4.279 0.081 18517 11591 1 10 . 1 1 101 101 THR C C 169 174.720 174.720 174.901 -0.181 18517 11592 1 10 . 1 1 101 101 THR CA C 169 62.080 62.080 61.739 0.341 18517 11593 1 10 . 1 1 101 101 THR CB C 169 69.930 69.930 69.446 0.484 18517 11594 1 10 . 1 1 101 101 THR H H 169 8.070 8.070 8.213 -0.143 18517 11595 1 10 . 1 1 102 102 ASP N N 170 123.090 123.090 123.239 -0.149 18517 11596 1 10 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.635 0.065 18517 11597 1 10 . 1 1 102 102 ASP C C 170 176.130 176.130 174.872 1.258 18517 11598 1 10 . 1 1 102 102 ASP CA C 170 54.780 54.780 54.026 0.754 18517 11599 1 10 . 1 1 102 102 ASP CB C 170 42.260 42.260 41.745 0.515 18517 11600 1 10 . 1 1 102 102 ASP H H 170 8.170 8.170 8.425 -0.255 18517 11601 1 10 . 1 1 103 103 SER N N 171 117.110 117.110 114.602 2.508 18517 11602 1 10 . 1 1 103 103 SER HA H 171 4.430 4.430 4.511 -0.081 18517 11603 1 10 . 1 1 103 103 SER C C 171 174.770 174.770 174.744 0.026 18517 11604 1 10 . 1 1 103 103 SER CA C 171 57.960 57.960 57.103 0.856 18517 11605 1 10 . 1 1 103 103 SER CB C 171 64.940 64.940 64.861 0.079 18517 11606 1 10 . 1 1 103 103 SER H H 171 8.450 8.450 7.955 0.495 18517 11607 1 10 . 1 1 104 104 GLU N N 172 122.970 122.970 121.520 1.450 18517 11608 1 10 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.988 0.042 18517 11609 1 10 . 1 1 104 104 GLU C C 172 178.860 178.860 177.725 1.135 18517 11610 1 10 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.178 -0.478 18517 11611 1 10 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.819 -0.169 18517 11612 1 10 . 1 1 104 104 GLU H H 172 8.830 8.830 8.964 -0.134 18517 11613 1 10 . 1 1 105 105 GLU N N 173 119.750 119.750 117.763 1.987 18517 11614 1 10 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.098 -0.118 18517 11615 1 10 . 1 1 105 105 GLU C C 173 178.920 178.920 178.377 0.543 18517 11616 1 10 . 1 1 105 105 GLU CA C 173 60.060 60.060 58.456 1.604 18517 11617 1 10 . 1 1 105 105 GLU CB C 173 29.730 29.730 28.218 1.512 18517 11618 1 10 . 1 1 105 105 GLU H H 173 8.580 8.580 8.477 0.103 18517 11619 1 10 . 1 1 106 106 LEU N N 174 121.860 121.860 122.200 -0.340 18517 11620 1 10 . 1 1 106 106 LEU HA H 174 4.180 4.180 3.996 0.184 18517 11621 1 10 . 1 1 106 106 LEU C C 174 178.210 178.210 178.393 -0.183 18517 11622 1 10 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.837 0.043 18517 11623 1 10 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.968 -0.818 18517 11624 1 10 . 1 1 106 106 LEU H H 174 7.920 7.920 7.558 0.362 18517 11625 1 10 . 1 1 107 107 LYS N N 175 118.740 118.740 119.011 -0.271 18517 11626 1 10 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.932 -0.152 18517 11627 1 10 . 1 1 107 107 LYS C C 175 178.700 178.700 179.160 -0.460 18517 11628 1 10 . 1 1 107 107 LYS CA C 175 61.170 61.170 60.262 0.908 18517 11629 1 10 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.382 0.048 18517 11630 1 10 . 1 1 107 107 LYS H H 175 8.340 8.340 8.186 0.154 18517 11631 1 10 . 1 1 108 108 THR N N 176 113.820 113.820 116.489 -2.669 18517 11632 1 10 . 1 1 108 108 THR HA H 176 3.840 3.840 4.002 -0.162 18517 11633 1 10 . 1 1 108 108 THR C C 176 176.620 176.620 176.371 0.249 18517 11634 1 10 . 1 1 108 108 THR CA C 176 66.910 66.910 66.921 -0.011 18517 11635 1 10 . 1 1 108 108 THR CB C 176 69.610 69.610 68.583 1.027 18517 11636 1 10 . 1 1 108 108 THR H H 176 7.950 7.950 8.392 -0.442 18517 11637 1 10 . 1 1 109 109 LEU N N 177 124.380 124.380 122.727 1.653 18517 11638 1 10 . 1 1 109 109 LEU HA H 177 3.830 3.830 3.992 -0.162 18517 11639 1 10 . 1 1 109 109 LEU C C 177 177.790 177.790 177.616 0.174 18517 11640 1 10 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.854 0.136 18517 11641 1 10 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.030 1.550 18517 11642 1 10 . 1 1 109 109 LEU H H 177 7.480 7.480 7.959 -0.479 18517 11643 1 10 . 1 1 110 110 LEU N N 178 117.230 117.230 118.322 -1.092 18517 11644 1 10 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.844 -0.004 18517 11645 1 10 . 1 1 110 110 LEU C C 178 179.540 179.540 179.553 -0.013 18517 11646 1 10 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.375 1.015 18517 11647 1 10 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.285 1.055 18517 11648 1 10 . 1 1 110 110 LEU H H 178 8.670 8.670 8.070 0.600 18517 11649 1 10 . 1 1 111 111 LEU N N 179 119.230 119.230 121.506 -2.276 18517 11650 1 10 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.074 0.006 18517 11651 1 10 . 1 1 111 111 LEU C C 179 179.310 179.310 178.694 0.616 18517 11652 1 10 . 1 1 111 111 LEU CA C 179 58.390 58.390 58.284 0.106 18517 11653 1 10 . 1 1 111 111 LEU CB C 179 42.020 42.020 41.130 0.890 18517 11654 1 10 . 1 1 111 111 LEU H H 179 7.940 7.940 8.394 -0.454 18517 11655 1 10 . 1 1 112 112 LYS N N 180 121.910 121.910 120.498 1.412 18517 11656 1 10 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.164 0.026 18517 11657 1 10 . 1 1 112 112 LYS C C 180 178.740 178.740 178.906 -0.166 18517 11658 1 10 . 1 1 112 112 LYS CA C 180 59.180 59.180 58.769 0.411 18517 11659 1 10 . 1 1 112 112 LYS CB C 180 31.870 31.870 31.896 -0.026 18517 11660 1 10 . 1 1 112 112 LYS H H 180 7.420 7.420 8.170 -0.750 18517 11661 1 10 . 1 1 113 113 PHE N N 181 118.220 118.220 118.335 -0.115 18517 11662 1 10 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.174 0.576 18517 11663 1 10 . 1 1 113 113 PHE C C 181 178.520 178.520 177.837 0.683 18517 11664 1 10 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.888 -3.808 18517 11665 1 10 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.125 -0.145 18517 11666 1 10 . 1 1 113 113 PHE H H 181 9.000 9.000 8.597 0.403 18517 11667 1 10 . 1 1 114 114 SER N N 182 113.300 113.300 115.083 -1.783 18517 11668 1 10 . 1 1 114 114 SER HA H 182 3.930 3.930 4.094 -0.164 18517 11669 1 10 . 1 1 114 114 SER C C 182 177.080 177.080 176.785 0.295 18517 11670 1 10 . 1 1 114 114 SER CA C 182 62.000 62.000 62.602 -0.602 18517 11671 1 10 . 1 1 114 114 SER CB C 182 63.510 63.510 63.158 0.352 18517 11672 1 10 . 1 1 114 114 SER H H 182 8.620 8.620 8.732 -0.112 18517 11673 1 10 . 1 1 115 115 GLU N N 183 121.540 121.540 120.977 0.563 18517 11674 1 10 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.012 0.058 18517 11675 1 10 . 1 1 115 115 GLU C C 183 179.860 179.860 178.792 1.068 18517 11676 1 10 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.402 0.378 18517 11677 1 10 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.619 0.271 18517 11678 1 10 . 1 1 115 115 GLU H H 183 8.250 8.250 8.054 0.196 18517 11679 1 10 . 1 1 116 116 ASP N N 184 121.740 121.740 121.260 0.480 18517 11680 1 10 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.382 0.128 18517 11681 1 10 . 1 1 116 116 ASP C C 184 179.570 179.570 178.505 1.065 18517 11682 1 10 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.763 -0.203 18517 11683 1 10 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.914 0.076 18517 11684 1 10 . 1 1 116 116 ASP H H 184 8.840 8.840 8.495 0.345 18517 11685 1 10 . 1 1 117 117 LEU N N 185 121.420 121.420 120.467 0.953 18517 11686 1 10 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.083 0.047 18517 11687 1 10 . 1 1 117 117 LEU C C 185 178.840 178.840 178.654 0.186 18517 11688 1 10 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.240 -0.011 18517 11689 1 10 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.685 0.965 18517 11690 1 10 . 1 1 117 117 LEU H H 185 8.350 8.350 8.350 0.000 18517 11691 1 10 . 1 1 118 118 LYS N N 186 119.640 119.640 118.374 1.266 18517 11692 1 10 . 1 1 118 118 LYS HA H 186 4.120 4.120 4.003 0.117 18517 11693 1 10 . 1 1 118 118 LYS C C 186 178.820 178.820 179.361 -0.541 18517 11694 1 10 . 1 1 118 118 LYS CA C 186 59.740 59.740 58.924 0.816 18517 11695 1 10 . 1 1 118 118 LYS CB C 186 32.510 32.510 31.777 0.733 18517 11696 1 10 . 1 1 118 118 LYS H H 186 8.220 8.220 8.231 -0.011 18517 11697 1 10 . 1 1 119 119 ALA N N 187 120.160 120.160 122.472 -2.312 18517 11698 1 10 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.074 0.086 18517 11699 1 10 . 1 1 119 119 ALA C C 187 180.450 180.450 179.425 1.025 18517 11700 1 10 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.289 -0.150 18517 11701 1 10 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.303 0.167 18517 11702 1 10 . 1 1 119 119 ALA H H 187 8.010 8.010 8.692 -0.682 18517 11703 1 10 . 1 1 120 120 GLU N N 188 117.930 117.930 118.210 -0.280 18517 11704 1 10 . 1 1 120 120 GLU HA H 188 4.180 4.180 3.884 0.296 18517 11705 1 10 . 1 1 120 120 GLU C C 188 178.780 178.780 178.976 -0.196 18517 11706 1 10 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.367 -0.537 18517 11707 1 10 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.373 0.597 18517 11708 1 10 . 1 1 120 120 GLU H H 188 7.640 7.640 8.071 -0.431 18517 11709 1 10 . 1 1 121 121 GLN N N 189 117.230 117.230 120.204 -2.974 18517 11710 1 10 . 1 1 121 121 GLN HA H 189 4.230 4.230 3.483 0.747 18517 11711 1 10 . 1 1 121 121 GLN C C 189 179.190 179.190 177.755 1.435 18517 11712 1 10 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.900 0.840 18517 11713 1 10 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.488 1.162 18517 11714 1 10 . 1 1 121 121 GLN H H 189 8.280 8.280 8.215 0.065 18517 11715 1 10 . 1 1 122 122 GLU N N 190 118.340 118.340 119.578 -1.238 18517 11716 1 10 . 1 1 122 122 GLU HA H 190 4.120 4.120 4.023 0.097 18517 11717 1 10 . 1 1 122 122 GLU C C 190 178.210 178.210 179.323 -1.113 18517 11718 1 10 . 1 1 122 122 GLU CA C 190 58.750 58.750 59.103 -0.353 18517 11719 1 10 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.178 0.792 18517 11720 1 10 . 1 1 122 122 GLU H H 190 8.250 8.250 8.119 0.131 18517 11721 1 10 . 1 1 123 123 LEU N N 191 118.930 118.930 120.547 -1.617 18517 11722 1 10 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.914 0.176 18517 11723 1 10 . 1 1 123 123 LEU C C 191 178.500 178.500 179.464 -0.964 18517 11724 1 10 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.045 -1.045 18517 11725 1 10 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.763 0.737 18517 11726 1 10 . 1 1 123 123 LEU H H 191 7.530 7.530 8.114 -0.584 18517 11727 1 10 . 1 1 124 124 HIS N N 192 115.650 115.650 117.345 -1.695 18517 11728 1 10 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.320 0.400 18517 11729 1 10 . 1 1 124 124 HIS C C 192 176.090 176.090 177.390 -1.300 18517 11730 1 10 . 1 1 124 124 HIS CA C 192 56.690 56.690 57.938 -1.248 18517 11731 1 10 . 1 1 124 124 HIS CB C 192 30.760 30.760 30.064 0.696 18517 11732 1 10 . 1 1 124 124 HIS H H 192 7.450 7.450 8.156 -0.706 18517 11733 1 10 . 1 1 125 125 SER N N 193 115.480 115.480 115.548 -0.068 18517 11734 1 10 . 1 1 125 125 SER HA H 193 4.310 4.310 4.045 0.265 18517 11735 1 10 . 1 1 125 125 SER CA C 193 60.180 60.180 62.040 -1.860 18517 11736 1 10 . 1 1 125 125 SER CB C 193 64.060 64.060 62.718 1.342 18517 11737 1 10 . 1 1 125 125 SER H H 193 8.020 8.020 8.343 -0.323 18517 11738 1 10 . 1 1 126 126 GLU C C 194 177.410 177.410 179.184 -1.774 18517 11739 1 10 . 1 1 126 126 GLU CA C 194 57.840 57.840 59.151 -1.311 18517 11740 1 10 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.179 0.711 18517 11741 1 10 . 1 1 127 127 ALA N N 195 122.910 122.910 121.822 1.088 18517 11742 1 10 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.110 0.080 18517 11743 1 10 . 1 1 127 127 ALA C C 195 178.610 178.610 178.953 -0.343 18517 11744 1 10 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.682 -0.892 18517 11745 1 10 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.679 0.581 18517 11746 1 10 . 1 1 127 127 ALA H H 195 8.020 8.020 7.558 0.462 18517 11747 1 10 . 1 1 128 128 LYS N N 196 117.770 117.770 115.375 2.395 18517 11748 1 10 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.258 0.002 18517 11749 1 10 . 1 1 128 128 LYS C C 196 177.400 177.400 177.198 0.202 18517 11750 1 10 . 1 1 128 128 LYS CA C 196 57.000 57.000 55.855 1.145 18517 11751 1 10 . 1 1 128 128 LYS CB C 196 32.740 32.740 32.969 -0.229 18517 11752 1 10 . 1 1 128 128 LYS H H 196 7.990 7.990 7.676 0.314 18517 11753 1 10 . 1 1 129 129 GLY N N 197 109.010 109.010 109.859 -0.849 18517 11754 1 10 . 1 1 129 129 GLY C C 197 175.770 175.770 175.476 0.294 18517 11755 1 10 . 1 1 129 129 GLY CA C 197 46.100 46.100 45.138 0.962 18517 11756 1 10 . 1 1 129 129 GLY H H 197 8.220 8.220 7.683 0.537 18517 11757 1 10 . 1 1 130 130 GLY N N 198 109.150 109.150 108.760 0.390 18517 11758 1 10 . 1 1 130 130 GLY C C 198 174.760 174.760 175.014 -0.254 18517 11759 1 10 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.270 -0.340 18517 11760 1 10 . 1 1 130 130 GLY H H 198 8.210 8.210 8.677 -0.467 18517 11761 1 10 . 1 1 131 131 GLU N N 199 121.560 121.560 120.778 0.782 18517 11762 1 10 . 1 1 131 131 GLU HA H 199 4.020 4.020 3.978 0.042 18517 11763 1 10 . 1 1 131 131 GLU C C 199 178.500 178.500 178.160 0.340 18517 11764 1 10 . 1 1 131 131 GLU CA C 199 59.900 59.900 58.820 1.080 18517 11765 1 10 . 1 1 131 131 GLU CB C 199 29.570 29.570 27.869 1.700 18517 11766 1 10 . 1 1 131 131 GLU H H 199 8.510 8.510 8.572 -0.062 18517 11767 1 10 . 1 1 132 132 ALA N N 200 122.390 122.390 122.658 -0.268 18517 11768 1 10 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.102 0.098 18517 11769 1 10 . 1 1 132 132 ALA C C 200 180.360 180.360 179.614 0.746 18517 11770 1 10 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.697 0.083 18517 11771 1 10 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.215 0.175 18517 11772 1 10 . 1 1 132 132 ALA H H 200 8.190 8.190 7.456 0.734 18517 11773 1 10 . 1 1 133 133 LEU N N 201 120.800 120.800 119.717 1.083 18517 11774 1 10 . 1 1 133 133 LEU HA H 201 4.210 4.210 3.915 0.295 18517 11775 1 10 . 1 1 133 133 LEU C C 201 179.270 179.270 179.217 0.053 18517 11776 1 10 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.899 -0.219 18517 11777 1 10 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.591 0.589 18517 11778 1 10 . 1 1 133 133 LEU H H 201 7.720 7.720 8.111 -0.391 18517 11779 1 10 . 1 1 134 134 LEU N N 202 120.680 120.680 120.241 0.439 18517 11780 1 10 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.980 0.000 18517 11781 1 10 . 1 1 134 134 LEU C C 202 179.030 179.030 178.835 0.195 18517 11782 1 10 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.674 0.756 18517 11783 1 10 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.392 0.228 18517 11784 1 10 . 1 1 134 134 LEU H H 202 8.470 8.470 8.647 -0.177 18517 11785 1 10 . 1 1 135 135 SER N N 203 113.290 113.290 115.651 -2.361 18517 11786 1 10 . 1 1 135 135 SER HA H 203 4.180 4.180 4.114 0.066 18517 11787 1 10 . 1 1 135 135 SER C C 203 177.300 177.300 176.845 0.455 18517 11788 1 10 . 1 1 135 135 SER CA C 203 62.080 62.080 62.612 -0.532 18517 11789 1 10 . 1 1 135 135 SER CB C 203 63.030 63.030 62.738 0.292 18517 11790 1 10 . 1 1 135 135 SER H H 203 8.210 8.210 8.289 -0.079 18517 11791 1 10 . 1 1 136 136 SER N N 204 117.500 117.500 119.144 -1.644 18517 11792 1 10 . 1 1 136 136 SER HA H 204 4.050 4.050 4.216 -0.166 18517 11793 1 10 . 1 1 136 136 SER C C 204 177.570 177.570 176.494 1.076 18517 11794 1 10 . 1 1 136 136 SER CA C 204 61.880 61.880 61.514 0.367 18517 11795 1 10 . 1 1 136 136 SER CB C 204 63.510 63.510 62.744 0.766 18517 11796 1 10 . 1 1 136 136 SER H H 204 7.730 7.730 8.053 -0.323 18517 11797 1 10 . 1 1 137 137 MET N N 205 122.500 122.500 122.319 0.181 18517 11798 1 10 . 1 1 137 137 MET HA H 205 4.140 4.140 3.986 0.154 18517 11799 1 10 . 1 1 137 137 MET C C 205 177.680 177.680 178.334 -0.654 18517 11800 1 10 . 1 1 137 137 MET CA C 205 60.140 60.140 60.035 0.105 18517 11801 1 10 . 1 1 137 137 MET CB C 205 33.460 33.460 32.458 1.002 18517 11802 1 10 . 1 1 137 137 MET H H 205 8.170 8.170 8.764 -0.594 18517 11803 1 10 . 1 1 138 138 LYS N N 206 121.410 121.410 118.786 2.624 18517 11804 1 10 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.890 -0.140 18517 11805 1 10 . 1 1 138 138 LYS C C 206 178.780 178.780 179.353 -0.573 18517 11806 1 10 . 1 1 138 138 LYS CA C 206 60.330 60.330 59.901 0.429 18517 11807 1 10 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.373 -0.103 18517 11808 1 10 . 1 1 138 138 LYS H H 206 8.810 8.810 8.330 0.480 18517 11809 1 10 . 1 1 139 139 THR N N 207 116.580 116.580 116.695 -0.115 18517 11810 1 10 . 1 1 139 139 THR HA H 207 4.060 4.060 4.021 0.039 18517 11811 1 10 . 1 1 139 139 THR C C 207 176.730 176.730 176.947 -0.217 18517 11812 1 10 . 1 1 139 139 THR CA C 207 67.150 67.150 66.776 0.374 18517 11813 1 10 . 1 1 139 139 THR CB C 207 69.220 69.220 68.477 0.743 18517 11814 1 10 . 1 1 139 139 THR H H 207 7.930 7.930 8.015 -0.085 18517 11815 1 10 . 1 1 140 140 GLN N N 208 121.390 121.390 121.176 0.214 18517 11816 1 10 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.083 -0.023 18517 11817 1 10 . 1 1 140 140 GLN C C 208 178.550 178.550 178.677 -0.127 18517 11818 1 10 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.122 0.178 18517 11819 1 10 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.828 0.033 18517 11820 1 10 . 1 1 140 140 GLN H H 208 7.600 7.600 8.404 -0.804 18517 11821 1 10 . 1 1 141 141 HIS N N 209 122.360 122.360 119.022 3.338 18517 11822 1 10 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.284 -0.454 18517 11823 1 10 . 1 1 141 141 HIS C C 209 176.390 176.390 176.785 -0.395 18517 11824 1 10 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.416 1.304 18517 11825 1 10 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.210 -1.110 18517 11826 1 10 . 1 1 141 141 HIS H H 209 8.980 8.980 8.633 0.347 18517 11827 1 10 . 1 1 142 142 ASP N N 210 120.740 120.740 120.082 0.658 18517 11828 1 10 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.411 -0.061 18517 11829 1 10 . 1 1 142 142 ASP C C 210 179.490 179.490 178.191 1.299 18517 11830 1 10 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.551 0.369 18517 11831 1 10 . 1 1 142 142 ASP CB C 210 40.590 40.590 41.039 -0.449 18517 11832 1 10 . 1 1 142 142 ASP H H 210 8.770 8.770 8.195 0.575 18517 11833 1 10 . 1 1 143 143 GLU N N 211 119.010 119.010 120.526 -1.516 18517 11834 1 10 . 1 1 143 143 GLU HA H 211 3.970 3.970 3.988 -0.018 18517 11835 1 10 . 1 1 143 143 GLU C C 211 179.070 179.070 178.846 0.224 18517 11836 1 10 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.558 -0.258 18517 11837 1 10 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.726 -0.236 18517 11838 1 10 . 1 1 143 143 GLU H H 211 7.850 7.850 8.206 -0.356 18517 11839 1 10 . 1 1 144 144 LEU N N 212 122.500 122.500 120.287 2.213 18517 11840 1 10 . 1 1 144 144 LEU HA H 212 4.070 4.070 3.996 0.074 18517 11841 1 10 . 1 1 144 144 LEU C C 212 179.340 179.340 179.507 -0.167 18517 11842 1 10 . 1 1 144 144 LEU CA C 212 58.390 58.390 57.955 0.435 18517 11843 1 10 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.850 0.330 18517 11844 1 10 . 1 1 144 144 LEU H H 212 8.070 8.070 8.044 0.026 18517 11845 1 10 . 1 1 145 145 LEU N N 213 118.110 118.110 118.598 -0.488 18517 11846 1 10 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.656 0.544 18517 11847 1 10 . 1 1 145 145 LEU C C 213 179.610 179.610 178.895 0.715 18517 11848 1 10 . 1 1 145 145 LEU CA C 213 58.750 58.750 58.290 0.460 18517 11849 1 10 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.189 0.041 18517 11850 1 10 . 1 1 145 145 LEU H H 213 8.370 8.370 7.962 0.408 18517 11851 1 10 . 1 1 146 146 LYS N N 214 117.290 117.290 119.714 -2.424 18517 11852 1 10 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.806 0.024 18517 11853 1 10 . 1 1 146 146 LYS C C 214 179.900 179.900 178.722 1.178 18517 11854 1 10 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.838 0.492 18517 11855 1 10 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.354 -0.004 18517 11856 1 10 . 1 1 146 146 LYS H H 214 7.560 7.560 8.288 -0.728 18517 11857 1 10 . 1 1 147 147 LYS N N 215 120.330 120.330 118.955 1.375 18517 11858 1 10 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.049 -0.029 18517 11859 1 10 . 1 1 147 147 LYS C C 215 180.550 180.550 179.434 1.116 18517 11860 1 10 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.017 1.083 18517 11861 1 10 . 1 1 147 147 LYS CB C 215 32.740 32.740 31.919 0.821 18517 11862 1 10 . 1 1 147 147 LYS H H 215 7.830 7.830 7.945 -0.115 18517 11863 1 10 . 1 1 148 148 PHE N N 216 117.370 117.370 118.103 -0.733 18517 11864 1 10 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.152 -0.072 18517 11865 1 10 . 1 1 148 148 PHE C C 216 178.200 178.200 177.259 0.941 18517 11866 1 10 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.145 0.975 18517 11867 1 10 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.448 1.272 18517 11868 1 10 . 1 1 148 148 PHE H H 216 8.010 8.010 8.321 -0.311 18517 11869 1 10 . 1 1 149 149 ALA N N 217 118.990 118.990 120.035 -1.045 18517 11870 1 10 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.167 -0.057 18517 11871 1 10 . 1 1 149 149 ALA C C 217 177.330 177.330 178.370 -1.040 18517 11872 1 10 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.960 -0.210 18517 11873 1 10 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.543 -0.942 18517 11874 1 10 . 1 1 149 149 ALA H H 217 7.720 7.720 8.004 -0.284 18517 11875 1 10 . 1 1 150 150 ALA N N 218 118.690 118.690 120.529 -1.839 18517 11876 1 10 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.381 -0.021 18517 11877 1 10 . 1 1 150 150 ALA C C 218 177.930 177.930 177.677 0.253 18517 11878 1 10 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.802 -0.712 18517 11879 1 10 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.464 0.276 18517 11880 1 10 . 1 1 150 150 ALA H H 218 7.280 7.280 7.805 -0.525 18517 11881 1 10 . 1 1 151 151 LEU N N 219 119.980 119.980 120.392 -0.412 18517 11882 1 10 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.541 -0.271 18517 11883 1 10 . 1 1 151 151 LEU C C 219 176.150 176.150 175.309 0.841 18517 11884 1 10 . 1 1 151 151 LEU CA C 219 56.170 56.170 54.495 1.675 18517 11885 1 10 . 1 1 151 151 LEU CB C 219 42.810 42.810 44.109 -1.299 18517 11886 1 10 . 1 1 151 151 LEU H H 219 7.050 7.050 7.647 -0.597 18517 11887 1 10 . 1 1 152 152 THR N N 220 112.070 112.070 112.948 -0.878 18517 11888 1 10 . 1 1 152 152 THR HA H 220 4.700 4.700 4.869 -0.169 18517 11889 1 10 . 1 1 152 152 THR C C 220 173.400 173.400 172.904 0.496 18517 11890 1 10 . 1 1 152 152 THR CA C 220 58.190 58.190 58.200 -0.010 18517 11891 1 10 . 1 1 152 152 THR CB C 220 70.960 70.960 69.281 1.679 18517 11892 1 10 . 1 1 152 152 THR H H 220 8.040 8.040 8.046 -0.006 18517 11893 1 10 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.644 0.066 18517 11894 1 10 . 1 1 153 153 PRO C C 221 176.720 176.720 176.660 0.060 18517 11895 1 10 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.351 0.559 18517 11896 1 10 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.273 1.977 18517 11897 1 10 . 1 1 154 154 THR N N 222 120.460 120.460 119.452 1.008 18517 11898 1 10 . 1 1 154 154 THR HA H 222 4.250 4.250 4.284 -0.034 18517 11899 1 10 . 1 1 154 154 THR C C 222 175.190 175.190 174.610 0.580 18517 11900 1 10 . 1 1 154 154 THR CA C 222 64.650 64.650 62.408 2.242 18517 11901 1 10 . 1 1 154 154 THR CB C 222 70.410 70.410 68.067 2.343 18517 11902 1 10 . 1 1 154 154 THR H H 222 8.530 8.530 8.417 0.113 18517 11903 1 10 . 1 1 155 155 PHE N N 223 122.260 122.260 122.188 0.072 18517 11904 1 10 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.777 0.213 18517 11905 1 10 . 1 1 155 155 PHE C C 223 172.560 172.560 174.776 -2.216 18517 11906 1 10 . 1 1 155 155 PHE CA C 223 56.770 56.770 57.063 -0.293 18517 11907 1 10 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.181 1.409 18517 11908 1 10 . 1 1 155 155 PHE H H 223 8.950 8.950 7.375 1.575 18517 11909 1 10 . 1 1 156 156 LEU N N 224 123.440 123.440 120.324 3.116 18517 11910 1 10 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.596 0.074 18517 11911 1 10 . 1 1 156 156 LEU C C 224 175.090 175.090 176.809 -1.719 18517 11912 1 10 . 1 1 156 156 LEU CA C 224 54.030 54.030 53.965 0.065 18517 11913 1 10 . 1 1 156 156 LEU CB C 224 46.300 46.300 43.286 3.014 18517 11914 1 10 . 1 1 156 156 LEU H H 224 7.210 7.210 7.310 -0.100 18517 11915 1 10 . 1 1 157 157 THR N N 225 113.010 113.010 115.801 -2.791 18517 11916 1 10 . 1 1 157 157 THR HA H 225 4.790 4.790 4.628 0.162 18517 11917 1 10 . 1 1 157 157 THR C C 225 176.130 176.130 174.181 1.949 18517 11918 1 10 . 1 1 157 157 THR CA C 225 59.860 59.860 61.164 -1.304 18517 11919 1 10 . 1 1 157 157 THR CB C 225 72.860 72.860 70.322 2.538 18517 11920 1 10 . 1 1 157 157 THR H H 225 9.200 9.200 8.126 1.074 18517 11921 1 10 . 1 1 158 158 SER N N 226 115.350 115.350 117.090 -1.740 18517 11922 1 10 . 1 1 158 158 SER C C 226 177.410 177.410 175.924 1.486 18517 11923 1 10 . 1 1 158 158 SER CA C 226 57.400 57.400 57.674 -0.274 18517 11924 1 10 . 1 1 158 158 SER CB C 226 66.200 66.200 63.898 2.302 18517 11925 1 10 . 1 1 158 158 SER H H 226 8.830 8.830 8.306 0.524 18517 11926 1 10 . 1 1 159 159 GLU N N 227 121.200 121.200 119.888 1.312 18517 11927 1 10 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.840 0.180 18517 11928 1 10 . 1 1 159 159 GLU C C 227 177.680 177.680 177.245 0.435 18517 11929 1 10 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.558 0.942 18517 11930 1 10 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.394 0.176 18517 11931 1 10 . 1 1 159 159 GLU H H 227 8.320 8.320 8.798 -0.478 18517 11932 1 10 . 1 1 160 160 ASP N N 228 115.350 115.350 118.256 -2.906 18517 11933 1 10 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.394 0.156 18517 11934 1 10 . 1 1 160 160 ASP C C 228 177.640 177.640 177.531 0.109 18517 11935 1 10 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.598 0.802 18517 11936 1 10 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.612 2.438 18517 11937 1 10 . 1 1 160 160 ASP H H 228 7.570 7.570 8.142 -0.572 18517 11938 1 10 . 1 1 161 161 ILE N N 229 108.150 108.150 113.074 -4.924 18517 11939 1 10 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.419 0.091 18517 11940 1 10 . 1 1 161 161 ILE C C 229 173.130 173.130 177.562 -4.432 18517 11941 1 10 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.582 -1.292 18517 11942 1 10 . 1 1 161 161 ILE CB C 229 39.400 39.400 39.002 0.398 18517 11943 1 10 . 1 1 161 161 ILE H H 229 7.190 7.190 7.769 -0.579 18517 11944 1 10 . 1 1 162 162 SER N N 230 115.290 115.290 115.347 -0.057 18517 11945 1 10 . 1 1 162 162 SER HA H 230 4.760 4.760 3.790 0.970 18517 11946 1 10 . 1 1 162 162 SER C C 230 176.060 176.060 174.491 1.569 18517 11947 1 10 . 1 1 162 162 SER CA C 230 57.920 57.920 56.809 1.111 18517 11948 1 10 . 1 1 162 162 SER CB C 230 66.120 66.120 61.838 4.282 18517 11949 1 10 . 1 1 162 162 SER H H 230 7.460 7.460 8.096 -0.636 18517 11950 1 10 . 1 1 163 163 GLY C C 231 173.260 173.260 173.201 0.059 18517 11951 1 10 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.599 0.951 18517 11952 1 10 . 1 1 164 164 TYR N N 232 115.290 115.290 117.658 -2.368 18517 11953 1 10 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.564 0.136 18517 11954 1 10 . 1 1 164 164 TYR C C 232 172.820 172.820 173.799 -0.979 18517 11955 1 10 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.422 -0.322 18517 11956 1 10 . 1 1 164 164 TYR CB C 232 39.800 39.800 38.888 0.912 18517 11957 1 10 . 1 1 164 164 TYR H H 232 7.370 7.370 7.326 0.044 18517 11958 1 10 . 1 1 165 165 LEU N N 233 120.980 120.980 123.165 -2.185 18517 11959 1 10 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.387 0.043 18517 11960 1 10 . 1 1 165 165 LEU C C 233 176.360 176.360 177.318 -0.958 18517 11961 1 10 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.556 1.104 18517 11962 1 10 . 1 1 165 165 LEU CB C 233 40.430 40.430 41.738 -1.308 18517 11963 1 10 . 1 1 165 165 LEU H H 233 8.830 8.830 8.384 0.446 18517 11964 1 10 . 1 1 166 166 THR N N 234 116.170 116.170 114.616 1.554 18517 11965 1 10 . 1 1 166 166 THR HA H 234 4.010 4.010 3.337 0.673 18517 11966 1 10 . 1 1 166 166 THR C C 234 173.070 173.070 173.661 -0.591 18517 11967 1 10 . 1 1 166 166 THR CA C 234 62.910 62.910 63.672 -0.762 18517 11968 1 10 . 1 1 166 166 THR CB C 234 70.170 70.170 69.015 1.155 18517 11969 1 10 . 1 1 166 166 THR H H 234 8.050 8.050 8.112 -0.062 18517 11970 1 10 . 1 1 167 167 VAL N N 235 117.640 117.640 121.612 -3.972 18517 11971 1 10 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.222 -0.012 18517 11972 1 10 . 1 1 167 167 VAL C C 235 172.330 172.330 173.833 -1.503 18517 11973 1 10 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.833 0.917 18517 11974 1 10 . 1 1 167 167 VAL CB C 235 35.880 35.880 32.028 3.852 18517 11975 1 10 . 1 1 167 167 VAL H H 235 7.160 7.160 7.753 -0.593 18517 11976 1 10 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.677 -0.487 18517 11977 1 10 . 1 1 168 168 PRO C C 236 173.710 173.710 175.450 -1.740 18517 11978 1 10 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.349 1.481 18517 11979 1 10 . 1 1 168 168 PRO CB C 236 32.270 32.270 32.959 -0.689 18517 11980 1 10 . 1 1 169 169 GLU N N 237 113.540 113.540 118.178 -4.638 18517 11981 1 10 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.123 0.257 18517 11982 1 10 . 1 1 169 169 GLU C C 237 176.690 176.690 178.388 -1.698 18517 11983 1 10 . 1 1 169 169 GLU CA C 237 53.750 53.750 55.866 -2.116 18517 11984 1 10 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.481 2.739 18517 11985 1 10 . 1 1 169 169 GLU H H 237 7.930 7.930 8.261 -0.331 18517 11986 1 10 . 1 1 170 170 TYR N N 238 119.400 119.400 121.845 -2.445 18517 11987 1 10 . 1 1 170 170 TYR HA H 238 4.000 4.000 3.891 0.109 18517 11988 1 10 . 1 1 170 170 TYR C C 238 177.610 177.610 176.964 0.646 18517 11989 1 10 . 1 1 170 170 TYR CA C 238 62.630 62.630 60.577 2.053 18517 11990 1 10 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.501 -0.761 18517 11991 1 10 . 1 1 170 170 TYR H H 238 8.490 8.490 8.791 -0.301 18517 11992 1 10 . 1 1 171 171 GLY N N 239 104.160 104.160 103.556 0.604 18517 11993 1 10 . 1 1 171 171 GLY C C 239 173.350 173.350 172.907 0.443 18517 11994 1 10 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.445 0.825 18517 11995 1 10 . 1 1 171 171 GLY H H 239 7.960 7.960 8.765 -0.805 18517 11996 1 10 . 1 1 172 172 ALA N N 240 121.860 121.860 124.271 -2.411 18517 11997 1 10 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.662 -0.492 18517 11998 1 10 . 1 1 172 172 ALA C C 240 172.160 172.160 175.266 -3.106 18517 11999 1 10 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.560 0.550 18517 12000 1 10 . 1 1 172 172 ALA CB C 240 20.930 20.930 18.516 2.414 18517 12001 1 10 . 1 1 172 172 ALA H H 240 6.910 6.910 8.071 -1.161 18517 12002 1 10 . 1 1 173 173 PRO HA H 241 4.550 4.550 2.601 1.949 18517 12003 1 10 . 1 1 173 173 PRO C C 241 176.610 176.610 176.577 0.033 18517 12004 1 10 . 1 1 173 173 PRO CA C 241 61.520 61.520 63.684 -2.164 18517 12005 1 10 . 1 1 173 173 PRO CB C 241 33.300 33.300 31.607 1.693 18517 12006 1 10 . 1 1 174 174 MET N N 242 114.000 114.000 114.470 -0.470 18517 12007 1 10 . 1 1 174 174 MET HA H 242 4.390 4.390 4.002 0.388 18517 12008 1 10 . 1 1 174 174 MET C C 242 173.960 173.960 174.708 -0.748 18517 12009 1 10 . 1 1 174 174 MET CA C 242 54.660 54.660 55.422 -0.762 18517 12010 1 10 . 1 1 174 174 MET CB C 242 34.170 34.170 32.258 1.912 18517 12011 1 10 . 1 1 174 174 MET H H 242 8.040 8.040 7.769 0.271 18517 12012 1 10 . 1 1 175 175 ASN N N 243 119.570 119.570 123.463 -3.893 18517 12013 1 10 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.866 0.074 18517 12014 1 10 . 1 1 175 175 ASN C C 243 174.320 174.320 175.325 -1.005 18517 12015 1 10 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.196 0.884 18517 12016 1 10 . 1 1 175 175 ASN CB C 243 38.850 38.850 37.510 1.340 18517 12017 1 10 . 1 1 175 175 ASN H H 243 7.960 7.960 8.400 -0.440 18517 12018 1 10 . 1 1 176 176 ALA N N 244 132.250 132.250 126.690 5.560 18517 12019 1 10 . 1 1 176 176 ALA C C 244 181.580 181.580 178.578 3.002 18517 12020 1 10 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.664 0.106 18517 12021 1 10 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.792 0.238 18517 12022 1 10 . 1 1 176 176 ALA H H 244 12.110 12.110 7.707 4.403 18517 12023 1 10 . 1 1 177 177 ALA N N 245 125.780 125.780 120.486 5.294 18517 12024 1 10 . 1 1 177 177 ALA HA H 245 3.870 3.870 4.027 -0.157 18517 12025 1 10 . 1 1 177 177 ALA C C 245 180.640 180.640 179.756 0.884 18517 12026 1 10 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.150 0.510 18517 12027 1 10 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.100 -0.260 18517 12028 1 10 . 1 1 177 177 ALA H H 245 10.240 10.240 8.652 1.588 18517 12029 1 10 . 1 1 178 178 LYS N N 246 119.810 119.810 119.398 0.412 18517 12030 1 10 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.129 -0.299 18517 12031 1 10 . 1 1 178 178 LYS C C 246 180.500 180.500 178.382 2.118 18517 12032 1 10 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.011 0.889 18517 12033 1 10 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.432 -1.112 18517 12034 1 10 . 1 1 178 178 LYS H H 246 8.470 8.470 7.650 0.820 18517 12035 1 10 . 1 1 179 179 TRP N N 247 121.170 121.170 121.956 -0.786 18517 12036 1 10 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.347 0.273 18517 12037 1 10 . 1 1 179 179 TRP C C 247 176.510 176.510 177.739 -1.229 18517 12038 1 10 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.545 0.275 18517 12039 1 10 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.712 -0.142 18517 12040 1 10 . 1 1 179 179 TRP H H 247 8.330 8.330 8.286 0.044 18517 12041 1 10 . 1 1 180 180 ALA N N 248 119.130 119.130 120.209 -1.079 18517 12042 1 10 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.734 0.806 18517 12043 1 10 . 1 1 180 180 ALA C C 248 182.110 182.110 179.469 2.641 18517 12044 1 10 . 1 1 180 180 ALA CA C 248 54.190 54.190 54.778 -0.588 18517 12045 1 10 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.114 0.596 18517 12046 1 10 . 1 1 180 180 ALA H H 248 7.990 7.990 8.662 -0.672 18517 12047 1 10 . 1 1 181 181 LYS N N 249 116.000 116.000 119.565 -3.565 18517 12048 1 10 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.080 -0.110 18517 12049 1 10 . 1 1 181 181 LYS C C 249 179.380 179.380 178.786 0.594 18517 12050 1 10 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.524 -0.814 18517 12051 1 10 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.712 -0.202 18517 12052 1 10 . 1 1 181 181 LYS H H 249 6.900 6.900 7.853 -0.953 18517 12053 1 10 . 1 1 182 182 VAL N N 250 122.270 122.270 116.852 5.418 18517 12054 1 10 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.779 -0.439 18517 12055 1 10 . 1 1 182 182 VAL C C 250 178.160 178.160 177.850 0.310 18517 12056 1 10 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.206 0.554 18517 12057 1 10 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.461 -0.621 18517 12058 1 10 . 1 1 182 182 VAL H H 250 7.050 7.050 8.032 -0.982 18517 12059 1 10 . 1 1 183 183 GLU N N 251 120.520 120.520 120.347 0.173 18517 12060 1 10 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.951 -0.771 18517 12061 1 10 . 1 1 183 183 GLU C C 251 179.480 179.480 179.189 0.291 18517 12062 1 10 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.150 1.540 18517 12063 1 10 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.641 -0.571 18517 12064 1 10 . 1 1 183 183 GLU H H 251 8.020 8.020 8.443 -0.423 18517 12065 1 10 . 1 1 184 184 GLY N N 252 102.930 102.930 108.554 -5.624 18517 12066 1 10 . 1 1 184 184 GLY C C 252 176.920 176.920 176.118 0.802 18517 12067 1 10 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.235 0.175 18517 12068 1 10 . 1 1 184 184 GLY H H 252 7.830 7.830 8.172 -0.342 18517 12069 1 10 . 1 1 185 185 MET N N 253 123.200 123.200 121.793 1.407 18517 12070 1 10 . 1 1 185 185 MET HA H 253 4.250 4.250 3.987 0.263 18517 12071 1 10 . 1 1 185 185 MET C C 253 179.370 179.370 178.518 0.852 18517 12072 1 10 . 1 1 185 185 MET CA C 253 59.300 59.300 59.445 -0.145 18517 12073 1 10 . 1 1 185 185 MET CB C 253 33.930 33.930 32.489 1.441 18517 12074 1 10 . 1 1 185 185 MET H H 253 7.890 7.890 7.864 0.025 18517 12075 1 10 . 1 1 186 186 ILE N N 254 120.150 120.150 119.902 0.248 18517 12076 1 10 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.713 -0.153 18517 12077 1 10 . 1 1 186 186 ILE C C 254 177.250 177.250 177.912 -0.662 18517 12078 1 10 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.959 0.561 18517 12079 1 10 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.877 0.413 18517 12080 1 10 . 1 1 186 186 ILE H H 254 8.260 8.260 8.226 0.034 18517 12081 1 10 . 1 1 187 187 HIS N N 255 119.810 119.810 119.365 0.445 18517 12082 1 10 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.151 -0.151 18517 12083 1 10 . 1 1 187 187 HIS C C 255 176.460 176.460 177.480 -1.020 18517 12084 1 10 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.934 0.396 18517 12085 1 10 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.603 2.027 18517 12086 1 10 . 1 1 187 187 HIS H H 255 8.900 8.900 8.843 0.057 18517 12087 1 10 . 1 1 188 188 GLY N N 256 103.160 103.160 107.061 -3.901 18517 12088 1 10 . 1 1 188 188 GLY C C 256 176.320 176.320 175.925 0.395 18517 12089 1 10 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.591 0.299 18517 12090 1 10 . 1 1 188 188 GLY H H 256 8.030 8.030 8.408 -0.378 18517 12091 1 10 . 1 1 189 189 LYS N N 257 119.510 119.510 121.294 -1.784 18517 12092 1 10 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.072 -0.072 18517 12093 1 10 . 1 1 189 189 LYS C C 257 178.660 178.660 179.017 -0.357 18517 12094 1 10 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.084 -0.594 18517 12095 1 10 . 1 1 189 189 LYS CB C 257 31.550 31.550 32.056 -0.506 18517 12096 1 10 . 1 1 189 189 LYS H H 257 7.120 7.120 7.629 -0.509 18517 12097 1 10 . 1 1 190 190 LEU N N 258 120.570 120.570 120.220 0.350 18517 12098 1 10 . 1 1 190 190 LEU HA H 258 3.930 3.930 3.990 -0.060 18517 12099 1 10 . 1 1 190 190 LEU C C 258 177.230 177.230 176.501 0.729 18517 12100 1 10 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.391 0.129 18517 12101 1 10 . 1 1 190 190 LEU CB C 258 42.970 42.970 42.302 0.668 18517 12102 1 10 . 1 1 190 190 LEU H H 258 8.060 8.060 8.224 -0.164 18517 12103 1 10 . 1 1 191 191 GLU N N 259 114.590 114.590 113.810 0.780 18517 12104 1 10 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.342 -0.062 18517 12105 1 10 . 1 1 191 191 GLU C C 259 176.230 176.230 176.292 -0.062 18517 12106 1 10 . 1 1 191 191 GLU CA C 259 55.340 55.340 55.537 -0.197 18517 12107 1 10 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.578 -0.248 18517 12108 1 10 . 1 1 191 191 GLU H H 259 7.330 7.330 7.594 -0.264 18517 12109 1 10 . 1 1 192 192 SER N N 260 115.240 115.240 115.966 -0.726 18517 12110 1 10 . 1 1 192 192 SER HA H 260 4.490 4.490 4.461 0.029 18517 12111 1 10 . 1 1 192 192 SER C C 260 173.770 173.770 174.956 -1.186 18517 12112 1 10 . 1 1 192 192 SER CA C 260 58.350 58.350 57.359 0.991 18517 12113 1 10 . 1 1 192 192 SER CB C 260 65.090 65.090 64.269 0.821 18517 12114 1 10 . 1 1 192 192 SER H H 260 7.130 7.130 7.559 -0.429 18517 12115 1 10 . 1 1 193 193 SER C C 261 174.600 174.600 174.467 0.133 18517 12116 1 10 . 1 1 193 193 SER CA C 261 59.980 59.980 60.391 -0.411 18517 12117 1 10 . 1 1 193 193 SER CB C 261 63.750 63.750 63.342 0.408 18517 12118 1 10 . 1 1 194 194 GLU N N 262 121.800 121.800 121.836 -0.036 18517 12119 1 10 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.537 -0.067 18517 12120 1 10 . 1 1 194 194 GLU C C 262 174.650 174.650 175.127 -0.477 18517 12121 1 10 . 1 1 194 194 GLU CA C 262 55.620 55.620 55.543 0.077 18517 12122 1 10 . 1 1 194 194 GLU CB C 262 30.210 30.210 29.651 0.559 18517 12123 1 10 . 1 1 194 194 GLU H H 262 7.840 7.840 8.277 -0.437 18517 12124 1 10 . 1 1 195 195 VAL N N 263 124.080 124.080 125.106 -1.026 18517 12125 1 10 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.433 -0.183 18517 12126 1 10 . 1 1 195 195 VAL C C 263 174.460 174.460 174.554 -0.094 18517 12127 1 10 . 1 1 195 195 VAL CA C 263 59.820 59.820 58.408 1.412 18517 12128 1 10 . 1 1 195 195 VAL CB C 263 33.620 33.620 32.097 1.523 18517 12129 1 10 . 1 1 195 195 VAL H H 263 8.020 8.020 8.208 -0.188 18517 12130 1 10 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.443 0.077 18517 12131 1 10 . 1 1 198 198 ASN C C 266 176.490 176.490 177.376 -0.886 18517 12132 1 10 . 1 1 198 198 ASN CA C 266 54.780 54.780 56.156 -1.376 18517 12133 1 10 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.663 0.397 18517 12134 1 10 . 1 1 199 199 LEU N N 267 120.680 120.680 122.595 -1.915 18517 12135 1 10 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.830 0.180 18517 12136 1 10 . 1 1 199 199 LEU C C 267 178.050 178.050 178.147 -0.097 18517 12137 1 10 . 1 1 199 199 LEU CA C 267 58.830 58.830 57.760 1.070 18517 12138 1 10 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.704 0.636 18517 12139 1 10 . 1 1 199 199 LEU H H 267 7.660 7.660 7.742 -0.082 18517 12140 1 10 . 1 1 200 200 LYS N N 268 116.740 116.740 119.450 -2.710 18517 12141 1 10 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.867 -0.137 18517 12142 1 10 . 1 1 200 200 LYS C C 268 178.520 178.520 178.625 -0.105 18517 12143 1 10 . 1 1 200 200 LYS CA C 268 61.800 61.800 59.811 1.989 18517 12144 1 10 . 1 1 200 200 LYS CB C 268 32.110 32.110 32.370 -0.260 18517 12145 1 10 . 1 1 200 200 LYS H H 268 8.280 8.280 8.560 -0.280 18517 12146 1 10 . 1 1 201 201 ALA N N 269 121.270 121.270 122.239 -0.969 18517 12147 1 10 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.056 0.184 18517 12148 1 10 . 1 1 201 201 ALA C C 269 180.890 180.890 179.639 1.251 18517 12149 1 10 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.074 0.106 18517 12150 1 10 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.350 0.120 18517 12151 1 10 . 1 1 201 201 ALA H H 269 7.710 7.710 7.913 -0.203 18517 12152 1 10 . 1 1 202 202 LEU N N 270 119.980 119.980 119.538 0.442 18517 12153 1 10 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.920 0.170 18517 12154 1 10 . 1 1 202 202 LEU C C 270 179.330 179.330 179.310 0.020 18517 12155 1 10 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.773 0.297 18517 12156 1 10 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.216 1.204 18517 12157 1 10 . 1 1 202 202 LEU H H 270 7.750 7.750 8.186 -0.436 18517 12158 1 10 . 1 1 203 203 VAL N N 271 118.450 118.450 119.181 -0.731 18517 12159 1 10 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.886 -0.056 18517 12160 1 10 . 1 1 203 203 VAL C C 271 177.110 177.110 178.313 -1.203 18517 12161 1 10 . 1 1 203 203 VAL CA C 271 67.710 67.710 66.173 1.537 18517 12162 1 10 . 1 1 203 203 VAL CB C 271 31.710 31.710 30.648 1.062 18517 12163 1 10 . 1 1 203 203 VAL H H 271 8.560 8.560 8.315 0.245 18517 12164 1 10 . 1 1 204 204 ALA N N 272 122.560 122.560 122.930 -0.370 18517 12165 1 10 . 1 1 204 204 ALA HA H 272 3.880 3.880 3.997 -0.117 18517 12166 1 10 . 1 1 204 204 ALA C C 272 178.700 178.700 179.668 -0.968 18517 12167 1 10 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.545 0.585 18517 12168 1 10 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.409 -0.019 18517 12169 1 10 . 1 1 204 204 ALA H H 272 8.120 8.120 8.450 -0.330 18517 12170 1 10 . 1 1 205 205 GLU N N 273 117.290 117.290 118.795 -1.505 18517 12171 1 10 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.058 -0.068 18517 12172 1 10 . 1 1 205 205 GLU C C 273 178.630 178.630 179.239 -0.609 18517 12173 1 10 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.162 0.978 18517 12174 1 10 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.358 0.612 18517 12175 1 10 . 1 1 205 205 GLU H H 273 7.670 7.670 8.279 -0.609 18517 12176 1 10 . 1 1 206 206 LEU N N 274 120.450 120.450 121.703 -1.253 18517 12177 1 10 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.003 -0.003 18517 12178 1 10 . 1 1 206 206 LEU C C 274 178.400 178.400 178.753 -0.353 18517 12179 1 10 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.182 0.728 18517 12180 1 10 . 1 1 206 206 LEU CB C 274 43.530 43.530 42.034 1.496 18517 12181 1 10 . 1 1 206 206 LEU H H 274 8.420 8.420 8.362 0.058 18517 12182 1 10 . 1 1 207 207 ILE N N 275 117.580 117.580 120.547 -2.967 18517 12183 1 10 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.558 -0.028 18517 12184 1 10 . 1 1 207 207 ILE C C 275 178.850 178.850 177.974 0.876 18517 12185 1 10 . 1 1 207 207 ILE CA C 275 66.080 66.080 65.929 0.151 18517 12186 1 10 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.774 0.996 18517 12187 1 10 . 1 1 207 207 ILE H H 275 8.700 8.700 8.325 0.375 18517 12188 1 10 . 1 1 208 208 GLU N N 276 119.100 119.100 118.905 0.195 18517 12189 1 10 . 1 1 208 208 GLU HA H 276 4.000 4.000 3.983 0.017 18517 12190 1 10 . 1 1 208 208 GLU C C 276 178.540 178.540 179.349 -0.809 18517 12191 1 10 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.396 1.054 18517 12192 1 10 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.079 1.440 18517 12193 1 10 . 1 1 208 208 GLU H H 276 7.950 7.950 8.562 -0.612 18517 12194 1 10 . 1 1 209 209 LEU N N 277 120.590 120.590 121.170 -0.580 18517 12195 1 10 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.032 0.188 18517 12196 1 10 . 1 1 209 209 LEU C C 277 179.520 179.520 178.505 1.015 18517 12197 1 10 . 1 1 209 209 LEU CA C 277 58.350 58.350 57.978 0.372 18517 12198 1 10 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.937 1.353 18517 12199 1 10 . 1 1 209 209 LEU H H 277 8.550 8.550 8.207 0.343 18517 12200 1 10 . 1 1 210 210 ARG N N 278 116.470 116.470 119.446 -2.976 18517 12201 1 10 . 1 1 210 210 ARG HA H 278 3.740 3.740 3.853 -0.113 18517 12202 1 10 . 1 1 210 210 ARG C C 278 179.190 179.190 178.653 0.537 18517 12203 1 10 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.896 1.784 18517 12204 1 10 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.202 1.198 18517 12205 1 10 . 1 1 210 210 ARG H H 278 8.590 8.590 8.446 0.144 18517 12206 1 10 . 1 1 211 211 ALA N N 279 120.470 120.470 121.627 -1.157 18517 12207 1 10 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.026 -0.116 18517 12208 1 10 . 1 1 211 211 ALA C C 279 181.350 181.350 179.891 1.459 18517 12209 1 10 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.115 0.585 18517 12210 1 10 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.332 -1.052 18517 12211 1 10 . 1 1 211 211 ALA H H 279 8.050 8.050 8.435 -0.385 18517 12212 1 10 . 1 1 212 212 GLN N N 280 120.070 120.070 118.005 2.065 18517 12213 1 10 . 1 1 212 212 GLN HA H 280 4.020 4.020 4.121 -0.101 18517 12214 1 10 . 1 1 212 212 GLN C C 280 179.490 179.490 178.524 0.966 18517 12215 1 10 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.340 0.960 18517 12216 1 10 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.523 0.657 18517 12217 1 10 . 1 1 212 212 GLN H H 280 8.300 8.300 8.048 0.252 18517 12218 1 10 . 1 1 213 213 MET N N 281 119.810 119.810 120.962 -1.152 18517 12219 1 10 . 1 1 213 213 MET HA H 281 3.730 3.730 4.233 -0.503 18517 12220 1 10 . 1 1 213 213 MET C C 281 177.490 177.490 178.129 -0.639 18517 12221 1 10 . 1 1 213 213 MET CA C 281 60.690 60.690 57.967 2.723 18517 12222 1 10 . 1 1 213 213 MET CB C 281 33.930 33.930 32.526 1.404 18517 12223 1 10 . 1 1 213 213 MET H H 281 8.420 8.420 8.714 -0.294 18517 12224 1 10 . 1 1 214 214 MET N N 282 114.000 114.000 117.308 -3.308 18517 12225 1 10 . 1 1 214 214 MET HA H 282 3.880 3.880 4.234 -0.354 18517 12226 1 10 . 1 1 214 214 MET C C 282 177.650 177.650 178.330 -0.680 18517 12227 1 10 . 1 1 214 214 MET CA C 282 58.670 58.670 59.008 -0.339 18517 12228 1 10 . 1 1 214 214 MET CB C 282 33.300 33.300 32.353 0.946 18517 12229 1 10 . 1 1 214 214 MET H H 282 7.890 7.890 8.122 -0.232 18517 12230 1 10 . 1 1 215 215 ALA N N 283 119.970 119.970 123.908 -3.938 18517 12231 1 10 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.106 0.034 18517 12232 1 10 . 1 1 215 215 ALA C C 283 180.580 180.580 179.205 1.375 18517 12233 1 10 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.211 -1.101 18517 12234 1 10 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.249 -0.569 18517 12235 1 10 . 1 1 215 215 ALA H H 283 7.580 7.580 8.127 -0.547 18517 12236 1 10 . 1 1 216 216 LEU N N 284 120.920 120.920 118.029 2.891 18517 12237 1 10 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.085 -0.125 18517 12238 1 10 . 1 1 216 216 LEU C C 284 177.910 177.910 179.200 -1.290 18517 12239 1 10 . 1 1 216 216 LEU CA C 284 57.920 57.920 56.909 1.011 18517 12240 1 10 . 1 1 216 216 LEU CB C 284 42.500 42.500 41.999 0.501 18517 12241 1 10 . 1 1 216 216 LEU H H 284 7.460 7.460 7.979 -0.519 18517 12242 1 10 . 1 1 217 217 LEU N N 285 116.470 116.470 122.477 -6.007 18517 12243 1 10 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.952 -0.272 18517 12244 1 10 . 1 1 217 217 LEU C C 285 178.310 178.310 178.469 -0.159 18517 12245 1 10 . 1 1 217 217 LEU CA C 285 57.440 57.440 58.117 -0.677 18517 12246 1 10 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.877 1.173 18517 12247 1 10 . 1 1 217 217 LEU H H 285 6.980 6.980 8.323 -1.343 18517 12248 1 10 . 1 1 218 218 TYR N N 286 111.080 111.080 115.315 -4.235 18517 12249 1 10 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.701 0.199 18517 12250 1 10 . 1 1 218 218 TYR C C 286 176.090 176.090 176.222 -0.132 18517 12251 1 10 . 1 1 218 218 TYR CA C 286 56.050 56.050 57.886 -1.837 18517 12252 1 10 . 1 1 218 218 TYR CB C 286 40.910 40.910 36.798 4.112 18517 12253 1 10 . 1 1 218 218 TYR H H 286 7.660 7.660 7.998 -0.338 18517 12254 1 10 . 1 1 219 219 GLY N N 287 108.260 108.260 108.868 -0.608 18517 12255 1 10 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.981 0.339 18517 12256 1 10 . 1 1 219 219 GLY H H 287 7.750 7.750 7.649 0.101 18517 12257 1 10 . 1 1 221 221 ILE HA H 289 3.490 3.490 2.869 0.621 18517 12258 1 10 . 1 1 221 221 ILE CA C 289 63.580 63.580 62.787 0.793 18517 12259 1 10 . 1 1 221 221 ILE CB C 289 38.280 38.280 38.198 0.082 18517 12260 1 10 . 1 1 222 222 GLY CA C 290 45.740 45.740 44.699 1.042 18517 12261 1 11 . 1 1 2 2 LYS N N 70 126.600 126.600 126.370 0.230 18517 12262 1 11 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.777 -0.417 18517 12263 1 11 . 1 1 2 2 LYS C C 70 176.000 176.000 174.709 1.291 18517 12264 1 11 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.641 0.809 18517 12265 1 11 . 1 1 2 2 LYS CB C 70 33.850 33.850 34.185 -0.335 18517 12266 1 11 . 1 1 2 2 LYS H H 70 8.530 8.530 8.483 0.047 18517 12267 1 11 . 1 1 3 3 THR N N 71 111.030 111.030 116.952 -5.922 18517 12268 1 11 . 1 1 3 3 THR HA H 71 4.400 4.400 4.555 -0.155 18517 12269 1 11 . 1 1 3 3 THR C C 71 175.650 175.650 174.891 0.759 18517 12270 1 11 . 1 1 3 3 THR CA C 71 60.610 60.610 59.999 0.611 18517 12271 1 11 . 1 1 3 3 THR CB C 71 71.520 71.520 70.046 1.474 18517 12272 1 11 . 1 1 3 3 THR H H 71 7.390 7.390 8.241 -0.851 18517 12273 1 11 . 1 1 4 4 LEU N N 72 121.560 121.560 123.285 -1.725 18517 12274 1 11 . 1 1 4 4 LEU C C 72 177.870 177.870 177.534 0.336 18517 12275 1 11 . 1 1 4 4 LEU CA C 72 58.480 58.480 59.004 -0.524 18517 12276 1 11 . 1 1 4 4 LEU CB C 72 42.180 42.180 42.106 0.074 18517 12277 1 11 . 1 1 4 4 LEU H H 72 8.980 8.980 8.560 0.420 18517 12278 1 11 . 1 1 5 5 ASP N N 73 115.530 115.530 117.171 -1.641 18517 12279 1 11 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.385 -0.055 18517 12280 1 11 . 1 1 5 5 ASP C C 73 179.290 179.290 178.596 0.694 18517 12281 1 11 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.320 0.520 18517 12282 1 11 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.585 0.245 18517 12283 1 11 . 1 1 5 5 ASP H H 73 8.270 8.270 8.703 -0.433 18517 12284 1 11 . 1 1 6 6 VAL N N 74 122.330 122.330 120.117 2.213 18517 12285 1 11 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.683 0.057 18517 12286 1 11 . 1 1 6 6 VAL C C 74 178.970 178.970 177.831 1.139 18517 12287 1 11 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.714 0.646 18517 12288 1 11 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.906 0.044 18517 12289 1 11 . 1 1 6 6 VAL H H 74 7.400 7.400 7.496 -0.096 18517 12290 1 11 . 1 1 7 7 LEU N N 75 121.360 121.360 121.000 0.360 18517 12291 1 11 . 1 1 7 7 LEU HA H 75 4.030 4.030 4.020 0.010 18517 12292 1 11 . 1 1 7 7 LEU C C 75 179.240 179.240 179.375 -0.135 18517 12293 1 11 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.116 0.114 18517 12294 1 11 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.330 1.560 18517 12295 1 11 . 1 1 7 7 LEU H H 75 8.300 8.300 8.562 -0.262 18517 12296 1 11 . 1 1 8 8 ARG N N 76 117.230 117.230 119.533 -2.303 18517 12297 1 11 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.042 -0.122 18517 12298 1 11 . 1 1 8 8 ARG C C 76 178.290 178.290 178.732 -0.442 18517 12299 1 11 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.559 1.211 18517 12300 1 11 . 1 1 8 8 ARG CB C 76 30.210 30.210 30.055 0.155 18517 12301 1 11 . 1 1 8 8 ARG H H 76 8.520 8.520 8.500 0.020 18517 12302 1 11 . 1 1 9 9 GLY N N 77 104.570 104.570 107.584 -3.014 18517 12303 1 11 . 1 1 9 9 GLY C C 77 176.180 176.180 176.184 -0.004 18517 12304 1 11 . 1 1 9 9 GLY CA C 77 47.170 47.170 47.007 0.163 18517 12305 1 11 . 1 1 9 9 GLY H H 77 7.620 7.620 8.248 -0.628 18517 12306 1 11 . 1 1 10 10 GLU N N 78 120.270 120.270 122.838 -2.568 18517 12307 1 11 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.073 0.197 18517 12308 1 11 . 1 1 10 10 GLU C C 78 179.030 179.030 179.083 -0.053 18517 12309 1 11 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.092 -0.222 18517 12310 1 11 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.540 1.861 18517 12311 1 11 . 1 1 10 10 GLU H H 78 8.100 8.100 8.176 -0.076 18517 12312 1 11 . 1 1 11 11 LEU N N 79 116.000 116.000 120.554 -4.554 18517 12313 1 11 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.903 0.607 18517 12314 1 11 . 1 1 11 11 LEU C C 79 179.630 179.630 179.125 0.505 18517 12315 1 11 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.326 -1.636 18517 12316 1 11 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.479 3.321 18517 12317 1 11 . 1 1 11 11 LEU H H 79 8.230 8.230 8.363 -0.133 18517 12318 1 11 . 1 1 12 12 ARG N N 80 120.020 120.020 118.621 1.399 18517 12319 1 11 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.950 -0.200 18517 12320 1 11 . 1 1 12 12 ARG C C 80 178.490 178.490 179.098 -0.608 18517 12321 1 11 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.810 2.190 18517 12322 1 11 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.939 1.301 18517 12323 1 11 . 1 1 12 12 ARG H H 80 8.210 8.210 8.611 -0.401 18517 12324 1 11 . 1 1 13 13 GLY N N 81 108.090 108.090 107.878 0.212 18517 12325 1 11 . 1 1 13 13 GLY C C 81 173.540 173.540 176.022 -2.482 18517 12326 1 11 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.956 1.044 18517 12327 1 11 . 1 1 13 13 GLY H H 81 8.890 8.890 8.421 0.469 18517 12328 1 11 . 1 1 14 14 GLN C C 82 179.540 179.540 178.174 1.366 18517 12329 1 11 . 1 1 14 14 GLN CA C 82 58.710 58.710 58.954 -0.244 18517 12330 1 11 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.339 0.761 18517 12331 1 11 . 1 1 15 15 ARG N N 83 118.220 118.220 119.544 -1.324 18517 12332 1 11 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.015 -0.065 18517 12333 1 11 . 1 1 15 15 ARG C C 83 177.710 177.710 178.596 -0.886 18517 12334 1 11 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.672 0.228 18517 12335 1 11 . 1 1 15 15 ARG CB C 83 29.650 29.650 29.790 -0.140 18517 12336 1 11 . 1 1 15 15 ARG H H 83 7.320 7.320 8.342 -1.022 18517 12337 1 11 . 1 1 16 16 GLU N N 84 118.810 118.810 120.176 -1.366 18517 12338 1 11 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.055 -0.205 18517 12339 1 11 . 1 1 16 16 GLU C C 84 178.750 178.750 178.873 -0.123 18517 12340 1 11 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.456 1.554 18517 12341 1 11 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.199 0.211 18517 12342 1 11 . 1 1 16 16 GLU H H 84 8.450 8.450 8.479 -0.029 18517 12343 1 11 . 1 1 17 17 ALA N N 85 122.790 122.790 122.159 0.631 18517 12344 1 11 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.124 0.066 18517 12345 1 11 . 1 1 17 17 ALA C C 85 180.360 180.360 179.813 0.547 18517 12346 1 11 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.112 0.347 18517 12347 1 11 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.206 -0.126 18517 12348 1 11 . 1 1 17 17 ALA H H 85 8.420 8.420 8.262 0.158 18517 12349 1 11 . 1 1 18 18 PHE N N 86 119.400 119.400 120.601 -1.201 18517 12350 1 11 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.270 0.020 18517 12351 1 11 . 1 1 18 18 PHE C C 86 177.560 177.560 177.665 -0.105 18517 12352 1 11 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.224 0.416 18517 12353 1 11 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.429 0.211 18517 12354 1 11 . 1 1 18 18 PHE H H 86 7.490 7.490 8.646 -1.156 18517 12355 1 11 . 1 1 19 19 LEU N N 87 117.470 117.470 120.041 -2.571 18517 12356 1 11 . 1 1 19 19 LEU HA H 87 4.070 4.070 4.058 0.012 18517 12357 1 11 . 1 1 19 19 LEU C C 87 178.880 178.880 178.396 0.484 18517 12358 1 11 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.216 -0.256 18517 12359 1 11 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.517 0.583 18517 12360 1 11 . 1 1 19 19 LEU H H 87 8.010 8.010 8.947 -0.937 18517 12361 1 11 . 1 1 20 20 SER N N 88 113.770 113.770 115.416 -1.646 18517 12362 1 11 . 1 1 20 20 SER HA H 88 4.070 4.070 4.123 -0.053 18517 12363 1 11 . 1 1 20 20 SER C C 88 175.680 175.680 176.716 -1.036 18517 12364 1 11 . 1 1 20 20 SER CA C 88 63.070 63.070 62.829 0.241 18517 12365 1 11 . 1 1 20 20 SER H H 88 8.100 8.100 8.289 -0.189 18517 12366 1 11 . 1 1 21 21 GLU N N 89 120.570 120.570 122.109 -1.539 18517 12367 1 11 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.040 -0.070 18517 12368 1 11 . 1 1 21 21 GLU C C 89 178.940 178.940 179.094 -0.154 18517 12369 1 11 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.221 0.039 18517 12370 1 11 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.442 -0.112 18517 12371 1 11 . 1 1 21 21 GLU H H 89 7.400 7.400 7.839 -0.439 18517 12372 1 11 . 1 1 22 22 ILE N N 90 119.350 119.350 120.369 -1.019 18517 12373 1 11 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.954 -0.264 18517 12374 1 11 . 1 1 22 22 ILE C C 90 177.230 177.230 178.511 -1.281 18517 12375 1 11 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.791 0.679 18517 12376 1 11 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.817 -0.427 18517 12377 1 11 . 1 1 22 22 ILE H H 90 7.250 7.250 8.079 -0.829 18517 12378 1 11 . 1 1 23 23 ILE N N 91 116.350 116.350 119.751 -3.401 18517 12379 1 11 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.827 -0.427 18517 12380 1 11 . 1 1 23 23 ILE C C 91 176.690 176.690 177.733 -1.043 18517 12381 1 11 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.490 2.240 18517 12382 1 11 . 1 1 23 23 ILE CB C 91 38.770 38.770 37.403 1.367 18517 12383 1 11 . 1 1 23 23 ILE H H 91 7.860 7.860 8.182 -0.322 18517 12384 1 11 . 1 1 24 24 LYS N N 92 116.000 116.000 117.424 -1.424 18517 12385 1 11 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.166 -0.026 18517 12386 1 11 . 1 1 24 24 LYS C C 92 176.270 176.270 176.781 -0.511 18517 12387 1 11 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.425 0.055 18517 12388 1 11 . 1 1 24 24 LYS CB C 92 33.300 33.300 33.015 0.285 18517 12389 1 11 . 1 1 24 24 LYS H H 92 7.170 7.170 8.032 -0.862 18517 12390 1 11 . 1 1 25 25 SER N N 93 114.650 114.650 114.856 -0.206 18517 12391 1 11 . 1 1 25 25 SER HA H 93 4.550 4.550 4.480 0.070 18517 12392 1 11 . 1 1 25 25 SER C C 93 173.370 173.370 173.348 0.022 18517 12393 1 11 . 1 1 25 25 SER CA C 93 57.240 57.240 57.629 -0.389 18517 12394 1 11 . 1 1 25 25 SER CB C 93 65.650 65.650 64.939 0.711 18517 12395 1 11 . 1 1 25 25 SER H H 93 7.730 7.730 7.814 -0.084 18517 12396 1 11 . 1 1 26 26 ASP N N 94 121.230 121.230 120.901 0.329 18517 12397 1 11 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.732 0.198 18517 12398 1 11 . 1 1 26 26 ASP C C 94 176.560 176.560 175.417 1.143 18517 12399 1 11 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.837 0.673 18517 12400 1 11 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.363 1.287 18517 12401 1 11 . 1 1 26 26 ASP H H 94 8.280 8.280 8.306 -0.026 18517 12402 1 11 . 1 1 27 27 GLY N N 95 109.310 109.310 108.542 0.768 18517 12403 1 11 . 1 1 27 27 GLY C C 95 171.080 171.080 172.000 -0.920 18517 12404 1 11 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.156 -0.386 18517 12405 1 11 . 1 1 27 27 GLY H H 95 8.160 8.160 7.651 0.509 18517 12406 1 11 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.702 0.438 18517 12407 1 11 . 1 1 29 29 PHE C C 97 175.230 175.230 176.705 -1.475 18517 12408 1 11 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.834 -0.344 18517 12409 1 11 . 1 1 29 29 PHE CB C 97 41.620 41.620 40.574 1.046 18517 12410 1 11 . 1 1 30 30 THR N N 98 112.600 112.600 113.911 -1.311 18517 12411 1 11 . 1 1 30 30 THR HA H 98 4.570 4.570 4.191 0.379 18517 12412 1 11 . 1 1 30 30 THR C C 98 176.690 176.690 174.685 2.005 18517 12413 1 11 . 1 1 30 30 THR CA C 98 60.290 60.290 59.498 0.792 18517 12414 1 11 . 1 1 30 30 THR CB C 98 71.600 71.600 71.155 0.445 18517 12415 1 11 . 1 1 30 30 THR H H 98 8.990 8.990 8.969 0.021 18517 12416 1 11 . 1 1 31 31 ILE N N 99 119.240 119.240 121.732 -2.492 18517 12417 1 11 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.673 0.147 18517 12418 1 11 . 1 1 31 31 ILE C C 99 176.090 176.090 176.904 -0.814 18517 12419 1 11 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.418 -3.278 18517 12420 1 11 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.892 -0.942 18517 12421 1 11 . 1 1 31 31 ILE H H 99 9.230 9.230 8.157 1.073 18517 12422 1 11 . 1 1 32 32 LEU N N 100 119.660 119.660 117.930 1.730 18517 12423 1 11 . 1 1 32 32 LEU HA H 100 4.030 4.030 4.020 0.010 18517 12424 1 11 . 1 1 32 32 LEU C C 100 181.050 181.050 179.165 1.885 18517 12425 1 11 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.520 0.040 18517 12426 1 11 . 1 1 32 32 LEU CB C 100 40.120 40.120 41.326 -1.206 18517 12427 1 11 . 1 1 32 32 LEU H H 100 7.310 7.310 8.203 -0.893 18517 12428 1 11 . 1 1 33 33 GLN N N 101 121.450 121.450 119.670 1.780 18517 12429 1 11 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.380 -0.130 18517 12430 1 11 . 1 1 33 33 GLN CA C 101 59.700 59.700 59.183 0.517 18517 12431 1 11 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.928 2.862 18517 12432 1 11 . 1 1 33 33 GLN H H 101 7.790 7.790 7.767 0.023 18517 12433 1 11 . 1 1 34 34 LEU C C 102 178.590 178.590 179.123 -0.533 18517 12434 1 11 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.197 0.433 18517 12435 1 11 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.706 -0.396 18517 12436 1 11 . 1 1 35 35 VAL N N 103 118.520 118.520 115.045 3.475 18517 12437 1 11 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.753 -0.333 18517 12438 1 11 . 1 1 35 35 VAL C C 103 177.930 177.930 177.914 0.016 18517 12439 1 11 . 1 1 35 35 VAL CA C 103 66.040 66.040 65.388 0.652 18517 12440 1 11 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.049 1.581 18517 12441 1 11 . 1 1 35 35 VAL H H 103 8.670 8.670 8.287 0.383 18517 12442 1 11 . 1 1 36 36 GLY N N 104 109.430 109.430 109.178 0.252 18517 12443 1 11 . 1 1 36 36 GLY C C 104 174.600 174.600 175.279 -0.679 18517 12444 1 11 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.062 0.978 18517 12445 1 11 . 1 1 36 36 GLY H H 104 7.880 7.880 7.943 -0.063 18517 12446 1 11 . 1 1 37 37 TYR N N 105 122.270 122.270 124.061 -1.791 18517 12447 1 11 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.436 -0.556 18517 12448 1 11 . 1 1 37 37 TYR C C 105 176.310 176.310 177.028 -0.718 18517 12449 1 11 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.324 3.776 18517 12450 1 11 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.686 -0.316 18517 12451 1 11 . 1 1 37 37 TYR H H 105 8.170 8.170 8.231 -0.061 18517 12452 1 11 . 1 1 38 38 LEU N N 106 120.100 120.100 120.882 -0.782 18517 12453 1 11 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.695 0.045 18517 12454 1 11 . 1 1 38 38 LEU C C 106 178.280 178.280 178.283 -0.003 18517 12455 1 11 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.291 0.339 18517 12456 1 11 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.730 1.000 18517 12457 1 11 . 1 1 38 38 LEU H H 106 7.610 7.610 8.347 -0.737 18517 12458 1 11 . 1 1 39 39 ARG N N 107 116.670 116.670 118.970 -2.300 18517 12459 1 11 . 1 1 39 39 ARG HA H 107 3.680 3.680 4.296 -0.616 18517 12460 1 11 . 1 1 39 39 ARG C C 107 179.480 179.480 178.519 0.961 18517 12461 1 11 . 1 1 39 39 ARG CA C 107 59.580 59.580 59.069 0.511 18517 12462 1 11 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.984 1.256 18517 12463 1 11 . 1 1 39 39 ARG H H 107 8.240 8.240 7.915 0.325 18517 12464 1 11 . 1 1 40 40 VAL N N 108 121.970 121.970 119.391 2.579 18517 12465 1 11 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.675 -0.275 18517 12466 1 11 . 1 1 40 40 VAL C C 108 178.440 178.440 178.357 0.083 18517 12467 1 11 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.457 1.493 18517 12468 1 11 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.313 -0.873 18517 12469 1 11 . 1 1 40 40 VAL H H 108 8.200 8.200 7.951 0.249 18517 12470 1 11 . 1 1 41 41 VAL N N 109 108.940 108.940 115.850 -6.910 18517 12471 1 11 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.522 0.718 18517 12472 1 11 . 1 1 41 41 VAL C C 109 175.070 175.070 177.456 -2.386 18517 12473 1 11 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.673 -3.083 18517 12474 1 11 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.522 -0.872 18517 12475 1 11 . 1 1 41 41 VAL H H 109 7.760 7.760 8.048 -0.288 18517 12476 1 11 . 1 1 42 42 ASP N N 110 124.670 124.670 122.401 2.269 18517 12477 1 11 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.273 0.347 18517 12478 1 11 . 1 1 42 42 ASP C C 110 177.310 177.310 178.330 -1.020 18517 12479 1 11 . 1 1 42 42 ASP CA C 110 59.980 59.980 58.143 1.837 18517 12480 1 11 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.595 4.355 18517 12481 1 11 . 1 1 42 42 ASP H H 110 7.360 7.360 8.319 -0.959 18517 12482 1 11 . 1 1 43 43 THR N N 111 102.340 102.340 113.504 -11.164 18517 12483 1 11 . 1 1 43 43 THR HA H 111 5.100 5.100 4.000 1.100 18517 12484 1 11 . 1 1 43 43 THR C C 111 174.940 174.940 176.543 -1.603 18517 12485 1 11 . 1 1 43 43 THR CA C 111 60.650 60.650 65.999 -5.349 18517 12486 1 11 . 1 1 43 43 THR CB C 111 69.610 69.610 68.464 1.146 18517 12487 1 11 . 1 1 43 43 THR H H 111 6.380 6.380 7.956 -1.576 18517 12488 1 11 . 1 1 44 44 ASP N N 112 119.750 119.750 123.210 -3.460 18517 12489 1 11 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.426 -0.566 18517 12490 1 11 . 1 1 44 44 ASP C C 112 178.850 178.850 178.428 0.422 18517 12491 1 11 . 1 1 44 44 ASP CA C 112 58.230 58.230 58.321 -0.091 18517 12492 1 11 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.575 -1.175 18517 12493 1 11 . 1 1 44 44 ASP H H 112 9.050 9.050 8.500 0.550 18517 12494 1 11 . 1 1 45 45 LEU N N 113 123.910 123.910 121.569 2.341 18517 12495 1 11 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.908 -0.098 18517 12496 1 11 . 1 1 45 45 LEU C C 113 182.040 182.040 178.203 3.837 18517 12497 1 11 . 1 1 45 45 LEU CA C 113 57.320 57.320 57.758 -0.438 18517 12498 1 11 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.928 -1.178 18517 12499 1 11 . 1 1 45 45 LEU H H 113 9.710 9.710 7.645 2.065 18517 12500 1 11 . 1 1 46 46 LEU N N 114 117.640 117.640 120.714 -3.074 18517 12501 1 11 . 1 1 46 46 LEU HA H 114 4.110 4.110 3.932 0.178 18517 12502 1 11 . 1 1 46 46 LEU C C 114 179.540 179.540 178.762 0.778 18517 12503 1 11 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.877 -0.317 18517 12504 1 11 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.598 -0.128 18517 12505 1 11 . 1 1 46 46 LEU H H 114 8.270 8.270 8.223 0.047 18517 12506 1 11 . 1 1 47 47 LEU N N 115 116.520 116.520 114.525 1.995 18517 12507 1 11 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.436 -0.296 18517 12508 1 11 . 1 1 47 47 LEU C C 115 173.850 173.850 176.287 -2.437 18517 12509 1 11 . 1 1 47 47 LEU CA C 115 55.420 55.420 53.728 1.692 18517 12510 1 11 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.361 3.360 18517 12511 1 11 . 1 1 47 47 LEU H H 115 8.160 8.160 8.273 -0.113 18517 12512 1 11 . 1 1 48 48 LYS N N 116 114.710 114.710 117.657 -2.947 18517 12513 1 11 . 1 1 48 48 LYS HA H 116 3.810 3.810 4.064 -0.254 18517 12514 1 11 . 1 1 48 48 LYS C C 116 176.510 176.510 175.677 0.833 18517 12515 1 11 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.851 0.349 18517 12516 1 11 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.489 -0.469 18517 12517 1 11 . 1 1 48 48 LYS H H 116 7.580 7.580 7.830 -0.250 18517 12518 1 11 . 1 1 49 49 VAL N N 117 119.050 119.050 118.605 0.445 18517 12519 1 11 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.177 -0.567 18517 12520 1 11 . 1 1 49 49 VAL C C 117 175.860 175.860 176.159 -0.299 18517 12521 1 11 . 1 1 49 49 VAL CA C 117 63.510 63.510 60.250 3.260 18517 12522 1 11 . 1 1 49 49 VAL CB C 117 32.350 32.350 33.072 -0.722 18517 12523 1 11 . 1 1 49 49 VAL H H 117 7.980 7.980 7.918 0.062 18517 12524 1 11 . 1 1 50 50 ASP N N 118 126.900 126.900 123.567 3.333 18517 12525 1 11 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.340 -0.090 18517 12526 1 11 . 1 1 50 50 ASP C C 118 177.700 177.700 177.550 0.150 18517 12527 1 11 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.353 0.697 18517 12528 1 11 . 1 1 50 50 ASP CB C 118 42.580 42.580 40.563 2.017 18517 12529 1 11 . 1 1 50 50 ASP H H 118 8.930 8.930 8.793 0.137 18517 12530 1 11 . 1 1 51 51 SER N N 119 124.790 124.790 117.887 6.903 18517 12531 1 11 . 1 1 51 51 SER HA H 119 4.070 4.070 4.102 -0.032 18517 12532 1 11 . 1 1 51 51 SER C C 119 177.220 177.220 176.514 0.706 18517 12533 1 11 . 1 1 51 51 SER CA C 119 61.640 61.640 62.435 -0.795 18517 12534 1 11 . 1 1 51 51 SER CB C 119 63.510 63.510 63.359 0.151 18517 12535 1 11 . 1 1 51 51 SER H H 119 8.560 8.560 8.776 -0.216 18517 12536 1 11 . 1 1 52 52 THR N N 120 119.880 119.880 116.762 3.118 18517 12537 1 11 . 1 1 52 52 THR HA H 120 4.190 4.190 4.282 -0.092 18517 12538 1 11 . 1 1 52 52 THR C C 120 177.120 177.120 176.496 0.624 18517 12539 1 11 . 1 1 52 52 THR CA C 120 66.280 66.280 65.438 0.842 18517 12540 1 11 . 1 1 52 52 THR CB C 120 68.420 68.420 68.870 -0.450 18517 12541 1 11 . 1 1 52 52 THR H H 120 8.310 8.310 8.126 0.184 18517 12542 1 11 . 1 1 53 53 LYS N N 121 122.270 122.270 122.660 -0.390 18517 12543 1 11 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.153 -0.033 18517 12544 1 11 . 1 1 53 53 LYS C C 121 178.970 178.970 178.618 0.352 18517 12545 1 11 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.475 0.105 18517 12546 1 11 . 1 1 53 53 LYS CB C 121 34.250 34.250 32.312 1.938 18517 12547 1 11 . 1 1 53 53 LYS H H 121 7.700 7.700 7.999 -0.299 18517 12548 1 11 . 1 1 54 54 VAL N N 122 120.070 120.070 119.412 0.658 18517 12549 1 11 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.930 -0.500 18517 12550 1 11 . 1 1 54 54 VAL C C 122 179.860 179.860 177.613 2.247 18517 12551 1 11 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.532 3.048 18517 12552 1 11 . 1 1 54 54 VAL CB C 122 32.820 32.820 32.015 0.805 18517 12553 1 11 . 1 1 54 54 VAL H H 122 7.890 7.890 8.206 -0.316 18517 12554 1 11 . 1 1 55 55 ASP N N 123 122.270 122.270 120.692 1.578 18517 12555 1 11 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.361 0.109 18517 12556 1 11 . 1 1 55 55 ASP C C 123 178.630 178.630 178.283 0.347 18517 12557 1 11 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.955 -0.155 18517 12558 1 11 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.959 1.061 18517 12559 1 11 . 1 1 55 55 ASP H H 123 8.270 8.270 8.075 0.195 18517 12560 1 11 . 1 1 56 56 GLU N N 124 119.600 119.600 119.381 0.219 18517 12561 1 11 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.035 -0.065 18517 12562 1 11 . 1 1 56 56 GLU C C 124 179.920 179.920 179.048 0.872 18517 12563 1 11 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.310 0.750 18517 12564 1 11 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.673 0.297 18517 12565 1 11 . 1 1 56 56 GLU H H 124 8.610 8.610 8.416 0.194 18517 12566 1 11 . 1 1 57 57 ALA N N 125 120.070 120.070 121.101 -1.031 18517 12567 1 11 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.120 -0.290 18517 12568 1 11 . 1 1 57 57 ALA C C 125 178.760 178.760 179.314 -0.554 18517 12569 1 11 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.797 0.583 18517 12570 1 11 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.433 1.706 18517 12571 1 11 . 1 1 57 57 ALA H H 125 8.420 8.420 8.287 0.133 18517 12572 1 11 . 1 1 58 58 GLY N N 126 106.740 106.740 107.101 -0.361 18517 12573 1 11 . 1 1 58 58 GLY C C 126 175.740 175.740 175.947 -0.207 18517 12574 1 11 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.908 0.382 18517 12575 1 11 . 1 1 58 58 GLY H H 126 8.200 8.200 8.247 -0.047 18517 12576 1 11 . 1 1 59 59 LYS N N 127 120.920 120.920 121.975 -1.055 18517 12577 1 11 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.048 -0.118 18517 12578 1 11 . 1 1 59 59 LYS C C 127 180.320 180.320 178.928 1.392 18517 12579 1 11 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.511 0.699 18517 12580 1 11 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.444 0.536 18517 12581 1 11 . 1 1 59 59 LYS H H 127 8.000 8.000 8.361 -0.361 18517 12582 1 11 . 1 1 60 60 LYS N N 128 118.400 118.400 119.301 -0.901 18517 12583 1 11 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.139 0.031 18517 12584 1 11 . 1 1 60 60 LYS C C 128 180.030 180.030 179.029 1.001 18517 12585 1 11 . 1 1 60 60 LYS CA C 128 58.750 58.750 58.914 -0.164 18517 12586 1 11 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.042 0.228 18517 12587 1 11 . 1 1 60 60 LYS H H 128 7.170 7.170 7.831 -0.661 18517 12588 1 11 . 1 1 61 61 VAL N N 129 121.050 121.050 120.362 0.688 18517 12589 1 11 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.346 -0.066 18517 12590 1 11 . 1 1 61 61 VAL C C 129 177.120 177.120 177.705 -0.585 18517 12591 1 11 . 1 1 61 61 VAL CA C 129 67.350 67.350 67.135 0.215 18517 12592 1 11 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.289 0.341 18517 12593 1 11 . 1 1 61 61 VAL H H 129 7.980 7.980 8.062 -0.082 18517 12594 1 11 . 1 1 62 62 LYS N N 130 120.040 120.040 120.157 -0.117 18517 12595 1 11 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.923 -0.223 18517 12596 1 11 . 1 1 62 62 LYS C C 130 178.550 178.550 178.690 -0.140 18517 12597 1 11 . 1 1 62 62 LYS CA C 130 60.330 60.330 59.957 0.373 18517 12598 1 11 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.299 1.471 18517 12599 1 11 . 1 1 62 62 LYS H H 130 8.910 8.910 8.605 0.305 18517 12600 1 11 . 1 1 63 63 ALA N N 131 119.570 119.570 122.400 -2.830 18517 12601 1 11 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.042 0.178 18517 12602 1 11 . 1 1 63 63 ALA C C 131 180.520 180.520 179.346 1.174 18517 12603 1 11 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.162 0.058 18517 12604 1 11 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.154 0.316 18517 12605 1 11 . 1 1 63 63 ALA H H 131 7.920 7.920 7.980 -0.060 18517 12606 1 11 . 1 1 64 64 TYR N N 132 120.510 120.510 120.452 0.058 18517 12607 1 11 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.185 0.275 18517 12608 1 11 . 1 1 64 64 TYR C C 132 176.510 176.510 177.889 -1.379 18517 12609 1 11 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.845 -0.205 18517 12610 1 11 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.786 -0.096 18517 12611 1 11 . 1 1 64 64 TYR H H 132 7.930 7.930 8.139 -0.209 18517 12612 1 11 . 1 1 65 65 LEU N N 133 117.290 117.290 119.763 -2.473 18517 12613 1 11 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.717 0.123 18517 12614 1 11 . 1 1 65 65 LEU C C 133 178.610 178.610 178.734 -0.124 18517 12615 1 11 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.129 -0.409 18517 12616 1 11 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.909 -1.479 18517 12617 1 11 . 1 1 65 65 LEU H H 133 8.240 8.240 8.838 -0.598 18517 12618 1 11 . 1 1 66 66 GLU N N 134 119.140 119.140 118.128 1.012 18517 12619 1 11 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.250 -0.390 18517 12620 1 11 . 1 1 66 66 GLU C C 134 180.200 180.200 178.785 1.415 18517 12621 1 11 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.431 1.508 18517 12622 1 11 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.481 0.329 18517 12623 1 11 . 1 1 66 66 GLU H H 134 8.370 8.370 8.612 -0.242 18517 12624 1 11 . 1 1 67 67 LYS N N 135 121.390 121.390 120.710 0.680 18517 12625 1 11 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.085 -0.085 18517 12626 1 11 . 1 1 67 67 LYS C C 135 179.080 179.080 178.385 0.695 18517 12627 1 11 . 1 1 67 67 LYS CA C 135 59.620 59.620 59.020 0.600 18517 12628 1 11 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.504 -0.234 18517 12629 1 11 . 1 1 67 67 LYS H H 135 7.820 7.820 7.677 0.143 18517 12630 1 11 . 1 1 68 68 ILE N N 136 110.310 110.310 111.915 -1.605 18517 12631 1 11 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.380 -0.080 18517 12632 1 11 . 1 1 68 68 ILE C C 136 175.520 175.520 176.232 -0.712 18517 12633 1 11 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.901 0.529 18517 12634 1 11 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.862 -0.882 18517 12635 1 11 . 1 1 68 68 ILE H H 136 7.380 7.380 7.519 -0.139 18517 12636 1 11 . 1 1 69 69 GLY N N 137 106.680 106.680 107.711 -1.031 18517 12637 1 11 . 1 1 69 69 GLY C C 137 174.160 174.160 173.795 0.365 18517 12638 1 11 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.479 0.991 18517 12639 1 11 . 1 1 69 69 GLY H H 137 7.470 7.470 7.741 -0.271 18517 12640 1 11 . 1 1 70 70 ILE N N 138 124.310 124.310 121.296 3.014 18517 12641 1 11 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.387 -0.187 18517 12642 1 11 . 1 1 70 70 ILE C C 138 174.190 174.190 174.417 -0.227 18517 12643 1 11 . 1 1 70 70 ILE CA C 138 59.380 59.380 59.646 -0.266 18517 12644 1 11 . 1 1 70 70 ILE CB C 138 37.340 37.340 38.598 -1.258 18517 12645 1 11 . 1 1 70 70 ILE H H 138 8.530 8.530 8.136 0.394 18517 12646 1 11 . 1 1 71 71 ARG N N 139 125.490 125.490 125.684 -0.194 18517 12647 1 11 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.798 -0.178 18517 12648 1 11 . 1 1 71 71 ARG C C 139 175.750 175.750 173.772 1.978 18517 12649 1 11 . 1 1 71 71 ARG CA C 139 54.660 54.660 53.825 0.835 18517 12650 1 11 . 1 1 71 71 ARG CB C 139 33.140 33.140 33.116 0.024 18517 12651 1 11 . 1 1 71 71 ARG H H 139 8.240 8.240 7.927 0.313 18517 12652 1 11 . 1 1 72 72 GLY N N 140 104.750 104.750 105.812 -1.062 18517 12653 1 11 . 1 1 72 72 GLY C C 140 172.920 172.920 172.240 0.680 18517 12654 1 11 . 1 1 72 72 GLY CA C 140 45.430 45.430 45.061 0.369 18517 12655 1 11 . 1 1 72 72 GLY H H 140 7.900 7.900 8.437 -0.537 18517 12656 1 11 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.697 -0.187 18517 12657 1 11 . 1 1 73 73 ASP C C 141 175.060 175.060 175.576 -0.516 18517 12658 1 11 . 1 1 73 73 ASP CA C 141 56.170 56.170 55.339 0.831 18517 12659 1 11 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.018 -0.188 18517 12660 1 11 . 1 1 74 74 SER N N 142 110.240 110.240 110.362 -0.122 18517 12661 1 11 . 1 1 74 74 SER HA H 142 4.740 4.740 4.646 0.094 18517 12662 1 11 . 1 1 74 74 SER C C 142 175.110 175.110 174.291 0.819 18517 12663 1 11 . 1 1 74 74 SER CA C 142 55.700 55.700 57.329 -1.629 18517 12664 1 11 . 1 1 74 74 SER CB C 142 67.390 67.390 65.599 1.791 18517 12665 1 11 . 1 1 74 74 SER H H 142 7.560 7.560 7.368 0.192 18517 12666 1 11 . 1 1 75 75 VAL N N 143 122.950 122.950 119.017 3.933 18517 12667 1 11 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.807 -0.077 18517 12668 1 11 . 1 1 75 75 VAL C C 143 176.230 176.230 177.069 -0.839 18517 12669 1 11 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.276 1.364 18517 12670 1 11 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.280 -0.041 18517 12671 1 11 . 1 1 75 75 VAL H H 143 9.470 9.470 8.767 0.703 18517 12672 1 11 . 1 1 76 76 GLU N N 144 121.390 121.390 120.777 0.613 18517 12673 1 11 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.099 -0.459 18517 12674 1 11 . 1 1 76 76 GLU C C 144 176.880 176.880 178.471 -1.591 18517 12675 1 11 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.288 4.022 18517 12676 1 11 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.521 -0.451 18517 12677 1 11 . 1 1 76 76 GLU H H 144 9.640 9.640 8.742 0.898 18517 12678 1 11 . 1 1 77 77 ALA N N 145 118.770 118.770 122.032 -3.262 18517 12679 1 11 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.164 0.096 18517 12680 1 11 . 1 1 77 77 ALA C C 145 180.350 180.350 179.602 0.748 18517 12681 1 11 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.642 0.138 18517 12682 1 11 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.086 1.104 18517 12683 1 11 . 1 1 77 77 ALA H H 145 7.860 7.860 7.767 0.093 18517 12684 1 11 . 1 1 78 78 ALA N N 146 120.920 120.920 121.679 -0.759 18517 12685 1 11 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.065 0.075 18517 12686 1 11 . 1 1 78 78 ALA C C 146 179.150 179.150 179.467 -0.317 18517 12687 1 11 . 1 1 78 78 ALA CA C 146 55.260 55.260 54.696 0.564 18517 12688 1 11 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.421 0.369 18517 12689 1 11 . 1 1 78 78 ALA H H 146 8.110 8.110 7.882 0.228 18517 12690 1 11 . 1 1 79 79 LEU N N 147 118.810 118.810 119.155 -0.345 18517 12691 1 11 . 1 1 79 79 LEU HA H 147 3.880 3.880 3.891 -0.011 18517 12692 1 11 . 1 1 79 79 LEU C C 147 179.080 179.080 178.718 0.362 18517 12693 1 11 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.900 0.490 18517 12694 1 11 . 1 1 79 79 LEU CB C 147 42.260 42.260 41.498 0.762 18517 12695 1 11 . 1 1 79 79 LEU H H 147 8.360 8.360 8.196 0.164 18517 12696 1 11 . 1 1 80 80 ASP N N 148 121.620 121.620 118.832 2.788 18517 12697 1 11 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.239 0.281 18517 12698 1 11 . 1 1 80 80 ASP C C 148 178.800 178.800 178.075 0.725 18517 12699 1 11 . 1 1 80 80 ASP CA C 148 58.390 58.390 57.857 0.533 18517 12700 1 11 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.892 -0.141 18517 12701 1 11 . 1 1 80 80 ASP H H 148 8.770 8.770 8.386 0.384 18517 12702 1 11 . 1 1 81 81 ASN N N 149 118.630 118.630 118.732 -0.102 18517 12703 1 11 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.473 0.097 18517 12704 1 11 . 1 1 81 81 ASN C C 149 177.970 177.970 177.713 0.257 18517 12705 1 11 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.139 -0.129 18517 12706 1 11 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.482 0.128 18517 12707 1 11 . 1 1 81 81 ASN H H 149 7.960 7.960 8.007 -0.047 18517 12708 1 11 . 1 1 82 82 LEU N N 150 120.030 120.030 117.763 2.267 18517 12709 1 11 . 1 1 82 82 LEU HA H 150 4.060 4.060 4.215 -0.155 18517 12710 1 11 . 1 1 82 82 LEU C C 150 177.790 177.790 179.007 -1.217 18517 12711 1 11 . 1 1 82 82 LEU CA C 150 58.870 58.870 57.673 1.197 18517 12712 1 11 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.315 0.545 18517 12713 1 11 . 1 1 82 82 LEU H H 150 8.230 8.230 8.025 0.205 18517 12714 1 11 . 1 1 83 83 MET N N 151 115.820 115.820 120.366 -4.546 18517 12715 1 11 . 1 1 83 83 MET HA H 151 4.390 4.390 3.854 0.536 18517 12716 1 11 . 1 1 83 83 MET C C 151 179.760 179.760 178.072 1.688 18517 12717 1 11 . 1 1 83 83 MET CA C 151 57.400 57.400 58.812 -1.412 18517 12718 1 11 . 1 1 83 83 MET CB C 151 31.080 31.080 32.540 -1.460 18517 12719 1 11 . 1 1 83 83 MET H H 151 8.800 8.800 8.168 0.632 18517 12720 1 11 . 1 1 84 84 ILE N N 152 120.330 120.330 119.552 0.778 18517 12721 1 11 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.835 0.005 18517 12722 1 11 . 1 1 84 84 ILE C C 152 178.660 178.660 178.280 0.380 18517 12723 1 11 . 1 1 84 84 ILE CA C 152 65.800 65.800 64.234 1.567 18517 12724 1 11 . 1 1 84 84 ILE CB C 152 38.450 38.450 36.433 2.017 18517 12725 1 11 . 1 1 84 84 ILE H H 152 8.540 8.540 8.375 0.165 18517 12726 1 11 . 1 1 85 85 LYS N N 153 118.930 118.930 119.520 -0.590 18517 12727 1 11 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.101 0.099 18517 12728 1 11 . 1 1 85 85 LYS C C 153 179.650 179.650 179.549 0.101 18517 12729 1 11 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.532 1.448 18517 12730 1 11 . 1 1 85 85 LYS CB C 153 33.540 33.540 31.980 1.560 18517 12731 1 11 . 1 1 85 85 LYS H H 153 7.510 7.510 8.035 -0.525 18517 12732 1 11 . 1 1 86 86 VAL N N 154 119.810 119.810 120.352 -0.542 18517 12733 1 11 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.703 -0.073 18517 12734 1 11 . 1 1 86 86 VAL C C 154 178.350 178.350 177.900 0.450 18517 12735 1 11 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.363 0.867 18517 12736 1 11 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.411 1.329 18517 12737 1 11 . 1 1 86 86 VAL H H 154 8.740 8.740 8.000 0.740 18517 12738 1 11 . 1 1 87 87 TYR N N 155 118.370 118.370 118.584 -0.214 18517 12739 1 11 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.164 0.106 18517 12740 1 11 . 1 1 87 87 TYR C C 155 178.580 178.580 178.146 0.434 18517 12741 1 11 . 1 1 87 87 TYR CA C 155 62.910 62.910 59.651 3.259 18517 12742 1 11 . 1 1 87 87 TYR CB C 155 37.980 37.980 36.939 1.041 18517 12743 1 11 . 1 1 87 87 TYR H H 155 8.520 8.520 8.045 0.475 18517 12744 1 11 . 1 1 88 88 GLU N N 156 119.900 119.900 120.738 -0.838 18517 12745 1 11 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.244 -0.064 18517 12746 1 11 . 1 1 88 88 GLU C C 156 179.270 179.270 178.926 0.344 18517 12747 1 11 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.605 -0.224 18517 12748 1 11 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.565 0.645 18517 12749 1 11 . 1 1 88 88 GLU H H 156 8.250 8.250 8.490 -0.240 18517 12750 1 11 . 1 1 89 89 ILE N N 157 119.510 119.510 118.032 1.478 18517 12751 1 11 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.931 0.149 18517 12752 1 11 . 1 1 89 89 ILE C C 157 177.890 177.890 178.299 -0.409 18517 12753 1 11 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.883 -0.573 18517 12754 1 11 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.168 1.042 18517 12755 1 11 . 1 1 89 89 ILE H H 157 7.630 7.630 7.889 -0.259 18517 12756 1 11 . 1 1 90 90 THR N N 158 114.240 114.240 116.081 -1.841 18517 12757 1 11 . 1 1 90 90 THR HA H 158 4.130 4.130 4.173 -0.043 18517 12758 1 11 . 1 1 90 90 THR C C 158 175.530 175.530 175.536 -0.006 18517 12759 1 11 . 1 1 90 90 THR CA C 158 64.460 64.460 65.753 -1.293 18517 12760 1 11 . 1 1 90 90 THR CB C 158 69.610 69.610 69.250 0.360 18517 12761 1 11 . 1 1 90 90 THR H H 158 7.770 7.770 7.978 -0.208 18517 12762 1 11 . 1 1 91 91 LYS N N 159 120.280 120.280 119.096 1.184 18517 12763 1 11 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.582 -0.272 18517 12764 1 11 . 1 1 91 91 LYS C C 159 177.420 177.420 176.413 1.007 18517 12765 1 11 . 1 1 91 91 LYS CA C 159 57.400 57.400 54.784 2.616 18517 12766 1 11 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.938 -0.718 18517 12767 1 11 . 1 1 91 91 LYS H H 159 7.890 7.890 8.401 -0.511 18517 12768 1 11 . 1 1 92 92 GLY N N 160 107.910 107.910 109.199 -1.289 18517 12769 1 11 . 1 1 92 92 GLY C C 160 174.430 174.430 174.461 -0.031 18517 12770 1 11 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.236 0.744 18517 12771 1 11 . 1 1 92 92 GLY H H 160 7.930 7.930 7.773 0.157 18517 12772 1 11 . 1 1 93 93 THR N N 161 113.570 113.570 117.889 -4.319 18517 12773 1 11 . 1 1 93 93 THR HA H 161 4.390 4.390 4.256 0.134 18517 12774 1 11 . 1 1 93 93 THR C C 161 174.790 174.790 175.028 -0.238 18517 12775 1 11 . 1 1 93 93 THR CA C 161 61.960 61.960 63.495 -1.535 18517 12776 1 11 . 1 1 93 93 THR CB C 161 70.010 70.010 69.582 0.428 18517 12777 1 11 . 1 1 93 93 THR H H 161 7.970 7.970 7.562 0.408 18517 12778 1 11 . 1 1 94 94 VAL N N 162 121.980 121.980 122.073 -0.093 18517 12779 1 11 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.253 -0.133 18517 12780 1 11 . 1 1 94 94 VAL C C 162 176.300 176.300 175.525 0.775 18517 12781 1 11 . 1 1 94 94 VAL CA C 162 62.830 62.830 61.552 1.278 18517 12782 1 11 . 1 1 94 94 VAL CB C 162 33.060 33.060 33.013 0.047 18517 12783 1 11 . 1 1 94 94 VAL H H 162 8.130 8.130 8.152 -0.022 18517 12784 1 11 . 1 1 95 95 GLU N N 163 124.140 124.140 123.956 0.184 18517 12785 1 11 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.312 -0.002 18517 12786 1 11 . 1 1 95 95 GLU C C 163 176.870 176.870 175.866 1.004 18517 12787 1 11 . 1 1 95 95 GLU CA C 163 57.080 57.080 56.560 0.520 18517 12788 1 11 . 1 1 95 95 GLU CB C 163 30.440 30.440 29.498 0.942 18517 12789 1 11 . 1 1 95 95 GLU H H 163 8.490 8.490 8.496 -0.006 18517 12790 1 11 . 1 1 96 96 SER N N 164 116.800 116.800 119.550 -2.750 18517 12791 1 11 . 1 1 96 96 SER HA H 164 4.430 4.430 4.766 -0.336 18517 12792 1 11 . 1 1 96 96 SER C C 164 174.940 174.940 173.723 1.217 18517 12793 1 11 . 1 1 96 96 SER CA C 164 59.070 59.070 58.706 0.364 18517 12794 1 11 . 1 1 96 96 SER CB C 164 64.220 64.220 63.700 0.520 18517 12795 1 11 . 1 1 96 96 SER H H 164 8.300 8.300 8.792 -0.492 18517 12796 1 11 . 1 1 97 97 SER C C 165 174.660 174.660 173.084 1.576 18517 12797 1 11 . 1 1 97 97 SER CA C 165 58.870 58.870 57.226 1.644 18517 12798 1 11 . 1 1 97 97 SER CB C 165 64.060 64.060 65.076 -1.016 18517 12799 1 11 . 1 1 98 98 ALA N N 166 125.490 125.490 122.186 3.304 18517 12800 1 11 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.238 0.112 18517 12801 1 11 . 1 1 98 98 ALA C C 166 177.780 177.780 175.738 2.042 18517 12802 1 11 . 1 1 98 98 ALA CA C 166 53.000 53.000 52.721 0.279 18517 12803 1 11 . 1 1 98 98 ALA CB C 166 19.340 19.340 18.044 1.296 18517 12804 1 11 . 1 1 98 98 ALA H H 166 8.180 8.180 8.534 -0.354 18517 12805 1 11 . 1 1 99 99 GLN N N 167 118.690 118.690 125.377 -6.687 18517 12806 1 11 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.272 0.068 18517 12807 1 11 . 1 1 99 99 GLN C C 167 176.680 176.680 175.316 1.364 18517 12808 1 11 . 1 1 99 99 GLN CA C 167 56.250 56.250 55.382 0.868 18517 12809 1 11 . 1 1 99 99 GLN CB C 167 29.650 29.650 29.451 0.199 18517 12810 1 11 . 1 1 99 99 GLN H H 167 8.170 8.170 8.518 -0.348 18517 12811 1 11 . 1 1 100 100 GLY N N 168 109.670 109.670 113.471 -3.801 18517 12812 1 11 . 1 1 100 100 GLY C C 168 174.460 174.460 173.489 0.971 18517 12813 1 11 . 1 1 100 100 GLY CA C 168 45.670 45.670 44.136 1.534 18517 12814 1 11 . 1 1 100 100 GLY H H 168 8.250 8.250 7.817 0.433 18517 12815 1 11 . 1 1 101 101 THR N N 169 112.660 112.660 116.453 -3.793 18517 12816 1 11 . 1 1 101 101 THR HA H 169 4.360 4.360 4.254 0.106 18517 12817 1 11 . 1 1 101 101 THR C C 169 174.720 174.720 174.249 0.471 18517 12818 1 11 . 1 1 101 101 THR CA C 169 62.080 62.080 61.505 0.575 18517 12819 1 11 . 1 1 101 101 THR CB C 169 69.930 69.930 68.166 1.764 18517 12820 1 11 . 1 1 101 101 THR H H 169 8.070 8.070 8.355 -0.285 18517 12821 1 11 . 1 1 102 102 ASP N N 170 123.090 123.090 122.156 0.934 18517 12822 1 11 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.274 0.426 18517 12823 1 11 . 1 1 102 102 ASP C C 170 176.130 176.130 174.722 1.408 18517 12824 1 11 . 1 1 102 102 ASP CA C 170 54.780 54.780 55.621 -0.841 18517 12825 1 11 . 1 1 102 102 ASP CB C 170 42.260 42.260 40.722 1.538 18517 12826 1 11 . 1 1 102 102 ASP H H 170 8.170 8.170 8.074 0.096 18517 12827 1 11 . 1 1 103 103 SER N N 171 117.110 117.110 113.036 4.074 18517 12828 1 11 . 1 1 103 103 SER HA H 171 4.430 4.430 4.579 -0.149 18517 12829 1 11 . 1 1 103 103 SER C C 171 174.770 174.770 174.004 0.766 18517 12830 1 11 . 1 1 103 103 SER CA C 171 57.960 57.960 57.807 0.153 18517 12831 1 11 . 1 1 103 103 SER CB C 171 64.940 64.940 64.994 -0.054 18517 12832 1 11 . 1 1 103 103 SER H H 171 8.450 8.450 8.121 0.329 18517 12833 1 11 . 1 1 104 104 GLU N N 172 122.970 122.970 123.556 -0.586 18517 12834 1 11 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.955 0.075 18517 12835 1 11 . 1 1 104 104 GLU C C 172 178.860 178.860 177.631 1.229 18517 12836 1 11 . 1 1 104 104 GLU CA C 172 59.700 59.700 59.898 -0.197 18517 12837 1 11 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.823 -0.173 18517 12838 1 11 . 1 1 104 104 GLU H H 172 8.830 8.830 8.851 -0.021 18517 12839 1 11 . 1 1 105 105 GLU N N 173 119.750 119.750 119.494 0.256 18517 12840 1 11 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.037 -0.057 18517 12841 1 11 . 1 1 105 105 GLU C C 173 178.920 178.920 178.258 0.662 18517 12842 1 11 . 1 1 105 105 GLU CA C 173 60.060 60.060 59.290 0.770 18517 12843 1 11 . 1 1 105 105 GLU CB C 173 29.730 29.730 28.985 0.745 18517 12844 1 11 . 1 1 105 105 GLU H H 173 8.580 8.580 8.563 0.017 18517 12845 1 11 . 1 1 106 106 LEU N N 174 121.860 121.860 120.345 1.515 18517 12846 1 11 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.017 0.163 18517 12847 1 11 . 1 1 106 106 LEU C C 174 178.210 178.210 178.542 -0.332 18517 12848 1 11 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.855 0.025 18517 12849 1 11 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.104 0.046 18517 12850 1 11 . 1 1 106 106 LEU H H 174 7.920 7.920 7.823 0.097 18517 12851 1 11 . 1 1 107 107 LYS N N 175 118.740 118.740 119.317 -0.577 18517 12852 1 11 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.955 -0.175 18517 12853 1 11 . 1 1 107 107 LYS C C 175 178.700 178.700 179.414 -0.714 18517 12854 1 11 . 1 1 107 107 LYS CA C 175 61.170 61.170 59.630 1.540 18517 12855 1 11 . 1 1 107 107 LYS CB C 175 32.430 32.430 31.834 0.596 18517 12856 1 11 . 1 1 107 107 LYS H H 175 8.340 8.340 8.306 0.034 18517 12857 1 11 . 1 1 108 108 THR N N 176 113.820 113.820 116.206 -2.386 18517 12858 1 11 . 1 1 108 108 THR HA H 176 3.840 3.840 4.069 -0.229 18517 12859 1 11 . 1 1 108 108 THR C C 176 176.620 176.620 176.636 -0.016 18517 12860 1 11 . 1 1 108 108 THR CA C 176 66.910 66.910 66.101 0.809 18517 12861 1 11 . 1 1 108 108 THR CB C 176 69.610 69.610 68.570 1.040 18517 12862 1 11 . 1 1 108 108 THR H H 176 7.950 7.950 8.045 -0.095 18517 12863 1 11 . 1 1 109 109 LEU N N 177 124.380 124.380 123.924 0.456 18517 12864 1 11 . 1 1 109 109 LEU HA H 177 3.830 3.830 3.993 -0.163 18517 12865 1 11 . 1 1 109 109 LEU C C 177 177.790 177.790 177.883 -0.093 18517 12866 1 11 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.972 0.018 18517 12867 1 11 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.035 1.545 18517 12868 1 11 . 1 1 109 109 LEU H H 177 7.480 7.480 8.158 -0.678 18517 12869 1 11 . 1 1 110 110 LEU N N 178 117.230 117.230 118.164 -0.934 18517 12870 1 11 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.902 -0.062 18517 12871 1 11 . 1 1 110 110 LEU C C 178 179.540 179.540 179.667 -0.127 18517 12872 1 11 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.507 0.883 18517 12873 1 11 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.311 1.029 18517 12874 1 11 . 1 1 110 110 LEU H H 178 8.670 8.670 8.320 0.350 18517 12875 1 11 . 1 1 111 111 LEU N N 179 119.230 119.230 122.745 -3.515 18517 12876 1 11 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.211 -0.131 18517 12877 1 11 . 1 1 111 111 LEU C C 179 179.310 179.310 179.390 -0.080 18517 12878 1 11 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.947 0.443 18517 12879 1 11 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.787 1.233 18517 12880 1 11 . 1 1 111 111 LEU H H 179 7.940 7.940 8.392 -0.452 18517 12881 1 11 . 1 1 112 112 LYS N N 180 121.910 121.910 119.876 2.034 18517 12882 1 11 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.395 -0.205 18517 12883 1 11 . 1 1 112 112 LYS C C 180 178.740 178.740 179.511 -0.771 18517 12884 1 11 . 1 1 112 112 LYS CA C 180 59.180 59.180 58.235 0.945 18517 12885 1 11 . 1 1 112 112 LYS CB C 180 31.870 31.870 31.860 0.010 18517 12886 1 11 . 1 1 112 112 LYS H H 180 7.420 7.420 8.123 -0.703 18517 12887 1 11 . 1 1 113 113 PHE N N 181 118.220 118.220 119.901 -1.681 18517 12888 1 11 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.285 0.465 18517 12889 1 11 . 1 1 113 113 PHE C C 181 178.520 178.520 177.706 0.814 18517 12890 1 11 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.609 -3.529 18517 12891 1 11 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.446 -0.466 18517 12892 1 11 . 1 1 113 113 PHE H H 181 9.000 9.000 8.657 0.343 18517 12893 1 11 . 1 1 114 114 SER N N 182 113.300 113.300 115.357 -2.057 18517 12894 1 11 . 1 1 114 114 SER HA H 182 3.930 3.930 4.137 -0.207 18517 12895 1 11 . 1 1 114 114 SER C C 182 177.080 177.080 176.920 0.160 18517 12896 1 11 . 1 1 114 114 SER CA C 182 62.000 62.000 62.406 -0.406 18517 12897 1 11 . 1 1 114 114 SER CB C 182 63.510 63.510 62.688 0.822 18517 12898 1 11 . 1 1 114 114 SER H H 182 8.620 8.620 8.896 -0.276 18517 12899 1 11 . 1 1 115 115 GLU N N 183 121.540 121.540 123.072 -1.532 18517 12900 1 11 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.017 0.053 18517 12901 1 11 . 1 1 115 115 GLU C C 183 179.860 179.860 178.785 1.075 18517 12902 1 11 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.485 0.295 18517 12903 1 11 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.459 0.431 18517 12904 1 11 . 1 1 115 115 GLU H H 183 8.250 8.250 8.569 -0.319 18517 12905 1 11 . 1 1 116 116 ASP N N 184 121.740 121.740 120.637 1.103 18517 12906 1 11 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.411 0.099 18517 12907 1 11 . 1 1 116 116 ASP C C 184 179.570 179.570 178.334 1.236 18517 12908 1 11 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.358 0.202 18517 12909 1 11 . 1 1 116 116 ASP CB C 184 40.990 40.990 41.010 -0.019 18517 12910 1 11 . 1 1 116 116 ASP H H 184 8.840 8.840 8.273 0.567 18517 12911 1 11 . 1 1 117 117 LEU N N 185 121.420 121.420 121.750 -0.330 18517 12912 1 11 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.041 0.089 18517 12913 1 11 . 1 1 117 117 LEU C C 185 178.840 178.840 178.625 0.215 18517 12914 1 11 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.550 -0.320 18517 12915 1 11 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.624 1.026 18517 12916 1 11 . 1 1 117 117 LEU H H 185 8.350 8.350 8.509 -0.159 18517 12917 1 11 . 1 1 118 118 LYS N N 186 119.640 119.640 118.641 0.999 18517 12918 1 11 . 1 1 118 118 LYS HA H 186 4.120 4.120 4.061 0.059 18517 12919 1 11 . 1 1 118 118 LYS C C 186 178.820 178.820 179.066 -0.246 18517 12920 1 11 . 1 1 118 118 LYS CA C 186 59.740 59.740 58.966 0.774 18517 12921 1 11 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.181 0.329 18517 12922 1 11 . 1 1 118 118 LYS H H 186 8.220 8.220 8.313 -0.093 18517 12923 1 11 . 1 1 119 119 ALA N N 187 120.160 120.160 122.657 -2.497 18517 12924 1 11 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.061 0.099 18517 12925 1 11 . 1 1 119 119 ALA C C 187 180.450 180.450 179.734 0.716 18517 12926 1 11 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.310 -0.170 18517 12927 1 11 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.408 0.062 18517 12928 1 11 . 1 1 119 119 ALA H H 187 8.010 8.010 8.077 -0.067 18517 12929 1 11 . 1 1 120 120 GLU N N 188 117.930 117.930 118.097 -0.167 18517 12930 1 11 . 1 1 120 120 GLU HA H 188 4.180 4.180 4.041 0.139 18517 12931 1 11 . 1 1 120 120 GLU C C 188 178.780 178.780 179.484 -0.704 18517 12932 1 11 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.297 -0.467 18517 12933 1 11 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.198 0.771 18517 12934 1 11 . 1 1 120 120 GLU H H 188 7.640 7.640 8.429 -0.789 18517 12935 1 11 . 1 1 121 121 GLN N N 189 117.230 117.230 118.524 -1.294 18517 12936 1 11 . 1 1 121 121 GLN HA H 189 4.230 4.230 3.932 0.298 18517 12937 1 11 . 1 1 121 121 GLN C C 189 179.190 179.190 178.567 0.623 18517 12938 1 11 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.493 1.246 18517 12939 1 11 . 1 1 121 121 GLN CB C 189 29.650 29.650 29.041 0.609 18517 12940 1 11 . 1 1 121 121 GLN H H 189 8.280 8.280 8.205 0.075 18517 12941 1 11 . 1 1 122 122 GLU N N 190 118.340 118.340 120.331 -1.991 18517 12942 1 11 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.796 0.324 18517 12943 1 11 . 1 1 122 122 GLU C C 190 178.210 178.210 178.728 -0.518 18517 12944 1 11 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.645 0.105 18517 12945 1 11 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.025 0.945 18517 12946 1 11 . 1 1 122 122 GLU H H 190 8.250 8.250 8.080 0.170 18517 12947 1 11 . 1 1 123 123 LEU N N 191 118.930 118.930 120.730 -1.800 18517 12948 1 11 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.874 0.216 18517 12949 1 11 . 1 1 123 123 LEU C C 191 178.500 178.500 179.254 -0.754 18517 12950 1 11 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.020 -1.020 18517 12951 1 11 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.770 0.730 18517 12952 1 11 . 1 1 123 123 LEU H H 191 7.530 7.530 8.073 -0.543 18517 12953 1 11 . 1 1 124 124 HIS N N 192 115.650 115.650 114.795 0.855 18517 12954 1 11 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.510 0.210 18517 12955 1 11 . 1 1 124 124 HIS C C 192 176.090 176.090 177.469 -1.379 18517 12956 1 11 . 1 1 124 124 HIS CA C 192 56.690 56.690 57.638 -0.948 18517 12957 1 11 . 1 1 124 124 HIS CB C 192 30.760 30.760 29.105 1.655 18517 12958 1 11 . 1 1 124 124 HIS H H 192 7.450 7.450 8.248 -0.798 18517 12959 1 11 . 1 1 125 125 SER N N 193 115.480 115.480 118.081 -2.601 18517 12960 1 11 . 1 1 125 125 SER HA H 193 4.310 4.310 3.938 0.372 18517 12961 1 11 . 1 1 125 125 SER CA C 193 60.180 60.180 61.932 -1.752 18517 12962 1 11 . 1 1 125 125 SER CB C 193 64.060 64.060 62.177 1.883 18517 12963 1 11 . 1 1 125 125 SER H H 193 8.020 8.020 8.097 -0.077 18517 12964 1 11 . 1 1 126 126 GLU C C 194 177.410 177.410 179.294 -1.884 18517 12965 1 11 . 1 1 126 126 GLU CA C 194 57.840 57.840 59.014 -1.174 18517 12966 1 11 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.194 0.696 18517 12967 1 11 . 1 1 127 127 ALA N N 195 122.910 122.910 122.914 -0.004 18517 12968 1 11 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.082 0.108 18517 12969 1 11 . 1 1 127 127 ALA C C 195 178.610 178.610 179.449 -0.839 18517 12970 1 11 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.986 -1.196 18517 12971 1 11 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.685 0.575 18517 12972 1 11 . 1 1 127 127 ALA H H 195 8.020 8.020 7.591 0.429 18517 12973 1 11 . 1 1 128 128 LYS N N 196 117.770 117.770 115.468 2.302 18517 12974 1 11 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.469 -0.209 18517 12975 1 11 . 1 1 128 128 LYS C C 196 177.400 177.400 176.361 1.039 18517 12976 1 11 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.806 2.194 18517 12977 1 11 . 1 1 128 128 LYS CB C 196 32.740 32.740 32.771 -0.031 18517 12978 1 11 . 1 1 128 128 LYS H H 196 7.990 7.990 8.155 -0.165 18517 12979 1 11 . 1 1 129 129 GLY N N 197 109.010 109.010 109.091 -0.081 18517 12980 1 11 . 1 1 129 129 GLY C C 197 175.770 175.770 175.651 0.119 18517 12981 1 11 . 1 1 129 129 GLY CA C 197 46.100 46.100 44.997 1.103 18517 12982 1 11 . 1 1 129 129 GLY H H 197 8.220 8.220 7.707 0.513 18517 12983 1 11 . 1 1 130 130 GLY N N 198 109.150 109.150 109.711 -0.561 18517 12984 1 11 . 1 1 130 130 GLY C C 198 174.760 174.760 175.492 -0.732 18517 12985 1 11 . 1 1 130 130 GLY CA C 198 46.930 46.930 46.992 -0.062 18517 12986 1 11 . 1 1 130 130 GLY H H 198 8.210 8.210 8.796 -0.586 18517 12987 1 11 . 1 1 131 131 GLU N N 199 121.560 121.560 121.555 0.005 18517 12988 1 11 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.034 -0.014 18517 12989 1 11 . 1 1 131 131 GLU C C 199 178.500 178.500 178.298 0.202 18517 12990 1 11 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.328 0.572 18517 12991 1 11 . 1 1 131 131 GLU CB C 199 29.570 29.570 29.016 0.554 18517 12992 1 11 . 1 1 131 131 GLU H H 199 8.510 8.510 8.591 -0.080 18517 12993 1 11 . 1 1 132 132 ALA N N 200 122.390 122.390 123.111 -0.721 18517 12994 1 11 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.194 0.006 18517 12995 1 11 . 1 1 132 132 ALA C C 200 180.360 180.360 180.015 0.345 18517 12996 1 11 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.708 0.072 18517 12997 1 11 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.145 0.245 18517 12998 1 11 . 1 1 132 132 ALA H H 200 8.190 8.190 8.067 0.123 18517 12999 1 11 . 1 1 133 133 LEU N N 201 120.800 120.800 120.331 0.469 18517 13000 1 11 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.146 0.064 18517 13001 1 11 . 1 1 133 133 LEU C C 201 179.270 179.270 179.475 -0.205 18517 13002 1 11 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.543 0.137 18517 13003 1 11 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.726 0.454 18517 13004 1 11 . 1 1 133 133 LEU H H 201 7.720 7.720 8.601 -0.881 18517 13005 1 11 . 1 1 134 134 LEU N N 202 120.680 120.680 120.588 0.092 18517 13006 1 11 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.873 0.107 18517 13007 1 11 . 1 1 134 134 LEU C C 202 179.030 179.030 178.483 0.547 18517 13008 1 11 . 1 1 134 134 LEU CA C 202 58.430 58.430 58.388 0.042 18517 13009 1 11 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.406 0.214 18517 13010 1 11 . 1 1 134 134 LEU H H 202 8.470 8.470 8.565 -0.095 18517 13011 1 11 . 1 1 135 135 SER N N 203 113.290 113.290 114.683 -1.393 18517 13012 1 11 . 1 1 135 135 SER HA H 203 4.180 4.180 4.102 0.078 18517 13013 1 11 . 1 1 135 135 SER C C 203 177.300 177.300 176.899 0.401 18517 13014 1 11 . 1 1 135 135 SER CA C 203 62.080 62.080 62.739 -0.659 18517 13015 1 11 . 1 1 135 135 SER CB C 203 63.030 63.030 62.934 0.096 18517 13016 1 11 . 1 1 135 135 SER H H 203 8.210 8.210 8.404 -0.194 18517 13017 1 11 . 1 1 136 136 SER N N 204 117.500 117.500 118.295 -0.795 18517 13018 1 11 . 1 1 136 136 SER HA H 204 4.050 4.050 4.205 -0.155 18517 13019 1 11 . 1 1 136 136 SER C C 204 177.570 177.570 176.381 1.189 18517 13020 1 11 . 1 1 136 136 SER CA C 204 61.880 61.880 61.658 0.222 18517 13021 1 11 . 1 1 136 136 SER CB C 204 63.510 63.510 62.783 0.727 18517 13022 1 11 . 1 1 136 136 SER H H 204 7.730 7.730 8.340 -0.610 18517 13023 1 11 . 1 1 137 137 MET N N 205 122.500 122.500 122.948 -0.448 18517 13024 1 11 . 1 1 137 137 MET HA H 205 4.140 4.140 4.088 0.052 18517 13025 1 11 . 1 1 137 137 MET C C 205 177.680 177.680 177.920 -0.240 18517 13026 1 11 . 1 1 137 137 MET CA C 205 60.140 60.140 59.403 0.737 18517 13027 1 11 . 1 1 137 137 MET CB C 205 33.460 33.460 32.656 0.804 18517 13028 1 11 . 1 1 137 137 MET H H 205 8.170 8.170 8.670 -0.500 18517 13029 1 11 . 1 1 138 138 LYS N N 206 121.410 121.410 118.392 3.018 18517 13030 1 11 . 1 1 138 138 LYS HA H 206 3.750 3.750 4.011 -0.261 18517 13031 1 11 . 1 1 138 138 LYS C C 206 178.780 178.780 179.329 -0.549 18517 13032 1 11 . 1 1 138 138 LYS CA C 206 60.330 60.330 59.859 0.471 18517 13033 1 11 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.384 -0.114 18517 13034 1 11 . 1 1 138 138 LYS H H 206 8.810 8.810 8.413 0.397 18517 13035 1 11 . 1 1 139 139 THR N N 207 116.580 116.580 117.461 -0.881 18517 13036 1 11 . 1 1 139 139 THR HA H 207 4.060 4.060 3.962 0.098 18517 13037 1 11 . 1 1 139 139 THR C C 207 176.730 176.730 177.026 -0.296 18517 13038 1 11 . 1 1 139 139 THR CA C 207 67.150 67.150 66.805 0.345 18517 13039 1 11 . 1 1 139 139 THR CB C 207 69.220 69.220 68.724 0.496 18517 13040 1 11 . 1 1 139 139 THR H H 207 7.930 7.930 8.220 -0.290 18517 13041 1 11 . 1 1 140 140 GLN N N 208 121.390 121.390 120.503 0.887 18517 13042 1 11 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.070 -0.010 18517 13043 1 11 . 1 1 140 140 GLN C C 208 178.550 178.550 178.061 0.489 18517 13044 1 11 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.255 0.045 18517 13045 1 11 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.253 0.607 18517 13046 1 11 . 1 1 140 140 GLN H H 208 7.600 7.600 8.297 -0.697 18517 13047 1 11 . 1 1 141 141 HIS N N 209 122.360 122.360 119.140 3.220 18517 13048 1 11 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.185 -0.355 18517 13049 1 11 . 1 1 141 141 HIS C C 209 176.390 176.390 177.053 -0.663 18517 13050 1 11 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.227 1.493 18517 13051 1 11 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.151 -1.050 18517 13052 1 11 . 1 1 141 141 HIS H H 209 8.980 8.980 8.469 0.511 18517 13053 1 11 . 1 1 142 142 ASP N N 210 120.740 120.740 120.136 0.604 18517 13054 1 11 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.374 -0.024 18517 13055 1 11 . 1 1 142 142 ASP C C 210 179.490 179.490 178.209 1.281 18517 13056 1 11 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.712 0.208 18517 13057 1 11 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.862 -0.272 18517 13058 1 11 . 1 1 142 142 ASP H H 210 8.770 8.770 8.381 0.389 18517 13059 1 11 . 1 1 143 143 GLU N N 211 119.010 119.010 120.891 -1.881 18517 13060 1 11 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.008 -0.038 18517 13061 1 11 . 1 1 143 143 GLU C C 211 179.070 179.070 178.979 0.091 18517 13062 1 11 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.495 -0.195 18517 13063 1 11 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.811 -0.321 18517 13064 1 11 . 1 1 143 143 GLU H H 211 7.850 7.850 8.038 -0.188 18517 13065 1 11 . 1 1 144 144 LEU N N 212 122.500 122.500 120.030 2.470 18517 13066 1 11 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.077 -0.007 18517 13067 1 11 . 1 1 144 144 LEU C C 212 179.340 179.340 179.256 0.084 18517 13068 1 11 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.263 0.127 18517 13069 1 11 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.279 0.901 18517 13070 1 11 . 1 1 144 144 LEU H H 212 8.070 8.070 8.411 -0.341 18517 13071 1 11 . 1 1 145 145 LEU N N 213 118.110 118.110 118.205 -0.095 18517 13072 1 11 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.665 0.535 18517 13073 1 11 . 1 1 145 145 LEU C C 213 179.610 179.610 179.103 0.507 18517 13074 1 11 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.974 0.776 18517 13075 1 11 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.147 0.083 18517 13076 1 11 . 1 1 145 145 LEU H H 213 8.370 8.370 8.084 0.286 18517 13077 1 11 . 1 1 146 146 LYS N N 214 117.290 117.290 120.236 -2.946 18517 13078 1 11 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.935 -0.105 18517 13079 1 11 . 1 1 146 146 LYS C C 214 179.900 179.900 178.973 0.927 18517 13080 1 11 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.783 0.547 18517 13081 1 11 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.276 0.073 18517 13082 1 11 . 1 1 146 146 LYS H H 214 7.560 7.560 8.241 -0.681 18517 13083 1 11 . 1 1 147 147 LYS N N 215 120.330 120.330 119.446 0.884 18517 13084 1 11 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.033 -0.013 18517 13085 1 11 . 1 1 147 147 LYS C C 215 180.550 180.550 179.375 1.175 18517 13086 1 11 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.101 0.999 18517 13087 1 11 . 1 1 147 147 LYS CB C 215 32.740 32.740 31.913 0.827 18517 13088 1 11 . 1 1 147 147 LYS H H 215 7.830 7.830 8.104 -0.274 18517 13089 1 11 . 1 1 148 148 PHE N N 216 117.370 117.370 117.319 0.051 18517 13090 1 11 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.199 -0.119 18517 13091 1 11 . 1 1 148 148 PHE C C 216 178.200 178.200 177.344 0.856 18517 13092 1 11 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.167 0.953 18517 13093 1 11 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.486 1.234 18517 13094 1 11 . 1 1 148 148 PHE H H 216 8.010 8.010 8.351 -0.341 18517 13095 1 11 . 1 1 149 149 ALA N N 217 118.990 118.990 120.492 -1.502 18517 13096 1 11 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.237 -0.127 18517 13097 1 11 . 1 1 149 149 ALA C C 217 177.330 177.330 178.287 -0.957 18517 13098 1 11 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.364 0.386 18517 13099 1 11 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.520 -0.920 18517 13100 1 11 . 1 1 149 149 ALA H H 217 7.720 7.720 7.837 -0.117 18517 13101 1 11 . 1 1 150 150 ALA N N 218 118.690 118.690 120.543 -1.853 18517 13102 1 11 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.346 0.014 18517 13103 1 11 . 1 1 150 150 ALA C C 218 177.930 177.930 177.693 0.237 18517 13104 1 11 . 1 1 150 150 ALA CA C 218 52.090 52.090 53.140 -1.050 18517 13105 1 11 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.544 0.196 18517 13106 1 11 . 1 1 150 150 ALA H H 218 7.280 7.280 7.707 -0.427 18517 13107 1 11 . 1 1 151 151 LEU N N 219 119.980 119.980 121.224 -1.244 18517 13108 1 11 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.527 -0.257 18517 13109 1 11 . 1 1 151 151 LEU C C 219 176.150 176.150 175.222 0.928 18517 13110 1 11 . 1 1 151 151 LEU CA C 219 56.170 56.170 54.785 1.385 18517 13111 1 11 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.660 -0.850 18517 13112 1 11 . 1 1 151 151 LEU H H 219 7.050 7.050 7.639 -0.589 18517 13113 1 11 . 1 1 152 152 THR N N 220 112.070 112.070 117.856 -5.786 18517 13114 1 11 . 1 1 152 152 THR HA H 220 4.700 4.700 4.894 -0.194 18517 13115 1 11 . 1 1 152 152 THR C C 220 173.400 173.400 173.092 0.308 18517 13116 1 11 . 1 1 152 152 THR CA C 220 58.190 58.190 58.227 -0.037 18517 13117 1 11 . 1 1 152 152 THR CB C 220 70.960 70.960 69.240 1.720 18517 13118 1 11 . 1 1 152 152 THR H H 220 8.040 8.040 8.276 -0.236 18517 13119 1 11 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.718 -0.008 18517 13120 1 11 . 1 1 153 153 PRO C C 221 176.720 176.720 176.161 0.559 18517 13121 1 11 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.194 0.716 18517 13122 1 11 . 1 1 153 153 PRO CB C 221 34.250 34.250 33.536 0.714 18517 13123 1 11 . 1 1 154 154 THR N N 222 120.460 120.460 118.714 1.746 18517 13124 1 11 . 1 1 154 154 THR HA H 222 4.250 4.250 4.320 -0.070 18517 13125 1 11 . 1 1 154 154 THR C C 222 175.190 175.190 175.130 0.060 18517 13126 1 11 . 1 1 154 154 THR CA C 222 64.650 64.650 62.764 1.886 18517 13127 1 11 . 1 1 154 154 THR CB C 222 70.410 70.410 68.188 2.222 18517 13128 1 11 . 1 1 154 154 THR H H 222 8.530 8.530 8.409 0.121 18517 13129 1 11 . 1 1 155 155 PHE N N 223 122.260 122.260 122.687 -0.427 18517 13130 1 11 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.602 0.388 18517 13131 1 11 . 1 1 155 155 PHE C C 223 172.560 172.560 174.956 -2.396 18517 13132 1 11 . 1 1 155 155 PHE CA C 223 56.770 56.770 58.042 -1.272 18517 13133 1 11 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.056 1.534 18517 13134 1 11 . 1 1 155 155 PHE H H 223 8.950 8.950 7.666 1.284 18517 13135 1 11 . 1 1 156 156 LEU N N 224 123.440 123.440 120.445 2.995 18517 13136 1 11 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.353 0.317 18517 13137 1 11 . 1 1 156 156 LEU C C 224 175.090 175.090 177.295 -2.205 18517 13138 1 11 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.413 -0.383 18517 13139 1 11 . 1 1 156 156 LEU CB C 224 46.300 46.300 42.791 3.509 18517 13140 1 11 . 1 1 156 156 LEU H H 224 7.210 7.210 7.231 -0.021 18517 13141 1 11 . 1 1 157 157 THR N N 225 113.010 113.010 112.421 0.589 18517 13142 1 11 . 1 1 157 157 THR HA H 225 4.790 4.790 4.566 0.224 18517 13143 1 11 . 1 1 157 157 THR C C 225 176.130 176.130 175.052 1.078 18517 13144 1 11 . 1 1 157 157 THR CA C 225 59.860 59.860 61.039 -1.179 18517 13145 1 11 . 1 1 157 157 THR CB C 225 72.860 72.860 69.630 3.230 18517 13146 1 11 . 1 1 157 157 THR H H 225 9.200 9.200 8.239 0.961 18517 13147 1 11 . 1 1 158 158 SER N N 226 115.350 115.350 117.704 -2.354 18517 13148 1 11 . 1 1 158 158 SER C C 226 177.410 177.410 175.994 1.416 18517 13149 1 11 . 1 1 158 158 SER CA C 226 57.400 57.400 58.378 -0.978 18517 13150 1 11 . 1 1 158 158 SER CB C 226 66.200 66.200 63.982 2.218 18517 13151 1 11 . 1 1 158 158 SER H H 226 8.830 8.830 8.500 0.330 18517 13152 1 11 . 1 1 159 159 GLU N N 227 121.200 121.200 122.237 -1.037 18517 13153 1 11 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.872 0.148 18517 13154 1 11 . 1 1 159 159 GLU C C 227 177.680 177.680 177.385 0.295 18517 13155 1 11 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.970 0.530 18517 13156 1 11 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.485 0.085 18517 13157 1 11 . 1 1 159 159 GLU H H 227 8.320 8.320 9.021 -0.701 18517 13158 1 11 . 1 1 160 160 ASP N N 228 115.350 115.350 117.947 -2.597 18517 13159 1 11 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.376 0.174 18517 13160 1 11 . 1 1 160 160 ASP C C 228 177.640 177.640 178.450 -0.810 18517 13161 1 11 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.989 0.411 18517 13162 1 11 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.482 2.568 18517 13163 1 11 . 1 1 160 160 ASP H H 228 7.570 7.570 8.291 -0.721 18517 13164 1 11 . 1 1 161 161 ILE N N 229 108.150 108.150 115.956 -7.806 18517 13165 1 11 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.232 0.278 18517 13166 1 11 . 1 1 161 161 ILE C C 229 173.130 173.130 177.773 -4.643 18517 13167 1 11 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.790 -1.500 18517 13168 1 11 . 1 1 161 161 ILE CB C 229 39.400 39.400 38.547 0.853 18517 13169 1 11 . 1 1 161 161 ILE H H 229 7.190 7.190 7.591 -0.401 18517 13170 1 11 . 1 1 162 162 SER N N 230 115.290 115.290 117.432 -2.142 18517 13171 1 11 . 1 1 162 162 SER HA H 230 4.760 4.760 3.815 0.945 18517 13172 1 11 . 1 1 162 162 SER C C 230 176.060 176.060 174.199 1.861 18517 13173 1 11 . 1 1 162 162 SER CA C 230 57.920 57.920 57.769 0.151 18517 13174 1 11 . 1 1 162 162 SER CB C 230 66.120 66.120 62.107 4.013 18517 13175 1 11 . 1 1 162 162 SER H H 230 7.460 7.460 8.196 -0.736 18517 13176 1 11 . 1 1 163 163 GLY C C 231 173.260 173.260 173.089 0.171 18517 13177 1 11 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.902 0.648 18517 13178 1 11 . 1 1 164 164 TYR N N 232 115.290 115.290 118.403 -3.113 18517 13179 1 11 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.734 -0.035 18517 13180 1 11 . 1 1 164 164 TYR C C 232 172.820 172.820 173.893 -1.073 18517 13181 1 11 . 1 1 164 164 TYR CA C 232 55.100 55.100 54.427 0.673 18517 13182 1 11 . 1 1 164 164 TYR CB C 232 39.800 39.800 40.079 -0.279 18517 13183 1 11 . 1 1 164 164 TYR H H 232 7.370 7.370 7.234 0.136 18517 13184 1 11 . 1 1 165 165 LEU N N 233 120.980 120.980 123.101 -2.121 18517 13185 1 11 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.443 -0.013 18517 13186 1 11 . 1 1 165 165 LEU C C 233 176.360 176.360 177.401 -1.041 18517 13187 1 11 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.562 1.098 18517 13188 1 11 . 1 1 165 165 LEU CB C 233 40.430 40.430 41.256 -0.826 18517 13189 1 11 . 1 1 165 165 LEU H H 233 8.830 8.830 8.811 0.019 18517 13190 1 11 . 1 1 166 166 THR N N 234 116.170 116.170 113.400 2.770 18517 13191 1 11 . 1 1 166 166 THR HA H 234 4.010 4.010 3.576 0.434 18517 13192 1 11 . 1 1 166 166 THR C C 234 173.070 173.070 173.873 -0.803 18517 13193 1 11 . 1 1 166 166 THR CA C 234 62.910 62.910 63.717 -0.807 18517 13194 1 11 . 1 1 166 166 THR CB C 234 70.170 70.170 69.541 0.629 18517 13195 1 11 . 1 1 166 166 THR H H 234 8.050 8.050 8.183 -0.133 18517 13196 1 11 . 1 1 167 167 VAL N N 235 117.640 117.640 114.604 3.036 18517 13197 1 11 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.291 -0.081 18517 13198 1 11 . 1 1 167 167 VAL C C 235 172.330 172.330 173.733 -1.403 18517 13199 1 11 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.648 1.102 18517 13200 1 11 . 1 1 167 167 VAL CB C 235 35.880 35.880 31.130 4.750 18517 13201 1 11 . 1 1 167 167 VAL H H 235 7.160 7.160 7.428 -0.268 18517 13202 1 11 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.520 -0.330 18517 13203 1 11 . 1 1 168 168 PRO C C 236 173.710 173.710 175.687 -1.977 18517 13204 1 11 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.379 1.451 18517 13205 1 11 . 1 1 168 168 PRO CB C 236 32.270 32.270 33.255 -0.986 18517 13206 1 11 . 1 1 169 169 GLU N N 237 113.540 113.540 117.954 -4.414 18517 13207 1 11 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.041 0.339 18517 13208 1 11 . 1 1 169 169 GLU C C 237 176.690 176.690 178.015 -1.325 18517 13209 1 11 . 1 1 169 169 GLU CA C 237 53.750 53.750 54.327 -0.577 18517 13210 1 11 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.964 2.256 18517 13211 1 11 . 1 1 169 169 GLU H H 237 7.930 7.930 8.230 -0.300 18517 13212 1 11 . 1 1 170 170 TYR N N 238 119.400 119.400 118.949 0.451 18517 13213 1 11 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.396 -0.396 18517 13214 1 11 . 1 1 170 170 TYR C C 238 177.610 177.610 176.462 1.148 18517 13215 1 11 . 1 1 170 170 TYR CA C 238 62.630 62.630 59.959 2.671 18517 13216 1 11 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.416 -0.676 18517 13217 1 11 . 1 1 170 170 TYR H H 238 8.490 8.490 8.239 0.251 18517 13218 1 11 . 1 1 171 171 GLY N N 239 104.160 104.160 103.824 0.336 18517 13219 1 11 . 1 1 171 171 GLY C C 239 173.350 173.350 173.156 0.194 18517 13220 1 11 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.795 0.475 18517 13221 1 11 . 1 1 171 171 GLY H H 239 7.960 7.960 7.898 0.062 18517 13222 1 11 . 1 1 172 172 ALA N N 240 121.860 121.860 123.265 -1.405 18517 13223 1 11 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.711 -0.541 18517 13224 1 11 . 1 1 172 172 ALA C C 240 172.160 172.160 174.179 -2.019 18517 13225 1 11 . 1 1 172 172 ALA CA C 240 50.110 50.110 48.925 1.185 18517 13226 1 11 . 1 1 172 172 ALA CB C 240 20.930 20.930 20.130 0.800 18517 13227 1 11 . 1 1 172 172 ALA H H 240 6.910 6.910 7.714 -0.804 18517 13228 1 11 . 1 1 173 173 PRO HA H 241 4.550 4.550 2.907 1.643 18517 13229 1 11 . 1 1 173 173 PRO C C 241 176.610 176.610 174.584 2.026 18517 13230 1 11 . 1 1 173 173 PRO CA C 241 61.520 61.520 61.624 -0.104 18517 13231 1 11 . 1 1 173 173 PRO CB C 241 33.300 33.300 32.411 0.889 18517 13232 1 11 . 1 1 174 174 MET N N 242 114.000 114.000 117.732 -3.732 18517 13233 1 11 . 1 1 174 174 MET HA H 242 4.390 4.390 4.471 -0.081 18517 13234 1 11 . 1 1 174 174 MET C C 242 173.960 173.960 174.104 -0.144 18517 13235 1 11 . 1 1 174 174 MET CA C 242 54.660 54.660 54.121 0.539 18517 13236 1 11 . 1 1 174 174 MET CB C 242 34.170 34.170 36.028 -1.858 18517 13237 1 11 . 1 1 174 174 MET H H 242 8.040 8.040 7.359 0.681 18517 13238 1 11 . 1 1 175 175 ASN N N 243 119.570 119.570 123.659 -4.089 18517 13239 1 11 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.911 0.029 18517 13240 1 11 . 1 1 175 175 ASN C C 243 174.320 174.320 175.678 -1.358 18517 13241 1 11 . 1 1 175 175 ASN CA C 243 53.080 53.080 51.932 1.148 18517 13242 1 11 . 1 1 175 175 ASN CB C 243 38.850 38.850 37.883 0.967 18517 13243 1 11 . 1 1 175 175 ASN H H 243 7.960 7.960 8.314 -0.354 18517 13244 1 11 . 1 1 176 176 ALA N N 244 132.250 132.250 130.092 2.158 18517 13245 1 11 . 1 1 176 176 ALA C C 244 181.580 181.580 178.677 2.903 18517 13246 1 11 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.610 0.160 18517 13247 1 11 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.803 0.227 18517 13248 1 11 . 1 1 176 176 ALA H H 244 12.110 12.110 8.515 3.595 18517 13249 1 11 . 1 1 177 177 ALA N N 245 125.780 125.780 121.080 4.700 18517 13250 1 11 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.943 -0.073 18517 13251 1 11 . 1 1 177 177 ALA C C 245 180.640 180.640 179.622 1.018 18517 13252 1 11 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.409 0.251 18517 13253 1 11 . 1 1 177 177 ALA CB C 245 17.840 17.840 17.980 -0.140 18517 13254 1 11 . 1 1 177 177 ALA H H 245 10.240 10.240 8.800 1.440 18517 13255 1 11 . 1 1 178 178 LYS N N 246 119.810 119.810 119.084 0.726 18517 13256 1 11 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.061 -0.231 18517 13257 1 11 . 1 1 178 178 LYS C C 246 180.500 180.500 178.410 2.090 18517 13258 1 11 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.328 0.572 18517 13259 1 11 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.355 -1.035 18517 13260 1 11 . 1 1 178 178 LYS H H 246 8.470 8.470 7.965 0.505 18517 13261 1 11 . 1 1 179 179 TRP N N 247 121.170 121.170 121.576 -0.406 18517 13262 1 11 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.373 0.247 18517 13263 1 11 . 1 1 179 179 TRP C C 247 176.510 176.510 178.010 -1.500 18517 13264 1 11 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.686 0.134 18517 13265 1 11 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.676 -0.106 18517 13266 1 11 . 1 1 179 179 TRP H H 247 8.330 8.330 8.240 0.090 18517 13267 1 11 . 1 1 180 180 ALA N N 248 119.130 119.130 121.016 -1.886 18517 13268 1 11 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.842 0.698 18517 13269 1 11 . 1 1 180 180 ALA C C 248 182.110 182.110 179.779 2.331 18517 13270 1 11 . 1 1 180 180 ALA CA C 248 54.190 54.190 54.928 -0.738 18517 13271 1 11 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.351 0.359 18517 13272 1 11 . 1 1 180 180 ALA H H 248 7.990 7.990 8.685 -0.695 18517 13273 1 11 . 1 1 181 181 LYS N N 249 116.000 116.000 119.289 -3.289 18517 13274 1 11 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.005 -0.035 18517 13275 1 11 . 1 1 181 181 LYS C C 249 179.380 179.380 178.946 0.434 18517 13276 1 11 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.624 -0.914 18517 13277 1 11 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.562 -0.052 18517 13278 1 11 . 1 1 181 181 LYS H H 249 6.900 6.900 7.884 -0.984 18517 13279 1 11 . 1 1 182 182 VAL N N 250 122.270 122.270 116.047 6.223 18517 13280 1 11 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.784 -0.444 18517 13281 1 11 . 1 1 182 182 VAL C C 250 178.160 178.160 177.914 0.246 18517 13282 1 11 . 1 1 182 182 VAL CA C 250 66.760 66.760 65.516 1.244 18517 13283 1 11 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.458 -0.618 18517 13284 1 11 . 1 1 182 182 VAL H H 250 7.050 7.050 8.031 -0.981 18517 13285 1 11 . 1 1 183 183 GLU N N 251 120.520 120.520 120.757 -0.237 18517 13286 1 11 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.833 -0.653 18517 13287 1 11 . 1 1 183 183 GLU C C 251 179.480 179.480 179.350 0.130 18517 13288 1 11 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.362 1.327 18517 13289 1 11 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.800 -0.730 18517 13290 1 11 . 1 1 183 183 GLU H H 251 8.020 8.020 8.704 -0.684 18517 13291 1 11 . 1 1 184 184 GLY N N 252 102.930 102.930 107.969 -5.039 18517 13292 1 11 . 1 1 184 184 GLY C C 252 176.920 176.920 176.228 0.692 18517 13293 1 11 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.181 0.230 18517 13294 1 11 . 1 1 184 184 GLY H H 252 7.830 7.830 8.274 -0.444 18517 13295 1 11 . 1 1 185 185 MET N N 253 123.200 123.200 121.913 1.287 18517 13296 1 11 . 1 1 185 185 MET HA H 253 4.250 4.250 4.086 0.164 18517 13297 1 11 . 1 1 185 185 MET C C 253 179.370 179.370 178.566 0.804 18517 13298 1 11 . 1 1 185 185 MET CA C 253 59.300 59.300 59.533 -0.233 18517 13299 1 11 . 1 1 185 185 MET CB C 253 33.930 33.930 32.589 1.341 18517 13300 1 11 . 1 1 185 185 MET H H 253 7.890 7.890 7.996 -0.106 18517 13301 1 11 . 1 1 186 186 ILE N N 254 120.150 120.150 120.021 0.129 18517 13302 1 11 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.713 -0.153 18517 13303 1 11 . 1 1 186 186 ILE C C 254 177.250 177.250 177.983 -0.733 18517 13304 1 11 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.491 1.029 18517 13305 1 11 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.609 0.681 18517 13306 1 11 . 1 1 186 186 ILE H H 254 8.260 8.260 8.328 -0.068 18517 13307 1 11 . 1 1 187 187 HIS N N 255 119.810 119.810 119.741 0.069 18517 13308 1 11 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.194 -0.194 18517 13309 1 11 . 1 1 187 187 HIS C C 255 176.460 176.460 177.462 -1.002 18517 13310 1 11 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.726 0.604 18517 13311 1 11 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.419 2.211 18517 13312 1 11 . 1 1 187 187 HIS H H 255 8.900 8.900 8.774 0.126 18517 13313 1 11 . 1 1 188 188 GLY N N 256 103.160 103.160 107.189 -4.029 18517 13314 1 11 . 1 1 188 188 GLY C C 256 176.320 176.320 176.038 0.282 18517 13315 1 11 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.952 -0.062 18517 13316 1 11 . 1 1 188 188 GLY H H 256 8.030 8.030 8.431 -0.401 18517 13317 1 11 . 1 1 189 189 LYS N N 257 119.510 119.510 122.291 -2.781 18517 13318 1 11 . 1 1 189 189 LYS HA H 257 4.000 4.000 3.936 0.064 18517 13319 1 11 . 1 1 189 189 LYS C C 257 178.660 178.660 179.587 -0.927 18517 13320 1 11 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.825 -1.335 18517 13321 1 11 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.556 -0.006 18517 13322 1 11 . 1 1 189 189 LYS H H 257 7.120 7.120 7.725 -0.605 18517 13323 1 11 . 1 1 190 190 LEU N N 258 120.570 120.570 122.000 -1.430 18517 13324 1 11 . 1 1 190 190 LEU HA H 258 3.930 3.930 3.985 -0.055 18517 13325 1 11 . 1 1 190 190 LEU C C 258 177.230 177.230 176.792 0.438 18517 13326 1 11 . 1 1 190 190 LEU CA C 258 57.520 57.520 58.017 -0.497 18517 13327 1 11 . 1 1 190 190 LEU CB C 258 42.970 42.970 42.202 0.768 18517 13328 1 11 . 1 1 190 190 LEU H H 258 8.060 8.060 8.496 -0.436 18517 13329 1 11 . 1 1 191 191 GLU N N 259 114.590 114.590 113.161 1.429 18517 13330 1 11 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.336 -0.056 18517 13331 1 11 . 1 1 191 191 GLU C C 259 176.230 176.230 175.944 0.286 18517 13332 1 11 . 1 1 191 191 GLU CA C 259 55.340 55.340 55.878 -0.538 18517 13333 1 11 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.794 -0.465 18517 13334 1 11 . 1 1 191 191 GLU H H 259 7.330 7.330 7.804 -0.474 18517 13335 1 11 . 1 1 192 192 SER N N 260 115.240 115.240 116.645 -1.405 18517 13336 1 11 . 1 1 192 192 SER HA H 260 4.490 4.490 4.686 -0.196 18517 13337 1 11 . 1 1 192 192 SER C C 260 173.770 173.770 173.982 -0.212 18517 13338 1 11 . 1 1 192 192 SER CA C 260 58.350 58.350 57.846 0.504 18517 13339 1 11 . 1 1 192 192 SER CB C 260 65.090 65.090 64.013 1.077 18517 13340 1 11 . 1 1 192 192 SER H H 260 7.130 7.130 7.683 -0.553 18517 13341 1 11 . 1 1 193 193 SER C C 261 174.600 174.600 175.028 -0.428 18517 13342 1 11 . 1 1 193 193 SER CA C 261 59.980 59.980 58.336 1.644 18517 13343 1 11 . 1 1 193 193 SER CB C 261 63.750 63.750 64.180 -0.430 18517 13344 1 11 . 1 1 194 194 GLU N N 262 121.800 121.800 120.050 1.750 18517 13345 1 11 . 1 1 194 194 GLU HA H 262 4.470 4.470 3.914 0.556 18517 13346 1 11 . 1 1 194 194 GLU C C 262 174.650 174.650 175.272 -0.622 18517 13347 1 11 . 1 1 194 194 GLU CA C 262 55.620 55.620 58.745 -3.125 18517 13348 1 11 . 1 1 194 194 GLU CB C 262 30.210 30.210 28.216 1.994 18517 13349 1 11 . 1 1 194 194 GLU H H 262 7.840 7.840 8.521 -0.681 18517 13350 1 11 . 1 1 195 195 VAL N N 263 124.080 124.080 121.190 2.890 18517 13351 1 11 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.525 -0.275 18517 13352 1 11 . 1 1 195 195 VAL C C 263 174.460 174.460 173.836 0.624 18517 13353 1 11 . 1 1 195 195 VAL CA C 263 59.820 59.820 58.548 1.272 18517 13354 1 11 . 1 1 195 195 VAL CB C 263 33.620 33.620 34.145 -0.526 18517 13355 1 11 . 1 1 195 195 VAL H H 263 8.020 8.020 7.850 0.170 18517 13356 1 11 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.438 0.082 18517 13357 1 11 . 1 1 198 198 ASN C C 266 176.490 176.490 177.144 -0.654 18517 13358 1 11 . 1 1 198 198 ASN CA C 266 54.780 54.780 56.462 -1.682 18517 13359 1 11 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.382 0.678 18517 13360 1 11 . 1 1 199 199 LEU N N 267 120.680 120.680 116.904 3.776 18517 13361 1 11 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.963 0.047 18517 13362 1 11 . 1 1 199 199 LEU C C 267 178.050 178.050 178.569 -0.519 18517 13363 1 11 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.172 0.658 18517 13364 1 11 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.012 1.328 18517 13365 1 11 . 1 1 199 199 LEU H H 267 7.660 7.660 8.032 -0.372 18517 13366 1 11 . 1 1 200 200 LYS N N 268 116.740 116.740 120.130 -3.390 18517 13367 1 11 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.958 -0.228 18517 13368 1 11 . 1 1 200 200 LYS C C 268 178.520 178.520 178.385 0.135 18517 13369 1 11 . 1 1 200 200 LYS CA C 268 61.800 61.800 58.425 3.375 18517 13370 1 11 . 1 1 200 200 LYS CB C 268 32.110 32.110 31.539 0.571 18517 13371 1 11 . 1 1 200 200 LYS H H 268 8.280 8.280 7.414 0.866 18517 13372 1 11 . 1 1 201 201 ALA N N 269 121.270 121.270 122.512 -1.242 18517 13373 1 11 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.016 0.224 18517 13374 1 11 . 1 1 201 201 ALA C C 269 180.890 180.890 179.325 1.565 18517 13375 1 11 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.305 -0.125 18517 13376 1 11 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.510 -0.040 18517 13377 1 11 . 1 1 201 201 ALA H H 269 7.710 7.710 8.011 -0.301 18517 13378 1 11 . 1 1 202 202 LEU N N 270 119.980 119.980 119.338 0.642 18517 13379 1 11 . 1 1 202 202 LEU HA H 270 4.090 4.090 4.009 0.081 18517 13380 1 11 . 1 1 202 202 LEU C C 270 179.330 179.330 179.665 -0.335 18517 13381 1 11 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.734 0.336 18517 13382 1 11 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.472 0.948 18517 13383 1 11 . 1 1 202 202 LEU H H 270 7.750 7.750 8.198 -0.448 18517 13384 1 11 . 1 1 203 203 VAL N N 271 118.450 118.450 119.808 -1.358 18517 13385 1 11 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.852 -0.022 18517 13386 1 11 . 1 1 203 203 VAL C C 271 177.110 177.110 177.832 -0.722 18517 13387 1 11 . 1 1 203 203 VAL CA C 271 67.710 67.710 67.139 0.571 18517 13388 1 11 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.540 0.171 18517 13389 1 11 . 1 1 203 203 VAL H H 271 8.560 8.560 8.370 0.190 18517 13390 1 11 . 1 1 204 204 ALA N N 272 122.560 122.560 122.290 0.270 18517 13391 1 11 . 1 1 204 204 ALA HA H 272 3.880 3.880 3.953 -0.073 18517 13392 1 11 . 1 1 204 204 ALA C C 272 178.700 178.700 179.309 -0.609 18517 13393 1 11 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.655 0.475 18517 13394 1 11 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.084 0.305 18517 13395 1 11 . 1 1 204 204 ALA H H 272 8.120 8.120 8.518 -0.398 18517 13396 1 11 . 1 1 205 205 GLU N N 273 117.290 117.290 118.584 -1.294 18517 13397 1 11 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.095 -0.105 18517 13398 1 11 . 1 1 205 205 GLU C C 273 178.630 178.630 179.358 -0.728 18517 13399 1 11 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.132 1.008 18517 13400 1 11 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.647 0.323 18517 13401 1 11 . 1 1 205 205 GLU H H 273 7.670 7.670 8.171 -0.501 18517 13402 1 11 . 1 1 206 206 LEU N N 274 120.450 120.450 122.182 -1.732 18517 13403 1 11 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.161 -0.161 18517 13404 1 11 . 1 1 206 206 LEU C C 274 178.400 178.400 178.240 0.160 18517 13405 1 11 . 1 1 206 206 LEU CA C 274 58.910 58.910 57.978 0.932 18517 13406 1 11 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.881 1.649 18517 13407 1 11 . 1 1 206 206 LEU H H 274 8.420 8.420 8.314 0.106 18517 13408 1 11 . 1 1 207 207 ILE N N 275 117.580 117.580 121.359 -3.779 18517 13409 1 11 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.525 0.005 18517 13410 1 11 . 1 1 207 207 ILE C C 275 178.850 178.850 178.218 0.632 18517 13411 1 11 . 1 1 207 207 ILE CA C 275 66.080 66.080 66.363 -0.283 18517 13412 1 11 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.674 1.096 18517 13413 1 11 . 1 1 207 207 ILE H H 275 8.700 8.700 8.609 0.091 18517 13414 1 11 . 1 1 208 208 GLU N N 276 119.100 119.100 118.343 0.757 18517 13415 1 11 . 1 1 208 208 GLU HA H 276 4.000 4.000 3.992 0.008 18517 13416 1 11 . 1 1 208 208 GLU C C 276 178.540 178.540 179.116 -0.576 18517 13417 1 11 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.688 0.762 18517 13418 1 11 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.170 1.350 18517 13419 1 11 . 1 1 208 208 GLU H H 276 7.950 7.950 8.283 -0.333 18517 13420 1 11 . 1 1 209 209 LEU N N 277 120.590 120.590 121.516 -0.926 18517 13421 1 11 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.078 0.142 18517 13422 1 11 . 1 1 209 209 LEU C C 277 179.520 179.520 178.665 0.855 18517 13423 1 11 . 1 1 209 209 LEU CA C 277 58.350 58.350 58.298 0.052 18517 13424 1 11 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.546 1.744 18517 13425 1 11 . 1 1 209 209 LEU H H 277 8.550 8.550 8.242 0.308 18517 13426 1 11 . 1 1 210 210 ARG N N 278 116.470 116.470 119.183 -2.713 18517 13427 1 11 . 1 1 210 210 ARG HA H 278 3.740 3.740 3.989 -0.249 18517 13428 1 11 . 1 1 210 210 ARG C C 278 179.190 179.190 178.862 0.328 18517 13429 1 11 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.469 2.211 18517 13430 1 11 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.379 1.021 18517 13431 1 11 . 1 1 210 210 ARG H H 278 8.590 8.590 8.685 -0.095 18517 13432 1 11 . 1 1 211 211 ALA N N 279 120.470 120.470 122.252 -1.782 18517 13433 1 11 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.097 -0.187 18517 13434 1 11 . 1 1 211 211 ALA C C 279 181.350 181.350 179.598 1.752 18517 13435 1 11 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.109 0.591 18517 13436 1 11 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.525 -1.245 18517 13437 1 11 . 1 1 211 211 ALA H H 279 8.050 8.050 8.619 -0.569 18517 13438 1 11 . 1 1 212 212 GLN N N 280 120.070 120.070 118.032 2.038 18517 13439 1 11 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.937 0.083 18517 13440 1 11 . 1 1 212 212 GLN C C 280 179.490 179.490 178.652 0.838 18517 13441 1 11 . 1 1 212 212 GLN CA C 280 59.300 59.300 59.051 0.249 18517 13442 1 11 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.730 0.450 18517 13443 1 11 . 1 1 212 212 GLN H H 280 8.300 8.300 8.245 0.055 18517 13444 1 11 . 1 1 213 213 MET N N 281 119.810 119.810 118.561 1.249 18517 13445 1 11 . 1 1 213 213 MET HA H 281 3.730 3.730 4.256 -0.526 18517 13446 1 11 . 1 1 213 213 MET C C 281 177.490 177.490 178.682 -1.192 18517 13447 1 11 . 1 1 213 213 MET CA C 281 60.690 60.690 57.086 3.604 18517 13448 1 11 . 1 1 213 213 MET CB C 281 33.930 33.930 31.905 2.025 18517 13449 1 11 . 1 1 213 213 MET H H 281 8.420 8.420 8.444 -0.024 18517 13450 1 11 . 1 1 214 214 MET N N 282 114.000 114.000 118.712 -4.712 18517 13451 1 11 . 1 1 214 214 MET HA H 282 3.880 3.880 4.166 -0.286 18517 13452 1 11 . 1 1 214 214 MET C C 282 177.650 177.650 178.434 -0.784 18517 13453 1 11 . 1 1 214 214 MET CA C 282 58.670 58.670 57.496 1.174 18517 13454 1 11 . 1 1 214 214 MET CB C 282 33.300 33.300 31.500 1.800 18517 13455 1 11 . 1 1 214 214 MET H H 282 7.890 7.890 8.281 -0.391 18517 13456 1 11 . 1 1 215 215 ALA N N 283 119.970 119.970 122.773 -2.803 18517 13457 1 11 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.078 0.062 18517 13458 1 11 . 1 1 215 215 ALA C C 283 180.580 180.580 179.092 1.488 18517 13459 1 11 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.033 -0.923 18517 13460 1 11 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.163 -0.483 18517 13461 1 11 . 1 1 215 215 ALA H H 283 7.580 7.580 8.269 -0.689 18517 13462 1 11 . 1 1 216 216 LEU N N 284 120.920 120.920 118.519 2.401 18517 13463 1 11 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.102 -0.142 18517 13464 1 11 . 1 1 216 216 LEU C C 284 177.910 177.910 179.505 -1.595 18517 13465 1 11 . 1 1 216 216 LEU CA C 284 57.920 57.920 56.970 0.950 18517 13466 1 11 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.106 0.394 18517 13467 1 11 . 1 1 216 216 LEU H H 284 7.460 7.460 8.119 -0.659 18517 13468 1 11 . 1 1 217 217 LEU N N 285 116.470 116.470 119.793 -3.323 18517 13469 1 11 . 1 1 217 217 LEU HA H 285 3.680 3.680 4.171 -0.491 18517 13470 1 11 . 1 1 217 217 LEU C C 285 178.310 178.310 176.866 1.444 18517 13471 1 11 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.318 0.122 18517 13472 1 11 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.610 1.440 18517 13473 1 11 . 1 1 217 217 LEU H H 285 6.980 6.980 8.257 -1.277 18517 13474 1 11 . 1 1 218 218 TYR N N 286 111.080 111.080 114.066 -2.986 18517 13475 1 11 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.728 0.172 18517 13476 1 11 . 1 1 218 218 TYR C C 286 176.090 176.090 175.513 0.577 18517 13477 1 11 . 1 1 218 218 TYR CA C 286 56.050 56.050 56.600 -0.550 18517 13478 1 11 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.621 2.289 18517 13479 1 11 . 1 1 218 218 TYR H H 286 7.660 7.660 7.817 -0.157 18517 13480 1 11 . 1 1 219 219 GLY N N 287 108.260 108.260 109.065 -0.805 18517 13481 1 11 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.393 0.927 18517 13482 1 11 . 1 1 219 219 GLY H H 287 7.750 7.750 7.578 0.172 18517 13483 1 11 . 1 1 221 221 ILE HA H 289 3.490 3.490 4.074 -0.584 18517 13484 1 11 . 1 1 221 221 ILE CA C 289 63.580 63.580 61.514 2.066 18517 13485 1 11 . 1 1 221 221 ILE CB C 289 38.280 38.280 37.828 0.452 18517 13486 1 11 . 1 1 222 222 GLY CA C 290 45.740 45.740 45.628 0.112 18517 13487 1 12 . 1 1 2 2 LYS N N 70 126.600 126.600 124.733 1.867 18517 13488 1 12 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.781 -0.421 18517 13489 1 12 . 1 1 2 2 LYS C C 70 176.000 176.000 174.940 1.060 18517 13490 1 12 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.626 0.824 18517 13491 1 12 . 1 1 2 2 LYS CB C 70 33.850 33.850 33.446 0.404 18517 13492 1 12 . 1 1 2 2 LYS H H 70 8.530 8.530 8.296 0.234 18517 13493 1 12 . 1 1 3 3 THR N N 71 111.030 111.030 115.308 -4.278 18517 13494 1 12 . 1 1 3 3 THR HA H 71 4.400 4.400 4.397 0.003 18517 13495 1 12 . 1 1 3 3 THR C C 71 175.650 175.650 174.344 1.306 18517 13496 1 12 . 1 1 3 3 THR CA C 71 60.610 60.610 60.768 -0.158 18517 13497 1 12 . 1 1 3 3 THR CB C 71 71.520 71.520 70.066 1.454 18517 13498 1 12 . 1 1 3 3 THR H H 71 7.390 7.390 7.954 -0.564 18517 13499 1 12 . 1 1 4 4 LEU N N 72 121.560 121.560 123.658 -2.098 18517 13500 1 12 . 1 1 4 4 LEU C C 72 177.870 177.870 177.652 0.218 18517 13501 1 12 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.629 -0.149 18517 13502 1 12 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.938 0.242 18517 13503 1 12 . 1 1 4 4 LEU H H 72 8.980 8.980 8.609 0.371 18517 13504 1 12 . 1 1 5 5 ASP N N 73 115.530 115.530 117.140 -1.610 18517 13505 1 12 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.382 -0.052 18517 13506 1 12 . 1 1 5 5 ASP C C 73 179.290 179.290 178.458 0.832 18517 13507 1 12 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.449 0.391 18517 13508 1 12 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.521 0.309 18517 13509 1 12 . 1 1 5 5 ASP H H 73 8.270 8.270 8.698 -0.428 18517 13510 1 12 . 1 1 6 6 VAL N N 74 122.330 122.330 119.986 2.344 18517 13511 1 12 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.747 -0.007 18517 13512 1 12 . 1 1 6 6 VAL C C 74 178.970 178.970 178.191 0.779 18517 13513 1 12 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.654 0.706 18517 13514 1 12 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.375 0.575 18517 13515 1 12 . 1 1 6 6 VAL H H 74 7.400 7.400 7.528 -0.128 18517 13516 1 12 . 1 1 7 7 LEU N N 75 121.360 121.360 121.167 0.193 18517 13517 1 12 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.932 0.098 18517 13518 1 12 . 1 1 7 7 LEU C C 75 179.240 179.240 179.477 -0.237 18517 13519 1 12 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.469 -0.239 18517 13520 1 12 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.127 1.763 18517 13521 1 12 . 1 1 7 7 LEU H H 75 8.300 8.300 8.740 -0.440 18517 13522 1 12 . 1 1 8 8 ARG N N 76 117.230 117.230 118.674 -1.444 18517 13523 1 12 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.048 -0.128 18517 13524 1 12 . 1 1 8 8 ARG C C 76 178.290 178.290 179.147 -0.857 18517 13525 1 12 . 1 1 8 8 ARG CA C 76 60.770 60.770 58.838 1.932 18517 13526 1 12 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.234 0.976 18517 13527 1 12 . 1 1 8 8 ARG H H 76 8.520 8.520 8.616 -0.096 18517 13528 1 12 . 1 1 9 9 GLY N N 77 104.570 104.570 108.035 -3.465 18517 13529 1 12 . 1 1 9 9 GLY C C 77 176.180 176.180 176.224 -0.044 18517 13530 1 12 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.997 0.173 18517 13531 1 12 . 1 1 9 9 GLY H H 77 7.620 7.620 8.580 -0.960 18517 13532 1 12 . 1 1 10 10 GLU N N 78 120.270 120.270 122.964 -2.694 18517 13533 1 12 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.115 0.155 18517 13534 1 12 . 1 1 10 10 GLU C C 78 179.030 179.030 179.115 -0.085 18517 13535 1 12 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.074 -0.204 18517 13536 1 12 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.591 1.809 18517 13537 1 12 . 1 1 10 10 GLU H H 78 8.100 8.100 8.267 -0.167 18517 13538 1 12 . 1 1 11 11 LEU N N 79 116.000 116.000 120.875 -4.875 18517 13539 1 12 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.919 0.591 18517 13540 1 12 . 1 1 11 11 LEU C C 79 179.630 179.630 179.065 0.565 18517 13541 1 12 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.250 -1.560 18517 13542 1 12 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.390 3.410 18517 13543 1 12 . 1 1 11 11 LEU H H 79 8.230 8.230 8.479 -0.249 18517 13544 1 12 . 1 1 12 12 ARG N N 80 120.020 120.020 118.880 1.140 18517 13545 1 12 . 1 1 12 12 ARG HA H 80 3.750 3.750 4.002 -0.252 18517 13546 1 12 . 1 1 12 12 ARG C C 80 178.490 178.490 178.825 -0.335 18517 13547 1 12 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.095 2.905 18517 13548 1 12 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.289 1.951 18517 13549 1 12 . 1 1 12 12 ARG H H 80 8.210 8.210 8.814 -0.604 18517 13550 1 12 . 1 1 13 13 GLY N N 81 108.090 108.090 107.105 0.985 18517 13551 1 12 . 1 1 13 13 GLY C C 81 173.540 173.540 176.753 -3.213 18517 13552 1 12 . 1 1 13 13 GLY CA C 81 48.000 48.000 47.041 0.959 18517 13553 1 12 . 1 1 13 13 GLY H H 81 8.890 8.890 8.488 0.402 18517 13554 1 12 . 1 1 14 14 GLN C C 82 179.540 179.540 178.918 0.622 18517 13555 1 12 . 1 1 14 14 GLN CA C 82 58.710 58.710 59.029 -0.319 18517 13556 1 12 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.270 0.830 18517 13557 1 12 . 1 1 15 15 ARG N N 83 118.220 118.220 118.095 0.125 18517 13558 1 12 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.051 -0.101 18517 13559 1 12 . 1 1 15 15 ARG C C 83 177.710 177.710 178.881 -1.171 18517 13560 1 12 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.280 0.620 18517 13561 1 12 . 1 1 15 15 ARG CB C 83 29.650 29.650 29.657 -0.007 18517 13562 1 12 . 1 1 15 15 ARG H H 83 7.320 7.320 8.463 -1.143 18517 13563 1 12 . 1 1 16 16 GLU N N 84 118.810 118.810 120.919 -2.109 18517 13564 1 12 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.074 -0.224 18517 13565 1 12 . 1 1 16 16 GLU C C 84 178.750 178.750 178.831 -0.081 18517 13566 1 12 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.505 1.505 18517 13567 1 12 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.363 0.047 18517 13568 1 12 . 1 1 16 16 GLU H H 84 8.450 8.450 8.646 -0.196 18517 13569 1 12 . 1 1 17 17 ALA N N 85 122.790 122.790 122.632 0.158 18517 13570 1 12 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.208 -0.018 18517 13571 1 12 . 1 1 17 17 ALA C C 85 180.360 180.360 179.731 0.629 18517 13572 1 12 . 1 1 17 17 ALA CA C 85 55.460 55.460 54.803 0.656 18517 13573 1 12 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.465 -0.385 18517 13574 1 12 . 1 1 17 17 ALA H H 85 8.420 8.420 8.093 0.327 18517 13575 1 12 . 1 1 18 18 PHE N N 86 119.400 119.400 120.447 -1.047 18517 13576 1 12 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.479 -0.189 18517 13577 1 12 . 1 1 18 18 PHE C C 86 177.560 177.560 177.859 -0.299 18517 13578 1 12 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.827 -0.187 18517 13579 1 12 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.435 0.205 18517 13580 1 12 . 1 1 18 18 PHE H H 86 7.490 7.490 8.321 -0.831 18517 13581 1 12 . 1 1 19 19 LEU N N 87 117.470 117.470 119.664 -2.194 18517 13582 1 12 . 1 1 19 19 LEU HA H 87 4.070 4.070 3.962 0.108 18517 13583 1 12 . 1 1 19 19 LEU C C 87 178.880 178.880 178.433 0.447 18517 13584 1 12 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.467 -0.507 18517 13585 1 12 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.894 0.206 18517 13586 1 12 . 1 1 19 19 LEU H H 87 8.010 8.010 8.878 -0.868 18517 13587 1 12 . 1 1 20 20 SER N N 88 113.770 113.770 115.704 -1.934 18517 13588 1 12 . 1 1 20 20 SER HA H 88 4.070 4.070 4.050 0.020 18517 13589 1 12 . 1 1 20 20 SER C C 88 175.680 175.680 176.889 -1.209 18517 13590 1 12 . 1 1 20 20 SER CA C 88 63.070 63.070 62.611 0.459 18517 13591 1 12 . 1 1 20 20 SER H H 88 8.100 8.100 8.357 -0.257 18517 13592 1 12 . 1 1 21 21 GLU N N 89 120.570 120.570 121.505 -0.935 18517 13593 1 12 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.004 -0.034 18517 13594 1 12 . 1 1 21 21 GLU C C 89 178.940 178.940 179.014 -0.074 18517 13595 1 12 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.264 -0.004 18517 13596 1 12 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.447 -0.117 18517 13597 1 12 . 1 1 21 21 GLU H H 89 7.400 7.400 7.805 -0.405 18517 13598 1 12 . 1 1 22 22 ILE N N 90 119.350 119.350 119.324 0.026 18517 13599 1 12 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.921 -0.231 18517 13600 1 12 . 1 1 22 22 ILE C C 90 177.230 177.230 178.454 -1.224 18517 13601 1 12 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.874 0.596 18517 13602 1 12 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.605 -0.215 18517 13603 1 12 . 1 1 22 22 ILE H H 90 7.250 7.250 7.939 -0.689 18517 13604 1 12 . 1 1 23 23 ILE N N 91 116.350 116.350 120.025 -3.675 18517 13605 1 12 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.877 -0.477 18517 13606 1 12 . 1 1 23 23 ILE C C 91 176.690 176.690 176.865 -0.175 18517 13607 1 12 . 1 1 23 23 ILE CA C 91 65.730 65.730 62.595 3.135 18517 13608 1 12 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.132 0.638 18517 13609 1 12 . 1 1 23 23 ILE H H 91 7.860 7.860 8.588 -0.728 18517 13610 1 12 . 1 1 24 24 LYS N N 92 116.000 116.000 120.132 -4.132 18517 13611 1 12 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.196 -0.056 18517 13612 1 12 . 1 1 24 24 LYS C C 92 176.270 176.270 177.186 -0.916 18517 13613 1 12 . 1 1 24 24 LYS CA C 92 57.480 57.480 58.663 -1.183 18517 13614 1 12 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.723 0.577 18517 13615 1 12 . 1 1 24 24 LYS H H 92 7.170 7.170 7.984 -0.814 18517 13616 1 12 . 1 1 25 25 SER N N 93 114.650 114.650 114.512 0.138 18517 13617 1 12 . 1 1 25 25 SER HA H 93 4.550 4.550 4.532 0.018 18517 13618 1 12 . 1 1 25 25 SER C C 93 173.370 173.370 172.992 0.378 18517 13619 1 12 . 1 1 25 25 SER CA C 93 57.240 57.240 58.802 -1.562 18517 13620 1 12 . 1 1 25 25 SER CB C 93 65.650 65.650 64.691 0.959 18517 13621 1 12 . 1 1 25 25 SER H H 93 7.730 7.730 7.889 -0.159 18517 13622 1 12 . 1 1 26 26 ASP N N 94 121.230 121.230 121.884 -0.654 18517 13623 1 12 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.760 0.170 18517 13624 1 12 . 1 1 26 26 ASP C C 94 176.560 176.560 176.095 0.465 18517 13625 1 12 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.240 1.270 18517 13626 1 12 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.653 0.997 18517 13627 1 12 . 1 1 26 26 ASP H H 94 8.280 8.280 8.496 -0.216 18517 13628 1 12 . 1 1 27 27 GLY N N 95 109.310 109.310 108.706 0.604 18517 13629 1 12 . 1 1 27 27 GLY C C 95 171.080 171.080 172.039 -0.959 18517 13630 1 12 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.508 -0.738 18517 13631 1 12 . 1 1 27 27 GLY H H 95 8.160 8.160 7.678 0.482 18517 13632 1 12 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.428 0.712 18517 13633 1 12 . 1 1 29 29 PHE C C 97 175.230 175.230 175.585 -0.355 18517 13634 1 12 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.721 -0.231 18517 13635 1 12 . 1 1 29 29 PHE CB C 97 41.620 41.620 40.355 1.266 18517 13636 1 12 . 1 1 30 30 THR N N 98 112.600 112.600 113.425 -0.825 18517 13637 1 12 . 1 1 30 30 THR HA H 98 4.570 4.570 4.013 0.557 18517 13638 1 12 . 1 1 30 30 THR C C 98 176.690 176.690 174.769 1.921 18517 13639 1 12 . 1 1 30 30 THR CA C 98 60.290 60.290 59.711 0.579 18517 13640 1 12 . 1 1 30 30 THR CB C 98 71.600 71.600 70.654 0.946 18517 13641 1 12 . 1 1 30 30 THR H H 98 8.990 8.990 8.191 0.799 18517 13642 1 12 . 1 1 31 31 ILE N N 99 119.240 119.240 121.680 -2.440 18517 13643 1 12 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.758 0.062 18517 13644 1 12 . 1 1 31 31 ILE C C 99 176.090 176.090 176.937 -0.847 18517 13645 1 12 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.483 -3.343 18517 13646 1 12 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.991 -1.041 18517 13647 1 12 . 1 1 31 31 ILE H H 99 9.230 9.230 8.164 1.066 18517 13648 1 12 . 1 1 32 32 LEU N N 100 119.660 119.660 118.030 1.630 18517 13649 1 12 . 1 1 32 32 LEU HA H 100 4.030 4.030 4.132 -0.102 18517 13650 1 12 . 1 1 32 32 LEU C C 100 181.050 181.050 179.497 1.553 18517 13651 1 12 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.447 0.113 18517 13652 1 12 . 1 1 32 32 LEU CB C 100 40.120 40.120 40.307 -0.187 18517 13653 1 12 . 1 1 32 32 LEU H H 100 7.310 7.310 8.247 -0.937 18517 13654 1 12 . 1 1 33 33 GLN N N 101 121.450 121.450 119.523 1.927 18517 13655 1 12 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.386 -0.136 18517 13656 1 12 . 1 1 33 33 GLN CA C 101 59.700 59.700 58.585 1.115 18517 13657 1 12 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.428 3.362 18517 13658 1 12 . 1 1 33 33 GLN H H 101 7.790 7.790 7.621 0.169 18517 13659 1 12 . 1 1 34 34 LEU C C 102 178.590 178.590 178.819 -0.229 18517 13660 1 12 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.272 0.358 18517 13661 1 12 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.641 -0.331 18517 13662 1 12 . 1 1 35 35 VAL N N 103 118.520 118.520 115.560 2.960 18517 13663 1 12 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.764 -0.344 18517 13664 1 12 . 1 1 35 35 VAL C C 103 177.930 177.930 177.880 0.050 18517 13665 1 12 . 1 1 35 35 VAL CA C 103 66.040 66.040 65.682 0.358 18517 13666 1 12 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.125 1.505 18517 13667 1 12 . 1 1 35 35 VAL H H 103 8.670 8.670 8.280 0.390 18517 13668 1 12 . 1 1 36 36 GLY N N 104 109.430 109.430 108.415 1.015 18517 13669 1 12 . 1 1 36 36 GLY C C 104 174.600 174.600 175.299 -0.699 18517 13670 1 12 . 1 1 36 36 GLY CA C 104 48.040 48.040 46.981 1.059 18517 13671 1 12 . 1 1 36 36 GLY H H 104 7.880 7.880 8.054 -0.174 18517 13672 1 12 . 1 1 37 37 TYR N N 105 122.270 122.270 123.774 -1.504 18517 13673 1 12 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.290 -0.410 18517 13674 1 12 . 1 1 37 37 TYR C C 105 176.310 176.310 177.020 -0.710 18517 13675 1 12 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.582 3.518 18517 13676 1 12 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.827 -0.457 18517 13677 1 12 . 1 1 37 37 TYR H H 105 8.170 8.170 8.057 0.113 18517 13678 1 12 . 1 1 38 38 LEU N N 106 120.100 120.100 121.419 -1.319 18517 13679 1 12 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.822 -0.082 18517 13680 1 12 . 1 1 38 38 LEU C C 106 178.280 178.280 178.273 0.007 18517 13681 1 12 . 1 1 38 38 LEU CA C 106 58.630 58.630 57.988 0.642 18517 13682 1 12 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.665 1.065 18517 13683 1 12 . 1 1 38 38 LEU H H 106 7.610 7.610 8.203 -0.593 18517 13684 1 12 . 1 1 39 39 ARG N N 107 116.670 116.670 118.754 -2.084 18517 13685 1 12 . 1 1 39 39 ARG HA H 107 3.680 3.680 4.373 -0.693 18517 13686 1 12 . 1 1 39 39 ARG C C 107 179.480 179.480 178.560 0.920 18517 13687 1 12 . 1 1 39 39 ARG CA C 107 59.580 59.580 59.171 0.409 18517 13688 1 12 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.851 1.389 18517 13689 1 12 . 1 1 39 39 ARG H H 107 8.240 8.240 7.824 0.416 18517 13690 1 12 . 1 1 40 40 VAL N N 108 121.970 121.970 119.792 2.178 18517 13691 1 12 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.555 -0.155 18517 13692 1 12 . 1 1 40 40 VAL C C 108 178.440 178.440 178.165 0.275 18517 13693 1 12 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.938 1.012 18517 13694 1 12 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.715 -1.275 18517 13695 1 12 . 1 1 40 40 VAL H H 108 8.200 8.200 7.720 0.480 18517 13696 1 12 . 1 1 41 41 VAL N N 109 108.940 108.940 115.506 -6.566 18517 13697 1 12 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.509 0.731 18517 13698 1 12 . 1 1 41 41 VAL C C 109 175.070 175.070 176.959 -1.889 18517 13699 1 12 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.752 -3.162 18517 13700 1 12 . 1 1 41 41 VAL CB C 109 29.650 29.650 31.140 -1.490 18517 13701 1 12 . 1 1 41 41 VAL H H 109 7.760 7.760 7.777 -0.017 18517 13702 1 12 . 1 1 42 42 ASP N N 110 124.670 124.670 120.898 3.772 18517 13703 1 12 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.327 0.293 18517 13704 1 12 . 1 1 42 42 ASP C C 110 177.310 177.310 178.238 -0.928 18517 13705 1 12 . 1 1 42 42 ASP CA C 110 59.980 59.980 57.294 2.686 18517 13706 1 12 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.496 4.454 18517 13707 1 12 . 1 1 42 42 ASP H H 110 7.360 7.360 8.395 -1.035 18517 13708 1 12 . 1 1 43 43 THR N N 111 102.340 102.340 111.477 -9.137 18517 13709 1 12 . 1 1 43 43 THR HA H 111 5.100 5.100 4.007 1.093 18517 13710 1 12 . 1 1 43 43 THR C C 111 174.940 174.940 176.580 -1.640 18517 13711 1 12 . 1 1 43 43 THR CA C 111 60.650 60.650 65.775 -5.125 18517 13712 1 12 . 1 1 43 43 THR CB C 111 69.610 69.610 68.606 1.004 18517 13713 1 12 . 1 1 43 43 THR H H 111 6.380 6.380 8.021 -1.641 18517 13714 1 12 . 1 1 44 44 ASP N N 112 119.750 119.750 122.874 -3.124 18517 13715 1 12 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.358 -0.498 18517 13716 1 12 . 1 1 44 44 ASP C C 112 178.850 178.850 177.918 0.932 18517 13717 1 12 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.749 0.481 18517 13718 1 12 . 1 1 44 44 ASP CB C 112 39.400 39.400 41.041 -1.641 18517 13719 1 12 . 1 1 44 44 ASP H H 112 9.050 9.050 7.976 1.074 18517 13720 1 12 . 1 1 45 45 LEU N N 113 123.910 123.910 121.258 2.652 18517 13721 1 12 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.936 -0.126 18517 13722 1 12 . 1 1 45 45 LEU C C 113 182.040 182.040 179.059 2.981 18517 13723 1 12 . 1 1 45 45 LEU CA C 113 57.320 57.320 57.665 -0.345 18517 13724 1 12 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.738 -0.988 18517 13725 1 12 . 1 1 45 45 LEU H H 113 9.710 9.710 7.937 1.773 18517 13726 1 12 . 1 1 46 46 LEU N N 114 117.640 117.640 119.408 -1.768 18517 13727 1 12 . 1 1 46 46 LEU HA H 114 4.110 4.110 3.998 0.112 18517 13728 1 12 . 1 1 46 46 LEU C C 114 179.540 179.540 177.836 1.704 18517 13729 1 12 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.391 0.169 18517 13730 1 12 . 1 1 46 46 LEU CB C 114 41.470 41.470 42.304 -0.834 18517 13731 1 12 . 1 1 46 46 LEU H H 114 8.270 8.270 7.821 0.449 18517 13732 1 12 . 1 1 47 47 LEU N N 115 116.520 116.520 114.771 1.749 18517 13733 1 12 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.457 -0.317 18517 13734 1 12 . 1 1 47 47 LEU C C 115 173.850 173.850 176.175 -2.325 18517 13735 1 12 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.098 1.322 18517 13736 1 12 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.453 3.267 18517 13737 1 12 . 1 1 47 47 LEU H H 115 8.160 8.160 7.762 0.398 18517 13738 1 12 . 1 1 48 48 LYS N N 116 114.710 114.710 116.927 -2.217 18517 13739 1 12 . 1 1 48 48 LYS HA H 116 3.810 3.810 3.933 -0.123 18517 13740 1 12 . 1 1 48 48 LYS C C 116 176.510 176.510 175.900 0.610 18517 13741 1 12 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.833 0.367 18517 13742 1 12 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.674 -0.654 18517 13743 1 12 . 1 1 48 48 LYS H H 116 7.580 7.580 7.734 -0.154 18517 13744 1 12 . 1 1 49 49 VAL N N 117 119.050 119.050 118.653 0.397 18517 13745 1 12 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.036 -0.426 18517 13746 1 12 . 1 1 49 49 VAL C C 117 175.860 175.860 176.432 -0.572 18517 13747 1 12 . 1 1 49 49 VAL CA C 117 63.510 63.510 61.583 1.927 18517 13748 1 12 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.797 -0.447 18517 13749 1 12 . 1 1 49 49 VAL H H 117 7.980 7.980 7.899 0.081 18517 13750 1 12 . 1 1 50 50 ASP N N 118 126.900 126.900 121.563 5.337 18517 13751 1 12 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.495 -0.245 18517 13752 1 12 . 1 1 50 50 ASP C C 118 177.700 177.700 177.504 0.196 18517 13753 1 12 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.382 0.668 18517 13754 1 12 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.619 0.961 18517 13755 1 12 . 1 1 50 50 ASP H H 118 8.930 8.930 8.576 0.354 18517 13756 1 12 . 1 1 51 51 SER N N 119 124.790 124.790 123.075 1.715 18517 13757 1 12 . 1 1 51 51 SER HA H 119 4.070 4.070 4.179 -0.109 18517 13758 1 12 . 1 1 51 51 SER C C 119 177.220 177.220 175.778 1.442 18517 13759 1 12 . 1 1 51 51 SER CA C 119 61.640 61.640 61.283 0.357 18517 13760 1 12 . 1 1 51 51 SER CB C 119 63.510 63.510 63.293 0.217 18517 13761 1 12 . 1 1 51 51 SER H H 119 8.560 8.560 8.833 -0.273 18517 13762 1 12 . 1 1 52 52 THR N N 120 119.880 119.880 118.475 1.405 18517 13763 1 12 . 1 1 52 52 THR HA H 120 4.190 4.190 4.208 -0.018 18517 13764 1 12 . 1 1 52 52 THR C C 120 177.120 177.120 176.052 1.068 18517 13765 1 12 . 1 1 52 52 THR CA C 120 66.280 66.280 65.617 0.663 18517 13766 1 12 . 1 1 52 52 THR CB C 120 68.420 68.420 68.527 -0.107 18517 13767 1 12 . 1 1 52 52 THR H H 120 8.310 8.310 7.815 0.495 18517 13768 1 12 . 1 1 53 53 LYS N N 121 122.270 122.270 122.659 -0.389 18517 13769 1 12 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.134 -0.014 18517 13770 1 12 . 1 1 53 53 LYS C C 121 178.970 178.970 178.992 -0.022 18517 13771 1 12 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.067 0.513 18517 13772 1 12 . 1 1 53 53 LYS CB C 121 34.250 34.250 31.806 2.444 18517 13773 1 12 . 1 1 53 53 LYS H H 121 7.700 7.700 8.711 -1.011 18517 13774 1 12 . 1 1 54 54 VAL N N 122 120.070 120.070 120.088 -0.018 18517 13775 1 12 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.830 -0.400 18517 13776 1 12 . 1 1 54 54 VAL C C 122 179.860 179.860 177.576 2.284 18517 13777 1 12 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.751 2.829 18517 13778 1 12 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.884 0.936 18517 13779 1 12 . 1 1 54 54 VAL H H 122 7.890 7.890 8.218 -0.328 18517 13780 1 12 . 1 1 55 55 ASP N N 123 122.270 122.270 120.382 1.888 18517 13781 1 12 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.337 0.133 18517 13782 1 12 . 1 1 55 55 ASP C C 123 178.630 178.630 178.372 0.258 18517 13783 1 12 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.842 -0.042 18517 13784 1 12 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.866 1.154 18517 13785 1 12 . 1 1 55 55 ASP H H 123 8.270 8.270 8.034 0.236 18517 13786 1 12 . 1 1 56 56 GLU N N 124 119.600 119.600 119.231 0.369 18517 13787 1 12 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.032 -0.062 18517 13788 1 12 . 1 1 56 56 GLU C C 124 179.920 179.920 179.061 0.859 18517 13789 1 12 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.232 0.828 18517 13790 1 12 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.452 0.518 18517 13791 1 12 . 1 1 56 56 GLU H H 124 8.610 8.610 8.423 0.187 18517 13792 1 12 . 1 1 57 57 ALA N N 125 120.070 120.070 122.263 -2.193 18517 13793 1 12 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.035 -0.205 18517 13794 1 12 . 1 1 57 57 ALA C C 125 178.760 178.760 179.555 -0.795 18517 13795 1 12 . 1 1 57 57 ALA CA C 125 55.380 55.380 55.051 0.329 18517 13796 1 12 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.510 1.630 18517 13797 1 12 . 1 1 57 57 ALA H H 125 8.420 8.420 8.348 0.072 18517 13798 1 12 . 1 1 58 58 GLY N N 126 106.740 106.740 106.717 0.023 18517 13799 1 12 . 1 1 58 58 GLY C C 126 175.740 175.740 175.948 -0.208 18517 13800 1 12 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.827 0.463 18517 13801 1 12 . 1 1 58 58 GLY H H 126 8.200 8.200 8.403 -0.203 18517 13802 1 12 . 1 1 59 59 LYS N N 127 120.920 120.920 122.098 -1.178 18517 13803 1 12 . 1 1 59 59 LYS HA H 127 3.930 3.930 3.953 -0.023 18517 13804 1 12 . 1 1 59 59 LYS C C 127 180.320 180.320 178.700 1.620 18517 13805 1 12 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.383 0.827 18517 13806 1 12 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.344 0.636 18517 13807 1 12 . 1 1 59 59 LYS H H 127 8.000 8.000 8.305 -0.305 18517 13808 1 12 . 1 1 60 60 LYS N N 128 118.400 118.400 118.786 -0.386 18517 13809 1 12 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.130 0.040 18517 13810 1 12 . 1 1 60 60 LYS C C 128 180.030 180.030 179.037 0.993 18517 13811 1 12 . 1 1 60 60 LYS CA C 128 58.750 58.750 59.449 -0.699 18517 13812 1 12 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.517 -0.247 18517 13813 1 12 . 1 1 60 60 LYS H H 128 7.170 7.170 7.828 -0.658 18517 13814 1 12 . 1 1 61 61 VAL N N 129 121.050 121.050 120.897 0.153 18517 13815 1 12 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.281 -0.001 18517 13816 1 12 . 1 1 61 61 VAL C C 129 177.120 177.120 177.425 -0.305 18517 13817 1 12 . 1 1 61 61 VAL CA C 129 67.350 67.350 67.110 0.240 18517 13818 1 12 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.309 0.321 18517 13819 1 12 . 1 1 61 61 VAL H H 129 7.980 7.980 8.076 -0.096 18517 13820 1 12 . 1 1 62 62 LYS N N 130 120.040 120.040 120.074 -0.034 18517 13821 1 12 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.923 -0.223 18517 13822 1 12 . 1 1 62 62 LYS C C 130 178.550 178.550 178.684 -0.134 18517 13823 1 12 . 1 1 62 62 LYS CA C 130 60.330 60.330 59.995 0.335 18517 13824 1 12 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.359 1.411 18517 13825 1 12 . 1 1 62 62 LYS H H 130 8.910 8.910 8.448 0.462 18517 13826 1 12 . 1 1 63 63 ALA N N 131 119.570 119.570 122.197 -2.627 18517 13827 1 12 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.046 0.174 18517 13828 1 12 . 1 1 63 63 ALA C C 131 180.520 180.520 179.424 1.096 18517 13829 1 12 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.165 0.055 18517 13830 1 12 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.206 0.264 18517 13831 1 12 . 1 1 63 63 ALA H H 131 7.920 7.920 8.336 -0.416 18517 13832 1 12 . 1 1 64 64 TYR N N 132 120.510 120.510 120.498 0.012 18517 13833 1 12 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.194 0.267 18517 13834 1 12 . 1 1 64 64 TYR C C 132 176.510 176.510 177.783 -1.273 18517 13835 1 12 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.875 -0.235 18517 13836 1 12 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.705 -0.015 18517 13837 1 12 . 1 1 64 64 TYR H H 132 7.930 7.930 8.040 -0.110 18517 13838 1 12 . 1 1 65 65 LEU N N 133 117.290 117.290 118.928 -1.638 18517 13839 1 12 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.649 0.191 18517 13840 1 12 . 1 1 65 65 LEU C C 133 178.610 178.610 179.383 -0.773 18517 13841 1 12 . 1 1 65 65 LEU CA C 133 57.720 57.720 57.983 -0.263 18517 13842 1 12 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.542 -1.112 18517 13843 1 12 . 1 1 65 65 LEU H H 133 8.240 8.240 8.408 -0.168 18517 13844 1 12 . 1 1 66 66 GLU N N 134 119.140 119.140 119.429 -0.289 18517 13845 1 12 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.076 -0.216 18517 13846 1 12 . 1 1 66 66 GLU C C 134 180.200 180.200 178.734 1.466 18517 13847 1 12 . 1 1 66 66 GLU CA C 134 59.940 59.940 59.130 0.810 18517 13848 1 12 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.249 0.561 18517 13849 1 12 . 1 1 66 66 GLU H H 134 8.370 8.370 8.679 -0.309 18517 13850 1 12 . 1 1 67 67 LYS N N 135 121.390 121.390 118.639 2.751 18517 13851 1 12 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.057 -0.057 18517 13852 1 12 . 1 1 67 67 LYS C C 135 179.080 179.080 178.686 0.394 18517 13853 1 12 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.792 0.828 18517 13854 1 12 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.436 -0.166 18517 13855 1 12 . 1 1 67 67 LYS H H 135 7.820 7.820 7.732 0.088 18517 13856 1 12 . 1 1 68 68 ILE N N 136 110.310 110.310 111.620 -1.310 18517 13857 1 12 . 1 1 68 68 ILE HA H 136 4.300 4.300 3.984 0.316 18517 13858 1 12 . 1 1 68 68 ILE C C 136 175.520 175.520 176.675 -1.155 18517 13859 1 12 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.699 0.731 18517 13860 1 12 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.559 -0.579 18517 13861 1 12 . 1 1 68 68 ILE H H 136 7.380 7.380 7.474 -0.094 18517 13862 1 12 . 1 1 69 69 GLY N N 137 106.680 106.680 108.798 -2.118 18517 13863 1 12 . 1 1 69 69 GLY C C 137 174.160 174.160 173.684 0.476 18517 13864 1 12 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.548 0.922 18517 13865 1 12 . 1 1 69 69 GLY H H 137 7.470 7.470 8.034 -0.564 18517 13866 1 12 . 1 1 70 70 ILE N N 138 124.310 124.310 120.475 3.835 18517 13867 1 12 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.218 -0.018 18517 13868 1 12 . 1 1 70 70 ILE C C 138 174.190 174.190 175.162 -0.972 18517 13869 1 12 . 1 1 70 70 ILE CA C 138 59.380 59.380 59.174 0.206 18517 13870 1 12 . 1 1 70 70 ILE CB C 138 37.340 37.340 37.636 -0.296 18517 13871 1 12 . 1 1 70 70 ILE H H 138 8.530 8.530 8.222 0.308 18517 13872 1 12 . 1 1 71 71 ARG N N 139 125.490 125.490 127.980 -2.490 18517 13873 1 12 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.530 0.090 18517 13874 1 12 . 1 1 71 71 ARG C C 139 175.750 175.750 175.647 0.103 18517 13875 1 12 . 1 1 71 71 ARG CA C 139 54.660 54.660 54.506 0.154 18517 13876 1 12 . 1 1 71 71 ARG CB C 139 33.140 33.140 31.945 1.195 18517 13877 1 12 . 1 1 71 71 ARG H H 139 8.240 8.240 8.026 0.214 18517 13878 1 12 . 1 1 72 72 GLY N N 140 104.750 104.750 108.550 -3.800 18517 13879 1 12 . 1 1 72 72 GLY C C 140 172.920 172.920 173.107 -0.187 18517 13880 1 12 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.966 0.464 18517 13881 1 12 . 1 1 72 72 GLY H H 140 7.900 7.900 7.881 0.019 18517 13882 1 12 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.526 -0.016 18517 13883 1 12 . 1 1 73 73 ASP C C 141 175.060 175.060 176.476 -1.416 18517 13884 1 12 . 1 1 73 73 ASP CA C 141 56.170 56.170 56.002 0.168 18517 13885 1 12 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.525 -0.695 18517 13886 1 12 . 1 1 74 74 SER N N 142 110.240 110.240 111.257 -1.017 18517 13887 1 12 . 1 1 74 74 SER HA H 142 4.740 4.740 4.678 0.062 18517 13888 1 12 . 1 1 74 74 SER C C 142 175.110 175.110 175.545 -0.435 18517 13889 1 12 . 1 1 74 74 SER CA C 142 55.700 55.700 55.567 0.133 18517 13890 1 12 . 1 1 74 74 SER CB C 142 67.390 67.390 64.817 2.573 18517 13891 1 12 . 1 1 74 74 SER H H 142 7.560 7.560 7.893 -0.333 18517 13892 1 12 . 1 1 75 75 VAL N N 143 122.950 122.950 123.032 -0.082 18517 13893 1 12 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.828 -0.098 18517 13894 1 12 . 1 1 75 75 VAL C C 143 176.230 176.230 177.116 -0.886 18517 13895 1 12 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.148 1.492 18517 13896 1 12 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.702 -0.462 18517 13897 1 12 . 1 1 75 75 VAL H H 143 9.470 9.470 8.867 0.603 18517 13898 1 12 . 1 1 76 76 GLU N N 144 121.390 121.390 120.782 0.608 18517 13899 1 12 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.065 -0.425 18517 13900 1 12 . 1 1 76 76 GLU C C 144 176.880 176.880 178.317 -1.437 18517 13901 1 12 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.172 4.138 18517 13902 1 12 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.776 -0.706 18517 13903 1 12 . 1 1 76 76 GLU H H 144 9.640 9.640 7.992 1.648 18517 13904 1 12 . 1 1 77 77 ALA N N 145 118.770 118.770 122.291 -3.521 18517 13905 1 12 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.223 0.037 18517 13906 1 12 . 1 1 77 77 ALA C C 145 180.350 180.350 179.620 0.730 18517 13907 1 12 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.255 0.524 18517 13908 1 12 . 1 1 77 77 ALA CB C 145 19.190 19.190 17.969 1.221 18517 13909 1 12 . 1 1 77 77 ALA H H 145 7.860 7.860 7.347 0.513 18517 13910 1 12 . 1 1 78 78 ALA N N 146 120.920 120.920 122.815 -1.895 18517 13911 1 12 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.010 0.130 18517 13912 1 12 . 1 1 78 78 ALA C C 146 179.150 179.150 179.369 -0.219 18517 13913 1 12 . 1 1 78 78 ALA CA C 146 55.260 55.260 55.230 0.030 18517 13914 1 12 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.707 0.083 18517 13915 1 12 . 1 1 78 78 ALA H H 146 8.110 8.110 8.331 -0.221 18517 13916 1 12 . 1 1 79 79 LEU N N 147 118.810 118.810 116.324 2.486 18517 13917 1 12 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.089 -0.209 18517 13918 1 12 . 1 1 79 79 LEU C C 147 179.080 179.080 178.628 0.452 18517 13919 1 12 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.837 0.553 18517 13920 1 12 . 1 1 79 79 LEU CB C 147 42.260 42.260 41.048 1.212 18517 13921 1 12 . 1 1 79 79 LEU H H 147 8.360 8.360 8.214 0.146 18517 13922 1 12 . 1 1 80 80 ASP N N 148 121.620 121.620 120.357 1.263 18517 13923 1 12 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.257 0.263 18517 13924 1 12 . 1 1 80 80 ASP C C 148 178.800 178.800 177.951 0.849 18517 13925 1 12 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.075 0.315 18517 13926 1 12 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.991 -0.241 18517 13927 1 12 . 1 1 80 80 ASP H H 148 8.770 8.770 8.436 0.334 18517 13928 1 12 . 1 1 81 81 ASN N N 149 118.630 118.630 118.400 0.230 18517 13929 1 12 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.479 0.091 18517 13930 1 12 . 1 1 81 81 ASN C C 149 177.970 177.970 177.672 0.298 18517 13931 1 12 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.021 -0.011 18517 13932 1 12 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.425 0.185 18517 13933 1 12 . 1 1 81 81 ASN H H 149 7.960 7.960 8.204 -0.244 18517 13934 1 12 . 1 1 82 82 LEU N N 150 120.030 120.030 120.496 -0.466 18517 13935 1 12 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.839 0.221 18517 13936 1 12 . 1 1 82 82 LEU C C 150 177.790 177.790 179.011 -1.221 18517 13937 1 12 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.036 0.834 18517 13938 1 12 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.691 0.170 18517 13939 1 12 . 1 1 82 82 LEU H H 150 8.230 8.230 8.309 -0.079 18517 13940 1 12 . 1 1 83 83 MET N N 151 115.820 115.820 117.931 -2.111 18517 13941 1 12 . 1 1 83 83 MET HA H 151 4.390 4.390 3.840 0.550 18517 13942 1 12 . 1 1 83 83 MET C C 151 179.760 179.760 178.723 1.037 18517 13943 1 12 . 1 1 83 83 MET CA C 151 57.400 57.400 57.845 -0.445 18517 13944 1 12 . 1 1 83 83 MET CB C 151 31.080 31.080 31.512 -0.432 18517 13945 1 12 . 1 1 83 83 MET H H 151 8.800 8.800 8.111 0.689 18517 13946 1 12 . 1 1 84 84 ILE N N 152 120.330 120.330 120.536 -0.206 18517 13947 1 12 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.640 0.200 18517 13948 1 12 . 1 1 84 84 ILE C C 152 178.660 178.660 178.269 0.391 18517 13949 1 12 . 1 1 84 84 ILE CA C 152 65.800 65.800 65.656 0.144 18517 13950 1 12 . 1 1 84 84 ILE CB C 152 38.450 38.450 37.284 1.166 18517 13951 1 12 . 1 1 84 84 ILE H H 152 8.540 8.540 8.744 -0.204 18517 13952 1 12 . 1 1 85 85 LYS N N 153 118.930 118.930 118.932 -0.002 18517 13953 1 12 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.019 0.181 18517 13954 1 12 . 1 1 85 85 LYS C C 153 179.650 179.650 179.440 0.210 18517 13955 1 12 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.746 1.234 18517 13956 1 12 . 1 1 85 85 LYS CB C 153 33.540 33.540 31.915 1.625 18517 13957 1 12 . 1 1 85 85 LYS H H 153 7.510 7.510 8.170 -0.660 18517 13958 1 12 . 1 1 86 86 VAL N N 154 119.810 119.810 120.150 -0.340 18517 13959 1 12 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.667 -0.037 18517 13960 1 12 . 1 1 86 86 VAL C C 154 178.350 178.350 178.209 0.141 18517 13961 1 12 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.266 0.964 18517 13962 1 12 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.223 1.517 18517 13963 1 12 . 1 1 86 86 VAL H H 154 8.740 8.740 8.077 0.663 18517 13964 1 12 . 1 1 87 87 TYR N N 155 118.370 118.370 118.435 -0.065 18517 13965 1 12 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.228 0.042 18517 13966 1 12 . 1 1 87 87 TYR C C 155 178.580 178.580 178.654 -0.074 18517 13967 1 12 . 1 1 87 87 TYR CA C 155 62.910 62.910 59.995 2.915 18517 13968 1 12 . 1 1 87 87 TYR CB C 155 37.980 37.980 36.988 0.992 18517 13969 1 12 . 1 1 87 87 TYR H H 155 8.520 8.520 8.309 0.211 18517 13970 1 12 . 1 1 88 88 GLU N N 156 119.900 119.900 121.362 -1.462 18517 13971 1 12 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.115 0.065 18517 13972 1 12 . 1 1 88 88 GLU C C 156 179.270 179.270 178.596 0.674 18517 13973 1 12 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.951 -0.571 18517 13974 1 12 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.546 0.664 18517 13975 1 12 . 1 1 88 88 GLU H H 156 8.250 8.250 8.632 -0.382 18517 13976 1 12 . 1 1 89 89 ILE N N 157 119.510 119.510 117.335 2.175 18517 13977 1 12 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.938 0.142 18517 13978 1 12 . 1 1 89 89 ILE C C 157 177.890 177.890 178.455 -0.565 18517 13979 1 12 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.765 -0.455 18517 13980 1 12 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.352 0.858 18517 13981 1 12 . 1 1 89 89 ILE H H 157 7.630 7.630 7.803 -0.173 18517 13982 1 12 . 1 1 90 90 THR N N 158 114.240 114.240 115.702 -1.462 18517 13983 1 12 . 1 1 90 90 THR HA H 158 4.130 4.130 4.211 -0.081 18517 13984 1 12 . 1 1 90 90 THR C C 158 175.530 175.530 175.457 0.073 18517 13985 1 12 . 1 1 90 90 THR CA C 158 64.460 64.460 65.461 -1.001 18517 13986 1 12 . 1 1 90 90 THR CB C 158 69.610 69.610 69.160 0.450 18517 13987 1 12 . 1 1 90 90 THR H H 158 7.770 7.770 8.295 -0.525 18517 13988 1 12 . 1 1 91 91 LYS N N 159 120.280 120.280 119.506 0.774 18517 13989 1 12 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.455 -0.145 18517 13990 1 12 . 1 1 91 91 LYS C C 159 177.420 177.420 177.300 0.120 18517 13991 1 12 . 1 1 91 91 LYS CA C 159 57.400 57.400 55.042 2.358 18517 13992 1 12 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.523 -0.303 18517 13993 1 12 . 1 1 91 91 LYS H H 159 7.890 7.890 8.040 -0.150 18517 13994 1 12 . 1 1 92 92 GLY N N 160 107.910 107.910 108.959 -1.049 18517 13995 1 12 . 1 1 92 92 GLY C C 160 174.430 174.430 175.239 -0.809 18517 13996 1 12 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.420 0.560 18517 13997 1 12 . 1 1 92 92 GLY H H 160 7.930 7.930 7.849 0.081 18517 13998 1 12 . 1 1 93 93 THR N N 161 113.570 113.570 118.480 -4.910 18517 13999 1 12 . 1 1 93 93 THR HA H 161 4.390 4.390 4.422 -0.032 18517 14000 1 12 . 1 1 93 93 THR C C 161 174.790 174.790 173.536 1.254 18517 14001 1 12 . 1 1 93 93 THR CA C 161 61.960 61.960 62.541 -0.582 18517 14002 1 12 . 1 1 93 93 THR CB C 161 70.010 70.010 67.455 2.555 18517 14003 1 12 . 1 1 93 93 THR H H 161 7.970 7.970 7.750 0.220 18517 14004 1 12 . 1 1 94 94 VAL N N 162 121.980 121.980 123.783 -1.803 18517 14005 1 12 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.198 -0.078 18517 14006 1 12 . 1 1 94 94 VAL C C 162 176.300 176.300 177.026 -0.726 18517 14007 1 12 . 1 1 94 94 VAL CA C 162 62.830 62.830 61.751 1.079 18517 14008 1 12 . 1 1 94 94 VAL CB C 162 33.060 33.060 32.383 0.677 18517 14009 1 12 . 1 1 94 94 VAL H H 162 8.130 8.130 7.903 0.227 18517 14010 1 12 . 1 1 95 95 GLU N N 163 124.140 124.140 127.197 -3.057 18517 14011 1 12 . 1 1 95 95 GLU HA H 163 4.310 4.310 3.988 0.322 18517 14012 1 12 . 1 1 95 95 GLU C C 163 176.870 176.870 174.710 2.160 18517 14013 1 12 . 1 1 95 95 GLU CA C 163 57.080 57.080 57.410 -0.330 18517 14014 1 12 . 1 1 95 95 GLU CB C 163 30.440 30.440 28.438 2.002 18517 14015 1 12 . 1 1 95 95 GLU H H 163 8.490 8.490 9.134 -0.644 18517 14016 1 12 . 1 1 96 96 SER N N 164 116.800 116.800 120.277 -3.477 18517 14017 1 12 . 1 1 96 96 SER HA H 164 4.430 4.430 4.715 -0.285 18517 14018 1 12 . 1 1 96 96 SER C C 164 174.940 174.940 172.186 2.754 18517 14019 1 12 . 1 1 96 96 SER CA C 164 59.070 59.070 59.013 0.057 18517 14020 1 12 . 1 1 96 96 SER CB C 164 64.220 64.220 64.535 -0.315 18517 14021 1 12 . 1 1 96 96 SER H H 164 8.300 8.300 8.498 -0.198 18517 14022 1 12 . 1 1 97 97 SER C C 165 174.660 174.660 173.514 1.146 18517 14023 1 12 . 1 1 97 97 SER CA C 165 58.870 58.870 59.108 -0.238 18517 14024 1 12 . 1 1 97 97 SER CB C 165 64.060 64.060 64.138 -0.078 18517 14025 1 12 . 1 1 98 98 ALA N N 166 125.490 125.490 126.044 -0.554 18517 14026 1 12 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.576 -0.226 18517 14027 1 12 . 1 1 98 98 ALA C C 166 177.780 177.780 177.549 0.231 18517 14028 1 12 . 1 1 98 98 ALA CA C 166 53.000 53.000 52.922 0.078 18517 14029 1 12 . 1 1 98 98 ALA CB C 166 19.340 19.340 19.516 -0.176 18517 14030 1 12 . 1 1 98 98 ALA H H 166 8.180 8.180 8.656 -0.476 18517 14031 1 12 . 1 1 99 99 GLN N N 167 118.690 118.690 118.666 0.024 18517 14032 1 12 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.488 -0.148 18517 14033 1 12 . 1 1 99 99 GLN C C 167 176.680 176.680 175.222 1.458 18517 14034 1 12 . 1 1 99 99 GLN CA C 167 56.250 56.250 55.462 0.788 18517 14035 1 12 . 1 1 99 99 GLN CB C 167 29.650 29.650 30.898 -1.248 18517 14036 1 12 . 1 1 99 99 GLN H H 167 8.170 8.170 7.587 0.583 18517 14037 1 12 . 1 1 100 100 GLY N N 168 109.670 109.670 112.106 -2.436 18517 14038 1 12 . 1 1 100 100 GLY C C 168 174.460 174.460 174.746 -0.286 18517 14039 1 12 . 1 1 100 100 GLY CA C 168 45.670 45.670 45.334 0.336 18517 14040 1 12 . 1 1 100 100 GLY H H 168 8.250 8.250 8.732 -0.482 18517 14041 1 12 . 1 1 101 101 THR N N 169 112.660 112.660 112.834 -0.174 18517 14042 1 12 . 1 1 101 101 THR HA H 169 4.360 4.360 4.361 -0.001 18517 14043 1 12 . 1 1 101 101 THR C C 169 174.720 174.720 173.547 1.173 18517 14044 1 12 . 1 1 101 101 THR CA C 169 62.080 62.080 60.579 1.501 18517 14045 1 12 . 1 1 101 101 THR CB C 169 69.930 69.930 69.564 0.366 18517 14046 1 12 . 1 1 101 101 THR H H 169 8.070 8.070 8.094 -0.024 18517 14047 1 12 . 1 1 102 102 ASP N N 170 123.090 123.090 120.697 2.393 18517 14048 1 12 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.681 0.019 18517 14049 1 12 . 1 1 102 102 ASP C C 170 176.130 176.130 175.224 0.906 18517 14050 1 12 . 1 1 102 102 ASP CA C 170 54.780 54.780 53.011 1.769 18517 14051 1 12 . 1 1 102 102 ASP CB C 170 42.260 42.260 41.520 0.740 18517 14052 1 12 . 1 1 102 102 ASP H H 170 8.170 8.170 7.825 0.345 18517 14053 1 12 . 1 1 103 103 SER N N 171 117.110 117.110 115.744 1.366 18517 14054 1 12 . 1 1 103 103 SER HA H 171 4.430 4.430 4.667 -0.237 18517 14055 1 12 . 1 1 103 103 SER C C 171 174.770 174.770 175.056 -0.286 18517 14056 1 12 . 1 1 103 103 SER CA C 171 57.960 57.960 56.545 1.415 18517 14057 1 12 . 1 1 103 103 SER CB C 171 64.940 64.940 65.576 -0.636 18517 14058 1 12 . 1 1 103 103 SER H H 171 8.450 8.450 8.039 0.411 18517 14059 1 12 . 1 1 104 104 GLU N N 172 122.970 122.970 120.867 2.103 18517 14060 1 12 . 1 1 104 104 GLU HA H 172 4.030 4.030 4.017 0.013 18517 14061 1 12 . 1 1 104 104 GLU C C 172 178.860 178.860 178.286 0.574 18517 14062 1 12 . 1 1 104 104 GLU CA C 172 59.700 59.700 59.618 0.082 18517 14063 1 12 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.477 0.173 18517 14064 1 12 . 1 1 104 104 GLU H H 172 8.830 8.830 8.973 -0.143 18517 14065 1 12 . 1 1 105 105 GLU N N 173 119.750 119.750 119.320 0.430 18517 14066 1 12 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.041 -0.061 18517 14067 1 12 . 1 1 105 105 GLU C C 173 178.920 178.920 179.007 -0.087 18517 14068 1 12 . 1 1 105 105 GLU CA C 173 60.060 60.060 58.940 1.120 18517 14069 1 12 . 1 1 105 105 GLU CB C 173 29.730 29.730 29.306 0.424 18517 14070 1 12 . 1 1 105 105 GLU H H 173 8.580 8.580 7.862 0.718 18517 14071 1 12 . 1 1 106 106 LEU N N 174 121.860 121.860 119.647 2.213 18517 14072 1 12 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.099 0.081 18517 14073 1 12 . 1 1 106 106 LEU C C 174 178.210 178.210 178.911 -0.701 18517 14074 1 12 . 1 1 106 106 LEU CA C 174 57.880 57.880 56.977 0.903 18517 14075 1 12 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.032 0.118 18517 14076 1 12 . 1 1 106 106 LEU H H 174 7.920 7.920 7.465 0.455 18517 14077 1 12 . 1 1 107 107 LYS N N 175 118.740 118.740 120.281 -1.541 18517 14078 1 12 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.892 -0.112 18517 14079 1 12 . 1 1 107 107 LYS C C 175 178.700 178.700 179.230 -0.530 18517 14080 1 12 . 1 1 107 107 LYS CA C 175 61.170 61.170 60.098 1.072 18517 14081 1 12 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.262 0.168 18517 14082 1 12 . 1 1 107 107 LYS H H 175 8.340 8.340 8.603 -0.263 18517 14083 1 12 . 1 1 108 108 THR N N 176 113.820 113.820 116.381 -2.561 18517 14084 1 12 . 1 1 108 108 THR HA H 176 3.840 3.840 4.019 -0.179 18517 14085 1 12 . 1 1 108 108 THR C C 176 176.620 176.620 176.492 0.128 18517 14086 1 12 . 1 1 108 108 THR CA C 176 66.910 66.910 66.538 0.372 18517 14087 1 12 . 1 1 108 108 THR CB C 176 69.610 69.610 68.545 1.065 18517 14088 1 12 . 1 1 108 108 THR H H 176 7.950 7.950 8.298 -0.348 18517 14089 1 12 . 1 1 109 109 LEU N N 177 124.380 124.380 122.845 1.535 18517 14090 1 12 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.110 -0.280 18517 14091 1 12 . 1 1 109 109 LEU C C 177 177.790 177.790 178.086 -0.296 18517 14092 1 12 . 1 1 109 109 LEU CA C 177 57.990 57.990 58.091 -0.101 18517 14093 1 12 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.751 0.830 18517 14094 1 12 . 1 1 109 109 LEU H H 177 7.480 7.480 7.827 -0.347 18517 14095 1 12 . 1 1 110 110 LEU N N 178 117.230 117.230 119.354 -2.124 18517 14096 1 12 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.749 0.091 18517 14097 1 12 . 1 1 110 110 LEU C C 178 179.540 179.540 179.272 0.268 18517 14098 1 12 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.707 0.683 18517 14099 1 12 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.375 0.965 18517 14100 1 12 . 1 1 110 110 LEU H H 178 8.670 8.670 7.934 0.736 18517 14101 1 12 . 1 1 111 111 LEU N N 179 119.230 119.230 120.622 -1.392 18517 14102 1 12 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.085 -0.005 18517 14103 1 12 . 1 1 111 111 LEU C C 179 179.310 179.310 179.000 0.310 18517 14104 1 12 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.841 0.549 18517 14105 1 12 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.665 1.355 18517 14106 1 12 . 1 1 111 111 LEU H H 179 7.940 7.940 8.596 -0.656 18517 14107 1 12 . 1 1 112 112 LYS N N 180 121.910 121.910 120.788 1.122 18517 14108 1 12 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.204 -0.014 18517 14109 1 12 . 1 1 112 112 LYS C C 180 178.740 178.740 179.213 -0.473 18517 14110 1 12 . 1 1 112 112 LYS CA C 180 59.180 59.180 58.632 0.548 18517 14111 1 12 . 1 1 112 112 LYS CB C 180 31.870 31.870 31.802 0.068 18517 14112 1 12 . 1 1 112 112 LYS H H 180 7.420 7.420 8.125 -0.705 18517 14113 1 12 . 1 1 113 113 PHE N N 181 118.220 118.220 119.393 -1.173 18517 14114 1 12 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.255 0.495 18517 14115 1 12 . 1 1 113 113 PHE C C 181 178.520 178.520 177.999 0.521 18517 14116 1 12 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.790 -3.710 18517 14117 1 12 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.252 -0.272 18517 14118 1 12 . 1 1 113 113 PHE H H 181 9.000 9.000 8.521 0.479 18517 14119 1 12 . 1 1 114 114 SER N N 182 113.300 113.300 115.430 -2.130 18517 14120 1 12 . 1 1 114 114 SER HA H 182 3.930 3.930 4.165 -0.235 18517 14121 1 12 . 1 1 114 114 SER C C 182 177.080 177.080 176.983 0.097 18517 14122 1 12 . 1 1 114 114 SER CA C 182 62.000 62.000 62.667 -0.667 18517 14123 1 12 . 1 1 114 114 SER CB C 182 63.510 63.510 62.878 0.632 18517 14124 1 12 . 1 1 114 114 SER H H 182 8.620 8.620 8.590 0.030 18517 14125 1 12 . 1 1 115 115 GLU N N 183 121.540 121.540 121.663 -0.123 18517 14126 1 12 . 1 1 115 115 GLU HA H 183 4.070 4.070 3.960 0.110 18517 14127 1 12 . 1 1 115 115 GLU C C 183 179.860 179.860 178.630 1.230 18517 14128 1 12 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.724 0.056 18517 14129 1 12 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.498 0.392 18517 14130 1 12 . 1 1 115 115 GLU H H 183 8.250 8.250 8.677 -0.427 18517 14131 1 12 . 1 1 116 116 ASP N N 184 121.740 121.740 120.826 0.914 18517 14132 1 12 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.412 0.098 18517 14133 1 12 . 1 1 116 116 ASP C C 184 179.570 179.570 178.332 1.238 18517 14134 1 12 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.389 0.171 18517 14135 1 12 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.945 0.045 18517 14136 1 12 . 1 1 116 116 ASP H H 184 8.840 8.840 8.387 0.453 18517 14137 1 12 . 1 1 117 117 LEU N N 185 121.420 121.420 121.120 0.300 18517 14138 1 12 . 1 1 117 117 LEU HA H 185 4.130 4.130 3.965 0.165 18517 14139 1 12 . 1 1 117 117 LEU C C 185 178.840 178.840 178.196 0.644 18517 14140 1 12 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.124 0.106 18517 14141 1 12 . 1 1 117 117 LEU CB C 185 42.650 42.650 42.040 0.610 18517 14142 1 12 . 1 1 117 117 LEU H H 185 8.350 8.350 8.403 -0.053 18517 14143 1 12 . 1 1 118 118 LYS N N 186 119.640 119.640 119.238 0.402 18517 14144 1 12 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.823 0.297 18517 14145 1 12 . 1 1 118 118 LYS C C 186 178.820 178.820 178.804 0.016 18517 14146 1 12 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.857 -0.117 18517 14147 1 12 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.345 0.165 18517 14148 1 12 . 1 1 118 118 LYS H H 186 8.220 8.220 8.380 -0.160 18517 14149 1 12 . 1 1 119 119 ALA N N 187 120.160 120.160 121.340 -1.180 18517 14150 1 12 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.021 0.139 18517 14151 1 12 . 1 1 119 119 ALA C C 187 180.450 180.450 179.828 0.622 18517 14152 1 12 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.304 -0.164 18517 14153 1 12 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.084 0.386 18517 14154 1 12 . 1 1 119 119 ALA H H 187 8.010 8.010 8.252 -0.242 18517 14155 1 12 . 1 1 120 120 GLU N N 188 117.930 117.930 117.752 0.178 18517 14156 1 12 . 1 1 120 120 GLU HA H 188 4.180 4.180 3.998 0.182 18517 14157 1 12 . 1 1 120 120 GLU C C 188 178.780 178.780 179.562 -0.782 18517 14158 1 12 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.290 -0.460 18517 14159 1 12 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.545 0.425 18517 14160 1 12 . 1 1 120 120 GLU H H 188 7.640 7.640 8.073 -0.433 18517 14161 1 12 . 1 1 121 121 GLN N N 189 117.230 117.230 118.136 -0.906 18517 14162 1 12 . 1 1 121 121 GLN HA H 189 4.230 4.230 4.166 0.064 18517 14163 1 12 . 1 1 121 121 GLN C C 189 179.190 179.190 178.231 0.959 18517 14164 1 12 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.149 1.591 18517 14165 1 12 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.732 0.918 18517 14166 1 12 . 1 1 121 121 GLN H H 189 8.280 8.280 8.399 -0.119 18517 14167 1 12 . 1 1 122 122 GLU N N 190 118.340 118.340 120.580 -2.240 18517 14168 1 12 . 1 1 122 122 GLU HA H 190 4.120 4.120 4.043 0.077 18517 14169 1 12 . 1 1 122 122 GLU C C 190 178.210 178.210 179.004 -0.794 18517 14170 1 12 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.789 -0.039 18517 14171 1 12 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.158 0.812 18517 14172 1 12 . 1 1 122 122 GLU H H 190 8.250 8.250 8.441 -0.191 18517 14173 1 12 . 1 1 123 123 LEU N N 191 118.930 118.930 120.612 -1.682 18517 14174 1 12 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.890 0.200 18517 14175 1 12 . 1 1 123 123 LEU C C 191 178.500 178.500 178.770 -0.270 18517 14176 1 12 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.050 -1.050 18517 14177 1 12 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.504 0.996 18517 14178 1 12 . 1 1 123 123 LEU H H 191 7.530 7.530 8.216 -0.686 18517 14179 1 12 . 1 1 124 124 HIS N N 192 115.650 115.650 119.168 -3.518 18517 14180 1 12 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.037 0.683 18517 14181 1 12 . 1 1 124 124 HIS C C 192 176.090 176.090 177.502 -1.412 18517 14182 1 12 . 1 1 124 124 HIS CA C 192 56.690 56.690 60.391 -3.701 18517 14183 1 12 . 1 1 124 124 HIS CB C 192 30.760 30.760 29.799 0.961 18517 14184 1 12 . 1 1 124 124 HIS H H 192 7.450 7.450 8.268 -0.818 18517 14185 1 12 . 1 1 125 125 SER N N 193 115.480 115.480 115.088 0.392 18517 14186 1 12 . 1 1 125 125 SER HA H 193 4.310 4.310 4.010 0.300 18517 14187 1 12 . 1 1 125 125 SER CA C 193 60.180 60.180 61.972 -1.792 18517 14188 1 12 . 1 1 125 125 SER CB C 193 64.060 64.060 62.481 1.579 18517 14189 1 12 . 1 1 125 125 SER H H 193 8.020 8.020 8.030 -0.010 18517 14190 1 12 . 1 1 126 126 GLU C C 194 177.410 177.410 179.197 -1.787 18517 14191 1 12 . 1 1 126 126 GLU CA C 194 57.840 57.840 58.618 -0.778 18517 14192 1 12 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.113 0.777 18517 14193 1 12 . 1 1 127 127 ALA N N 195 122.910 122.910 122.212 0.698 18517 14194 1 12 . 1 1 127 127 ALA HA H 195 4.190 4.190 3.843 0.347 18517 14195 1 12 . 1 1 127 127 ALA C C 195 178.610 178.610 178.875 -0.265 18517 14196 1 12 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.353 -0.563 18517 14197 1 12 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.303 0.957 18517 14198 1 12 . 1 1 127 127 ALA H H 195 8.020 8.020 8.318 -0.298 18517 14199 1 12 . 1 1 128 128 LYS N N 196 117.770 117.770 114.496 3.274 18517 14200 1 12 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.300 -0.040 18517 14201 1 12 . 1 1 128 128 LYS C C 196 177.400 177.400 176.816 0.584 18517 14202 1 12 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.844 2.156 18517 14203 1 12 . 1 1 128 128 LYS CB C 196 32.740 32.740 32.845 -0.105 18517 14204 1 12 . 1 1 128 128 LYS H H 196 7.990 7.990 7.811 0.179 18517 14205 1 12 . 1 1 129 129 GLY N N 197 109.010 109.010 108.395 0.615 18517 14206 1 12 . 1 1 129 129 GLY C C 197 175.770 175.770 175.581 0.189 18517 14207 1 12 . 1 1 129 129 GLY CA C 197 46.100 46.100 44.931 1.169 18517 14208 1 12 . 1 1 129 129 GLY H H 197 8.220 8.220 7.577 0.643 18517 14209 1 12 . 1 1 130 130 GLY N N 198 109.150 109.150 109.557 -0.407 18517 14210 1 12 . 1 1 130 130 GLY C C 198 174.760 174.760 175.365 -0.605 18517 14211 1 12 . 1 1 130 130 GLY CA C 198 46.930 46.930 46.993 -0.063 18517 14212 1 12 . 1 1 130 130 GLY H H 198 8.210 8.210 8.787 -0.577 18517 14213 1 12 . 1 1 131 131 GLU N N 199 121.560 121.560 121.472 0.088 18517 14214 1 12 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.016 0.004 18517 14215 1 12 . 1 1 131 131 GLU C C 199 178.500 178.500 178.233 0.267 18517 14216 1 12 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.020 0.880 18517 14217 1 12 . 1 1 131 131 GLU CB C 199 29.570 29.570 28.794 0.776 18517 14218 1 12 . 1 1 131 131 GLU H H 199 8.510 8.510 8.627 -0.117 18517 14219 1 12 . 1 1 132 132 ALA N N 200 122.390 122.390 123.026 -0.636 18517 14220 1 12 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.179 0.021 18517 14221 1 12 . 1 1 132 132 ALA C C 200 180.360 180.360 180.197 0.163 18517 14222 1 12 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.803 -0.023 18517 14223 1 12 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.461 -0.071 18517 14224 1 12 . 1 1 132 132 ALA H H 200 8.190 8.190 7.725 0.465 18517 14225 1 12 . 1 1 133 133 LEU N N 201 120.800 120.800 120.685 0.115 18517 14226 1 12 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.258 -0.048 18517 14227 1 12 . 1 1 133 133 LEU C C 201 179.270 179.270 179.592 -0.322 18517 14228 1 12 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.722 -0.042 18517 14229 1 12 . 1 1 133 133 LEU CB C 201 42.180 42.180 40.742 1.438 18517 14230 1 12 . 1 1 133 133 LEU H H 201 7.720 7.720 8.247 -0.527 18517 14231 1 12 . 1 1 134 134 LEU N N 202 120.680 120.680 120.177 0.503 18517 14232 1 12 . 1 1 134 134 LEU HA H 202 3.980 3.980 4.005 -0.025 18517 14233 1 12 . 1 1 134 134 LEU C C 202 179.030 179.030 178.993 0.037 18517 14234 1 12 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.772 0.659 18517 14235 1 12 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.378 0.242 18517 14236 1 12 . 1 1 134 134 LEU H H 202 8.470 8.470 8.829 -0.359 18517 14237 1 12 . 1 1 135 135 SER N N 203 113.290 113.290 114.713 -1.423 18517 14238 1 12 . 1 1 135 135 SER HA H 203 4.180 4.180 4.100 0.080 18517 14239 1 12 . 1 1 135 135 SER C C 203 177.300 177.300 176.677 0.623 18517 14240 1 12 . 1 1 135 135 SER CA C 203 62.080 62.080 62.707 -0.627 18517 14241 1 12 . 1 1 135 135 SER CB C 203 63.030 63.030 62.994 0.036 18517 14242 1 12 . 1 1 135 135 SER H H 203 8.210 8.210 8.253 -0.043 18517 14243 1 12 . 1 1 136 136 SER N N 204 117.500 117.500 118.543 -1.043 18517 14244 1 12 . 1 1 136 136 SER HA H 204 4.050 4.050 4.211 -0.161 18517 14245 1 12 . 1 1 136 136 SER C C 204 177.570 177.570 176.572 0.998 18517 14246 1 12 . 1 1 136 136 SER CA C 204 61.880 61.880 61.580 0.300 18517 14247 1 12 . 1 1 136 136 SER CB C 204 63.510 63.510 63.032 0.478 18517 14248 1 12 . 1 1 136 136 SER H H 204 7.730 7.730 8.145 -0.415 18517 14249 1 12 . 1 1 137 137 MET N N 205 122.500 122.500 123.168 -0.668 18517 14250 1 12 . 1 1 137 137 MET HA H 205 4.140 4.140 4.055 0.085 18517 14251 1 12 . 1 1 137 137 MET C C 205 177.680 177.680 178.849 -1.169 18517 14252 1 12 . 1 1 137 137 MET CA C 205 60.140 60.140 59.632 0.508 18517 14253 1 12 . 1 1 137 137 MET CB C 205 33.460 33.460 32.472 0.988 18517 14254 1 12 . 1 1 137 137 MET H H 205 8.170 8.170 8.749 -0.579 18517 14255 1 12 . 1 1 138 138 LYS N N 206 121.410 121.410 117.954 3.456 18517 14256 1 12 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.944 -0.194 18517 14257 1 12 . 1 1 138 138 LYS C C 206 178.780 178.780 179.545 -0.765 18517 14258 1 12 . 1 1 138 138 LYS CA C 206 60.330 60.330 60.000 0.330 18517 14259 1 12 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.248 0.022 18517 14260 1 12 . 1 1 138 138 LYS H H 206 8.810 8.810 8.159 0.651 18517 14261 1 12 . 1 1 139 139 THR N N 207 116.580 116.580 116.917 -0.337 18517 14262 1 12 . 1 1 139 139 THR HA H 207 4.060 4.060 4.057 0.003 18517 14263 1 12 . 1 1 139 139 THR C C 207 176.730 176.730 176.904 -0.174 18517 14264 1 12 . 1 1 139 139 THR CA C 207 67.150 67.150 66.637 0.513 18517 14265 1 12 . 1 1 139 139 THR CB C 207 69.220 69.220 68.526 0.694 18517 14266 1 12 . 1 1 139 139 THR H H 207 7.930 7.930 8.141 -0.211 18517 14267 1 12 . 1 1 140 140 GLN N N 208 121.390 121.390 120.332 1.058 18517 14268 1 12 . 1 1 140 140 GLN HA H 208 4.060 4.060 3.961 0.099 18517 14269 1 12 . 1 1 140 140 GLN C C 208 178.550 178.550 178.198 0.352 18517 14270 1 12 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.555 -0.255 18517 14271 1 12 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.731 0.129 18517 14272 1 12 . 1 1 140 140 GLN H H 208 7.600 7.600 8.612 -1.012 18517 14273 1 12 . 1 1 141 141 HIS N N 209 122.360 122.360 119.204 3.156 18517 14274 1 12 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.344 -0.514 18517 14275 1 12 . 1 1 141 141 HIS C C 209 176.390 176.390 177.318 -0.928 18517 14276 1 12 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.142 1.577 18517 14277 1 12 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.185 -1.085 18517 14278 1 12 . 1 1 141 141 HIS H H 209 8.980 8.980 8.284 0.696 18517 14279 1 12 . 1 1 142 142 ASP N N 210 120.740 120.740 120.683 0.057 18517 14280 1 12 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.392 -0.042 18517 14281 1 12 . 1 1 142 142 ASP C C 210 179.490 179.490 178.195 1.295 18517 14282 1 12 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.975 -0.055 18517 14283 1 12 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.854 -0.264 18517 14284 1 12 . 1 1 142 142 ASP H H 210 8.770 8.770 8.339 0.431 18517 14285 1 12 . 1 1 143 143 GLU N N 211 119.010 119.010 120.362 -1.352 18517 14286 1 12 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.041 -0.071 18517 14287 1 12 . 1 1 143 143 GLU C C 211 179.070 179.070 178.955 0.115 18517 14288 1 12 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.355 -0.056 18517 14289 1 12 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.718 -0.228 18517 14290 1 12 . 1 1 143 143 GLU H H 211 7.850 7.850 8.178 -0.328 18517 14291 1 12 . 1 1 144 144 LEU N N 212 122.500 122.500 120.520 1.980 18517 14292 1 12 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.040 0.030 18517 14293 1 12 . 1 1 144 144 LEU C C 212 179.340 179.340 179.333 0.007 18517 14294 1 12 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.100 0.290 18517 14295 1 12 . 1 1 144 144 LEU CB C 212 42.180 42.180 42.002 0.178 18517 14296 1 12 . 1 1 144 144 LEU H H 212 8.070 8.070 8.197 -0.127 18517 14297 1 12 . 1 1 145 145 LEU N N 213 118.110 118.110 118.019 0.091 18517 14298 1 12 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.788 0.412 18517 14299 1 12 . 1 1 145 145 LEU C C 213 179.610 179.610 179.088 0.522 18517 14300 1 12 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.686 1.064 18517 14301 1 12 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.208 0.022 18517 14302 1 12 . 1 1 145 145 LEU H H 213 8.370 8.370 8.417 -0.047 18517 14303 1 12 . 1 1 146 146 LYS N N 214 117.290 117.290 120.482 -3.192 18517 14304 1 12 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.978 -0.148 18517 14305 1 12 . 1 1 146 146 LYS C C 214 179.900 179.900 178.744 1.156 18517 14306 1 12 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.169 1.161 18517 14307 1 12 . 1 1 146 146 LYS CB C 214 32.350 32.350 31.903 0.447 18517 14308 1 12 . 1 1 146 146 LYS H H 214 7.560 7.560 8.252 -0.692 18517 14309 1 12 . 1 1 147 147 LYS N N 215 120.330 120.330 119.567 0.763 18517 14310 1 12 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.024 -0.004 18517 14311 1 12 . 1 1 147 147 LYS C C 215 180.550 180.550 179.452 1.098 18517 14312 1 12 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.328 0.772 18517 14313 1 12 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.060 0.680 18517 14314 1 12 . 1 1 147 147 LYS H H 215 7.830 7.830 7.954 -0.124 18517 14315 1 12 . 1 1 148 148 PHE N N 216 117.370 117.370 118.067 -0.697 18517 14316 1 12 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.210 -0.130 18517 14317 1 12 . 1 1 148 148 PHE C C 216 178.200 178.200 177.861 0.339 18517 14318 1 12 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.242 0.878 18517 14319 1 12 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.340 1.380 18517 14320 1 12 . 1 1 148 148 PHE H H 216 8.010 8.010 8.441 -0.431 18517 14321 1 12 . 1 1 149 149 ALA N N 217 118.990 118.990 121.752 -2.762 18517 14322 1 12 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.227 -0.117 18517 14323 1 12 . 1 1 149 149 ALA C C 217 177.330 177.330 178.214 -0.884 18517 14324 1 12 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.825 -0.075 18517 14325 1 12 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.378 -0.778 18517 14326 1 12 . 1 1 149 149 ALA H H 217 7.720 7.720 8.052 -0.332 18517 14327 1 12 . 1 1 150 150 ALA N N 218 118.690 118.690 120.583 -1.893 18517 14328 1 12 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.285 0.075 18517 14329 1 12 . 1 1 150 150 ALA C C 218 177.930 177.930 178.165 -0.235 18517 14330 1 12 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.632 -0.542 18517 14331 1 12 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.375 0.365 18517 14332 1 12 . 1 1 150 150 ALA H H 218 7.280 7.280 7.734 -0.454 18517 14333 1 12 . 1 1 151 151 LEU N N 219 119.980 119.980 121.555 -1.575 18517 14334 1 12 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.228 0.042 18517 14335 1 12 . 1 1 151 151 LEU C C 219 176.150 176.150 175.448 0.702 18517 14336 1 12 . 1 1 151 151 LEU CA C 219 56.170 56.170 55.852 0.318 18517 14337 1 12 . 1 1 151 151 LEU CB C 219 42.810 42.810 42.741 0.069 18517 14338 1 12 . 1 1 151 151 LEU H H 219 7.050 7.050 7.656 -0.606 18517 14339 1 12 . 1 1 152 152 THR N N 220 112.070 112.070 117.138 -5.068 18517 14340 1 12 . 1 1 152 152 THR HA H 220 4.700 4.700 4.854 -0.154 18517 14341 1 12 . 1 1 152 152 THR C C 220 173.400 173.400 173.011 0.389 18517 14342 1 12 . 1 1 152 152 THR CA C 220 58.190 58.190 58.469 -0.279 18517 14343 1 12 . 1 1 152 152 THR CB C 220 70.960 70.960 69.643 1.317 18517 14344 1 12 . 1 1 152 152 THR H H 220 8.040 8.040 7.959 0.081 18517 14345 1 12 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.705 0.005 18517 14346 1 12 . 1 1 153 153 PRO C C 221 176.720 176.720 175.932 0.788 18517 14347 1 12 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.372 0.538 18517 14348 1 12 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.573 1.677 18517 14349 1 12 . 1 1 154 154 THR N N 222 120.460 120.460 114.882 5.578 18517 14350 1 12 . 1 1 154 154 THR HA H 222 4.250 4.250 4.428 -0.178 18517 14351 1 12 . 1 1 154 154 THR C C 222 175.190 175.190 175.249 -0.059 18517 14352 1 12 . 1 1 154 154 THR CA C 222 64.650 64.650 61.751 2.899 18517 14353 1 12 . 1 1 154 154 THR CB C 222 70.410 70.410 69.966 0.444 18517 14354 1 12 . 1 1 154 154 THR H H 222 8.530 8.530 8.233 0.297 18517 14355 1 12 . 1 1 155 155 PHE N N 223 122.260 122.260 122.507 -0.247 18517 14356 1 12 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.819 0.171 18517 14357 1 12 . 1 1 155 155 PHE C C 223 172.560 172.560 174.792 -2.232 18517 14358 1 12 . 1 1 155 155 PHE CA C 223 56.770 56.770 56.980 -0.210 18517 14359 1 12 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.623 0.967 18517 14360 1 12 . 1 1 155 155 PHE H H 223 8.950 8.950 7.937 1.013 18517 14361 1 12 . 1 1 156 156 LEU N N 224 123.440 123.440 121.600 1.840 18517 14362 1 12 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.437 0.233 18517 14363 1 12 . 1 1 156 156 LEU C C 224 175.090 175.090 176.744 -1.654 18517 14364 1 12 . 1 1 156 156 LEU CA C 224 54.030 54.030 53.801 0.229 18517 14365 1 12 . 1 1 156 156 LEU CB C 224 46.300 46.300 42.922 3.378 18517 14366 1 12 . 1 1 156 156 LEU H H 224 7.210 7.210 7.103 0.107 18517 14367 1 12 . 1 1 157 157 THR N N 225 113.010 113.010 112.711 0.299 18517 14368 1 12 . 1 1 157 157 THR HA H 225 4.790 4.790 4.495 0.295 18517 14369 1 12 . 1 1 157 157 THR C C 225 176.130 176.130 174.685 1.445 18517 14370 1 12 . 1 1 157 157 THR CA C 225 59.860 59.860 61.236 -1.376 18517 14371 1 12 . 1 1 157 157 THR CB C 225 72.860 72.860 69.802 3.058 18517 14372 1 12 . 1 1 157 157 THR H H 225 9.200 9.200 8.092 1.108 18517 14373 1 12 . 1 1 158 158 SER N N 226 115.350 115.350 119.573 -4.223 18517 14374 1 12 . 1 1 158 158 SER C C 226 177.410 177.410 175.782 1.628 18517 14375 1 12 . 1 1 158 158 SER CA C 226 57.400 57.400 57.983 -0.583 18517 14376 1 12 . 1 1 158 158 SER CB C 226 66.200 66.200 64.106 2.095 18517 14377 1 12 . 1 1 158 158 SER H H 226 8.830 8.830 8.489 0.341 18517 14378 1 12 . 1 1 159 159 GLU N N 227 121.200 121.200 121.267 -0.067 18517 14379 1 12 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.870 0.150 18517 14380 1 12 . 1 1 159 159 GLU C C 227 177.680 177.680 177.194 0.486 18517 14381 1 12 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.655 0.845 18517 14382 1 12 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.559 0.011 18517 14383 1 12 . 1 1 159 159 GLU H H 227 8.320 8.320 8.837 -0.517 18517 14384 1 12 . 1 1 160 160 ASP N N 228 115.350 115.350 117.666 -2.316 18517 14385 1 12 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.407 0.143 18517 14386 1 12 . 1 1 160 160 ASP C C 228 177.640 177.640 177.592 0.048 18517 14387 1 12 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.587 0.813 18517 14388 1 12 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.605 2.445 18517 14389 1 12 . 1 1 160 160 ASP H H 228 7.570 7.570 8.180 -0.610 18517 14390 1 12 . 1 1 161 161 ILE N N 229 108.150 108.150 112.803 -4.653 18517 14391 1 12 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.372 0.138 18517 14392 1 12 . 1 1 161 161 ILE C C 229 173.130 173.130 177.641 -4.511 18517 14393 1 12 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.455 -1.165 18517 14394 1 12 . 1 1 161 161 ILE CB C 229 39.400 39.400 39.182 0.218 18517 14395 1 12 . 1 1 161 161 ILE H H 229 7.190 7.190 7.655 -0.465 18517 14396 1 12 . 1 1 162 162 SER N N 230 115.290 115.290 117.203 -1.913 18517 14397 1 12 . 1 1 162 162 SER HA H 230 4.760 4.760 3.892 0.868 18517 14398 1 12 . 1 1 162 162 SER C C 230 176.060 176.060 173.906 2.154 18517 14399 1 12 . 1 1 162 162 SER CA C 230 57.920 57.920 57.907 0.013 18517 14400 1 12 . 1 1 162 162 SER CB C 230 66.120 66.120 61.920 4.200 18517 14401 1 12 . 1 1 162 162 SER H H 230 7.460 7.460 8.222 -0.762 18517 14402 1 12 . 1 1 163 163 GLY C C 231 173.260 173.260 172.983 0.277 18517 14403 1 12 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.900 0.650 18517 14404 1 12 . 1 1 164 164 TYR N N 232 115.290 115.290 119.077 -3.787 18517 14405 1 12 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.678 0.022 18517 14406 1 12 . 1 1 164 164 TYR C C 232 172.820 172.820 173.813 -0.993 18517 14407 1 12 . 1 1 164 164 TYR CA C 232 55.100 55.100 54.958 0.142 18517 14408 1 12 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.984 -0.185 18517 14409 1 12 . 1 1 164 164 TYR H H 232 7.370 7.370 7.309 0.061 18517 14410 1 12 . 1 1 165 165 LEU N N 233 120.980 120.980 123.172 -2.192 18517 14411 1 12 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.326 0.104 18517 14412 1 12 . 1 1 165 165 LEU C C 233 176.360 176.360 177.399 -1.039 18517 14413 1 12 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.640 1.020 18517 14414 1 12 . 1 1 165 165 LEU CB C 233 40.430 40.430 40.984 -0.554 18517 14415 1 12 . 1 1 165 165 LEU H H 233 8.830 8.830 8.729 0.101 18517 14416 1 12 . 1 1 166 166 THR N N 234 116.170 116.170 113.627 2.543 18517 14417 1 12 . 1 1 166 166 THR HA H 234 4.010 4.010 3.409 0.601 18517 14418 1 12 . 1 1 166 166 THR C C 234 173.070 173.070 173.949 -0.879 18517 14419 1 12 . 1 1 166 166 THR CA C 234 62.910 62.910 63.229 -0.319 18517 14420 1 12 . 1 1 166 166 THR CB C 234 70.170 70.170 68.950 1.220 18517 14421 1 12 . 1 1 166 166 THR H H 234 8.050 8.050 7.772 0.278 18517 14422 1 12 . 1 1 167 167 VAL N N 235 117.640 117.640 115.901 1.739 18517 14423 1 12 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.323 -0.113 18517 14424 1 12 . 1 1 167 167 VAL C C 235 172.330 172.330 174.176 -1.846 18517 14425 1 12 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.529 1.222 18517 14426 1 12 . 1 1 167 167 VAL CB C 235 35.880 35.880 30.856 5.024 18517 14427 1 12 . 1 1 167 167 VAL H H 235 7.160 7.160 7.444 -0.284 18517 14428 1 12 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.403 -0.213 18517 14429 1 12 . 1 1 168 168 PRO C C 236 173.710 173.710 175.436 -1.726 18517 14430 1 12 . 1 1 168 168 PRO CA C 236 62.830 62.830 62.025 0.805 18517 14431 1 12 . 1 1 168 168 PRO CB C 236 32.270 32.270 32.754 -0.484 18517 14432 1 12 . 1 1 169 169 GLU N N 237 113.540 113.540 118.873 -5.333 18517 14433 1 12 . 1 1 169 169 GLU HA H 237 4.380 4.380 3.941 0.439 18517 14434 1 12 . 1 1 169 169 GLU C C 237 176.690 176.690 178.047 -1.357 18517 14435 1 12 . 1 1 169 169 GLU CA C 237 53.750 53.750 55.092 -1.342 18517 14436 1 12 . 1 1 169 169 GLU CB C 237 33.220 33.220 31.001 2.219 18517 14437 1 12 . 1 1 169 169 GLU H H 237 7.930 7.930 8.138 -0.208 18517 14438 1 12 . 1 1 170 170 TYR N N 238 119.400 119.400 120.989 -1.589 18517 14439 1 12 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.280 -0.280 18517 14440 1 12 . 1 1 170 170 TYR C C 238 177.610 177.610 176.291 1.319 18517 14441 1 12 . 1 1 170 170 TYR CA C 238 62.630 62.630 59.782 2.848 18517 14442 1 12 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.218 -0.478 18517 14443 1 12 . 1 1 170 170 TYR H H 238 8.490 8.490 8.308 0.182 18517 14444 1 12 . 1 1 171 171 GLY N N 239 104.160 104.160 104.416 -0.256 18517 14445 1 12 . 1 1 171 171 GLY C C 239 173.350 173.350 172.916 0.434 18517 14446 1 12 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.432 0.838 18517 14447 1 12 . 1 1 171 171 GLY H H 239 7.960 7.960 7.803 0.157 18517 14448 1 12 . 1 1 172 172 ALA N N 240 121.860 121.860 123.163 -1.303 18517 14449 1 12 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.769 -0.599 18517 14450 1 12 . 1 1 172 172 ALA C C 240 172.160 172.160 174.553 -2.393 18517 14451 1 12 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.075 1.035 18517 14452 1 12 . 1 1 172 172 ALA CB C 240 20.930 20.930 20.320 0.610 18517 14453 1 12 . 1 1 172 172 ALA H H 240 6.910 6.910 7.850 -0.940 18517 14454 1 12 . 1 1 173 173 PRO HA H 241 4.550 4.550 2.673 1.877 18517 14455 1 12 . 1 1 173 173 PRO C C 241 176.610 176.610 174.931 1.679 18517 14456 1 12 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.024 -0.504 18517 14457 1 12 . 1 1 173 173 PRO CB C 241 33.300 33.300 30.828 2.472 18517 14458 1 12 . 1 1 174 174 MET N N 242 114.000 114.000 124.599 -10.599 18517 14459 1 12 . 1 1 174 174 MET HA H 242 4.390 4.390 4.419 -0.029 18517 14460 1 12 . 1 1 174 174 MET C C 242 173.960 173.960 175.110 -1.150 18517 14461 1 12 . 1 1 174 174 MET CA C 242 54.660 54.660 53.339 1.321 18517 14462 1 12 . 1 1 174 174 MET CB C 242 34.170 34.170 34.839 -0.669 18517 14463 1 12 . 1 1 174 174 MET H H 242 8.040 8.040 7.577 0.463 18517 14464 1 12 . 1 1 175 175 ASN N N 243 119.570 119.570 123.957 -4.387 18517 14465 1 12 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.701 0.239 18517 14466 1 12 . 1 1 175 175 ASN C C 243 174.320 174.320 175.073 -0.753 18517 14467 1 12 . 1 1 175 175 ASN CA C 243 53.080 53.080 51.632 1.448 18517 14468 1 12 . 1 1 175 175 ASN CB C 243 38.850 38.850 38.759 0.091 18517 14469 1 12 . 1 1 175 175 ASN H H 243 7.960 7.960 8.278 -0.318 18517 14470 1 12 . 1 1 176 176 ALA N N 244 132.250 132.250 130.842 1.408 18517 14471 1 12 . 1 1 176 176 ALA C C 244 181.580 181.580 178.661 2.919 18517 14472 1 12 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.316 0.455 18517 14473 1 12 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.816 0.214 18517 14474 1 12 . 1 1 176 176 ALA H H 244 12.110 12.110 8.643 3.467 18517 14475 1 12 . 1 1 177 177 ALA N N 245 125.780 125.780 121.476 4.304 18517 14476 1 12 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.916 -0.046 18517 14477 1 12 . 1 1 177 177 ALA C C 245 180.640 180.640 179.252 1.388 18517 14478 1 12 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.186 0.474 18517 14479 1 12 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.206 -0.365 18517 14480 1 12 . 1 1 177 177 ALA H H 245 10.240 10.240 8.036 2.204 18517 14481 1 12 . 1 1 178 178 LYS N N 246 119.810 119.810 119.132 0.678 18517 14482 1 12 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.097 -0.267 18517 14483 1 12 . 1 1 178 178 LYS C C 246 180.500 180.500 178.409 2.091 18517 14484 1 12 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.228 0.672 18517 14485 1 12 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.473 -1.153 18517 14486 1 12 . 1 1 178 178 LYS H H 246 8.470 8.470 8.200 0.270 18517 14487 1 12 . 1 1 179 179 TRP N N 247 121.170 121.170 121.713 -0.543 18517 14488 1 12 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.419 0.201 18517 14489 1 12 . 1 1 179 179 TRP C C 247 176.510 176.510 177.952 -1.442 18517 14490 1 12 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.655 0.165 18517 14491 1 12 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.742 -0.172 18517 14492 1 12 . 1 1 179 179 TRP H H 247 8.330 8.330 8.219 0.111 18517 14493 1 12 . 1 1 180 180 ALA N N 248 119.130 119.130 120.650 -1.520 18517 14494 1 12 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.810 0.730 18517 14495 1 12 . 1 1 180 180 ALA C C 248 182.110 182.110 179.892 2.218 18517 14496 1 12 . 1 1 180 180 ALA CA C 248 54.190 54.190 55.346 -1.156 18517 14497 1 12 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.108 0.602 18517 14498 1 12 . 1 1 180 180 ALA H H 248 7.990 7.990 8.474 -0.484 18517 14499 1 12 . 1 1 181 181 LYS N N 249 116.000 116.000 119.201 -3.201 18517 14500 1 12 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.039 -0.069 18517 14501 1 12 . 1 1 181 181 LYS C C 249 179.380 179.380 179.079 0.301 18517 14502 1 12 . 1 1 181 181 LYS CA C 249 58.710 58.710 58.897 -0.187 18517 14503 1 12 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.153 0.357 18517 14504 1 12 . 1 1 181 181 LYS H H 249 6.900 6.900 7.896 -0.996 18517 14505 1 12 . 1 1 182 182 VAL N N 250 122.270 122.270 116.312 5.958 18517 14506 1 12 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.692 -0.352 18517 14507 1 12 . 1 1 182 182 VAL C C 250 178.160 178.160 177.872 0.288 18517 14508 1 12 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.723 0.037 18517 14509 1 12 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.473 -0.633 18517 14510 1 12 . 1 1 182 182 VAL H H 250 7.050 7.050 8.086 -1.036 18517 14511 1 12 . 1 1 183 183 GLU N N 251 120.520 120.520 120.580 -0.060 18517 14512 1 12 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.880 -0.700 18517 14513 1 12 . 1 1 183 183 GLU C C 251 179.480 179.480 178.938 0.542 18517 14514 1 12 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.183 1.507 18517 14515 1 12 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.672 -0.602 18517 14516 1 12 . 1 1 183 183 GLU H H 251 8.020 8.020 8.496 -0.476 18517 14517 1 12 . 1 1 184 184 GLY N N 252 102.930 102.930 107.063 -4.133 18517 14518 1 12 . 1 1 184 184 GLY C C 252 176.920 176.920 176.577 0.343 18517 14519 1 12 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.139 0.271 18517 14520 1 12 . 1 1 184 184 GLY H H 252 7.830 7.830 8.086 -0.256 18517 14521 1 12 . 1 1 185 185 MET N N 253 123.200 123.200 121.667 1.533 18517 14522 1 12 . 1 1 185 185 MET HA H 253 4.250 4.250 4.120 0.130 18517 14523 1 12 . 1 1 185 185 MET C C 253 179.370 179.370 178.533 0.837 18517 14524 1 12 . 1 1 185 185 MET CA C 253 59.300 59.300 59.221 0.079 18517 14525 1 12 . 1 1 185 185 MET CB C 253 33.930 33.930 32.589 1.341 18517 14526 1 12 . 1 1 185 185 MET H H 253 7.890 7.890 7.954 -0.064 18517 14527 1 12 . 1 1 186 186 ILE N N 254 120.150 120.150 120.362 -0.212 18517 14528 1 12 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.694 -0.134 18517 14529 1 12 . 1 1 186 186 ILE C C 254 177.250 177.250 178.093 -0.843 18517 14530 1 12 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.767 0.753 18517 14531 1 12 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.695 0.595 18517 14532 1 12 . 1 1 186 186 ILE H H 254 8.260 8.260 8.425 -0.165 18517 14533 1 12 . 1 1 187 187 HIS N N 255 119.810 119.810 119.082 0.728 18517 14534 1 12 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.217 -0.217 18517 14535 1 12 . 1 1 187 187 HIS C C 255 176.460 176.460 177.386 -0.926 18517 14536 1 12 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.785 0.545 18517 14537 1 12 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.836 1.794 18517 14538 1 12 . 1 1 187 187 HIS H H 255 8.900 8.900 8.687 0.213 18517 14539 1 12 . 1 1 188 188 GLY N N 256 103.160 103.160 106.483 -3.323 18517 14540 1 12 . 1 1 188 188 GLY C C 256 176.320 176.320 175.434 0.886 18517 14541 1 12 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.561 0.329 18517 14542 1 12 . 1 1 188 188 GLY H H 256 8.030 8.030 8.147 -0.117 18517 14543 1 12 . 1 1 189 189 LYS N N 257 119.510 119.510 119.090 0.420 18517 14544 1 12 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.157 -0.157 18517 14545 1 12 . 1 1 189 189 LYS C C 257 178.660 178.660 178.965 -0.305 18517 14546 1 12 . 1 1 189 189 LYS CA C 257 56.490 56.490 56.279 0.211 18517 14547 1 12 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.825 -0.275 18517 14548 1 12 . 1 1 189 189 LYS H H 257 7.120 7.120 7.503 -0.383 18517 14549 1 12 . 1 1 190 190 LEU N N 258 120.570 120.570 121.378 -0.808 18517 14550 1 12 . 1 1 190 190 LEU HA H 258 3.930 3.930 3.898 0.032 18517 14551 1 12 . 1 1 190 190 LEU C C 258 177.230 177.230 176.934 0.296 18517 14552 1 12 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.421 0.099 18517 14553 1 12 . 1 1 190 190 LEU CB C 258 42.970 42.970 42.082 0.888 18517 14554 1 12 . 1 1 190 190 LEU H H 258 8.060 8.060 8.156 -0.096 18517 14555 1 12 . 1 1 191 191 GLU N N 259 114.590 114.590 114.113 0.477 18517 14556 1 12 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.075 0.205 18517 14557 1 12 . 1 1 191 191 GLU C C 259 176.230 176.230 176.800 -0.570 18517 14558 1 12 . 1 1 191 191 GLU CA C 259 55.340 55.340 56.194 -0.854 18517 14559 1 12 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.202 0.128 18517 14560 1 12 . 1 1 191 191 GLU H H 259 7.330 7.330 7.619 -0.289 18517 14561 1 12 . 1 1 192 192 SER N N 260 115.240 115.240 116.743 -1.503 18517 14562 1 12 . 1 1 192 192 SER HA H 260 4.490 4.490 4.274 0.216 18517 14563 1 12 . 1 1 192 192 SER C C 260 173.770 173.770 175.342 -1.572 18517 14564 1 12 . 1 1 192 192 SER CA C 260 58.350 58.350 58.085 0.265 18517 14565 1 12 . 1 1 192 192 SER CB C 260 65.090 65.090 64.414 0.676 18517 14566 1 12 . 1 1 192 192 SER H H 260 7.130 7.130 7.438 -0.308 18517 14567 1 12 . 1 1 193 193 SER C C 261 174.600 174.600 175.380 -0.780 18517 14568 1 12 . 1 1 193 193 SER CA C 261 59.980 59.980 59.950 0.030 18517 14569 1 12 . 1 1 193 193 SER CB C 261 63.750 63.750 63.151 0.599 18517 14570 1 12 . 1 1 194 194 GLU N N 262 121.800 121.800 122.488 -0.688 18517 14571 1 12 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.401 0.069 18517 14572 1 12 . 1 1 194 194 GLU C C 262 174.650 174.650 174.800 -0.150 18517 14573 1 12 . 1 1 194 194 GLU CA C 262 55.620 55.620 55.911 -0.291 18517 14574 1 12 . 1 1 194 194 GLU CB C 262 30.210 30.210 30.261 -0.051 18517 14575 1 12 . 1 1 194 194 GLU H H 262 7.840 7.840 7.974 -0.134 18517 14576 1 12 . 1 1 195 195 VAL N N 263 124.080 124.080 126.255 -2.175 18517 14577 1 12 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.491 -0.241 18517 14578 1 12 . 1 1 195 195 VAL C C 263 174.460 174.460 173.589 0.871 18517 14579 1 12 . 1 1 195 195 VAL CA C 263 59.820 59.820 58.028 1.792 18517 14580 1 12 . 1 1 195 195 VAL CB C 263 33.620 33.620 33.677 -0.057 18517 14581 1 12 . 1 1 195 195 VAL H H 263 8.020 8.020 7.995 0.025 18517 14582 1 12 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.449 0.071 18517 14583 1 12 . 1 1 198 198 ASN C C 266 176.490 176.490 177.363 -0.873 18517 14584 1 12 . 1 1 198 198 ASN CA C 266 54.780 54.780 55.907 -1.127 18517 14585 1 12 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.973 0.087 18517 14586 1 12 . 1 1 199 199 LEU N N 267 120.680 120.680 120.690 -0.010 18517 14587 1 12 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.773 0.237 18517 14588 1 12 . 1 1 199 199 LEU C C 267 178.050 178.050 178.200 -0.150 18517 14589 1 12 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.197 0.633 18517 14590 1 12 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.736 0.604 18517 14591 1 12 . 1 1 199 199 LEU H H 267 7.660 7.660 7.909 -0.249 18517 14592 1 12 . 1 1 200 200 LYS N N 268 116.740 116.740 119.035 -2.295 18517 14593 1 12 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.935 -0.205 18517 14594 1 12 . 1 1 200 200 LYS C C 268 178.520 178.520 178.681 -0.161 18517 14595 1 12 . 1 1 200 200 LYS CA C 268 61.800 61.800 59.530 2.270 18517 14596 1 12 . 1 1 200 200 LYS CB C 268 32.110 32.110 32.401 -0.291 18517 14597 1 12 . 1 1 200 200 LYS H H 268 8.280 8.280 8.422 -0.142 18517 14598 1 12 . 1 1 201 201 ALA N N 269 121.270 121.270 122.663 -1.393 18517 14599 1 12 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.090 0.150 18517 14600 1 12 . 1 1 201 201 ALA C C 269 180.890 180.890 179.885 1.005 18517 14601 1 12 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.108 0.072 18517 14602 1 12 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.106 0.364 18517 14603 1 12 . 1 1 201 201 ALA H H 269 7.710 7.710 7.989 -0.279 18517 14604 1 12 . 1 1 202 202 LEU N N 270 119.980 119.980 119.227 0.753 18517 14605 1 12 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.873 0.217 18517 14606 1 12 . 1 1 202 202 LEU C C 270 179.330 179.330 179.393 -0.063 18517 14607 1 12 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.647 0.423 18517 14608 1 12 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.130 1.290 18517 14609 1 12 . 1 1 202 202 LEU H H 270 7.750 7.750 8.348 -0.598 18517 14610 1 12 . 1 1 203 203 VAL N N 271 118.450 118.450 119.763 -1.313 18517 14611 1 12 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.932 -0.102 18517 14612 1 12 . 1 1 203 203 VAL C C 271 177.110 177.110 178.100 -0.990 18517 14613 1 12 . 1 1 203 203 VAL CA C 271 67.710 67.710 66.632 1.078 18517 14614 1 12 . 1 1 203 203 VAL CB C 271 31.710 31.710 30.733 0.977 18517 14615 1 12 . 1 1 203 203 VAL H H 271 8.560 8.560 8.453 0.107 18517 14616 1 12 . 1 1 204 204 ALA N N 272 122.560 122.560 121.846 0.714 18517 14617 1 12 . 1 1 204 204 ALA HA H 272 3.880 3.880 4.011 -0.131 18517 14618 1 12 . 1 1 204 204 ALA C C 272 178.700 178.700 179.848 -1.148 18517 14619 1 12 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.630 0.500 18517 14620 1 12 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.209 0.181 18517 14621 1 12 . 1 1 204 204 ALA H H 272 8.120 8.120 8.661 -0.541 18517 14622 1 12 . 1 1 205 205 GLU N N 273 117.290 117.290 119.296 -2.006 18517 14623 1 12 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.115 -0.125 18517 14624 1 12 . 1 1 205 205 GLU C C 273 178.630 178.630 179.032 -0.402 18517 14625 1 12 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.084 1.056 18517 14626 1 12 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.609 0.361 18517 14627 1 12 . 1 1 205 205 GLU H H 273 7.670 7.670 8.085 -0.415 18517 14628 1 12 . 1 1 206 206 LEU N N 274 120.450 120.450 122.364 -1.914 18517 14629 1 12 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.036 -0.036 18517 14630 1 12 . 1 1 206 206 LEU C C 274 178.400 178.400 178.362 0.038 18517 14631 1 12 . 1 1 206 206 LEU CA C 274 58.910 58.910 57.716 1.194 18517 14632 1 12 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.557 1.973 18517 14633 1 12 . 1 1 206 206 LEU H H 274 8.420 8.420 8.346 0.074 18517 14634 1 12 . 1 1 207 207 ILE N N 275 117.580 117.580 120.204 -2.624 18517 14635 1 12 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.530 -0.000 18517 14636 1 12 . 1 1 207 207 ILE C C 275 178.850 178.850 178.041 0.809 18517 14637 1 12 . 1 1 207 207 ILE CA C 275 66.080 66.080 66.112 -0.032 18517 14638 1 12 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.621 1.149 18517 14639 1 12 . 1 1 207 207 ILE H H 275 8.700 8.700 8.840 -0.140 18517 14640 1 12 . 1 1 208 208 GLU N N 276 119.100 119.100 119.261 -0.161 18517 14641 1 12 . 1 1 208 208 GLU HA H 276 4.000 4.000 3.958 0.042 18517 14642 1 12 . 1 1 208 208 GLU C C 276 178.540 178.540 179.004 -0.464 18517 14643 1 12 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.435 1.015 18517 14644 1 12 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.413 1.107 18517 14645 1 12 . 1 1 208 208 GLU H H 276 7.950 7.950 8.270 -0.320 18517 14646 1 12 . 1 1 209 209 LEU N N 277 120.590 120.590 120.618 -0.028 18517 14647 1 12 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.099 0.121 18517 14648 1 12 . 1 1 209 209 LEU C C 277 179.520 179.520 178.756 0.764 18517 14649 1 12 . 1 1 209 209 LEU CA C 277 58.350 58.350 58.039 0.311 18517 14650 1 12 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.428 1.862 18517 14651 1 12 . 1 1 209 209 LEU H H 277 8.550 8.550 8.304 0.246 18517 14652 1 12 . 1 1 210 210 ARG N N 278 116.470 116.470 119.353 -2.883 18517 14653 1 12 . 1 1 210 210 ARG HA H 278 3.740 3.740 3.954 -0.214 18517 14654 1 12 . 1 1 210 210 ARG C C 278 179.190 179.190 178.846 0.344 18517 14655 1 12 . 1 1 210 210 ARG CA C 278 61.680 61.680 60.123 1.557 18517 14656 1 12 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.441 0.959 18517 14657 1 12 . 1 1 210 210 ARG H H 278 8.590 8.590 8.775 -0.185 18517 14658 1 12 . 1 1 211 211 ALA N N 279 120.470 120.470 121.400 -0.930 18517 14659 1 12 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.106 -0.196 18517 14660 1 12 . 1 1 211 211 ALA C C 279 181.350 181.350 179.926 1.424 18517 14661 1 12 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.130 0.570 18517 14662 1 12 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.558 -1.278 18517 14663 1 12 . 1 1 211 211 ALA H H 279 8.050 8.050 8.474 -0.424 18517 14664 1 12 . 1 1 212 212 GLN N N 280 120.070 120.070 118.031 2.039 18517 14665 1 12 . 1 1 212 212 GLN HA H 280 4.020 4.020 4.073 -0.053 18517 14666 1 12 . 1 1 212 212 GLN C C 280 179.490 179.490 178.507 0.983 18517 14667 1 12 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.372 0.928 18517 14668 1 12 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.847 0.333 18517 14669 1 12 . 1 1 212 212 GLN H H 280 8.300 8.300 8.003 0.297 18517 14670 1 12 . 1 1 213 213 MET N N 281 119.810 119.810 121.450 -1.640 18517 14671 1 12 . 1 1 213 213 MET HA H 281 3.730 3.730 4.199 -0.469 18517 14672 1 12 . 1 1 213 213 MET C C 281 177.490 177.490 178.043 -0.553 18517 14673 1 12 . 1 1 213 213 MET CA C 281 60.690 60.690 58.354 2.336 18517 14674 1 12 . 1 1 213 213 MET CB C 281 33.930 33.930 32.603 1.327 18517 14675 1 12 . 1 1 213 213 MET H H 281 8.420 8.420 8.540 -0.120 18517 14676 1 12 . 1 1 214 214 MET N N 282 114.000 114.000 117.595 -3.595 18517 14677 1 12 . 1 1 214 214 MET HA H 282 3.880 3.880 4.060 -0.180 18517 14678 1 12 . 1 1 214 214 MET C C 282 177.650 177.650 178.076 -0.426 18517 14679 1 12 . 1 1 214 214 MET CA C 282 58.670 58.670 58.999 -0.329 18517 14680 1 12 . 1 1 214 214 MET CB C 282 33.300 33.300 32.476 0.824 18517 14681 1 12 . 1 1 214 214 MET H H 282 7.890 7.890 8.225 -0.335 18517 14682 1 12 . 1 1 215 215 ALA N N 283 119.970 119.970 123.194 -3.224 18517 14683 1 12 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.102 0.038 18517 14684 1 12 . 1 1 215 215 ALA C C 283 180.580 180.580 178.945 1.635 18517 14685 1 12 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.277 -1.167 18517 14686 1 12 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.401 -0.721 18517 14687 1 12 . 1 1 215 215 ALA H H 283 7.580 7.580 8.147 -0.567 18517 14688 1 12 . 1 1 216 216 LEU N N 284 120.920 120.920 115.088 5.832 18517 14689 1 12 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.311 -0.351 18517 14690 1 12 . 1 1 216 216 LEU C C 284 177.910 177.910 179.345 -1.435 18517 14691 1 12 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.520 0.399 18517 14692 1 12 . 1 1 216 216 LEU CB C 284 42.500 42.500 41.764 0.736 18517 14693 1 12 . 1 1 216 216 LEU H H 284 7.460 7.460 7.780 -0.320 18517 14694 1 12 . 1 1 217 217 LEU N N 285 116.470 116.470 121.485 -5.015 18517 14695 1 12 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.759 -0.079 18517 14696 1 12 . 1 1 217 217 LEU C C 285 178.310 178.310 177.968 0.342 18517 14697 1 12 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.676 -0.236 18517 14698 1 12 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.264 1.786 18517 14699 1 12 . 1 1 217 217 LEU H H 285 6.980 6.980 8.098 -1.118 18517 14700 1 12 . 1 1 218 218 TYR N N 286 111.080 111.080 113.856 -2.776 18517 14701 1 12 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.525 0.375 18517 14702 1 12 . 1 1 218 218 TYR C C 286 176.090 176.090 175.675 0.415 18517 14703 1 12 . 1 1 218 218 TYR CA C 286 56.050 56.050 57.467 -1.417 18517 14704 1 12 . 1 1 218 218 TYR CB C 286 40.910 40.910 37.666 3.244 18517 14705 1 12 . 1 1 218 218 TYR H H 286 7.660 7.660 8.078 -0.418 18517 14706 1 12 . 1 1 219 219 GLY N N 287 108.260 108.260 109.491 -1.231 18517 14707 1 12 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.321 0.999 18517 14708 1 12 . 1 1 219 219 GLY H H 287 7.750 7.750 7.654 0.096 18517 14709 1 12 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.957 -0.467 18517 14710 1 12 . 1 1 221 221 ILE CA C 289 63.580 63.580 61.181 2.399 18517 14711 1 12 . 1 1 221 221 ILE CB C 289 38.280 38.280 37.751 0.529 18517 14712 1 12 . 1 1 222 222 GLY CA C 290 45.740 45.740 45.543 0.197 18517 14713 1 13 . 1 1 2 2 LYS N N 70 126.600 126.600 121.167 5.433 18517 14714 1 13 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.861 -0.501 18517 14715 1 13 . 1 1 2 2 LYS C C 70 176.000 176.000 174.651 1.349 18517 14716 1 13 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.945 0.505 18517 14717 1 13 . 1 1 2 2 LYS CB C 70 33.850 33.850 34.061 -0.211 18517 14718 1 13 . 1 1 2 2 LYS H H 70 8.530 8.530 8.341 0.189 18517 14719 1 13 . 1 1 3 3 THR N N 71 111.030 111.030 114.502 -3.472 18517 14720 1 13 . 1 1 3 3 THR HA H 71 4.400 4.400 4.449 -0.049 18517 14721 1 13 . 1 1 3 3 THR C C 71 175.650 175.650 174.555 1.095 18517 14722 1 13 . 1 1 3 3 THR CA C 71 60.610 60.610 60.423 0.187 18517 14723 1 13 . 1 1 3 3 THR CB C 71 71.520 71.520 69.838 1.682 18517 14724 1 13 . 1 1 3 3 THR H H 71 7.390 7.390 8.115 -0.725 18517 14725 1 13 . 1 1 4 4 LEU N N 72 121.560 121.560 121.807 -0.247 18517 14726 1 13 . 1 1 4 4 LEU C C 72 177.870 177.870 178.080 -0.210 18517 14727 1 13 . 1 1 4 4 LEU CA C 72 58.480 58.480 59.479 -0.999 18517 14728 1 13 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.736 0.444 18517 14729 1 13 . 1 1 4 4 LEU H H 72 8.980 8.980 8.505 0.475 18517 14730 1 13 . 1 1 5 5 ASP N N 73 115.530 115.530 117.763 -2.233 18517 14731 1 13 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.365 -0.035 18517 14732 1 13 . 1 1 5 5 ASP C C 73 179.290 179.290 178.353 0.937 18517 14733 1 13 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.380 0.460 18517 14734 1 13 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.557 0.273 18517 14735 1 13 . 1 1 5 5 ASP H H 73 8.270 8.270 8.568 -0.298 18517 14736 1 13 . 1 1 6 6 VAL N N 74 122.330 122.330 120.183 2.147 18517 14737 1 13 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.744 -0.004 18517 14738 1 13 . 1 1 6 6 VAL C C 74 178.970 178.970 177.836 1.134 18517 14739 1 13 . 1 1 6 6 VAL CA C 74 66.360 66.360 66.016 0.344 18517 14740 1 13 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.856 0.094 18517 14741 1 13 . 1 1 6 6 VAL H H 74 7.400 7.400 7.404 -0.004 18517 14742 1 13 . 1 1 7 7 LEU N N 75 121.360 121.360 120.473 0.887 18517 14743 1 13 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.907 0.123 18517 14744 1 13 . 1 1 7 7 LEU C C 75 179.240 179.240 179.335 -0.095 18517 14745 1 13 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.369 -0.139 18517 14746 1 13 . 1 1 7 7 LEU CB C 75 42.890 42.890 40.990 1.900 18517 14747 1 13 . 1 1 7 7 LEU H H 75 8.300 8.300 8.601 -0.301 18517 14748 1 13 . 1 1 8 8 ARG N N 76 117.230 117.230 118.569 -1.339 18517 14749 1 13 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.231 -0.311 18517 14750 1 13 . 1 1 8 8 ARG C C 76 178.290 178.290 179.159 -0.869 18517 14751 1 13 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.633 1.137 18517 14752 1 13 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.820 0.390 18517 14753 1 13 . 1 1 8 8 ARG H H 76 8.520 8.520 8.882 -0.362 18517 14754 1 13 . 1 1 9 9 GLY N N 77 104.570 104.570 107.085 -2.515 18517 14755 1 13 . 1 1 9 9 GLY C C 77 176.180 176.180 176.308 -0.128 18517 14756 1 13 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.788 0.382 18517 14757 1 13 . 1 1 9 9 GLY H H 77 7.620 7.620 8.367 -0.747 18517 14758 1 13 . 1 1 10 10 GLU N N 78 120.270 120.270 122.654 -2.384 18517 14759 1 13 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.182 0.088 18517 14760 1 13 . 1 1 10 10 GLU C C 78 179.030 179.030 178.809 0.221 18517 14761 1 13 . 1 1 10 10 GLU CA C 78 58.870 58.870 58.675 0.195 18517 14762 1 13 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.668 1.732 18517 14763 1 13 . 1 1 10 10 GLU H H 78 8.100 8.100 8.122 -0.022 18517 14764 1 13 . 1 1 11 11 LEU N N 79 116.000 116.000 121.802 -5.802 18517 14765 1 13 . 1 1 11 11 LEU HA H 79 4.510 4.510 4.033 0.477 18517 14766 1 13 . 1 1 11 11 LEU C C 79 179.630 179.630 178.547 1.083 18517 14767 1 13 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.134 -1.444 18517 14768 1 13 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.826 2.974 18517 14769 1 13 . 1 1 11 11 LEU H H 79 8.230 8.230 8.414 -0.184 18517 14770 1 13 . 1 1 12 12 ARG N N 80 120.020 120.020 118.834 1.186 18517 14771 1 13 . 1 1 12 12 ARG HA H 80 3.750 3.750 4.007 -0.257 18517 14772 1 13 . 1 1 12 12 ARG C C 80 178.490 178.490 178.698 -0.208 18517 14773 1 13 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.897 2.103 18517 14774 1 13 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.865 1.375 18517 14775 1 13 . 1 1 12 12 ARG H H 80 8.210 8.210 8.667 -0.457 18517 14776 1 13 . 1 1 13 13 GLY N N 81 108.090 108.090 107.790 0.300 18517 14777 1 13 . 1 1 13 13 GLY C C 81 173.540 173.540 176.298 -2.758 18517 14778 1 13 . 1 1 13 13 GLY CA C 81 48.000 48.000 47.076 0.924 18517 14779 1 13 . 1 1 13 13 GLY H H 81 8.890 8.890 8.270 0.620 18517 14780 1 13 . 1 1 14 14 GLN C C 82 179.540 179.540 178.450 1.090 18517 14781 1 13 . 1 1 14 14 GLN CA C 82 58.710 58.710 59.176 -0.466 18517 14782 1 13 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.516 0.584 18517 14783 1 13 . 1 1 15 15 ARG N N 83 118.220 118.220 120.679 -2.459 18517 14784 1 13 . 1 1 15 15 ARG HA H 83 3.950 3.950 3.980 -0.030 18517 14785 1 13 . 1 1 15 15 ARG C C 83 177.710 177.710 178.614 -0.904 18517 14786 1 13 . 1 1 15 15 ARG CA C 83 59.900 59.900 60.103 -0.203 18517 14787 1 13 . 1 1 15 15 ARG CB C 83 29.650 29.650 30.214 -0.564 18517 14788 1 13 . 1 1 15 15 ARG H H 83 7.320 7.320 8.268 -0.948 18517 14789 1 13 . 1 1 16 16 GLU N N 84 118.810 118.810 119.487 -0.677 18517 14790 1 13 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.053 -0.203 18517 14791 1 13 . 1 1 16 16 GLU C C 84 178.750 178.750 179.082 -0.332 18517 14792 1 13 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.750 1.260 18517 14793 1 13 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.076 0.334 18517 14794 1 13 . 1 1 16 16 GLU H H 84 8.450 8.450 8.726 -0.276 18517 14795 1 13 . 1 1 17 17 ALA N N 85 122.790 122.790 122.200 0.590 18517 14796 1 13 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.113 0.077 18517 14797 1 13 . 1 1 17 17 ALA C C 85 180.360 180.360 179.476 0.884 18517 14798 1 13 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.162 0.298 18517 14799 1 13 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.530 -0.450 18517 14800 1 13 . 1 1 17 17 ALA H H 85 8.420 8.420 8.382 0.038 18517 14801 1 13 . 1 1 18 18 PHE N N 86 119.400 119.400 119.873 -0.473 18517 14802 1 13 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.287 0.003 18517 14803 1 13 . 1 1 18 18 PHE C C 86 177.560 177.560 177.293 0.267 18517 14804 1 13 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.639 0.001 18517 14805 1 13 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.565 0.075 18517 14806 1 13 . 1 1 18 18 PHE H H 86 7.490 7.490 8.291 -0.801 18517 14807 1 13 . 1 1 19 19 LEU N N 87 117.470 117.470 120.449 -2.979 18517 14808 1 13 . 1 1 19 19 LEU HA H 87 4.070 4.070 3.987 0.083 18517 14809 1 13 . 1 1 19 19 LEU C C 87 178.880 178.880 178.658 0.222 18517 14810 1 13 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.344 -0.384 18517 14811 1 13 . 1 1 19 19 LEU CB C 87 42.100 42.100 42.001 0.099 18517 14812 1 13 . 1 1 19 19 LEU H H 87 8.010 8.010 8.975 -0.965 18517 14813 1 13 . 1 1 20 20 SER N N 88 113.770 113.770 114.619 -0.849 18517 14814 1 13 . 1 1 20 20 SER HA H 88 4.070 4.070 4.151 -0.081 18517 14815 1 13 . 1 1 20 20 SER C C 88 175.680 175.680 176.982 -1.302 18517 14816 1 13 . 1 1 20 20 SER CA C 88 63.070 63.070 62.179 0.891 18517 14817 1 13 . 1 1 20 20 SER H H 88 8.100 8.100 8.596 -0.496 18517 14818 1 13 . 1 1 21 21 GLU N N 89 120.570 120.570 121.718 -1.148 18517 14819 1 13 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.039 -0.069 18517 14820 1 13 . 1 1 21 21 GLU C C 89 178.940 178.940 179.141 -0.201 18517 14821 1 13 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.255 0.005 18517 14822 1 13 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.105 0.225 18517 14823 1 13 . 1 1 21 21 GLU H H 89 7.400 7.400 7.957 -0.557 18517 14824 1 13 . 1 1 22 22 ILE N N 90 119.350 119.350 119.236 0.114 18517 14825 1 13 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.985 -0.295 18517 14826 1 13 . 1 1 22 22 ILE C C 90 177.230 177.230 178.141 -0.911 18517 14827 1 13 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.656 0.814 18517 14828 1 13 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.684 -0.294 18517 14829 1 13 . 1 1 22 22 ILE H H 90 7.250 7.250 7.914 -0.664 18517 14830 1 13 . 1 1 23 23 ILE N N 91 116.350 116.350 117.876 -1.526 18517 14831 1 13 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.791 -0.391 18517 14832 1 13 . 1 1 23 23 ILE C C 91 176.690 176.690 176.710 -0.020 18517 14833 1 13 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.061 2.669 18517 14834 1 13 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.353 0.417 18517 14835 1 13 . 1 1 23 23 ILE H H 91 7.860 7.860 8.227 -0.367 18517 14836 1 13 . 1 1 24 24 LYS N N 92 116.000 116.000 118.006 -2.006 18517 14837 1 13 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.188 -0.048 18517 14838 1 13 . 1 1 24 24 LYS C C 92 176.270 176.270 177.367 -1.097 18517 14839 1 13 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.823 -0.343 18517 14840 1 13 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.853 0.447 18517 14841 1 13 . 1 1 24 24 LYS H H 92 7.170 7.170 7.982 -0.812 18517 14842 1 13 . 1 1 25 25 SER N N 93 114.650 114.650 114.022 0.628 18517 14843 1 13 . 1 1 25 25 SER HA H 93 4.550 4.550 4.468 0.082 18517 14844 1 13 . 1 1 25 25 SER C C 93 173.370 173.370 173.362 0.008 18517 14845 1 13 . 1 1 25 25 SER CA C 93 57.240 57.240 59.163 -1.923 18517 14846 1 13 . 1 1 25 25 SER CB C 93 65.650 65.650 64.615 1.035 18517 14847 1 13 . 1 1 25 25 SER H H 93 7.730 7.730 7.843 -0.113 18517 14848 1 13 . 1 1 26 26 ASP N N 94 121.230 121.230 117.572 3.658 18517 14849 1 13 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.653 0.277 18517 14850 1 13 . 1 1 26 26 ASP C C 94 176.560 176.560 175.205 1.355 18517 14851 1 13 . 1 1 26 26 ASP CA C 94 54.510 54.510 55.391 -0.881 18517 14852 1 13 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.815 0.835 18517 14853 1 13 . 1 1 26 26 ASP H H 94 8.280 8.280 8.496 -0.216 18517 14854 1 13 . 1 1 27 27 GLY N N 95 109.310 109.310 108.926 0.384 18517 14855 1 13 . 1 1 27 27 GLY C C 95 171.080 171.080 172.063 -0.983 18517 14856 1 13 . 1 1 27 27 GLY CA C 95 42.770 42.770 44.112 -1.342 18517 14857 1 13 . 1 1 27 27 GLY H H 95 8.160 8.160 7.864 0.296 18517 14858 1 13 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.930 0.210 18517 14859 1 13 . 1 1 29 29 PHE C C 97 175.230 175.230 176.117 -0.887 18517 14860 1 13 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.065 0.425 18517 14861 1 13 . 1 1 29 29 PHE CB C 97 41.620 41.620 42.570 -0.950 18517 14862 1 13 . 1 1 30 30 THR N N 98 112.600 112.600 113.263 -0.663 18517 14863 1 13 . 1 1 30 30 THR HA H 98 4.570 4.570 4.257 0.313 18517 14864 1 13 . 1 1 30 30 THR C C 98 176.690 176.690 174.943 1.747 18517 14865 1 13 . 1 1 30 30 THR CA C 98 60.290 60.290 59.545 0.745 18517 14866 1 13 . 1 1 30 30 THR CB C 98 71.600 71.600 71.179 0.421 18517 14867 1 13 . 1 1 30 30 THR H H 98 8.990 8.990 9.109 -0.119 18517 14868 1 13 . 1 1 31 31 ILE N N 99 119.240 119.240 121.465 -2.225 18517 14869 1 13 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.537 0.283 18517 14870 1 13 . 1 1 31 31 ILE C C 99 176.090 176.090 176.606 -0.516 18517 14871 1 13 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.067 -2.927 18517 14872 1 13 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.603 -0.653 18517 14873 1 13 . 1 1 31 31 ILE H H 99 9.230 9.230 8.091 1.139 18517 14874 1 13 . 1 1 32 32 LEU N N 100 119.660 119.660 120.263 -0.603 18517 14875 1 13 . 1 1 32 32 LEU HA H 100 4.030 4.030 3.913 0.117 18517 14876 1 13 . 1 1 32 32 LEU C C 100 181.050 181.050 178.729 2.321 18517 14877 1 13 . 1 1 32 32 LEU CA C 100 57.560 57.560 58.175 -0.615 18517 14878 1 13 . 1 1 32 32 LEU CB C 100 40.120 40.120 40.908 -0.788 18517 14879 1 13 . 1 1 32 32 LEU H H 100 7.310 7.310 8.062 -0.752 18517 14880 1 13 . 1 1 33 33 GLN N N 101 121.450 121.450 118.301 3.149 18517 14881 1 13 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.300 -0.050 18517 14882 1 13 . 1 1 33 33 GLN CA C 101 59.700 59.700 59.147 0.553 18517 14883 1 13 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.624 3.166 18517 14884 1 13 . 1 1 33 33 GLN H H 101 7.790 7.790 7.740 0.050 18517 14885 1 13 . 1 1 34 34 LEU C C 102 178.590 178.590 179.036 -0.446 18517 14886 1 13 . 1 1 34 34 LEU CA C 102 58.630 58.630 57.924 0.706 18517 14887 1 13 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.593 -0.283 18517 14888 1 13 . 1 1 35 35 VAL N N 103 118.520 118.520 118.498 0.022 18517 14889 1 13 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.706 -0.286 18517 14890 1 13 . 1 1 35 35 VAL C C 103 177.930 177.930 178.335 -0.405 18517 14891 1 13 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.458 -0.418 18517 14892 1 13 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.928 0.702 18517 14893 1 13 . 1 1 35 35 VAL H H 103 8.670 8.670 8.616 0.054 18517 14894 1 13 . 1 1 36 36 GLY N N 104 109.430 109.430 108.304 1.126 18517 14895 1 13 . 1 1 36 36 GLY C C 104 174.600 174.600 175.548 -0.948 18517 14896 1 13 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.215 0.825 18517 14897 1 13 . 1 1 36 36 GLY H H 104 7.880 7.880 8.547 -0.667 18517 14898 1 13 . 1 1 37 37 TYR N N 105 122.270 122.270 124.195 -1.925 18517 14899 1 13 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.423 -0.543 18517 14900 1 13 . 1 1 37 37 TYR C C 105 176.310 176.310 176.960 -0.650 18517 14901 1 13 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.113 3.987 18517 14902 1 13 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.676 -0.306 18517 14903 1 13 . 1 1 37 37 TYR H H 105 8.170 8.170 8.187 -0.017 18517 14904 1 13 . 1 1 38 38 LEU N N 106 120.100 120.100 121.468 -1.368 18517 14905 1 13 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.774 -0.034 18517 14906 1 13 . 1 1 38 38 LEU C C 106 178.280 178.280 178.076 0.204 18517 14907 1 13 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.483 0.147 18517 14908 1 13 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.780 0.950 18517 14909 1 13 . 1 1 38 38 LEU H H 106 7.610 7.610 8.467 -0.857 18517 14910 1 13 . 1 1 39 39 ARG N N 107 116.670 116.670 118.806 -2.136 18517 14911 1 13 . 1 1 39 39 ARG HA H 107 3.680 3.680 3.923 -0.243 18517 14912 1 13 . 1 1 39 39 ARG C C 107 179.480 179.480 178.391 1.089 18517 14913 1 13 . 1 1 39 39 ARG CA C 107 59.580 59.580 58.481 1.099 18517 14914 1 13 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.234 2.006 18517 14915 1 13 . 1 1 39 39 ARG H H 107 8.240 8.240 7.860 0.380 18517 14916 1 13 . 1 1 40 40 VAL N N 108 121.970 121.970 119.280 2.690 18517 14917 1 13 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.655 -0.255 18517 14918 1 13 . 1 1 40 40 VAL C C 108 178.440 178.440 178.436 0.004 18517 14919 1 13 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.438 1.512 18517 14920 1 13 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.275 -0.835 18517 14921 1 13 . 1 1 40 40 VAL H H 108 8.200 8.200 7.890 0.310 18517 14922 1 13 . 1 1 41 41 VAL N N 109 108.940 108.940 116.371 -7.431 18517 14923 1 13 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.390 0.850 18517 14924 1 13 . 1 1 41 41 VAL C C 109 175.070 175.070 177.385 -2.315 18517 14925 1 13 . 1 1 41 41 VAL CA C 109 62.590 62.590 66.247 -3.657 18517 14926 1 13 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.904 -1.254 18517 14927 1 13 . 1 1 41 41 VAL H H 109 7.760 7.760 8.070 -0.310 18517 14928 1 13 . 1 1 42 42 ASP N N 110 124.670 124.670 121.233 3.437 18517 14929 1 13 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.351 0.269 18517 14930 1 13 . 1 1 42 42 ASP C C 110 177.310 177.310 178.727 -1.417 18517 14931 1 13 . 1 1 42 42 ASP CA C 110 59.980 59.980 57.711 2.269 18517 14932 1 13 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.284 4.666 18517 14933 1 13 . 1 1 42 42 ASP H H 110 7.360 7.360 8.573 -1.213 18517 14934 1 13 . 1 1 43 43 THR N N 111 102.340 102.340 113.199 -10.859 18517 14935 1 13 . 1 1 43 43 THR HA H 111 5.100 5.100 3.986 1.114 18517 14936 1 13 . 1 1 43 43 THR C C 111 174.940 174.940 176.743 -1.803 18517 14937 1 13 . 1 1 43 43 THR CA C 111 60.650 60.650 66.193 -5.543 18517 14938 1 13 . 1 1 43 43 THR CB C 111 69.610 69.610 68.761 0.849 18517 14939 1 13 . 1 1 43 43 THR H H 111 6.380 6.380 7.955 -1.575 18517 14940 1 13 . 1 1 44 44 ASP N N 112 119.750 119.750 123.620 -3.870 18517 14941 1 13 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.379 -0.519 18517 14942 1 13 . 1 1 44 44 ASP C C 112 178.850 178.850 178.575 0.275 18517 14943 1 13 . 1 1 44 44 ASP CA C 112 58.230 58.230 58.222 0.008 18517 14944 1 13 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.493 -1.093 18517 14945 1 13 . 1 1 44 44 ASP H H 112 9.050 9.050 8.358 0.692 18517 14946 1 13 . 1 1 45 45 LEU N N 113 123.910 123.910 121.630 2.280 18517 14947 1 13 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.906 -0.096 18517 14948 1 13 . 1 1 45 45 LEU C C 113 182.040 182.040 178.389 3.651 18517 14949 1 13 . 1 1 45 45 LEU CA C 113 57.320 57.320 58.091 -0.771 18517 14950 1 13 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.642 -0.892 18517 14951 1 13 . 1 1 45 45 LEU H H 113 9.710 9.710 8.020 1.690 18517 14952 1 13 . 1 1 46 46 LEU N N 114 117.640 117.640 120.811 -3.171 18517 14953 1 13 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.202 -0.092 18517 14954 1 13 . 1 1 46 46 LEU C C 114 179.540 179.540 179.323 0.217 18517 14955 1 13 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.910 -0.350 18517 14956 1 13 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.998 -0.528 18517 14957 1 13 . 1 1 46 46 LEU H H 114 8.270 8.270 8.263 0.007 18517 14958 1 13 . 1 1 47 47 LEU N N 115 116.520 116.520 115.377 1.143 18517 14959 1 13 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.358 -0.218 18517 14960 1 13 . 1 1 47 47 LEU C C 115 173.850 173.850 176.384 -2.534 18517 14961 1 13 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.229 1.191 18517 14962 1 13 . 1 1 47 47 LEU CB C 115 44.720 44.720 40.993 3.727 18517 14963 1 13 . 1 1 47 47 LEU H H 115 8.160 8.160 8.222 -0.062 18517 14964 1 13 . 1 1 48 48 LYS N N 116 114.710 114.710 116.780 -2.070 18517 14965 1 13 . 1 1 48 48 LYS HA H 116 3.810 3.810 4.035 -0.225 18517 14966 1 13 . 1 1 48 48 LYS C C 116 176.510 176.510 175.935 0.575 18517 14967 1 13 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.851 0.349 18517 14968 1 13 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.695 -0.675 18517 14969 1 13 . 1 1 48 48 LYS H H 116 7.580 7.580 7.795 -0.215 18517 14970 1 13 . 1 1 49 49 VAL N N 117 119.050 119.050 119.697 -0.647 18517 14971 1 13 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.030 -0.420 18517 14972 1 13 . 1 1 49 49 VAL C C 117 175.860 175.860 175.956 -0.096 18517 14973 1 13 . 1 1 49 49 VAL CA C 117 63.510 63.510 62.000 1.510 18517 14974 1 13 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.463 -0.113 18517 14975 1 13 . 1 1 49 49 VAL H H 117 7.980 7.980 7.944 0.036 18517 14976 1 13 . 1 1 50 50 ASP N N 118 126.900 126.900 122.095 4.805 18517 14977 1 13 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.497 -0.247 18517 14978 1 13 . 1 1 50 50 ASP C C 118 177.700 177.700 177.510 0.190 18517 14979 1 13 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.159 0.891 18517 14980 1 13 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.731 0.849 18517 14981 1 13 . 1 1 50 50 ASP H H 118 8.930 8.930 8.436 0.494 18517 14982 1 13 . 1 1 51 51 SER N N 119 124.790 124.790 122.148 2.642 18517 14983 1 13 . 1 1 51 51 SER HA H 119 4.070 4.070 4.138 -0.067 18517 14984 1 13 . 1 1 51 51 SER C C 119 177.220 177.220 176.163 1.057 18517 14985 1 13 . 1 1 51 51 SER CA C 119 61.640 61.640 62.030 -0.390 18517 14986 1 13 . 1 1 51 51 SER CB C 119 63.510 63.510 63.501 0.009 18517 14987 1 13 . 1 1 51 51 SER H H 119 8.560 8.560 8.917 -0.357 18517 14988 1 13 . 1 1 52 52 THR N N 120 119.880 119.880 113.849 6.031 18517 14989 1 13 . 1 1 52 52 THR HA H 120 4.190 4.190 4.211 -0.021 18517 14990 1 13 . 1 1 52 52 THR C C 120 177.120 177.120 176.427 0.693 18517 14991 1 13 . 1 1 52 52 THR CA C 120 66.280 66.280 64.955 1.325 18517 14992 1 13 . 1 1 52 52 THR CB C 120 68.420 68.420 68.534 -0.114 18517 14993 1 13 . 1 1 52 52 THR H H 120 8.310 8.310 7.751 0.559 18517 14994 1 13 . 1 1 53 53 LYS N N 121 122.270 122.270 122.888 -0.618 18517 14995 1 13 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.116 0.004 18517 14996 1 13 . 1 1 53 53 LYS C C 121 178.970 178.970 178.810 0.160 18517 14997 1 13 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.075 0.505 18517 14998 1 13 . 1 1 53 53 LYS CB C 121 34.250 34.250 31.913 2.337 18517 14999 1 13 . 1 1 53 53 LYS H H 121 7.700 7.700 8.636 -0.936 18517 15000 1 13 . 1 1 54 54 VAL N N 122 120.070 120.070 120.280 -0.210 18517 15001 1 13 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.825 -0.395 18517 15002 1 13 . 1 1 54 54 VAL C C 122 179.860 179.860 177.617 2.243 18517 15003 1 13 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.816 2.764 18517 15004 1 13 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.880 0.940 18517 15005 1 13 . 1 1 54 54 VAL H H 122 7.890 7.890 8.208 -0.318 18517 15006 1 13 . 1 1 55 55 ASP N N 123 122.270 122.270 120.546 1.724 18517 15007 1 13 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.279 0.191 18517 15008 1 13 . 1 1 55 55 ASP C C 123 178.630 178.630 178.222 0.408 18517 15009 1 13 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.954 -0.154 18517 15010 1 13 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.886 1.134 18517 15011 1 13 . 1 1 55 55 ASP H H 123 8.270 8.270 8.282 -0.012 18517 15012 1 13 . 1 1 56 56 GLU N N 124 119.600 119.600 119.201 0.399 18517 15013 1 13 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.036 -0.066 18517 15014 1 13 . 1 1 56 56 GLU C C 124 179.920 179.920 179.029 0.891 18517 15015 1 13 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.197 0.863 18517 15016 1 13 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.519 0.451 18517 15017 1 13 . 1 1 56 56 GLU H H 124 8.610 8.610 8.144 0.466 18517 15018 1 13 . 1 1 57 57 ALA N N 125 120.070 120.070 122.167 -2.097 18517 15019 1 13 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.024 -0.194 18517 15020 1 13 . 1 1 57 57 ALA C C 125 178.760 178.760 179.617 -0.857 18517 15021 1 13 . 1 1 57 57 ALA CA C 125 55.380 55.380 55.060 0.320 18517 15022 1 13 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.502 1.638 18517 15023 1 13 . 1 1 57 57 ALA H H 125 8.420 8.420 8.430 -0.010 18517 15024 1 13 . 1 1 58 58 GLY N N 126 106.740 106.740 106.279 0.461 18517 15025 1 13 . 1 1 58 58 GLY C C 126 175.740 175.740 175.959 -0.219 18517 15026 1 13 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.757 0.533 18517 15027 1 13 . 1 1 58 58 GLY H H 126 8.200 8.200 8.562 -0.362 18517 15028 1 13 . 1 1 59 59 LYS N N 127 120.920 120.920 122.301 -1.381 18517 15029 1 13 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.023 -0.093 18517 15030 1 13 . 1 1 59 59 LYS C C 127 180.320 180.320 178.721 1.599 18517 15031 1 13 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.562 0.648 18517 15032 1 13 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.409 0.571 18517 15033 1 13 . 1 1 59 59 LYS H H 127 8.000 8.000 8.086 -0.086 18517 15034 1 13 . 1 1 60 60 LYS N N 128 118.400 118.400 119.347 -0.947 18517 15035 1 13 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.095 0.075 18517 15036 1 13 . 1 1 60 60 LYS C C 128 180.030 180.030 179.130 0.900 18517 15037 1 13 . 1 1 60 60 LYS CA C 128 58.750 58.750 59.757 -1.007 18517 15038 1 13 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.472 -0.202 18517 15039 1 13 . 1 1 60 60 LYS H H 128 7.170 7.170 7.834 -0.664 18517 15040 1 13 . 1 1 61 61 VAL N N 129 121.050 121.050 120.453 0.597 18517 15041 1 13 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.351 -0.071 18517 15042 1 13 . 1 1 61 61 VAL C C 129 177.120 177.120 177.753 -0.633 18517 15043 1 13 . 1 1 61 61 VAL CA C 129 67.350 67.350 67.326 0.024 18517 15044 1 13 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.387 0.243 18517 15045 1 13 . 1 1 61 61 VAL H H 129 7.980 7.980 7.963 0.017 18517 15046 1 13 . 1 1 62 62 LYS N N 130 120.040 120.040 119.667 0.373 18517 15047 1 13 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.995 -0.295 18517 15048 1 13 . 1 1 62 62 LYS C C 130 178.550 178.550 178.765 -0.215 18517 15049 1 13 . 1 1 62 62 LYS CA C 130 60.330 60.330 59.429 0.901 18517 15050 1 13 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.296 1.474 18517 15051 1 13 . 1 1 62 62 LYS H H 130 8.910 8.910 8.401 0.509 18517 15052 1 13 . 1 1 63 63 ALA N N 131 119.570 119.570 123.744 -4.174 18517 15053 1 13 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.062 0.158 18517 15054 1 13 . 1 1 63 63 ALA C C 131 180.520 180.520 179.167 1.353 18517 15055 1 13 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.201 0.019 18517 15056 1 13 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.182 0.288 18517 15057 1 13 . 1 1 63 63 ALA H H 131 7.920 7.920 8.294 -0.374 18517 15058 1 13 . 1 1 64 64 TYR N N 132 120.510 120.510 120.457 0.053 18517 15059 1 13 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.176 0.284 18517 15060 1 13 . 1 1 64 64 TYR C C 132 176.510 176.510 177.925 -1.415 18517 15061 1 13 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.612 0.028 18517 15062 1 13 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.645 0.045 18517 15063 1 13 . 1 1 64 64 TYR H H 132 7.930 7.930 8.195 -0.265 18517 15064 1 13 . 1 1 65 65 LEU N N 133 117.290 117.290 119.850 -2.560 18517 15065 1 13 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.573 0.267 18517 15066 1 13 . 1 1 65 65 LEU C C 133 178.610 178.610 178.703 -0.093 18517 15067 1 13 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.139 -0.419 18517 15068 1 13 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.799 -1.369 18517 15069 1 13 . 1 1 65 65 LEU H H 133 8.240 8.240 8.562 -0.322 18517 15070 1 13 . 1 1 66 66 GLU N N 134 119.140 119.140 118.347 0.793 18517 15071 1 13 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.096 -0.236 18517 15072 1 13 . 1 1 66 66 GLU C C 134 180.200 180.200 178.705 1.495 18517 15073 1 13 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.832 1.108 18517 15074 1 13 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.559 0.251 18517 15075 1 13 . 1 1 66 66 GLU H H 134 8.370 8.370 8.434 -0.064 18517 15076 1 13 . 1 1 67 67 LYS N N 135 121.390 121.390 120.569 0.821 18517 15077 1 13 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.100 -0.100 18517 15078 1 13 . 1 1 67 67 LYS C C 135 179.080 179.080 178.406 0.674 18517 15079 1 13 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.723 0.897 18517 15080 1 13 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.321 -0.051 18517 15081 1 13 . 1 1 67 67 LYS H H 135 7.820 7.820 7.731 0.089 18517 15082 1 13 . 1 1 68 68 ILE N N 136 110.310 110.310 110.233 0.077 18517 15083 1 13 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.090 0.210 18517 15084 1 13 . 1 1 68 68 ILE C C 136 175.520 175.520 175.716 -0.196 18517 15085 1 13 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.875 0.555 18517 15086 1 13 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.742 -0.762 18517 15087 1 13 . 1 1 68 68 ILE H H 136 7.380 7.380 7.531 -0.151 18517 15088 1 13 . 1 1 69 69 GLY N N 137 106.680 106.680 107.156 -0.476 18517 15089 1 13 . 1 1 69 69 GLY C C 137 174.160 174.160 173.869 0.291 18517 15090 1 13 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.428 1.042 18517 15091 1 13 . 1 1 69 69 GLY H H 137 7.470 7.470 7.579 -0.109 18517 15092 1 13 . 1 1 70 70 ILE N N 138 124.310 124.310 121.318 2.992 18517 15093 1 13 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.358 -0.158 18517 15094 1 13 . 1 1 70 70 ILE C C 138 174.190 174.190 175.012 -0.822 18517 15095 1 13 . 1 1 70 70 ILE CA C 138 59.380 59.380 59.096 0.284 18517 15096 1 13 . 1 1 70 70 ILE CB C 138 37.340 37.340 37.865 -0.525 18517 15097 1 13 . 1 1 70 70 ILE H H 138 8.530 8.530 8.268 0.262 18517 15098 1 13 . 1 1 71 71 ARG N N 139 125.490 125.490 127.514 -2.024 18517 15099 1 13 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.663 -0.043 18517 15100 1 13 . 1 1 71 71 ARG C C 139 175.750 175.750 175.413 0.337 18517 15101 1 13 . 1 1 71 71 ARG CA C 139 54.660 54.660 54.650 0.010 18517 15102 1 13 . 1 1 71 71 ARG CB C 139 33.140 33.140 32.744 0.396 18517 15103 1 13 . 1 1 71 71 ARG H H 139 8.240 8.240 8.469 -0.229 18517 15104 1 13 . 1 1 72 72 GLY N N 140 104.750 104.750 108.685 -3.935 18517 15105 1 13 . 1 1 72 72 GLY C C 140 172.920 172.920 173.017 -0.097 18517 15106 1 13 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.637 0.793 18517 15107 1 13 . 1 1 72 72 GLY H H 140 7.900 7.900 8.126 -0.226 18517 15108 1 13 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.503 0.007 18517 15109 1 13 . 1 1 73 73 ASP C C 141 175.060 175.060 176.423 -1.363 18517 15110 1 13 . 1 1 73 73 ASP CA C 141 56.170 56.170 55.936 0.234 18517 15111 1 13 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.453 -0.623 18517 15112 1 13 . 1 1 74 74 SER N N 142 110.240 110.240 110.422 -0.182 18517 15113 1 13 . 1 1 74 74 SER HA H 142 4.740 4.740 4.640 0.100 18517 15114 1 13 . 1 1 74 74 SER C C 142 175.110 175.110 174.767 0.343 18517 15115 1 13 . 1 1 74 74 SER CA C 142 55.700 55.700 56.279 -0.578 18517 15116 1 13 . 1 1 74 74 SER CB C 142 67.390 67.390 64.724 2.666 18517 15117 1 13 . 1 1 74 74 SER H H 142 7.560 7.560 7.597 -0.037 18517 15118 1 13 . 1 1 75 75 VAL N N 143 122.950 122.950 120.758 2.192 18517 15119 1 13 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.897 -0.167 18517 15120 1 13 . 1 1 75 75 VAL C C 143 176.230 176.230 176.768 -0.538 18517 15121 1 13 . 1 1 75 75 VAL CA C 143 66.640 66.640 64.631 2.009 18517 15122 1 13 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.759 -0.519 18517 15123 1 13 . 1 1 75 75 VAL H H 143 9.470 9.470 8.821 0.649 18517 15124 1 13 . 1 1 76 76 GLU N N 144 121.390 121.390 121.292 0.098 18517 15125 1 13 . 1 1 76 76 GLU HA H 144 3.640 3.640 3.859 -0.219 18517 15126 1 13 . 1 1 76 76 GLU C C 144 176.880 176.880 178.478 -1.598 18517 15127 1 13 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.699 3.611 18517 15128 1 13 . 1 1 76 76 GLU CB C 144 28.070 28.070 29.015 -0.945 18517 15129 1 13 . 1 1 76 76 GLU H H 144 9.640 9.640 7.805 1.835 18517 15130 1 13 . 1 1 77 77 ALA N N 145 118.770 118.770 121.662 -2.892 18517 15131 1 13 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.279 -0.019 18517 15132 1 13 . 1 1 77 77 ALA C C 145 180.350 180.350 179.508 0.842 18517 15133 1 13 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.457 0.323 18517 15134 1 13 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.009 1.181 18517 15135 1 13 . 1 1 77 77 ALA H H 145 7.860 7.860 7.455 0.405 18517 15136 1 13 . 1 1 78 78 ALA N N 146 120.920 120.920 122.682 -1.762 18517 15137 1 13 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.054 0.086 18517 15138 1 13 . 1 1 78 78 ALA C C 146 179.150 179.150 179.255 -0.105 18517 15139 1 13 . 1 1 78 78 ALA CA C 146 55.260 55.260 55.118 0.141 18517 15140 1 13 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.745 0.045 18517 15141 1 13 . 1 1 78 78 ALA H H 146 8.110 8.110 8.161 -0.051 18517 15142 1 13 . 1 1 79 79 LEU N N 147 118.810 118.810 117.036 1.774 18517 15143 1 13 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.086 -0.206 18517 15144 1 13 . 1 1 79 79 LEU C C 147 179.080 179.080 178.540 0.540 18517 15145 1 13 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.867 0.523 18517 15146 1 13 . 1 1 79 79 LEU CB C 147 42.260 42.260 40.999 1.261 18517 15147 1 13 . 1 1 79 79 LEU H H 147 8.360 8.360 8.200 0.160 18517 15148 1 13 . 1 1 80 80 ASP N N 148 121.620 121.620 119.561 2.059 18517 15149 1 13 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.206 0.314 18517 15150 1 13 . 1 1 80 80 ASP C C 148 178.800 178.800 177.879 0.921 18517 15151 1 13 . 1 1 80 80 ASP CA C 148 58.390 58.390 57.877 0.513 18517 15152 1 13 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.941 -0.192 18517 15153 1 13 . 1 1 80 80 ASP H H 148 8.770 8.770 8.244 0.526 18517 15154 1 13 . 1 1 81 81 ASN N N 149 118.630 118.630 118.899 -0.269 18517 15155 1 13 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.427 0.143 18517 15156 1 13 . 1 1 81 81 ASN C C 149 177.970 177.970 177.784 0.186 18517 15157 1 13 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.132 -0.122 18517 15158 1 13 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.551 0.059 18517 15159 1 13 . 1 1 81 81 ASN H H 149 7.960 7.960 8.136 -0.176 18517 15160 1 13 . 1 1 82 82 LEU N N 150 120.030 120.030 117.867 2.163 18517 15161 1 13 . 1 1 82 82 LEU HA H 150 4.060 4.060 4.260 -0.200 18517 15162 1 13 . 1 1 82 82 LEU C C 150 177.790 177.790 178.906 -1.116 18517 15163 1 13 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.076 0.794 18517 15164 1 13 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.410 0.451 18517 15165 1 13 . 1 1 82 82 LEU H H 150 8.230 8.230 8.209 0.021 18517 15166 1 13 . 1 1 83 83 MET N N 151 115.820 115.820 119.915 -4.095 18517 15167 1 13 . 1 1 83 83 MET HA H 151 4.390 4.390 4.328 0.062 18517 15168 1 13 . 1 1 83 83 MET C C 151 179.760 179.760 178.853 0.907 18517 15169 1 13 . 1 1 83 83 MET CA C 151 57.400 57.400 59.615 -2.215 18517 15170 1 13 . 1 1 83 83 MET CB C 151 31.080 31.080 32.810 -1.730 18517 15171 1 13 . 1 1 83 83 MET H H 151 8.800 8.800 8.196 0.604 18517 15172 1 13 . 1 1 84 84 ILE N N 152 120.330 120.330 120.725 -0.395 18517 15173 1 13 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.715 0.125 18517 15174 1 13 . 1 1 84 84 ILE C C 152 178.660 178.660 178.270 0.390 18517 15175 1 13 . 1 1 84 84 ILE CA C 152 65.800 65.800 64.118 1.682 18517 15176 1 13 . 1 1 84 84 ILE CB C 152 38.450 38.450 36.425 2.025 18517 15177 1 13 . 1 1 84 84 ILE H H 152 8.540 8.540 8.561 -0.021 18517 15178 1 13 . 1 1 85 85 LYS N N 153 118.930 118.930 119.725 -0.795 18517 15179 1 13 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.042 0.158 18517 15180 1 13 . 1 1 85 85 LYS C C 153 179.650 179.650 179.580 0.070 18517 15181 1 13 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.859 1.121 18517 15182 1 13 . 1 1 85 85 LYS CB C 153 33.540 33.540 32.229 1.311 18517 15183 1 13 . 1 1 85 85 LYS H H 153 7.510 7.510 8.010 -0.500 18517 15184 1 13 . 1 1 86 86 VAL N N 154 119.810 119.810 119.668 0.142 18517 15185 1 13 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.586 0.044 18517 15186 1 13 . 1 1 86 86 VAL C C 154 178.350 178.350 178.413 -0.063 18517 15187 1 13 . 1 1 86 86 VAL CA C 154 67.230 67.230 67.001 0.229 18517 15188 1 13 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.684 1.056 18517 15189 1 13 . 1 1 86 86 VAL H H 154 8.740 8.740 8.522 0.218 18517 15190 1 13 . 1 1 87 87 TYR N N 155 118.370 118.370 118.163 0.207 18517 15191 1 13 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.296 -0.026 18517 15192 1 13 . 1 1 87 87 TYR C C 155 178.580 178.580 178.130 0.450 18517 15193 1 13 . 1 1 87 87 TYR CA C 155 62.910 62.910 60.782 2.128 18517 15194 1 13 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.395 0.585 18517 15195 1 13 . 1 1 87 87 TYR H H 155 8.520 8.520 8.390 0.130 18517 15196 1 13 . 1 1 88 88 GLU N N 156 119.900 119.900 120.539 -0.639 18517 15197 1 13 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.067 0.113 18517 15198 1 13 . 1 1 88 88 GLU C C 156 179.270 179.270 178.465 0.805 18517 15199 1 13 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.653 -0.272 18517 15200 1 13 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.543 0.667 18517 15201 1 13 . 1 1 88 88 GLU H H 156 8.250 8.250 8.394 -0.144 18517 15202 1 13 . 1 1 89 89 ILE N N 157 119.510 119.510 118.207 1.303 18517 15203 1 13 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.911 0.169 18517 15204 1 13 . 1 1 89 89 ILE C C 157 177.890 177.890 178.443 -0.553 18517 15205 1 13 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.462 -0.152 18517 15206 1 13 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.106 1.104 18517 15207 1 13 . 1 1 89 89 ILE H H 157 7.630 7.630 7.724 -0.094 18517 15208 1 13 . 1 1 90 90 THR N N 158 114.240 114.240 115.320 -1.080 18517 15209 1 13 . 1 1 90 90 THR HA H 158 4.130 4.130 4.064 0.066 18517 15210 1 13 . 1 1 90 90 THR C C 158 175.530 175.530 175.894 -0.364 18517 15211 1 13 . 1 1 90 90 THR CA C 158 64.460 64.460 66.187 -1.727 18517 15212 1 13 . 1 1 90 90 THR CB C 158 69.610 69.610 68.784 0.826 18517 15213 1 13 . 1 1 90 90 THR H H 158 7.770 7.770 8.030 -0.260 18517 15214 1 13 . 1 1 91 91 LYS N N 159 120.280 120.280 119.084 1.196 18517 15215 1 13 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.298 0.012 18517 15216 1 13 . 1 1 91 91 LYS C C 159 177.420 177.420 177.632 -0.212 18517 15217 1 13 . 1 1 91 91 LYS CA C 159 57.400 57.400 57.144 0.256 18517 15218 1 13 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.595 -0.375 18517 15219 1 13 . 1 1 91 91 LYS H H 159 7.890 7.890 8.072 -0.182 18517 15220 1 13 . 1 1 92 92 GLY N N 160 107.910 107.910 107.134 0.776 18517 15221 1 13 . 1 1 92 92 GLY C C 160 174.430 174.430 173.448 0.982 18517 15222 1 13 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.103 0.877 18517 15223 1 13 . 1 1 92 92 GLY H H 160 7.930 7.930 8.309 -0.379 18517 15224 1 13 . 1 1 93 93 THR N N 161 113.570 113.570 114.631 -1.061 18517 15225 1 13 . 1 1 93 93 THR HA H 161 4.390 4.390 4.612 -0.222 18517 15226 1 13 . 1 1 93 93 THR C C 161 174.790 174.790 173.752 1.038 18517 15227 1 13 . 1 1 93 93 THR CA C 161 61.960 61.960 60.693 1.267 18517 15228 1 13 . 1 1 93 93 THR CB C 161 70.010 70.010 71.719 -1.709 18517 15229 1 13 . 1 1 93 93 THR H H 161 7.970 7.970 7.308 0.662 18517 15230 1 13 . 1 1 94 94 VAL N N 162 121.980 121.980 123.349 -1.369 18517 15231 1 13 . 1 1 94 94 VAL HA H 162 4.120 4.120 3.763 0.357 18517 15232 1 13 . 1 1 94 94 VAL C C 162 176.300 176.300 175.227 1.073 18517 15233 1 13 . 1 1 94 94 VAL CA C 162 62.830 62.830 65.229 -2.399 18517 15234 1 13 . 1 1 94 94 VAL CB C 162 33.060 33.060 32.283 0.777 18517 15235 1 13 . 1 1 94 94 VAL H H 162 8.130 8.130 9.008 -0.878 18517 15236 1 13 . 1 1 95 95 GLU N N 163 124.140 124.140 115.828 8.312 18517 15237 1 13 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.251 0.059 18517 15238 1 13 . 1 1 95 95 GLU C C 163 176.870 176.870 175.477 1.393 18517 15239 1 13 . 1 1 95 95 GLU CA C 163 57.080 57.080 56.803 0.277 18517 15240 1 13 . 1 1 95 95 GLU CB C 163 30.440 30.440 29.486 0.954 18517 15241 1 13 . 1 1 95 95 GLU H H 163 8.490 8.490 8.412 0.078 18517 15242 1 13 . 1 1 96 96 SER N N 164 116.800 116.800 114.244 2.556 18517 15243 1 13 . 1 1 96 96 SER HA H 164 4.430 4.430 4.865 -0.435 18517 15244 1 13 . 1 1 96 96 SER C C 164 174.940 174.940 172.249 2.691 18517 15245 1 13 . 1 1 96 96 SER CA C 164 59.070 59.070 56.828 2.242 18517 15246 1 13 . 1 1 96 96 SER CB C 164 64.220 64.220 64.315 -0.095 18517 15247 1 13 . 1 1 96 96 SER H H 164 8.300 8.300 7.959 0.341 18517 15248 1 13 . 1 1 97 97 SER C C 165 174.660 174.660 173.641 1.019 18517 15249 1 13 . 1 1 97 97 SER CA C 165 58.870 58.870 57.579 1.291 18517 15250 1 13 . 1 1 97 97 SER CB C 165 64.060 64.060 65.439 -1.379 18517 15251 1 13 . 1 1 98 98 ALA N N 166 125.490 125.490 127.975 -2.485 18517 15252 1 13 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.606 -0.256 18517 15253 1 13 . 1 1 98 98 ALA C C 166 177.780 177.780 176.566 1.214 18517 15254 1 13 . 1 1 98 98 ALA CA C 166 53.000 53.000 51.346 1.654 18517 15255 1 13 . 1 1 98 98 ALA CB C 166 19.340 19.340 20.521 -1.181 18517 15256 1 13 . 1 1 98 98 ALA H H 166 8.180 8.180 8.455 -0.275 18517 15257 1 13 . 1 1 99 99 GLN N N 167 118.690 118.690 119.824 -1.134 18517 15258 1 13 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.096 0.244 18517 15259 1 13 . 1 1 99 99 GLN C C 167 176.680 176.680 175.309 1.371 18517 15260 1 13 . 1 1 99 99 GLN CA C 167 56.250 56.250 56.821 -0.571 18517 15261 1 13 . 1 1 99 99 GLN CB C 167 29.650 29.650 29.413 0.237 18517 15262 1 13 . 1 1 99 99 GLN H H 167 8.170 8.170 8.524 -0.354 18517 15263 1 13 . 1 1 100 100 GLY N N 168 109.670 109.670 110.250 -0.580 18517 15264 1 13 . 1 1 100 100 GLY C C 168 174.460 174.460 173.500 0.960 18517 15265 1 13 . 1 1 100 100 GLY CA C 168 45.670 45.670 44.764 0.906 18517 15266 1 13 . 1 1 100 100 GLY H H 168 8.250 8.250 8.294 -0.044 18517 15267 1 13 . 1 1 101 101 THR N N 169 112.660 112.660 117.790 -5.130 18517 15268 1 13 . 1 1 101 101 THR HA H 169 4.360 4.360 4.196 0.164 18517 15269 1 13 . 1 1 101 101 THR C C 169 174.720 174.720 174.542 0.178 18517 15270 1 13 . 1 1 101 101 THR CA C 169 62.080 62.080 62.189 -0.109 18517 15271 1 13 . 1 1 101 101 THR CB C 169 69.930 69.930 69.224 0.706 18517 15272 1 13 . 1 1 101 101 THR H H 169 8.070 8.070 8.165 -0.095 18517 15273 1 13 . 1 1 102 102 ASP N N 170 123.090 123.090 124.000 -0.910 18517 15274 1 13 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.964 -0.264 18517 15275 1 13 . 1 1 102 102 ASP C C 170 176.130 176.130 174.658 1.472 18517 15276 1 13 . 1 1 102 102 ASP CA C 170 54.780 54.780 52.604 2.176 18517 15277 1 13 . 1 1 102 102 ASP CB C 170 42.260 42.260 42.907 -0.647 18517 15278 1 13 . 1 1 102 102 ASP H H 170 8.170 8.170 8.251 -0.081 18517 15279 1 13 . 1 1 103 103 SER N N 171 117.110 117.110 112.885 4.225 18517 15280 1 13 . 1 1 103 103 SER HA H 171 4.430 4.430 4.571 -0.141 18517 15281 1 13 . 1 1 103 103 SER C C 171 174.770 174.770 174.028 0.742 18517 15282 1 13 . 1 1 103 103 SER CA C 171 57.960 57.960 57.115 0.845 18517 15283 1 13 . 1 1 103 103 SER CB C 171 64.940 64.940 65.035 -0.095 18517 15284 1 13 . 1 1 103 103 SER H H 171 8.450 8.450 7.909 0.541 18517 15285 1 13 . 1 1 104 104 GLU N N 172 122.970 122.970 123.449 -0.479 18517 15286 1 13 . 1 1 104 104 GLU HA H 172 4.030 4.030 4.013 0.017 18517 15287 1 13 . 1 1 104 104 GLU C C 172 178.860 178.860 177.903 0.957 18517 15288 1 13 . 1 1 104 104 GLU CA C 172 59.700 59.700 59.592 0.108 18517 15289 1 13 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.748 -0.099 18517 15290 1 13 . 1 1 104 104 GLU H H 172 8.830 8.830 9.009 -0.179 18517 15291 1 13 . 1 1 105 105 GLU N N 173 119.750 119.750 118.593 1.157 18517 15292 1 13 . 1 1 105 105 GLU HA H 173 3.980 3.980 3.987 -0.007 18517 15293 1 13 . 1 1 105 105 GLU C C 173 178.920 178.920 178.837 0.083 18517 15294 1 13 . 1 1 105 105 GLU CA C 173 60.060 60.060 59.096 0.964 18517 15295 1 13 . 1 1 105 105 GLU CB C 173 29.730 29.730 28.989 0.740 18517 15296 1 13 . 1 1 105 105 GLU H H 173 8.580 8.580 7.710 0.870 18517 15297 1 13 . 1 1 106 106 LEU N N 174 121.860 121.860 121.025 0.835 18517 15298 1 13 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.009 0.171 18517 15299 1 13 . 1 1 106 106 LEU C C 174 178.210 178.210 178.214 -0.004 18517 15300 1 13 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.961 -0.081 18517 15301 1 13 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.380 -0.230 18517 15302 1 13 . 1 1 106 106 LEU H H 174 7.920 7.920 7.534 0.386 18517 15303 1 13 . 1 1 107 107 LYS N N 175 118.740 118.740 119.196 -0.456 18517 15304 1 13 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.938 -0.158 18517 15305 1 13 . 1 1 107 107 LYS C C 175 178.700 178.700 179.313 -0.613 18517 15306 1 13 . 1 1 107 107 LYS CA C 175 61.170 61.170 59.434 1.736 18517 15307 1 13 . 1 1 107 107 LYS CB C 175 32.430 32.430 31.601 0.829 18517 15308 1 13 . 1 1 107 107 LYS H H 175 8.340 8.340 8.508 -0.168 18517 15309 1 13 . 1 1 108 108 THR N N 176 113.820 113.820 116.225 -2.405 18517 15310 1 13 . 1 1 108 108 THR HA H 176 3.840 3.840 4.064 -0.224 18517 15311 1 13 . 1 1 108 108 THR C C 176 176.620 176.620 176.339 0.281 18517 15312 1 13 . 1 1 108 108 THR CA C 176 66.910 66.910 66.621 0.289 18517 15313 1 13 . 1 1 108 108 THR CB C 176 69.610 69.610 68.581 1.029 18517 15314 1 13 . 1 1 108 108 THR H H 176 7.950 7.950 8.187 -0.236 18517 15315 1 13 . 1 1 109 109 LEU N N 177 124.380 124.380 123.438 0.942 18517 15316 1 13 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.036 -0.206 18517 15317 1 13 . 1 1 109 109 LEU C C 177 177.790 177.790 178.008 -0.218 18517 15318 1 13 . 1 1 109 109 LEU CA C 177 57.990 57.990 58.084 -0.093 18517 15319 1 13 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.557 1.023 18517 15320 1 13 . 1 1 109 109 LEU H H 177 7.480 7.480 7.972 -0.492 18517 15321 1 13 . 1 1 110 110 LEU N N 178 117.230 117.230 119.474 -2.244 18517 15322 1 13 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.747 0.093 18517 15323 1 13 . 1 1 110 110 LEU C C 178 179.540 179.540 179.217 0.323 18517 15324 1 13 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.950 0.440 18517 15325 1 13 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.252 1.088 18517 15326 1 13 . 1 1 110 110 LEU H H 178 8.670 8.670 8.443 0.227 18517 15327 1 13 . 1 1 111 111 LEU N N 179 119.230 119.230 121.204 -1.974 18517 15328 1 13 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.131 -0.051 18517 15329 1 13 . 1 1 111 111 LEU C C 179 179.310 179.310 179.381 -0.071 18517 15330 1 13 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.603 0.787 18517 15331 1 13 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.676 1.344 18517 15332 1 13 . 1 1 111 111 LEU H H 179 7.940 7.940 8.420 -0.480 18517 15333 1 13 . 1 1 112 112 LYS N N 180 121.910 121.910 120.223 1.687 18517 15334 1 13 . 1 1 112 112 LYS HA H 180 4.190 4.190 3.996 0.194 18517 15335 1 13 . 1 1 112 112 LYS C C 180 178.740 178.740 178.904 -0.164 18517 15336 1 13 . 1 1 112 112 LYS CA C 180 59.180 59.180 60.024 -0.844 18517 15337 1 13 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.487 -0.617 18517 15338 1 13 . 1 1 112 112 LYS H H 180 7.420 7.420 8.101 -0.681 18517 15339 1 13 . 1 1 113 113 PHE N N 181 118.220 118.220 118.428 -0.208 18517 15340 1 13 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.166 0.584 18517 15341 1 13 . 1 1 113 113 PHE C C 181 178.520 178.520 178.087 0.433 18517 15342 1 13 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.355 -3.275 18517 15343 1 13 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.342 -0.362 18517 15344 1 13 . 1 1 113 113 PHE H H 181 9.000 9.000 8.981 0.019 18517 15345 1 13 . 1 1 114 114 SER N N 182 113.300 113.300 115.335 -2.035 18517 15346 1 13 . 1 1 114 114 SER HA H 182 3.930 3.930 4.013 -0.083 18517 15347 1 13 . 1 1 114 114 SER C C 182 177.080 177.080 176.834 0.246 18517 15348 1 13 . 1 1 114 114 SER CA C 182 62.000 62.000 62.295 -0.295 18517 15349 1 13 . 1 1 114 114 SER CB C 182 63.510 63.510 62.569 0.941 18517 15350 1 13 . 1 1 114 114 SER H H 182 8.620 8.620 8.656 -0.036 18517 15351 1 13 . 1 1 115 115 GLU N N 183 121.540 121.540 122.804 -1.264 18517 15352 1 13 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.017 0.053 18517 15353 1 13 . 1 1 115 115 GLU C C 183 179.860 179.860 178.848 1.012 18517 15354 1 13 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.401 0.379 18517 15355 1 13 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.484 0.406 18517 15356 1 13 . 1 1 115 115 GLU H H 183 8.250 8.250 8.162 0.088 18517 15357 1 13 . 1 1 116 116 ASP N N 184 121.740 121.740 120.594 1.146 18517 15358 1 13 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.461 0.049 18517 15359 1 13 . 1 1 116 116 ASP C C 184 179.570 179.570 178.536 1.034 18517 15360 1 13 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.559 0.001 18517 15361 1 13 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.969 0.021 18517 15362 1 13 . 1 1 116 116 ASP H H 184 8.840 8.840 8.551 0.289 18517 15363 1 13 . 1 1 117 117 LEU N N 185 121.420 121.420 121.299 0.121 18517 15364 1 13 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.069 0.061 18517 15365 1 13 . 1 1 117 117 LEU C C 185 178.840 178.840 178.340 0.500 18517 15366 1 13 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.004 0.226 18517 15367 1 13 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.932 0.718 18517 15368 1 13 . 1 1 117 117 LEU H H 185 8.350 8.350 8.014 0.336 18517 15369 1 13 . 1 1 118 118 LYS N N 186 119.640 119.640 119.756 -0.116 18517 15370 1 13 . 1 1 118 118 LYS HA H 186 4.120 4.120 4.206 -0.086 18517 15371 1 13 . 1 1 118 118 LYS C C 186 178.820 178.820 178.808 0.012 18517 15372 1 13 . 1 1 118 118 LYS CA C 186 59.740 59.740 58.856 0.884 18517 15373 1 13 . 1 1 118 118 LYS CB C 186 32.510 32.510 31.913 0.596 18517 15374 1 13 . 1 1 118 118 LYS H H 186 8.220 8.220 8.081 0.139 18517 15375 1 13 . 1 1 119 119 ALA N N 187 120.160 120.160 120.849 -0.689 18517 15376 1 13 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.260 -0.100 18517 15377 1 13 . 1 1 119 119 ALA C C 187 180.450 180.450 179.776 0.674 18517 15378 1 13 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.224 -0.084 18517 15379 1 13 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.138 0.332 18517 15380 1 13 . 1 1 119 119 ALA H H 187 8.010 8.010 8.261 -0.251 18517 15381 1 13 . 1 1 120 120 GLU N N 188 117.930 117.930 118.844 -0.914 18517 15382 1 13 . 1 1 120 120 GLU HA H 188 4.180 4.180 4.005 0.175 18517 15383 1 13 . 1 1 120 120 GLU C C 188 178.780 178.780 179.058 -0.278 18517 15384 1 13 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.468 -0.638 18517 15385 1 13 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.450 0.520 18517 15386 1 13 . 1 1 120 120 GLU H H 188 7.640 7.640 8.338 -0.698 18517 15387 1 13 . 1 1 121 121 GLN N N 189 117.230 117.230 117.640 -0.410 18517 15388 1 13 . 1 1 121 121 GLN HA H 189 4.230 4.230 4.079 0.151 18517 15389 1 13 . 1 1 121 121 GLN C C 189 179.190 179.190 178.264 0.926 18517 15390 1 13 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.675 1.065 18517 15391 1 13 . 1 1 121 121 GLN CB C 189 29.650 29.650 29.238 0.412 18517 15392 1 13 . 1 1 121 121 GLN H H 189 8.280 8.280 8.133 0.147 18517 15393 1 13 . 1 1 122 122 GLU N N 190 118.340 118.340 120.771 -2.431 18517 15394 1 13 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.603 0.517 18517 15395 1 13 . 1 1 122 122 GLU C C 190 178.210 178.210 178.931 -0.721 18517 15396 1 13 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.905 -0.155 18517 15397 1 13 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.039 0.931 18517 15398 1 13 . 1 1 122 122 GLU H H 190 8.250 8.250 8.121 0.129 18517 15399 1 13 . 1 1 123 123 LEU N N 191 118.930 118.930 121.582 -2.652 18517 15400 1 13 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.912 0.178 18517 15401 1 13 . 1 1 123 123 LEU C C 191 178.500 178.500 178.886 -0.386 18517 15402 1 13 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.325 -1.325 18517 15403 1 13 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.642 0.858 18517 15404 1 13 . 1 1 123 123 LEU H H 191 7.530 7.530 8.234 -0.704 18517 15405 1 13 . 1 1 124 124 HIS N N 192 115.650 115.650 118.585 -2.935 18517 15406 1 13 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.178 0.542 18517 15407 1 13 . 1 1 124 124 HIS C C 192 176.090 176.090 177.514 -1.424 18517 15408 1 13 . 1 1 124 124 HIS CA C 192 56.690 56.690 59.761 -3.071 18517 15409 1 13 . 1 1 124 124 HIS CB C 192 30.760 30.760 30.354 0.406 18517 15410 1 13 . 1 1 124 124 HIS H H 192 7.450 7.450 8.203 -0.753 18517 15411 1 13 . 1 1 125 125 SER N N 193 115.480 115.480 115.495 -0.015 18517 15412 1 13 . 1 1 125 125 SER HA H 193 4.310 4.310 3.912 0.398 18517 15413 1 13 . 1 1 125 125 SER CA C 193 60.180 60.180 61.839 -1.659 18517 15414 1 13 . 1 1 125 125 SER CB C 193 64.060 64.060 62.841 1.219 18517 15415 1 13 . 1 1 125 125 SER H H 193 8.020 8.020 8.405 -0.385 18517 15416 1 13 . 1 1 126 126 GLU C C 194 177.410 177.410 179.167 -1.757 18517 15417 1 13 . 1 1 126 126 GLU CA C 194 57.840 57.840 59.163 -1.323 18517 15418 1 13 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.704 0.186 18517 15419 1 13 . 1 1 127 127 ALA N N 195 122.910 122.910 122.355 0.555 18517 15420 1 13 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.075 0.115 18517 15421 1 13 . 1 1 127 127 ALA C C 195 178.610 178.610 179.301 -0.691 18517 15422 1 13 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.752 -0.962 18517 15423 1 13 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.631 0.629 18517 15424 1 13 . 1 1 127 127 ALA H H 195 8.020 8.020 7.724 0.296 18517 15425 1 13 . 1 1 128 128 LYS N N 196 117.770 117.770 115.199 2.571 18517 15426 1 13 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.364 -0.104 18517 15427 1 13 . 1 1 128 128 LYS C C 196 177.400 177.400 176.122 1.278 18517 15428 1 13 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.525 2.475 18517 15429 1 13 . 1 1 128 128 LYS CB C 196 32.740 32.740 32.242 0.498 18517 15430 1 13 . 1 1 128 128 LYS H H 196 7.990 7.990 7.665 0.325 18517 15431 1 13 . 1 1 129 129 GLY N N 197 109.010 109.010 109.420 -0.410 18517 15432 1 13 . 1 1 129 129 GLY C C 197 175.770 175.770 175.554 0.216 18517 15433 1 13 . 1 1 129 129 GLY CA C 197 46.100 46.100 44.815 1.285 18517 15434 1 13 . 1 1 129 129 GLY H H 197 8.220 8.220 7.610 0.610 18517 15435 1 13 . 1 1 130 130 GLY N N 198 109.150 109.150 111.065 -1.915 18517 15436 1 13 . 1 1 130 130 GLY C C 198 174.760 174.760 175.592 -0.832 18517 15437 1 13 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.012 -0.082 18517 15438 1 13 . 1 1 130 130 GLY H H 198 8.210 8.210 8.341 -0.131 18517 15439 1 13 . 1 1 131 131 GLU N N 199 121.560 121.560 121.592 -0.032 18517 15440 1 13 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.106 -0.086 18517 15441 1 13 . 1 1 131 131 GLU C C 199 178.500 178.500 179.218 -0.718 18517 15442 1 13 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.604 0.296 18517 15443 1 13 . 1 1 131 131 GLU CB C 199 29.570 29.570 29.106 0.464 18517 15444 1 13 . 1 1 131 131 GLU H H 199 8.510 8.510 8.841 -0.331 18517 15445 1 13 . 1 1 132 132 ALA N N 200 122.390 122.390 122.400 -0.010 18517 15446 1 13 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.193 0.007 18517 15447 1 13 . 1 1 132 132 ALA C C 200 180.360 180.360 179.940 0.420 18517 15448 1 13 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.680 0.100 18517 15449 1 13 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.166 0.224 18517 15450 1 13 . 1 1 132 132 ALA H H 200 8.190 8.190 7.591 0.599 18517 15451 1 13 . 1 1 133 133 LEU N N 201 120.800 120.800 121.264 -0.464 18517 15452 1 13 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.227 -0.017 18517 15453 1 13 . 1 1 133 133 LEU C C 201 179.270 179.270 179.516 -0.246 18517 15454 1 13 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.853 -0.173 18517 15455 1 13 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.996 0.184 18517 15456 1 13 . 1 1 133 133 LEU H H 201 7.720 7.720 8.435 -0.715 18517 15457 1 13 . 1 1 134 134 LEU N N 202 120.680 120.680 120.376 0.304 18517 15458 1 13 . 1 1 134 134 LEU HA H 202 3.980 3.980 4.078 -0.098 18517 15459 1 13 . 1 1 134 134 LEU C C 202 179.030 179.030 178.579 0.451 18517 15460 1 13 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.508 0.922 18517 15461 1 13 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.292 0.328 18517 15462 1 13 . 1 1 134 134 LEU H H 202 8.470 8.470 8.613 -0.143 18517 15463 1 13 . 1 1 135 135 SER N N 203 113.290 113.290 114.977 -1.687 18517 15464 1 13 . 1 1 135 135 SER HA H 203 4.180 4.180 4.145 0.035 18517 15465 1 13 . 1 1 135 135 SER C C 203 177.300 177.300 176.874 0.426 18517 15466 1 13 . 1 1 135 135 SER CA C 203 62.080 62.080 62.209 -0.129 18517 15467 1 13 . 1 1 135 135 SER CB C 203 63.030 63.030 62.871 0.159 18517 15468 1 13 . 1 1 135 135 SER H H 203 8.210 8.210 8.546 -0.336 18517 15469 1 13 . 1 1 136 136 SER N N 204 117.500 117.500 118.447 -0.947 18517 15470 1 13 . 1 1 136 136 SER HA H 204 4.050 4.050 4.278 -0.228 18517 15471 1 13 . 1 1 136 136 SER C C 204 177.570 177.570 176.804 0.766 18517 15472 1 13 . 1 1 136 136 SER CA C 204 61.880 61.880 61.149 0.731 18517 15473 1 13 . 1 1 136 136 SER CB C 204 63.510 63.510 62.410 1.100 18517 15474 1 13 . 1 1 136 136 SER H H 204 7.730 7.730 8.362 -0.632 18517 15475 1 13 . 1 1 137 137 MET N N 205 122.500 122.500 123.466 -0.966 18517 15476 1 13 . 1 1 137 137 MET HA H 205 4.140 4.140 4.107 0.033 18517 15477 1 13 . 1 1 137 137 MET C C 205 177.680 177.680 178.564 -0.884 18517 15478 1 13 . 1 1 137 137 MET CA C 205 60.140 60.140 59.608 0.532 18517 15479 1 13 . 1 1 137 137 MET CB C 205 33.460 33.460 32.507 0.953 18517 15480 1 13 . 1 1 137 137 MET H H 205 8.170 8.170 8.418 -0.248 18517 15481 1 13 . 1 1 138 138 LYS N N 206 121.410 121.410 119.071 2.339 18517 15482 1 13 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.946 -0.196 18517 15483 1 13 . 1 1 138 138 LYS C C 206 178.780 178.780 179.224 -0.444 18517 15484 1 13 . 1 1 138 138 LYS CA C 206 60.330 60.330 59.942 0.388 18517 15485 1 13 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.416 -0.146 18517 15486 1 13 . 1 1 138 138 LYS H H 206 8.810 8.810 8.165 0.645 18517 15487 1 13 . 1 1 139 139 THR N N 207 116.580 116.580 116.541 0.039 18517 15488 1 13 . 1 1 139 139 THR HA H 207 4.060 4.060 4.023 0.037 18517 15489 1 13 . 1 1 139 139 THR C C 207 176.730 176.730 177.061 -0.331 18517 15490 1 13 . 1 1 139 139 THR CA C 207 67.150 67.150 66.859 0.291 18517 15491 1 13 . 1 1 139 139 THR CB C 207 69.220 69.220 68.435 0.785 18517 15492 1 13 . 1 1 139 139 THR H H 207 7.930 7.930 8.188 -0.258 18517 15493 1 13 . 1 1 140 140 GLN N N 208 121.390 121.390 120.230 1.160 18517 15494 1 13 . 1 1 140 140 GLN HA H 208 4.060 4.060 3.979 0.081 18517 15495 1 13 . 1 1 140 140 GLN C C 208 178.550 178.550 178.164 0.386 18517 15496 1 13 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.502 -0.202 18517 15497 1 13 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.716 0.144 18517 15498 1 13 . 1 1 140 140 GLN H H 208 7.600 7.600 8.219 -0.619 18517 15499 1 13 . 1 1 141 141 HIS N N 209 122.360 122.360 119.523 2.837 18517 15500 1 13 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.314 -0.484 18517 15501 1 13 . 1 1 141 141 HIS C C 209 176.390 176.390 177.417 -1.027 18517 15502 1 13 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.231 1.489 18517 15503 1 13 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.139 -1.039 18517 15504 1 13 . 1 1 141 141 HIS H H 209 8.980 8.980 8.281 0.699 18517 15505 1 13 . 1 1 142 142 ASP N N 210 120.740 120.740 119.561 1.179 18517 15506 1 13 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.413 -0.063 18517 15507 1 13 . 1 1 142 142 ASP C C 210 179.490 179.490 178.410 1.080 18517 15508 1 13 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.780 0.140 18517 15509 1 13 . 1 1 142 142 ASP CB C 210 40.590 40.590 41.028 -0.438 18517 15510 1 13 . 1 1 142 142 ASP H H 210 8.770 8.770 8.431 0.339 18517 15511 1 13 . 1 1 143 143 GLU N N 211 119.010 119.010 120.893 -1.883 18517 15512 1 13 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.061 -0.091 18517 15513 1 13 . 1 1 143 143 GLU C C 211 179.070 179.070 179.034 0.036 18517 15514 1 13 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.213 0.087 18517 15515 1 13 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.427 0.063 18517 15516 1 13 . 1 1 143 143 GLU H H 211 7.850 7.850 8.051 -0.201 18517 15517 1 13 . 1 1 144 144 LEU N N 212 122.500 122.500 120.022 2.478 18517 15518 1 13 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.135 -0.065 18517 15519 1 13 . 1 1 144 144 LEU C C 212 179.340 179.340 179.483 -0.143 18517 15520 1 13 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.221 0.169 18517 15521 1 13 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.185 0.995 18517 15522 1 13 . 1 1 144 144 LEU H H 212 8.070 8.070 8.389 -0.319 18517 15523 1 13 . 1 1 145 145 LEU N N 213 118.110 118.110 118.656 -0.546 18517 15524 1 13 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.838 0.361 18517 15525 1 13 . 1 1 145 145 LEU C C 213 179.610 179.610 179.265 0.345 18517 15526 1 13 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.973 0.777 18517 15527 1 13 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.272 -0.042 18517 15528 1 13 . 1 1 145 145 LEU H H 213 8.370 8.370 8.236 0.134 18517 15529 1 13 . 1 1 146 146 LYS N N 214 117.290 117.290 119.899 -2.609 18517 15530 1 13 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.966 -0.136 18517 15531 1 13 . 1 1 146 146 LYS C C 214 179.900 179.900 178.675 1.225 18517 15532 1 13 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.087 1.243 18517 15533 1 13 . 1 1 146 146 LYS CB C 214 32.350 32.350 31.882 0.468 18517 15534 1 13 . 1 1 146 146 LYS H H 214 7.560 7.560 8.566 -1.006 18517 15535 1 13 . 1 1 147 147 LYS N N 215 120.330 120.330 119.022 1.308 18517 15536 1 13 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.009 0.011 18517 15537 1 13 . 1 1 147 147 LYS C C 215 180.550 180.550 179.498 1.052 18517 15538 1 13 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.358 0.742 18517 15539 1 13 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.288 0.452 18517 15540 1 13 . 1 1 147 147 LYS H H 215 7.830 7.830 7.902 -0.072 18517 15541 1 13 . 1 1 148 148 PHE N N 216 117.370 117.370 117.798 -0.428 18517 15542 1 13 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.237 -0.157 18517 15543 1 13 . 1 1 148 148 PHE C C 216 178.200 178.200 177.307 0.893 18517 15544 1 13 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.208 0.912 18517 15545 1 13 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.460 1.260 18517 15546 1 13 . 1 1 148 148 PHE H H 216 8.010 8.010 8.305 -0.295 18517 15547 1 13 . 1 1 149 149 ALA N N 217 118.990 118.990 121.157 -2.167 18517 15548 1 13 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.284 -0.174 18517 15549 1 13 . 1 1 149 149 ALA C C 217 177.330 177.330 178.176 -0.846 18517 15550 1 13 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.394 0.356 18517 15551 1 13 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.742 -1.142 18517 15552 1 13 . 1 1 149 149 ALA H H 217 7.720 7.720 7.879 -0.159 18517 15553 1 13 . 1 1 150 150 ALA N N 218 118.690 118.690 120.481 -1.791 18517 15554 1 13 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.291 0.069 18517 15555 1 13 . 1 1 150 150 ALA C C 218 177.930 177.930 177.904 0.026 18517 15556 1 13 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.668 -0.578 18517 15557 1 13 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.362 0.378 18517 15558 1 13 . 1 1 150 150 ALA H H 218 7.280 7.280 7.825 -0.545 18517 15559 1 13 . 1 1 151 151 LEU N N 219 119.980 119.980 121.371 -1.391 18517 15560 1 13 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.335 -0.065 18517 15561 1 13 . 1 1 151 151 LEU C C 219 176.150 176.150 175.283 0.867 18517 15562 1 13 . 1 1 151 151 LEU CA C 219 56.170 56.170 55.309 0.860 18517 15563 1 13 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.481 -0.671 18517 15564 1 13 . 1 1 151 151 LEU H H 219 7.050 7.050 7.367 -0.317 18517 15565 1 13 . 1 1 152 152 THR N N 220 112.070 112.070 117.113 -5.043 18517 15566 1 13 . 1 1 152 152 THR HA H 220 4.700 4.700 4.738 -0.038 18517 15567 1 13 . 1 1 152 152 THR C C 220 173.400 173.400 173.633 -0.233 18517 15568 1 13 . 1 1 152 152 THR CA C 220 58.190 58.190 58.157 0.033 18517 15569 1 13 . 1 1 152 152 THR CB C 220 70.960 70.960 69.510 1.450 18517 15570 1 13 . 1 1 152 152 THR H H 220 8.040 8.040 8.133 -0.093 18517 15571 1 13 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.592 0.118 18517 15572 1 13 . 1 1 153 153 PRO C C 221 176.720 176.720 176.519 0.201 18517 15573 1 13 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.099 0.811 18517 15574 1 13 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.696 1.554 18517 15575 1 13 . 1 1 154 154 THR N N 222 120.460 120.460 115.954 4.506 18517 15576 1 13 . 1 1 154 154 THR HA H 222 4.250 4.250 4.565 -0.315 18517 15577 1 13 . 1 1 154 154 THR C C 222 175.190 175.190 174.912 0.278 18517 15578 1 13 . 1 1 154 154 THR CA C 222 64.650 64.650 62.344 2.306 18517 15579 1 13 . 1 1 154 154 THR CB C 222 70.410 70.410 68.759 1.651 18517 15580 1 13 . 1 1 154 154 THR H H 222 8.530 8.530 8.394 0.136 18517 15581 1 13 . 1 1 155 155 PHE N N 223 122.260 122.260 122.812 -0.552 18517 15582 1 13 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.767 0.223 18517 15583 1 13 . 1 1 155 155 PHE C C 223 172.560 172.560 174.355 -1.795 18517 15584 1 13 . 1 1 155 155 PHE CA C 223 56.770 56.770 56.858 -0.089 18517 15585 1 13 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.350 1.240 18517 15586 1 13 . 1 1 155 155 PHE H H 223 8.950 8.950 7.706 1.244 18517 15587 1 13 . 1 1 156 156 LEU N N 224 123.440 123.440 120.060 3.380 18517 15588 1 13 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.387 0.283 18517 15589 1 13 . 1 1 156 156 LEU C C 224 175.090 175.090 177.296 -2.206 18517 15590 1 13 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.142 -0.112 18517 15591 1 13 . 1 1 156 156 LEU CB C 224 46.300 46.300 42.750 3.550 18517 15592 1 13 . 1 1 156 156 LEU H H 224 7.210 7.210 7.329 -0.119 18517 15593 1 13 . 1 1 157 157 THR N N 225 113.010 113.010 111.967 1.043 18517 15594 1 13 . 1 1 157 157 THR HA H 225 4.790 4.790 4.571 0.219 18517 15595 1 13 . 1 1 157 157 THR C C 225 176.130 176.130 174.876 1.254 18517 15596 1 13 . 1 1 157 157 THR CA C 225 59.860 59.860 60.921 -1.061 18517 15597 1 13 . 1 1 157 157 THR CB C 225 72.860 72.860 69.497 3.363 18517 15598 1 13 . 1 1 157 157 THR H H 225 9.200 9.200 8.189 1.011 18517 15599 1 13 . 1 1 158 158 SER N N 226 115.350 115.350 115.784 -0.434 18517 15600 1 13 . 1 1 158 158 SER C C 226 177.410 177.410 175.908 1.502 18517 15601 1 13 . 1 1 158 158 SER CA C 226 57.400 57.400 56.921 0.479 18517 15602 1 13 . 1 1 158 158 SER CB C 226 66.200 66.200 64.102 2.098 18517 15603 1 13 . 1 1 158 158 SER H H 226 8.830 8.830 8.538 0.292 18517 15604 1 13 . 1 1 159 159 GLU N N 227 121.200 121.200 125.180 -3.980 18517 15605 1 13 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.949 0.071 18517 15606 1 13 . 1 1 159 159 GLU C C 227 177.680 177.680 176.701 0.979 18517 15607 1 13 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.349 1.151 18517 15608 1 13 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.270 0.300 18517 15609 1 13 . 1 1 159 159 GLU H H 227 8.320 8.320 8.933 -0.613 18517 15610 1 13 . 1 1 160 160 ASP N N 228 115.350 115.350 119.363 -4.013 18517 15611 1 13 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.368 0.182 18517 15612 1 13 . 1 1 160 160 ASP C C 228 177.640 177.640 178.383 -0.743 18517 15613 1 13 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.994 0.406 18517 15614 1 13 . 1 1 160 160 ASP CB C 228 43.050 43.050 41.070 1.980 18517 15615 1 13 . 1 1 160 160 ASP H H 228 7.570 7.570 7.618 -0.048 18517 15616 1 13 . 1 1 161 161 ILE N N 229 108.150 108.150 115.816 -7.666 18517 15617 1 13 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.238 0.272 18517 15618 1 13 . 1 1 161 161 ILE C C 229 173.130 173.130 177.549 -4.419 18517 15619 1 13 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.647 -1.357 18517 15620 1 13 . 1 1 161 161 ILE CB C 229 39.400 39.400 38.621 0.779 18517 15621 1 13 . 1 1 161 161 ILE H H 229 7.190 7.190 7.532 -0.342 18517 15622 1 13 . 1 1 162 162 SER N N 230 115.290 115.290 117.655 -2.365 18517 15623 1 13 . 1 1 162 162 SER HA H 230 4.760 4.760 3.790 0.970 18517 15624 1 13 . 1 1 162 162 SER C C 230 176.060 176.060 174.103 1.957 18517 15625 1 13 . 1 1 162 162 SER CA C 230 57.920 57.920 57.818 0.102 18517 15626 1 13 . 1 1 162 162 SER CB C 230 66.120 66.120 61.985 4.135 18517 15627 1 13 . 1 1 162 162 SER H H 230 7.460 7.460 8.192 -0.732 18517 15628 1 13 . 1 1 163 163 GLY C C 231 173.260 173.260 173.075 0.185 18517 15629 1 13 . 1 1 163 163 GLY CA C 231 45.550 45.550 45.022 0.528 18517 15630 1 13 . 1 1 164 164 TYR N N 232 115.290 115.290 118.960 -3.670 18517 15631 1 13 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.660 0.040 18517 15632 1 13 . 1 1 164 164 TYR C C 232 172.820 172.820 173.607 -0.787 18517 15633 1 13 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.189 -0.089 18517 15634 1 13 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.691 0.109 18517 15635 1 13 . 1 1 164 164 TYR H H 232 7.370 7.370 7.313 0.057 18517 15636 1 13 . 1 1 165 165 LEU N N 233 120.980 120.980 121.690 -0.710 18517 15637 1 13 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.670 -0.240 18517 15638 1 13 . 1 1 165 165 LEU C C 233 176.360 176.360 177.577 -1.217 18517 15639 1 13 . 1 1 165 165 LEU CA C 233 55.660 55.660 53.710 1.950 18517 15640 1 13 . 1 1 165 165 LEU CB C 233 40.430 40.430 43.170 -2.740 18517 15641 1 13 . 1 1 165 165 LEU H H 233 8.830 8.830 8.784 0.046 18517 15642 1 13 . 1 1 166 166 THR N N 234 116.170 116.170 117.636 -1.466 18517 15643 1 13 . 1 1 166 166 THR HA H 234 4.010 4.010 3.493 0.517 18517 15644 1 13 . 1 1 166 166 THR C C 234 173.070 173.070 173.614 -0.544 18517 15645 1 13 . 1 1 166 166 THR CA C 234 62.910 62.910 63.331 -0.421 18517 15646 1 13 . 1 1 166 166 THR CB C 234 70.170 70.170 68.702 1.468 18517 15647 1 13 . 1 1 166 166 THR H H 234 8.050 8.050 8.648 -0.598 18517 15648 1 13 . 1 1 167 167 VAL N N 235 117.640 117.640 114.533 3.107 18517 15649 1 13 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.412 -0.202 18517 15650 1 13 . 1 1 167 167 VAL C C 235 172.330 172.330 173.765 -1.435 18517 15651 1 13 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.893 0.857 18517 15652 1 13 . 1 1 167 167 VAL CB C 235 35.880 35.880 32.208 3.672 18517 15653 1 13 . 1 1 167 167 VAL H H 235 7.160 7.160 7.312 -0.152 18517 15654 1 13 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.350 -0.160 18517 15655 1 13 . 1 1 168 168 PRO C C 236 173.710 173.710 175.980 -2.270 18517 15656 1 13 . 1 1 168 168 PRO CA C 236 62.830 62.830 62.470 0.360 18517 15657 1 13 . 1 1 168 168 PRO CB C 236 32.270 32.270 32.786 -0.516 18517 15658 1 13 . 1 1 169 169 GLU N N 237 113.540 113.540 117.938 -4.398 18517 15659 1 13 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.012 0.368 18517 15660 1 13 . 1 1 169 169 GLU C C 237 176.690 176.690 178.524 -1.834 18517 15661 1 13 . 1 1 169 169 GLU CA C 237 53.750 53.750 54.404 -0.653 18517 15662 1 13 . 1 1 169 169 GLU CB C 237 33.220 33.220 31.163 2.057 18517 15663 1 13 . 1 1 169 169 GLU H H 237 7.930 7.930 8.429 -0.499 18517 15664 1 13 . 1 1 170 170 TYR N N 238 119.400 119.400 121.383 -1.983 18517 15665 1 13 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.265 -0.265 18517 15666 1 13 . 1 1 170 170 TYR C C 238 177.610 177.610 176.332 1.278 18517 15667 1 13 . 1 1 170 170 TYR CA C 238 62.630 62.630 59.697 2.933 18517 15668 1 13 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.377 -0.637 18517 15669 1 13 . 1 1 170 170 TYR H H 238 8.490 8.490 8.192 0.298 18517 15670 1 13 . 1 1 171 171 GLY N N 239 104.160 104.160 103.237 0.923 18517 15671 1 13 . 1 1 171 171 GLY C C 239 173.350 173.350 173.020 0.330 18517 15672 1 13 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.135 1.135 18517 15673 1 13 . 1 1 171 171 GLY H H 239 7.960 7.960 8.297 -0.337 18517 15674 1 13 . 1 1 172 172 ALA N N 240 121.860 121.860 123.862 -2.002 18517 15675 1 13 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.997 -0.827 18517 15676 1 13 . 1 1 172 172 ALA C C 240 172.160 172.160 174.404 -2.244 18517 15677 1 13 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.025 1.085 18517 15678 1 13 . 1 1 172 172 ALA CB C 240 20.930 20.930 19.909 1.021 18517 15679 1 13 . 1 1 172 172 ALA H H 240 6.910 6.910 7.816 -0.906 18517 15680 1 13 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.728 0.822 18517 15681 1 13 . 1 1 173 173 PRO C C 241 176.610 176.610 175.710 0.900 18517 15682 1 13 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.336 -0.815 18517 15683 1 13 . 1 1 173 173 PRO CB C 241 33.300 33.300 32.744 0.556 18517 15684 1 13 . 1 1 174 174 MET N N 242 114.000 114.000 118.421 -4.421 18517 15685 1 13 . 1 1 174 174 MET HA H 242 4.390 4.390 4.408 -0.018 18517 15686 1 13 . 1 1 174 174 MET C C 242 173.960 173.960 174.202 -0.242 18517 15687 1 13 . 1 1 174 174 MET CA C 242 54.660 54.660 54.103 0.557 18517 15688 1 13 . 1 1 174 174 MET CB C 242 34.170 34.170 36.591 -2.421 18517 15689 1 13 . 1 1 174 174 MET H H 242 8.040 8.040 7.586 0.454 18517 15690 1 13 . 1 1 175 175 ASN N N 243 119.570 119.570 119.997 -0.427 18517 15691 1 13 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.742 0.198 18517 15692 1 13 . 1 1 175 175 ASN C C 243 174.320 174.320 175.249 -0.929 18517 15693 1 13 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.461 0.619 18517 15694 1 13 . 1 1 175 175 ASN CB C 243 38.850 38.850 39.288 -0.438 18517 15695 1 13 . 1 1 175 175 ASN H H 243 7.960 7.960 8.239 -0.279 18517 15696 1 13 . 1 1 176 176 ALA N N 244 132.250 132.250 129.378 2.872 18517 15697 1 13 . 1 1 176 176 ALA C C 244 181.580 181.580 178.290 3.290 18517 15698 1 13 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.222 0.548 18517 15699 1 13 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.654 0.376 18517 15700 1 13 . 1 1 176 176 ALA H H 244 12.110 12.110 8.248 3.862 18517 15701 1 13 . 1 1 177 177 ALA N N 245 125.780 125.780 121.036 4.744 18517 15702 1 13 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.982 -0.112 18517 15703 1 13 . 1 1 177 177 ALA C C 245 180.640 180.640 179.681 0.959 18517 15704 1 13 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.154 0.506 18517 15705 1 13 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.074 -0.234 18517 15706 1 13 . 1 1 177 177 ALA H H 245 10.240 10.240 8.366 1.874 18517 15707 1 13 . 1 1 178 178 LYS N N 246 119.810 119.810 119.163 0.647 18517 15708 1 13 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.091 -0.261 18517 15709 1 13 . 1 1 178 178 LYS C C 246 180.500 180.500 178.521 1.979 18517 15710 1 13 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.302 0.598 18517 15711 1 13 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.597 -1.277 18517 15712 1 13 . 1 1 178 178 LYS H H 246 8.470 8.470 8.017 0.453 18517 15713 1 13 . 1 1 179 179 TRP N N 247 121.170 121.170 121.870 -0.700 18517 15714 1 13 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.461 0.159 18517 15715 1 13 . 1 1 179 179 TRP C C 247 176.510 176.510 177.740 -1.230 18517 15716 1 13 . 1 1 179 179 TRP CA C 247 59.820 59.820 60.168 -0.348 18517 15717 1 13 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.743 -0.173 18517 15718 1 13 . 1 1 179 179 TRP H H 247 8.330 8.330 8.325 0.005 18517 15719 1 13 . 1 1 180 180 ALA N N 248 119.130 119.130 121.427 -2.297 18517 15720 1 13 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.833 0.707 18517 15721 1 13 . 1 1 180 180 ALA C C 248 182.110 182.110 179.041 3.069 18517 15722 1 13 . 1 1 180 180 ALA CA C 248 54.190 54.190 55.127 -0.938 18517 15723 1 13 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.086 0.624 18517 15724 1 13 . 1 1 180 180 ALA H H 248 7.990 7.990 8.703 -0.713 18517 15725 1 13 . 1 1 181 181 LYS N N 249 116.000 116.000 118.309 -2.309 18517 15726 1 13 . 1 1 181 181 LYS HA H 249 3.970 3.970 3.980 -0.010 18517 15727 1 13 . 1 1 181 181 LYS C C 249 179.380 179.380 179.025 0.355 18517 15728 1 13 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.426 -0.716 18517 15729 1 13 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.508 0.002 18517 15730 1 13 . 1 1 181 181 LYS H H 249 6.900 6.900 7.782 -0.882 18517 15731 1 13 . 1 1 182 182 VAL N N 250 122.270 122.270 116.410 5.860 18517 15732 1 13 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.594 -0.254 18517 15733 1 13 . 1 1 182 182 VAL C C 250 178.160 178.160 177.581 0.579 18517 15734 1 13 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.206 0.554 18517 15735 1 13 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.346 -0.506 18517 15736 1 13 . 1 1 182 182 VAL H H 250 7.050 7.050 7.827 -0.777 18517 15737 1 13 . 1 1 183 183 GLU N N 251 120.520 120.520 120.057 0.463 18517 15738 1 13 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.985 -0.805 18517 15739 1 13 . 1 1 183 183 GLU C C 251 179.480 179.480 178.961 0.519 18517 15740 1 13 . 1 1 183 183 GLU CA C 251 60.690 60.690 58.541 2.149 18517 15741 1 13 . 1 1 183 183 GLU CB C 251 28.070 28.070 29.215 -1.145 18517 15742 1 13 . 1 1 183 183 GLU H H 251 8.020 8.020 8.605 -0.585 18517 15743 1 13 . 1 1 184 184 GLY N N 252 102.930 102.930 107.750 -4.820 18517 15744 1 13 . 1 1 184 184 GLY C C 252 176.920 176.920 176.315 0.605 18517 15745 1 13 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.022 0.388 18517 15746 1 13 . 1 1 184 184 GLY H H 252 7.830 7.830 7.948 -0.118 18517 15747 1 13 . 1 1 185 185 MET N N 253 123.200 123.200 121.071 2.129 18517 15748 1 13 . 1 1 185 185 MET HA H 253 4.250 4.250 4.114 0.136 18517 15749 1 13 . 1 1 185 185 MET C C 253 179.370 179.370 177.958 1.412 18517 15750 1 13 . 1 1 185 185 MET CA C 253 59.300 59.300 59.297 0.002 18517 15751 1 13 . 1 1 185 185 MET CB C 253 33.930 33.930 32.592 1.338 18517 15752 1 13 . 1 1 185 185 MET H H 253 7.890 7.890 7.943 -0.053 18517 15753 1 13 . 1 1 186 186 ILE N N 254 120.150 120.150 120.016 0.134 18517 15754 1 13 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.624 -0.064 18517 15755 1 13 . 1 1 186 186 ILE C C 254 177.250 177.250 178.131 -0.881 18517 15756 1 13 . 1 1 186 186 ILE CA C 254 66.520 66.520 64.892 1.628 18517 15757 1 13 . 1 1 186 186 ILE CB C 254 38.290 38.290 36.565 1.725 18517 15758 1 13 . 1 1 186 186 ILE H H 254 8.260 8.260 8.148 0.112 18517 15759 1 13 . 1 1 187 187 HIS N N 255 119.810 119.810 119.804 0.006 18517 15760 1 13 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.256 -0.256 18517 15761 1 13 . 1 1 187 187 HIS C C 255 176.460 176.460 177.536 -1.076 18517 15762 1 13 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.658 0.672 18517 15763 1 13 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.593 2.037 18517 15764 1 13 . 1 1 187 187 HIS H H 255 8.900 8.900 8.299 0.601 18517 15765 1 13 . 1 1 188 188 GLY N N 256 103.160 103.160 106.337 -3.177 18517 15766 1 13 . 1 1 188 188 GLY C C 256 176.320 176.320 175.985 0.335 18517 15767 1 13 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.768 0.122 18517 15768 1 13 . 1 1 188 188 GLY H H 256 8.030 8.030 8.222 -0.192 18517 15769 1 13 . 1 1 189 189 LYS N N 257 119.510 119.510 121.276 -1.766 18517 15770 1 13 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.223 -0.223 18517 15771 1 13 . 1 1 189 189 LYS C C 257 178.660 178.660 179.249 -0.589 18517 15772 1 13 . 1 1 189 189 LYS CA C 257 56.490 56.490 56.754 -0.264 18517 15773 1 13 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.758 -0.208 18517 15774 1 13 . 1 1 189 189 LYS H H 257 7.120 7.120 7.774 -0.654 18517 15775 1 13 . 1 1 190 190 LEU N N 258 120.570 120.570 120.655 -0.085 18517 15776 1 13 . 1 1 190 190 LEU HA H 258 3.930 3.930 4.017 -0.087 18517 15777 1 13 . 1 1 190 190 LEU C C 258 177.230 177.230 177.454 -0.224 18517 15778 1 13 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.194 0.326 18517 15779 1 13 . 1 1 190 190 LEU CB C 258 42.970 42.970 41.328 1.642 18517 15780 1 13 . 1 1 190 190 LEU H H 258 8.060 8.060 8.252 -0.192 18517 15781 1 13 . 1 1 191 191 GLU N N 259 114.590 114.590 115.191 -0.601 18517 15782 1 13 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.136 0.144 18517 15783 1 13 . 1 1 191 191 GLU C C 259 176.230 176.230 176.785 -0.555 18517 15784 1 13 . 1 1 191 191 GLU CA C 259 55.340 55.340 56.190 -0.850 18517 15785 1 13 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.522 -0.192 18517 15786 1 13 . 1 1 191 191 GLU H H 259 7.330 7.330 7.688 -0.358 18517 15787 1 13 . 1 1 192 192 SER N N 260 115.240 115.240 117.819 -2.579 18517 15788 1 13 . 1 1 192 192 SER HA H 260 4.490 4.490 4.352 0.138 18517 15789 1 13 . 1 1 192 192 SER C C 260 173.770 173.770 174.878 -1.108 18517 15790 1 13 . 1 1 192 192 SER CA C 260 58.350 58.350 58.754 -0.404 18517 15791 1 13 . 1 1 192 192 SER CB C 260 65.090 65.090 63.669 1.421 18517 15792 1 13 . 1 1 192 192 SER H H 260 7.130 7.130 7.523 -0.393 18517 15793 1 13 . 1 1 193 193 SER C C 261 174.600 174.600 174.814 -0.214 18517 15794 1 13 . 1 1 193 193 SER CA C 261 59.980 59.980 60.172 -0.192 18517 15795 1 13 . 1 1 193 193 SER CB C 261 63.750 63.750 63.283 0.467 18517 15796 1 13 . 1 1 194 194 GLU N N 262 121.800 121.800 122.228 -0.428 18517 15797 1 13 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.493 -0.023 18517 15798 1 13 . 1 1 194 194 GLU C C 262 174.650 174.650 175.046 -0.396 18517 15799 1 13 . 1 1 194 194 GLU CA C 262 55.620 55.620 55.270 0.350 18517 15800 1 13 . 1 1 194 194 GLU CB C 262 30.210 30.210 29.279 0.931 18517 15801 1 13 . 1 1 194 194 GLU H H 262 7.840 7.840 8.449 -0.609 18517 15802 1 13 . 1 1 195 195 VAL N N 263 124.080 124.080 125.630 -1.550 18517 15803 1 13 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.370 -0.120 18517 15804 1 13 . 1 1 195 195 VAL C C 263 174.460 174.460 173.908 0.552 18517 15805 1 13 . 1 1 195 195 VAL CA C 263 59.820 59.820 58.697 1.123 18517 15806 1 13 . 1 1 195 195 VAL CB C 263 33.620 33.620 32.857 0.763 18517 15807 1 13 . 1 1 195 195 VAL H H 263 8.020 8.020 8.083 -0.063 18517 15808 1 13 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.389 0.131 18517 15809 1 13 . 1 1 198 198 ASN C C 266 176.490 176.490 177.167 -0.677 18517 15810 1 13 . 1 1 198 198 ASN CA C 266 54.780 54.780 56.168 -1.388 18517 15811 1 13 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.511 0.549 18517 15812 1 13 . 1 1 199 199 LEU N N 267 120.680 120.680 122.863 -2.183 18517 15813 1 13 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.922 0.088 18517 15814 1 13 . 1 1 199 199 LEU C C 267 178.050 178.050 178.230 -0.180 18517 15815 1 13 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.055 0.775 18517 15816 1 13 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.792 0.548 18517 15817 1 13 . 1 1 199 199 LEU H H 267 7.660 7.660 7.699 -0.039 18517 15818 1 13 . 1 1 200 200 LYS N N 268 116.740 116.740 118.693 -1.953 18517 15819 1 13 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.784 -0.054 18517 15820 1 13 . 1 1 200 200 LYS C C 268 178.520 178.520 178.710 -0.190 18517 15821 1 13 . 1 1 200 200 LYS CA C 268 61.800 61.800 59.913 1.887 18517 15822 1 13 . 1 1 200 200 LYS CB C 268 32.110 32.110 32.334 -0.224 18517 15823 1 13 . 1 1 200 200 LYS H H 268 8.280 8.280 8.534 -0.254 18517 15824 1 13 . 1 1 201 201 ALA N N 269 121.270 121.270 122.392 -1.122 18517 15825 1 13 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.124 0.116 18517 15826 1 13 . 1 1 201 201 ALA C C 269 180.890 180.890 179.889 1.001 18517 15827 1 13 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.047 0.133 18517 15828 1 13 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.244 0.227 18517 15829 1 13 . 1 1 201 201 ALA H H 269 7.710 7.710 8.006 -0.296 18517 15830 1 13 . 1 1 202 202 LEU N N 270 119.980 119.980 119.641 0.339 18517 15831 1 13 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.953 0.137 18517 15832 1 13 . 1 1 202 202 LEU C C 270 179.330 179.330 179.562 -0.232 18517 15833 1 13 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.610 0.460 18517 15834 1 13 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.210 1.210 18517 15835 1 13 . 1 1 202 202 LEU H H 270 7.750 7.750 8.484 -0.734 18517 15836 1 13 . 1 1 203 203 VAL N N 271 118.450 118.450 119.784 -1.334 18517 15837 1 13 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.946 -0.116 18517 15838 1 13 . 1 1 203 203 VAL C C 271 177.110 177.110 178.150 -1.040 18517 15839 1 13 . 1 1 203 203 VAL CA C 271 67.710 67.710 66.782 0.928 18517 15840 1 13 . 1 1 203 203 VAL CB C 271 31.710 31.710 30.834 0.876 18517 15841 1 13 . 1 1 203 203 VAL H H 271 8.560 8.560 8.578 -0.018 18517 15842 1 13 . 1 1 204 204 ALA N N 272 122.560 122.560 122.387 0.173 18517 15843 1 13 . 1 1 204 204 ALA HA H 272 3.880 3.880 3.979 -0.099 18517 15844 1 13 . 1 1 204 204 ALA C C 272 178.700 178.700 179.537 -0.837 18517 15845 1 13 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.483 0.646 18517 15846 1 13 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.236 0.154 18517 15847 1 13 . 1 1 204 204 ALA H H 272 8.120 8.120 8.378 -0.258 18517 15848 1 13 . 1 1 205 205 GLU N N 273 117.290 117.290 119.379 -2.089 18517 15849 1 13 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.035 -0.045 18517 15850 1 13 . 1 1 205 205 GLU C C 273 178.630 178.630 179.067 -0.437 18517 15851 1 13 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.351 0.789 18517 15852 1 13 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.643 0.327 18517 15853 1 13 . 1 1 205 205 GLU H H 273 7.670 7.670 8.167 -0.497 18517 15854 1 13 . 1 1 206 206 LEU N N 274 120.450 120.450 121.529 -1.079 18517 15855 1 13 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.031 -0.031 18517 15856 1 13 . 1 1 206 206 LEU C C 274 178.400 178.400 178.710 -0.310 18517 15857 1 13 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.150 0.760 18517 15858 1 13 . 1 1 206 206 LEU CB C 274 43.530 43.530 42.073 1.457 18517 15859 1 13 . 1 1 206 206 LEU H H 274 8.420 8.420 8.490 -0.070 18517 15860 1 13 . 1 1 207 207 ILE N N 275 117.580 117.580 120.266 -2.686 18517 15861 1 13 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.543 -0.013 18517 15862 1 13 . 1 1 207 207 ILE C C 275 178.850 178.850 178.059 0.791 18517 15863 1 13 . 1 1 207 207 ILE CA C 275 66.080 66.080 65.810 0.270 18517 15864 1 13 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.646 1.124 18517 15865 1 13 . 1 1 207 207 ILE H H 275 8.700 8.700 8.419 0.281 18517 15866 1 13 . 1 1 208 208 GLU N N 276 119.100 119.100 119.168 -0.068 18517 15867 1 13 . 1 1 208 208 GLU HA H 276 4.000 4.000 4.065 -0.065 18517 15868 1 13 . 1 1 208 208 GLU C C 276 178.540 178.540 179.692 -1.152 18517 15869 1 13 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.273 1.177 18517 15870 1 13 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.250 1.270 18517 15871 1 13 . 1 1 208 208 GLU H H 276 7.950 7.950 8.261 -0.311 18517 15872 1 13 . 1 1 209 209 LEU N N 277 120.590 120.590 119.658 0.932 18517 15873 1 13 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.076 0.144 18517 15874 1 13 . 1 1 209 209 LEU C C 277 179.520 179.520 179.150 0.370 18517 15875 1 13 . 1 1 209 209 LEU CA C 277 58.350 58.350 57.909 0.441 18517 15876 1 13 . 1 1 209 209 LEU CB C 277 43.290 43.290 40.950 2.340 18517 15877 1 13 . 1 1 209 209 LEU H H 277 8.550 8.550 8.575 -0.025 18517 15878 1 13 . 1 1 210 210 ARG N N 278 116.470 116.470 118.358 -1.888 18517 15879 1 13 . 1 1 210 210 ARG HA H 278 3.740 3.740 4.136 -0.396 18517 15880 1 13 . 1 1 210 210 ARG C C 278 179.190 179.190 179.066 0.124 18517 15881 1 13 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.766 1.915 18517 15882 1 13 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.155 1.245 18517 15883 1 13 . 1 1 210 210 ARG H H 278 8.590 8.590 8.579 0.011 18517 15884 1 13 . 1 1 211 211 ALA N N 279 120.470 120.470 123.019 -2.549 18517 15885 1 13 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.062 -0.152 18517 15886 1 13 . 1 1 211 211 ALA C C 279 181.350 181.350 179.581 1.769 18517 15887 1 13 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.311 0.389 18517 15888 1 13 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.435 -1.155 18517 15889 1 13 . 1 1 211 211 ALA H H 279 8.050 8.050 8.420 -0.370 18517 15890 1 13 . 1 1 212 212 GLN N N 280 120.070 120.070 117.703 2.367 18517 15891 1 13 . 1 1 212 212 GLN HA H 280 4.020 4.020 4.053 -0.033 18517 15892 1 13 . 1 1 212 212 GLN C C 280 179.490 179.490 178.579 0.911 18517 15893 1 13 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.480 0.820 18517 15894 1 13 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.770 0.410 18517 15895 1 13 . 1 1 212 212 GLN H H 280 8.300 8.300 8.229 0.071 18517 15896 1 13 . 1 1 213 213 MET N N 281 119.810 119.810 121.174 -1.364 18517 15897 1 13 . 1 1 213 213 MET HA H 281 3.730 3.730 4.241 -0.511 18517 15898 1 13 . 1 1 213 213 MET C C 281 177.490 177.490 178.108 -0.618 18517 15899 1 13 . 1 1 213 213 MET CA C 281 60.690 60.690 58.130 2.559 18517 15900 1 13 . 1 1 213 213 MET CB C 281 33.930 33.930 32.481 1.449 18517 15901 1 13 . 1 1 213 213 MET H H 281 8.420 8.420 8.425 -0.005 18517 15902 1 13 . 1 1 214 214 MET N N 282 114.000 114.000 118.433 -4.433 18517 15903 1 13 . 1 1 214 214 MET HA H 282 3.880 3.880 4.299 -0.419 18517 15904 1 13 . 1 1 214 214 MET C C 282 177.650 177.650 177.992 -0.342 18517 15905 1 13 . 1 1 214 214 MET CA C 282 58.670 58.670 57.599 1.071 18517 15906 1 13 . 1 1 214 214 MET CB C 282 33.300 33.300 31.902 1.398 18517 15907 1 13 . 1 1 214 214 MET H H 282 7.890 7.890 8.337 -0.447 18517 15908 1 13 . 1 1 215 215 ALA N N 283 119.970 119.970 122.722 -2.752 18517 15909 1 13 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.105 0.035 18517 15910 1 13 . 1 1 215 215 ALA C C 283 180.580 180.580 179.011 1.569 18517 15911 1 13 . 1 1 215 215 ALA CA C 283 54.110 54.110 54.909 -0.799 18517 15912 1 13 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.119 -0.439 18517 15913 1 13 . 1 1 215 215 ALA H H 283 7.580 7.580 8.167 -0.587 18517 15914 1 13 . 1 1 216 216 LEU N N 284 120.920 120.920 118.448 2.472 18517 15915 1 13 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.230 -0.270 18517 15916 1 13 . 1 1 216 216 LEU C C 284 177.910 177.910 179.546 -1.636 18517 15917 1 13 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.191 0.729 18517 15918 1 13 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.250 0.250 18517 15919 1 13 . 1 1 216 216 LEU H H 284 7.460 7.460 7.955 -0.495 18517 15920 1 13 . 1 1 217 217 LEU N N 285 116.470 116.470 121.841 -5.371 18517 15921 1 13 . 1 1 217 217 LEU HA H 285 3.680 3.680 4.060 -0.380 18517 15922 1 13 . 1 1 217 217 LEU C C 285 178.310 178.310 177.092 1.218 18517 15923 1 13 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.703 -0.263 18517 15924 1 13 . 1 1 217 217 LEU CB C 285 43.050 43.050 42.225 0.825 18517 15925 1 13 . 1 1 217 217 LEU H H 285 6.980 6.980 8.509 -1.529 18517 15926 1 13 . 1 1 218 218 TYR N N 286 111.080 111.080 113.825 -2.745 18517 15927 1 13 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.572 0.328 18517 15928 1 13 . 1 1 218 218 TYR C C 286 176.090 176.090 176.151 -0.061 18517 15929 1 13 . 1 1 218 218 TYR CA C 286 56.050 56.050 56.936 -0.886 18517 15930 1 13 . 1 1 218 218 TYR CB C 286 40.910 40.910 37.480 3.430 18517 15931 1 13 . 1 1 218 218 TYR H H 286 7.660 7.660 8.010 -0.350 18517 15932 1 13 . 1 1 219 219 GLY N N 287 108.260 108.260 110.404 -2.144 18517 15933 1 13 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.675 0.645 18517 15934 1 13 . 1 1 219 219 GLY H H 287 7.750 7.750 7.535 0.215 18517 15935 1 13 . 1 1 221 221 ILE HA H 289 3.490 3.490 4.184 -0.694 18517 15936 1 13 . 1 1 221 221 ILE CA C 289 63.580 63.580 60.382 3.198 18517 15937 1 13 . 1 1 221 221 ILE CB C 289 38.280 38.280 39.117 -0.837 18517 15938 1 13 . 1 1 222 222 GLY CA C 290 45.740 45.740 44.685 1.054 18517 15939 1 14 . 1 1 2 2 LYS N N 70 126.600 126.600 121.837 4.763 18517 15940 1 14 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.149 0.211 18517 15941 1 14 . 1 1 2 2 LYS C C 70 176.000 176.000 174.760 1.240 18517 15942 1 14 . 1 1 2 2 LYS CA C 70 56.450 56.450 56.942 -0.492 18517 15943 1 14 . 1 1 2 2 LYS CB C 70 33.850 33.850 32.370 1.480 18517 15944 1 14 . 1 1 2 2 LYS H H 70 8.530 8.530 8.457 0.073 18517 15945 1 14 . 1 1 3 3 THR N N 71 111.030 111.030 114.761 -3.731 18517 15946 1 14 . 1 1 3 3 THR HA H 71 4.400 4.400 4.536 -0.136 18517 15947 1 14 . 1 1 3 3 THR C C 71 175.650 175.650 175.320 0.330 18517 15948 1 14 . 1 1 3 3 THR CA C 71 60.610 60.610 60.184 0.425 18517 15949 1 14 . 1 1 3 3 THR CB C 71 71.520 71.520 70.165 1.355 18517 15950 1 14 . 1 1 3 3 THR H H 71 7.390 7.390 7.917 -0.527 18517 15951 1 14 . 1 1 4 4 LEU N N 72 121.560 121.560 122.690 -1.130 18517 15952 1 14 . 1 1 4 4 LEU C C 72 177.870 177.870 177.667 0.203 18517 15953 1 14 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.314 0.166 18517 15954 1 14 . 1 1 4 4 LEU CB C 72 42.180 42.180 42.013 0.167 18517 15955 1 14 . 1 1 4 4 LEU H H 72 8.980 8.980 8.668 0.312 18517 15956 1 14 . 1 1 5 5 ASP N N 73 115.530 115.530 117.104 -1.574 18517 15957 1 14 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.401 -0.071 18517 15958 1 14 . 1 1 5 5 ASP C C 73 179.290 179.290 178.265 1.025 18517 15959 1 14 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.498 0.342 18517 15960 1 14 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.565 0.265 18517 15961 1 14 . 1 1 5 5 ASP H H 73 8.270 8.270 8.732 -0.462 18517 15962 1 14 . 1 1 6 6 VAL N N 74 122.330 122.330 119.869 2.461 18517 15963 1 14 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.705 0.035 18517 15964 1 14 . 1 1 6 6 VAL C C 74 178.970 178.970 177.505 1.465 18517 15965 1 14 . 1 1 6 6 VAL CA C 74 66.360 66.360 66.233 0.128 18517 15966 1 14 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.898 0.052 18517 15967 1 14 . 1 1 6 6 VAL H H 74 7.400 7.400 7.358 0.042 18517 15968 1 14 . 1 1 7 7 LEU N N 75 121.360 121.360 120.423 0.937 18517 15969 1 14 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.874 0.156 18517 15970 1 14 . 1 1 7 7 LEU C C 75 179.240 179.240 178.818 0.422 18517 15971 1 14 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.556 -0.326 18517 15972 1 14 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.149 1.741 18517 15973 1 14 . 1 1 7 7 LEU H H 75 8.300 8.300 8.583 -0.283 18517 15974 1 14 . 1 1 8 8 ARG N N 76 117.230 117.230 119.994 -2.764 18517 15975 1 14 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.243 -0.323 18517 15976 1 14 . 1 1 8 8 ARG C C 76 178.290 178.290 179.007 -0.717 18517 15977 1 14 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.732 1.038 18517 15978 1 14 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.972 0.238 18517 15979 1 14 . 1 1 8 8 ARG H H 76 8.520 8.520 8.896 -0.376 18517 15980 1 14 . 1 1 9 9 GLY N N 77 104.570 104.570 107.464 -2.894 18517 15981 1 14 . 1 1 9 9 GLY C C 77 176.180 176.180 176.450 -0.270 18517 15982 1 14 . 1 1 9 9 GLY CA C 77 47.170 47.170 47.049 0.121 18517 15983 1 14 . 1 1 9 9 GLY H H 77 7.620 7.620 8.310 -0.690 18517 15984 1 14 . 1 1 10 10 GLU N N 78 120.270 120.270 122.885 -2.615 18517 15985 1 14 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.093 0.177 18517 15986 1 14 . 1 1 10 10 GLU C C 78 179.030 179.030 179.263 -0.233 18517 15987 1 14 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.005 -0.135 18517 15988 1 14 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.203 2.197 18517 15989 1 14 . 1 1 10 10 GLU H H 78 8.100 8.100 8.252 -0.152 18517 15990 1 14 . 1 1 11 11 LEU N N 79 116.000 116.000 120.482 -4.482 18517 15991 1 14 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.968 0.542 18517 15992 1 14 . 1 1 11 11 LEU C C 79 179.630 179.630 178.869 0.761 18517 15993 1 14 . 1 1 11 11 LEU CA C 79 56.690 56.690 57.927 -1.237 18517 15994 1 14 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.587 3.213 18517 15995 1 14 . 1 1 11 11 LEU H H 79 8.230 8.230 8.655 -0.425 18517 15996 1 14 . 1 1 12 12 ARG N N 80 120.020 120.020 119.659 0.361 18517 15997 1 14 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.936 -0.186 18517 15998 1 14 . 1 1 12 12 ARG C C 80 178.490 178.490 178.507 -0.017 18517 15999 1 14 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.985 2.015 18517 16000 1 14 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.916 1.324 18517 16001 1 14 . 1 1 12 12 ARG H H 80 8.210 8.210 8.812 -0.602 18517 16002 1 14 . 1 1 13 13 GLY N N 81 108.090 108.090 106.934 1.156 18517 16003 1 14 . 1 1 13 13 GLY C C 81 173.540 173.540 176.740 -3.200 18517 16004 1 14 . 1 1 13 13 GLY CA C 81 48.000 48.000 47.250 0.750 18517 16005 1 14 . 1 1 13 13 GLY H H 81 8.890 8.890 8.567 0.323 18517 16006 1 14 . 1 1 14 14 GLN C C 82 179.540 179.540 179.049 0.491 18517 16007 1 14 . 1 1 14 14 GLN CA C 82 58.710 58.710 58.778 -0.068 18517 16008 1 14 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.247 0.853 18517 16009 1 14 . 1 1 15 15 ARG N N 83 118.220 118.220 119.707 -1.487 18517 16010 1 14 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.019 -0.069 18517 16011 1 14 . 1 1 15 15 ARG C C 83 177.710 177.710 178.897 -1.187 18517 16012 1 14 . 1 1 15 15 ARG CA C 83 59.900 59.900 60.325 -0.425 18517 16013 1 14 . 1 1 15 15 ARG CB C 83 29.650 29.650 30.236 -0.586 18517 16014 1 14 . 1 1 15 15 ARG H H 83 7.320 7.320 8.769 -1.449 18517 16015 1 14 . 1 1 16 16 GLU N N 84 118.810 118.810 120.167 -1.357 18517 16016 1 14 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.193 -0.343 18517 16017 1 14 . 1 1 16 16 GLU C C 84 178.750 178.750 178.848 -0.098 18517 16018 1 14 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.230 1.780 18517 16019 1 14 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.733 -0.323 18517 16020 1 14 . 1 1 16 16 GLU H H 84 8.450 8.450 8.669 -0.219 18517 16021 1 14 . 1 1 17 17 ALA N N 85 122.790 122.790 122.857 -0.067 18517 16022 1 14 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.103 0.087 18517 16023 1 14 . 1 1 17 17 ALA C C 85 180.360 180.360 179.299 1.061 18517 16024 1 14 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.269 0.191 18517 16025 1 14 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.368 -0.288 18517 16026 1 14 . 1 1 17 17 ALA H H 85 8.420 8.420 8.334 0.086 18517 16027 1 14 . 1 1 18 18 PHE N N 86 119.400 119.400 119.861 -0.461 18517 16028 1 14 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.232 0.058 18517 16029 1 14 . 1 1 18 18 PHE C C 86 177.560 177.560 177.345 0.215 18517 16030 1 14 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.622 0.018 18517 16031 1 14 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.304 0.336 18517 16032 1 14 . 1 1 18 18 PHE H H 86 7.490 7.490 8.154 -0.664 18517 16033 1 14 . 1 1 19 19 LEU N N 87 117.470 117.470 119.794 -2.324 18517 16034 1 14 . 1 1 19 19 LEU HA H 87 4.070 4.070 4.048 0.022 18517 16035 1 14 . 1 1 19 19 LEU C C 87 178.880 178.880 178.601 0.279 18517 16036 1 14 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.318 -0.358 18517 16037 1 14 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.685 0.414 18517 16038 1 14 . 1 1 19 19 LEU H H 87 8.010 8.010 8.528 -0.518 18517 16039 1 14 . 1 1 20 20 SER N N 88 113.770 113.770 114.928 -1.158 18517 16040 1 14 . 1 1 20 20 SER HA H 88 4.070 4.070 4.141 -0.071 18517 16041 1 14 . 1 1 20 20 SER C C 88 175.680 175.680 176.907 -1.227 18517 16042 1 14 . 1 1 20 20 SER CA C 88 63.070 63.070 62.530 0.540 18517 16043 1 14 . 1 1 20 20 SER H H 88 8.100 8.100 8.394 -0.294 18517 16044 1 14 . 1 1 21 21 GLU N N 89 120.570 120.570 121.924 -1.354 18517 16045 1 14 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.060 -0.090 18517 16046 1 14 . 1 1 21 21 GLU C C 89 178.940 178.940 178.626 0.314 18517 16047 1 14 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.070 0.190 18517 16048 1 14 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.244 0.086 18517 16049 1 14 . 1 1 21 21 GLU H H 89 7.400 7.400 7.886 -0.486 18517 16050 1 14 . 1 1 22 22 ILE N N 90 119.350 119.350 118.763 0.587 18517 16051 1 14 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.942 -0.252 18517 16052 1 14 . 1 1 22 22 ILE C C 90 177.230 177.230 178.981 -1.751 18517 16053 1 14 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.675 0.795 18517 16054 1 14 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.866 -0.476 18517 16055 1 14 . 1 1 22 22 ILE H H 90 7.250 7.250 8.026 -0.776 18517 16056 1 14 . 1 1 23 23 ILE N N 91 116.350 116.350 119.785 -3.435 18517 16057 1 14 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.886 -0.486 18517 16058 1 14 . 1 1 23 23 ILE C C 91 176.690 176.690 177.129 -0.439 18517 16059 1 14 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.293 2.437 18517 16060 1 14 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.557 0.213 18517 16061 1 14 . 1 1 23 23 ILE H H 91 7.860 7.860 8.173 -0.313 18517 16062 1 14 . 1 1 24 24 LYS N N 92 116.000 116.000 117.288 -1.288 18517 16063 1 14 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.265 -0.125 18517 16064 1 14 . 1 1 24 24 LYS C C 92 176.270 176.270 176.848 -0.578 18517 16065 1 14 . 1 1 24 24 LYS CA C 92 57.480 57.480 56.602 0.877 18517 16066 1 14 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.987 0.313 18517 16067 1 14 . 1 1 24 24 LYS H H 92 7.170 7.170 8.045 -0.875 18517 16068 1 14 . 1 1 25 25 SER N N 93 114.650 114.650 116.117 -1.467 18517 16069 1 14 . 1 1 25 25 SER HA H 93 4.550 4.550 4.550 -0.000 18517 16070 1 14 . 1 1 25 25 SER C C 93 173.370 173.370 173.138 0.232 18517 16071 1 14 . 1 1 25 25 SER CA C 93 57.240 57.240 58.191 -0.951 18517 16072 1 14 . 1 1 25 25 SER CB C 93 65.650 65.650 65.022 0.629 18517 16073 1 14 . 1 1 25 25 SER H H 93 7.730 7.730 7.982 -0.252 18517 16074 1 14 . 1 1 26 26 ASP N N 94 121.230 121.230 124.908 -3.678 18517 16075 1 14 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.809 0.121 18517 16076 1 14 . 1 1 26 26 ASP C C 94 176.560 176.560 175.946 0.614 18517 16077 1 14 . 1 1 26 26 ASP CA C 94 54.510 54.510 54.014 0.496 18517 16078 1 14 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.530 1.120 18517 16079 1 14 . 1 1 26 26 ASP H H 94 8.280 8.280 8.591 -0.311 18517 16080 1 14 . 1 1 27 27 GLY N N 95 109.310 109.310 108.190 1.120 18517 16081 1 14 . 1 1 27 27 GLY C C 95 171.080 171.080 172.011 -0.931 18517 16082 1 14 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.077 -0.307 18517 16083 1 14 . 1 1 27 27 GLY H H 95 8.160 8.160 7.544 0.616 18517 16084 1 14 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.708 0.432 18517 16085 1 14 . 1 1 29 29 PHE C C 97 175.230 175.230 176.195 -0.965 18517 16086 1 14 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.489 0.001 18517 16087 1 14 . 1 1 29 29 PHE CB C 97 41.620 41.620 40.707 0.913 18517 16088 1 14 . 1 1 30 30 THR N N 98 112.600 112.600 117.510 -4.910 18517 16089 1 14 . 1 1 30 30 THR HA H 98 4.570 4.570 4.151 0.419 18517 16090 1 14 . 1 1 30 30 THR C C 98 176.690 176.690 175.427 1.263 18517 16091 1 14 . 1 1 30 30 THR CA C 98 60.290 60.290 61.240 -0.950 18517 16092 1 14 . 1 1 30 30 THR CB C 98 71.600 71.600 70.391 1.209 18517 16093 1 14 . 1 1 30 30 THR H H 98 8.990 8.990 8.304 0.686 18517 16094 1 14 . 1 1 31 31 ILE N N 99 119.240 119.240 124.679 -5.439 18517 16095 1 14 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.565 0.255 18517 16096 1 14 . 1 1 31 31 ILE C C 99 176.090 176.090 176.592 -0.502 18517 16097 1 14 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.759 -3.619 18517 16098 1 14 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.872 -0.922 18517 16099 1 14 . 1 1 31 31 ILE H H 99 9.230 9.230 7.993 1.237 18517 16100 1 14 . 1 1 32 32 LEU N N 100 119.660 119.660 118.988 0.672 18517 16101 1 14 . 1 1 32 32 LEU HA H 100 4.030 4.030 3.917 0.113 18517 16102 1 14 . 1 1 32 32 LEU C C 100 181.050 181.050 179.143 1.907 18517 16103 1 14 . 1 1 32 32 LEU CA C 100 57.560 57.560 58.158 -0.598 18517 16104 1 14 . 1 1 32 32 LEU CB C 100 40.120 40.120 41.026 -0.906 18517 16105 1 14 . 1 1 32 32 LEU H H 100 7.310 7.310 8.080 -0.770 18517 16106 1 14 . 1 1 33 33 GLN N N 101 121.450 121.450 118.337 3.113 18517 16107 1 14 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.426 -0.176 18517 16108 1 14 . 1 1 33 33 GLN CA C 101 59.700 59.700 59.064 0.636 18517 16109 1 14 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.509 3.281 18517 16110 1 14 . 1 1 33 33 GLN H H 101 7.790 7.790 7.839 -0.049 18517 16111 1 14 . 1 1 34 34 LEU C C 102 178.590 178.590 179.126 -0.536 18517 16112 1 14 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.013 0.618 18517 16113 1 14 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.588 -0.278 18517 16114 1 14 . 1 1 35 35 VAL N N 103 118.520 118.520 118.391 0.129 18517 16115 1 14 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.720 -0.300 18517 16116 1 14 . 1 1 35 35 VAL C C 103 177.930 177.930 178.391 -0.461 18517 16117 1 14 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.402 -0.362 18517 16118 1 14 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.548 1.082 18517 16119 1 14 . 1 1 35 35 VAL H H 103 8.670 8.670 8.428 0.242 18517 16120 1 14 . 1 1 36 36 GLY N N 104 109.430 109.430 108.672 0.758 18517 16121 1 14 . 1 1 36 36 GLY C C 104 174.600 174.600 175.732 -1.132 18517 16122 1 14 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.324 0.716 18517 16123 1 14 . 1 1 36 36 GLY H H 104 7.880 7.880 8.165 -0.285 18517 16124 1 14 . 1 1 37 37 TYR N N 105 122.270 122.270 124.064 -1.794 18517 16125 1 14 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.413 -0.533 18517 16126 1 14 . 1 1 37 37 TYR C C 105 176.310 176.310 177.125 -0.815 18517 16127 1 14 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.370 3.729 18517 16128 1 14 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.798 -0.428 18517 16129 1 14 . 1 1 37 37 TYR H H 105 8.170 8.170 8.121 0.049 18517 16130 1 14 . 1 1 38 38 LEU N N 106 120.100 120.100 121.657 -1.557 18517 16131 1 14 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.820 -0.080 18517 16132 1 14 . 1 1 38 38 LEU C C 106 178.280 178.280 178.235 0.045 18517 16133 1 14 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.201 0.429 18517 16134 1 14 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.607 1.123 18517 16135 1 14 . 1 1 38 38 LEU H H 106 7.610 7.610 8.481 -0.871 18517 16136 1 14 . 1 1 39 39 ARG N N 107 116.670 116.670 118.577 -1.907 18517 16137 1 14 . 1 1 39 39 ARG HA H 107 3.680 3.680 4.199 -0.519 18517 16138 1 14 . 1 1 39 39 ARG C C 107 179.480 179.480 178.504 0.976 18517 16139 1 14 . 1 1 39 39 ARG CA C 107 59.580 59.580 59.272 0.308 18517 16140 1 14 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.892 1.348 18517 16141 1 14 . 1 1 39 39 ARG H H 107 8.240 8.240 8.072 0.168 18517 16142 1 14 . 1 1 40 40 VAL N N 108 121.970 121.970 119.443 2.527 18517 16143 1 14 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.630 -0.230 18517 16144 1 14 . 1 1 40 40 VAL C C 108 178.440 178.440 178.273 0.167 18517 16145 1 14 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.876 1.074 18517 16146 1 14 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.834 -1.394 18517 16147 1 14 . 1 1 40 40 VAL H H 108 8.200 8.200 7.770 0.430 18517 16148 1 14 . 1 1 41 41 VAL N N 109 108.940 108.940 115.552 -6.612 18517 16149 1 14 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.370 0.870 18517 16150 1 14 . 1 1 41 41 VAL C C 109 175.070 175.070 177.209 -2.139 18517 16151 1 14 . 1 1 41 41 VAL CA C 109 62.590 62.590 66.014 -3.424 18517 16152 1 14 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.890 -1.240 18517 16153 1 14 . 1 1 41 41 VAL H H 109 7.760 7.760 7.874 -0.114 18517 16154 1 14 . 1 1 42 42 ASP N N 110 124.670 124.670 121.981 2.689 18517 16155 1 14 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.273 0.347 18517 16156 1 14 . 1 1 42 42 ASP C C 110 177.310 177.310 178.535 -1.225 18517 16157 1 14 . 1 1 42 42 ASP CA C 110 59.980 59.980 58.085 1.895 18517 16158 1 14 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.815 4.135 18517 16159 1 14 . 1 1 42 42 ASP H H 110 7.360 7.360 8.569 -1.209 18517 16160 1 14 . 1 1 43 43 THR N N 111 102.340 102.340 112.123 -9.783 18517 16161 1 14 . 1 1 43 43 THR HA H 111 5.100 5.100 4.006 1.094 18517 16162 1 14 . 1 1 43 43 THR C C 111 174.940 174.940 176.213 -1.273 18517 16163 1 14 . 1 1 43 43 THR CA C 111 60.650 60.650 65.444 -4.794 18517 16164 1 14 . 1 1 43 43 THR CB C 111 69.610 69.610 68.284 1.326 18517 16165 1 14 . 1 1 43 43 THR H H 111 6.380 6.380 8.038 -1.658 18517 16166 1 14 . 1 1 44 44 ASP N N 112 119.750 119.750 122.722 -2.972 18517 16167 1 14 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.249 -0.389 18517 16168 1 14 . 1 1 44 44 ASP C C 112 178.850 178.850 177.577 1.273 18517 16169 1 14 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.264 0.966 18517 16170 1 14 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.749 -1.349 18517 16171 1 14 . 1 1 44 44 ASP H H 112 9.050 9.050 8.167 0.883 18517 16172 1 14 . 1 1 45 45 LEU N N 113 123.910 123.910 120.320 3.590 18517 16173 1 14 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.816 -0.006 18517 16174 1 14 . 1 1 45 45 LEU C C 113 182.040 182.040 178.704 3.336 18517 16175 1 14 . 1 1 45 45 LEU CA C 113 57.320 57.320 57.858 -0.538 18517 16176 1 14 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.631 -0.881 18517 16177 1 14 . 1 1 45 45 LEU H H 113 9.710 9.710 7.540 2.170 18517 16178 1 14 . 1 1 46 46 LEU N N 114 117.640 117.640 117.702 -0.062 18517 16179 1 14 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.177 -0.067 18517 16180 1 14 . 1 1 46 46 LEU C C 114 179.540 179.540 179.103 0.437 18517 16181 1 14 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.266 0.294 18517 16182 1 14 . 1 1 46 46 LEU CB C 114 41.470 41.470 40.763 0.707 18517 16183 1 14 . 1 1 46 46 LEU H H 114 8.270 8.270 7.548 0.722 18517 16184 1 14 . 1 1 47 47 LEU N N 115 116.520 116.520 115.198 1.322 18517 16185 1 14 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.444 -0.304 18517 16186 1 14 . 1 1 47 47 LEU C C 115 173.850 173.850 176.670 -2.820 18517 16187 1 14 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.144 1.276 18517 16188 1 14 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.346 3.374 18517 16189 1 14 . 1 1 47 47 LEU H H 115 8.160 8.160 8.092 0.068 18517 16190 1 14 . 1 1 48 48 LYS N N 116 114.710 114.710 117.557 -2.847 18517 16191 1 14 . 1 1 48 48 LYS HA H 116 3.810 3.810 4.101 -0.291 18517 16192 1 14 . 1 1 48 48 LYS C C 116 176.510 176.510 176.441 0.069 18517 16193 1 14 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.854 0.346 18517 16194 1 14 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.713 -0.693 18517 16195 1 14 . 1 1 48 48 LYS H H 116 7.580 7.580 7.688 -0.108 18517 16196 1 14 . 1 1 49 49 VAL N N 117 119.050 119.050 113.755 5.295 18517 16197 1 14 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.161 -0.551 18517 16198 1 14 . 1 1 49 49 VAL C C 117 175.860 175.860 175.590 0.270 18517 16199 1 14 . 1 1 49 49 VAL CA C 117 63.510 63.510 60.579 2.931 18517 16200 1 14 . 1 1 49 49 VAL CB C 117 32.350 32.350 33.656 -1.306 18517 16201 1 14 . 1 1 49 49 VAL H H 117 7.980 7.980 7.446 0.534 18517 16202 1 14 . 1 1 50 50 ASP N N 118 126.900 126.900 119.952 6.948 18517 16203 1 14 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.477 -0.227 18517 16204 1 14 . 1 1 50 50 ASP C C 118 177.700 177.700 177.064 0.636 18517 16205 1 14 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.536 0.514 18517 16206 1 14 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.069 1.512 18517 16207 1 14 . 1 1 50 50 ASP H H 118 8.930 8.930 8.706 0.224 18517 16208 1 14 . 1 1 51 51 SER N N 119 124.790 124.790 122.338 2.452 18517 16209 1 14 . 1 1 51 51 SER HA H 119 4.070 4.070 4.223 -0.153 18517 16210 1 14 . 1 1 51 51 SER C C 119 177.220 177.220 176.208 1.012 18517 16211 1 14 . 1 1 51 51 SER CA C 119 61.640 61.640 61.600 0.040 18517 16212 1 14 . 1 1 51 51 SER CB C 119 63.510 63.510 63.199 0.311 18517 16213 1 14 . 1 1 51 51 SER H H 119 8.560 8.560 8.805 -0.245 18517 16214 1 14 . 1 1 52 52 THR N N 120 119.880 119.880 119.022 0.858 18517 16215 1 14 . 1 1 52 52 THR HA H 120 4.190 4.190 4.114 0.076 18517 16216 1 14 . 1 1 52 52 THR C C 120 177.120 177.120 176.179 0.941 18517 16217 1 14 . 1 1 52 52 THR CA C 120 66.280 66.280 66.559 -0.280 18517 16218 1 14 . 1 1 52 52 THR CB C 120 68.420 68.420 68.430 -0.010 18517 16219 1 14 . 1 1 52 52 THR H H 120 8.310 8.310 7.728 0.582 18517 16220 1 14 . 1 1 53 53 LYS N N 121 122.270 122.270 122.667 -0.397 18517 16221 1 14 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.059 0.061 18517 16222 1 14 . 1 1 53 53 LYS C C 121 178.970 178.970 178.971 -0.001 18517 16223 1 14 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.404 0.176 18517 16224 1 14 . 1 1 53 53 LYS CB C 121 34.250 34.250 31.882 2.368 18517 16225 1 14 . 1 1 53 53 LYS H H 121 7.700 7.700 9.050 -1.350 18517 16226 1 14 . 1 1 54 54 VAL N N 122 120.070 120.070 119.664 0.406 18517 16227 1 14 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.916 -0.486 18517 16228 1 14 . 1 1 54 54 VAL C C 122 179.860 179.860 177.760 2.100 18517 16229 1 14 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.604 2.976 18517 16230 1 14 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.890 0.930 18517 16231 1 14 . 1 1 54 54 VAL H H 122 7.890 7.890 8.219 -0.329 18517 16232 1 14 . 1 1 55 55 ASP N N 123 122.270 122.270 121.149 1.121 18517 16233 1 14 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.374 0.096 18517 16234 1 14 . 1 1 55 55 ASP C C 123 178.630 178.630 178.486 0.144 18517 16235 1 14 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.793 0.007 18517 16236 1 14 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.907 1.113 18517 16237 1 14 . 1 1 55 55 ASP H H 123 8.270 8.270 8.086 0.184 18517 16238 1 14 . 1 1 56 56 GLU N N 124 119.600 119.600 119.285 0.315 18517 16239 1 14 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.092 -0.122 18517 16240 1 14 . 1 1 56 56 GLU C C 124 179.920 179.920 178.998 0.922 18517 16241 1 14 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.105 0.955 18517 16242 1 14 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.534 0.436 18517 16243 1 14 . 1 1 56 56 GLU H H 124 8.610 8.610 8.501 0.109 18517 16244 1 14 . 1 1 57 57 ALA N N 125 120.070 120.070 122.025 -1.955 18517 16245 1 14 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.154 -0.324 18517 16246 1 14 . 1 1 57 57 ALA C C 125 178.760 178.760 179.566 -0.806 18517 16247 1 14 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.909 0.471 18517 16248 1 14 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.497 1.643 18517 16249 1 14 . 1 1 57 57 ALA H H 125 8.420 8.420 8.526 -0.106 18517 16250 1 14 . 1 1 58 58 GLY N N 126 106.740 106.740 106.480 0.260 18517 16251 1 14 . 1 1 58 58 GLY C C 126 175.740 175.740 175.881 -0.141 18517 16252 1 14 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.806 0.484 18517 16253 1 14 . 1 1 58 58 GLY H H 126 8.200 8.200 8.546 -0.346 18517 16254 1 14 . 1 1 59 59 LYS N N 127 120.920 120.920 121.839 -0.919 18517 16255 1 14 . 1 1 59 59 LYS HA H 127 3.930 3.930 3.974 -0.044 18517 16256 1 14 . 1 1 59 59 LYS C C 127 180.320 180.320 178.664 1.656 18517 16257 1 14 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.372 0.838 18517 16258 1 14 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.366 0.614 18517 16259 1 14 . 1 1 59 59 LYS H H 127 8.000 8.000 7.978 0.022 18517 16260 1 14 . 1 1 60 60 LYS N N 128 118.400 118.400 119.440 -1.040 18517 16261 1 14 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.116 0.054 18517 16262 1 14 . 1 1 60 60 LYS C C 128 180.030 180.030 179.167 0.863 18517 16263 1 14 . 1 1 60 60 LYS CA C 128 58.750 58.750 59.380 -0.631 18517 16264 1 14 . 1 1 60 60 LYS CB C 128 32.270 32.270 31.983 0.287 18517 16265 1 14 . 1 1 60 60 LYS H H 128 7.170 7.170 7.872 -0.702 18517 16266 1 14 . 1 1 61 61 VAL N N 129 121.050 121.050 120.414 0.636 18517 16267 1 14 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.433 -0.153 18517 16268 1 14 . 1 1 61 61 VAL C C 129 177.120 177.120 177.692 -0.572 18517 16269 1 14 . 1 1 61 61 VAL CA C 129 67.350 67.350 66.913 0.437 18517 16270 1 14 . 1 1 61 61 VAL CB C 129 31.630 31.630 30.792 0.838 18517 16271 1 14 . 1 1 61 61 VAL H H 129 7.980 7.980 8.102 -0.122 18517 16272 1 14 . 1 1 62 62 LYS N N 130 120.040 120.040 119.725 0.315 18517 16273 1 14 . 1 1 62 62 LYS HA H 130 3.700 3.700 4.045 -0.345 18517 16274 1 14 . 1 1 62 62 LYS C C 130 178.550 178.550 179.002 -0.452 18517 16275 1 14 . 1 1 62 62 LYS CA C 130 60.330 60.330 59.000 1.330 18517 16276 1 14 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.240 1.530 18517 16277 1 14 . 1 1 62 62 LYS H H 130 8.910 8.910 8.599 0.311 18517 16278 1 14 . 1 1 63 63 ALA N N 131 119.570 119.570 123.559 -3.989 18517 16279 1 14 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.090 0.130 18517 16280 1 14 . 1 1 63 63 ALA C C 131 180.520 180.520 179.259 1.261 18517 16281 1 14 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.235 -0.015 18517 16282 1 14 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.127 0.343 18517 16283 1 14 . 1 1 63 63 ALA H H 131 7.920 7.920 8.249 -0.329 18517 16284 1 14 . 1 1 64 64 TYR N N 132 120.510 120.510 120.551 -0.041 18517 16285 1 14 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.155 0.305 18517 16286 1 14 . 1 1 64 64 TYR C C 132 176.510 176.510 177.787 -1.277 18517 16287 1 14 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.897 -0.257 18517 16288 1 14 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.792 -0.102 18517 16289 1 14 . 1 1 64 64 TYR H H 132 7.930 7.930 8.230 -0.300 18517 16290 1 14 . 1 1 65 65 LEU N N 133 117.290 117.290 120.073 -2.783 18517 16291 1 14 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.789 0.051 18517 16292 1 14 . 1 1 65 65 LEU C C 133 178.610 178.610 179.037 -0.427 18517 16293 1 14 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.330 -0.609 18517 16294 1 14 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.823 -1.393 18517 16295 1 14 . 1 1 65 65 LEU H H 133 8.240 8.240 8.791 -0.551 18517 16296 1 14 . 1 1 66 66 GLU N N 134 119.140 119.140 117.735 1.405 18517 16297 1 14 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.171 -0.311 18517 16298 1 14 . 1 1 66 66 GLU C C 134 180.200 180.200 179.059 1.141 18517 16299 1 14 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.841 1.099 18517 16300 1 14 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.334 0.476 18517 16301 1 14 . 1 1 66 66 GLU H H 134 8.370 8.370 8.484 -0.114 18517 16302 1 14 . 1 1 67 67 LYS N N 135 121.390 121.390 120.745 0.645 18517 16303 1 14 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.084 -0.084 18517 16304 1 14 . 1 1 67 67 LYS C C 135 179.080 179.080 178.380 0.700 18517 16305 1 14 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.761 0.859 18517 16306 1 14 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.347 -0.077 18517 16307 1 14 . 1 1 67 67 LYS H H 135 7.820 7.820 7.712 0.108 18517 16308 1 14 . 1 1 68 68 ILE N N 136 110.310 110.310 112.194 -1.884 18517 16309 1 14 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.071 0.229 18517 16310 1 14 . 1 1 68 68 ILE C C 136 175.520 175.520 176.930 -1.410 18517 16311 1 14 . 1 1 68 68 ILE CA C 136 62.430 62.430 62.061 0.369 18517 16312 1 14 . 1 1 68 68 ILE CB C 136 37.980 37.980 39.121 -1.141 18517 16313 1 14 . 1 1 68 68 ILE H H 136 7.380 7.380 7.524 -0.144 18517 16314 1 14 . 1 1 69 69 GLY N N 137 106.680 106.680 108.377 -1.697 18517 16315 1 14 . 1 1 69 69 GLY C C 137 174.160 174.160 173.529 0.631 18517 16316 1 14 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.509 0.961 18517 16317 1 14 . 1 1 69 69 GLY H H 137 7.470 7.470 8.029 -0.559 18517 16318 1 14 . 1 1 70 70 ILE N N 138 124.310 124.310 121.097 3.213 18517 16319 1 14 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.427 -0.227 18517 16320 1 14 . 1 1 70 70 ILE C C 138 174.190 174.190 174.894 -0.704 18517 16321 1 14 . 1 1 70 70 ILE CA C 138 59.380 59.380 58.812 0.568 18517 16322 1 14 . 1 1 70 70 ILE CB C 138 37.340 37.340 39.093 -1.753 18517 16323 1 14 . 1 1 70 70 ILE H H 138 8.530 8.530 8.323 0.207 18517 16324 1 14 . 1 1 71 71 ARG N N 139 125.490 125.490 125.560 -0.070 18517 16325 1 14 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.559 0.061 18517 16326 1 14 . 1 1 71 71 ARG C C 139 175.750 175.750 175.880 -0.130 18517 16327 1 14 . 1 1 71 71 ARG CA C 139 54.660 54.660 54.675 -0.015 18517 16328 1 14 . 1 1 71 71 ARG CB C 139 33.140 33.140 33.199 -0.059 18517 16329 1 14 . 1 1 71 71 ARG H H 139 8.240 8.240 8.627 -0.387 18517 16330 1 14 . 1 1 72 72 GLY N N 140 104.750 104.750 107.435 -2.685 18517 16331 1 14 . 1 1 72 72 GLY C C 140 172.920 172.920 173.449 -0.529 18517 16332 1 14 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.691 0.740 18517 16333 1 14 . 1 1 72 72 GLY H H 140 7.900 7.900 8.211 -0.311 18517 16334 1 14 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.585 -0.075 18517 16335 1 14 . 1 1 73 73 ASP C C 141 175.060 175.060 176.720 -1.660 18517 16336 1 14 . 1 1 73 73 ASP CA C 141 56.170 56.170 55.926 0.244 18517 16337 1 14 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.674 -0.844 18517 16338 1 14 . 1 1 74 74 SER N N 142 110.240 110.240 112.952 -2.712 18517 16339 1 14 . 1 1 74 74 SER HA H 142 4.740 4.740 4.654 0.086 18517 16340 1 14 . 1 1 74 74 SER C C 142 175.110 175.110 174.518 0.592 18517 16341 1 14 . 1 1 74 74 SER CA C 142 55.700 55.700 56.319 -0.619 18517 16342 1 14 . 1 1 74 74 SER CB C 142 67.390 67.390 64.589 2.801 18517 16343 1 14 . 1 1 74 74 SER H H 142 7.560 7.560 7.513 0.047 18517 16344 1 14 . 1 1 75 75 VAL N N 143 122.950 122.950 120.548 2.402 18517 16345 1 14 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.880 -0.150 18517 16346 1 14 . 1 1 75 75 VAL C C 143 176.230 176.230 177.180 -0.950 18517 16347 1 14 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.277 1.363 18517 16348 1 14 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.691 -0.451 18517 16349 1 14 . 1 1 75 75 VAL H H 143 9.470 9.470 8.913 0.557 18517 16350 1 14 . 1 1 76 76 GLU N N 144 121.390 121.390 121.581 -0.191 18517 16351 1 14 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.038 -0.398 18517 16352 1 14 . 1 1 76 76 GLU C C 144 176.880 176.880 178.739 -1.859 18517 16353 1 14 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.790 3.520 18517 16354 1 14 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.362 -0.292 18517 16355 1 14 . 1 1 76 76 GLU H H 144 9.640 9.640 8.391 1.249 18517 16356 1 14 . 1 1 77 77 ALA N N 145 118.770 118.770 121.765 -2.995 18517 16357 1 14 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.214 0.046 18517 16358 1 14 . 1 1 77 77 ALA C C 145 180.350 180.350 179.605 0.745 18517 16359 1 14 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.708 0.072 18517 16360 1 14 . 1 1 77 77 ALA CB C 145 19.190 19.190 17.901 1.289 18517 16361 1 14 . 1 1 77 77 ALA H H 145 7.860 7.860 8.208 -0.348 18517 16362 1 14 . 1 1 78 78 ALA N N 146 120.920 120.920 122.595 -1.675 18517 16363 1 14 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.051 0.089 18517 16364 1 14 . 1 1 78 78 ALA C C 146 179.150 179.150 179.413 -0.263 18517 16365 1 14 . 1 1 78 78 ALA CA C 146 55.260 55.260 55.096 0.163 18517 16366 1 14 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.739 0.051 18517 16367 1 14 . 1 1 78 78 ALA H H 146 8.110 8.110 8.074 0.036 18517 16368 1 14 . 1 1 79 79 LEU N N 147 118.810 118.810 116.257 2.553 18517 16369 1 14 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.144 -0.264 18517 16370 1 14 . 1 1 79 79 LEU C C 147 179.080 179.080 178.592 0.488 18517 16371 1 14 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.644 0.746 18517 16372 1 14 . 1 1 79 79 LEU CB C 147 42.260 42.260 40.998 1.262 18517 16373 1 14 . 1 1 79 79 LEU H H 147 8.360 8.360 8.232 0.128 18517 16374 1 14 . 1 1 80 80 ASP N N 148 121.620 121.620 120.174 1.446 18517 16375 1 14 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.253 0.267 18517 16376 1 14 . 1 1 80 80 ASP C C 148 178.800 178.800 178.162 0.638 18517 16377 1 14 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.025 0.365 18517 16378 1 14 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.874 -0.124 18517 16379 1 14 . 1 1 80 80 ASP H H 148 8.770 8.770 8.483 0.287 18517 16380 1 14 . 1 1 81 81 ASN N N 149 118.630 118.630 118.593 0.037 18517 16381 1 14 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.470 0.100 18517 16382 1 14 . 1 1 81 81 ASN C C 149 177.970 177.970 177.879 0.091 18517 16383 1 14 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.006 0.004 18517 16384 1 14 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.452 0.158 18517 16385 1 14 . 1 1 81 81 ASN H H 149 7.960 7.960 8.312 -0.352 18517 16386 1 14 . 1 1 82 82 LEU N N 150 120.030 120.030 120.497 -0.467 18517 16387 1 14 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.860 0.200 18517 16388 1 14 . 1 1 82 82 LEU C C 150 177.790 177.790 179.081 -1.291 18517 16389 1 14 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.083 0.787 18517 16390 1 14 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.819 0.041 18517 16391 1 14 . 1 1 82 82 LEU H H 150 8.230 8.230 8.245 -0.015 18517 16392 1 14 . 1 1 83 83 MET N N 151 115.820 115.820 117.846 -2.026 18517 16393 1 14 . 1 1 83 83 MET HA H 151 4.390 4.390 4.034 0.356 18517 16394 1 14 . 1 1 83 83 MET C C 151 179.760 179.760 178.993 0.767 18517 16395 1 14 . 1 1 83 83 MET CA C 151 57.400 57.400 58.167 -0.767 18517 16396 1 14 . 1 1 83 83 MET CB C 151 31.080 31.080 31.580 -0.500 18517 16397 1 14 . 1 1 83 83 MET H H 151 8.800 8.800 8.298 0.502 18517 16398 1 14 . 1 1 84 84 ILE N N 152 120.330 120.330 120.280 0.050 18517 16399 1 14 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.690 0.150 18517 16400 1 14 . 1 1 84 84 ILE C C 152 178.660 178.660 178.289 0.371 18517 16401 1 14 . 1 1 84 84 ILE CA C 152 65.800 65.800 65.859 -0.059 18517 16402 1 14 . 1 1 84 84 ILE CB C 152 38.450 38.450 37.261 1.189 18517 16403 1 14 . 1 1 84 84 ILE H H 152 8.540 8.540 8.958 -0.418 18517 16404 1 14 . 1 1 85 85 LYS N N 153 118.930 118.930 119.978 -1.048 18517 16405 1 14 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.349 -0.149 18517 16406 1 14 . 1 1 85 85 LYS C C 153 179.650 179.650 179.701 -0.051 18517 16407 1 14 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.873 1.107 18517 16408 1 14 . 1 1 85 85 LYS CB C 153 33.540 33.540 31.881 1.659 18517 16409 1 14 . 1 1 85 85 LYS H H 153 7.510 7.510 8.029 -0.519 18517 16410 1 14 . 1 1 86 86 VAL N N 154 119.810 119.810 119.510 0.300 18517 16411 1 14 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.638 -0.008 18517 16412 1 14 . 1 1 86 86 VAL C C 154 178.350 178.350 178.534 -0.184 18517 16413 1 14 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.632 0.598 18517 16414 1 14 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.764 0.976 18517 16415 1 14 . 1 1 86 86 VAL H H 154 8.740 8.740 8.155 0.585 18517 16416 1 14 . 1 1 87 87 TYR N N 155 118.370 118.370 119.491 -1.121 18517 16417 1 14 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.205 0.065 18517 16418 1 14 . 1 1 87 87 TYR C C 155 178.580 178.580 178.191 0.389 18517 16419 1 14 . 1 1 87 87 TYR CA C 155 62.910 62.910 61.879 1.031 18517 16420 1 14 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.163 0.817 18517 16421 1 14 . 1 1 87 87 TYR H H 155 8.520 8.520 8.448 0.072 18517 16422 1 14 . 1 1 88 88 GLU N N 156 119.900 119.900 120.308 -0.408 18517 16423 1 14 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.254 -0.074 18517 16424 1 14 . 1 1 88 88 GLU C C 156 179.270 179.270 179.117 0.153 18517 16425 1 14 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.341 0.039 18517 16426 1 14 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.575 0.635 18517 16427 1 14 . 1 1 88 88 GLU H H 156 8.250 8.250 8.843 -0.593 18517 16428 1 14 . 1 1 89 89 ILE N N 157 119.510 119.510 118.682 0.828 18517 16429 1 14 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.966 0.114 18517 16430 1 14 . 1 1 89 89 ILE C C 157 177.890 177.890 178.122 -0.232 18517 16431 1 14 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.380 -0.070 18517 16432 1 14 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.260 0.950 18517 16433 1 14 . 1 1 89 89 ILE H H 157 7.630 7.630 7.825 -0.195 18517 16434 1 14 . 1 1 90 90 THR N N 158 114.240 114.240 114.095 0.145 18517 16435 1 14 . 1 1 90 90 THR HA H 158 4.130 4.130 4.132 -0.002 18517 16436 1 14 . 1 1 90 90 THR C C 158 175.530 175.530 175.536 -0.006 18517 16437 1 14 . 1 1 90 90 THR CA C 158 64.460 64.460 65.338 -0.878 18517 16438 1 14 . 1 1 90 90 THR CB C 158 69.610 69.610 69.230 0.380 18517 16439 1 14 . 1 1 90 90 THR H H 158 7.770 7.770 8.343 -0.573 18517 16440 1 14 . 1 1 91 91 LYS N N 159 120.280 120.280 118.573 1.707 18517 16441 1 14 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.374 -0.064 18517 16442 1 14 . 1 1 91 91 LYS C C 159 177.420 177.420 177.763 -0.343 18517 16443 1 14 . 1 1 91 91 LYS CA C 159 57.400 57.400 56.161 1.239 18517 16444 1 14 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.874 -0.654 18517 16445 1 14 . 1 1 91 91 LYS H H 159 7.890 7.890 8.233 -0.343 18517 16446 1 14 . 1 1 92 92 GLY N N 160 107.910 107.910 108.127 -0.217 18517 16447 1 14 . 1 1 92 92 GLY C C 160 174.430 174.430 175.027 -0.597 18517 16448 1 14 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.309 0.671 18517 16449 1 14 . 1 1 92 92 GLY H H 160 7.930 7.930 8.051 -0.121 18517 16450 1 14 . 1 1 93 93 THR N N 161 113.570 113.570 118.627 -5.057 18517 16451 1 14 . 1 1 93 93 THR HA H 161 4.390 4.390 4.434 -0.044 18517 16452 1 14 . 1 1 93 93 THR C C 161 174.790 174.790 173.488 1.302 18517 16453 1 14 . 1 1 93 93 THR CA C 161 61.960 61.960 62.357 -0.397 18517 16454 1 14 . 1 1 93 93 THR CB C 161 70.010 70.010 67.779 2.231 18517 16455 1 14 . 1 1 93 93 THR H H 161 7.970 7.970 8.068 -0.098 18517 16456 1 14 . 1 1 94 94 VAL N N 162 121.980 121.980 125.332 -3.352 18517 16457 1 14 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.076 0.044 18517 16458 1 14 . 1 1 94 94 VAL C C 162 176.300 176.300 175.198 1.102 18517 16459 1 14 . 1 1 94 94 VAL CA C 162 62.830 62.830 60.863 1.967 18517 16460 1 14 . 1 1 94 94 VAL CB C 162 33.060 33.060 33.337 -0.277 18517 16461 1 14 . 1 1 94 94 VAL H H 162 8.130 8.130 7.942 0.188 18517 16462 1 14 . 1 1 95 95 GLU N N 163 124.140 124.140 127.061 -2.921 18517 16463 1 14 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.075 0.235 18517 16464 1 14 . 1 1 95 95 GLU C C 163 176.870 176.870 174.748 2.122 18517 16465 1 14 . 1 1 95 95 GLU CA C 163 57.080 57.080 57.723 -0.643 18517 16466 1 14 . 1 1 95 95 GLU CB C 163 30.440 30.440 28.291 2.149 18517 16467 1 14 . 1 1 95 95 GLU H H 163 8.490 8.490 9.760 -1.270 18517 16468 1 14 . 1 1 96 96 SER N N 164 116.800 116.800 118.014 -1.214 18517 16469 1 14 . 1 1 96 96 SER HA H 164 4.430 4.430 4.729 -0.299 18517 16470 1 14 . 1 1 96 96 SER C C 164 174.940 174.940 174.582 0.358 18517 16471 1 14 . 1 1 96 96 SER CA C 164 59.070 59.070 58.517 0.553 18517 16472 1 14 . 1 1 96 96 SER CB C 164 64.220 64.220 65.842 -1.622 18517 16473 1 14 . 1 1 96 96 SER H H 164 8.300 8.300 8.601 -0.301 18517 16474 1 14 . 1 1 97 97 SER C C 165 174.660 174.660 172.817 1.843 18517 16475 1 14 . 1 1 97 97 SER CA C 165 58.870 58.870 57.991 0.879 18517 16476 1 14 . 1 1 97 97 SER CB C 165 64.060 64.060 64.900 -0.841 18517 16477 1 14 . 1 1 98 98 ALA N N 166 125.490 125.490 124.671 0.819 18517 16478 1 14 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.485 -0.135 18517 16479 1 14 . 1 1 98 98 ALA C C 166 177.780 177.780 177.340 0.440 18517 16480 1 14 . 1 1 98 98 ALA CA C 166 53.000 53.000 52.328 0.673 18517 16481 1 14 . 1 1 98 98 ALA CB C 166 19.340 19.340 18.238 1.102 18517 16482 1 14 . 1 1 98 98 ALA H H 166 8.180 8.180 8.335 -0.155 18517 16483 1 14 . 1 1 99 99 GLN N N 167 118.690 118.690 123.470 -4.780 18517 16484 1 14 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.433 -0.093 18517 16485 1 14 . 1 1 99 99 GLN C C 167 176.680 176.680 175.779 0.901 18517 16486 1 14 . 1 1 99 99 GLN CA C 167 56.250 56.250 54.444 1.806 18517 16487 1 14 . 1 1 99 99 GLN CB C 167 29.650 29.650 31.019 -1.369 18517 16488 1 14 . 1 1 99 99 GLN H H 167 8.170 8.170 7.961 0.209 18517 16489 1 14 . 1 1 100 100 GLY N N 168 109.670 109.670 108.205 1.465 18517 16490 1 14 . 1 1 100 100 GLY C C 168 174.460 174.460 174.229 0.231 18517 16491 1 14 . 1 1 100 100 GLY CA C 168 45.670 45.670 44.961 0.709 18517 16492 1 14 . 1 1 100 100 GLY H H 168 8.250 8.250 8.883 -0.633 18517 16493 1 14 . 1 1 101 101 THR N N 169 112.660 112.660 116.445 -3.785 18517 16494 1 14 . 1 1 101 101 THR HA H 169 4.360 4.360 4.111 0.249 18517 16495 1 14 . 1 1 101 101 THR C C 169 174.720 174.720 174.800 -0.080 18517 16496 1 14 . 1 1 101 101 THR CA C 169 62.080 62.080 61.792 0.288 18517 16497 1 14 . 1 1 101 101 THR CB C 169 69.930 69.930 69.561 0.369 18517 16498 1 14 . 1 1 101 101 THR H H 169 8.070 8.070 8.298 -0.228 18517 16499 1 14 . 1 1 102 102 ASP N N 170 123.090 123.090 127.044 -3.954 18517 16500 1 14 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.671 0.029 18517 16501 1 14 . 1 1 102 102 ASP C C 170 176.130 176.130 175.555 0.575 18517 16502 1 14 . 1 1 102 102 ASP CA C 170 54.780 54.780 53.141 1.639 18517 16503 1 14 . 1 1 102 102 ASP CB C 170 42.260 42.260 40.082 2.178 18517 16504 1 14 . 1 1 102 102 ASP H H 170 8.170 8.170 8.426 -0.256 18517 16505 1 14 . 1 1 103 103 SER N N 171 117.110 117.110 118.848 -1.738 18517 16506 1 14 . 1 1 103 103 SER HA H 171 4.430 4.430 4.464 -0.034 18517 16507 1 14 . 1 1 103 103 SER C C 171 174.770 174.770 175.260 -0.490 18517 16508 1 14 . 1 1 103 103 SER CA C 171 57.960 57.960 57.590 0.370 18517 16509 1 14 . 1 1 103 103 SER CB C 171 64.940 64.940 64.601 0.339 18517 16510 1 14 . 1 1 103 103 SER H H 171 8.450 8.450 7.767 0.683 18517 16511 1 14 . 1 1 104 104 GLU N N 172 122.970 122.970 122.933 0.037 18517 16512 1 14 . 1 1 104 104 GLU HA H 172 4.030 4.030 4.011 0.019 18517 16513 1 14 . 1 1 104 104 GLU C C 172 178.860 178.860 178.423 0.437 18517 16514 1 14 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.107 -0.407 18517 16515 1 14 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.431 0.219 18517 16516 1 14 . 1 1 104 104 GLU H H 172 8.830 8.830 8.981 -0.151 18517 16517 1 14 . 1 1 105 105 GLU N N 173 119.750 119.750 117.868 1.882 18517 16518 1 14 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.061 -0.081 18517 16519 1 14 . 1 1 105 105 GLU C C 173 178.920 178.920 178.513 0.407 18517 16520 1 14 . 1 1 105 105 GLU CA C 173 60.060 60.060 58.945 1.115 18517 16521 1 14 . 1 1 105 105 GLU CB C 173 29.730 29.730 28.777 0.953 18517 16522 1 14 . 1 1 105 105 GLU H H 173 8.580 8.580 8.852 -0.272 18517 16523 1 14 . 1 1 106 106 LEU N N 174 121.860 121.860 122.045 -0.185 18517 16524 1 14 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.037 0.142 18517 16525 1 14 . 1 1 106 106 LEU C C 174 178.210 178.210 178.233 -0.023 18517 16526 1 14 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.485 0.395 18517 16527 1 14 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.886 -0.736 18517 16528 1 14 . 1 1 106 106 LEU H H 174 7.920 7.920 7.321 0.599 18517 16529 1 14 . 1 1 107 107 LYS N N 175 118.740 118.740 119.711 -0.971 18517 16530 1 14 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.883 -0.103 18517 16531 1 14 . 1 1 107 107 LYS C C 175 178.700 178.700 179.163 -0.463 18517 16532 1 14 . 1 1 107 107 LYS CA C 175 61.170 61.170 60.253 0.917 18517 16533 1 14 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.158 0.272 18517 16534 1 14 . 1 1 107 107 LYS H H 175 8.340 8.340 8.662 -0.322 18517 16535 1 14 . 1 1 108 108 THR N N 176 113.820 113.820 116.074 -2.254 18517 16536 1 14 . 1 1 108 108 THR HA H 176 3.840 3.840 4.047 -0.207 18517 16537 1 14 . 1 1 108 108 THR C C 176 176.620 176.620 176.137 0.483 18517 16538 1 14 . 1 1 108 108 THR CA C 176 66.910 66.910 66.782 0.128 18517 16539 1 14 . 1 1 108 108 THR CB C 176 69.610 69.610 68.534 1.076 18517 16540 1 14 . 1 1 108 108 THR H H 176 7.950 7.950 8.370 -0.420 18517 16541 1 14 . 1 1 109 109 LEU N N 177 124.380 124.380 123.144 1.236 18517 16542 1 14 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.134 -0.304 18517 16543 1 14 . 1 1 109 109 LEU C C 177 177.790 177.790 178.305 -0.515 18517 16544 1 14 . 1 1 109 109 LEU CA C 177 57.990 57.990 58.012 -0.022 18517 16545 1 14 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.202 1.378 18517 16546 1 14 . 1 1 109 109 LEU H H 177 7.480 7.480 7.945 -0.465 18517 16547 1 14 . 1 1 110 110 LEU N N 178 117.230 117.230 118.906 -1.676 18517 16548 1 14 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.824 0.016 18517 16549 1 14 . 1 1 110 110 LEU C C 178 179.540 179.540 179.501 0.039 18517 16550 1 14 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.747 0.643 18517 16551 1 14 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.340 1.000 18517 16552 1 14 . 1 1 110 110 LEU H H 178 8.670 8.670 8.483 0.187 18517 16553 1 14 . 1 1 111 111 LEU N N 179 119.230 119.230 121.226 -1.996 18517 16554 1 14 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.023 0.057 18517 16555 1 14 . 1 1 111 111 LEU C C 179 179.310 179.310 179.196 0.114 18517 16556 1 14 . 1 1 111 111 LEU CA C 179 58.390 58.390 58.375 0.015 18517 16557 1 14 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.627 1.393 18517 16558 1 14 . 1 1 111 111 LEU H H 179 7.940 7.940 8.556 -0.616 18517 16559 1 14 . 1 1 112 112 LYS N N 180 121.910 121.910 120.247 1.663 18517 16560 1 14 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.173 0.017 18517 16561 1 14 . 1 1 112 112 LYS C C 180 178.740 178.740 179.243 -0.503 18517 16562 1 14 . 1 1 112 112 LYS CA C 180 59.180 59.180 58.847 0.333 18517 16563 1 14 . 1 1 112 112 LYS CB C 180 31.870 31.870 31.944 -0.074 18517 16564 1 14 . 1 1 112 112 LYS H H 180 7.420 7.420 8.114 -0.694 18517 16565 1 14 . 1 1 113 113 PHE N N 181 118.220 118.220 119.082 -0.862 18517 16566 1 14 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.303 0.447 18517 16567 1 14 . 1 1 113 113 PHE C C 181 178.520 178.520 178.121 0.399 18517 16568 1 14 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.605 -3.525 18517 16569 1 14 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.310 -0.330 18517 16570 1 14 . 1 1 113 113 PHE H H 181 9.000 9.000 8.526 0.474 18517 16571 1 14 . 1 1 114 114 SER N N 182 113.300 113.300 114.709 -1.409 18517 16572 1 14 . 1 1 114 114 SER HA H 182 3.930 3.930 4.158 -0.228 18517 16573 1 14 . 1 1 114 114 SER C C 182 177.080 177.080 176.782 0.298 18517 16574 1 14 . 1 1 114 114 SER CA C 182 62.000 62.000 62.021 -0.021 18517 16575 1 14 . 1 1 114 114 SER CB C 182 63.510 63.510 63.131 0.379 18517 16576 1 14 . 1 1 114 114 SER H H 182 8.620 8.620 8.868 -0.248 18517 16577 1 14 . 1 1 115 115 GLU N N 183 121.540 121.540 122.090 -0.550 18517 16578 1 14 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.043 0.027 18517 16579 1 14 . 1 1 115 115 GLU C C 183 179.860 179.860 178.538 1.322 18517 16580 1 14 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.387 0.393 18517 16581 1 14 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.518 0.372 18517 16582 1 14 . 1 1 115 115 GLU H H 183 8.250 8.250 8.554 -0.304 18517 16583 1 14 . 1 1 116 116 ASP N N 184 121.740 121.740 120.993 0.747 18517 16584 1 14 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.421 0.089 18517 16585 1 14 . 1 1 116 116 ASP C C 184 179.570 179.570 178.545 1.025 18517 16586 1 14 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.504 0.056 18517 16587 1 14 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.995 -0.005 18517 16588 1 14 . 1 1 116 116 ASP H H 184 8.840 8.840 8.371 0.469 18517 16589 1 14 . 1 1 117 117 LEU N N 185 121.420 121.420 121.483 -0.063 18517 16590 1 14 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.026 0.104 18517 16591 1 14 . 1 1 117 117 LEU C C 185 178.840 178.840 178.617 0.223 18517 16592 1 14 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.464 -0.234 18517 16593 1 14 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.513 1.137 18517 16594 1 14 . 1 1 117 117 LEU H H 185 8.350 8.350 8.365 -0.015 18517 16595 1 14 . 1 1 118 118 LYS N N 186 119.640 119.640 118.784 0.856 18517 16596 1 14 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.987 0.133 18517 16597 1 14 . 1 1 118 118 LYS C C 186 178.820 178.820 179.108 -0.288 18517 16598 1 14 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.085 0.655 18517 16599 1 14 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.219 0.291 18517 16600 1 14 . 1 1 118 118 LYS H H 186 8.220 8.220 8.219 0.001 18517 16601 1 14 . 1 1 119 119 ALA N N 187 120.160 120.160 122.485 -2.325 18517 16602 1 14 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.411 -0.251 18517 16603 1 14 . 1 1 119 119 ALA C C 187 180.450 180.450 179.946 0.504 18517 16604 1 14 . 1 1 119 119 ALA CA C 187 55.140 55.140 54.873 0.267 18517 16605 1 14 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.396 0.073 18517 16606 1 14 . 1 1 119 119 ALA H H 187 8.010 8.010 8.346 -0.336 18517 16607 1 14 . 1 1 120 120 GLU N N 188 117.930 117.930 117.914 0.016 18517 16608 1 14 . 1 1 120 120 GLU HA H 188 4.180 4.180 3.873 0.307 18517 16609 1 14 . 1 1 120 120 GLU C C 188 178.780 178.780 179.435 -0.655 18517 16610 1 14 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.986 -1.157 18517 16611 1 14 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.483 0.487 18517 16612 1 14 . 1 1 120 120 GLU H H 188 7.640 7.640 8.388 -0.748 18517 16613 1 14 . 1 1 121 121 GLN N N 189 117.230 117.230 117.063 0.167 18517 16614 1 14 . 1 1 121 121 GLN HA H 189 4.230 4.230 4.081 0.149 18517 16615 1 14 . 1 1 121 121 GLN C C 189 179.190 179.190 178.144 1.046 18517 16616 1 14 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.422 1.318 18517 16617 1 14 . 1 1 121 121 GLN CB C 189 29.650 29.650 29.264 0.386 18517 16618 1 14 . 1 1 121 121 GLN H H 189 8.280 8.280 8.128 0.152 18517 16619 1 14 . 1 1 122 122 GLU N N 190 118.340 118.340 121.290 -2.950 18517 16620 1 14 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.962 0.158 18517 16621 1 14 . 1 1 122 122 GLU C C 190 178.210 178.210 178.863 -0.653 18517 16622 1 14 . 1 1 122 122 GLU CA C 190 58.750 58.750 59.211 -0.461 18517 16623 1 14 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.167 0.803 18517 16624 1 14 . 1 1 122 122 GLU H H 190 8.250 8.250 8.102 0.148 18517 16625 1 14 . 1 1 123 123 LEU N N 191 118.930 118.930 119.958 -1.028 18517 16626 1 14 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.994 0.096 18517 16627 1 14 . 1 1 123 123 LEU C C 191 178.500 178.500 178.815 -0.315 18517 16628 1 14 . 1 1 123 123 LEU CA C 191 57.000 57.000 57.574 -0.574 18517 16629 1 14 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.591 0.909 18517 16630 1 14 . 1 1 123 123 LEU H H 191 7.530 7.530 8.052 -0.522 18517 16631 1 14 . 1 1 124 124 HIS N N 192 115.650 115.650 120.031 -4.381 18517 16632 1 14 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.135 0.585 18517 16633 1 14 . 1 1 124 124 HIS C C 192 176.090 176.090 177.520 -1.430 18517 16634 1 14 . 1 1 124 124 HIS CA C 192 56.690 56.690 59.703 -3.014 18517 16635 1 14 . 1 1 124 124 HIS CB C 192 30.760 30.760 29.919 0.841 18517 16636 1 14 . 1 1 124 124 HIS H H 192 7.450 7.450 8.344 -0.894 18517 16637 1 14 . 1 1 125 125 SER N N 193 115.480 115.480 115.089 0.391 18517 16638 1 14 . 1 1 125 125 SER HA H 193 4.310 4.310 4.142 0.168 18517 16639 1 14 . 1 1 125 125 SER CA C 193 60.180 60.180 62.143 -1.963 18517 16640 1 14 . 1 1 125 125 SER CB C 193 64.060 64.060 62.678 1.382 18517 16641 1 14 . 1 1 125 125 SER H H 193 8.020 8.020 8.225 -0.205 18517 16642 1 14 . 1 1 126 126 GLU C C 194 177.410 177.410 179.221 -1.811 18517 16643 1 14 . 1 1 126 126 GLU CA C 194 57.840 57.840 58.885 -1.045 18517 16644 1 14 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.400 0.490 18517 16645 1 14 . 1 1 127 127 ALA N N 195 122.910 122.910 123.186 -0.276 18517 16646 1 14 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.073 0.117 18517 16647 1 14 . 1 1 127 127 ALA C C 195 178.610 178.610 179.419 -0.809 18517 16648 1 14 . 1 1 127 127 ALA CA C 195 53.790 53.790 55.064 -1.274 18517 16649 1 14 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.657 0.604 18517 16650 1 14 . 1 1 127 127 ALA H H 195 8.020 8.020 8.276 -0.256 18517 16651 1 14 . 1 1 128 128 LYS N N 196 117.770 117.770 116.898 0.872 18517 16652 1 14 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.389 -0.129 18517 16653 1 14 . 1 1 128 128 LYS C C 196 177.400 177.400 176.369 1.031 18517 16654 1 14 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.830 2.170 18517 16655 1 14 . 1 1 128 128 LYS CB C 196 32.740 32.740 33.360 -0.620 18517 16656 1 14 . 1 1 128 128 LYS H H 196 7.990 7.990 8.090 -0.100 18517 16657 1 14 . 1 1 129 129 GLY N N 197 109.010 109.010 108.470 0.540 18517 16658 1 14 . 1 1 129 129 GLY C C 197 175.770 175.770 175.419 0.351 18517 16659 1 14 . 1 1 129 129 GLY CA C 197 46.100 46.100 44.918 1.182 18517 16660 1 14 . 1 1 129 129 GLY H H 197 8.220 8.220 7.625 0.595 18517 16661 1 14 . 1 1 130 130 GLY N N 198 109.150 109.150 109.912 -0.762 18517 16662 1 14 . 1 1 130 130 GLY C C 198 174.760 174.760 175.340 -0.580 18517 16663 1 14 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.253 -0.323 18517 16664 1 14 . 1 1 130 130 GLY H H 198 8.210 8.210 8.754 -0.544 18517 16665 1 14 . 1 1 131 131 GLU N N 199 121.560 121.560 121.118 0.442 18517 16666 1 14 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.068 -0.048 18517 16667 1 14 . 1 1 131 131 GLU C C 199 178.500 178.500 178.370 0.130 18517 16668 1 14 . 1 1 131 131 GLU CA C 199 59.900 59.900 58.462 1.438 18517 16669 1 14 . 1 1 131 131 GLU CB C 199 29.570 29.570 28.101 1.469 18517 16670 1 14 . 1 1 131 131 GLU H H 199 8.510 8.510 8.596 -0.086 18517 16671 1 14 . 1 1 132 132 ALA N N 200 122.390 122.390 122.539 -0.149 18517 16672 1 14 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.200 0.000 18517 16673 1 14 . 1 1 132 132 ALA C C 200 180.360 180.360 179.642 0.718 18517 16674 1 14 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.605 0.175 18517 16675 1 14 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.149 0.241 18517 16676 1 14 . 1 1 132 132 ALA H H 200 8.190 8.190 7.376 0.814 18517 16677 1 14 . 1 1 133 133 LEU N N 201 120.800 120.800 120.914 -0.114 18517 16678 1 14 . 1 1 133 133 LEU HA H 201 4.210 4.210 3.974 0.236 18517 16679 1 14 . 1 1 133 133 LEU C C 201 179.270 179.270 178.683 0.587 18517 16680 1 14 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.941 -0.261 18517 16681 1 14 . 1 1 133 133 LEU CB C 201 42.180 42.180 42.229 -0.049 18517 16682 1 14 . 1 1 133 133 LEU H H 201 7.720 7.720 7.996 -0.276 18517 16683 1 14 . 1 1 134 134 LEU N N 202 120.680 120.680 119.342 1.338 18517 16684 1 14 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.833 0.147 18517 16685 1 14 . 1 1 134 134 LEU C C 202 179.030 179.030 179.340 -0.310 18517 16686 1 14 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.877 0.553 18517 16687 1 14 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.406 0.214 18517 16688 1 14 . 1 1 134 134 LEU H H 202 8.470 8.470 8.775 -0.305 18517 16689 1 14 . 1 1 135 135 SER N N 203 113.290 113.290 114.998 -1.708 18517 16690 1 14 . 1 1 135 135 SER HA H 203 4.180 4.180 4.188 -0.008 18517 16691 1 14 . 1 1 135 135 SER C C 203 177.300 177.300 177.036 0.264 18517 16692 1 14 . 1 1 135 135 SER CA C 203 62.080 62.080 61.693 0.388 18517 16693 1 14 . 1 1 135 135 SER CB C 203 63.030 63.030 62.203 0.827 18517 16694 1 14 . 1 1 135 135 SER H H 203 8.210 8.210 8.378 -0.168 18517 16695 1 14 . 1 1 136 136 SER N N 204 117.500 117.500 119.070 -1.570 18517 16696 1 14 . 1 1 136 136 SER HA H 204 4.050 4.050 4.202 -0.152 18517 16697 1 14 . 1 1 136 136 SER C C 204 177.570 177.570 176.549 1.021 18517 16698 1 14 . 1 1 136 136 SER CA C 204 61.880 61.880 61.940 -0.060 18517 16699 1 14 . 1 1 136 136 SER CB C 204 63.510 63.510 62.882 0.628 18517 16700 1 14 . 1 1 136 136 SER H H 204 7.730 7.730 8.081 -0.351 18517 16701 1 14 . 1 1 137 137 MET N N 205 122.500 122.500 121.756 0.744 18517 16702 1 14 . 1 1 137 137 MET HA H 205 4.140 4.140 4.012 0.128 18517 16703 1 14 . 1 1 137 137 MET C C 205 177.680 177.680 178.505 -0.825 18517 16704 1 14 . 1 1 137 137 MET CA C 205 60.140 60.140 59.442 0.698 18517 16705 1 14 . 1 1 137 137 MET CB C 205 33.460 33.460 32.393 1.067 18517 16706 1 14 . 1 1 137 137 MET H H 205 8.170 8.170 8.514 -0.344 18517 16707 1 14 . 1 1 138 138 LYS N N 206 121.410 121.410 119.421 1.989 18517 16708 1 14 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.934 -0.184 18517 16709 1 14 . 1 1 138 138 LYS C C 206 178.780 178.780 179.190 -0.410 18517 16710 1 14 . 1 1 138 138 LYS CA C 206 60.330 60.330 60.145 0.185 18517 16711 1 14 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.436 -0.166 18517 16712 1 14 . 1 1 138 138 LYS H H 206 8.810 8.810 8.438 0.372 18517 16713 1 14 . 1 1 139 139 THR N N 207 116.580 116.580 116.196 0.384 18517 16714 1 14 . 1 1 139 139 THR HA H 207 4.060 4.060 3.988 0.072 18517 16715 1 14 . 1 1 139 139 THR C C 207 176.730 176.730 176.876 -0.146 18517 16716 1 14 . 1 1 139 139 THR CA C 207 67.150 67.150 67.223 -0.073 18517 16717 1 14 . 1 1 139 139 THR CB C 207 69.220 69.220 68.588 0.632 18517 16718 1 14 . 1 1 139 139 THR H H 207 7.930 7.930 8.356 -0.426 18517 16719 1 14 . 1 1 140 140 GLN N N 208 121.390 121.390 121.175 0.215 18517 16720 1 14 . 1 1 140 140 GLN HA H 208 4.060 4.060 3.994 0.066 18517 16721 1 14 . 1 1 140 140 GLN C C 208 178.550 178.550 177.600 0.950 18517 16722 1 14 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.142 0.158 18517 16723 1 14 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.929 -0.069 18517 16724 1 14 . 1 1 140 140 GLN H H 208 7.600 7.600 8.276 -0.676 18517 16725 1 14 . 1 1 141 141 HIS N N 209 122.360 122.360 119.442 2.918 18517 16726 1 14 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.298 -0.468 18517 16727 1 14 . 1 1 141 141 HIS C C 209 176.390 176.390 177.300 -0.910 18517 16728 1 14 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.105 1.615 18517 16729 1 14 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.184 -1.084 18517 16730 1 14 . 1 1 141 141 HIS H H 209 8.980 8.980 8.530 0.450 18517 16731 1 14 . 1 1 142 142 ASP N N 210 120.740 120.740 120.637 0.103 18517 16732 1 14 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.340 0.010 18517 16733 1 14 . 1 1 142 142 ASP C C 210 179.490 179.490 178.025 1.465 18517 16734 1 14 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.951 -0.031 18517 16735 1 14 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.741 -0.151 18517 16736 1 14 . 1 1 142 142 ASP H H 210 8.770 8.770 8.501 0.269 18517 16737 1 14 . 1 1 143 143 GLU N N 211 119.010 119.010 120.692 -1.682 18517 16738 1 14 . 1 1 143 143 GLU HA H 211 3.970 3.970 3.977 -0.007 18517 16739 1 14 . 1 1 143 143 GLU C C 211 179.070 179.070 179.011 0.059 18517 16740 1 14 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.510 -0.209 18517 16741 1 14 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.739 -0.249 18517 16742 1 14 . 1 1 143 143 GLU H H 211 7.850 7.850 7.931 -0.081 18517 16743 1 14 . 1 1 144 144 LEU N N 212 122.500 122.500 120.365 2.135 18517 16744 1 14 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.104 -0.034 18517 16745 1 14 . 1 1 144 144 LEU C C 212 179.340 179.340 179.714 -0.374 18517 16746 1 14 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.081 0.309 18517 16747 1 14 . 1 1 144 144 LEU CB C 212 42.180 42.180 40.943 1.237 18517 16748 1 14 . 1 1 144 144 LEU H H 212 8.070 8.070 8.361 -0.291 18517 16749 1 14 . 1 1 145 145 LEU N N 213 118.110 118.110 119.511 -1.401 18517 16750 1 14 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.788 0.412 18517 16751 1 14 . 1 1 145 145 LEU C C 213 179.610 179.610 179.223 0.387 18517 16752 1 14 . 1 1 145 145 LEU CA C 213 58.750 58.750 58.319 0.431 18517 16753 1 14 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.054 0.176 18517 16754 1 14 . 1 1 145 145 LEU H H 213 8.370 8.370 8.183 0.187 18517 16755 1 14 . 1 1 146 146 LYS N N 214 117.290 117.290 119.870 -2.580 18517 16756 1 14 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.904 -0.074 18517 16757 1 14 . 1 1 146 146 LYS C C 214 179.900 179.900 178.792 1.108 18517 16758 1 14 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.161 1.169 18517 16759 1 14 . 1 1 146 146 LYS CB C 214 32.350 32.350 31.949 0.401 18517 16760 1 14 . 1 1 146 146 LYS H H 214 7.560 7.560 8.548 -0.988 18517 16761 1 14 . 1 1 147 147 LYS N N 215 120.330 120.330 118.889 1.441 18517 16762 1 14 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.008 0.012 18517 16763 1 14 . 1 1 147 147 LYS C C 215 180.550 180.550 179.443 1.107 18517 16764 1 14 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.437 0.663 18517 16765 1 14 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.329 0.411 18517 16766 1 14 . 1 1 147 147 LYS H H 215 7.830 7.830 8.044 -0.214 18517 16767 1 14 . 1 1 148 148 PHE N N 216 117.370 117.370 118.148 -0.778 18517 16768 1 14 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.233 -0.153 18517 16769 1 14 . 1 1 148 148 PHE C C 216 178.200 178.200 177.248 0.952 18517 16770 1 14 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.035 1.085 18517 16771 1 14 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.508 1.212 18517 16772 1 14 . 1 1 148 148 PHE H H 216 8.010 8.010 8.411 -0.401 18517 16773 1 14 . 1 1 149 149 ALA N N 217 118.990 118.990 120.420 -1.430 18517 16774 1 14 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.427 -0.317 18517 16775 1 14 . 1 1 149 149 ALA C C 217 177.330 177.330 178.052 -0.722 18517 16776 1 14 . 1 1 149 149 ALA CA C 217 53.750 53.750 52.947 0.803 18517 16777 1 14 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.569 -0.969 18517 16778 1 14 . 1 1 149 149 ALA H H 217 7.720 7.720 7.919 -0.199 18517 16779 1 14 . 1 1 150 150 ALA N N 218 118.690 118.690 120.781 -2.091 18517 16780 1 14 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.358 0.002 18517 16781 1 14 . 1 1 150 150 ALA C C 218 177.930 177.930 177.671 0.259 18517 16782 1 14 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.922 -0.832 18517 16783 1 14 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.642 0.098 18517 16784 1 14 . 1 1 150 150 ALA H H 218 7.280 7.280 7.678 -0.398 18517 16785 1 14 . 1 1 151 151 LEU N N 219 119.980 119.980 120.681 -0.701 18517 16786 1 14 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.455 -0.185 18517 16787 1 14 . 1 1 151 151 LEU C C 219 176.150 176.150 174.899 1.251 18517 16788 1 14 . 1 1 151 151 LEU CA C 219 56.170 56.170 54.660 1.510 18517 16789 1 14 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.557 -0.747 18517 16790 1 14 . 1 1 151 151 LEU H H 219 7.050 7.050 7.594 -0.544 18517 16791 1 14 . 1 1 152 152 THR N N 220 112.070 112.070 116.860 -4.790 18517 16792 1 14 . 1 1 152 152 THR HA H 220 4.700 4.700 4.920 -0.220 18517 16793 1 14 . 1 1 152 152 THR C C 220 173.400 173.400 173.100 0.300 18517 16794 1 14 . 1 1 152 152 THR CA C 220 58.190 58.190 58.370 -0.180 18517 16795 1 14 . 1 1 152 152 THR CB C 220 70.960 70.960 69.498 1.462 18517 16796 1 14 . 1 1 152 152 THR H H 220 8.040 8.040 8.202 -0.162 18517 16797 1 14 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.750 -0.040 18517 16798 1 14 . 1 1 153 153 PRO C C 221 176.720 176.720 176.001 0.719 18517 16799 1 14 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.052 0.858 18517 16800 1 14 . 1 1 153 153 PRO CB C 221 34.250 34.250 33.363 0.887 18517 16801 1 14 . 1 1 154 154 THR N N 222 120.460 120.460 118.222 2.238 18517 16802 1 14 . 1 1 154 154 THR HA H 222 4.250 4.250 4.365 -0.115 18517 16803 1 14 . 1 1 154 154 THR C C 222 175.190 175.190 175.352 -0.162 18517 16804 1 14 . 1 1 154 154 THR CA C 222 64.650 64.650 62.684 1.966 18517 16805 1 14 . 1 1 154 154 THR CB C 222 70.410 70.410 68.418 1.992 18517 16806 1 14 . 1 1 154 154 THR H H 222 8.530 8.530 8.491 0.039 18517 16807 1 14 . 1 1 155 155 PHE N N 223 122.260 122.260 122.811 -0.551 18517 16808 1 14 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.731 0.259 18517 16809 1 14 . 1 1 155 155 PHE C C 223 172.560 172.560 174.713 -2.153 18517 16810 1 14 . 1 1 155 155 PHE CA C 223 56.770 56.770 57.338 -0.568 18517 16811 1 14 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.260 1.330 18517 16812 1 14 . 1 1 155 155 PHE H H 223 8.950 8.950 7.528 1.422 18517 16813 1 14 . 1 1 156 156 LEU N N 224 123.440 123.440 120.741 2.699 18517 16814 1 14 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.410 0.260 18517 16815 1 14 . 1 1 156 156 LEU C C 224 175.090 175.090 176.823 -1.733 18517 16816 1 14 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.220 -0.190 18517 16817 1 14 . 1 1 156 156 LEU CB C 224 46.300 46.300 42.968 3.332 18517 16818 1 14 . 1 1 156 156 LEU H H 224 7.210 7.210 7.146 0.064 18517 16819 1 14 . 1 1 157 157 THR N N 225 113.010 113.010 115.804 -2.794 18517 16820 1 14 . 1 1 157 157 THR HA H 225 4.790 4.790 4.696 0.094 18517 16821 1 14 . 1 1 157 157 THR C C 225 176.130 176.130 174.752 1.378 18517 16822 1 14 . 1 1 157 157 THR CA C 225 59.860 59.860 61.505 -1.645 18517 16823 1 14 . 1 1 157 157 THR CB C 225 72.860 72.860 71.050 1.810 18517 16824 1 14 . 1 1 157 157 THR H H 225 9.200 9.200 8.350 0.850 18517 16825 1 14 . 1 1 158 158 SER N N 226 115.350 115.350 120.734 -5.384 18517 16826 1 14 . 1 1 158 158 SER C C 226 177.410 177.410 176.052 1.358 18517 16827 1 14 . 1 1 158 158 SER CA C 226 57.400 57.400 57.898 -0.498 18517 16828 1 14 . 1 1 158 158 SER CB C 226 66.200 66.200 63.533 2.667 18517 16829 1 14 . 1 1 158 158 SER H H 226 8.830 8.830 8.876 -0.046 18517 16830 1 14 . 1 1 159 159 GLU N N 227 121.200 121.200 119.519 1.681 18517 16831 1 14 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.996 0.024 18517 16832 1 14 . 1 1 159 159 GLU C C 227 177.680 177.680 176.486 1.194 18517 16833 1 14 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.385 1.115 18517 16834 1 14 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.344 0.226 18517 16835 1 14 . 1 1 159 159 GLU H H 227 8.320 8.320 8.705 -0.385 18517 16836 1 14 . 1 1 160 160 ASP N N 228 115.350 115.350 115.950 -0.600 18517 16837 1 14 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.392 0.158 18517 16838 1 14 . 1 1 160 160 ASP C C 228 177.640 177.640 177.476 0.164 18517 16839 1 14 . 1 1 160 160 ASP CA C 228 57.400 57.400 55.940 1.460 18517 16840 1 14 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.407 2.643 18517 16841 1 14 . 1 1 160 160 ASP H H 228 7.570 7.570 8.272 -0.702 18517 16842 1 14 . 1 1 161 161 ILE N N 229 108.150 108.150 113.113 -4.963 18517 16843 1 14 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.473 0.037 18517 16844 1 14 . 1 1 161 161 ILE C C 229 173.130 173.130 177.173 -4.043 18517 16845 1 14 . 1 1 161 161 ILE CA C 229 61.290 61.290 61.358 -0.068 18517 16846 1 14 . 1 1 161 161 ILE CB C 229 39.400 39.400 40.421 -1.021 18517 16847 1 14 . 1 1 161 161 ILE H H 229 7.190 7.190 7.720 -0.530 18517 16848 1 14 . 1 1 162 162 SER N N 230 115.290 115.290 117.801 -2.511 18517 16849 1 14 . 1 1 162 162 SER HA H 230 4.760 4.760 4.051 0.709 18517 16850 1 14 . 1 1 162 162 SER C C 230 176.060 176.060 174.019 2.041 18517 16851 1 14 . 1 1 162 162 SER CA C 230 57.920 57.920 57.939 -0.019 18517 16852 1 14 . 1 1 162 162 SER CB C 230 66.120 66.120 61.903 4.217 18517 16853 1 14 . 1 1 162 162 SER H H 230 7.460 7.460 8.378 -0.918 18517 16854 1 14 . 1 1 163 163 GLY C C 231 173.260 173.260 172.947 0.313 18517 16855 1 14 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.968 0.582 18517 16856 1 14 . 1 1 164 164 TYR N N 232 115.290 115.290 118.317 -3.027 18517 16857 1 14 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.670 0.030 18517 16858 1 14 . 1 1 164 164 TYR C C 232 172.820 172.820 173.721 -0.901 18517 16859 1 14 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.102 -0.002 18517 16860 1 14 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.873 -0.073 18517 16861 1 14 . 1 1 164 164 TYR H H 232 7.370 7.370 7.249 0.121 18517 16862 1 14 . 1 1 165 165 LEU N N 233 120.980 120.980 122.925 -1.945 18517 16863 1 14 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.500 -0.070 18517 16864 1 14 . 1 1 165 165 LEU C C 233 176.360 176.360 177.650 -1.290 18517 16865 1 14 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.426 1.234 18517 16866 1 14 . 1 1 165 165 LEU CB C 233 40.430 40.430 42.028 -1.598 18517 16867 1 14 . 1 1 165 165 LEU H H 233 8.830 8.830 8.557 0.273 18517 16868 1 14 . 1 1 166 166 THR N N 234 116.170 116.170 116.102 0.068 18517 16869 1 14 . 1 1 166 166 THR HA H 234 4.010 4.010 3.564 0.446 18517 16870 1 14 . 1 1 166 166 THR C C 234 173.070 173.070 173.991 -0.921 18517 16871 1 14 . 1 1 166 166 THR CA C 234 62.910 62.910 64.070 -1.160 18517 16872 1 14 . 1 1 166 166 THR CB C 234 70.170 70.170 69.154 1.016 18517 16873 1 14 . 1 1 166 166 THR H H 234 8.050 8.050 8.465 -0.415 18517 16874 1 14 . 1 1 167 167 VAL N N 235 117.640 117.640 116.164 1.476 18517 16875 1 14 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.373 -0.163 18517 16876 1 14 . 1 1 167 167 VAL C C 235 172.330 172.330 173.716 -1.386 18517 16877 1 14 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.896 0.854 18517 16878 1 14 . 1 1 167 167 VAL CB C 235 35.880 35.880 32.516 3.364 18517 16879 1 14 . 1 1 167 167 VAL H H 235 7.160 7.160 7.399 -0.239 18517 16880 1 14 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.473 -0.283 18517 16881 1 14 . 1 1 168 168 PRO C C 236 173.710 173.710 175.672 -1.962 18517 16882 1 14 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.496 1.334 18517 16883 1 14 . 1 1 168 168 PRO CB C 236 32.270 32.270 33.521 -1.251 18517 16884 1 14 . 1 1 169 169 GLU N N 237 113.540 113.540 118.733 -5.193 18517 16885 1 14 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.147 0.233 18517 16886 1 14 . 1 1 169 169 GLU C C 237 176.690 176.690 177.968 -1.278 18517 16887 1 14 . 1 1 169 169 GLU CA C 237 53.750 53.750 54.451 -0.701 18517 16888 1 14 . 1 1 169 169 GLU CB C 237 33.220 33.220 31.454 1.766 18517 16889 1 14 . 1 1 169 169 GLU H H 237 7.930 7.930 8.329 -0.399 18517 16890 1 14 . 1 1 170 170 TYR N N 238 119.400 119.400 121.303 -1.903 18517 16891 1 14 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.384 -0.384 18517 16892 1 14 . 1 1 170 170 TYR C C 238 177.610 177.610 176.467 1.143 18517 16893 1 14 . 1 1 170 170 TYR CA C 238 62.630 62.630 59.913 2.717 18517 16894 1 14 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.238 -0.498 18517 16895 1 14 . 1 1 170 170 TYR H H 238 8.490 8.490 8.499 -0.009 18517 16896 1 14 . 1 1 171 171 GLY N N 239 104.160 104.160 103.976 0.184 18517 16897 1 14 . 1 1 171 171 GLY C C 239 173.350 173.350 172.463 0.887 18517 16898 1 14 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.535 0.735 18517 16899 1 14 . 1 1 171 171 GLY H H 239 7.960 7.960 7.862 0.098 18517 16900 1 14 . 1 1 172 172 ALA N N 240 121.860 121.860 122.517 -0.657 18517 16901 1 14 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.862 -0.692 18517 16902 1 14 . 1 1 172 172 ALA C C 240 172.160 172.160 174.460 -2.300 18517 16903 1 14 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.258 0.852 18517 16904 1 14 . 1 1 172 172 ALA CB C 240 20.930 20.930 19.933 0.997 18517 16905 1 14 . 1 1 172 172 ALA H H 240 6.910 6.910 7.714 -0.804 18517 16906 1 14 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.840 0.710 18517 16907 1 14 . 1 1 173 173 PRO C C 241 176.610 176.610 174.979 1.631 18517 16908 1 14 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.221 -0.701 18517 16909 1 14 . 1 1 173 173 PRO CB C 241 33.300 33.300 32.816 0.484 18517 16910 1 14 . 1 1 174 174 MET N N 242 114.000 114.000 119.720 -5.720 18517 16911 1 14 . 1 1 174 174 MET HA H 242 4.390 4.390 4.458 -0.068 18517 16912 1 14 . 1 1 174 174 MET C C 242 173.960 173.960 174.252 -0.292 18517 16913 1 14 . 1 1 174 174 MET CA C 242 54.660 54.660 53.561 1.099 18517 16914 1 14 . 1 1 174 174 MET CB C 242 34.170 34.170 35.855 -1.685 18517 16915 1 14 . 1 1 174 174 MET H H 242 8.040 8.040 7.204 0.836 18517 16916 1 14 . 1 1 175 175 ASN N N 243 119.570 119.570 123.593 -4.023 18517 16917 1 14 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.817 0.123 18517 16918 1 14 . 1 1 175 175 ASN C C 243 174.320 174.320 175.195 -0.875 18517 16919 1 14 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.032 1.048 18517 16920 1 14 . 1 1 175 175 ASN CB C 243 38.850 38.850 38.349 0.501 18517 16921 1 14 . 1 1 175 175 ASN H H 243 7.960 7.960 8.234 -0.274 18517 16922 1 14 . 1 1 176 176 ALA N N 244 132.250 132.250 129.683 2.567 18517 16923 1 14 . 1 1 176 176 ALA C C 244 181.580 181.580 178.652 2.928 18517 16924 1 14 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.670 0.100 18517 16925 1 14 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.850 0.180 18517 16926 1 14 . 1 1 176 176 ALA H H 244 12.110 12.110 8.423 3.687 18517 16927 1 14 . 1 1 177 177 ALA N N 245 125.780 125.780 120.796 4.984 18517 16928 1 14 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.956 -0.086 18517 16929 1 14 . 1 1 177 177 ALA C C 245 180.640 180.640 179.669 0.971 18517 16930 1 14 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.292 0.368 18517 16931 1 14 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.018 -0.178 18517 16932 1 14 . 1 1 177 177 ALA H H 245 10.240 10.240 8.453 1.787 18517 16933 1 14 . 1 1 178 178 LYS N N 246 119.810 119.810 119.062 0.748 18517 16934 1 14 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.061 -0.231 18517 16935 1 14 . 1 1 178 178 LYS C C 246 180.500 180.500 178.323 2.177 18517 16936 1 14 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.129 0.771 18517 16937 1 14 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.340 -1.020 18517 16938 1 14 . 1 1 178 178 LYS H H 246 8.470 8.470 7.841 0.629 18517 16939 1 14 . 1 1 179 179 TRP N N 247 121.170 121.170 121.782 -0.612 18517 16940 1 14 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.316 0.304 18517 16941 1 14 . 1 1 179 179 TRP C C 247 176.510 176.510 177.906 -1.396 18517 16942 1 14 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.687 0.133 18517 16943 1 14 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.646 -0.076 18517 16944 1 14 . 1 1 179 179 TRP H H 247 8.330 8.330 8.474 -0.144 18517 16945 1 14 . 1 1 180 180 ALA N N 248 119.130 119.130 119.925 -0.795 18517 16946 1 14 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.770 0.770 18517 16947 1 14 . 1 1 180 180 ALA C C 248 182.110 182.110 179.566 2.544 18517 16948 1 14 . 1 1 180 180 ALA CA C 248 54.190 54.190 54.740 -0.550 18517 16949 1 14 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.055 0.655 18517 16950 1 14 . 1 1 180 180 ALA H H 248 7.990 7.990 8.627 -0.637 18517 16951 1 14 . 1 1 181 181 LYS N N 249 116.000 116.000 119.623 -3.623 18517 16952 1 14 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.090 -0.120 18517 16953 1 14 . 1 1 181 181 LYS C C 249 179.380 179.380 178.808 0.572 18517 16954 1 14 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.438 -0.728 18517 16955 1 14 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.740 -0.230 18517 16956 1 14 . 1 1 181 181 LYS H H 249 6.900 6.900 7.835 -0.935 18517 16957 1 14 . 1 1 182 182 VAL N N 250 122.270 122.270 116.357 5.913 18517 16958 1 14 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.769 -0.429 18517 16959 1 14 . 1 1 182 182 VAL C C 250 178.160 178.160 177.804 0.356 18517 16960 1 14 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.173 0.587 18517 16961 1 14 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.446 -0.606 18517 16962 1 14 . 1 1 182 182 VAL H H 250 7.050 7.050 8.084 -1.034 18517 16963 1 14 . 1 1 183 183 GLU N N 251 120.520 120.520 120.326 0.194 18517 16964 1 14 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.939 -0.759 18517 16965 1 14 . 1 1 183 183 GLU C C 251 179.480 179.480 178.833 0.647 18517 16966 1 14 . 1 1 183 183 GLU CA C 251 60.690 60.690 58.744 1.946 18517 16967 1 14 . 1 1 183 183 GLU CB C 251 28.070 28.070 29.004 -0.934 18517 16968 1 14 . 1 1 183 183 GLU H H 251 8.020 8.020 8.602 -0.582 18517 16969 1 14 . 1 1 184 184 GLY N N 252 102.930 102.930 107.848 -4.918 18517 16970 1 14 . 1 1 184 184 GLY C C 252 176.920 176.920 176.353 0.567 18517 16971 1 14 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.115 0.295 18517 16972 1 14 . 1 1 184 184 GLY H H 252 7.830 7.830 8.033 -0.203 18517 16973 1 14 . 1 1 185 185 MET N N 253 123.200 123.200 121.691 1.509 18517 16974 1 14 . 1 1 185 185 MET HA H 253 4.250 4.250 4.051 0.199 18517 16975 1 14 . 1 1 185 185 MET C C 253 179.370 179.370 178.496 0.874 18517 16976 1 14 . 1 1 185 185 MET CA C 253 59.300 59.300 59.294 0.006 18517 16977 1 14 . 1 1 185 185 MET CB C 253 33.930 33.930 32.491 1.439 18517 16978 1 14 . 1 1 185 185 MET H H 253 7.890 7.890 7.873 0.017 18517 16979 1 14 . 1 1 186 186 ILE N N 254 120.150 120.150 119.931 0.219 18517 16980 1 14 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.728 -0.168 18517 16981 1 14 . 1 1 186 186 ILE C C 254 177.250 177.250 178.053 -0.803 18517 16982 1 14 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.620 0.900 18517 16983 1 14 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.592 0.698 18517 16984 1 14 . 1 1 186 186 ILE H H 254 8.260 8.260 8.121 0.139 18517 16985 1 14 . 1 1 187 187 HIS N N 255 119.810 119.810 119.196 0.614 18517 16986 1 14 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.210 -0.210 18517 16987 1 14 . 1 1 187 187 HIS C C 255 176.460 176.460 177.377 -0.917 18517 16988 1 14 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.803 0.527 18517 16989 1 14 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.708 1.922 18517 16990 1 14 . 1 1 187 187 HIS H H 255 8.900 8.900 8.523 0.377 18517 16991 1 14 . 1 1 188 188 GLY N N 256 103.160 103.160 106.747 -3.587 18517 16992 1 14 . 1 1 188 188 GLY C C 256 176.320 176.320 176.073 0.247 18517 16993 1 14 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.878 0.012 18517 16994 1 14 . 1 1 188 188 GLY H H 256 8.030 8.030 8.458 -0.428 18517 16995 1 14 . 1 1 189 189 LYS N N 257 119.510 119.510 121.877 -2.367 18517 16996 1 14 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.096 -0.096 18517 16997 1 14 . 1 1 189 189 LYS C C 257 178.660 178.660 179.346 -0.686 18517 16998 1 14 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.061 -0.571 18517 16999 1 14 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.690 -0.140 18517 17000 1 14 . 1 1 189 189 LYS H H 257 7.120 7.120 7.820 -0.700 18517 17001 1 14 . 1 1 190 190 LEU N N 258 120.570 120.570 120.335 0.235 18517 17002 1 14 . 1 1 190 190 LEU HA H 258 3.930 3.930 3.991 -0.061 18517 17003 1 14 . 1 1 190 190 LEU C C 258 177.230 177.230 176.923 0.307 18517 17004 1 14 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.264 0.256 18517 17005 1 14 . 1 1 190 190 LEU CB C 258 42.970 42.970 41.969 1.001 18517 17006 1 14 . 1 1 190 190 LEU H H 258 8.060 8.060 8.307 -0.247 18517 17007 1 14 . 1 1 191 191 GLU N N 259 114.590 114.590 114.229 0.361 18517 17008 1 14 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.159 0.121 18517 17009 1 14 . 1 1 191 191 GLU C C 259 176.230 176.230 176.851 -0.621 18517 17010 1 14 . 1 1 191 191 GLU CA C 259 55.340 55.340 56.162 -0.822 18517 17011 1 14 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.449 -0.119 18517 17012 1 14 . 1 1 191 191 GLU H H 259 7.330 7.330 7.715 -0.385 18517 17013 1 14 . 1 1 192 192 SER N N 260 115.240 115.240 117.395 -2.155 18517 17014 1 14 . 1 1 192 192 SER HA H 260 4.490 4.490 4.315 0.175 18517 17015 1 14 . 1 1 192 192 SER C C 260 173.770 173.770 174.963 -1.193 18517 17016 1 14 . 1 1 192 192 SER CA C 260 58.350 58.350 58.605 -0.255 18517 17017 1 14 . 1 1 192 192 SER CB C 260 65.090 65.090 64.139 0.951 18517 17018 1 14 . 1 1 192 192 SER H H 260 7.130 7.130 7.524 -0.394 18517 17019 1 14 . 1 1 193 193 SER C C 261 174.600 174.600 174.753 -0.153 18517 17020 1 14 . 1 1 193 193 SER CA C 261 59.980 59.980 59.998 -0.018 18517 17021 1 14 . 1 1 193 193 SER CB C 261 63.750 63.750 63.282 0.468 18517 17022 1 14 . 1 1 194 194 GLU N N 262 121.800 121.800 121.735 0.065 18517 17023 1 14 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.629 -0.159 18517 17024 1 14 . 1 1 194 194 GLU C C 262 174.650 174.650 174.927 -0.277 18517 17025 1 14 . 1 1 194 194 GLU CA C 262 55.620 55.620 55.311 0.309 18517 17026 1 14 . 1 1 194 194 GLU CB C 262 30.210 30.210 30.077 0.133 18517 17027 1 14 . 1 1 194 194 GLU H H 262 7.840 7.840 8.319 -0.479 18517 17028 1 14 . 1 1 195 195 VAL N N 263 124.080 124.080 126.125 -2.045 18517 17029 1 14 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.313 -0.063 18517 17030 1 14 . 1 1 195 195 VAL C C 263 174.460 174.460 174.070 0.390 18517 17031 1 14 . 1 1 195 195 VAL CA C 263 59.820 59.820 59.203 0.617 18517 17032 1 14 . 1 1 195 195 VAL CB C 263 33.620 33.620 32.855 0.765 18517 17033 1 14 . 1 1 195 195 VAL H H 263 8.020 8.020 8.214 -0.194 18517 17034 1 14 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.405 0.115 18517 17035 1 14 . 1 1 198 198 ASN C C 266 176.490 176.490 177.237 -0.747 18517 17036 1 14 . 1 1 198 198 ASN CA C 266 54.780 54.780 55.315 -0.534 18517 17037 1 14 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.904 0.156 18517 17038 1 14 . 1 1 199 199 LEU N N 267 120.680 120.680 121.070 -0.390 18517 17039 1 14 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.862 0.148 18517 17040 1 14 . 1 1 199 199 LEU C C 267 178.050 178.050 178.351 -0.301 18517 17041 1 14 . 1 1 199 199 LEU CA C 267 58.830 58.830 57.717 1.113 18517 17042 1 14 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.448 0.892 18517 17043 1 14 . 1 1 199 199 LEU H H 267 7.660 7.660 7.718 -0.058 18517 17044 1 14 . 1 1 200 200 LYS N N 268 116.740 116.740 119.749 -3.009 18517 17045 1 14 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.873 -0.143 18517 17046 1 14 . 1 1 200 200 LYS C C 268 178.520 178.520 178.635 -0.115 18517 17047 1 14 . 1 1 200 200 LYS CA C 268 61.800 61.800 58.996 2.804 18517 17048 1 14 . 1 1 200 200 LYS CB C 268 32.110 32.110 31.755 0.355 18517 17049 1 14 . 1 1 200 200 LYS H H 268 8.280 8.280 8.508 -0.228 18517 17050 1 14 . 1 1 201 201 ALA N N 269 121.270 121.270 121.722 -0.452 18517 17051 1 14 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.052 0.188 18517 17052 1 14 . 1 1 201 201 ALA C C 269 180.890 180.890 179.639 1.251 18517 17053 1 14 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.131 0.049 18517 17054 1 14 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.380 0.090 18517 17055 1 14 . 1 1 201 201 ALA H H 269 7.710 7.710 7.802 -0.092 18517 17056 1 14 . 1 1 202 202 LEU N N 270 119.980 119.980 119.180 0.800 18517 17057 1 14 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.834 0.256 18517 17058 1 14 . 1 1 202 202 LEU C C 270 179.330 179.330 179.344 -0.014 18517 17059 1 14 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.915 0.155 18517 17060 1 14 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.047 1.373 18517 17061 1 14 . 1 1 202 202 LEU H H 270 7.750 7.750 8.286 -0.536 18517 17062 1 14 . 1 1 203 203 VAL N N 271 118.450 118.450 119.576 -1.126 18517 17063 1 14 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.888 -0.058 18517 17064 1 14 . 1 1 203 203 VAL C C 271 177.110 177.110 178.127 -1.017 18517 17065 1 14 . 1 1 203 203 VAL CA C 271 67.710 67.710 66.682 1.028 18517 17066 1 14 . 1 1 203 203 VAL CB C 271 31.710 31.710 30.701 1.009 18517 17067 1 14 . 1 1 203 203 VAL H H 271 8.560 8.560 8.542 0.018 18517 17068 1 14 . 1 1 204 204 ALA N N 272 122.560 122.560 121.570 0.990 18517 17069 1 14 . 1 1 204 204 ALA HA H 272 3.880 3.880 3.996 -0.116 18517 17070 1 14 . 1 1 204 204 ALA C C 272 178.700 178.700 179.959 -1.259 18517 17071 1 14 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.615 0.515 18517 17072 1 14 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.197 0.193 18517 17073 1 14 . 1 1 204 204 ALA H H 272 8.120 8.120 8.242 -0.122 18517 17074 1 14 . 1 1 205 205 GLU N N 273 117.290 117.290 119.035 -1.745 18517 17075 1 14 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.073 -0.083 18517 17076 1 14 . 1 1 205 205 GLU C C 273 178.630 178.630 179.195 -0.565 18517 17077 1 14 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.254 0.886 18517 17078 1 14 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.445 0.525 18517 17079 1 14 . 1 1 205 205 GLU H H 273 7.670 7.670 8.178 -0.508 18517 17080 1 14 . 1 1 206 206 LEU N N 274 120.450 120.450 121.625 -1.175 18517 17081 1 14 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.089 -0.089 18517 17082 1 14 . 1 1 206 206 LEU C C 274 178.400 178.400 179.043 -0.643 18517 17083 1 14 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.168 0.742 18517 17084 1 14 . 1 1 206 206 LEU CB C 274 43.530 43.530 42.175 1.355 18517 17085 1 14 . 1 1 206 206 LEU H H 274 8.420 8.420 8.606 -0.186 18517 17086 1 14 . 1 1 207 207 ILE N N 275 117.580 117.580 120.066 -2.486 18517 17087 1 14 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.805 -0.275 18517 17088 1 14 . 1 1 207 207 ILE C C 275 178.850 178.850 178.648 0.202 18517 17089 1 14 . 1 1 207 207 ILE CA C 275 66.080 66.080 63.832 2.248 18517 17090 1 14 . 1 1 207 207 ILE CB C 275 38.770 38.770 36.530 2.240 18517 17091 1 14 . 1 1 207 207 ILE H H 275 8.700 8.700 8.763 -0.063 18517 17092 1 14 . 1 1 208 208 GLU N N 276 119.100 119.100 119.174 -0.074 18517 17093 1 14 . 1 1 208 208 GLU HA H 276 4.000 4.000 4.136 -0.136 18517 17094 1 14 . 1 1 208 208 GLU C C 276 178.540 178.540 179.576 -1.036 18517 17095 1 14 . 1 1 208 208 GLU CA C 276 60.450 60.450 58.940 1.510 18517 17096 1 14 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.274 1.246 18517 17097 1 14 . 1 1 208 208 GLU H H 276 7.950 7.950 8.102 -0.152 18517 17098 1 14 . 1 1 209 209 LEU N N 277 120.590 120.590 122.841 -2.251 18517 17099 1 14 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.111 0.109 18517 17100 1 14 . 1 1 209 209 LEU C C 277 179.520 179.520 178.217 1.303 18517 17101 1 14 . 1 1 209 209 LEU CA C 277 58.350 58.350 58.286 0.064 18517 17102 1 14 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.970 1.320 18517 17103 1 14 . 1 1 209 209 LEU H H 277 8.550 8.550 8.566 -0.016 18517 17104 1 14 . 1 1 210 210 ARG N N 278 116.470 116.470 119.389 -2.919 18517 17105 1 14 . 1 1 210 210 ARG HA H 278 3.740 3.740 4.060 -0.320 18517 17106 1 14 . 1 1 210 210 ARG C C 278 179.190 179.190 178.503 0.687 18517 17107 1 14 . 1 1 210 210 ARG CA C 278 61.680 61.680 58.755 2.925 18517 17108 1 14 . 1 1 210 210 ARG CB C 278 31.400 31.400 29.804 1.596 18517 17109 1 14 . 1 1 210 210 ARG H H 278 8.590 8.590 8.784 -0.194 18517 17110 1 14 . 1 1 211 211 ALA N N 279 120.470 120.470 122.498 -2.028 18517 17111 1 14 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.080 -0.170 18517 17112 1 14 . 1 1 211 211 ALA C C 279 181.350 181.350 179.891 1.459 18517 17113 1 14 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.222 0.478 18517 17114 1 14 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.093 -0.813 18517 17115 1 14 . 1 1 211 211 ALA H H 279 8.050 8.050 8.308 -0.258 18517 17116 1 14 . 1 1 212 212 GLN N N 280 120.070 120.070 118.457 1.613 18517 17117 1 14 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.937 0.083 18517 17118 1 14 . 1 1 212 212 GLN C C 280 179.490 179.490 178.569 0.921 18517 17119 1 14 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.670 0.629 18517 17120 1 14 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.731 0.449 18517 17121 1 14 . 1 1 212 212 GLN H H 280 8.300 8.300 8.021 0.279 18517 17122 1 14 . 1 1 213 213 MET N N 281 119.810 119.810 120.155 -0.345 18517 17123 1 14 . 1 1 213 213 MET HA H 281 3.730 3.730 4.163 -0.433 18517 17124 1 14 . 1 1 213 213 MET C C 281 177.490 177.490 178.279 -0.789 18517 17125 1 14 . 1 1 213 213 MET CA C 281 60.690 60.690 58.350 2.340 18517 17126 1 14 . 1 1 213 213 MET CB C 281 33.930 33.930 32.523 1.407 18517 17127 1 14 . 1 1 213 213 MET H H 281 8.420 8.420 8.519 -0.099 18517 17128 1 14 . 1 1 214 214 MET N N 282 114.000 114.000 118.008 -4.008 18517 17129 1 14 . 1 1 214 214 MET HA H 282 3.880 3.880 4.261 -0.381 18517 17130 1 14 . 1 1 214 214 MET C C 282 177.650 177.650 178.236 -0.586 18517 17131 1 14 . 1 1 214 214 MET CA C 282 58.670 58.670 57.397 1.273 18517 17132 1 14 . 1 1 214 214 MET CB C 282 33.300 33.300 31.855 1.446 18517 17133 1 14 . 1 1 214 214 MET H H 282 7.890 7.890 8.286 -0.396 18517 17134 1 14 . 1 1 215 215 ALA N N 283 119.970 119.970 123.099 -3.129 18517 17135 1 14 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.060 0.080 18517 17136 1 14 . 1 1 215 215 ALA C C 283 180.580 180.580 179.196 1.384 18517 17137 1 14 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.019 -0.909 18517 17138 1 14 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.461 -0.781 18517 17139 1 14 . 1 1 215 215 ALA H H 283 7.580 7.580 8.161 -0.581 18517 17140 1 14 . 1 1 216 216 LEU N N 284 120.920 120.920 118.116 2.804 18517 17141 1 14 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.146 -0.186 18517 17142 1 14 . 1 1 216 216 LEU C C 284 177.910 177.910 179.470 -1.560 18517 17143 1 14 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.262 0.658 18517 17144 1 14 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.186 0.314 18517 17145 1 14 . 1 1 216 216 LEU H H 284 7.460 7.460 8.196 -0.736 18517 17146 1 14 . 1 1 217 217 LEU N N 285 116.470 116.470 119.948 -3.478 18517 17147 1 14 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.844 -0.164 18517 17148 1 14 . 1 1 217 217 LEU C C 285 178.310 178.310 176.859 1.451 18517 17149 1 14 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.637 -0.197 18517 17150 1 14 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.781 1.269 18517 17151 1 14 . 1 1 217 217 LEU H H 285 6.980 6.980 8.296 -1.316 18517 17152 1 14 . 1 1 218 218 TYR N N 286 111.080 111.080 114.155 -3.075 18517 17153 1 14 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.567 0.333 18517 17154 1 14 . 1 1 218 218 TYR C C 286 176.090 176.090 175.864 0.226 18517 17155 1 14 . 1 1 218 218 TYR CA C 286 56.050 56.050 56.944 -0.894 18517 17156 1 14 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.406 2.504 18517 17157 1 14 . 1 1 218 218 TYR H H 286 7.660 7.660 7.754 -0.094 18517 17158 1 14 . 1 1 219 219 GLY N N 287 108.260 108.260 108.861 -0.601 18517 17159 1 14 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.151 1.169 18517 17160 1 14 . 1 1 219 219 GLY H H 287 7.750 7.750 7.866 -0.116 18517 17161 1 14 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.610 -0.120 18517 17162 1 14 . 1 1 221 221 ILE CA C 289 63.580 63.580 64.578 -0.998 18517 17163 1 14 . 1 1 221 221 ILE CB C 289 38.280 38.280 37.937 0.343 18517 17164 1 14 . 1 1 222 222 GLY CA C 290 45.740 45.740 45.141 0.599 18517 17165 1 15 . 1 1 2 2 LYS N N 70 126.600 126.600 126.010 0.590 18517 17166 1 15 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.825 -0.465 18517 17167 1 15 . 1 1 2 2 LYS C C 70 176.000 176.000 174.267 1.733 18517 17168 1 15 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.537 0.913 18517 17169 1 15 . 1 1 2 2 LYS CB C 70 33.850 33.850 35.222 -1.372 18517 17170 1 15 . 1 1 2 2 LYS H H 70 8.530 8.530 8.420 0.110 18517 17171 1 15 . 1 1 3 3 THR N N 71 111.030 111.030 113.321 -2.291 18517 17172 1 15 . 1 1 3 3 THR HA H 71 4.400 4.400 4.432 -0.032 18517 17173 1 15 . 1 1 3 3 THR C C 71 175.650 175.650 174.371 1.279 18517 17174 1 15 . 1 1 3 3 THR CA C 71 60.610 60.610 61.351 -0.741 18517 17175 1 15 . 1 1 3 3 THR CB C 71 71.520 71.520 69.773 1.747 18517 17176 1 15 . 1 1 3 3 THR H H 71 7.390 7.390 7.886 -0.496 18517 17177 1 15 . 1 1 4 4 LEU N N 72 121.560 121.560 122.429 -0.869 18517 17178 1 15 . 1 1 4 4 LEU C C 72 177.870 177.870 178.315 -0.445 18517 17179 1 15 . 1 1 4 4 LEU CA C 72 58.480 58.480 59.586 -1.106 18517 17180 1 15 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.742 0.438 18517 17181 1 15 . 1 1 4 4 LEU H H 72 8.980 8.980 8.581 0.399 18517 17182 1 15 . 1 1 5 5 ASP N N 73 115.530 115.530 117.251 -1.721 18517 17183 1 15 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.374 -0.044 18517 17184 1 15 . 1 1 5 5 ASP C C 73 179.290 179.290 178.296 0.994 18517 17185 1 15 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.185 0.655 18517 17186 1 15 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.614 0.216 18517 17187 1 15 . 1 1 5 5 ASP H H 73 8.270 8.270 8.782 -0.512 18517 17188 1 15 . 1 1 6 6 VAL N N 74 122.330 122.330 120.523 1.807 18517 17189 1 15 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.781 -0.041 18517 17190 1 15 . 1 1 6 6 VAL C C 74 178.970 178.970 177.800 1.170 18517 17191 1 15 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.871 0.489 18517 17192 1 15 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.926 0.024 18517 17193 1 15 . 1 1 6 6 VAL H H 74 7.400 7.400 7.255 0.145 18517 17194 1 15 . 1 1 7 7 LEU N N 75 121.360 121.360 121.287 0.073 18517 17195 1 15 . 1 1 7 7 LEU HA H 75 4.030 4.030 4.197 -0.167 18517 17196 1 15 . 1 1 7 7 LEU C C 75 179.240 179.240 179.576 -0.336 18517 17197 1 15 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.083 0.147 18517 17198 1 15 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.255 1.635 18517 17199 1 15 . 1 1 7 7 LEU H H 75 8.300 8.300 8.621 -0.321 18517 17200 1 15 . 1 1 8 8 ARG N N 76 117.230 117.230 118.494 -1.264 18517 17201 1 15 . 1 1 8 8 ARG HA H 76 3.920 3.920 3.987 -0.067 18517 17202 1 15 . 1 1 8 8 ARG C C 76 178.290 178.290 178.989 -0.699 18517 17203 1 15 . 1 1 8 8 ARG CA C 76 60.770 60.770 60.013 0.757 18517 17204 1 15 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.776 0.434 18517 17205 1 15 . 1 1 8 8 ARG H H 76 8.520 8.520 8.739 -0.219 18517 17206 1 15 . 1 1 9 9 GLY N N 77 104.570 104.570 107.340 -2.770 18517 17207 1 15 . 1 1 9 9 GLY C C 77 176.180 176.180 176.065 0.115 18517 17208 1 15 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.717 0.453 18517 17209 1 15 . 1 1 9 9 GLY H H 77 7.620 7.620 8.222 -0.602 18517 17210 1 15 . 1 1 10 10 GLU N N 78 120.270 120.270 123.157 -2.887 18517 17211 1 15 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.018 0.252 18517 17212 1 15 . 1 1 10 10 GLU C C 78 179.030 179.030 179.151 -0.121 18517 17213 1 15 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.263 -0.393 18517 17214 1 15 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.488 1.912 18517 17215 1 15 . 1 1 10 10 GLU H H 78 8.100 8.100 8.294 -0.194 18517 17216 1 15 . 1 1 11 11 LEU N N 79 116.000 116.000 120.084 -4.084 18517 17217 1 15 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.916 0.594 18517 17218 1 15 . 1 1 11 11 LEU C C 79 179.630 179.630 178.972 0.658 18517 17219 1 15 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.706 -2.016 18517 17220 1 15 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.636 3.164 18517 17221 1 15 . 1 1 11 11 LEU H H 79 8.230 8.230 8.543 -0.313 18517 17222 1 15 . 1 1 12 12 ARG N N 80 120.020 120.020 118.427 1.593 18517 17223 1 15 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.904 -0.154 18517 17224 1 15 . 1 1 12 12 ARG C C 80 178.490 178.490 179.165 -0.675 18517 17225 1 15 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.842 2.158 18517 17226 1 15 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.933 1.307 18517 17227 1 15 . 1 1 12 12 ARG H H 80 8.210 8.210 8.369 -0.159 18517 17228 1 15 . 1 1 13 13 GLY N N 81 108.090 108.090 107.502 0.588 18517 17229 1 15 . 1 1 13 13 GLY C C 81 173.540 173.540 175.857 -2.317 18517 17230 1 15 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.668 1.332 18517 17231 1 15 . 1 1 13 13 GLY H H 81 8.890 8.890 8.568 0.322 18517 17232 1 15 . 1 1 14 14 GLN C C 82 179.540 179.540 178.133 1.407 18517 17233 1 15 . 1 1 14 14 GLN CA C 82 58.710 58.710 58.928 -0.218 18517 17234 1 15 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.715 0.385 18517 17235 1 15 . 1 1 15 15 ARG N N 83 118.220 118.220 120.232 -2.012 18517 17236 1 15 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.041 -0.091 18517 17237 1 15 . 1 1 15 15 ARG C C 83 177.710 177.710 178.245 -0.535 18517 17238 1 15 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.332 0.568 18517 17239 1 15 . 1 1 15 15 ARG CB C 83 29.650 29.650 29.805 -0.155 18517 17240 1 15 . 1 1 15 15 ARG H H 83 7.320 7.320 8.521 -1.201 18517 17241 1 15 . 1 1 16 16 GLU N N 84 118.810 118.810 119.861 -1.051 18517 17242 1 15 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.174 -0.324 18517 17243 1 15 . 1 1 16 16 GLU C C 84 178.750 178.750 178.717 0.033 18517 17244 1 15 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.479 1.531 18517 17245 1 15 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.547 -0.137 18517 17246 1 15 . 1 1 16 16 GLU H H 84 8.450 8.450 8.308 0.142 18517 17247 1 15 . 1 1 17 17 ALA N N 85 122.790 122.790 122.600 0.190 18517 17248 1 15 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.119 0.071 18517 17249 1 15 . 1 1 17 17 ALA C C 85 180.360 180.360 179.548 0.812 18517 17250 1 15 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.137 0.323 18517 17251 1 15 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.267 -0.187 18517 17252 1 15 . 1 1 17 17 ALA H H 85 8.420 8.420 8.213 0.206 18517 17253 1 15 . 1 1 18 18 PHE N N 86 119.400 119.400 119.908 -0.508 18517 17254 1 15 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.192 0.098 18517 17255 1 15 . 1 1 18 18 PHE C C 86 177.560 177.560 177.354 0.206 18517 17256 1 15 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.635 0.005 18517 17257 1 15 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.299 0.341 18517 17258 1 15 . 1 1 18 18 PHE H H 86 7.490 7.490 8.203 -0.713 18517 17259 1 15 . 1 1 19 19 LEU N N 87 117.470 117.470 119.825 -2.355 18517 17260 1 15 . 1 1 19 19 LEU HA H 87 4.070 4.070 4.008 0.062 18517 17261 1 15 . 1 1 19 19 LEU C C 87 178.880 178.880 178.500 0.380 18517 17262 1 15 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.462 -0.502 18517 17263 1 15 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.738 0.362 18517 17264 1 15 . 1 1 19 19 LEU H H 87 8.010 8.010 8.775 -0.765 18517 17265 1 15 . 1 1 20 20 SER N N 88 113.770 113.770 115.082 -1.312 18517 17266 1 15 . 1 1 20 20 SER HA H 88 4.070 4.070 4.140 -0.070 18517 17267 1 15 . 1 1 20 20 SER C C 88 175.680 175.680 176.920 -1.240 18517 17268 1 15 . 1 1 20 20 SER CA C 88 63.070 63.070 62.412 0.658 18517 17269 1 15 . 1 1 20 20 SER H H 88 8.100 8.100 8.368 -0.268 18517 17270 1 15 . 1 1 21 21 GLU N N 89 120.570 120.570 121.942 -1.372 18517 17271 1 15 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.005 -0.035 18517 17272 1 15 . 1 1 21 21 GLU C C 89 178.940 178.940 178.944 -0.004 18517 17273 1 15 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.362 -0.102 18517 17274 1 15 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.270 0.060 18517 17275 1 15 . 1 1 21 21 GLU H H 89 7.400 7.400 7.854 -0.454 18517 17276 1 15 . 1 1 22 22 ILE N N 90 119.350 119.350 119.639 -0.289 18517 17277 1 15 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.933 -0.243 18517 17278 1 15 . 1 1 22 22 ILE C C 90 177.230 177.230 178.749 -1.519 18517 17279 1 15 . 1 1 22 22 ILE CA C 90 63.470 63.470 63.135 0.336 18517 17280 1 15 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.476 -0.086 18517 17281 1 15 . 1 1 22 22 ILE H H 90 7.250 7.250 8.082 -0.832 18517 17282 1 15 . 1 1 23 23 ILE N N 91 116.350 116.350 119.003 -2.653 18517 17283 1 15 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.813 -0.413 18517 17284 1 15 . 1 1 23 23 ILE C C 91 176.690 176.690 176.558 0.132 18517 17285 1 15 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.304 2.426 18517 17286 1 15 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.097 0.673 18517 17287 1 15 . 1 1 23 23 ILE H H 91 7.860 7.860 8.464 -0.604 18517 17288 1 15 . 1 1 24 24 LYS N N 92 116.000 116.000 117.010 -1.010 18517 17289 1 15 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.279 -0.139 18517 17290 1 15 . 1 1 24 24 LYS C C 92 176.270 176.270 176.670 -0.400 18517 17291 1 15 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.438 0.042 18517 17292 1 15 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.984 0.316 18517 17293 1 15 . 1 1 24 24 LYS H H 92 7.170 7.170 7.874 -0.704 18517 17294 1 15 . 1 1 25 25 SER N N 93 114.650 114.650 115.411 -0.761 18517 17295 1 15 . 1 1 25 25 SER HA H 93 4.550 4.550 4.377 0.173 18517 17296 1 15 . 1 1 25 25 SER C C 93 173.370 173.370 173.072 0.298 18517 17297 1 15 . 1 1 25 25 SER CA C 93 57.240 57.240 59.009 -1.769 18517 17298 1 15 . 1 1 25 25 SER CB C 93 65.650 65.650 63.994 1.656 18517 17299 1 15 . 1 1 25 25 SER H H 93 7.730 7.730 7.826 -0.096 18517 17300 1 15 . 1 1 26 26 ASP N N 94 121.230 121.230 123.501 -2.271 18517 17301 1 15 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.773 0.157 18517 17302 1 15 . 1 1 26 26 ASP C C 94 176.560 176.560 175.686 0.874 18517 17303 1 15 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.486 1.024 18517 17304 1 15 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.791 0.859 18517 17305 1 15 . 1 1 26 26 ASP H H 94 8.280 8.280 8.519 -0.239 18517 17306 1 15 . 1 1 27 27 GLY N N 95 109.310 109.310 108.867 0.443 18517 17307 1 15 . 1 1 27 27 GLY C C 95 171.080 171.080 171.614 -0.534 18517 17308 1 15 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.306 -0.536 18517 17309 1 15 . 1 1 27 27 GLY H H 95 8.160 8.160 7.658 0.502 18517 17310 1 15 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.661 0.479 18517 17311 1 15 . 1 1 29 29 PHE C C 97 175.230 175.230 176.053 -0.823 18517 17312 1 15 . 1 1 29 29 PHE CA C 97 56.490 56.490 55.883 0.607 18517 17313 1 15 . 1 1 29 29 PHE CB C 97 41.620 41.620 42.045 -0.425 18517 17314 1 15 . 1 1 30 30 THR N N 98 112.600 112.600 111.266 1.334 18517 17315 1 15 . 1 1 30 30 THR HA H 98 4.570 4.570 4.111 0.459 18517 17316 1 15 . 1 1 30 30 THR C C 98 176.690 176.690 174.673 2.017 18517 17317 1 15 . 1 1 30 30 THR CA C 98 60.290 60.290 59.972 0.318 18517 17318 1 15 . 1 1 30 30 THR CB C 98 71.600 71.600 71.189 0.411 18517 17319 1 15 . 1 1 30 30 THR H H 98 8.990 8.990 8.312 0.678 18517 17320 1 15 . 1 1 31 31 ILE N N 99 119.240 119.240 121.622 -2.382 18517 17321 1 15 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.807 0.013 18517 17322 1 15 . 1 1 31 31 ILE C C 99 176.090 176.090 176.343 -0.253 18517 17323 1 15 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.262 -3.122 18517 17324 1 15 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.873 -0.923 18517 17325 1 15 . 1 1 31 31 ILE H H 99 9.230 9.230 8.174 1.056 18517 17326 1 15 . 1 1 32 32 LEU N N 100 119.660 119.660 120.438 -0.778 18517 17327 1 15 . 1 1 32 32 LEU HA H 100 4.030 4.030 4.143 -0.113 18517 17328 1 15 . 1 1 32 32 LEU C C 100 181.050 181.050 178.816 2.234 18517 17329 1 15 . 1 1 32 32 LEU CA C 100 57.560 57.560 58.067 -0.507 18517 17330 1 15 . 1 1 32 32 LEU CB C 100 40.120 40.120 41.700 -1.580 18517 17331 1 15 . 1 1 32 32 LEU H H 100 7.310 7.310 7.973 -0.663 18517 17332 1 15 . 1 1 33 33 GLN N N 101 121.450 121.450 119.239 2.211 18517 17333 1 15 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.270 -0.020 18517 17334 1 15 . 1 1 33 33 GLN CA C 101 59.700 59.700 58.803 0.897 18517 17335 1 15 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.328 3.462 18517 17336 1 15 . 1 1 33 33 GLN H H 101 7.790 7.790 8.200 -0.410 18517 17337 1 15 . 1 1 34 34 LEU C C 102 178.590 178.590 179.300 -0.710 18517 17338 1 15 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.177 0.453 18517 17339 1 15 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.442 -0.132 18517 17340 1 15 . 1 1 35 35 VAL N N 103 118.520 118.520 115.796 2.724 18517 17341 1 15 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.767 -0.347 18517 17342 1 15 . 1 1 35 35 VAL C C 103 177.930 177.930 177.920 0.010 18517 17343 1 15 . 1 1 35 35 VAL CA C 103 66.040 66.040 65.885 0.155 18517 17344 1 15 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.242 1.388 18517 17345 1 15 . 1 1 35 35 VAL H H 103 8.670 8.670 8.460 0.210 18517 17346 1 15 . 1 1 36 36 GLY N N 104 109.430 109.430 108.519 0.911 18517 17347 1 15 . 1 1 36 36 GLY C C 104 174.600 174.600 175.426 -0.826 18517 17348 1 15 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.047 0.993 18517 17349 1 15 . 1 1 36 36 GLY H H 104 7.880 7.880 8.234 -0.354 18517 17350 1 15 . 1 1 37 37 TYR N N 105 122.270 122.270 123.935 -1.665 18517 17351 1 15 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.451 -0.571 18517 17352 1 15 . 1 1 37 37 TYR C C 105 176.310 176.310 176.918 -0.608 18517 17353 1 15 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.018 4.082 18517 17354 1 15 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.883 -0.513 18517 17355 1 15 . 1 1 37 37 TYR H H 105 8.170 8.170 8.422 -0.252 18517 17356 1 15 . 1 1 38 38 LEU N N 106 120.100 120.100 121.197 -1.097 18517 17357 1 15 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.817 -0.077 18517 17358 1 15 . 1 1 38 38 LEU C C 106 178.280 178.280 178.483 -0.203 18517 17359 1 15 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.023 0.607 18517 17360 1 15 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.125 1.605 18517 17361 1 15 . 1 1 38 38 LEU H H 106 7.610 7.610 8.334 -0.724 18517 17362 1 15 . 1 1 39 39 ARG N N 107 116.670 116.670 118.906 -2.236 18517 17363 1 15 . 1 1 39 39 ARG HA H 107 3.680 3.680 4.185 -0.505 18517 17364 1 15 . 1 1 39 39 ARG C C 107 179.480 179.480 178.579 0.901 18517 17365 1 15 . 1 1 39 39 ARG CA C 107 59.580 59.580 59.236 0.344 18517 17366 1 15 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.902 1.338 18517 17367 1 15 . 1 1 39 39 ARG H H 107 8.240 8.240 7.872 0.368 18517 17368 1 15 . 1 1 40 40 VAL N N 108 121.970 121.970 119.508 2.462 18517 17369 1 15 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.683 -0.283 18517 17370 1 15 . 1 1 40 40 VAL C C 108 178.440 178.440 178.624 -0.184 18517 17371 1 15 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.277 1.673 18517 17372 1 15 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.208 -0.768 18517 17373 1 15 . 1 1 40 40 VAL H H 108 8.200 8.200 7.929 0.271 18517 17374 1 15 . 1 1 41 41 VAL N N 109 108.940 108.940 116.692 -7.752 18517 17375 1 15 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.477 0.763 18517 17376 1 15 . 1 1 41 41 VAL C C 109 175.070 175.070 177.577 -2.507 18517 17377 1 15 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.866 -3.276 18517 17378 1 15 . 1 1 41 41 VAL CB C 109 29.650 29.650 29.863 -0.213 18517 17379 1 15 . 1 1 41 41 VAL H H 109 7.760 7.760 8.110 -0.350 18517 17380 1 15 . 1 1 42 42 ASP N N 110 124.670 124.670 122.384 2.286 18517 17381 1 15 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.324 0.296 18517 17382 1 15 . 1 1 42 42 ASP C C 110 177.310 177.310 178.811 -1.501 18517 17383 1 15 . 1 1 42 42 ASP CA C 110 59.980 59.980 58.019 1.961 18517 17384 1 15 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.600 4.350 18517 17385 1 15 . 1 1 42 42 ASP H H 110 7.360 7.360 8.360 -1.000 18517 17386 1 15 . 1 1 43 43 THR N N 111 102.340 102.340 112.891 -10.551 18517 17387 1 15 . 1 1 43 43 THR HA H 111 5.100 5.100 3.918 1.182 18517 17388 1 15 . 1 1 43 43 THR C C 111 174.940 174.940 176.886 -1.946 18517 17389 1 15 . 1 1 43 43 THR CA C 111 60.650 60.650 66.007 -5.357 18517 17390 1 15 . 1 1 43 43 THR CB C 111 69.610 69.610 68.718 0.892 18517 17391 1 15 . 1 1 43 43 THR H H 111 6.380 6.380 7.995 -1.615 18517 17392 1 15 . 1 1 44 44 ASP N N 112 119.750 119.750 123.363 -3.613 18517 17393 1 15 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.354 -0.494 18517 17394 1 15 . 1 1 44 44 ASP C C 112 178.850 178.850 178.374 0.476 18517 17395 1 15 . 1 1 44 44 ASP CA C 112 58.230 58.230 58.141 0.089 18517 17396 1 15 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.478 -1.078 18517 17397 1 15 . 1 1 44 44 ASP H H 112 9.050 9.050 8.363 0.687 18517 17398 1 15 . 1 1 45 45 LEU N N 113 123.910 123.910 121.271 2.639 18517 17399 1 15 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.949 -0.139 18517 17400 1 15 . 1 1 45 45 LEU C C 113 182.040 182.040 178.413 3.627 18517 17401 1 15 . 1 1 45 45 LEU CA C 113 57.320 57.320 57.942 -0.622 18517 17402 1 15 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.633 -0.882 18517 17403 1 15 . 1 1 45 45 LEU H H 113 9.710 9.710 7.782 1.928 18517 17404 1 15 . 1 1 46 46 LEU N N 114 117.640 117.640 119.972 -2.332 18517 17405 1 15 . 1 1 46 46 LEU HA H 114 4.110 4.110 3.939 0.171 18517 17406 1 15 . 1 1 46 46 LEU C C 114 179.540 179.540 178.793 0.747 18517 17407 1 15 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.764 -0.204 18517 17408 1 15 . 1 1 46 46 LEU CB C 114 41.470 41.470 42.089 -0.619 18517 17409 1 15 . 1 1 46 46 LEU H H 114 8.270 8.270 8.288 -0.018 18517 17410 1 15 . 1 1 47 47 LEU N N 115 116.520 116.520 115.083 1.437 18517 17411 1 15 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.434 -0.294 18517 17412 1 15 . 1 1 47 47 LEU C C 115 173.850 173.850 176.118 -2.268 18517 17413 1 15 . 1 1 47 47 LEU CA C 115 55.420 55.420 53.986 1.434 18517 17414 1 15 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.425 3.295 18517 17415 1 15 . 1 1 47 47 LEU H H 115 8.160 8.160 8.055 0.105 18517 17416 1 15 . 1 1 48 48 LYS N N 116 114.710 114.710 117.413 -2.703 18517 17417 1 15 . 1 1 48 48 LYS HA H 116 3.810 3.810 4.016 -0.206 18517 17418 1 15 . 1 1 48 48 LYS C C 116 176.510 176.510 176.018 0.492 18517 17419 1 15 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.788 0.412 18517 17420 1 15 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.478 -0.458 18517 17421 1 15 . 1 1 48 48 LYS H H 116 7.580 7.580 7.834 -0.254 18517 17422 1 15 . 1 1 49 49 VAL N N 117 119.050 119.050 119.003 0.047 18517 17423 1 15 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.120 -0.510 18517 17424 1 15 . 1 1 49 49 VAL C C 117 175.860 175.860 175.962 -0.102 18517 17425 1 15 . 1 1 49 49 VAL CA C 117 63.510 63.510 61.165 2.345 18517 17426 1 15 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.320 0.030 18517 17427 1 15 . 1 1 49 49 VAL H H 117 7.980 7.980 8.196 -0.216 18517 17428 1 15 . 1 1 50 50 ASP N N 118 126.900 126.900 121.351 5.549 18517 17429 1 15 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.531 -0.281 18517 17430 1 15 . 1 1 50 50 ASP C C 118 177.700 177.700 177.048 0.652 18517 17431 1 15 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.032 1.018 18517 17432 1 15 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.677 0.903 18517 17433 1 15 . 1 1 50 50 ASP H H 118 8.930 8.930 8.376 0.554 18517 17434 1 15 . 1 1 51 51 SER N N 119 124.790 124.790 121.609 3.181 18517 17435 1 15 . 1 1 51 51 SER HA H 119 4.070 4.070 4.241 -0.171 18517 17436 1 15 . 1 1 51 51 SER C C 119 177.220 177.220 176.054 1.166 18517 17437 1 15 . 1 1 51 51 SER CA C 119 61.640 61.640 60.852 0.788 18517 17438 1 15 . 1 1 51 51 SER CB C 119 63.510 63.510 63.087 0.423 18517 17439 1 15 . 1 1 51 51 SER H H 119 8.560 8.560 8.752 -0.192 18517 17440 1 15 . 1 1 52 52 THR N N 120 119.880 119.880 118.292 1.588 18517 17441 1 15 . 1 1 52 52 THR HA H 120 4.190 4.190 4.135 0.055 18517 17442 1 15 . 1 1 52 52 THR C C 120 177.120 177.120 176.175 0.945 18517 17443 1 15 . 1 1 52 52 THR CA C 120 66.280 66.280 65.958 0.322 18517 17444 1 15 . 1 1 52 52 THR CB C 120 68.420 68.420 68.703 -0.283 18517 17445 1 15 . 1 1 52 52 THR H H 120 8.310 8.310 7.869 0.441 18517 17446 1 15 . 1 1 53 53 LYS N N 121 122.270 122.270 122.928 -0.658 18517 17447 1 15 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.048 0.072 18517 17448 1 15 . 1 1 53 53 LYS C C 121 178.970 178.970 178.924 0.046 18517 17449 1 15 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.948 -0.368 18517 17450 1 15 . 1 1 53 53 LYS CB C 121 34.250 34.250 32.270 1.980 18517 17451 1 15 . 1 1 53 53 LYS H H 121 7.700 7.700 8.809 -1.109 18517 17452 1 15 . 1 1 54 54 VAL N N 122 120.070 120.070 119.902 0.168 18517 17453 1 15 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.945 -0.515 18517 17454 1 15 . 1 1 54 54 VAL C C 122 179.860 179.860 177.693 2.167 18517 17455 1 15 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.456 3.124 18517 17456 1 15 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.397 1.423 18517 17457 1 15 . 1 1 54 54 VAL H H 122 7.890 7.890 8.075 -0.185 18517 17458 1 15 . 1 1 55 55 ASP N N 123 122.270 122.270 120.863 1.407 18517 17459 1 15 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.359 0.111 18517 17460 1 15 . 1 1 55 55 ASP C C 123 178.630 178.630 178.339 0.291 18517 17461 1 15 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.905 -0.105 18517 17462 1 15 . 1 1 55 55 ASP CB C 123 42.020 42.020 41.124 0.896 18517 17463 1 15 . 1 1 55 55 ASP H H 123 8.270 8.270 8.070 0.200 18517 17464 1 15 . 1 1 56 56 GLU N N 124 119.600 119.600 119.200 0.400 18517 17465 1 15 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.062 -0.092 18517 17466 1 15 . 1 1 56 56 GLU C C 124 179.920 179.920 179.103 0.817 18517 17467 1 15 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.067 0.993 18517 17468 1 15 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.402 0.568 18517 17469 1 15 . 1 1 56 56 GLU H H 124 8.610 8.610 8.424 0.186 18517 17470 1 15 . 1 1 57 57 ALA N N 125 120.070 120.070 122.343 -2.273 18517 17471 1 15 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.047 -0.217 18517 17472 1 15 . 1 1 57 57 ALA C C 125 178.760 178.760 179.498 -0.738 18517 17473 1 15 . 1 1 57 57 ALA CA C 125 55.380 55.380 55.041 0.339 18517 17474 1 15 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.402 1.738 18517 17475 1 15 . 1 1 57 57 ALA H H 125 8.420 8.420 8.658 -0.238 18517 17476 1 15 . 1 1 58 58 GLY N N 126 106.740 106.740 106.402 0.338 18517 17477 1 15 . 1 1 58 58 GLY C C 126 175.740 175.740 175.927 -0.187 18517 17478 1 15 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.834 0.456 18517 17479 1 15 . 1 1 58 58 GLY H H 126 8.200 8.200 8.426 -0.226 18517 17480 1 15 . 1 1 59 59 LYS N N 127 120.920 120.920 122.096 -1.176 18517 17481 1 15 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.024 -0.094 18517 17482 1 15 . 1 1 59 59 LYS C C 127 180.320 180.320 178.927 1.393 18517 17483 1 15 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.403 0.807 18517 17484 1 15 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.435 0.545 18517 17485 1 15 . 1 1 59 59 LYS H H 127 8.000 8.000 8.159 -0.159 18517 17486 1 15 . 1 1 60 60 LYS N N 128 118.400 118.400 119.574 -1.174 18517 17487 1 15 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.199 -0.029 18517 17488 1 15 . 1 1 60 60 LYS C C 128 180.030 180.030 178.852 1.178 18517 17489 1 15 . 1 1 60 60 LYS CA C 128 58.750 58.750 58.600 0.150 18517 17490 1 15 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.143 0.127 18517 17491 1 15 . 1 1 60 60 LYS H H 128 7.170 7.170 7.900 -0.730 18517 17492 1 15 . 1 1 61 61 VAL N N 129 121.050 121.050 120.785 0.265 18517 17493 1 15 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.398 -0.118 18517 17494 1 15 . 1 1 61 61 VAL C C 129 177.120 177.120 177.739 -0.619 18517 17495 1 15 . 1 1 61 61 VAL CA C 129 67.350 67.350 66.731 0.619 18517 17496 1 15 . 1 1 61 61 VAL CB C 129 31.630 31.630 30.804 0.826 18517 17497 1 15 . 1 1 61 61 VAL H H 129 7.980 7.980 8.136 -0.156 18517 17498 1 15 . 1 1 62 62 LYS N N 130 120.040 120.040 120.024 0.016 18517 17499 1 15 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.884 -0.184 18517 17500 1 15 . 1 1 62 62 LYS C C 130 178.550 178.550 178.883 -0.333 18517 17501 1 15 . 1 1 62 62 LYS CA C 130 60.330 60.330 60.197 0.133 18517 17502 1 15 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.310 1.460 18517 17503 1 15 . 1 1 62 62 LYS H H 130 8.910 8.910 8.553 0.357 18517 17504 1 15 . 1 1 63 63 ALA N N 131 119.570 119.570 122.163 -2.593 18517 17505 1 15 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.009 0.211 18517 17506 1 15 . 1 1 63 63 ALA C C 131 180.520 180.520 179.251 1.269 18517 17507 1 15 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.261 -0.041 18517 17508 1 15 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.154 0.316 18517 17509 1 15 . 1 1 63 63 ALA H H 131 7.920 7.920 7.816 0.104 18517 17510 1 15 . 1 1 64 64 TYR N N 132 120.510 120.510 120.592 -0.082 18517 17511 1 15 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.219 0.241 18517 17512 1 15 . 1 1 64 64 TYR C C 132 176.510 176.510 177.921 -1.411 18517 17513 1 15 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.508 0.132 18517 17514 1 15 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.664 0.025 18517 17515 1 15 . 1 1 64 64 TYR H H 132 7.930 7.930 8.265 -0.335 18517 17516 1 15 . 1 1 65 65 LEU N N 133 117.290 117.290 120.374 -3.084 18517 17517 1 15 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.618 0.222 18517 17518 1 15 . 1 1 65 65 LEU C C 133 178.610 178.610 178.141 0.469 18517 17519 1 15 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.444 -0.724 18517 17520 1 15 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.838 -1.408 18517 17521 1 15 . 1 1 65 65 LEU H H 133 8.240 8.240 8.579 -0.339 18517 17522 1 15 . 1 1 66 66 GLU N N 134 119.140 119.140 117.829 1.311 18517 17523 1 15 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.217 -0.357 18517 17524 1 15 . 1 1 66 66 GLU C C 134 180.200 180.200 178.964 1.236 18517 17525 1 15 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.283 1.657 18517 17526 1 15 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.477 0.333 18517 17527 1 15 . 1 1 66 66 GLU H H 134 8.370 8.370 8.548 -0.178 18517 17528 1 15 . 1 1 67 67 LYS N N 135 121.390 121.390 120.088 1.302 18517 17529 1 15 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.035 -0.035 18517 17530 1 15 . 1 1 67 67 LYS C C 135 179.080 179.080 178.682 0.398 18517 17531 1 15 . 1 1 67 67 LYS CA C 135 59.620 59.620 59.173 0.447 18517 17532 1 15 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.512 -0.242 18517 17533 1 15 . 1 1 67 67 LYS H H 135 7.820 7.820 7.839 -0.019 18517 17534 1 15 . 1 1 68 68 ILE N N 136 110.310 110.310 112.116 -1.806 18517 17535 1 15 . 1 1 68 68 ILE HA H 136 4.300 4.300 3.866 0.434 18517 17536 1 15 . 1 1 68 68 ILE C C 136 175.520 175.520 176.555 -1.035 18517 17537 1 15 . 1 1 68 68 ILE CA C 136 62.430 62.430 62.353 0.077 18517 17538 1 15 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.228 -0.248 18517 17539 1 15 . 1 1 68 68 ILE H H 136 7.380 7.380 7.620 -0.240 18517 17540 1 15 . 1 1 69 69 GLY N N 137 106.680 106.680 106.949 -0.269 18517 17541 1 15 . 1 1 69 69 GLY C C 137 174.160 174.160 174.102 0.058 18517 17542 1 15 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.371 1.099 18517 17543 1 15 . 1 1 69 69 GLY H H 137 7.470 7.470 7.567 -0.097 18517 17544 1 15 . 1 1 70 70 ILE N N 138 124.310 124.310 122.352 1.958 18517 17545 1 15 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.370 -0.170 18517 17546 1 15 . 1 1 70 70 ILE C C 138 174.190 174.190 175.453 -1.263 18517 17547 1 15 . 1 1 70 70 ILE CA C 138 59.380 59.380 59.283 0.097 18517 17548 1 15 . 1 1 70 70 ILE CB C 138 37.340 37.340 37.056 0.284 18517 17549 1 15 . 1 1 70 70 ILE H H 138 8.530 8.530 8.275 0.255 18517 17550 1 15 . 1 1 71 71 ARG N N 139 125.490 125.490 128.150 -2.660 18517 17551 1 15 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.628 -0.008 18517 17552 1 15 . 1 1 71 71 ARG C C 139 175.750 175.750 175.151 0.599 18517 17553 1 15 . 1 1 71 71 ARG CA C 139 54.660 54.660 54.951 -0.291 18517 17554 1 15 . 1 1 71 71 ARG CB C 139 33.140 33.140 31.770 1.370 18517 17555 1 15 . 1 1 71 71 ARG H H 139 8.240 8.240 8.037 0.203 18517 17556 1 15 . 1 1 72 72 GLY N N 140 104.750 104.750 110.770 -6.020 18517 17557 1 15 . 1 1 72 72 GLY C C 140 172.920 172.920 172.510 0.410 18517 17558 1 15 . 1 1 72 72 GLY CA C 140 45.430 45.430 45.186 0.244 18517 17559 1 15 . 1 1 72 72 GLY H H 140 7.900 7.900 7.966 -0.066 18517 17560 1 15 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.641 -0.131 18517 17561 1 15 . 1 1 73 73 ASP C C 141 175.060 175.060 176.429 -1.369 18517 17562 1 15 . 1 1 73 73 ASP CA C 141 56.170 56.170 54.601 1.569 18517 17563 1 15 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.987 -1.157 18517 17564 1 15 . 1 1 74 74 SER N N 142 110.240 110.240 115.260 -5.020 18517 17565 1 15 . 1 1 74 74 SER HA H 142 4.740 4.740 4.721 0.019 18517 17566 1 15 . 1 1 74 74 SER C C 142 175.110 175.110 175.898 -0.788 18517 17567 1 15 . 1 1 74 74 SER CA C 142 55.700 55.700 57.310 -1.610 18517 17568 1 15 . 1 1 74 74 SER CB C 142 67.390 67.390 65.072 2.318 18517 17569 1 15 . 1 1 74 74 SER H H 142 7.560 7.560 8.068 -0.508 18517 17570 1 15 . 1 1 75 75 VAL N N 143 122.950 122.950 122.291 0.659 18517 17571 1 15 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.788 -0.058 18517 17572 1 15 . 1 1 75 75 VAL C C 143 176.230 176.230 177.161 -0.931 18517 17573 1 15 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.772 0.868 18517 17574 1 15 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.393 -0.153 18517 17575 1 15 . 1 1 75 75 VAL H H 143 9.470 9.470 8.788 0.682 18517 17576 1 15 . 1 1 76 76 GLU N N 144 121.390 121.390 120.167 1.223 18517 17577 1 15 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.058 -0.418 18517 17578 1 15 . 1 1 76 76 GLU C C 144 176.880 176.880 178.487 -1.607 18517 17579 1 15 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.387 3.923 18517 17580 1 15 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.186 -0.116 18517 17581 1 15 . 1 1 76 76 GLU H H 144 9.640 9.640 8.945 0.695 18517 17582 1 15 . 1 1 77 77 ALA N N 145 118.770 118.770 122.647 -3.877 18517 17583 1 15 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.240 0.020 18517 17584 1 15 . 1 1 77 77 ALA C C 145 180.350 180.350 179.628 0.722 18517 17585 1 15 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.401 0.379 18517 17586 1 15 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.060 1.130 18517 17587 1 15 . 1 1 77 77 ALA H H 145 7.860 7.860 7.361 0.499 18517 17588 1 15 . 1 1 78 78 ALA N N 146 120.920 120.920 122.444 -1.524 18517 17589 1 15 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.055 0.085 18517 17590 1 15 . 1 1 78 78 ALA C C 146 179.150 179.150 178.960 0.190 18517 17591 1 15 . 1 1 78 78 ALA CA C 146 55.260 55.260 54.949 0.311 18517 17592 1 15 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.566 0.224 18517 17593 1 15 . 1 1 78 78 ALA H H 146 8.110 8.110 8.638 -0.528 18517 17594 1 15 . 1 1 79 79 LEU N N 147 118.810 118.810 119.795 -0.985 18517 17595 1 15 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.069 -0.189 18517 17596 1 15 . 1 1 79 79 LEU C C 147 179.080 179.080 178.303 0.777 18517 17597 1 15 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.860 0.530 18517 17598 1 15 . 1 1 79 79 LEU CB C 147 42.260 42.260 40.946 1.315 18517 17599 1 15 . 1 1 79 79 LEU H H 147 8.360 8.360 8.462 -0.102 18517 17600 1 15 . 1 1 80 80 ASP N N 148 121.620 121.620 120.541 1.079 18517 17601 1 15 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.226 0.294 18517 17602 1 15 . 1 1 80 80 ASP C C 148 178.800 178.800 178.039 0.761 18517 17603 1 15 . 1 1 80 80 ASP CA C 148 58.390 58.390 57.955 0.435 18517 17604 1 15 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.855 -0.104 18517 17605 1 15 . 1 1 80 80 ASP H H 148 8.770 8.770 8.438 0.332 18517 17606 1 15 . 1 1 81 81 ASN N N 149 118.630 118.630 118.124 0.506 18517 17607 1 15 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.394 0.176 18517 17608 1 15 . 1 1 81 81 ASN C C 149 177.970 177.970 177.620 0.350 18517 17609 1 15 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.699 -0.689 18517 17610 1 15 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.734 -0.124 18517 17611 1 15 . 1 1 81 81 ASN H H 149 7.960 7.960 7.965 -0.005 18517 17612 1 15 . 1 1 82 82 LEU N N 150 120.030 120.030 120.860 -0.830 18517 17613 1 15 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.938 0.122 18517 17614 1 15 . 1 1 82 82 LEU C C 150 177.790 177.790 179.253 -1.463 18517 17615 1 15 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.125 0.745 18517 17616 1 15 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.884 -0.024 18517 17617 1 15 . 1 1 82 82 LEU H H 150 8.230 8.230 8.396 -0.166 18517 17618 1 15 . 1 1 83 83 MET N N 151 115.820 115.820 118.148 -2.328 18517 17619 1 15 . 1 1 83 83 MET HA H 151 4.390 4.390 4.344 0.046 18517 17620 1 15 . 1 1 83 83 MET C C 151 179.760 179.760 179.204 0.556 18517 17621 1 15 . 1 1 83 83 MET CA C 151 57.400 57.400 57.942 -0.542 18517 17622 1 15 . 1 1 83 83 MET CB C 151 31.080 31.080 31.400 -0.320 18517 17623 1 15 . 1 1 83 83 MET H H 151 8.800 8.800 8.417 0.383 18517 17624 1 15 . 1 1 84 84 ILE N N 152 120.330 120.330 120.784 -0.454 18517 17625 1 15 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.706 0.134 18517 17626 1 15 . 1 1 84 84 ILE C C 152 178.660 178.660 178.464 0.196 18517 17627 1 15 . 1 1 84 84 ILE CA C 152 65.800 65.800 64.481 1.319 18517 17628 1 15 . 1 1 84 84 ILE CB C 152 38.450 38.450 36.558 1.892 18517 17629 1 15 . 1 1 84 84 ILE H H 152 8.540 8.540 8.807 -0.267 18517 17630 1 15 . 1 1 85 85 LYS N N 153 118.930 118.930 119.892 -0.962 18517 17631 1 15 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.062 0.138 18517 17632 1 15 . 1 1 85 85 LYS C C 153 179.650 179.650 179.605 0.045 18517 17633 1 15 . 1 1 85 85 LYS CA C 153 59.980 59.980 59.693 0.287 18517 17634 1 15 . 1 1 85 85 LYS CB C 153 33.540 33.540 32.465 1.075 18517 17635 1 15 . 1 1 85 85 LYS H H 153 7.510 7.510 8.097 -0.587 18517 17636 1 15 . 1 1 86 86 VAL N N 154 119.810 119.810 120.625 -0.815 18517 17637 1 15 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.595 0.035 18517 17638 1 15 . 1 1 86 86 VAL C C 154 178.350 178.350 177.873 0.477 18517 17639 1 15 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.862 0.368 18517 17640 1 15 . 1 1 86 86 VAL CB C 154 32.740 32.740 32.018 0.722 18517 17641 1 15 . 1 1 86 86 VAL H H 154 8.740 8.740 8.529 0.211 18517 17642 1 15 . 1 1 87 87 TYR N N 155 118.370 118.370 118.171 0.199 18517 17643 1 15 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.310 -0.040 18517 17644 1 15 . 1 1 87 87 TYR C C 155 178.580 178.580 178.264 0.316 18517 17645 1 15 . 1 1 87 87 TYR CA C 155 62.910 62.910 60.610 2.300 18517 17646 1 15 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.517 0.463 18517 17647 1 15 . 1 1 87 87 TYR H H 155 8.520 8.520 8.664 -0.144 18517 17648 1 15 . 1 1 88 88 GLU N N 156 119.900 119.900 121.697 -1.797 18517 17649 1 15 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.388 -0.208 18517 17650 1 15 . 1 1 88 88 GLU C C 156 179.270 179.270 179.057 0.213 18517 17651 1 15 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.051 0.329 18517 17652 1 15 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.297 0.913 18517 17653 1 15 . 1 1 88 88 GLU H H 156 8.250 8.250 8.426 -0.176 18517 17654 1 15 . 1 1 89 89 ILE N N 157 119.510 119.510 117.486 2.024 18517 17655 1 15 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.910 0.170 18517 17656 1 15 . 1 1 89 89 ILE C C 157 177.890 177.890 178.108 -0.218 18517 17657 1 15 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.250 0.060 18517 17658 1 15 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.149 1.061 18517 17659 1 15 . 1 1 89 89 ILE H H 157 7.630 7.630 7.928 -0.298 18517 17660 1 15 . 1 1 90 90 THR N N 158 114.240 114.240 115.212 -0.972 18517 17661 1 15 . 1 1 90 90 THR HA H 158 4.130 4.130 4.092 0.038 18517 17662 1 15 . 1 1 90 90 THR C C 158 175.530 175.530 175.795 -0.265 18517 17663 1 15 . 1 1 90 90 THR CA C 158 64.460 64.460 65.649 -1.189 18517 17664 1 15 . 1 1 90 90 THR CB C 158 69.610 69.610 68.924 0.686 18517 17665 1 15 . 1 1 90 90 THR H H 158 7.770 7.770 7.946 -0.176 18517 17666 1 15 . 1 1 91 91 LYS N N 159 120.280 120.280 119.885 0.395 18517 17667 1 15 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.358 -0.048 18517 17668 1 15 . 1 1 91 91 LYS C C 159 177.420 177.420 177.114 0.306 18517 17669 1 15 . 1 1 91 91 LYS CA C 159 57.400 57.400 56.431 0.969 18517 17670 1 15 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.753 -0.533 18517 17671 1 15 . 1 1 91 91 LYS H H 159 7.890 7.890 8.277 -0.387 18517 17672 1 15 . 1 1 92 92 GLY N N 160 107.910 107.910 107.881 0.029 18517 17673 1 15 . 1 1 92 92 GLY C C 160 174.430 174.430 173.982 0.448 18517 17674 1 15 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.136 0.843 18517 17675 1 15 . 1 1 92 92 GLY H H 160 7.930 7.930 7.946 -0.016 18517 17676 1 15 . 1 1 93 93 THR N N 161 113.570 113.570 111.354 2.216 18517 17677 1 15 . 1 1 93 93 THR HA H 161 4.390 4.390 4.515 -0.125 18517 17678 1 15 . 1 1 93 93 THR C C 161 174.790 174.790 173.609 1.181 18517 17679 1 15 . 1 1 93 93 THR CA C 161 61.960 61.960 61.440 0.520 18517 17680 1 15 . 1 1 93 93 THR CB C 161 70.010 70.010 70.205 -0.195 18517 17681 1 15 . 1 1 93 93 THR H H 161 7.970 7.970 7.651 0.319 18517 17682 1 15 . 1 1 94 94 VAL N N 162 121.980 121.980 125.364 -3.384 18517 17683 1 15 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.154 -0.034 18517 17684 1 15 . 1 1 94 94 VAL C C 162 176.300 176.300 176.373 -0.073 18517 17685 1 15 . 1 1 94 94 VAL CA C 162 62.830 62.830 62.838 -0.008 18517 17686 1 15 . 1 1 94 94 VAL CB C 162 33.060 33.060 31.415 1.645 18517 17687 1 15 . 1 1 94 94 VAL H H 162 8.130 8.130 8.741 -0.611 18517 17688 1 15 . 1 1 95 95 GLU N N 163 124.140 124.140 116.018 8.122 18517 17689 1 15 . 1 1 95 95 GLU HA H 163 4.310 4.310 3.909 0.401 18517 17690 1 15 . 1 1 95 95 GLU C C 163 176.870 176.870 176.180 0.690 18517 17691 1 15 . 1 1 95 95 GLU CA C 163 57.080 57.080 58.708 -1.628 18517 17692 1 15 . 1 1 95 95 GLU CB C 163 30.440 30.440 28.137 2.303 18517 17693 1 15 . 1 1 95 95 GLU H H 163 8.490 8.490 7.963 0.527 18517 17694 1 15 . 1 1 96 96 SER N N 164 116.800 116.800 118.484 -1.684 18517 17695 1 15 . 1 1 96 96 SER HA H 164 4.430 4.430 4.700 -0.270 18517 17696 1 15 . 1 1 96 96 SER C C 164 174.940 174.940 174.117 0.823 18517 17697 1 15 . 1 1 96 96 SER CA C 164 59.070 59.070 57.894 1.176 18517 17698 1 15 . 1 1 96 96 SER CB C 164 64.220 64.220 64.298 -0.078 18517 17699 1 15 . 1 1 96 96 SER H H 164 8.300 8.300 8.147 0.153 18517 17700 1 15 . 1 1 97 97 SER C C 165 174.660 174.660 173.931 0.729 18517 17701 1 15 . 1 1 97 97 SER CA C 165 58.870 58.870 59.014 -0.144 18517 17702 1 15 . 1 1 97 97 SER CB C 165 64.060 64.060 62.454 1.606 18517 17703 1 15 . 1 1 98 98 ALA N N 166 125.490 125.490 128.837 -3.347 18517 17704 1 15 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.614 -0.264 18517 17705 1 15 . 1 1 98 98 ALA C C 166 177.780 177.780 175.719 2.061 18517 17706 1 15 . 1 1 98 98 ALA CA C 166 53.000 53.000 50.997 2.003 18517 17707 1 15 . 1 1 98 98 ALA CB C 166 19.340 19.340 20.520 -1.180 18517 17708 1 15 . 1 1 98 98 ALA H H 166 8.180 8.180 7.883 0.297 18517 17709 1 15 . 1 1 99 99 GLN N N 167 118.690 118.690 119.589 -0.899 18517 17710 1 15 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.245 0.095 18517 17711 1 15 . 1 1 99 99 GLN C C 167 176.680 176.680 176.232 0.448 18517 17712 1 15 . 1 1 99 99 GLN CA C 167 56.250 56.250 55.868 0.382 18517 17713 1 15 . 1 1 99 99 GLN CB C 167 29.650 29.650 28.611 1.039 18517 17714 1 15 . 1 1 99 99 GLN H H 167 8.170 8.170 8.525 -0.355 18517 17715 1 15 . 1 1 100 100 GLY N N 168 109.670 109.670 114.619 -4.949 18517 17716 1 15 . 1 1 100 100 GLY C C 168 174.460 174.460 174.151 0.309 18517 17717 1 15 . 1 1 100 100 GLY CA C 168 45.670 45.670 44.430 1.240 18517 17718 1 15 . 1 1 100 100 GLY H H 168 8.250 8.250 8.650 -0.400 18517 17719 1 15 . 1 1 101 101 THR N N 169 112.660 112.660 115.252 -2.592 18517 17720 1 15 . 1 1 101 101 THR HA H 169 4.360 4.360 4.359 0.001 18517 17721 1 15 . 1 1 101 101 THR C C 169 174.720 174.720 173.713 1.007 18517 17722 1 15 . 1 1 101 101 THR CA C 169 62.080 62.080 61.423 0.657 18517 17723 1 15 . 1 1 101 101 THR CB C 169 69.930 69.930 70.178 -0.248 18517 17724 1 15 . 1 1 101 101 THR H H 169 8.070 8.070 7.603 0.467 18517 17725 1 15 . 1 1 102 102 ASP N N 170 123.090 123.090 118.712 4.378 18517 17726 1 15 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.482 0.218 18517 17727 1 15 . 1 1 102 102 ASP C C 170 176.130 176.130 175.375 0.755 18517 17728 1 15 . 1 1 102 102 ASP CA C 170 54.780 54.780 54.770 0.010 18517 17729 1 15 . 1 1 102 102 ASP CB C 170 42.260 42.260 40.627 1.633 18517 17730 1 15 . 1 1 102 102 ASP H H 170 8.170 8.170 8.525 -0.355 18517 17731 1 15 . 1 1 103 103 SER N N 171 117.110 117.110 116.997 0.113 18517 17732 1 15 . 1 1 103 103 SER HA H 171 4.430 4.430 4.332 0.098 18517 17733 1 15 . 1 1 103 103 SER C C 171 174.770 174.770 175.479 -0.709 18517 17734 1 15 . 1 1 103 103 SER CA C 171 57.960 57.960 58.438 -0.478 18517 17735 1 15 . 1 1 103 103 SER CB C 171 64.940 64.940 64.140 0.800 18517 17736 1 15 . 1 1 103 103 SER H H 171 8.450 8.450 8.484 -0.034 18517 17737 1 15 . 1 1 104 104 GLU N N 172 122.970 122.970 123.395 -0.425 18517 17738 1 15 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.996 0.034 18517 17739 1 15 . 1 1 104 104 GLU C C 172 178.860 178.860 178.582 0.278 18517 17740 1 15 . 1 1 104 104 GLU CA C 172 59.700 59.700 59.739 -0.039 18517 17741 1 15 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.409 0.241 18517 17742 1 15 . 1 1 104 104 GLU H H 172 8.830 8.830 9.003 -0.173 18517 17743 1 15 . 1 1 105 105 GLU N N 173 119.750 119.750 118.447 1.303 18517 17744 1 15 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.027 -0.047 18517 17745 1 15 . 1 1 105 105 GLU C C 173 178.920 178.920 178.771 0.149 18517 17746 1 15 . 1 1 105 105 GLU CA C 173 60.060 60.060 59.277 0.783 18517 17747 1 15 . 1 1 105 105 GLU CB C 173 29.730 29.730 29.110 0.619 18517 17748 1 15 . 1 1 105 105 GLU H H 173 8.580 8.580 8.961 -0.381 18517 17749 1 15 . 1 1 106 106 LEU N N 174 121.860 121.860 119.481 2.379 18517 17750 1 15 . 1 1 106 106 LEU HA H 174 4.180 4.180 3.983 0.197 18517 17751 1 15 . 1 1 106 106 LEU C C 174 178.210 178.210 178.779 -0.569 18517 17752 1 15 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.197 0.683 18517 17753 1 15 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.777 -0.627 18517 17754 1 15 . 1 1 106 106 LEU H H 174 7.920 7.920 7.557 0.363 18517 17755 1 15 . 1 1 107 107 LYS N N 175 118.740 118.740 119.540 -0.800 18517 17756 1 15 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.868 -0.088 18517 17757 1 15 . 1 1 107 107 LYS C C 175 178.700 178.700 179.142 -0.442 18517 17758 1 15 . 1 1 107 107 LYS CA C 175 61.170 61.170 60.269 0.901 18517 17759 1 15 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.230 0.200 18517 17760 1 15 . 1 1 107 107 LYS H H 175 8.340 8.340 8.319 0.021 18517 17761 1 15 . 1 1 108 108 THR N N 176 113.820 113.820 117.282 -3.462 18517 17762 1 15 . 1 1 108 108 THR HA H 176 3.840 3.840 3.969 -0.129 18517 17763 1 15 . 1 1 108 108 THR C C 176 176.620 176.620 176.036 0.584 18517 17764 1 15 . 1 1 108 108 THR CA C 176 66.910 66.910 67.165 -0.255 18517 17765 1 15 . 1 1 108 108 THR CB C 176 69.610 69.610 68.796 0.814 18517 17766 1 15 . 1 1 108 108 THR H H 176 7.950 7.950 8.279 -0.329 18517 17767 1 15 . 1 1 109 109 LEU N N 177 124.380 124.380 122.460 1.920 18517 17768 1 15 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.083 -0.253 18517 17769 1 15 . 1 1 109 109 LEU C C 177 177.790 177.790 178.113 -0.323 18517 17770 1 15 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.723 0.267 18517 17771 1 15 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.822 0.758 18517 17772 1 15 . 1 1 109 109 LEU H H 177 7.480 7.480 7.973 -0.493 18517 17773 1 15 . 1 1 110 110 LEU N N 178 117.230 117.230 119.276 -2.046 18517 17774 1 15 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.733 0.106 18517 17775 1 15 . 1 1 110 110 LEU C C 178 179.540 179.540 179.198 0.342 18517 17776 1 15 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.437 0.953 18517 17777 1 15 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.328 1.012 18517 17778 1 15 . 1 1 110 110 LEU H H 178 8.670 8.670 7.928 0.742 18517 17779 1 15 . 1 1 111 111 LEU N N 179 119.230 119.230 120.915 -1.685 18517 17780 1 15 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.047 0.033 18517 17781 1 15 . 1 1 111 111 LEU C C 179 179.310 179.310 178.724 0.586 18517 17782 1 15 . 1 1 111 111 LEU CA C 179 58.390 58.390 58.145 0.245 18517 17783 1 15 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.994 1.026 18517 17784 1 15 . 1 1 111 111 LEU H H 179 7.940 7.940 8.260 -0.320 18517 17785 1 15 . 1 1 112 112 LYS N N 180 121.910 121.910 120.969 0.941 18517 17786 1 15 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.075 0.115 18517 17787 1 15 . 1 1 112 112 LYS C C 180 178.740 178.740 179.103 -0.363 18517 17788 1 15 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.003 0.177 18517 17789 1 15 . 1 1 112 112 LYS CB C 180 31.870 31.870 31.809 0.061 18517 17790 1 15 . 1 1 112 112 LYS H H 180 7.420 7.420 7.969 -0.549 18517 17791 1 15 . 1 1 113 113 PHE N N 181 118.220 118.220 118.948 -0.728 18517 17792 1 15 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.266 0.484 18517 17793 1 15 . 1 1 113 113 PHE C C 181 178.520 178.520 177.790 0.730 18517 17794 1 15 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.279 -3.199 18517 17795 1 15 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.147 -0.167 18517 17796 1 15 . 1 1 113 113 PHE H H 181 9.000 9.000 8.534 0.466 18517 17797 1 15 . 1 1 114 114 SER N N 182 113.300 113.300 116.078 -2.778 18517 17798 1 15 . 1 1 114 114 SER HA H 182 3.930 3.930 3.998 -0.068 18517 17799 1 15 . 1 1 114 114 SER C C 182 177.080 177.080 176.631 0.449 18517 17800 1 15 . 1 1 114 114 SER CA C 182 62.000 62.000 62.361 -0.361 18517 17801 1 15 . 1 1 114 114 SER CB C 182 63.510 63.510 62.990 0.520 18517 17802 1 15 . 1 1 114 114 SER H H 182 8.620 8.620 8.652 -0.032 18517 17803 1 15 . 1 1 115 115 GLU N N 183 121.540 121.540 120.559 0.981 18517 17804 1 15 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.033 0.037 18517 17805 1 15 . 1 1 115 115 GLU C C 183 179.860 179.860 179.028 0.832 18517 17806 1 15 . 1 1 115 115 GLU CA C 183 59.780 59.780 58.977 0.802 18517 17807 1 15 . 1 1 115 115 GLU CB C 183 29.890 29.890 28.915 0.976 18517 17808 1 15 . 1 1 115 115 GLU H H 183 8.250 8.250 8.467 -0.217 18517 17809 1 15 . 1 1 116 116 ASP N N 184 121.740 121.740 121.018 0.722 18517 17810 1 15 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.392 0.118 18517 17811 1 15 . 1 1 116 116 ASP C C 184 179.570 179.570 178.326 1.244 18517 17812 1 15 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.481 0.079 18517 17813 1 15 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.773 0.217 18517 17814 1 15 . 1 1 116 116 ASP H H 184 8.840 8.840 8.494 0.346 18517 17815 1 15 . 1 1 117 117 LEU N N 185 121.420 121.420 120.606 0.814 18517 17816 1 15 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.021 0.109 18517 17817 1 15 . 1 1 117 117 LEU C C 185 178.840 178.840 178.952 -0.112 18517 17818 1 15 . 1 1 117 117 LEU CA C 185 58.230 58.230 57.979 0.251 18517 17819 1 15 . 1 1 117 117 LEU CB C 185 42.650 42.650 42.104 0.546 18517 17820 1 15 . 1 1 117 117 LEU H H 185 8.350 8.350 8.380 -0.030 18517 17821 1 15 . 1 1 118 118 LYS N N 186 119.640 119.640 117.981 1.659 18517 17822 1 15 . 1 1 118 118 LYS HA H 186 4.120 4.120 4.126 -0.006 18517 17823 1 15 . 1 1 118 118 LYS C C 186 178.820 178.820 179.325 -0.505 18517 17824 1 15 . 1 1 118 118 LYS CA C 186 59.740 59.740 58.399 1.341 18517 17825 1 15 . 1 1 118 118 LYS CB C 186 32.510 32.510 31.594 0.916 18517 17826 1 15 . 1 1 118 118 LYS H H 186 8.220 8.220 8.241 -0.021 18517 17827 1 15 . 1 1 119 119 ALA N N 187 120.160 120.160 123.000 -2.840 18517 17828 1 15 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.080 0.080 18517 17829 1 15 . 1 1 119 119 ALA C C 187 180.450 180.450 179.966 0.484 18517 17830 1 15 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.538 -0.398 18517 17831 1 15 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.079 0.391 18517 17832 1 15 . 1 1 119 119 ALA H H 187 8.010 8.010 8.491 -0.481 18517 17833 1 15 . 1 1 120 120 GLU N N 188 117.930 117.930 118.000 -0.070 18517 17834 1 15 . 1 1 120 120 GLU HA H 188 4.180 4.180 4.036 0.144 18517 17835 1 15 . 1 1 120 120 GLU C C 188 178.780 178.780 179.182 -0.402 18517 17836 1 15 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.439 -0.609 18517 17837 1 15 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.364 0.606 18517 17838 1 15 . 1 1 120 120 GLU H H 188 7.640 7.640 8.190 -0.550 18517 17839 1 15 . 1 1 121 121 GLN N N 189 117.230 117.230 119.894 -2.664 18517 17840 1 15 . 1 1 121 121 GLN HA H 189 4.230 4.230 4.171 0.059 18517 17841 1 15 . 1 1 121 121 GLN C C 189 179.190 179.190 178.362 0.828 18517 17842 1 15 . 1 1 121 121 GLN CA C 189 59.740 59.740 59.080 0.660 18517 17843 1 15 . 1 1 121 121 GLN CB C 189 29.650 29.650 29.249 0.401 18517 17844 1 15 . 1 1 121 121 GLN H H 189 8.280 8.280 8.261 0.019 18517 17845 1 15 . 1 1 122 122 GLU N N 190 118.340 118.340 120.790 -2.450 18517 17846 1 15 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.996 0.124 18517 17847 1 15 . 1 1 122 122 GLU C C 190 178.210 178.210 179.127 -0.917 18517 17848 1 15 . 1 1 122 122 GLU CA C 190 58.750 58.750 59.075 -0.325 18517 17849 1 15 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.369 0.601 18517 17850 1 15 . 1 1 122 122 GLU H H 190 8.250 8.250 8.511 -0.261 18517 17851 1 15 . 1 1 123 123 LEU N N 191 118.930 118.930 120.765 -1.835 18517 17852 1 15 . 1 1 123 123 LEU HA H 191 4.090 4.090 4.008 0.082 18517 17853 1 15 . 1 1 123 123 LEU C C 191 178.500 178.500 179.030 -0.530 18517 17854 1 15 . 1 1 123 123 LEU CA C 191 57.000 57.000 57.847 -0.848 18517 17855 1 15 . 1 1 123 123 LEU CB C 191 42.500 42.500 40.770 1.730 18517 17856 1 15 . 1 1 123 123 LEU H H 191 7.530 7.530 8.377 -0.847 18517 17857 1 15 . 1 1 124 124 HIS N N 192 115.650 115.650 119.183 -3.533 18517 17858 1 15 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.228 0.492 18517 17859 1 15 . 1 1 124 124 HIS C C 192 176.090 176.090 177.761 -1.671 18517 17860 1 15 . 1 1 124 124 HIS CA C 192 56.690 56.690 60.319 -3.629 18517 17861 1 15 . 1 1 124 124 HIS CB C 192 30.760 30.760 30.084 0.676 18517 17862 1 15 . 1 1 124 124 HIS H H 192 7.450 7.450 8.428 -0.978 18517 17863 1 15 . 1 1 125 125 SER N N 193 115.480 115.480 114.256 1.224 18517 17864 1 15 . 1 1 125 125 SER HA H 193 4.310 4.310 3.993 0.317 18517 17865 1 15 . 1 1 125 125 SER CA C 193 60.180 60.180 60.991 -0.811 18517 17866 1 15 . 1 1 125 125 SER CB C 193 64.060 64.060 62.143 1.917 18517 17867 1 15 . 1 1 125 125 SER H H 193 8.020 8.020 8.176 -0.156 18517 17868 1 15 . 1 1 126 126 GLU C C 194 177.410 177.410 179.117 -1.707 18517 17869 1 15 . 1 1 126 126 GLU CA C 194 57.840 57.840 59.088 -1.248 18517 17870 1 15 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.638 0.252 18517 17871 1 15 . 1 1 127 127 ALA N N 195 122.910 122.910 123.204 -0.294 18517 17872 1 15 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.064 0.126 18517 17873 1 15 . 1 1 127 127 ALA C C 195 178.610 178.610 179.600 -0.990 18517 17874 1 15 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.929 -1.139 18517 17875 1 15 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.636 0.625 18517 17876 1 15 . 1 1 127 127 ALA H H 195 8.020 8.020 7.881 0.139 18517 17877 1 15 . 1 1 128 128 LYS N N 196 117.770 117.770 116.076 1.694 18517 17878 1 15 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.332 -0.072 18517 17879 1 15 . 1 1 128 128 LYS C C 196 177.400 177.400 176.187 1.213 18517 17880 1 15 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.751 2.249 18517 17881 1 15 . 1 1 128 128 LYS CB C 196 32.740 32.740 32.527 0.213 18517 17882 1 15 . 1 1 128 128 LYS H H 196 7.990 7.990 8.052 -0.062 18517 17883 1 15 . 1 1 129 129 GLY N N 197 109.010 109.010 107.840 1.170 18517 17884 1 15 . 1 1 129 129 GLY C C 197 175.770 175.770 175.450 0.320 18517 17885 1 15 . 1 1 129 129 GLY CA C 197 46.100 46.100 44.908 1.192 18517 17886 1 15 . 1 1 129 129 GLY H H 197 8.220 8.220 7.519 0.701 18517 17887 1 15 . 1 1 130 130 GLY N N 198 109.150 109.150 111.779 -2.629 18517 17888 1 15 . 1 1 130 130 GLY C C 198 174.760 174.760 175.898 -1.138 18517 17889 1 15 . 1 1 130 130 GLY CA C 198 46.930 46.930 46.870 0.060 18517 17890 1 15 . 1 1 130 130 GLY H H 198 8.210 8.210 8.438 -0.228 18517 17891 1 15 . 1 1 131 131 GLU N N 199 121.560 121.560 121.389 0.171 18517 17892 1 15 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.045 -0.025 18517 17893 1 15 . 1 1 131 131 GLU C C 199 178.500 178.500 178.106 0.394 18517 17894 1 15 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.386 0.514 18517 17895 1 15 . 1 1 131 131 GLU CB C 199 29.570 29.570 29.314 0.256 18517 17896 1 15 . 1 1 131 131 GLU H H 199 8.510 8.510 8.631 -0.121 18517 17897 1 15 . 1 1 132 132 ALA N N 200 122.390 122.390 122.494 -0.104 18517 17898 1 15 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.178 0.022 18517 17899 1 15 . 1 1 132 132 ALA C C 200 180.360 180.360 180.068 0.292 18517 17900 1 15 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.859 -0.079 18517 17901 1 15 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.026 0.364 18517 17902 1 15 . 1 1 132 132 ALA H H 200 8.190 8.190 7.649 0.541 18517 17903 1 15 . 1 1 133 133 LEU N N 201 120.800 120.800 120.790 0.010 18517 17904 1 15 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.340 -0.130 18517 17905 1 15 . 1 1 133 133 LEU C C 201 179.270 179.270 179.095 0.175 18517 17906 1 15 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.421 0.259 18517 17907 1 15 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.361 0.819 18517 17908 1 15 . 1 1 133 133 LEU H H 201 7.720 7.720 8.327 -0.607 18517 17909 1 15 . 1 1 134 134 LEU N N 202 120.680 120.680 120.870 -0.190 18517 17910 1 15 . 1 1 134 134 LEU HA H 202 3.980 3.980 4.029 -0.049 18517 17911 1 15 . 1 1 134 134 LEU C C 202 179.030 179.030 178.495 0.535 18517 17912 1 15 . 1 1 134 134 LEU CA C 202 58.430 58.430 58.003 0.427 18517 17913 1 15 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.489 0.131 18517 17914 1 15 . 1 1 134 134 LEU H H 202 8.470 8.470 8.698 -0.228 18517 17915 1 15 . 1 1 135 135 SER N N 203 113.290 113.290 115.204 -1.914 18517 17916 1 15 . 1 1 135 135 SER HA H 203 4.180 4.180 4.155 0.025 18517 17917 1 15 . 1 1 135 135 SER C C 203 177.300 177.300 176.862 0.438 18517 17918 1 15 . 1 1 135 135 SER CA C 203 62.080 62.080 62.736 -0.656 18517 17919 1 15 . 1 1 135 135 SER CB C 203 63.030 63.030 62.938 0.092 18517 17920 1 15 . 1 1 135 135 SER H H 203 8.210 8.210 8.689 -0.479 18517 17921 1 15 . 1 1 136 136 SER N N 204 117.500 117.500 118.822 -1.322 18517 17922 1 15 . 1 1 136 136 SER HA H 204 4.050 4.050 4.170 -0.120 18517 17923 1 15 . 1 1 136 136 SER C C 204 177.570 177.570 176.449 1.121 18517 17924 1 15 . 1 1 136 136 SER CA C 204 61.880 61.880 61.602 0.278 18517 17925 1 15 . 1 1 136 136 SER CB C 204 63.510 63.510 62.969 0.541 18517 17926 1 15 . 1 1 136 136 SER H H 204 7.730 7.730 8.340 -0.610 18517 17927 1 15 . 1 1 137 137 MET N N 205 122.500 122.500 123.742 -1.242 18517 17928 1 15 . 1 1 137 137 MET HA H 205 4.140 4.140 4.022 0.118 18517 17929 1 15 . 1 1 137 137 MET C C 205 177.680 177.680 177.741 -0.061 18517 17930 1 15 . 1 1 137 137 MET CA C 205 60.140 60.140 59.314 0.826 18517 17931 1 15 . 1 1 137 137 MET CB C 205 33.460 33.460 32.533 0.927 18517 17932 1 15 . 1 1 137 137 MET H H 205 8.170 8.170 8.194 -0.024 18517 17933 1 15 . 1 1 138 138 LYS N N 206 121.410 121.410 118.677 2.733 18517 17934 1 15 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.875 -0.125 18517 17935 1 15 . 1 1 138 138 LYS C C 206 178.780 178.780 178.900 -0.120 18517 17936 1 15 . 1 1 138 138 LYS CA C 206 60.330 60.330 60.205 0.125 18517 17937 1 15 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.441 -0.172 18517 17938 1 15 . 1 1 138 138 LYS H H 206 8.810 8.810 8.455 0.355 18517 17939 1 15 . 1 1 139 139 THR N N 207 116.580 116.580 116.475 0.105 18517 17940 1 15 . 1 1 139 139 THR HA H 207 4.060 4.060 4.007 0.053 18517 17941 1 15 . 1 1 139 139 THR C C 207 176.730 176.730 177.298 -0.568 18517 17942 1 15 . 1 1 139 139 THR CA C 207 67.150 67.150 66.968 0.183 18517 17943 1 15 . 1 1 139 139 THR CB C 207 69.220 69.220 68.534 0.686 18517 17944 1 15 . 1 1 139 139 THR H H 207 7.930 7.930 8.266 -0.336 18517 17945 1 15 . 1 1 140 140 GLN N N 208 121.390 121.390 120.984 0.406 18517 17946 1 15 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.141 -0.081 18517 17947 1 15 . 1 1 140 140 GLN C C 208 178.550 178.550 178.193 0.357 18517 17948 1 15 . 1 1 140 140 GLN CA C 208 59.300 59.300 58.875 0.425 18517 17949 1 15 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.331 0.529 18517 17950 1 15 . 1 1 140 140 GLN H H 208 7.600 7.600 8.119 -0.519 18517 17951 1 15 . 1 1 141 141 HIS N N 209 122.360 122.360 119.917 2.443 18517 17952 1 15 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.273 -0.443 18517 17953 1 15 . 1 1 141 141 HIS C C 209 176.390 176.390 177.315 -0.925 18517 17954 1 15 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.154 1.566 18517 17955 1 15 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.253 -1.153 18517 17956 1 15 . 1 1 141 141 HIS H H 209 8.980 8.980 8.376 0.604 18517 17957 1 15 . 1 1 142 142 ASP N N 210 120.740 120.740 120.365 0.375 18517 17958 1 15 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.402 -0.052 18517 17959 1 15 . 1 1 142 142 ASP C C 210 179.490 179.490 178.115 1.375 18517 17960 1 15 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.941 -0.021 18517 17961 1 15 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.916 -0.326 18517 17962 1 15 . 1 1 142 142 ASP H H 210 8.770 8.770 8.533 0.237 18517 17963 1 15 . 1 1 143 143 GLU N N 211 119.010 119.010 120.681 -1.671 18517 17964 1 15 . 1 1 143 143 GLU HA H 211 3.970 3.970 3.997 -0.027 18517 17965 1 15 . 1 1 143 143 GLU C C 211 179.070 179.070 178.855 0.215 18517 17966 1 15 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.529 -0.229 18517 17967 1 15 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.668 -0.178 18517 17968 1 15 . 1 1 143 143 GLU H H 211 7.850 7.850 8.109 -0.259 18517 17969 1 15 . 1 1 144 144 LEU N N 212 122.500 122.500 120.230 2.270 18517 17970 1 15 . 1 1 144 144 LEU HA H 212 4.070 4.070 3.995 0.075 18517 17971 1 15 . 1 1 144 144 LEU C C 212 179.340 179.340 179.175 0.165 18517 17972 1 15 . 1 1 144 144 LEU CA C 212 58.390 58.390 57.998 0.392 18517 17973 1 15 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.796 0.384 18517 17974 1 15 . 1 1 144 144 LEU H H 212 8.070 8.070 8.076 -0.006 18517 17975 1 15 . 1 1 145 145 LEU N N 213 118.110 118.110 117.774 0.336 18517 17976 1 15 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.541 0.659 18517 17977 1 15 . 1 1 145 145 LEU C C 213 179.610 179.610 178.941 0.669 18517 17978 1 15 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.583 1.167 18517 17979 1 15 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.154 0.076 18517 17980 1 15 . 1 1 145 145 LEU H H 213 8.370 8.370 8.124 0.246 18517 17981 1 15 . 1 1 146 146 LYS N N 214 117.290 117.290 120.533 -3.243 18517 17982 1 15 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.918 -0.088 18517 17983 1 15 . 1 1 146 146 LYS C C 214 179.900 179.900 178.935 0.965 18517 17984 1 15 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.912 0.418 18517 17985 1 15 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.305 0.045 18517 17986 1 15 . 1 1 146 146 LYS H H 214 7.560 7.560 8.296 -0.736 18517 17987 1 15 . 1 1 147 147 LYS N N 215 120.330 120.330 119.498 0.832 18517 17988 1 15 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.062 -0.042 18517 17989 1 15 . 1 1 147 147 LYS C C 215 180.550 180.550 179.335 1.215 18517 17990 1 15 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.267 0.833 18517 17991 1 15 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.103 0.637 18517 17992 1 15 . 1 1 147 147 LYS H H 215 7.830 7.830 8.108 -0.278 18517 17993 1 15 . 1 1 148 148 PHE N N 216 117.370 117.370 118.046 -0.676 18517 17994 1 15 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.194 -0.114 18517 17995 1 15 . 1 1 148 148 PHE C C 216 178.200 178.200 177.888 0.312 18517 17996 1 15 . 1 1 148 148 PHE CA C 216 62.120 62.120 60.774 1.346 18517 17997 1 15 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.271 1.449 18517 17998 1 15 . 1 1 148 148 PHE H H 216 8.010 8.010 8.687 -0.677 18517 17999 1 15 . 1 1 149 149 ALA N N 217 118.990 118.990 120.267 -1.277 18517 18000 1 15 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.348 -0.238 18517 18001 1 15 . 1 1 149 149 ALA C C 217 177.330 177.330 178.113 -0.783 18517 18002 1 15 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.196 0.554 18517 18003 1 15 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.432 -0.832 18517 18004 1 15 . 1 1 149 149 ALA H H 217 7.720 7.720 7.954 -0.234 18517 18005 1 15 . 1 1 150 150 ALA N N 218 118.690 118.690 120.718 -2.028 18517 18006 1 15 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.385 -0.025 18517 18007 1 15 . 1 1 150 150 ALA C C 218 177.930 177.930 177.632 0.298 18517 18008 1 15 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.922 -0.832 18517 18009 1 15 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.668 0.072 18517 18010 1 15 . 1 1 150 150 ALA H H 218 7.280 7.280 7.664 -0.384 18517 18011 1 15 . 1 1 151 151 LEU N N 219 119.980 119.980 120.609 -0.629 18517 18012 1 15 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.310 -0.040 18517 18013 1 15 . 1 1 151 151 LEU C C 219 176.150 176.150 174.770 1.380 18517 18014 1 15 . 1 1 151 151 LEU CA C 219 56.170 56.170 55.036 1.134 18517 18015 1 15 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.035 -0.225 18517 18016 1 15 . 1 1 151 151 LEU H H 219 7.050 7.050 7.855 -0.805 18517 18017 1 15 . 1 1 152 152 THR N N 220 112.070 112.070 116.508 -4.438 18517 18018 1 15 . 1 1 152 152 THR HA H 220 4.700 4.700 4.852 -0.152 18517 18019 1 15 . 1 1 152 152 THR C C 220 173.400 173.400 172.979 0.421 18517 18020 1 15 . 1 1 152 152 THR CA C 220 58.190 58.190 58.501 -0.311 18517 18021 1 15 . 1 1 152 152 THR CB C 220 70.960 70.960 69.310 1.650 18517 18022 1 15 . 1 1 152 152 THR H H 220 8.040 8.040 7.900 0.140 18517 18023 1 15 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.721 -0.011 18517 18024 1 15 . 1 1 153 153 PRO C C 221 176.720 176.720 175.963 0.757 18517 18025 1 15 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.345 0.565 18517 18026 1 15 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.545 1.705 18517 18027 1 15 . 1 1 154 154 THR N N 222 120.460 120.460 116.804 3.656 18517 18028 1 15 . 1 1 154 154 THR HA H 222 4.250 4.250 4.202 0.048 18517 18029 1 15 . 1 1 154 154 THR C C 222 175.190 175.190 175.618 -0.428 18517 18030 1 15 . 1 1 154 154 THR CA C 222 64.650 64.650 62.247 2.403 18517 18031 1 15 . 1 1 154 154 THR CB C 222 70.410 70.410 69.519 0.891 18517 18032 1 15 . 1 1 154 154 THR H H 222 8.530 8.530 8.258 0.272 18517 18033 1 15 . 1 1 155 155 PHE N N 223 122.260 122.260 122.709 -0.449 18517 18034 1 15 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.829 0.161 18517 18035 1 15 . 1 1 155 155 PHE C C 223 172.560 172.560 175.042 -2.482 18517 18036 1 15 . 1 1 155 155 PHE CA C 223 56.770 56.770 56.844 -0.074 18517 18037 1 15 . 1 1 155 155 PHE CB C 223 40.590 40.590 38.746 1.844 18517 18038 1 15 . 1 1 155 155 PHE H H 223 8.950 8.950 7.757 1.193 18517 18039 1 15 . 1 1 156 156 LEU N N 224 123.440 123.440 120.831 2.609 18517 18040 1 15 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.484 0.186 18517 18041 1 15 . 1 1 156 156 LEU C C 224 175.090 175.090 177.244 -2.154 18517 18042 1 15 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.271 -0.241 18517 18043 1 15 . 1 1 156 156 LEU CB C 224 46.300 46.300 42.703 3.597 18517 18044 1 15 . 1 1 156 156 LEU H H 224 7.210 7.210 7.020 0.190 18517 18045 1 15 . 1 1 157 157 THR N N 225 113.010 113.010 115.929 -2.919 18517 18046 1 15 . 1 1 157 157 THR HA H 225 4.790 4.790 4.693 0.097 18517 18047 1 15 . 1 1 157 157 THR C C 225 176.130 176.130 174.665 1.465 18517 18048 1 15 . 1 1 157 157 THR CA C 225 59.860 59.860 61.262 -1.402 18517 18049 1 15 . 1 1 157 157 THR CB C 225 72.860 72.860 70.634 2.226 18517 18050 1 15 . 1 1 157 157 THR H H 225 9.200 9.200 8.379 0.821 18517 18051 1 15 . 1 1 158 158 SER N N 226 115.350 115.350 120.175 -4.825 18517 18052 1 15 . 1 1 158 158 SER C C 226 177.410 177.410 176.085 1.325 18517 18053 1 15 . 1 1 158 158 SER CA C 226 57.400 57.400 58.742 -1.342 18517 18054 1 15 . 1 1 158 158 SER CB C 226 66.200 66.200 63.820 2.380 18517 18055 1 15 . 1 1 158 158 SER H H 226 8.830 8.830 8.530 0.300 18517 18056 1 15 . 1 1 159 159 GLU N N 227 121.200 121.200 121.644 -0.444 18517 18057 1 15 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.938 0.082 18517 18058 1 15 . 1 1 159 159 GLU C C 227 177.680 177.680 177.420 0.260 18517 18059 1 15 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.681 0.820 18517 18060 1 15 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.601 -0.031 18517 18061 1 15 . 1 1 159 159 GLU H H 227 8.320 8.320 8.857 -0.537 18517 18062 1 15 . 1 1 160 160 ASP N N 228 115.350 115.350 117.965 -2.615 18517 18063 1 15 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.414 0.136 18517 18064 1 15 . 1 1 160 160 ASP C C 228 177.640 177.640 177.824 -0.184 18517 18065 1 15 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.785 0.615 18517 18066 1 15 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.639 2.412 18517 18067 1 15 . 1 1 160 160 ASP H H 228 7.570 7.570 8.197 -0.627 18517 18068 1 15 . 1 1 161 161 ILE N N 229 108.150 108.150 114.710 -6.560 18517 18069 1 15 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.341 0.169 18517 18070 1 15 . 1 1 161 161 ILE C C 229 173.130 173.130 177.442 -4.312 18517 18071 1 15 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.694 -1.404 18517 18072 1 15 . 1 1 161 161 ILE CB C 229 39.400 39.400 38.864 0.537 18517 18073 1 15 . 1 1 161 161 ILE H H 229 7.190 7.190 7.610 -0.420 18517 18074 1 15 . 1 1 162 162 SER N N 230 115.290 115.290 118.455 -3.165 18517 18075 1 15 . 1 1 162 162 SER HA H 230 4.760 4.760 4.149 0.611 18517 18076 1 15 . 1 1 162 162 SER C C 230 176.060 176.060 174.303 1.757 18517 18077 1 15 . 1 1 162 162 SER CA C 230 57.920 57.920 58.307 -0.388 18517 18078 1 15 . 1 1 162 162 SER CB C 230 66.120 66.120 61.692 4.428 18517 18079 1 15 . 1 1 162 162 SER H H 230 7.460 7.460 8.267 -0.807 18517 18080 1 15 . 1 1 163 163 GLY C C 231 173.260 173.260 173.448 -0.188 18517 18081 1 15 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.676 0.874 18517 18082 1 15 . 1 1 164 164 TYR N N 232 115.290 115.290 118.705 -3.415 18517 18083 1 15 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.827 -0.127 18517 18084 1 15 . 1 1 164 164 TYR C C 232 172.820 172.820 174.163 -1.343 18517 18085 1 15 . 1 1 164 164 TYR CA C 232 55.100 55.100 54.837 0.263 18517 18086 1 15 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.644 0.156 18517 18087 1 15 . 1 1 164 164 TYR H H 232 7.370 7.370 7.376 -0.006 18517 18088 1 15 . 1 1 165 165 LEU N N 233 120.980 120.980 122.772 -1.792 18517 18089 1 15 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.521 -0.091 18517 18090 1 15 . 1 1 165 165 LEU C C 233 176.360 176.360 177.569 -1.209 18517 18091 1 15 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.393 1.267 18517 18092 1 15 . 1 1 165 165 LEU CB C 233 40.430 40.430 41.089 -0.659 18517 18093 1 15 . 1 1 165 165 LEU H H 233 8.830 8.830 8.956 -0.126 18517 18094 1 15 . 1 1 166 166 THR N N 234 116.170 116.170 115.468 0.702 18517 18095 1 15 . 1 1 166 166 THR HA H 234 4.010 4.010 3.477 0.533 18517 18096 1 15 . 1 1 166 166 THR C C 234 173.070 173.070 173.488 -0.418 18517 18097 1 15 . 1 1 166 166 THR CA C 234 62.910 62.910 64.109 -1.199 18517 18098 1 15 . 1 1 166 166 THR CB C 234 70.170 70.170 69.176 0.994 18517 18099 1 15 . 1 1 166 166 THR H H 234 8.050 8.050 7.870 0.180 18517 18100 1 15 . 1 1 167 167 VAL N N 235 117.640 117.640 121.797 -4.157 18517 18101 1 15 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.000 0.210 18517 18102 1 15 . 1 1 167 167 VAL C C 235 172.330 172.330 174.350 -2.020 18517 18103 1 15 . 1 1 167 167 VAL CA C 235 58.750 58.750 58.908 -0.158 18517 18104 1 15 . 1 1 167 167 VAL CB C 235 35.880 35.880 31.932 3.948 18517 18105 1 15 . 1 1 167 167 VAL H H 235 7.160 7.160 7.609 -0.449 18517 18106 1 15 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.455 -0.265 18517 18107 1 15 . 1 1 168 168 PRO C C 236 173.710 173.710 175.529 -1.819 18517 18108 1 15 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.874 0.956 18517 18109 1 15 . 1 1 168 168 PRO CB C 236 32.270 32.270 33.602 -1.332 18517 18110 1 15 . 1 1 169 169 GLU N N 237 113.540 113.540 116.695 -3.155 18517 18111 1 15 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.130 0.250 18517 18112 1 15 . 1 1 169 169 GLU C C 237 176.690 176.690 177.227 -0.537 18517 18113 1 15 . 1 1 169 169 GLU CA C 237 53.750 53.750 54.378 -0.628 18517 18114 1 15 . 1 1 169 169 GLU CB C 237 33.220 33.220 31.776 1.444 18517 18115 1 15 . 1 1 169 169 GLU H H 237 7.930 7.930 8.328 -0.398 18517 18116 1 15 . 1 1 170 170 TYR N N 238 119.400 119.400 119.558 -0.158 18517 18117 1 15 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.524 -0.524 18517 18118 1 15 . 1 1 170 170 TYR C C 238 177.610 177.610 177.455 0.155 18517 18119 1 15 . 1 1 170 170 TYR CA C 238 62.630 62.630 60.682 1.948 18517 18120 1 15 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.242 -0.502 18517 18121 1 15 . 1 1 170 170 TYR H H 238 8.490 8.490 8.361 0.129 18517 18122 1 15 . 1 1 171 171 GLY N N 239 104.160 104.160 103.904 0.256 18517 18123 1 15 . 1 1 171 171 GLY C C 239 173.350 173.350 173.606 -0.256 18517 18124 1 15 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.526 0.744 18517 18125 1 15 . 1 1 171 171 GLY H H 239 7.960 7.960 8.271 -0.311 18517 18126 1 15 . 1 1 172 172 ALA N N 240 121.860 121.860 123.235 -1.375 18517 18127 1 15 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.877 -0.707 18517 18128 1 15 . 1 1 172 172 ALA C C 240 172.160 172.160 174.695 -2.535 18517 18129 1 15 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.601 0.509 18517 18130 1 15 . 1 1 172 172 ALA CB C 240 20.930 20.930 19.955 0.975 18517 18131 1 15 . 1 1 172 172 ALA H H 240 6.910 6.910 7.550 -0.640 18517 18132 1 15 . 1 1 173 173 PRO HA H 241 4.550 4.550 4.365 0.185 18517 18133 1 15 . 1 1 173 173 PRO C C 241 176.610 176.610 175.005 1.605 18517 18134 1 15 . 1 1 173 173 PRO CA C 241 61.520 61.520 61.863 -0.343 18517 18135 1 15 . 1 1 173 173 PRO CB C 241 33.300 33.300 32.871 0.429 18517 18136 1 15 . 1 1 174 174 MET N N 242 114.000 114.000 116.478 -2.478 18517 18137 1 15 . 1 1 174 174 MET HA H 242 4.390 4.390 4.552 -0.162 18517 18138 1 15 . 1 1 174 174 MET C C 242 173.960 173.960 175.143 -1.183 18517 18139 1 15 . 1 1 174 174 MET CA C 242 54.660 54.660 53.737 0.923 18517 18140 1 15 . 1 1 174 174 MET CB C 242 34.170 34.170 36.215 -2.045 18517 18141 1 15 . 1 1 174 174 MET H H 242 8.040 8.040 7.858 0.182 18517 18142 1 15 . 1 1 175 175 ASN N N 243 119.570 119.570 124.622 -5.052 18517 18143 1 15 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.720 0.220 18517 18144 1 15 . 1 1 175 175 ASN C C 243 174.320 174.320 175.351 -1.031 18517 18145 1 15 . 1 1 175 175 ASN CA C 243 53.080 53.080 53.034 0.046 18517 18146 1 15 . 1 1 175 175 ASN CB C 243 38.850 38.850 37.090 1.760 18517 18147 1 15 . 1 1 175 175 ASN H H 243 7.960 7.960 9.056 -1.096 18517 18148 1 15 . 1 1 176 176 ALA N N 244 132.250 132.250 126.537 5.713 18517 18149 1 15 . 1 1 176 176 ALA C C 244 181.580 181.580 178.443 3.137 18517 18150 1 15 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.357 0.413 18517 18151 1 15 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.933 0.097 18517 18152 1 15 . 1 1 176 176 ALA H H 244 12.110 12.110 7.990 4.120 18517 18153 1 15 . 1 1 177 177 ALA N N 245 125.780 125.780 120.807 4.973 18517 18154 1 15 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.989 -0.119 18517 18155 1 15 . 1 1 177 177 ALA C C 245 180.640 180.640 179.612 1.028 18517 18156 1 15 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.270 0.390 18517 18157 1 15 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.260 -0.420 18517 18158 1 15 . 1 1 177 177 ALA H H 245 10.240 10.240 8.456 1.784 18517 18159 1 15 . 1 1 178 178 LYS N N 246 119.810 119.810 119.201 0.609 18517 18160 1 15 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.067 -0.237 18517 18161 1 15 . 1 1 178 178 LYS C C 246 180.500 180.500 178.444 2.056 18517 18162 1 15 . 1 1 178 178 LYS CA C 246 59.900 59.900 58.942 0.958 18517 18163 1 15 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.199 -0.879 18517 18164 1 15 . 1 1 178 178 LYS H H 246 8.470 8.470 7.584 0.886 18517 18165 1 15 . 1 1 179 179 TRP N N 247 121.170 121.170 121.951 -0.781 18517 18166 1 15 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.383 0.237 18517 18167 1 15 . 1 1 179 179 TRP C C 247 176.510 176.510 177.907 -1.397 18517 18168 1 15 . 1 1 179 179 TRP CA C 247 59.820 59.820 60.175 -0.355 18517 18169 1 15 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.780 -0.210 18517 18170 1 15 . 1 1 179 179 TRP H H 247 8.330 8.330 8.604 -0.274 18517 18171 1 15 . 1 1 180 180 ALA N N 248 119.130 119.130 119.853 -0.723 18517 18172 1 15 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.818 0.722 18517 18173 1 15 . 1 1 180 180 ALA C C 248 182.110 182.110 179.657 2.453 18517 18174 1 15 . 1 1 180 180 ALA CA C 248 54.190 54.190 54.980 -0.790 18517 18175 1 15 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.037 0.673 18517 18176 1 15 . 1 1 180 180 ALA H H 248 7.990 7.990 8.751 -0.761 18517 18177 1 15 . 1 1 181 181 LYS N N 249 116.000 116.000 119.526 -3.526 18517 18178 1 15 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.070 -0.100 18517 18179 1 15 . 1 1 181 181 LYS C C 249 179.380 179.380 178.781 0.599 18517 18180 1 15 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.553 -0.843 18517 18181 1 15 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.694 -0.184 18517 18182 1 15 . 1 1 181 181 LYS H H 249 6.900 6.900 7.775 -0.875 18517 18183 1 15 . 1 1 182 182 VAL N N 250 122.270 122.270 115.954 6.316 18517 18184 1 15 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.789 -0.449 18517 18185 1 15 . 1 1 182 182 VAL C C 250 178.160 178.160 177.760 0.400 18517 18186 1 15 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.076 0.684 18517 18187 1 15 . 1 1 182 182 VAL CB C 250 30.840 30.840 30.811 0.029 18517 18188 1 15 . 1 1 182 182 VAL H H 250 7.050 7.050 8.056 -1.006 18517 18189 1 15 . 1 1 183 183 GLU N N 251 120.520 120.520 120.983 -0.463 18517 18190 1 15 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.939 -0.759 18517 18191 1 15 . 1 1 183 183 GLU C C 251 179.480 179.480 178.870 0.610 18517 18192 1 15 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.333 1.357 18517 18193 1 15 . 1 1 183 183 GLU CB C 251 28.070 28.070 29.160 -1.090 18517 18194 1 15 . 1 1 183 183 GLU H H 251 8.020 8.020 8.756 -0.736 18517 18195 1 15 . 1 1 184 184 GLY N N 252 102.930 102.930 107.514 -4.584 18517 18196 1 15 . 1 1 184 184 GLY C C 252 176.920 176.920 176.434 0.486 18517 18197 1 15 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.106 0.304 18517 18198 1 15 . 1 1 184 184 GLY H H 252 7.830 7.830 8.080 -0.250 18517 18199 1 15 . 1 1 185 185 MET N N 253 123.200 123.200 121.777 1.423 18517 18200 1 15 . 1 1 185 185 MET HA H 253 4.250 4.250 4.004 0.246 18517 18201 1 15 . 1 1 185 185 MET C C 253 179.370 179.370 178.457 0.913 18517 18202 1 15 . 1 1 185 185 MET CA C 253 59.300 59.300 59.276 0.024 18517 18203 1 15 . 1 1 185 185 MET CB C 253 33.930 33.930 32.474 1.456 18517 18204 1 15 . 1 1 185 185 MET H H 253 7.890 7.890 7.866 0.024 18517 18205 1 15 . 1 1 186 186 ILE N N 254 120.150 120.150 119.629 0.521 18517 18206 1 15 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.631 -0.071 18517 18207 1 15 . 1 1 186 186 ILE C C 254 177.250 177.250 177.963 -0.713 18517 18208 1 15 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.702 0.818 18517 18209 1 15 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.656 0.635 18517 18210 1 15 . 1 1 186 186 ILE H H 254 8.260 8.260 8.320 -0.060 18517 18211 1 15 . 1 1 187 187 HIS N N 255 119.810 119.810 119.150 0.660 18517 18212 1 15 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.181 -0.181 18517 18213 1 15 . 1 1 187 187 HIS C C 255 176.460 176.460 177.408 -0.948 18517 18214 1 15 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.966 0.364 18517 18215 1 15 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.787 1.843 18517 18216 1 15 . 1 1 187 187 HIS H H 255 8.900 8.900 8.642 0.258 18517 18217 1 15 . 1 1 188 188 GLY N N 256 103.160 103.160 106.464 -3.304 18517 18218 1 15 . 1 1 188 188 GLY C C 256 176.320 176.320 175.875 0.445 18517 18219 1 15 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.868 0.022 18517 18220 1 15 . 1 1 188 188 GLY H H 256 8.030 8.030 8.382 -0.352 18517 18221 1 15 . 1 1 189 189 LYS N N 257 119.510 119.510 120.882 -1.372 18517 18222 1 15 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.030 -0.030 18517 18223 1 15 . 1 1 189 189 LYS C C 257 178.660 178.660 178.916 -0.256 18517 18224 1 15 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.338 -0.848 18517 18225 1 15 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.560 -0.010 18517 18226 1 15 . 1 1 189 189 LYS H H 257 7.120 7.120 7.725 -0.605 18517 18227 1 15 . 1 1 190 190 LEU N N 258 120.570 120.570 117.883 2.687 18517 18228 1 15 . 1 1 190 190 LEU HA H 258 3.930 3.930 4.126 -0.196 18517 18229 1 15 . 1 1 190 190 LEU C C 258 177.230 177.230 178.358 -1.128 18517 18230 1 15 . 1 1 190 190 LEU CA C 258 57.520 57.520 55.937 1.583 18517 18231 1 15 . 1 1 190 190 LEU CB C 258 42.970 42.970 40.648 2.322 18517 18232 1 15 . 1 1 190 190 LEU H H 258 8.060 8.060 8.365 -0.305 18517 18233 1 15 . 1 1 191 191 GLU N N 259 114.590 114.590 117.275 -2.685 18517 18234 1 15 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.164 0.116 18517 18235 1 15 . 1 1 191 191 GLU C C 259 176.230 176.230 176.691 -0.461 18517 18236 1 15 . 1 1 191 191 GLU CA C 259 55.340 55.340 57.324 -1.984 18517 18237 1 15 . 1 1 191 191 GLU CB C 259 29.330 29.330 30.301 -0.971 18517 18238 1 15 . 1 1 191 191 GLU H H 259 7.330 7.330 7.998 -0.668 18517 18239 1 15 . 1 1 192 192 SER N N 260 115.240 115.240 114.099 1.141 18517 18240 1 15 . 1 1 192 192 SER HA H 260 4.490 4.490 4.653 -0.163 18517 18241 1 15 . 1 1 192 192 SER C C 260 173.770 173.770 173.628 0.142 18517 18242 1 15 . 1 1 192 192 SER CA C 260 58.350 58.350 57.722 0.628 18517 18243 1 15 . 1 1 192 192 SER CB C 260 65.090 65.090 63.698 1.392 18517 18244 1 15 . 1 1 192 192 SER H H 260 7.130 7.130 7.867 -0.737 18517 18245 1 15 . 1 1 193 193 SER C C 261 174.600 174.600 173.509 1.091 18517 18246 1 15 . 1 1 193 193 SER CA C 261 59.980 59.980 59.260 0.720 18517 18247 1 15 . 1 1 193 193 SER CB C 261 63.750 63.750 64.944 -1.194 18517 18248 1 15 . 1 1 194 194 GLU N N 262 121.800 121.800 119.894 1.906 18517 18249 1 15 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.462 0.008 18517 18250 1 15 . 1 1 194 194 GLU C C 262 174.650 174.650 174.947 -0.297 18517 18251 1 15 . 1 1 194 194 GLU CA C 262 55.620 55.620 55.668 -0.048 18517 18252 1 15 . 1 1 194 194 GLU CB C 262 30.210 30.210 31.856 -1.646 18517 18253 1 15 . 1 1 194 194 GLU H H 262 7.840 7.840 7.735 0.105 18517 18254 1 15 . 1 1 195 195 VAL N N 263 124.080 124.080 122.336 1.744 18517 18255 1 15 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.140 0.110 18517 18256 1 15 . 1 1 195 195 VAL C C 263 174.460 174.460 174.790 -0.330 18517 18257 1 15 . 1 1 195 195 VAL CA C 263 59.820 59.820 60.298 -0.478 18517 18258 1 15 . 1 1 195 195 VAL CB C 263 33.620 33.620 32.691 0.930 18517 18259 1 15 . 1 1 195 195 VAL H H 263 8.020 8.020 8.366 -0.346 18517 18260 1 15 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.194 0.326 18517 18261 1 15 . 1 1 198 198 ASN C C 266 176.490 176.490 177.563 -1.073 18517 18262 1 15 . 1 1 198 198 ASN CA C 266 54.780 54.780 56.472 -1.692 18517 18263 1 15 . 1 1 198 198 ASN CB C 266 38.060 38.060 38.442 -0.382 18517 18264 1 15 . 1 1 199 199 LEU N N 267 120.680 120.680 120.640 0.040 18517 18265 1 15 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.935 0.075 18517 18266 1 15 . 1 1 199 199 LEU C C 267 178.050 178.050 178.167 -0.117 18517 18267 1 15 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.245 0.585 18517 18268 1 15 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.723 0.617 18517 18269 1 15 . 1 1 199 199 LEU H H 267 7.660 7.660 8.095 -0.435 18517 18270 1 15 . 1 1 200 200 LYS N N 268 116.740 116.740 119.315 -2.575 18517 18271 1 15 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.978 -0.248 18517 18272 1 15 . 1 1 200 200 LYS C C 268 178.520 178.520 178.508 0.012 18517 18273 1 15 . 1 1 200 200 LYS CA C 268 61.800 61.800 58.460 3.340 18517 18274 1 15 . 1 1 200 200 LYS CB C 268 32.110 32.110 31.593 0.517 18517 18275 1 15 . 1 1 200 200 LYS H H 268 8.280 8.280 8.170 0.110 18517 18276 1 15 . 1 1 201 201 ALA N N 269 121.270 121.270 122.416 -1.146 18517 18277 1 15 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.131 0.109 18517 18278 1 15 . 1 1 201 201 ALA C C 269 180.890 180.890 179.397 1.493 18517 18279 1 15 . 1 1 201 201 ALA CA C 269 55.180 55.180 54.929 0.251 18517 18280 1 15 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.386 0.084 18517 18281 1 15 . 1 1 201 201 ALA H H 269 7.710 7.710 8.005 -0.295 18517 18282 1 15 . 1 1 202 202 LEU N N 270 119.980 119.980 119.547 0.433 18517 18283 1 15 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.968 0.122 18517 18284 1 15 . 1 1 202 202 LEU C C 270 179.330 179.330 179.290 0.040 18517 18285 1 15 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.986 0.084 18517 18286 1 15 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.563 0.857 18517 18287 1 15 . 1 1 202 202 LEU H H 270 7.750 7.750 8.308 -0.558 18517 18288 1 15 . 1 1 203 203 VAL N N 271 118.450 118.450 119.521 -1.071 18517 18289 1 15 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.929 -0.099 18517 18290 1 15 . 1 1 203 203 VAL C C 271 177.110 177.110 177.779 -0.669 18517 18291 1 15 . 1 1 203 203 VAL CA C 271 67.710 67.710 67.064 0.646 18517 18292 1 15 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.072 0.638 18517 18293 1 15 . 1 1 203 203 VAL H H 271 8.560 8.560 8.128 0.432 18517 18294 1 15 . 1 1 204 204 ALA N N 272 122.560 122.560 121.864 0.696 18517 18295 1 15 . 1 1 204 204 ALA HA H 272 3.880 3.880 4.100 -0.220 18517 18296 1 15 . 1 1 204 204 ALA C C 272 178.700 178.700 179.987 -1.287 18517 18297 1 15 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.458 0.672 18517 18298 1 15 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.084 0.306 18517 18299 1 15 . 1 1 204 204 ALA H H 272 8.120 8.120 8.195 -0.075 18517 18300 1 15 . 1 1 205 205 GLU N N 273 117.290 117.290 119.284 -1.994 18517 18301 1 15 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.145 -0.155 18517 18302 1 15 . 1 1 205 205 GLU C C 273 178.630 178.630 178.942 -0.312 18517 18303 1 15 . 1 1 205 205 GLU CA C 273 60.140 60.140 58.956 1.185 18517 18304 1 15 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.351 0.619 18517 18305 1 15 . 1 1 205 205 GLU H H 273 7.670 7.670 8.178 -0.508 18517 18306 1 15 . 1 1 206 206 LEU N N 274 120.450 120.450 122.115 -1.665 18517 18307 1 15 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.053 -0.053 18517 18308 1 15 . 1 1 206 206 LEU C C 274 178.400 178.400 178.653 -0.253 18517 18309 1 15 . 1 1 206 206 LEU CA C 274 58.910 58.910 57.654 1.256 18517 18310 1 15 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.367 2.163 18517 18311 1 15 . 1 1 206 206 LEU H H 274 8.420 8.420 8.379 0.041 18517 18312 1 15 . 1 1 207 207 ILE N N 275 117.580 117.580 119.593 -2.013 18517 18313 1 15 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.545 -0.015 18517 18314 1 15 . 1 1 207 207 ILE C C 275 178.850 178.850 177.856 0.994 18517 18315 1 15 . 1 1 207 207 ILE CA C 275 66.080 66.080 66.013 0.067 18517 18316 1 15 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.575 1.195 18517 18317 1 15 . 1 1 207 207 ILE H H 275 8.700 8.700 8.476 0.224 18517 18318 1 15 . 1 1 208 208 GLU N N 276 119.100 119.100 120.431 -1.331 18517 18319 1 15 . 1 1 208 208 GLU HA H 276 4.000 4.000 3.998 0.002 18517 18320 1 15 . 1 1 208 208 GLU C C 276 178.540 178.540 179.264 -0.724 18517 18321 1 15 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.939 0.511 18517 18322 1 15 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.819 0.701 18517 18323 1 15 . 1 1 208 208 GLU H H 276 7.950 7.950 7.942 0.008 18517 18324 1 15 . 1 1 209 209 LEU N N 277 120.590 120.590 119.317 1.273 18517 18325 1 15 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.192 0.028 18517 18326 1 15 . 1 1 209 209 LEU C C 277 179.520 179.520 179.704 -0.184 18517 18327 1 15 . 1 1 209 209 LEU CA C 277 58.350 58.350 57.715 0.635 18517 18328 1 15 . 1 1 209 209 LEU CB C 277 43.290 43.290 40.844 2.446 18517 18329 1 15 . 1 1 209 209 LEU H H 277 8.550 8.550 8.595 -0.045 18517 18330 1 15 . 1 1 210 210 ARG N N 278 116.470 116.470 120.451 -3.981 18517 18331 1 15 . 1 1 210 210 ARG HA H 278 3.740 3.740 4.091 -0.351 18517 18332 1 15 . 1 1 210 210 ARG C C 278 179.190 179.190 178.628 0.562 18517 18333 1 15 . 1 1 210 210 ARG CA C 278 61.680 61.680 58.730 2.950 18517 18334 1 15 . 1 1 210 210 ARG CB C 278 31.400 31.400 29.636 1.764 18517 18335 1 15 . 1 1 210 210 ARG H H 278 8.590 8.590 8.821 -0.231 18517 18336 1 15 . 1 1 211 211 ALA N N 279 120.470 120.470 121.591 -1.121 18517 18337 1 15 . 1 1 211 211 ALA HA H 279 3.910 3.910 3.999 -0.089 18517 18338 1 15 . 1 1 211 211 ALA C C 279 181.350 181.350 179.763 1.587 18517 18339 1 15 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.150 0.550 18517 18340 1 15 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.482 -1.202 18517 18341 1 15 . 1 1 211 211 ALA H H 279 8.050 8.050 8.117 -0.067 18517 18342 1 15 . 1 1 212 212 GLN N N 280 120.070 120.070 118.229 1.841 18517 18343 1 15 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.967 0.053 18517 18344 1 15 . 1 1 212 212 GLN C C 280 179.490 179.490 178.814 0.676 18517 18345 1 15 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.979 0.321 18517 18346 1 15 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.793 0.387 18517 18347 1 15 . 1 1 212 212 GLN H H 280 8.300 8.300 8.472 -0.172 18517 18348 1 15 . 1 1 213 213 MET N N 281 119.810 119.810 117.265 2.545 18517 18349 1 15 . 1 1 213 213 MET HA H 281 3.730 3.730 4.277 -0.547 18517 18350 1 15 . 1 1 213 213 MET C C 281 177.490 177.490 178.421 -0.931 18517 18351 1 15 . 1 1 213 213 MET CA C 281 60.690 60.690 56.770 3.920 18517 18352 1 15 . 1 1 213 213 MET CB C 281 33.930 33.930 31.820 2.110 18517 18353 1 15 . 1 1 213 213 MET H H 281 8.420 8.420 8.548 -0.128 18517 18354 1 15 . 1 1 214 214 MET N N 282 114.000 114.000 118.920 -4.920 18517 18355 1 15 . 1 1 214 214 MET HA H 282 3.880 3.880 4.214 -0.334 18517 18356 1 15 . 1 1 214 214 MET C C 282 177.650 177.650 178.296 -0.646 18517 18357 1 15 . 1 1 214 214 MET CA C 282 58.670 58.670 57.061 1.609 18517 18358 1 15 . 1 1 214 214 MET CB C 282 33.300 33.300 31.426 1.874 18517 18359 1 15 . 1 1 214 214 MET H H 282 7.890 7.890 8.300 -0.410 18517 18360 1 15 . 1 1 215 215 ALA N N 283 119.970 119.970 123.366 -3.396 18517 18361 1 15 . 1 1 215 215 ALA HA H 283 4.140 4.140 3.990 0.150 18517 18362 1 15 . 1 1 215 215 ALA C C 283 180.580 180.580 179.043 1.537 18517 18363 1 15 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.087 -0.977 18517 18364 1 15 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.332 -0.652 18517 18365 1 15 . 1 1 215 215 ALA H H 283 7.580 7.580 8.208 -0.628 18517 18366 1 15 . 1 1 216 216 LEU N N 284 120.920 120.920 117.916 3.004 18517 18367 1 15 . 1 1 216 216 LEU HA H 284 3.960 3.960 3.965 -0.005 18517 18368 1 15 . 1 1 216 216 LEU C C 284 177.910 177.910 179.179 -1.269 18517 18369 1 15 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.095 0.825 18517 18370 1 15 . 1 1 216 216 LEU CB C 284 42.500 42.500 41.985 0.515 18517 18371 1 15 . 1 1 216 216 LEU H H 284 7.460 7.460 8.134 -0.674 18517 18372 1 15 . 1 1 217 217 LEU N N 285 116.470 116.470 119.859 -3.389 18517 18373 1 15 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.829 -0.149 18517 18374 1 15 . 1 1 217 217 LEU C C 285 178.310 178.310 176.431 1.879 18517 18375 1 15 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.034 0.406 18517 18376 1 15 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.938 1.112 18517 18377 1 15 . 1 1 217 217 LEU H H 285 6.980 6.980 8.150 -1.170 18517 18378 1 15 . 1 1 218 218 TYR N N 286 111.080 111.080 113.613 -2.533 18517 18379 1 15 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.585 0.315 18517 18380 1 15 . 1 1 218 218 TYR C C 286 176.090 176.090 175.529 0.561 18517 18381 1 15 . 1 1 218 218 TYR CA C 286 56.050 56.050 56.135 -0.084 18517 18382 1 15 . 1 1 218 218 TYR CB C 286 40.910 40.910 37.646 3.264 18517 18383 1 15 . 1 1 218 218 TYR H H 286 7.660 7.660 7.519 0.141 18517 18384 1 15 . 1 1 219 219 GLY N N 287 108.260 108.260 110.813 -2.553 18517 18385 1 15 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.739 0.581 18517 18386 1 15 . 1 1 219 219 GLY H H 287 7.750 7.750 7.702 0.048 18517 18387 1 15 . 1 1 221 221 ILE HA H 289 3.490 3.490 4.482 -0.992 18517 18388 1 15 . 1 1 221 221 ILE CA C 289 63.580 63.580 61.483 2.097 18517 18389 1 15 . 1 1 221 221 ILE CB C 289 38.280 38.280 39.188 -0.908 18517 18390 1 15 . 1 1 222 222 GLY CA C 290 45.740 45.740 44.571 1.169 18517 18391 1 16 . 1 1 2 2 LYS N N 70 126.600 126.600 127.390 -0.790 18517 18392 1 16 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.757 -0.397 18517 18393 1 16 . 1 1 2 2 LYS C C 70 176.000 176.000 174.679 1.321 18517 18394 1 16 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.462 0.987 18517 18395 1 16 . 1 1 2 2 LYS CB C 70 33.850 33.850 33.137 0.713 18517 18396 1 16 . 1 1 2 2 LYS H H 70 8.530 8.530 8.377 0.153 18517 18397 1 16 . 1 1 3 3 THR N N 71 111.030 111.030 118.378 -7.348 18517 18398 1 16 . 1 1 3 3 THR HA H 71 4.400 4.400 4.631 -0.231 18517 18399 1 16 . 1 1 3 3 THR C C 71 175.650 175.650 175.200 0.450 18517 18400 1 16 . 1 1 3 3 THR CA C 71 60.610 60.610 59.679 0.931 18517 18401 1 16 . 1 1 3 3 THR CB C 71 71.520 71.520 70.287 1.233 18517 18402 1 16 . 1 1 3 3 THR H H 71 7.390 7.390 8.318 -0.928 18517 18403 1 16 . 1 1 4 4 LEU N N 72 121.560 121.560 122.107 -0.547 18517 18404 1 16 . 1 1 4 4 LEU C C 72 177.870 177.870 178.756 -0.886 18517 18405 1 16 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.547 -0.067 18517 18406 1 16 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.868 0.312 18517 18407 1 16 . 1 1 4 4 LEU H H 72 8.980 8.980 8.531 0.449 18517 18408 1 16 . 1 1 5 5 ASP N N 73 115.530 115.530 118.119 -2.589 18517 18409 1 16 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.382 -0.052 18517 18410 1 16 . 1 1 5 5 ASP C C 73 179.290 179.290 178.491 0.799 18517 18411 1 16 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.418 0.422 18517 18412 1 16 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.689 0.141 18517 18413 1 16 . 1 1 5 5 ASP H H 73 8.270 8.270 8.544 -0.274 18517 18414 1 16 . 1 1 6 6 VAL N N 74 122.330 122.330 119.312 3.018 18517 18415 1 16 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.624 0.116 18517 18416 1 16 . 1 1 6 6 VAL C C 74 178.970 178.970 177.837 1.133 18517 18417 1 16 . 1 1 6 6 VAL CA C 74 66.360 66.360 66.069 0.291 18517 18418 1 16 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.911 0.039 18517 18419 1 16 . 1 1 6 6 VAL H H 74 7.400 7.400 7.220 0.180 18517 18420 1 16 . 1 1 7 7 LEU N N 75 121.360 121.360 120.101 1.259 18517 18421 1 16 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.980 0.050 18517 18422 1 16 . 1 1 7 7 LEU C C 75 179.240 179.240 179.105 0.135 18517 18423 1 16 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.417 -0.187 18517 18424 1 16 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.342 1.548 18517 18425 1 16 . 1 1 7 7 LEU H H 75 8.300 8.300 8.374 -0.074 18517 18426 1 16 . 1 1 8 8 ARG N N 76 117.230 117.230 119.275 -2.045 18517 18427 1 16 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.087 -0.167 18517 18428 1 16 . 1 1 8 8 ARG C C 76 178.290 178.290 178.825 -0.535 18517 18429 1 16 . 1 1 8 8 ARG CA C 76 60.770 60.770 58.694 2.076 18517 18430 1 16 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.595 0.615 18517 18431 1 16 . 1 1 8 8 ARG H H 76 8.520 8.520 8.805 -0.285 18517 18432 1 16 . 1 1 9 9 GLY N N 77 104.570 104.570 107.461 -2.891 18517 18433 1 16 . 1 1 9 9 GLY C C 77 176.180 176.180 176.567 -0.387 18517 18434 1 16 . 1 1 9 9 GLY CA C 77 47.170 47.170 47.011 0.159 18517 18435 1 16 . 1 1 9 9 GLY H H 77 7.620 7.620 8.354 -0.734 18517 18436 1 16 . 1 1 10 10 GLU N N 78 120.270 120.270 123.022 -2.752 18517 18437 1 16 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.182 0.088 18517 18438 1 16 . 1 1 10 10 GLU C C 78 179.030 179.030 179.219 -0.189 18517 18439 1 16 . 1 1 10 10 GLU CA C 78 58.870 58.870 58.850 0.020 18517 18440 1 16 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.238 2.162 18517 18441 1 16 . 1 1 10 10 GLU H H 78 8.100 8.100 8.350 -0.250 18517 18442 1 16 . 1 1 11 11 LEU N N 79 116.000 116.000 120.532 -4.532 18517 18443 1 16 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.991 0.519 18517 18444 1 16 . 1 1 11 11 LEU C C 79 179.630 179.630 178.849 0.781 18517 18445 1 16 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.516 -1.825 18517 18446 1 16 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.574 3.226 18517 18447 1 16 . 1 1 11 11 LEU H H 79 8.230 8.230 8.396 -0.166 18517 18448 1 16 . 1 1 12 12 ARG N N 80 120.020 120.020 119.620 0.400 18517 18449 1 16 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.889 -0.139 18517 18450 1 16 . 1 1 12 12 ARG C C 80 178.490 178.490 178.746 -0.256 18517 18451 1 16 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.877 2.123 18517 18452 1 16 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.974 1.266 18517 18453 1 16 . 1 1 12 12 ARG H H 80 8.210 8.210 8.753 -0.543 18517 18454 1 16 . 1 1 13 13 GLY N N 81 108.090 108.090 106.918 1.172 18517 18455 1 16 . 1 1 13 13 GLY C C 81 173.540 173.540 176.281 -2.741 18517 18456 1 16 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.929 1.071 18517 18457 1 16 . 1 1 13 13 GLY H H 81 8.890 8.890 8.507 0.383 18517 18458 1 16 . 1 1 14 14 GLN C C 82 179.540 179.540 178.753 0.787 18517 18459 1 16 . 1 1 14 14 GLN CA C 82 58.710 58.710 59.375 -0.665 18517 18460 1 16 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.885 0.215 18517 18461 1 16 . 1 1 15 15 ARG N N 83 118.220 118.220 118.436 -0.216 18517 18462 1 16 . 1 1 15 15 ARG HA H 83 3.950 3.950 3.912 0.038 18517 18463 1 16 . 1 1 15 15 ARG C C 83 177.710 177.710 178.757 -1.047 18517 18464 1 16 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.471 0.429 18517 18465 1 16 . 1 1 15 15 ARG CB C 83 29.650 29.650 29.672 -0.022 18517 18466 1 16 . 1 1 15 15 ARG H H 83 7.320 7.320 8.637 -1.317 18517 18467 1 16 . 1 1 16 16 GLU N N 84 118.810 118.810 120.755 -1.945 18517 18468 1 16 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.191 -0.341 18517 18469 1 16 . 1 1 16 16 GLU C C 84 178.750 178.750 179.004 -0.254 18517 18470 1 16 . 1 1 16 16 GLU CA C 84 61.010 61.010 58.966 2.044 18517 18471 1 16 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.448 -0.038 18517 18472 1 16 . 1 1 16 16 GLU H H 84 8.450 8.450 8.432 0.018 18517 18473 1 16 . 1 1 17 17 ALA N N 85 122.790 122.790 123.652 -0.862 18517 18474 1 16 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.151 0.039 18517 18475 1 16 . 1 1 17 17 ALA C C 85 180.360 180.360 179.836 0.524 18517 18476 1 16 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.346 0.114 18517 18477 1 16 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.278 -0.198 18517 18478 1 16 . 1 1 17 17 ALA H H 85 8.420 8.420 8.517 -0.097 18517 18479 1 16 . 1 1 18 18 PHE N N 86 119.400 119.400 118.410 0.990 18517 18480 1 16 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.188 0.102 18517 18481 1 16 . 1 1 18 18 PHE C C 86 177.560 177.560 178.111 -0.551 18517 18482 1 16 . 1 1 18 18 PHE CA C 86 61.640 61.640 62.010 -0.370 18517 18483 1 16 . 1 1 18 18 PHE CB C 86 39.640 39.640 38.516 1.124 18517 18484 1 16 . 1 1 18 18 PHE H H 86 7.490 7.490 8.672 -1.182 18517 18485 1 16 . 1 1 19 19 LEU N N 87 117.470 117.470 120.209 -2.739 18517 18486 1 16 . 1 1 19 19 LEU HA H 87 4.070 4.070 3.981 0.089 18517 18487 1 16 . 1 1 19 19 LEU C C 87 178.880 178.880 178.453 0.427 18517 18488 1 16 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.669 -0.709 18517 18489 1 16 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.531 0.569 18517 18490 1 16 . 1 1 19 19 LEU H H 87 8.010 8.010 8.834 -0.824 18517 18491 1 16 . 1 1 20 20 SER N N 88 113.770 113.770 114.239 -0.469 18517 18492 1 16 . 1 1 20 20 SER HA H 88 4.070 4.070 4.066 0.004 18517 18493 1 16 . 1 1 20 20 SER C C 88 175.680 175.680 176.806 -1.126 18517 18494 1 16 . 1 1 20 20 SER CA C 88 63.070 63.070 62.055 1.015 18517 18495 1 16 . 1 1 20 20 SER H H 88 8.100 8.100 8.631 -0.531 18517 18496 1 16 . 1 1 21 21 GLU N N 89 120.570 120.570 121.995 -1.425 18517 18497 1 16 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.034 -0.064 18517 18498 1 16 . 1 1 21 21 GLU C C 89 178.940 178.940 179.478 -0.538 18517 18499 1 16 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.592 -0.332 18517 18500 1 16 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.736 -0.406 18517 18501 1 16 . 1 1 21 21 GLU H H 89 7.400 7.400 7.972 -0.572 18517 18502 1 16 . 1 1 22 22 ILE N N 90 119.350 119.350 119.780 -0.430 18517 18503 1 16 . 1 1 22 22 ILE HA H 90 3.690 3.690 4.049 -0.359 18517 18504 1 16 . 1 1 22 22 ILE C C 90 177.230 177.230 178.423 -1.193 18517 18505 1 16 . 1 1 22 22 ILE CA C 90 63.470 63.470 64.511 -1.041 18517 18506 1 16 . 1 1 22 22 ILE CB C 90 36.390 36.390 37.711 -1.321 18517 18507 1 16 . 1 1 22 22 ILE H H 90 7.250 7.250 8.653 -1.403 18517 18508 1 16 . 1 1 23 23 ILE N N 91 116.350 116.350 117.896 -1.546 18517 18509 1 16 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.860 -0.460 18517 18510 1 16 . 1 1 23 23 ILE C C 91 176.690 176.690 177.005 -0.315 18517 18511 1 16 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.207 2.523 18517 18512 1 16 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.331 0.439 18517 18513 1 16 . 1 1 23 23 ILE H H 91 7.860 7.860 8.242 -0.382 18517 18514 1 16 . 1 1 24 24 LYS N N 92 116.000 116.000 118.464 -2.464 18517 18515 1 16 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.179 -0.039 18517 18516 1 16 . 1 1 24 24 LYS C C 92 176.270 176.270 177.085 -0.815 18517 18517 1 16 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.837 -0.357 18517 18518 1 16 . 1 1 24 24 LYS CB C 92 33.300 33.300 33.126 0.174 18517 18519 1 16 . 1 1 24 24 LYS H H 92 7.170 7.170 8.045 -0.875 18517 18520 1 16 . 1 1 25 25 SER N N 93 114.650 114.650 115.404 -0.754 18517 18521 1 16 . 1 1 25 25 SER HA H 93 4.550 4.550 4.363 0.187 18517 18522 1 16 . 1 1 25 25 SER C C 93 173.370 173.370 173.205 0.165 18517 18523 1 16 . 1 1 25 25 SER CA C 93 57.240 57.240 60.026 -2.786 18517 18524 1 16 . 1 1 25 25 SER CB C 93 65.650 65.650 63.716 1.934 18517 18525 1 16 . 1 1 25 25 SER H H 93 7.730 7.730 7.846 -0.116 18517 18526 1 16 . 1 1 26 26 ASP N N 94 121.230 121.230 123.167 -1.937 18517 18527 1 16 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.794 0.136 18517 18528 1 16 . 1 1 26 26 ASP C C 94 176.560 176.560 174.949 1.611 18517 18529 1 16 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.154 1.357 18517 18530 1 16 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.757 0.893 18517 18531 1 16 . 1 1 26 26 ASP H H 94 8.280 8.280 8.304 -0.024 18517 18532 1 16 . 1 1 27 27 GLY N N 95 109.310 109.310 108.125 1.185 18517 18533 1 16 . 1 1 27 27 GLY C C 95 171.080 171.080 171.803 -0.723 18517 18534 1 16 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.133 -0.362 18517 18535 1 16 . 1 1 27 27 GLY H H 95 8.160 8.160 7.481 0.679 18517 18536 1 16 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.484 0.656 18517 18537 1 16 . 1 1 29 29 PHE C C 97 175.230 175.230 174.476 0.754 18517 18538 1 16 . 1 1 29 29 PHE CA C 97 56.490 56.490 55.684 0.806 18517 18539 1 16 . 1 1 29 29 PHE CB C 97 41.620 41.620 42.708 -1.088 18517 18540 1 16 . 1 1 30 30 THR N N 98 112.600 112.600 112.771 -0.171 18517 18541 1 16 . 1 1 30 30 THR HA H 98 4.570 4.570 4.450 0.120 18517 18542 1 16 . 1 1 30 30 THR C C 98 176.690 176.690 174.793 1.897 18517 18543 1 16 . 1 1 30 30 THR CA C 98 60.290 60.290 59.870 0.420 18517 18544 1 16 . 1 1 30 30 THR CB C 98 71.600 71.600 70.905 0.695 18517 18545 1 16 . 1 1 30 30 THR H H 98 8.990 8.990 8.243 0.747 18517 18546 1 16 . 1 1 31 31 ILE N N 99 119.240 119.240 120.970 -1.730 18517 18547 1 16 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.633 0.187 18517 18548 1 16 . 1 1 31 31 ILE C C 99 176.090 176.090 176.340 -0.250 18517 18549 1 16 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.335 -3.195 18517 18550 1 16 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.672 -0.722 18517 18551 1 16 . 1 1 31 31 ILE H H 99 9.230 9.230 7.741 1.489 18517 18552 1 16 . 1 1 32 32 LEU N N 100 119.660 119.660 118.595 1.065 18517 18553 1 16 . 1 1 32 32 LEU HA H 100 4.030 4.030 4.072 -0.042 18517 18554 1 16 . 1 1 32 32 LEU C C 100 181.050 181.050 179.381 1.669 18517 18555 1 16 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.978 -0.418 18517 18556 1 16 . 1 1 32 32 LEU CB C 100 40.120 40.120 40.477 -0.357 18517 18557 1 16 . 1 1 32 32 LEU H H 100 7.310 7.310 8.114 -0.804 18517 18558 1 16 . 1 1 33 33 GLN N N 101 121.450 121.450 118.205 3.245 18517 18559 1 16 . 1 1 33 33 GLN HA H 101 4.250 4.250 3.979 0.271 18517 18560 1 16 . 1 1 33 33 GLN CA C 101 59.700 59.700 58.387 1.313 18517 18561 1 16 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.355 3.435 18517 18562 1 16 . 1 1 33 33 GLN H H 101 7.790 7.790 7.429 0.361 18517 18563 1 16 . 1 1 34 34 LEU C C 102 178.590 178.590 179.194 -0.604 18517 18564 1 16 . 1 1 34 34 LEU CA C 102 58.630 58.630 57.620 1.010 18517 18565 1 16 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.619 -0.309 18517 18566 1 16 . 1 1 35 35 VAL N N 103 118.520 118.520 114.956 3.564 18517 18567 1 16 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.706 -0.286 18517 18568 1 16 . 1 1 35 35 VAL C C 103 177.930 177.930 177.949 -0.019 18517 18569 1 16 . 1 1 35 35 VAL CA C 103 66.040 66.040 65.651 0.389 18517 18570 1 16 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.702 0.928 18517 18571 1 16 . 1 1 35 35 VAL H H 103 8.670 8.670 8.475 0.195 18517 18572 1 16 . 1 1 36 36 GLY N N 104 109.430 109.430 108.697 0.733 18517 18573 1 16 . 1 1 36 36 GLY C C 104 174.600 174.600 175.464 -0.864 18517 18574 1 16 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.241 0.799 18517 18575 1 16 . 1 1 36 36 GLY H H 104 7.880 7.880 8.213 -0.333 18517 18576 1 16 . 1 1 37 37 TYR N N 105 122.270 122.270 124.148 -1.878 18517 18577 1 16 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.359 -0.479 18517 18578 1 16 . 1 1 37 37 TYR C C 105 176.310 176.310 177.017 -0.707 18517 18579 1 16 . 1 1 37 37 TYR CA C 105 64.100 64.100 59.999 4.101 18517 18580 1 16 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.712 -0.343 18517 18581 1 16 . 1 1 37 37 TYR H H 105 8.170 8.170 8.024 0.146 18517 18582 1 16 . 1 1 38 38 LEU N N 106 120.100 120.100 121.189 -1.089 18517 18583 1 16 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.767 -0.027 18517 18584 1 16 . 1 1 38 38 LEU C C 106 178.280 178.280 178.418 -0.138 18517 18585 1 16 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.037 0.593 18517 18586 1 16 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.558 1.172 18517 18587 1 16 . 1 1 38 38 LEU H H 106 7.610 7.610 8.192 -0.582 18517 18588 1 16 . 1 1 39 39 ARG N N 107 116.670 116.670 118.840 -2.170 18517 18589 1 16 . 1 1 39 39 ARG HA H 107 3.680 3.680 3.887 -0.207 18517 18590 1 16 . 1 1 39 39 ARG C C 107 179.480 179.480 178.142 1.338 18517 18591 1 16 . 1 1 39 39 ARG CA C 107 59.580 59.580 58.608 0.972 18517 18592 1 16 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.177 2.063 18517 18593 1 16 . 1 1 39 39 ARG H H 107 8.240 8.240 7.684 0.556 18517 18594 1 16 . 1 1 40 40 VAL N N 108 121.970 121.970 118.786 3.184 18517 18595 1 16 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.511 -0.111 18517 18596 1 16 . 1 1 40 40 VAL C C 108 178.440 178.440 178.242 0.198 18517 18597 1 16 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.288 1.662 18517 18598 1 16 . 1 1 40 40 VAL CB C 108 30.440 30.440 30.941 -0.501 18517 18599 1 16 . 1 1 40 40 VAL H H 108 8.200 8.200 7.763 0.438 18517 18600 1 16 . 1 1 41 41 VAL N N 109 108.940 108.940 115.383 -6.443 18517 18601 1 16 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.537 0.703 18517 18602 1 16 . 1 1 41 41 VAL C C 109 175.070 175.070 177.285 -2.215 18517 18603 1 16 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.605 -3.015 18517 18604 1 16 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.527 -0.877 18517 18605 1 16 . 1 1 41 41 VAL H H 109 7.760 7.760 7.756 0.004 18517 18606 1 16 . 1 1 42 42 ASP N N 110 124.670 124.670 119.749 4.921 18517 18607 1 16 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.360 0.260 18517 18608 1 16 . 1 1 42 42 ASP C C 110 177.310 177.310 178.187 -0.877 18517 18609 1 16 . 1 1 42 42 ASP CA C 110 59.980 59.980 57.688 2.292 18517 18610 1 16 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.790 4.160 18517 18611 1 16 . 1 1 42 42 ASP H H 110 7.360 7.360 8.196 -0.836 18517 18612 1 16 . 1 1 43 43 THR N N 111 102.340 102.340 114.024 -11.684 18517 18613 1 16 . 1 1 43 43 THR HA H 111 5.100 5.100 3.999 1.101 18517 18614 1 16 . 1 1 43 43 THR C C 111 174.940 174.940 176.536 -1.596 18517 18615 1 16 . 1 1 43 43 THR CA C 111 60.650 60.650 66.509 -5.859 18517 18616 1 16 . 1 1 43 43 THR CB C 111 69.610 69.610 67.923 1.687 18517 18617 1 16 . 1 1 43 43 THR H H 111 6.380 6.380 7.942 -1.562 18517 18618 1 16 . 1 1 44 44 ASP N N 112 119.750 119.750 123.130 -3.380 18517 18619 1 16 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.419 -0.559 18517 18620 1 16 . 1 1 44 44 ASP C C 112 178.850 178.850 178.394 0.456 18517 18621 1 16 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.782 0.448 18517 18622 1 16 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.230 -0.830 18517 18623 1 16 . 1 1 44 44 ASP H H 112 9.050 9.050 8.484 0.566 18517 18624 1 16 . 1 1 45 45 LEU N N 113 123.910 123.910 121.762 2.148 18517 18625 1 16 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.989 -0.179 18517 18626 1 16 . 1 1 45 45 LEU C C 113 182.040 182.040 178.228 3.812 18517 18627 1 16 . 1 1 45 45 LEU CA C 113 57.320 57.320 57.875 -0.555 18517 18628 1 16 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.803 -1.053 18517 18629 1 16 . 1 1 45 45 LEU H H 113 9.710 9.710 7.825 1.885 18517 18630 1 16 . 1 1 46 46 LEU N N 114 117.640 117.640 119.330 -1.690 18517 18631 1 16 . 1 1 46 46 LEU HA H 114 4.110 4.110 3.972 0.138 18517 18632 1 16 . 1 1 46 46 LEU C C 114 179.540 179.540 178.994 0.546 18517 18633 1 16 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.790 -0.230 18517 18634 1 16 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.663 -0.193 18517 18635 1 16 . 1 1 46 46 LEU H H 114 8.270 8.270 7.666 0.604 18517 18636 1 16 . 1 1 47 47 LEU N N 115 116.520 116.520 114.810 1.710 18517 18637 1 16 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.393 -0.253 18517 18638 1 16 . 1 1 47 47 LEU C C 115 173.850 173.850 176.391 -2.541 18517 18639 1 16 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.048 1.372 18517 18640 1 16 . 1 1 47 47 LEU CB C 115 44.720 44.720 40.771 3.949 18517 18641 1 16 . 1 1 47 47 LEU H H 115 8.160 8.160 8.162 -0.002 18517 18642 1 16 . 1 1 48 48 LYS N N 116 114.710 114.710 116.683 -1.973 18517 18643 1 16 . 1 1 48 48 LYS HA H 116 3.810 3.810 3.993 -0.183 18517 18644 1 16 . 1 1 48 48 LYS C C 116 176.510 176.510 175.828 0.682 18517 18645 1 16 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.852 0.348 18517 18646 1 16 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.640 -0.620 18517 18647 1 16 . 1 1 48 48 LYS H H 116 7.580 7.580 7.727 -0.147 18517 18648 1 16 . 1 1 49 49 VAL N N 117 119.050 119.050 119.459 -0.409 18517 18649 1 16 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.057 -0.447 18517 18650 1 16 . 1 1 49 49 VAL C C 117 175.860 175.860 176.003 -0.143 18517 18651 1 16 . 1 1 49 49 VAL CA C 117 63.510 63.510 61.890 1.620 18517 18652 1 16 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.528 -0.178 18517 18653 1 16 . 1 1 49 49 VAL H H 117 7.980 7.980 7.944 0.036 18517 18654 1 16 . 1 1 50 50 ASP N N 118 126.900 126.900 122.545 4.355 18517 18655 1 16 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.466 -0.216 18517 18656 1 16 . 1 1 50 50 ASP C C 118 177.700 177.700 177.180 0.520 18517 18657 1 16 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.305 0.745 18517 18658 1 16 . 1 1 50 50 ASP CB C 118 42.580 42.580 42.290 0.290 18517 18659 1 16 . 1 1 50 50 ASP H H 118 8.930 8.930 8.564 0.366 18517 18660 1 16 . 1 1 51 51 SER N N 119 124.790 124.790 121.669 3.121 18517 18661 1 16 . 1 1 51 51 SER HA H 119 4.070 4.070 4.186 -0.116 18517 18662 1 16 . 1 1 51 51 SER C C 119 177.220 177.220 176.005 1.215 18517 18663 1 16 . 1 1 51 51 SER CA C 119 61.640 61.640 61.748 -0.108 18517 18664 1 16 . 1 1 51 51 SER CB C 119 63.510 63.510 63.427 0.083 18517 18665 1 16 . 1 1 51 51 SER H H 119 8.560 8.560 8.867 -0.307 18517 18666 1 16 . 1 1 52 52 THR N N 120 119.880 119.880 118.472 1.408 18517 18667 1 16 . 1 1 52 52 THR HA H 120 4.190 4.190 4.174 0.016 18517 18668 1 16 . 1 1 52 52 THR C C 120 177.120 177.120 176.448 0.672 18517 18669 1 16 . 1 1 52 52 THR CA C 120 66.280 66.280 66.083 0.197 18517 18670 1 16 . 1 1 52 52 THR CB C 120 68.420 68.420 68.809 -0.389 18517 18671 1 16 . 1 1 52 52 THR H H 120 8.310 8.310 8.340 -0.030 18517 18672 1 16 . 1 1 53 53 LYS N N 121 122.270 122.270 122.590 -0.320 18517 18673 1 16 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.203 -0.083 18517 18674 1 16 . 1 1 53 53 LYS C C 121 178.970 178.970 179.070 -0.100 18517 18675 1 16 . 1 1 53 53 LYS CA C 121 59.580 59.580 58.929 0.651 18517 18676 1 16 . 1 1 53 53 LYS CB C 121 34.250 34.250 32.037 2.213 18517 18677 1 16 . 1 1 53 53 LYS H H 121 7.700 7.700 8.614 -0.914 18517 18678 1 16 . 1 1 54 54 VAL N N 122 120.070 120.070 116.725 3.345 18517 18679 1 16 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.953 -0.523 18517 18680 1 16 . 1 1 54 54 VAL C C 122 179.860 179.860 177.918 1.942 18517 18681 1 16 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.615 2.965 18517 18682 1 16 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.297 1.523 18517 18683 1 16 . 1 1 54 54 VAL H H 122 7.890 7.890 8.087 -0.197 18517 18684 1 16 . 1 1 55 55 ASP N N 123 122.270 122.270 120.186 2.084 18517 18685 1 16 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.313 0.157 18517 18686 1 16 . 1 1 55 55 ASP C C 123 178.630 178.630 178.493 0.137 18517 18687 1 16 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.859 -0.059 18517 18688 1 16 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.930 1.090 18517 18689 1 16 . 1 1 55 55 ASP H H 123 8.270 8.270 8.030 0.240 18517 18690 1 16 . 1 1 56 56 GLU N N 124 119.600 119.600 119.059 0.541 18517 18691 1 16 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.069 -0.099 18517 18692 1 16 . 1 1 56 56 GLU C C 124 179.920 179.920 179.210 0.710 18517 18693 1 16 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.175 0.885 18517 18694 1 16 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.507 0.463 18517 18695 1 16 . 1 1 56 56 GLU H H 124 8.610 8.610 8.205 0.405 18517 18696 1 16 . 1 1 57 57 ALA N N 125 120.070 120.070 122.093 -2.023 18517 18697 1 16 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.153 -0.323 18517 18698 1 16 . 1 1 57 57 ALA C C 125 178.760 178.760 179.597 -0.837 18517 18699 1 16 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.956 0.424 18517 18700 1 16 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.521 1.619 18517 18701 1 16 . 1 1 57 57 ALA H H 125 8.420 8.420 8.352 0.068 18517 18702 1 16 . 1 1 58 58 GLY N N 126 106.740 106.740 105.995 0.745 18517 18703 1 16 . 1 1 58 58 GLY C C 126 175.740 175.740 175.968 -0.228 18517 18704 1 16 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.685 0.605 18517 18705 1 16 . 1 1 58 58 GLY H H 126 8.200 8.200 8.811 -0.611 18517 18706 1 16 . 1 1 59 59 LYS N N 127 120.920 120.920 121.756 -0.836 18517 18707 1 16 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.058 -0.128 18517 18708 1 16 . 1 1 59 59 LYS C C 127 180.320 180.320 178.593 1.727 18517 18709 1 16 . 1 1 59 59 LYS CA C 127 60.210 60.210 58.983 1.226 18517 18710 1 16 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.336 0.644 18517 18711 1 16 . 1 1 59 59 LYS H H 127 8.000 8.000 8.016 -0.016 18517 18712 1 16 . 1 1 60 60 LYS N N 128 118.400 118.400 119.464 -1.064 18517 18713 1 16 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.174 -0.004 18517 18714 1 16 . 1 1 60 60 LYS C C 128 180.030 180.030 179.051 0.979 18517 18715 1 16 . 1 1 60 60 LYS CA C 128 58.750 58.750 58.722 0.028 18517 18716 1 16 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.100 0.170 18517 18717 1 16 . 1 1 60 60 LYS H H 128 7.170 7.170 7.826 -0.656 18517 18718 1 16 . 1 1 61 61 VAL N N 129 121.050 121.050 120.542 0.508 18517 18719 1 16 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.487 -0.207 18517 18720 1 16 . 1 1 61 61 VAL C C 129 177.120 177.120 177.659 -0.539 18517 18721 1 16 . 1 1 61 61 VAL CA C 129 67.350 67.350 67.201 0.149 18517 18722 1 16 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.345 0.285 18517 18723 1 16 . 1 1 61 61 VAL H H 129 7.980 7.980 8.099 -0.119 18517 18724 1 16 . 1 1 62 62 LYS N N 130 120.040 120.040 120.132 -0.092 18517 18725 1 16 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.911 -0.211 18517 18726 1 16 . 1 1 62 62 LYS C C 130 178.550 178.550 178.617 -0.067 18517 18727 1 16 . 1 1 62 62 LYS CA C 130 60.330 60.330 60.024 0.306 18517 18728 1 16 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.273 1.497 18517 18729 1 16 . 1 1 62 62 LYS H H 130 8.910 8.910 8.489 0.421 18517 18730 1 16 . 1 1 63 63 ALA N N 131 119.570 119.570 121.966 -2.396 18517 18731 1 16 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.052 0.168 18517 18732 1 16 . 1 1 63 63 ALA C C 131 180.520 180.520 179.511 1.009 18517 18733 1 16 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.096 0.124 18517 18734 1 16 . 1 1 63 63 ALA CB C 131 18.470 18.470 17.862 0.608 18517 18735 1 16 . 1 1 63 63 ALA H H 131 7.920 7.920 8.145 -0.225 18517 18736 1 16 . 1 1 64 64 TYR N N 132 120.510 120.510 120.376 0.134 18517 18737 1 16 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.148 0.312 18517 18738 1 16 . 1 1 64 64 TYR C C 132 176.510 176.510 177.850 -1.340 18517 18739 1 16 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.730 -0.090 18517 18740 1 16 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.652 0.038 18517 18741 1 16 . 1 1 64 64 TYR H H 132 7.930 7.930 8.172 -0.242 18517 18742 1 16 . 1 1 65 65 LEU N N 133 117.290 117.290 119.877 -2.587 18517 18743 1 16 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.615 0.225 18517 18744 1 16 . 1 1 65 65 LEU C C 133 178.610 178.610 178.916 -0.306 18517 18745 1 16 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.321 -0.601 18517 18746 1 16 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.867 -1.437 18517 18747 1 16 . 1 1 65 65 LEU H H 133 8.240 8.240 8.744 -0.504 18517 18748 1 16 . 1 1 66 66 GLU N N 134 119.140 119.140 117.528 1.612 18517 18749 1 16 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.252 -0.392 18517 18750 1 16 . 1 1 66 66 GLU C C 134 180.200 180.200 179.120 1.080 18517 18751 1 16 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.689 1.251 18517 18752 1 16 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.409 0.401 18517 18753 1 16 . 1 1 66 66 GLU H H 134 8.370 8.370 8.460 -0.090 18517 18754 1 16 . 1 1 67 67 LYS N N 135 121.390 121.390 120.012 1.378 18517 18755 1 16 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.029 -0.029 18517 18756 1 16 . 1 1 67 67 LYS C C 135 179.080 179.080 178.706 0.374 18517 18757 1 16 . 1 1 67 67 LYS CA C 135 59.620 59.620 59.059 0.561 18517 18758 1 16 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.465 -0.195 18517 18759 1 16 . 1 1 67 67 LYS H H 135 7.820 7.820 7.790 0.030 18517 18760 1 16 . 1 1 68 68 ILE N N 136 110.310 110.310 113.282 -2.972 18517 18761 1 16 . 1 1 68 68 ILE HA H 136 4.300 4.300 3.993 0.307 18517 18762 1 16 . 1 1 68 68 ILE C C 136 175.520 175.520 176.847 -1.327 18517 18763 1 16 . 1 1 68 68 ILE CA C 136 62.430 62.430 62.199 0.231 18517 18764 1 16 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.531 -0.551 18517 18765 1 16 . 1 1 68 68 ILE H H 136 7.380 7.380 7.532 -0.152 18517 18766 1 16 . 1 1 69 69 GLY N N 137 106.680 106.680 107.935 -1.255 18517 18767 1 16 . 1 1 69 69 GLY C C 137 174.160 174.160 173.637 0.523 18517 18768 1 16 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.468 1.002 18517 18769 1 16 . 1 1 69 69 GLY H H 137 7.470 7.470 7.824 -0.354 18517 18770 1 16 . 1 1 70 70 ILE N N 138 124.310 124.310 122.530 1.780 18517 18771 1 16 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.268 -0.068 18517 18772 1 16 . 1 1 70 70 ILE C C 138 174.190 174.190 175.127 -0.937 18517 18773 1 16 . 1 1 70 70 ILE CA C 138 59.380 59.380 59.417 -0.037 18517 18774 1 16 . 1 1 70 70 ILE CB C 138 37.340 37.340 39.211 -1.871 18517 18775 1 16 . 1 1 70 70 ILE H H 138 8.530 8.530 8.265 0.265 18517 18776 1 16 . 1 1 71 71 ARG N N 139 125.490 125.490 127.100 -1.610 18517 18777 1 16 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.453 0.167 18517 18778 1 16 . 1 1 71 71 ARG C C 139 175.750 175.750 174.980 0.770 18517 18779 1 16 . 1 1 71 71 ARG CA C 139 54.660 54.660 54.835 -0.175 18517 18780 1 16 . 1 1 71 71 ARG CB C 139 33.140 33.140 30.762 2.378 18517 18781 1 16 . 1 1 71 71 ARG H H 139 8.240 8.240 8.518 -0.278 18517 18782 1 16 . 1 1 72 72 GLY N N 140 104.750 104.750 111.231 -6.481 18517 18783 1 16 . 1 1 72 72 GLY C C 140 172.920 172.920 173.290 -0.370 18517 18784 1 16 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.278 1.152 18517 18785 1 16 . 1 1 72 72 GLY H H 140 7.900 7.900 8.437 -0.537 18517 18786 1 16 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.505 0.005 18517 18787 1 16 . 1 1 73 73 ASP C C 141 175.060 175.060 175.379 -0.319 18517 18788 1 16 . 1 1 73 73 ASP CA C 141 56.170 56.170 55.700 0.470 18517 18789 1 16 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.463 -0.633 18517 18790 1 16 . 1 1 74 74 SER N N 142 110.240 110.240 111.523 -1.283 18517 18791 1 16 . 1 1 74 74 SER HA H 142 4.740 4.740 4.680 0.060 18517 18792 1 16 . 1 1 74 74 SER C C 142 175.110 175.110 174.242 0.868 18517 18793 1 16 . 1 1 74 74 SER CA C 142 55.700 55.700 57.410 -1.710 18517 18794 1 16 . 1 1 74 74 SER CB C 142 67.390 67.390 66.386 1.004 18517 18795 1 16 . 1 1 74 74 SER H H 142 7.560 7.560 7.525 0.035 18517 18796 1 16 . 1 1 75 75 VAL N N 143 122.950 122.950 120.135 2.815 18517 18797 1 16 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.860 -0.130 18517 18798 1 16 . 1 1 75 75 VAL C C 143 176.230 176.230 177.432 -1.202 18517 18799 1 16 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.567 1.073 18517 18800 1 16 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.568 -0.328 18517 18801 1 16 . 1 1 75 75 VAL H H 143 9.470 9.470 8.791 0.679 18517 18802 1 16 . 1 1 76 76 GLU N N 144 121.390 121.390 120.462 0.928 18517 18803 1 16 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.055 -0.415 18517 18804 1 16 . 1 1 76 76 GLU C C 144 176.880 176.880 178.339 -1.459 18517 18805 1 16 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.202 4.108 18517 18806 1 16 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.275 -0.205 18517 18807 1 16 . 1 1 76 76 GLU H H 144 9.640 9.640 8.951 0.689 18517 18808 1 16 . 1 1 77 77 ALA N N 145 118.770 118.770 122.257 -3.487 18517 18809 1 16 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.580 -0.320 18517 18810 1 16 . 1 1 77 77 ALA C C 145 180.350 180.350 179.543 0.807 18517 18811 1 16 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.116 0.664 18517 18812 1 16 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.272 0.918 18517 18813 1 16 . 1 1 77 77 ALA H H 145 7.860 7.860 8.262 -0.402 18517 18814 1 16 . 1 1 78 78 ALA N N 146 120.920 120.920 123.377 -2.457 18517 18815 1 16 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.100 0.040 18517 18816 1 16 . 1 1 78 78 ALA C C 146 179.150 179.150 179.149 0.001 18517 18817 1 16 . 1 1 78 78 ALA CA C 146 55.260 55.260 55.008 0.252 18517 18818 1 16 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.769 0.021 18517 18819 1 16 . 1 1 78 78 ALA H H 146 8.110 8.110 8.037 0.073 18517 18820 1 16 . 1 1 79 79 LEU N N 147 118.810 118.810 116.244 2.566 18517 18821 1 16 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.038 -0.158 18517 18822 1 16 . 1 1 79 79 LEU C C 147 179.080 179.080 178.613 0.467 18517 18823 1 16 . 1 1 79 79 LEU CA C 147 58.390 58.390 58.054 0.336 18517 18824 1 16 . 1 1 79 79 LEU CB C 147 42.260 42.260 40.699 1.562 18517 18825 1 16 . 1 1 79 79 LEU H H 147 8.360 8.360 8.069 0.291 18517 18826 1 16 . 1 1 80 80 ASP N N 148 121.620 121.620 120.704 0.916 18517 18827 1 16 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.217 0.303 18517 18828 1 16 . 1 1 80 80 ASP C C 148 178.800 178.800 178.360 0.440 18517 18829 1 16 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.185 0.204 18517 18830 1 16 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.323 0.427 18517 18831 1 16 . 1 1 80 80 ASP H H 148 8.770 8.770 8.445 0.325 18517 18832 1 16 . 1 1 81 81 ASN N N 149 118.630 118.630 119.104 -0.474 18517 18833 1 16 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.456 0.114 18517 18834 1 16 . 1 1 81 81 ASN C C 149 177.970 177.970 177.801 0.169 18517 18835 1 16 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.190 -0.180 18517 18836 1 16 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.393 0.217 18517 18837 1 16 . 1 1 81 81 ASN H H 149 7.960 7.960 7.920 0.040 18517 18838 1 16 . 1 1 82 82 LEU N N 150 120.030 120.030 120.429 -0.399 18517 18839 1 16 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.858 0.202 18517 18840 1 16 . 1 1 82 82 LEU C C 150 177.790 177.790 179.050 -1.260 18517 18841 1 16 . 1 1 82 82 LEU CA C 150 58.870 58.870 57.952 0.918 18517 18842 1 16 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.784 0.076 18517 18843 1 16 . 1 1 82 82 LEU H H 150 8.230 8.230 8.319 -0.089 18517 18844 1 16 . 1 1 83 83 MET N N 151 115.820 115.820 118.570 -2.750 18517 18845 1 16 . 1 1 83 83 MET HA H 151 4.390 4.390 3.852 0.538 18517 18846 1 16 . 1 1 83 83 MET C C 151 179.760 179.760 178.469 1.291 18517 18847 1 16 . 1 1 83 83 MET CA C 151 57.400 57.400 58.757 -1.357 18517 18848 1 16 . 1 1 83 83 MET CB C 151 31.080 31.080 31.994 -0.914 18517 18849 1 16 . 1 1 83 83 MET H H 151 8.800 8.800 8.336 0.464 18517 18850 1 16 . 1 1 84 84 ILE N N 152 120.330 120.330 120.011 0.319 18517 18851 1 16 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.651 0.189 18517 18852 1 16 . 1 1 84 84 ILE C C 152 178.660 178.660 178.116 0.544 18517 18853 1 16 . 1 1 84 84 ILE CA C 152 65.800 65.800 65.630 0.170 18517 18854 1 16 . 1 1 84 84 ILE CB C 152 38.450 38.450 37.303 1.147 18517 18855 1 16 . 1 1 84 84 ILE H H 152 8.540 8.540 8.607 -0.067 18517 18856 1 16 . 1 1 85 85 LYS N N 153 118.930 118.930 119.404 -0.474 18517 18857 1 16 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.119 0.081 18517 18858 1 16 . 1 1 85 85 LYS C C 153 179.650 179.650 179.527 0.123 18517 18859 1 16 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.519 1.461 18517 18860 1 16 . 1 1 85 85 LYS CB C 153 33.540 33.540 31.799 1.741 18517 18861 1 16 . 1 1 85 85 LYS H H 153 7.510 7.510 7.963 -0.453 18517 18862 1 16 . 1 1 86 86 VAL N N 154 119.810 119.810 120.542 -0.732 18517 18863 1 16 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.685 -0.055 18517 18864 1 16 . 1 1 86 86 VAL C C 154 178.350 178.350 178.253 0.097 18517 18865 1 16 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.513 0.718 18517 18866 1 16 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.494 1.246 18517 18867 1 16 . 1 1 86 86 VAL H H 154 8.740 8.740 8.107 0.633 18517 18868 1 16 . 1 1 87 87 TYR N N 155 118.370 118.370 118.816 -0.446 18517 18869 1 16 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.181 0.089 18517 18870 1 16 . 1 1 87 87 TYR C C 155 178.580 178.580 178.346 0.234 18517 18871 1 16 . 1 1 87 87 TYR CA C 155 62.910 62.910 60.499 2.411 18517 18872 1 16 . 1 1 87 87 TYR CB C 155 37.980 37.980 36.987 0.993 18517 18873 1 16 . 1 1 87 87 TYR H H 155 8.520 8.520 8.285 0.235 18517 18874 1 16 . 1 1 88 88 GLU N N 156 119.900 119.900 120.031 -0.131 18517 18875 1 16 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.026 0.154 18517 18876 1 16 . 1 1 88 88 GLU C C 156 179.270 179.270 179.119 0.151 18517 18877 1 16 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.637 -0.257 18517 18878 1 16 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.440 0.770 18517 18879 1 16 . 1 1 88 88 GLU H H 156 8.250 8.250 8.729 -0.479 18517 18880 1 16 . 1 1 89 89 ILE N N 157 119.510 119.510 119.443 0.067 18517 18881 1 16 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.928 0.152 18517 18882 1 16 . 1 1 89 89 ILE C C 157 177.890 177.890 178.300 -0.410 18517 18883 1 16 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.195 0.115 18517 18884 1 16 . 1 1 89 89 ILE CB C 157 38.210 38.210 36.972 1.238 18517 18885 1 16 . 1 1 89 89 ILE H H 157 7.630 7.630 7.835 -0.205 18517 18886 1 16 . 1 1 90 90 THR N N 158 114.240 114.240 115.576 -1.336 18517 18887 1 16 . 1 1 90 90 THR HA H 158 4.130 4.130 4.067 0.063 18517 18888 1 16 . 1 1 90 90 THR C C 158 175.530 175.530 176.467 -0.937 18517 18889 1 16 . 1 1 90 90 THR CA C 158 64.460 64.460 65.670 -1.210 18517 18890 1 16 . 1 1 90 90 THR CB C 158 69.610 69.610 68.976 0.634 18517 18891 1 16 . 1 1 90 90 THR H H 158 7.770 7.770 8.300 -0.530 18517 18892 1 16 . 1 1 91 91 LYS N N 159 120.280 120.280 117.525 2.755 18517 18893 1 16 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.429 -0.119 18517 18894 1 16 . 1 1 91 91 LYS C C 159 177.420 177.420 177.280 0.140 18517 18895 1 16 . 1 1 91 91 LYS CA C 159 57.400 57.400 55.919 1.482 18517 18896 1 16 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.646 -0.426 18517 18897 1 16 . 1 1 91 91 LYS H H 159 7.890 7.890 8.249 -0.359 18517 18898 1 16 . 1 1 92 92 GLY N N 160 107.910 107.910 108.321 -0.411 18517 18899 1 16 . 1 1 92 92 GLY C C 160 174.430 174.430 173.581 0.849 18517 18900 1 16 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.262 0.718 18517 18901 1 16 . 1 1 92 92 GLY H H 160 7.930 7.930 8.173 -0.243 18517 18902 1 16 . 1 1 93 93 THR N N 161 113.570 113.570 113.054 0.516 18517 18903 1 16 . 1 1 93 93 THR HA H 161 4.390 4.390 4.497 -0.107 18517 18904 1 16 . 1 1 93 93 THR C C 161 174.790 174.790 172.323 2.467 18517 18905 1 16 . 1 1 93 93 THR CA C 161 61.960 61.960 60.496 1.464 18517 18906 1 16 . 1 1 93 93 THR CB C 161 70.010 70.010 70.181 -0.171 18517 18907 1 16 . 1 1 93 93 THR H H 161 7.970 7.970 7.548 0.422 18517 18908 1 16 . 1 1 94 94 VAL N N 162 121.980 121.980 124.402 -2.422 18517 18909 1 16 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.391 -0.271 18517 18910 1 16 . 1 1 94 94 VAL C C 162 176.300 176.300 175.508 0.792 18517 18911 1 16 . 1 1 94 94 VAL CA C 162 62.830 62.830 59.931 2.899 18517 18912 1 16 . 1 1 94 94 VAL CB C 162 33.060 33.060 35.364 -2.304 18517 18913 1 16 . 1 1 94 94 VAL H H 162 8.130 8.130 8.464 -0.334 18517 18914 1 16 . 1 1 95 95 GLU N N 163 124.140 124.140 123.257 0.883 18517 18915 1 16 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.298 0.012 18517 18916 1 16 . 1 1 95 95 GLU C C 163 176.870 176.870 176.627 0.243 18517 18917 1 16 . 1 1 95 95 GLU CA C 163 57.080 57.080 57.901 -0.821 18517 18918 1 16 . 1 1 95 95 GLU CB C 163 30.440 30.440 30.020 0.419 18517 18919 1 16 . 1 1 95 95 GLU H H 163 8.490 8.490 8.433 0.057 18517 18920 1 16 . 1 1 96 96 SER N N 164 116.800 116.800 112.929 3.871 18517 18921 1 16 . 1 1 96 96 SER HA H 164 4.430 4.430 4.595 -0.165 18517 18922 1 16 . 1 1 96 96 SER C C 164 174.940 174.940 172.895 2.045 18517 18923 1 16 . 1 1 96 96 SER CA C 164 59.070 59.070 58.223 0.847 18517 18924 1 16 . 1 1 96 96 SER CB C 164 64.220 64.220 63.503 0.717 18517 18925 1 16 . 1 1 96 96 SER H H 164 8.300 8.300 7.922 0.378 18517 18926 1 16 . 1 1 97 97 SER C C 165 174.660 174.660 173.575 1.085 18517 18927 1 16 . 1 1 97 97 SER CA C 165 58.870 58.870 58.735 0.135 18517 18928 1 16 . 1 1 97 97 SER CB C 165 64.060 64.060 63.008 1.052 18517 18929 1 16 . 1 1 98 98 ALA N N 166 125.490 125.490 123.832 1.658 18517 18930 1 16 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.006 0.344 18517 18931 1 16 . 1 1 98 98 ALA C C 166 177.780 177.780 175.481 2.299 18517 18932 1 16 . 1 1 98 98 ALA CA C 166 53.000 53.000 53.315 -0.315 18517 18933 1 16 . 1 1 98 98 ALA CB C 166 19.340 19.340 17.325 2.015 18517 18934 1 16 . 1 1 98 98 ALA H H 166 8.180 8.180 7.771 0.409 18517 18935 1 16 . 1 1 99 99 GLN N N 167 118.690 118.690 121.564 -2.874 18517 18936 1 16 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.520 -0.180 18517 18937 1 16 . 1 1 99 99 GLN C C 167 176.680 176.680 175.257 1.423 18517 18938 1 16 . 1 1 99 99 GLN CA C 167 56.250 56.250 55.400 0.850 18517 18939 1 16 . 1 1 99 99 GLN CB C 167 29.650 29.650 30.608 -0.958 18517 18940 1 16 . 1 1 99 99 GLN H H 167 8.170 8.170 8.295 -0.125 18517 18941 1 16 . 1 1 100 100 GLY N N 168 109.670 109.670 108.767 0.903 18517 18942 1 16 . 1 1 100 100 GLY C C 168 174.460 174.460 172.720 1.740 18517 18943 1 16 . 1 1 100 100 GLY CA C 168 45.670 45.670 45.377 0.293 18517 18944 1 16 . 1 1 100 100 GLY H H 168 8.250 8.250 8.325 -0.075 18517 18945 1 16 . 1 1 101 101 THR N N 169 112.660 112.660 115.151 -2.491 18517 18946 1 16 . 1 1 101 101 THR HA H 169 4.360 4.360 4.480 -0.120 18517 18947 1 16 . 1 1 101 101 THR C C 169 174.720 174.720 173.285 1.435 18517 18948 1 16 . 1 1 101 101 THR CA C 169 62.080 62.080 60.795 1.285 18517 18949 1 16 . 1 1 101 101 THR CB C 169 69.930 69.930 69.826 0.104 18517 18950 1 16 . 1 1 101 101 THR H H 169 8.070 8.070 8.262 -0.192 18517 18951 1 16 . 1 1 102 102 ASP N N 170 123.090 123.090 123.161 -0.071 18517 18952 1 16 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.864 -0.164 18517 18953 1 16 . 1 1 102 102 ASP C C 170 176.130 176.130 175.053 1.077 18517 18954 1 16 . 1 1 102 102 ASP CA C 170 54.780 54.780 52.589 2.191 18517 18955 1 16 . 1 1 102 102 ASP CB C 170 42.260 42.260 43.693 -1.433 18517 18956 1 16 . 1 1 102 102 ASP H H 170 8.170 8.170 8.193 -0.023 18517 18957 1 16 . 1 1 103 103 SER N N 171 117.110 117.110 114.734 2.376 18517 18958 1 16 . 1 1 103 103 SER HA H 171 4.430 4.430 4.617 -0.187 18517 18959 1 16 . 1 1 103 103 SER C C 171 174.770 174.770 175.241 -0.471 18517 18960 1 16 . 1 1 103 103 SER CA C 171 57.960 57.960 57.828 0.132 18517 18961 1 16 . 1 1 103 103 SER CB C 171 64.940 64.940 64.843 0.097 18517 18962 1 16 . 1 1 103 103 SER H H 171 8.450 8.450 8.450 -0.000 18517 18963 1 16 . 1 1 104 104 GLU N N 172 122.970 122.970 122.636 0.334 18517 18964 1 16 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.967 0.063 18517 18965 1 16 . 1 1 104 104 GLU C C 172 178.860 178.860 178.651 0.209 18517 18966 1 16 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.339 -0.639 18517 18967 1 16 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.596 0.054 18517 18968 1 16 . 1 1 104 104 GLU H H 172 8.830 8.830 9.046 -0.216 18517 18969 1 16 . 1 1 105 105 GLU N N 173 119.750 119.750 117.754 1.996 18517 18970 1 16 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.048 -0.068 18517 18971 1 16 . 1 1 105 105 GLU C C 173 178.920 178.920 178.750 0.170 18517 18972 1 16 . 1 1 105 105 GLU CA C 173 60.060 60.060 59.146 0.914 18517 18973 1 16 . 1 1 105 105 GLU CB C 173 29.730 29.730 29.115 0.615 18517 18974 1 16 . 1 1 105 105 GLU H H 173 8.580 8.580 8.808 -0.228 18517 18975 1 16 . 1 1 106 106 LEU N N 174 121.860 121.860 120.392 1.468 18517 18976 1 16 . 1 1 106 106 LEU HA H 174 4.180 4.180 3.902 0.278 18517 18977 1 16 . 1 1 106 106 LEU C C 174 178.210 178.210 178.722 -0.512 18517 18978 1 16 . 1 1 106 106 LEU CA C 174 57.880 57.880 58.041 -0.161 18517 18979 1 16 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.409 -0.259 18517 18980 1 16 . 1 1 106 106 LEU H H 174 7.920 7.920 7.343 0.577 18517 18981 1 16 . 1 1 107 107 LYS N N 175 118.740 118.740 119.744 -1.004 18517 18982 1 16 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.989 -0.209 18517 18983 1 16 . 1 1 107 107 LYS C C 175 178.700 178.700 179.607 -0.907 18517 18984 1 16 . 1 1 107 107 LYS CA C 175 61.170 61.170 60.010 1.160 18517 18985 1 16 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.155 0.275 18517 18986 1 16 . 1 1 107 107 LYS H H 175 8.340 8.340 8.445 -0.105 18517 18987 1 16 . 1 1 108 108 THR N N 176 113.820 113.820 116.778 -2.958 18517 18988 1 16 . 1 1 108 108 THR HA H 176 3.840 3.840 3.988 -0.148 18517 18989 1 16 . 1 1 108 108 THR C C 176 176.620 176.620 176.695 -0.075 18517 18990 1 16 . 1 1 108 108 THR CA C 176 66.910 66.910 66.422 0.488 18517 18991 1 16 . 1 1 108 108 THR CB C 176 69.610 69.610 68.829 0.782 18517 18992 1 16 . 1 1 108 108 THR H H 176 7.950 7.950 8.287 -0.337 18517 18993 1 16 . 1 1 109 109 LEU N N 177 124.380 124.380 122.725 1.655 18517 18994 1 16 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.250 -0.420 18517 18995 1 16 . 1 1 109 109 LEU C C 177 177.790 177.790 177.724 0.066 18517 18996 1 16 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.369 0.621 18517 18997 1 16 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.630 0.950 18517 18998 1 16 . 1 1 109 109 LEU H H 177 7.480 7.480 7.987 -0.507 18517 18999 1 16 . 1 1 110 110 LEU N N 178 117.230 117.230 120.101 -2.871 18517 19000 1 16 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.757 0.083 18517 19001 1 16 . 1 1 110 110 LEU C C 178 179.540 179.540 179.332 0.208 18517 19002 1 16 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.998 0.392 18517 19003 1 16 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.243 1.097 18517 19004 1 16 . 1 1 110 110 LEU H H 178 8.670 8.670 8.359 0.311 18517 19005 1 16 . 1 1 111 111 LEU N N 179 119.230 119.230 121.476 -2.246 18517 19006 1 16 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.215 -0.135 18517 19007 1 16 . 1 1 111 111 LEU C C 179 179.310 179.310 179.417 -0.107 18517 19008 1 16 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.691 0.699 18517 19009 1 16 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.683 1.337 18517 19010 1 16 . 1 1 111 111 LEU H H 179 7.940 7.940 8.669 -0.729 18517 19011 1 16 . 1 1 112 112 LYS N N 180 121.910 121.910 120.543 1.367 18517 19012 1 16 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.106 0.084 18517 19013 1 16 . 1 1 112 112 LYS C C 180 178.740 178.740 179.606 -0.866 18517 19014 1 16 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.322 -0.141 18517 19015 1 16 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.112 -0.242 18517 19016 1 16 . 1 1 112 112 LYS H H 180 7.420 7.420 7.918 -0.498 18517 19017 1 16 . 1 1 113 113 PHE N N 181 118.220 118.220 119.992 -1.772 18517 19018 1 16 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.219 0.531 18517 19019 1 16 . 1 1 113 113 PHE C C 181 178.520 178.520 177.985 0.535 18517 19020 1 16 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.920 -3.840 18517 19021 1 16 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.479 -0.499 18517 19022 1 16 . 1 1 113 113 PHE H H 181 9.000 9.000 8.785 0.215 18517 19023 1 16 . 1 1 114 114 SER N N 182 113.300 113.300 114.673 -1.373 18517 19024 1 16 . 1 1 114 114 SER HA H 182 3.930 3.930 4.132 -0.202 18517 19025 1 16 . 1 1 114 114 SER C C 182 177.080 177.080 176.785 0.295 18517 19026 1 16 . 1 1 114 114 SER CA C 182 62.000 62.000 62.245 -0.245 18517 19027 1 16 . 1 1 114 114 SER CB C 182 63.510 63.510 62.971 0.539 18517 19028 1 16 . 1 1 114 114 SER H H 182 8.620 8.620 8.684 -0.064 18517 19029 1 16 . 1 1 115 115 GLU N N 183 121.540 121.540 122.355 -0.815 18517 19030 1 16 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.114 -0.044 18517 19031 1 16 . 1 1 115 115 GLU C C 183 179.860 179.860 178.389 1.471 18517 19032 1 16 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.169 0.611 18517 19033 1 16 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.368 0.522 18517 19034 1 16 . 1 1 115 115 GLU H H 183 8.250 8.250 8.595 -0.345 18517 19035 1 16 . 1 1 116 116 ASP N N 184 121.740 121.740 120.624 1.116 18517 19036 1 16 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.371 0.139 18517 19037 1 16 . 1 1 116 116 ASP C C 184 179.570 179.570 178.483 1.087 18517 19038 1 16 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.396 0.164 18517 19039 1 16 . 1 1 116 116 ASP CB C 184 40.990 40.990 41.276 -0.286 18517 19040 1 16 . 1 1 116 116 ASP H H 184 8.840 8.840 8.377 0.463 18517 19041 1 16 . 1 1 117 117 LEU N N 185 121.420 121.420 121.391 0.029 18517 19042 1 16 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.077 0.053 18517 19043 1 16 . 1 1 117 117 LEU C C 185 178.840 178.840 178.664 0.176 18517 19044 1 16 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.123 0.107 18517 19045 1 16 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.602 1.048 18517 19046 1 16 . 1 1 117 117 LEU H H 185 8.350 8.350 8.293 0.057 18517 19047 1 16 . 1 1 118 118 LYS N N 186 119.640 119.640 119.496 0.144 18517 19048 1 16 . 1 1 118 118 LYS HA H 186 4.120 4.120 4.285 -0.165 18517 19049 1 16 . 1 1 118 118 LYS C C 186 178.820 178.820 178.916 -0.096 18517 19050 1 16 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.511 0.229 18517 19051 1 16 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.417 0.093 18517 19052 1 16 . 1 1 118 118 LYS H H 186 8.220 8.220 8.354 -0.134 18517 19053 1 16 . 1 1 119 119 ALA N N 187 120.160 120.160 122.045 -1.885 18517 19054 1 16 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.023 0.137 18517 19055 1 16 . 1 1 119 119 ALA C C 187 180.450 180.450 179.365 1.085 18517 19056 1 16 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.439 -0.299 18517 19057 1 16 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.307 0.163 18517 19058 1 16 . 1 1 119 119 ALA H H 187 8.010 8.010 8.228 -0.218 18517 19059 1 16 . 1 1 120 120 GLU N N 188 117.930 117.930 118.857 -0.927 18517 19060 1 16 . 1 1 120 120 GLU HA H 188 4.180 4.180 3.934 0.246 18517 19061 1 16 . 1 1 120 120 GLU C C 188 178.780 178.780 178.355 0.425 18517 19062 1 16 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.094 -0.264 18517 19063 1 16 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.342 0.628 18517 19064 1 16 . 1 1 120 120 GLU H H 188 7.640 7.640 8.497 -0.857 18517 19065 1 16 . 1 1 121 121 GLN N N 189 117.230 117.230 119.767 -2.537 18517 19066 1 16 . 1 1 121 121 GLN HA H 189 4.230 4.230 3.509 0.721 18517 19067 1 16 . 1 1 121 121 GLN C C 189 179.190 179.190 178.275 0.915 18517 19068 1 16 . 1 1 121 121 GLN CA C 189 59.740 59.740 59.217 0.523 18517 19069 1 16 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.758 0.892 18517 19070 1 16 . 1 1 121 121 GLN H H 189 8.280 8.280 8.045 0.235 18517 19071 1 16 . 1 1 122 122 GLU N N 190 118.340 118.340 119.859 -1.519 18517 19072 1 16 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.991 0.129 18517 19073 1 16 . 1 1 122 122 GLU C C 190 178.210 178.210 178.948 -0.738 18517 19074 1 16 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.903 -0.153 18517 19075 1 16 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.283 0.687 18517 19076 1 16 . 1 1 122 122 GLU H H 190 8.250 8.250 8.092 0.158 18517 19077 1 16 . 1 1 123 123 LEU N N 191 118.930 118.930 122.486 -3.556 18517 19078 1 16 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.876 0.214 18517 19079 1 16 . 1 1 123 123 LEU C C 191 178.500 178.500 178.420 0.080 18517 19080 1 16 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.215 -1.215 18517 19081 1 16 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.717 0.783 18517 19082 1 16 . 1 1 123 123 LEU H H 191 7.530 7.530 8.265 -0.735 18517 19083 1 16 . 1 1 124 124 HIS N N 192 115.650 115.650 117.547 -1.897 18517 19084 1 16 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.186 0.534 18517 19085 1 16 . 1 1 124 124 HIS C C 192 176.090 176.090 177.661 -1.571 18517 19086 1 16 . 1 1 124 124 HIS CA C 192 56.690 56.690 59.637 -2.947 18517 19087 1 16 . 1 1 124 124 HIS CB C 192 30.760 30.760 29.771 0.989 18517 19088 1 16 . 1 1 124 124 HIS H H 192 7.450 7.450 8.533 -1.083 18517 19089 1 16 . 1 1 125 125 SER N N 193 115.480 115.480 115.266 0.214 18517 19090 1 16 . 1 1 125 125 SER HA H 193 4.310 4.310 4.364 -0.055 18517 19091 1 16 . 1 1 125 125 SER CA C 193 60.180 60.180 62.479 -2.299 18517 19092 1 16 . 1 1 125 125 SER CB C 193 64.060 64.060 63.174 0.886 18517 19093 1 16 . 1 1 125 125 SER H H 193 8.020 8.020 8.169 -0.149 18517 19094 1 16 . 1 1 126 126 GLU C C 194 177.410 177.410 179.155 -1.745 18517 19095 1 16 . 1 1 126 126 GLU CA C 194 57.840 57.840 58.559 -0.719 18517 19096 1 16 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.875 0.015 18517 19097 1 16 . 1 1 127 127 ALA N N 195 122.910 122.910 123.192 -0.282 18517 19098 1 16 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.082 0.108 18517 19099 1 16 . 1 1 127 127 ALA C C 195 178.610 178.610 179.183 -0.573 18517 19100 1 16 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.993 -1.203 18517 19101 1 16 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.747 0.513 18517 19102 1 16 . 1 1 127 127 ALA H H 195 8.020 8.020 8.371 -0.351 18517 19103 1 16 . 1 1 128 128 LYS N N 196 117.770 117.770 117.442 0.328 18517 19104 1 16 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.358 -0.098 18517 19105 1 16 . 1 1 128 128 LYS C C 196 177.400 177.400 176.671 0.729 18517 19106 1 16 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.178 2.822 18517 19107 1 16 . 1 1 128 128 LYS CB C 196 32.740 32.740 33.199 -0.459 18517 19108 1 16 . 1 1 128 128 LYS H H 196 7.990 7.990 7.754 0.236 18517 19109 1 16 . 1 1 129 129 GLY N N 197 109.010 109.010 108.915 0.095 18517 19110 1 16 . 1 1 129 129 GLY C C 197 175.770 175.770 175.632 0.138 18517 19111 1 16 . 1 1 129 129 GLY CA C 197 46.100 46.100 45.404 0.696 18517 19112 1 16 . 1 1 129 129 GLY H H 197 8.220 8.220 7.785 0.435 18517 19113 1 16 . 1 1 130 130 GLY N N 198 109.150 109.150 108.689 0.461 18517 19114 1 16 . 1 1 130 130 GLY C C 198 174.760 174.760 175.468 -0.708 18517 19115 1 16 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.201 -0.271 18517 19116 1 16 . 1 1 130 130 GLY H H 198 8.210 8.210 8.107 0.103 18517 19117 1 16 . 1 1 131 131 GLU N N 199 121.560 121.560 121.126 0.434 18517 19118 1 16 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.086 -0.066 18517 19119 1 16 . 1 1 131 131 GLU C C 199 178.500 178.500 178.251 0.249 18517 19120 1 16 . 1 1 131 131 GLU CA C 199 59.900 59.900 58.311 1.589 18517 19121 1 16 . 1 1 131 131 GLU CB C 199 29.570 29.570 28.091 1.479 18517 19122 1 16 . 1 1 131 131 GLU H H 199 8.510 8.510 7.976 0.534 18517 19123 1 16 . 1 1 132 132 ALA N N 200 122.390 122.390 123.195 -0.805 18517 19124 1 16 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.161 0.039 18517 19125 1 16 . 1 1 132 132 ALA C C 200 180.360 180.360 179.742 0.618 18517 19126 1 16 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.773 0.007 18517 19127 1 16 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.154 0.236 18517 19128 1 16 . 1 1 132 132 ALA H H 200 8.190 8.190 7.448 0.742 18517 19129 1 16 . 1 1 133 133 LEU N N 201 120.800 120.800 119.429 1.371 18517 19130 1 16 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.066 0.143 18517 19131 1 16 . 1 1 133 133 LEU C C 201 179.270 179.270 179.153 0.117 18517 19132 1 16 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.625 0.055 18517 19133 1 16 . 1 1 133 133 LEU CB C 201 42.180 42.180 40.588 1.592 18517 19134 1 16 . 1 1 133 133 LEU H H 201 7.720 7.720 8.192 -0.472 18517 19135 1 16 . 1 1 134 134 LEU N N 202 120.680 120.680 120.747 -0.067 18517 19136 1 16 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.985 -0.005 18517 19137 1 16 . 1 1 134 134 LEU C C 202 179.030 179.030 179.025 0.005 18517 19138 1 16 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.555 0.875 18517 19139 1 16 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.337 0.284 18517 19140 1 16 . 1 1 134 134 LEU H H 202 8.470 8.470 8.439 0.031 18517 19141 1 16 . 1 1 135 135 SER N N 203 113.290 113.290 113.943 -0.653 18517 19142 1 16 . 1 1 135 135 SER HA H 203 4.180 4.180 4.069 0.111 18517 19143 1 16 . 1 1 135 135 SER C C 203 177.300 177.300 176.666 0.634 18517 19144 1 16 . 1 1 135 135 SER CA C 203 62.080 62.080 61.912 0.168 18517 19145 1 16 . 1 1 135 135 SER CB C 203 63.030 63.030 62.759 0.271 18517 19146 1 16 . 1 1 135 135 SER H H 203 8.210 8.210 8.364 -0.154 18517 19147 1 16 . 1 1 136 136 SER N N 204 117.500 117.500 118.250 -0.750 18517 19148 1 16 . 1 1 136 136 SER HA H 204 4.050 4.050 4.214 -0.164 18517 19149 1 16 . 1 1 136 136 SER C C 204 177.570 177.570 176.558 1.012 18517 19150 1 16 . 1 1 136 136 SER CA C 204 61.880 61.880 61.090 0.790 18517 19151 1 16 . 1 1 136 136 SER CB C 204 63.510 63.510 62.842 0.668 18517 19152 1 16 . 1 1 136 136 SER H H 204 7.730 7.730 7.992 -0.262 18517 19153 1 16 . 1 1 137 137 MET N N 205 122.500 122.500 122.346 0.154 18517 19154 1 16 . 1 1 137 137 MET HA H 205 4.140 4.140 3.982 0.158 18517 19155 1 16 . 1 1 137 137 MET C C 205 177.680 177.680 178.466 -0.786 18517 19156 1 16 . 1 1 137 137 MET CA C 205 60.140 60.140 59.930 0.210 18517 19157 1 16 . 1 1 137 137 MET CB C 205 33.460 33.460 32.515 0.945 18517 19158 1 16 . 1 1 137 137 MET H H 205 8.170 8.170 8.644 -0.474 18517 19159 1 16 . 1 1 138 138 LYS N N 206 121.410 121.410 119.165 2.245 18517 19160 1 16 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.864 -0.114 18517 19161 1 16 . 1 1 138 138 LYS C C 206 178.780 178.780 179.134 -0.354 18517 19162 1 16 . 1 1 138 138 LYS CA C 206 60.330 60.330 60.090 0.240 18517 19163 1 16 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.385 -0.115 18517 19164 1 16 . 1 1 138 138 LYS H H 206 8.810 8.810 8.397 0.413 18517 19165 1 16 . 1 1 139 139 THR N N 207 116.580 116.580 116.986 -0.406 18517 19166 1 16 . 1 1 139 139 THR HA H 207 4.060 4.060 3.938 0.122 18517 19167 1 16 . 1 1 139 139 THR C C 207 176.730 176.730 176.911 -0.181 18517 19168 1 16 . 1 1 139 139 THR CA C 207 67.150 67.150 66.924 0.226 18517 19169 1 16 . 1 1 139 139 THR CB C 207 69.220 69.220 68.704 0.516 18517 19170 1 16 . 1 1 139 139 THR H H 207 7.930 7.930 8.074 -0.144 18517 19171 1 16 . 1 1 140 140 GLN N N 208 121.390 121.390 120.543 0.847 18517 19172 1 16 . 1 1 140 140 GLN HA H 208 4.060 4.060 3.989 0.071 18517 19173 1 16 . 1 1 140 140 GLN C C 208 178.550 178.550 178.457 0.093 18517 19174 1 16 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.407 -0.107 18517 19175 1 16 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.740 0.120 18517 19176 1 16 . 1 1 140 140 GLN H H 208 7.600 7.600 8.376 -0.776 18517 19177 1 16 . 1 1 141 141 HIS N N 209 122.360 122.360 119.348 3.012 18517 19178 1 16 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.336 -0.506 18517 19179 1 16 . 1 1 141 141 HIS C C 209 176.390 176.390 177.331 -0.941 18517 19180 1 16 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.142 1.578 18517 19181 1 16 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.222 -1.122 18517 19182 1 16 . 1 1 141 141 HIS H H 209 8.980 8.980 8.700 0.280 18517 19183 1 16 . 1 1 142 142 ASP N N 210 120.740 120.740 120.761 -0.021 18517 19184 1 16 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.446 -0.096 18517 19185 1 16 . 1 1 142 142 ASP C C 210 179.490 179.490 178.175 1.315 18517 19186 1 16 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.846 0.074 18517 19187 1 16 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.862 -0.272 18517 19188 1 16 . 1 1 142 142 ASP H H 210 8.770 8.770 8.393 0.377 18517 19189 1 16 . 1 1 143 143 GLU N N 211 119.010 119.010 120.662 -1.652 18517 19190 1 16 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.000 -0.030 18517 19191 1 16 . 1 1 143 143 GLU C C 211 179.070 179.070 178.932 0.138 18517 19192 1 16 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.581 -0.282 18517 19193 1 16 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.693 -0.203 18517 19194 1 16 . 1 1 143 143 GLU H H 211 7.850 7.850 8.303 -0.453 18517 19195 1 16 . 1 1 144 144 LEU N N 212 122.500 122.500 120.207 2.293 18517 19196 1 16 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.049 0.021 18517 19197 1 16 . 1 1 144 144 LEU C C 212 179.340 179.340 179.418 -0.078 18517 19198 1 16 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.060 0.330 18517 19199 1 16 . 1 1 144 144 LEU CB C 212 42.180 42.180 42.011 0.169 18517 19200 1 16 . 1 1 144 144 LEU H H 212 8.070 8.070 8.074 -0.004 18517 19201 1 16 . 1 1 145 145 LEU N N 213 118.110 118.110 118.164 -0.054 18517 19202 1 16 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.839 0.361 18517 19203 1 16 . 1 1 145 145 LEU C C 213 179.610 179.610 179.143 0.467 18517 19204 1 16 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.684 1.066 18517 19205 1 16 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.209 0.021 18517 19206 1 16 . 1 1 145 145 LEU H H 213 8.370 8.370 8.221 0.149 18517 19207 1 16 . 1 1 146 146 LYS N N 214 117.290 117.290 120.412 -3.122 18517 19208 1 16 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.890 -0.060 18517 19209 1 16 . 1 1 146 146 LYS C C 214 179.900 179.900 178.652 1.248 18517 19210 1 16 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.910 0.420 18517 19211 1 16 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.298 0.052 18517 19212 1 16 . 1 1 146 146 LYS H H 214 7.560 7.560 8.525 -0.965 18517 19213 1 16 . 1 1 147 147 LYS N N 215 120.330 120.330 119.164 1.166 18517 19214 1 16 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.026 -0.006 18517 19215 1 16 . 1 1 147 147 LYS C C 215 180.550 180.550 179.521 1.029 18517 19216 1 16 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.031 1.069 18517 19217 1 16 . 1 1 147 147 LYS CB C 215 32.740 32.740 31.940 0.800 18517 19218 1 16 . 1 1 147 147 LYS H H 215 7.830 7.830 7.876 -0.046 18517 19219 1 16 . 1 1 148 148 PHE N N 216 117.370 117.370 117.867 -0.497 18517 19220 1 16 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.249 -0.169 18517 19221 1 16 . 1 1 148 148 PHE C C 216 178.200 178.200 177.157 1.043 18517 19222 1 16 . 1 1 148 148 PHE CA C 216 62.120 62.120 60.979 1.141 18517 19223 1 16 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.548 1.172 18517 19224 1 16 . 1 1 148 148 PHE H H 216 8.010 8.010 8.357 -0.347 18517 19225 1 16 . 1 1 149 149 ALA N N 217 118.990 118.990 121.061 -2.071 18517 19226 1 16 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.189 -0.079 18517 19227 1 16 . 1 1 149 149 ALA C C 217 177.330 177.330 178.443 -1.113 18517 19228 1 16 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.681 0.069 18517 19229 1 16 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.501 -0.901 18517 19230 1 16 . 1 1 149 149 ALA H H 217 7.720 7.720 7.872 -0.152 18517 19231 1 16 . 1 1 150 150 ALA N N 218 118.690 118.690 120.281 -1.591 18517 19232 1 16 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.333 0.027 18517 19233 1 16 . 1 1 150 150 ALA C C 218 177.930 177.930 177.702 0.228 18517 19234 1 16 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.791 -0.701 18517 19235 1 16 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.463 0.277 18517 19236 1 16 . 1 1 150 150 ALA H H 218 7.280 7.280 7.858 -0.578 18517 19237 1 16 . 1 1 151 151 LEU N N 219 119.980 119.980 121.104 -1.124 18517 19238 1 16 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.313 -0.043 18517 19239 1 16 . 1 1 151 151 LEU C C 219 176.150 176.150 174.990 1.160 18517 19240 1 16 . 1 1 151 151 LEU CA C 219 56.170 56.170 55.867 0.303 18517 19241 1 16 . 1 1 151 151 LEU CB C 219 42.810 42.810 42.931 -0.120 18517 19242 1 16 . 1 1 151 151 LEU H H 219 7.050 7.050 7.437 -0.387 18517 19243 1 16 . 1 1 152 152 THR N N 220 112.070 112.070 117.091 -5.021 18517 19244 1 16 . 1 1 152 152 THR HA H 220 4.700 4.700 4.980 -0.280 18517 19245 1 16 . 1 1 152 152 THR C C 220 173.400 173.400 173.054 0.346 18517 19246 1 16 . 1 1 152 152 THR CA C 220 58.190 58.190 58.224 -0.034 18517 19247 1 16 . 1 1 152 152 THR CB C 220 70.960 70.960 70.289 0.671 18517 19248 1 16 . 1 1 152 152 THR H H 220 8.040 8.040 7.970 0.070 18517 19249 1 16 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.697 0.013 18517 19250 1 16 . 1 1 153 153 PRO C C 221 176.720 176.720 176.035 0.685 18517 19251 1 16 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.401 0.509 18517 19252 1 16 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.504 1.746 18517 19253 1 16 . 1 1 154 154 THR N N 222 120.460 120.460 118.571 1.889 18517 19254 1 16 . 1 1 154 154 THR HA H 222 4.250 4.250 4.290 -0.040 18517 19255 1 16 . 1 1 154 154 THR C C 222 175.190 175.190 175.057 0.133 18517 19256 1 16 . 1 1 154 154 THR CA C 222 64.650 64.650 62.843 1.807 18517 19257 1 16 . 1 1 154 154 THR CB C 222 70.410 70.410 68.064 2.346 18517 19258 1 16 . 1 1 154 154 THR H H 222 8.530 8.530 8.467 0.063 18517 19259 1 16 . 1 1 155 155 PHE N N 223 122.260 122.260 122.416 -0.156 18517 19260 1 16 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.629 0.361 18517 19261 1 16 . 1 1 155 155 PHE C C 223 172.560 172.560 174.585 -2.025 18517 19262 1 16 . 1 1 155 155 PHE CA C 223 56.770 56.770 57.792 -1.022 18517 19263 1 16 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.007 1.583 18517 19264 1 16 . 1 1 155 155 PHE H H 223 8.950 8.950 7.663 1.287 18517 19265 1 16 . 1 1 156 156 LEU N N 224 123.440 123.440 119.244 4.196 18517 19266 1 16 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.415 0.255 18517 19267 1 16 . 1 1 156 156 LEU C C 224 175.090 175.090 176.945 -1.855 18517 19268 1 16 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.046 -0.016 18517 19269 1 16 . 1 1 156 156 LEU CB C 224 46.300 46.300 42.912 3.388 18517 19270 1 16 . 1 1 156 156 LEU H H 224 7.210 7.210 7.211 -0.001 18517 19271 1 16 . 1 1 157 157 THR N N 225 113.010 113.010 113.923 -0.913 18517 19272 1 16 . 1 1 157 157 THR HA H 225 4.790 4.790 4.687 0.103 18517 19273 1 16 . 1 1 157 157 THR C C 225 176.130 176.130 174.537 1.593 18517 19274 1 16 . 1 1 157 157 THR CA C 225 59.860 59.860 61.093 -1.233 18517 19275 1 16 . 1 1 157 157 THR CB C 225 72.860 72.860 70.199 2.661 18517 19276 1 16 . 1 1 157 157 THR H H 225 9.200 9.200 8.151 1.049 18517 19277 1 16 . 1 1 158 158 SER N N 226 115.350 115.350 118.509 -3.159 18517 19278 1 16 . 1 1 158 158 SER C C 226 177.410 177.410 175.667 1.743 18517 19279 1 16 . 1 1 158 158 SER CA C 226 57.400 57.400 58.010 -0.610 18517 19280 1 16 . 1 1 158 158 SER CB C 226 66.200 66.200 64.084 2.116 18517 19281 1 16 . 1 1 158 158 SER H H 226 8.830 8.830 8.388 0.442 18517 19282 1 16 . 1 1 159 159 GLU N N 227 121.200 121.200 121.971 -0.771 18517 19283 1 16 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.854 0.166 18517 19284 1 16 . 1 1 159 159 GLU C C 227 177.680 177.680 177.804 -0.124 18517 19285 1 16 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.857 0.643 18517 19286 1 16 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.435 0.135 18517 19287 1 16 . 1 1 159 159 GLU H H 227 8.320 8.320 9.017 -0.697 18517 19288 1 16 . 1 1 160 160 ASP N N 228 115.350 115.350 118.234 -2.884 18517 19289 1 16 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.382 0.168 18517 19290 1 16 . 1 1 160 160 ASP C C 228 177.640 177.640 178.012 -0.372 18517 19291 1 16 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.990 0.410 18517 19292 1 16 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.570 2.480 18517 19293 1 16 . 1 1 160 160 ASP H H 228 7.570 7.570 8.262 -0.692 18517 19294 1 16 . 1 1 161 161 ILE N N 229 108.150 108.150 114.869 -6.719 18517 19295 1 16 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.271 0.239 18517 19296 1 16 . 1 1 161 161 ILE C C 229 173.130 173.130 177.418 -4.288 18517 19297 1 16 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.676 -1.386 18517 19298 1 16 . 1 1 161 161 ILE CB C 229 39.400 39.400 38.607 0.793 18517 19299 1 16 . 1 1 161 161 ILE H H 229 7.190 7.190 7.476 -0.286 18517 19300 1 16 . 1 1 162 162 SER N N 230 115.290 115.290 118.302 -3.012 18517 19301 1 16 . 1 1 162 162 SER HA H 230 4.760 4.760 3.793 0.967 18517 19302 1 16 . 1 1 162 162 SER C C 230 176.060 176.060 174.521 1.539 18517 19303 1 16 . 1 1 162 162 SER CA C 230 57.920 57.920 58.014 -0.094 18517 19304 1 16 . 1 1 162 162 SER CB C 230 66.120 66.120 61.504 4.616 18517 19305 1 16 . 1 1 162 162 SER H H 230 7.460 7.460 8.252 -0.792 18517 19306 1 16 . 1 1 163 163 GLY C C 231 173.260 173.260 173.164 0.096 18517 19307 1 16 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.804 0.745 18517 19308 1 16 . 1 1 164 164 TYR N N 232 115.290 115.290 117.112 -1.822 18517 19309 1 16 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.728 -0.028 18517 19310 1 16 . 1 1 164 164 TYR C C 232 172.820 172.820 174.154 -1.334 18517 19311 1 16 . 1 1 164 164 TYR CA C 232 55.100 55.100 54.233 0.868 18517 19312 1 16 . 1 1 164 164 TYR CB C 232 39.800 39.800 40.301 -0.501 18517 19313 1 16 . 1 1 164 164 TYR H H 232 7.370 7.370 7.065 0.305 18517 19314 1 16 . 1 1 165 165 LEU N N 233 120.980 120.980 122.329 -1.349 18517 19315 1 16 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.382 0.048 18517 19316 1 16 . 1 1 165 165 LEU C C 233 176.360 176.360 177.355 -0.995 18517 19317 1 16 . 1 1 165 165 LEU CA C 233 55.660 55.660 55.373 0.287 18517 19318 1 16 . 1 1 165 165 LEU CB C 233 40.430 40.430 41.231 -0.801 18517 19319 1 16 . 1 1 165 165 LEU H H 233 8.830 8.830 8.736 0.094 18517 19320 1 16 . 1 1 166 166 THR N N 234 116.170 116.170 114.978 1.192 18517 19321 1 16 . 1 1 166 166 THR HA H 234 4.010 4.010 3.466 0.544 18517 19322 1 16 . 1 1 166 166 THR C C 234 173.070 173.070 173.628 -0.558 18517 19323 1 16 . 1 1 166 166 THR CA C 234 62.910 62.910 63.800 -0.890 18517 19324 1 16 . 1 1 166 166 THR CB C 234 70.170 70.170 68.810 1.360 18517 19325 1 16 . 1 1 166 166 THR H H 234 8.050 8.050 8.167 -0.117 18517 19326 1 16 . 1 1 167 167 VAL N N 235 117.640 117.640 120.894 -3.254 18517 19327 1 16 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.194 0.016 18517 19328 1 16 . 1 1 167 167 VAL C C 235 172.330 172.330 173.544 -1.214 18517 19329 1 16 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.809 0.942 18517 19330 1 16 . 1 1 167 167 VAL CB C 235 35.880 35.880 33.066 2.814 18517 19331 1 16 . 1 1 167 167 VAL H H 235 7.160 7.160 7.308 -0.148 18517 19332 1 16 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.711 -0.521 18517 19333 1 16 . 1 1 168 168 PRO C C 236 173.710 173.710 175.254 -1.544 18517 19334 1 16 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.228 1.602 18517 19335 1 16 . 1 1 168 168 PRO CB C 236 32.270 32.270 33.450 -1.180 18517 19336 1 16 . 1 1 169 169 GLU N N 237 113.540 113.540 118.021 -4.481 18517 19337 1 16 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.036 0.344 18517 19338 1 16 . 1 1 169 169 GLU C C 237 176.690 176.690 178.338 -1.648 18517 19339 1 16 . 1 1 169 169 GLU CA C 237 53.750 53.750 55.251 -1.500 18517 19340 1 16 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.814 2.406 18517 19341 1 16 . 1 1 169 169 GLU H H 237 7.930 7.930 8.168 -0.238 18517 19342 1 16 . 1 1 170 170 TYR N N 238 119.400 119.400 122.726 -3.326 18517 19343 1 16 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.195 -0.195 18517 19344 1 16 . 1 1 170 170 TYR C C 238 177.610 177.610 176.544 1.066 18517 19345 1 16 . 1 1 170 170 TYR CA C 238 62.630 62.630 60.883 1.747 18517 19346 1 16 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.334 -0.593 18517 19347 1 16 . 1 1 170 170 TYR H H 238 8.490 8.490 8.719 -0.229 18517 19348 1 16 . 1 1 171 171 GLY N N 239 104.160 104.160 103.466 0.694 18517 19349 1 16 . 1 1 171 171 GLY C C 239 173.350 173.350 173.582 -0.232 18517 19350 1 16 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.084 1.186 18517 19351 1 16 . 1 1 171 171 GLY H H 239 7.960 7.960 8.081 -0.121 18517 19352 1 16 . 1 1 172 172 ALA N N 240 121.860 121.860 123.458 -1.598 18517 19353 1 16 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.812 -0.642 18517 19354 1 16 . 1 1 172 172 ALA C C 240 172.160 172.160 174.662 -2.502 18517 19355 1 16 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.379 0.731 18517 19356 1 16 . 1 1 172 172 ALA CB C 240 20.930 20.930 19.956 0.974 18517 19357 1 16 . 1 1 172 172 ALA H H 240 6.910 6.910 7.796 -0.886 18517 19358 1 16 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.891 0.659 18517 19359 1 16 . 1 1 173 173 PRO C C 241 176.610 176.610 175.058 1.552 18517 19360 1 16 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.594 -1.074 18517 19361 1 16 . 1 1 173 173 PRO CB C 241 33.300 33.300 31.026 2.273 18517 19362 1 16 . 1 1 174 174 MET N N 242 114.000 114.000 123.631 -9.631 18517 19363 1 16 . 1 1 174 174 MET HA H 242 4.390 4.390 4.530 -0.140 18517 19364 1 16 . 1 1 174 174 MET C C 242 173.960 173.960 174.250 -0.290 18517 19365 1 16 . 1 1 174 174 MET CA C 242 54.660 54.660 53.651 1.009 18517 19366 1 16 . 1 1 174 174 MET CB C 242 34.170 34.170 36.201 -2.031 18517 19367 1 16 . 1 1 174 174 MET H H 242 8.040 8.040 8.288 -0.248 18517 19368 1 16 . 1 1 175 175 ASN N N 243 119.570 119.570 120.445 -0.875 18517 19369 1 16 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.747 0.193 18517 19370 1 16 . 1 1 175 175 ASN C C 243 174.320 174.320 175.155 -0.835 18517 19371 1 16 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.237 0.843 18517 19372 1 16 . 1 1 175 175 ASN CB C 243 38.850 38.850 39.262 -0.412 18517 19373 1 16 . 1 1 175 175 ASN H H 243 7.960 7.960 8.124 -0.164 18517 19374 1 16 . 1 1 176 176 ALA N N 244 132.250 132.250 127.660 4.590 18517 19375 1 16 . 1 1 176 176 ALA C C 244 181.580 181.580 178.551 3.029 18517 19376 1 16 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.286 0.484 18517 19377 1 16 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.600 0.430 18517 19378 1 16 . 1 1 176 176 ALA H H 244 12.110 12.110 8.624 3.486 18517 19379 1 16 . 1 1 177 177 ALA N N 245 125.780 125.780 121.270 4.510 18517 19380 1 16 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.981 -0.111 18517 19381 1 16 . 1 1 177 177 ALA C C 245 180.640 180.640 179.002 1.638 18517 19382 1 16 . 1 1 177 177 ALA CA C 245 55.660 55.660 54.884 0.776 18517 19383 1 16 . 1 1 177 177 ALA CB C 245 17.840 17.840 17.832 0.008 18517 19384 1 16 . 1 1 177 177 ALA H H 245 10.240 10.240 8.598 1.642 18517 19385 1 16 . 1 1 178 178 LYS N N 246 119.810 119.810 118.731 1.079 18517 19386 1 16 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.081 -0.251 18517 19387 1 16 . 1 1 178 178 LYS C C 246 180.500 180.500 178.237 2.263 18517 19388 1 16 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.283 0.617 18517 19389 1 16 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.419 -1.099 18517 19390 1 16 . 1 1 178 178 LYS H H 246 8.470 8.470 7.665 0.805 18517 19391 1 16 . 1 1 179 179 TRP N N 247 121.170 121.170 121.862 -0.692 18517 19392 1 16 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.430 0.190 18517 19393 1 16 . 1 1 179 179 TRP C C 247 176.510 176.510 177.954 -1.444 18517 19394 1 16 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.897 -0.077 18517 19395 1 16 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.770 -0.200 18517 19396 1 16 . 1 1 179 179 TRP H H 247 8.330 8.330 8.330 -0.000 18517 19397 1 16 . 1 1 180 180 ALA N N 248 119.130 119.130 120.115 -0.985 18517 19398 1 16 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.809 0.731 18517 19399 1 16 . 1 1 180 180 ALA C C 248 182.110 182.110 179.400 2.710 18517 19400 1 16 . 1 1 180 180 ALA CA C 248 54.190 54.190 54.980 -0.790 18517 19401 1 16 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.141 0.569 18517 19402 1 16 . 1 1 180 180 ALA H H 248 7.990 7.990 8.699 -0.709 18517 19403 1 16 . 1 1 181 181 LYS N N 249 116.000 116.000 119.714 -3.714 18517 19404 1 16 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.111 -0.141 18517 19405 1 16 . 1 1 181 181 LYS C C 249 179.380 179.380 178.710 0.670 18517 19406 1 16 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.389 -0.679 18517 19407 1 16 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.705 -0.195 18517 19408 1 16 . 1 1 181 181 LYS H H 249 6.900 6.900 7.835 -0.935 18517 19409 1 16 . 1 1 182 182 VAL N N 250 122.270 122.270 116.252 6.018 18517 19410 1 16 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.680 -0.340 18517 19411 1 16 . 1 1 182 182 VAL C C 250 178.160 178.160 177.862 0.298 18517 19412 1 16 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.166 0.594 18517 19413 1 16 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.498 -0.659 18517 19414 1 16 . 1 1 182 182 VAL H H 250 7.050 7.050 8.055 -1.005 18517 19415 1 16 . 1 1 183 183 GLU N N 251 120.520 120.520 119.722 0.798 18517 19416 1 16 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.930 -0.750 18517 19417 1 16 . 1 1 183 183 GLU C C 251 179.480 179.480 179.289 0.191 18517 19418 1 16 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.226 1.464 18517 19419 1 16 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.438 -0.368 18517 19420 1 16 . 1 1 183 183 GLU H H 251 8.020 8.020 8.690 -0.670 18517 19421 1 16 . 1 1 184 184 GLY N N 252 102.930 102.930 108.071 -5.141 18517 19422 1 16 . 1 1 184 184 GLY C C 252 176.920 176.920 176.448 0.472 18517 19423 1 16 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.167 0.243 18517 19424 1 16 . 1 1 184 184 GLY H H 252 7.830 7.830 8.107 -0.277 18517 19425 1 16 . 1 1 185 185 MET N N 253 123.200 123.200 121.661 1.539 18517 19426 1 16 . 1 1 185 185 MET HA H 253 4.250 4.250 4.127 0.123 18517 19427 1 16 . 1 1 185 185 MET C C 253 179.370 179.370 178.507 0.863 18517 19428 1 16 . 1 1 185 185 MET CA C 253 59.300 59.300 59.300 0.000 18517 19429 1 16 . 1 1 185 185 MET CB C 253 33.930 33.930 32.628 1.302 18517 19430 1 16 . 1 1 185 185 MET H H 253 7.890 7.890 7.904 -0.014 18517 19431 1 16 . 1 1 186 186 ILE N N 254 120.150 120.150 120.645 -0.495 18517 19432 1 16 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.687 -0.127 18517 19433 1 16 . 1 1 186 186 ILE C C 254 177.250 177.250 177.985 -0.735 18517 19434 1 16 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.634 0.886 18517 19435 1 16 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.615 0.675 18517 19436 1 16 . 1 1 186 186 ILE H H 254 8.260 8.260 8.302 -0.042 18517 19437 1 16 . 1 1 187 187 HIS N N 255 119.810 119.810 119.531 0.279 18517 19438 1 16 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.192 -0.192 18517 19439 1 16 . 1 1 187 187 HIS C C 255 176.460 176.460 177.506 -1.046 18517 19440 1 16 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.663 0.667 18517 19441 1 16 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.408 2.222 18517 19442 1 16 . 1 1 187 187 HIS H H 255 8.900 8.900 8.849 0.051 18517 19443 1 16 . 1 1 188 188 GLY N N 256 103.160 103.160 106.856 -3.696 18517 19444 1 16 . 1 1 188 188 GLY C C 256 176.320 176.320 176.509 -0.189 18517 19445 1 16 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.848 0.042 18517 19446 1 16 . 1 1 188 188 GLY H H 256 8.030 8.030 8.274 -0.244 18517 19447 1 16 . 1 1 189 189 LYS N N 257 119.510 119.510 123.203 -3.693 18517 19448 1 16 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.130 -0.130 18517 19449 1 16 . 1 1 189 189 LYS C C 257 178.660 178.660 179.427 -0.767 18517 19450 1 16 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.573 -1.083 18517 19451 1 16 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.602 -0.052 18517 19452 1 16 . 1 1 189 189 LYS H H 257 7.120 7.120 7.984 -0.864 18517 19453 1 16 . 1 1 190 190 LEU N N 258 120.570 120.570 121.507 -0.937 18517 19454 1 16 . 1 1 190 190 LEU HA H 258 3.930 3.930 4.078 -0.148 18517 19455 1 16 . 1 1 190 190 LEU C C 258 177.230 177.230 177.578 -0.348 18517 19456 1 16 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.721 -0.201 18517 19457 1 16 . 1 1 190 190 LEU CB C 258 42.970 42.970 41.839 1.131 18517 19458 1 16 . 1 1 190 190 LEU H H 258 8.060 8.060 8.153 -0.093 18517 19459 1 16 . 1 1 191 191 GLU N N 259 114.590 114.590 114.739 -0.149 18517 19460 1 16 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.388 -0.107 18517 19461 1 16 . 1 1 191 191 GLU C C 259 176.230 176.230 175.870 0.360 18517 19462 1 16 . 1 1 191 191 GLU CA C 259 55.340 55.340 54.789 0.551 18517 19463 1 16 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.724 -0.394 18517 19464 1 16 . 1 1 191 191 GLU H H 259 7.330 7.330 7.965 -0.635 18517 19465 1 16 . 1 1 192 192 SER N N 260 115.240 115.240 117.633 -2.393 18517 19466 1 16 . 1 1 192 192 SER HA H 260 4.490 4.490 4.389 0.101 18517 19467 1 16 . 1 1 192 192 SER C C 260 173.770 173.770 174.568 -0.798 18517 19468 1 16 . 1 1 192 192 SER CA C 260 58.350 58.350 58.334 0.016 18517 19469 1 16 . 1 1 192 192 SER CB C 260 65.090 65.090 63.750 1.340 18517 19470 1 16 . 1 1 192 192 SER H H 260 7.130 7.130 7.593 -0.463 18517 19471 1 16 . 1 1 193 193 SER C C 261 174.600 174.600 174.309 0.291 18517 19472 1 16 . 1 1 193 193 SER CA C 261 59.980 59.980 59.248 0.732 18517 19473 1 16 . 1 1 193 193 SER CB C 261 63.750 63.750 62.968 0.782 18517 19474 1 16 . 1 1 194 194 GLU N N 262 121.800 121.800 121.430 0.370 18517 19475 1 16 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.340 0.130 18517 19476 1 16 . 1 1 194 194 GLU C C 262 174.650 174.650 175.833 -1.183 18517 19477 1 16 . 1 1 194 194 GLU CA C 262 55.620 55.620 55.896 -0.276 18517 19478 1 16 . 1 1 194 194 GLU CB C 262 30.210 30.210 30.115 0.095 18517 19479 1 16 . 1 1 194 194 GLU H H 262 7.840 7.840 7.908 -0.068 18517 19480 1 16 . 1 1 195 195 VAL N N 263 124.080 124.080 121.595 2.485 18517 19481 1 16 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.399 -0.149 18517 19482 1 16 . 1 1 195 195 VAL C C 263 174.460 174.460 174.501 -0.041 18517 19483 1 16 . 1 1 195 195 VAL CA C 263 59.820 59.820 58.952 0.868 18517 19484 1 16 . 1 1 195 195 VAL CB C 263 33.620 33.620 32.909 0.711 18517 19485 1 16 . 1 1 195 195 VAL H H 263 8.020 8.020 8.360 -0.340 18517 19486 1 16 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.676 -0.156 18517 19487 1 16 . 1 1 198 198 ASN C C 266 176.490 176.490 177.411 -0.921 18517 19488 1 16 . 1 1 198 198 ASN CA C 266 54.780 54.780 55.617 -0.837 18517 19489 1 16 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.906 0.154 18517 19490 1 16 . 1 1 199 199 LEU N N 267 120.680 120.680 117.546 3.134 18517 19491 1 16 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.978 0.032 18517 19492 1 16 . 1 1 199 199 LEU C C 267 178.050 178.050 178.465 -0.415 18517 19493 1 16 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.384 0.446 18517 19494 1 16 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.029 1.311 18517 19495 1 16 . 1 1 199 199 LEU H H 267 7.660 7.660 8.295 -0.635 18517 19496 1 16 . 1 1 200 200 LYS N N 268 116.740 116.740 120.128 -3.388 18517 19497 1 16 . 1 1 200 200 LYS HA H 268 3.730 3.730 4.006 -0.276 18517 19498 1 16 . 1 1 200 200 LYS C C 268 178.520 178.520 178.107 0.413 18517 19499 1 16 . 1 1 200 200 LYS CA C 268 61.800 61.800 58.912 2.888 18517 19500 1 16 . 1 1 200 200 LYS CB C 268 32.110 32.110 31.931 0.179 18517 19501 1 16 . 1 1 200 200 LYS H H 268 8.280 8.280 7.607 0.673 18517 19502 1 16 . 1 1 201 201 ALA N N 269 121.270 121.270 122.670 -1.400 18517 19503 1 16 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.056 0.184 18517 19504 1 16 . 1 1 201 201 ALA C C 269 180.890 180.890 179.598 1.292 18517 19505 1 16 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.158 0.022 18517 19506 1 16 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.342 0.128 18517 19507 1 16 . 1 1 201 201 ALA H H 269 7.710 7.710 7.915 -0.205 18517 19508 1 16 . 1 1 202 202 LEU N N 270 119.980 119.980 119.240 0.740 18517 19509 1 16 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.925 0.165 18517 19510 1 16 . 1 1 202 202 LEU C C 270 179.330 179.330 179.288 0.042 18517 19511 1 16 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.681 0.389 18517 19512 1 16 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.223 1.197 18517 19513 1 16 . 1 1 202 202 LEU H H 270 7.750 7.750 8.071 -0.321 18517 19514 1 16 . 1 1 203 203 VAL N N 271 118.450 118.450 119.707 -1.257 18517 19515 1 16 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.942 -0.112 18517 19516 1 16 . 1 1 203 203 VAL C C 271 177.110 177.110 178.119 -1.009 18517 19517 1 16 . 1 1 203 203 VAL CA C 271 67.710 67.710 66.538 1.172 18517 19518 1 16 . 1 1 203 203 VAL CB C 271 31.710 31.710 30.758 0.952 18517 19519 1 16 . 1 1 203 203 VAL H H 271 8.560 8.560 8.272 0.288 18517 19520 1 16 . 1 1 204 204 ALA N N 272 122.560 122.560 121.947 0.613 18517 19521 1 16 . 1 1 204 204 ALA HA H 272 3.880 3.880 4.014 -0.134 18517 19522 1 16 . 1 1 204 204 ALA C C 272 178.700 178.700 179.885 -1.185 18517 19523 1 16 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.782 0.348 18517 19524 1 16 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.243 0.147 18517 19525 1 16 . 1 1 204 204 ALA H H 272 8.120 8.120 8.755 -0.635 18517 19526 1 16 . 1 1 205 205 GLU N N 273 117.290 117.290 118.497 -1.207 18517 19527 1 16 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.157 -0.167 18517 19528 1 16 . 1 1 205 205 GLU C C 273 178.630 178.630 179.133 -0.503 18517 19529 1 16 . 1 1 205 205 GLU CA C 273 60.140 60.140 58.761 1.379 18517 19530 1 16 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.413 0.557 18517 19531 1 16 . 1 1 205 205 GLU H H 273 7.670 7.670 8.038 -0.368 18517 19532 1 16 . 1 1 206 206 LEU N N 274 120.450 120.450 122.594 -2.144 18517 19533 1 16 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.057 -0.057 18517 19534 1 16 . 1 1 206 206 LEU C C 274 178.400 178.400 178.528 -0.128 18517 19535 1 16 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.019 0.891 18517 19536 1 16 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.826 1.704 18517 19537 1 16 . 1 1 206 206 LEU H H 274 8.420 8.420 8.245 0.175 18517 19538 1 16 . 1 1 207 207 ILE N N 275 117.580 117.580 120.108 -2.528 18517 19539 1 16 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.521 0.009 18517 19540 1 16 . 1 1 207 207 ILE C C 275 178.850 178.850 178.069 0.781 18517 19541 1 16 . 1 1 207 207 ILE CA C 275 66.080 66.080 66.045 0.035 18517 19542 1 16 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.630 1.140 18517 19543 1 16 . 1 1 207 207 ILE H H 275 8.700 8.700 8.678 0.022 18517 19544 1 16 . 1 1 208 208 GLU N N 276 119.100 119.100 119.557 -0.457 18517 19545 1 16 . 1 1 208 208 GLU HA H 276 4.000 4.000 4.000 -0.000 18517 19546 1 16 . 1 1 208 208 GLU C C 276 178.540 178.540 178.924 -0.384 18517 19547 1 16 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.564 0.886 18517 19548 1 16 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.345 1.175 18517 19549 1 16 . 1 1 208 208 GLU H H 276 7.950 7.950 8.254 -0.304 18517 19550 1 16 . 1 1 209 209 LEU N N 277 120.590 120.590 120.369 0.221 18517 19551 1 16 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.049 0.171 18517 19552 1 16 . 1 1 209 209 LEU C C 277 179.520 179.520 178.741 0.779 18517 19553 1 16 . 1 1 209 209 LEU CA C 277 58.350 58.350 58.287 0.063 18517 19554 1 16 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.445 1.845 18517 19555 1 16 . 1 1 209 209 LEU H H 277 8.550 8.550 8.165 0.385 18517 19556 1 16 . 1 1 210 210 ARG N N 278 116.470 116.470 119.202 -2.732 18517 19557 1 16 . 1 1 210 210 ARG HA H 278 3.740 3.740 4.067 -0.327 18517 19558 1 16 . 1 1 210 210 ARG C C 278 179.190 179.190 178.801 0.389 18517 19559 1 16 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.449 2.231 18517 19560 1 16 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.288 1.112 18517 19561 1 16 . 1 1 210 210 ARG H H 278 8.590 8.590 8.636 -0.046 18517 19562 1 16 . 1 1 211 211 ALA N N 279 120.470 120.470 123.247 -2.777 18517 19563 1 16 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.051 -0.141 18517 19564 1 16 . 1 1 211 211 ALA C C 279 181.350 181.350 179.849 1.501 18517 19565 1 16 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.132 0.568 18517 19566 1 16 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.402 -1.122 18517 19567 1 16 . 1 1 211 211 ALA H H 279 8.050 8.050 8.300 -0.250 18517 19568 1 16 . 1 1 212 212 GLN N N 280 120.070 120.070 117.589 2.481 18517 19569 1 16 . 1 1 212 212 GLN HA H 280 4.020 4.020 4.023 -0.003 18517 19570 1 16 . 1 1 212 212 GLN C C 280 179.490 179.490 178.761 0.729 18517 19571 1 16 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.597 0.703 18517 19572 1 16 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.277 0.903 18517 19573 1 16 . 1 1 212 212 GLN H H 280 8.300 8.300 8.253 0.047 18517 19574 1 16 . 1 1 213 213 MET N N 281 119.810 119.810 118.420 1.390 18517 19575 1 16 . 1 1 213 213 MET HA H 281 3.730 3.730 4.265 -0.535 18517 19576 1 16 . 1 1 213 213 MET C C 281 177.490 177.490 178.786 -1.296 18517 19577 1 16 . 1 1 213 213 MET CA C 281 60.690 60.690 56.896 3.794 18517 19578 1 16 . 1 1 213 213 MET CB C 281 33.930 33.930 31.616 2.314 18517 19579 1 16 . 1 1 213 213 MET H H 281 8.420 8.420 8.478 -0.058 18517 19580 1 16 . 1 1 214 214 MET N N 282 114.000 114.000 119.083 -5.083 18517 19581 1 16 . 1 1 214 214 MET HA H 282 3.880 3.880 4.058 -0.178 18517 19582 1 16 . 1 1 214 214 MET C C 282 177.650 177.650 178.176 -0.526 18517 19583 1 16 . 1 1 214 214 MET CA C 282 58.670 58.670 57.735 0.935 18517 19584 1 16 . 1 1 214 214 MET CB C 282 33.300 33.300 31.560 1.740 18517 19585 1 16 . 1 1 214 214 MET H H 282 7.890 7.890 8.331 -0.441 18517 19586 1 16 . 1 1 215 215 ALA N N 283 119.970 119.970 122.628 -2.658 18517 19587 1 16 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.171 -0.031 18517 19588 1 16 . 1 1 215 215 ALA C C 283 180.580 180.580 178.879 1.701 18517 19589 1 16 . 1 1 215 215 ALA CA C 283 54.110 54.110 54.930 -0.820 18517 19590 1 16 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.259 -0.579 18517 19591 1 16 . 1 1 215 215 ALA H H 283 7.580 7.580 7.923 -0.343 18517 19592 1 16 . 1 1 216 216 LEU N N 284 120.920 120.920 117.284 3.636 18517 19593 1 16 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.145 -0.185 18517 19594 1 16 . 1 1 216 216 LEU C C 284 177.910 177.910 179.185 -1.275 18517 19595 1 16 . 1 1 216 216 LEU CA C 284 57.920 57.920 56.942 0.978 18517 19596 1 16 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.272 0.228 18517 19597 1 16 . 1 1 216 216 LEU H H 284 7.460 7.460 7.761 -0.301 18517 19598 1 16 . 1 1 217 217 LEU N N 285 116.470 116.470 120.136 -3.666 18517 19599 1 16 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.763 -0.083 18517 19600 1 16 . 1 1 217 217 LEU C C 285 178.310 178.310 177.323 0.987 18517 19601 1 16 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.170 0.270 18517 19602 1 16 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.728 1.322 18517 19603 1 16 . 1 1 217 217 LEU H H 285 6.980 6.980 8.210 -1.230 18517 19604 1 16 . 1 1 218 218 TYR N N 286 111.080 111.080 114.817 -3.737 18517 19605 1 16 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.589 0.311 18517 19606 1 16 . 1 1 218 218 TYR C C 286 176.090 176.090 175.880 0.210 18517 19607 1 16 . 1 1 218 218 TYR CA C 286 56.050 56.050 57.356 -1.306 18517 19608 1 16 . 1 1 218 218 TYR CB C 286 40.910 40.910 37.813 3.097 18517 19609 1 16 . 1 1 218 218 TYR H H 286 7.660 7.660 7.873 -0.213 18517 19610 1 16 . 1 1 219 219 GLY N N 287 108.260 108.260 110.667 -2.407 18517 19611 1 16 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.667 0.653 18517 19612 1 16 . 1 1 219 219 GLY H H 287 7.750 7.750 7.798 -0.048 18517 19613 1 16 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.618 -0.128 18517 19614 1 16 . 1 1 221 221 ILE CA C 289 63.580 63.580 63.748 -0.168 18517 19615 1 16 . 1 1 221 221 ILE CB C 289 38.280 38.280 36.940 1.340 18517 19616 1 16 . 1 1 222 222 GLY CA C 290 45.740 45.740 45.565 0.175 18517 19617 1 17 . 1 1 2 2 LYS N N 70 126.600 126.600 123.215 3.385 18517 19618 1 17 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.823 -0.463 18517 19619 1 17 . 1 1 2 2 LYS C C 70 176.000 176.000 174.728 1.272 18517 19620 1 17 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.328 1.121 18517 19621 1 17 . 1 1 2 2 LYS CB C 70 33.850 33.850 34.005 -0.155 18517 19622 1 17 . 1 1 2 2 LYS H H 70 8.530 8.530 8.418 0.112 18517 19623 1 17 . 1 1 3 3 THR N N 71 111.030 111.030 115.821 -4.791 18517 19624 1 17 . 1 1 3 3 THR HA H 71 4.400 4.400 4.454 -0.054 18517 19625 1 17 . 1 1 3 3 THR C C 71 175.650 175.650 174.078 1.572 18517 19626 1 17 . 1 1 3 3 THR CA C 71 60.610 60.610 60.627 -0.016 18517 19627 1 17 . 1 1 3 3 THR CB C 71 71.520 71.520 71.312 0.208 18517 19628 1 17 . 1 1 3 3 THR H H 71 7.390 7.390 8.011 -0.621 18517 19629 1 17 . 1 1 4 4 LEU N N 72 121.560 121.560 124.691 -3.131 18517 19630 1 17 . 1 1 4 4 LEU C C 72 177.870 177.870 178.026 -0.156 18517 19631 1 17 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.707 -0.227 18517 19632 1 17 . 1 1 4 4 LEU CB C 72 42.180 42.180 40.859 1.321 18517 19633 1 17 . 1 1 4 4 LEU H H 72 8.980 8.980 8.727 0.253 18517 19634 1 17 . 1 1 5 5 ASP N N 73 115.530 115.530 118.026 -2.496 18517 19635 1 17 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.402 -0.072 18517 19636 1 17 . 1 1 5 5 ASP C C 73 179.290 179.290 179.194 0.096 18517 19637 1 17 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.727 0.113 18517 19638 1 17 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.437 0.393 18517 19639 1 17 . 1 1 5 5 ASP H H 73 8.270 8.270 8.794 -0.524 18517 19640 1 17 . 1 1 6 6 VAL N N 74 122.330 122.330 120.458 1.872 18517 19641 1 17 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.659 0.081 18517 19642 1 17 . 1 1 6 6 VAL C C 74 178.970 178.970 177.854 1.116 18517 19643 1 17 . 1 1 6 6 VAL CA C 74 66.360 66.360 66.105 0.255 18517 19644 1 17 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.786 0.164 18517 19645 1 17 . 1 1 6 6 VAL H H 74 7.400 7.400 7.216 0.184 18517 19646 1 17 . 1 1 7 7 LEU N N 75 121.360 121.360 120.341 1.019 18517 19647 1 17 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.883 0.147 18517 19648 1 17 . 1 1 7 7 LEU C C 75 179.240 179.240 179.111 0.129 18517 19649 1 17 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.491 -0.261 18517 19650 1 17 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.362 1.528 18517 19651 1 17 . 1 1 7 7 LEU H H 75 8.300 8.300 8.605 -0.305 18517 19652 1 17 . 1 1 8 8 ARG N N 76 117.230 117.230 118.453 -1.223 18517 19653 1 17 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.041 -0.121 18517 19654 1 17 . 1 1 8 8 ARG C C 76 178.290 178.290 179.106 -0.816 18517 19655 1 17 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.783 0.987 18517 19656 1 17 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.837 0.373 18517 19657 1 17 . 1 1 8 8 ARG H H 76 8.520 8.520 8.792 -0.272 18517 19658 1 17 . 1 1 9 9 GLY N N 77 104.570 104.570 108.161 -3.591 18517 19659 1 17 . 1 1 9 9 GLY C C 77 176.180 176.180 176.387 -0.207 18517 19660 1 17 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.865 0.305 18517 19661 1 17 . 1 1 9 9 GLY H H 77 7.620 7.620 8.328 -0.708 18517 19662 1 17 . 1 1 10 10 GLU N N 78 120.270 120.270 123.102 -2.832 18517 19663 1 17 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.145 0.125 18517 19664 1 17 . 1 1 10 10 GLU C C 78 179.030 179.030 179.179 -0.149 18517 19665 1 17 . 1 1 10 10 GLU CA C 78 58.870 58.870 58.896 -0.026 18517 19666 1 17 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.243 2.157 18517 19667 1 17 . 1 1 10 10 GLU H H 78 8.100 8.100 8.387 -0.287 18517 19668 1 17 . 1 1 11 11 LEU N N 79 116.000 116.000 120.352 -4.352 18517 19669 1 17 . 1 1 11 11 LEU HA H 79 4.510 4.510 4.012 0.498 18517 19670 1 17 . 1 1 11 11 LEU C C 79 179.630 179.630 179.321 0.309 18517 19671 1 17 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.033 -1.343 18517 19672 1 17 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.660 3.139 18517 19673 1 17 . 1 1 11 11 LEU H H 79 8.230 8.230 8.623 -0.393 18517 19674 1 17 . 1 1 12 12 ARG N N 80 120.020 120.020 119.844 0.176 18517 19675 1 17 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.929 -0.179 18517 19676 1 17 . 1 1 12 12 ARG C C 80 178.490 178.490 178.474 0.016 18517 19677 1 17 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.687 2.313 18517 19678 1 17 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.948 1.292 18517 19679 1 17 . 1 1 12 12 ARG H H 80 8.210 8.210 8.606 -0.396 18517 19680 1 17 . 1 1 13 13 GLY N N 81 108.090 108.090 106.750 1.340 18517 19681 1 17 . 1 1 13 13 GLY C C 81 173.540 173.540 175.890 -2.350 18517 19682 1 17 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.960 1.040 18517 19683 1 17 . 1 1 13 13 GLY H H 81 8.890 8.890 8.471 0.419 18517 19684 1 17 . 1 1 14 14 GLN C C 82 179.540 179.540 177.835 1.705 18517 19685 1 17 . 1 1 14 14 GLN CA C 82 58.710 58.710 58.964 -0.254 18517 19686 1 17 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.533 0.567 18517 19687 1 17 . 1 1 15 15 ARG N N 83 118.220 118.220 120.351 -2.131 18517 19688 1 17 . 1 1 15 15 ARG HA H 83 3.950 3.950 3.826 0.124 18517 19689 1 17 . 1 1 15 15 ARG C C 83 177.710 177.710 178.681 -0.971 18517 19690 1 17 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.912 -0.012 18517 19691 1 17 . 1 1 15 15 ARG CB C 83 29.650 29.650 30.027 -0.377 18517 19692 1 17 . 1 1 15 15 ARG H H 83 7.320 7.320 8.369 -1.049 18517 19693 1 17 . 1 1 16 16 GLU N N 84 118.810 118.810 118.880 -0.070 18517 19694 1 17 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.099 -0.249 18517 19695 1 17 . 1 1 16 16 GLU C C 84 178.750 178.750 178.979 -0.229 18517 19696 1 17 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.161 1.849 18517 19697 1 17 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.082 0.328 18517 19698 1 17 . 1 1 16 16 GLU H H 84 8.450 8.450 8.744 -0.294 18517 19699 1 17 . 1 1 17 17 ALA N N 85 122.790 122.790 123.060 -0.270 18517 19700 1 17 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.157 0.033 18517 19701 1 17 . 1 1 17 17 ALA C C 85 180.360 180.360 180.107 0.253 18517 19702 1 17 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.197 0.263 18517 19703 1 17 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.303 -0.223 18517 19704 1 17 . 1 1 17 17 ALA H H 85 8.420 8.420 8.105 0.315 18517 19705 1 17 . 1 1 18 18 PHE N N 86 119.400 119.400 119.187 0.213 18517 19706 1 17 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.239 0.051 18517 19707 1 17 . 1 1 18 18 PHE C C 86 177.560 177.560 177.945 -0.385 18517 19708 1 17 . 1 1 18 18 PHE CA C 86 61.640 61.640 60.959 0.681 18517 19709 1 17 . 1 1 18 18 PHE CB C 86 39.640 39.640 38.382 1.258 18517 19710 1 17 . 1 1 18 18 PHE H H 86 7.490 7.490 8.721 -1.231 18517 19711 1 17 . 1 1 19 19 LEU N N 87 117.470 117.470 120.256 -2.786 18517 19712 1 17 . 1 1 19 19 LEU HA H 87 4.070 4.070 4.008 0.062 18517 19713 1 17 . 1 1 19 19 LEU C C 87 178.880 178.880 178.583 0.297 18517 19714 1 17 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.899 -0.939 18517 19715 1 17 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.456 0.644 18517 19716 1 17 . 1 1 19 19 LEU H H 87 8.010 8.010 9.056 -1.046 18517 19717 1 17 . 1 1 20 20 SER N N 88 113.770 113.770 114.512 -0.742 18517 19718 1 17 . 1 1 20 20 SER HA H 88 4.070 4.070 4.128 -0.058 18517 19719 1 17 . 1 1 20 20 SER C C 88 175.680 175.680 176.760 -1.080 18517 19720 1 17 . 1 1 20 20 SER CA C 88 63.070 63.070 62.678 0.392 18517 19721 1 17 . 1 1 20 20 SER H H 88 8.100 8.100 8.328 -0.228 18517 19722 1 17 . 1 1 21 21 GLU N N 89 120.570 120.570 122.534 -1.964 18517 19723 1 17 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.017 -0.047 18517 19724 1 17 . 1 1 21 21 GLU C C 89 178.940 178.940 179.044 -0.104 18517 19725 1 17 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.432 -0.172 18517 19726 1 17 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.572 -0.242 18517 19727 1 17 . 1 1 21 21 GLU H H 89 7.400 7.400 7.864 -0.464 18517 19728 1 17 . 1 1 22 22 ILE N N 90 119.350 119.350 118.882 0.468 18517 19729 1 17 . 1 1 22 22 ILE HA H 90 3.690 3.690 4.041 -0.351 18517 19730 1 17 . 1 1 22 22 ILE C C 90 177.230 177.230 178.455 -1.225 18517 19731 1 17 . 1 1 22 22 ILE CA C 90 63.470 63.470 63.148 0.322 18517 19732 1 17 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.842 -0.452 18517 19733 1 17 . 1 1 22 22 ILE H H 90 7.250 7.250 8.599 -1.349 18517 19734 1 17 . 1 1 23 23 ILE N N 91 116.350 116.350 118.902 -2.552 18517 19735 1 17 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.870 -0.470 18517 19736 1 17 . 1 1 23 23 ILE C C 91 176.690 176.690 177.057 -0.367 18517 19737 1 17 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.170 2.560 18517 19738 1 17 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.329 0.441 18517 19739 1 17 . 1 1 23 23 ILE H H 91 7.860 7.860 8.328 -0.468 18517 19740 1 17 . 1 1 24 24 LYS N N 92 116.000 116.000 118.468 -2.468 18517 19741 1 17 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.159 -0.019 18517 19742 1 17 . 1 1 24 24 LYS C C 92 176.270 176.270 177.291 -1.021 18517 19743 1 17 . 1 1 24 24 LYS CA C 92 57.480 57.480 58.241 -0.761 18517 19744 1 17 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.938 0.362 18517 19745 1 17 . 1 1 24 24 LYS H H 92 7.170 7.170 7.814 -0.644 18517 19746 1 17 . 1 1 25 25 SER N N 93 114.650 114.650 115.322 -0.672 18517 19747 1 17 . 1 1 25 25 SER HA H 93 4.550 4.550 4.402 0.148 18517 19748 1 17 . 1 1 25 25 SER C C 93 173.370 173.370 173.540 -0.170 18517 19749 1 17 . 1 1 25 25 SER CA C 93 57.240 57.240 59.016 -1.776 18517 19750 1 17 . 1 1 25 25 SER CB C 93 65.650 65.650 63.435 2.215 18517 19751 1 17 . 1 1 25 25 SER H H 93 7.730 7.730 7.879 -0.149 18517 19752 1 17 . 1 1 26 26 ASP N N 94 121.230 121.230 127.946 -6.716 18517 19753 1 17 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.788 0.142 18517 19754 1 17 . 1 1 26 26 ASP C C 94 176.560 176.560 175.370 1.190 18517 19755 1 17 . 1 1 26 26 ASP CA C 94 54.510 54.510 52.697 1.813 18517 19756 1 17 . 1 1 26 26 ASP CB C 94 42.650 42.650 40.603 2.047 18517 19757 1 17 . 1 1 26 26 ASP H H 94 8.280 8.280 8.420 -0.140 18517 19758 1 17 . 1 1 27 27 GLY N N 95 109.310 109.310 109.552 -0.242 18517 19759 1 17 . 1 1 27 27 GLY C C 95 171.080 171.080 170.918 0.162 18517 19760 1 17 . 1 1 27 27 GLY CA C 95 42.770 42.770 44.139 -1.369 18517 19761 1 17 . 1 1 27 27 GLY H H 95 8.160 8.160 6.977 1.183 18517 19762 1 17 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.561 0.579 18517 19763 1 17 . 1 1 29 29 PHE C C 97 175.230 175.230 175.212 0.018 18517 19764 1 17 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.259 0.231 18517 19765 1 17 . 1 1 29 29 PHE CB C 97 41.620 41.620 41.216 0.404 18517 19766 1 17 . 1 1 30 30 THR N N 98 112.600 112.600 112.361 0.239 18517 19767 1 17 . 1 1 30 30 THR HA H 98 4.570 4.570 4.111 0.459 18517 19768 1 17 . 1 1 30 30 THR C C 98 176.690 176.690 174.494 2.196 18517 19769 1 17 . 1 1 30 30 THR CA C 98 60.290 60.290 59.610 0.680 18517 19770 1 17 . 1 1 30 30 THR CB C 98 71.600 71.600 71.569 0.032 18517 19771 1 17 . 1 1 30 30 THR H H 98 8.990 8.990 7.872 1.118 18517 19772 1 17 . 1 1 31 31 ILE N N 99 119.240 119.240 121.697 -2.457 18517 19773 1 17 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.419 0.401 18517 19774 1 17 . 1 1 31 31 ILE C C 99 176.090 176.090 176.688 -0.598 18517 19775 1 17 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.283 -3.143 18517 19776 1 17 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.803 -0.853 18517 19777 1 17 . 1 1 31 31 ILE H H 99 9.230 9.230 8.033 1.197 18517 19778 1 17 . 1 1 32 32 LEU N N 100 119.660 119.660 118.263 1.397 18517 19779 1 17 . 1 1 32 32 LEU HA H 100 4.030 4.030 4.004 0.026 18517 19780 1 17 . 1 1 32 32 LEU C C 100 181.050 181.050 179.048 2.002 18517 19781 1 17 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.414 0.146 18517 19782 1 17 . 1 1 32 32 LEU CB C 100 40.120 40.120 41.121 -1.001 18517 19783 1 17 . 1 1 32 32 LEU H H 100 7.310 7.310 8.129 -0.819 18517 19784 1 17 . 1 1 33 33 GLN N N 101 121.450 121.450 119.659 1.791 18517 19785 1 17 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.156 0.094 18517 19786 1 17 . 1 1 33 33 GLN CA C 101 59.700 59.700 58.541 1.159 18517 19787 1 17 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.259 3.531 18517 19788 1 17 . 1 1 33 33 GLN H H 101 7.790 7.790 7.574 0.216 18517 19789 1 17 . 1 1 34 34 LEU C C 102 178.590 178.590 178.890 -0.300 18517 19790 1 17 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.099 0.531 18517 19791 1 17 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.692 -0.382 18517 19792 1 17 . 1 1 35 35 VAL N N 103 118.520 118.520 117.734 0.786 18517 19793 1 17 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.748 -0.328 18517 19794 1 17 . 1 1 35 35 VAL C C 103 177.930 177.930 178.581 -0.651 18517 19795 1 17 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.125 -0.085 18517 19796 1 17 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.328 1.302 18517 19797 1 17 . 1 1 35 35 VAL H H 103 8.670 8.670 8.678 -0.009 18517 19798 1 17 . 1 1 36 36 GLY N N 104 109.430 109.430 108.438 0.992 18517 19799 1 17 . 1 1 36 36 GLY C C 104 174.600 174.600 175.911 -1.311 18517 19800 1 17 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.256 0.784 18517 19801 1 17 . 1 1 36 36 GLY H H 104 7.880 7.880 8.325 -0.445 18517 19802 1 17 . 1 1 37 37 TYR N N 105 122.270 122.270 124.193 -1.923 18517 19803 1 17 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.463 -0.583 18517 19804 1 17 . 1 1 37 37 TYR C C 105 176.310 176.310 177.094 -0.784 18517 19805 1 17 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.044 4.056 18517 19806 1 17 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.832 -0.462 18517 19807 1 17 . 1 1 37 37 TYR H H 105 8.170 8.170 8.114 0.056 18517 19808 1 17 . 1 1 38 38 LEU N N 106 120.100 120.100 121.289 -1.189 18517 19809 1 17 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.868 -0.128 18517 19810 1 17 . 1 1 38 38 LEU C C 106 178.280 178.280 178.603 -0.323 18517 19811 1 17 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.081 0.549 18517 19812 1 17 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.712 1.018 18517 19813 1 17 . 1 1 38 38 LEU H H 106 7.610 7.610 8.516 -0.906 18517 19814 1 17 . 1 1 39 39 ARG N N 107 116.670 116.670 118.670 -2.000 18517 19815 1 17 . 1 1 39 39 ARG HA H 107 3.680 3.680 3.968 -0.288 18517 19816 1 17 . 1 1 39 39 ARG C C 107 179.480 179.480 178.638 0.842 18517 19817 1 17 . 1 1 39 39 ARG CA C 107 59.580 59.580 59.333 0.247 18517 19818 1 17 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.840 1.399 18517 19819 1 17 . 1 1 39 39 ARG H H 107 8.240 8.240 7.934 0.306 18517 19820 1 17 . 1 1 40 40 VAL N N 108 121.970 121.970 121.150 0.820 18517 19821 1 17 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.618 -0.218 18517 19822 1 17 . 1 1 40 40 VAL C C 108 178.440 178.440 178.191 0.249 18517 19823 1 17 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.251 1.699 18517 19824 1 17 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.190 -0.750 18517 19825 1 17 . 1 1 40 40 VAL H H 108 8.200 8.200 7.921 0.279 18517 19826 1 17 . 1 1 41 41 VAL N N 109 108.940 108.940 116.471 -7.531 18517 19827 1 17 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.573 0.667 18517 19828 1 17 . 1 1 41 41 VAL C C 109 175.070 175.070 177.801 -2.731 18517 19829 1 17 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.892 -3.302 18517 19830 1 17 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.325 -0.675 18517 19831 1 17 . 1 1 41 41 VAL H H 109 7.760 7.760 8.106 -0.346 18517 19832 1 17 . 1 1 42 42 ASP N N 110 124.670 124.670 121.573 3.097 18517 19833 1 17 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.310 0.310 18517 19834 1 17 . 1 1 42 42 ASP C C 110 177.310 177.310 178.033 -0.723 18517 19835 1 17 . 1 1 42 42 ASP CA C 110 59.980 59.980 58.358 1.622 18517 19836 1 17 . 1 1 42 42 ASP CB C 110 44.950 44.950 41.150 3.800 18517 19837 1 17 . 1 1 42 42 ASP H H 110 7.360 7.360 8.475 -1.115 18517 19838 1 17 . 1 1 43 43 THR N N 111 102.340 102.340 112.393 -10.053 18517 19839 1 17 . 1 1 43 43 THR HA H 111 5.100 5.100 4.060 1.040 18517 19840 1 17 . 1 1 43 43 THR C C 111 174.940 174.940 176.512 -1.572 18517 19841 1 17 . 1 1 43 43 THR CA C 111 60.650 60.650 65.435 -4.785 18517 19842 1 17 . 1 1 43 43 THR CB C 111 69.610 69.610 68.336 1.274 18517 19843 1 17 . 1 1 43 43 THR H H 111 6.380 6.380 8.003 -1.623 18517 19844 1 17 . 1 1 44 44 ASP N N 112 119.750 119.750 123.655 -3.905 18517 19845 1 17 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.286 -0.426 18517 19846 1 17 . 1 1 44 44 ASP C C 112 178.850 178.850 178.013 0.837 18517 19847 1 17 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.829 0.401 18517 19848 1 17 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.843 -1.443 18517 19849 1 17 . 1 1 44 44 ASP H H 112 9.050 9.050 8.226 0.824 18517 19850 1 17 . 1 1 45 45 LEU N N 113 123.910 123.910 121.129 2.781 18517 19851 1 17 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.840 -0.030 18517 19852 1 17 . 1 1 45 45 LEU C C 113 182.040 182.040 178.646 3.394 18517 19853 1 17 . 1 1 45 45 LEU CA C 113 57.320 57.320 57.920 -0.600 18517 19854 1 17 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.527 -0.777 18517 19855 1 17 . 1 1 45 45 LEU H H 113 9.710 9.710 7.739 1.971 18517 19856 1 17 . 1 1 46 46 LEU N N 114 117.640 117.640 119.216 -1.576 18517 19857 1 17 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.131 -0.021 18517 19858 1 17 . 1 1 46 46 LEU C C 114 179.540 179.540 178.238 1.302 18517 19859 1 17 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.627 -0.067 18517 19860 1 17 . 1 1 46 46 LEU CB C 114 41.470 41.470 42.079 -0.609 18517 19861 1 17 . 1 1 46 46 LEU H H 114 8.270 8.270 7.916 0.354 18517 19862 1 17 . 1 1 47 47 LEU N N 115 116.520 116.520 115.420 1.100 18517 19863 1 17 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.457 -0.317 18517 19864 1 17 . 1 1 47 47 LEU C C 115 173.850 173.850 175.996 -2.146 18517 19865 1 17 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.204 1.216 18517 19866 1 17 . 1 1 47 47 LEU CB C 115 44.720 44.720 42.196 2.524 18517 19867 1 17 . 1 1 47 47 LEU H H 115 8.160 8.160 7.814 0.346 18517 19868 1 17 . 1 1 48 48 LYS N N 116 114.710 114.710 118.182 -3.472 18517 19869 1 17 . 1 1 48 48 LYS HA H 116 3.810 3.810 3.961 -0.151 18517 19870 1 17 . 1 1 48 48 LYS C C 116 176.510 176.510 175.926 0.584 18517 19871 1 17 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.844 0.356 18517 19872 1 17 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.578 -0.558 18517 19873 1 17 . 1 1 48 48 LYS H H 116 7.580 7.580 7.837 -0.257 18517 19874 1 17 . 1 1 49 49 VAL N N 117 119.050 119.050 119.232 -0.182 18517 19875 1 17 . 1 1 49 49 VAL HA H 117 3.610 3.610 3.976 -0.366 18517 19876 1 17 . 1 1 49 49 VAL C C 117 175.860 175.860 176.230 -0.370 18517 19877 1 17 . 1 1 49 49 VAL CA C 117 63.510 63.510 61.838 1.672 18517 19878 1 17 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.247 0.103 18517 19879 1 17 . 1 1 49 49 VAL H H 117 7.980 7.980 8.029 -0.049 18517 19880 1 17 . 1 1 50 50 ASP N N 118 126.900 126.900 121.863 5.037 18517 19881 1 17 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.460 -0.210 18517 19882 1 17 . 1 1 50 50 ASP C C 118 177.700 177.700 177.211 0.489 18517 19883 1 17 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.225 0.825 18517 19884 1 17 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.880 0.700 18517 19885 1 17 . 1 1 50 50 ASP H H 118 8.930 8.930 8.479 0.451 18517 19886 1 17 . 1 1 51 51 SER N N 119 124.790 124.790 122.281 2.509 18517 19887 1 17 . 1 1 51 51 SER HA H 119 4.070 4.070 4.246 -0.176 18517 19888 1 17 . 1 1 51 51 SER C C 119 177.220 177.220 176.414 0.806 18517 19889 1 17 . 1 1 51 51 SER CA C 119 61.640 61.640 61.390 0.250 18517 19890 1 17 . 1 1 51 51 SER CB C 119 63.510 63.510 63.257 0.253 18517 19891 1 17 . 1 1 51 51 SER H H 119 8.560 8.560 8.793 -0.233 18517 19892 1 17 . 1 1 52 52 THR N N 120 119.880 119.880 119.131 0.749 18517 19893 1 17 . 1 1 52 52 THR HA H 120 4.190 4.190 4.109 0.081 18517 19894 1 17 . 1 1 52 52 THR C C 120 177.120 177.120 176.081 1.039 18517 19895 1 17 . 1 1 52 52 THR CA C 120 66.280 66.280 66.468 -0.188 18517 19896 1 17 . 1 1 52 52 THR CB C 120 68.420 68.420 68.683 -0.263 18517 19897 1 17 . 1 1 52 52 THR H H 120 8.310 8.310 8.396 -0.086 18517 19898 1 17 . 1 1 53 53 LYS N N 121 122.270 122.270 122.823 -0.553 18517 19899 1 17 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.144 -0.024 18517 19900 1 17 . 1 1 53 53 LYS C C 121 178.970 178.970 179.061 -0.091 18517 19901 1 17 . 1 1 53 53 LYS CA C 121 59.580 59.580 58.995 0.585 18517 19902 1 17 . 1 1 53 53 LYS CB C 121 34.250 34.250 31.951 2.299 18517 19903 1 17 . 1 1 53 53 LYS H H 121 7.700 7.700 8.874 -1.174 18517 19904 1 17 . 1 1 54 54 VAL N N 122 120.070 120.070 120.411 -0.341 18517 19905 1 17 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.817 -0.387 18517 19906 1 17 . 1 1 54 54 VAL C C 122 179.860 179.860 177.475 2.385 18517 19907 1 17 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.867 2.713 18517 19908 1 17 . 1 1 54 54 VAL CB C 122 32.820 32.820 32.046 0.774 18517 19909 1 17 . 1 1 54 54 VAL H H 122 7.890 7.890 8.261 -0.371 18517 19910 1 17 . 1 1 55 55 ASP N N 123 122.270 122.270 120.642 1.628 18517 19911 1 17 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.362 0.108 18517 19912 1 17 . 1 1 55 55 ASP C C 123 178.630 178.630 178.433 0.197 18517 19913 1 17 . 1 1 55 55 ASP CA C 123 57.800 57.800 58.053 -0.253 18517 19914 1 17 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.969 1.051 18517 19915 1 17 . 1 1 55 55 ASP H H 123 8.270 8.270 7.945 0.325 18517 19916 1 17 . 1 1 56 56 GLU N N 124 119.600 119.600 119.163 0.437 18517 19917 1 17 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.130 -0.160 18517 19918 1 17 . 1 1 56 56 GLU C C 124 179.920 179.920 179.152 0.768 18517 19919 1 17 . 1 1 56 56 GLU CA C 124 60.060 60.060 58.879 1.181 18517 19920 1 17 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.392 0.578 18517 19921 1 17 . 1 1 56 56 GLU H H 124 8.610 8.610 8.476 0.134 18517 19922 1 17 . 1 1 57 57 ALA N N 125 120.070 120.070 122.627 -2.557 18517 19923 1 17 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.179 -0.349 18517 19924 1 17 . 1 1 57 57 ALA C C 125 178.760 178.760 179.439 -0.679 18517 19925 1 17 . 1 1 57 57 ALA CA C 125 55.380 55.380 55.030 0.350 18517 19926 1 17 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.441 1.699 18517 19927 1 17 . 1 1 57 57 ALA H H 125 8.420 8.420 8.456 -0.036 18517 19928 1 17 . 1 1 58 58 GLY N N 126 106.740 106.740 105.972 0.768 18517 19929 1 17 . 1 1 58 58 GLY C C 126 175.740 175.740 175.989 -0.249 18517 19930 1 17 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.723 0.567 18517 19931 1 17 . 1 1 58 58 GLY H H 126 8.200 8.200 8.556 -0.356 18517 19932 1 17 . 1 1 59 59 LYS N N 127 120.920 120.920 121.851 -0.931 18517 19933 1 17 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.201 -0.271 18517 19934 1 17 . 1 1 59 59 LYS C C 127 180.320 180.320 178.688 1.632 18517 19935 1 17 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.050 1.159 18517 19936 1 17 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.455 0.525 18517 19937 1 17 . 1 1 59 59 LYS H H 127 8.000 8.000 8.051 -0.051 18517 19938 1 17 . 1 1 60 60 LYS N N 128 118.400 118.400 120.009 -1.609 18517 19939 1 17 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.180 -0.010 18517 19940 1 17 . 1 1 60 60 LYS C C 128 180.030 180.030 179.071 0.959 18517 19941 1 17 . 1 1 60 60 LYS CA C 128 58.750 58.750 58.782 -0.032 18517 19942 1 17 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.066 0.204 18517 19943 1 17 . 1 1 60 60 LYS H H 128 7.170 7.170 7.908 -0.738 18517 19944 1 17 . 1 1 61 61 VAL N N 129 121.050 121.050 120.207 0.843 18517 19945 1 17 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.635 -0.355 18517 19946 1 17 . 1 1 61 61 VAL C C 129 177.120 177.120 177.850 -0.730 18517 19947 1 17 . 1 1 61 61 VAL CA C 129 67.350 67.350 66.974 0.376 18517 19948 1 17 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.322 0.308 18517 19949 1 17 . 1 1 61 61 VAL H H 129 7.980 7.980 8.140 -0.160 18517 19950 1 17 . 1 1 62 62 LYS N N 130 120.040 120.040 120.233 -0.193 18517 19951 1 17 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.916 -0.216 18517 19952 1 17 . 1 1 62 62 LYS C C 130 178.550 178.550 178.664 -0.114 18517 19953 1 17 . 1 1 62 62 LYS CA C 130 60.330 60.330 60.035 0.295 18517 19954 1 17 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.289 1.481 18517 19955 1 17 . 1 1 62 62 LYS H H 130 8.910 8.910 8.415 0.495 18517 19956 1 17 . 1 1 63 63 ALA N N 131 119.570 119.570 122.422 -2.852 18517 19957 1 17 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.039 0.181 18517 19958 1 17 . 1 1 63 63 ALA C C 131 180.520 180.520 179.359 1.161 18517 19959 1 17 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.175 0.045 18517 19960 1 17 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.142 0.328 18517 19961 1 17 . 1 1 63 63 ALA H H 131 7.920 7.920 8.242 -0.322 18517 19962 1 17 . 1 1 64 64 TYR N N 132 120.510 120.510 120.366 0.144 18517 19963 1 17 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.167 0.293 18517 19964 1 17 . 1 1 64 64 TYR C C 132 176.510 176.510 177.615 -1.105 18517 19965 1 17 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.361 0.279 18517 19966 1 17 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.494 0.196 18517 19967 1 17 . 1 1 64 64 TYR H H 132 7.930 7.930 8.089 -0.159 18517 19968 1 17 . 1 1 65 65 LEU N N 133 117.290 117.290 119.747 -2.457 18517 19969 1 17 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.540 0.300 18517 19970 1 17 . 1 1 65 65 LEU C C 133 178.610 178.610 178.751 -0.141 18517 19971 1 17 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.047 -0.327 18517 19972 1 17 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.742 -1.312 18517 19973 1 17 . 1 1 65 65 LEU H H 133 8.240 8.240 8.654 -0.414 18517 19974 1 17 . 1 1 66 66 GLU N N 134 119.140 119.140 118.742 0.398 18517 19975 1 17 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.170 -0.310 18517 19976 1 17 . 1 1 66 66 GLU C C 134 180.200 180.200 178.743 1.457 18517 19977 1 17 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.845 1.095 18517 19978 1 17 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.601 0.209 18517 19979 1 17 . 1 1 66 66 GLU H H 134 8.370 8.370 8.601 -0.231 18517 19980 1 17 . 1 1 67 67 LYS N N 135 121.390 121.390 120.049 1.341 18517 19981 1 17 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.133 -0.133 18517 19982 1 17 . 1 1 67 67 LYS C C 135 179.080 179.080 178.574 0.506 18517 19983 1 17 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.816 0.804 18517 19984 1 17 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.581 -0.311 18517 19985 1 17 . 1 1 67 67 LYS H H 135 7.820 7.820 7.701 0.119 18517 19986 1 17 . 1 1 68 68 ILE N N 136 110.310 110.310 111.739 -1.429 18517 19987 1 17 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.059 0.241 18517 19988 1 17 . 1 1 68 68 ILE C C 136 175.520 175.520 176.031 -0.511 18517 19989 1 17 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.781 0.649 18517 19990 1 17 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.606 -0.626 18517 19991 1 17 . 1 1 68 68 ILE H H 136 7.380 7.380 7.653 -0.273 18517 19992 1 17 . 1 1 69 69 GLY N N 137 106.680 106.680 107.876 -1.196 18517 19993 1 17 . 1 1 69 69 GLY C C 137 174.160 174.160 173.796 0.364 18517 19994 1 17 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.480 0.990 18517 19995 1 17 . 1 1 69 69 GLY H H 137 7.470 7.470 7.577 -0.107 18517 19996 1 17 . 1 1 70 70 ILE N N 138 124.310 124.310 121.354 2.956 18517 19997 1 17 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.390 -0.190 18517 19998 1 17 . 1 1 70 70 ILE C C 138 174.190 174.190 175.002 -0.812 18517 19999 1 17 . 1 1 70 70 ILE CA C 138 59.380 59.380 58.868 0.512 18517 20000 1 17 . 1 1 70 70 ILE CB C 138 37.340 37.340 38.412 -1.072 18517 20001 1 17 . 1 1 70 70 ILE H H 138 8.530 8.530 8.274 0.256 18517 20002 1 17 . 1 1 71 71 ARG N N 139 125.490 125.490 127.994 -2.504 18517 20003 1 17 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.520 0.100 18517 20004 1 17 . 1 1 71 71 ARG C C 139 175.750 175.750 175.977 -0.227 18517 20005 1 17 . 1 1 71 71 ARG CA C 139 54.660 54.660 55.526 -0.866 18517 20006 1 17 . 1 1 71 71 ARG CB C 139 33.140 33.140 31.368 1.772 18517 20007 1 17 . 1 1 71 71 ARG H H 139 8.240 8.240 8.615 -0.375 18517 20008 1 17 . 1 1 72 72 GLY N N 140 104.750 104.750 110.967 -6.217 18517 20009 1 17 . 1 1 72 72 GLY C C 140 172.920 172.920 173.723 -0.803 18517 20010 1 17 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.386 1.044 18517 20011 1 17 . 1 1 72 72 GLY H H 140 7.900 7.900 8.411 -0.511 18517 20012 1 17 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.494 0.016 18517 20013 1 17 . 1 1 73 73 ASP C C 141 175.060 175.060 176.057 -0.997 18517 20014 1 17 . 1 1 73 73 ASP CA C 141 56.170 56.170 55.914 0.256 18517 20015 1 17 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.207 -0.377 18517 20016 1 17 . 1 1 74 74 SER N N 142 110.240 110.240 110.599 -0.359 18517 20017 1 17 . 1 1 74 74 SER HA H 142 4.740 4.740 4.755 -0.015 18517 20018 1 17 . 1 1 74 74 SER C C 142 175.110 175.110 174.731 0.379 18517 20019 1 17 . 1 1 74 74 SER CA C 142 55.700 55.700 57.147 -1.446 18517 20020 1 17 . 1 1 74 74 SER CB C 142 67.390 67.390 65.605 1.785 18517 20021 1 17 . 1 1 74 74 SER H H 142 7.560 7.560 7.594 -0.034 18517 20022 1 17 . 1 1 75 75 VAL N N 143 122.950 122.950 120.640 2.310 18517 20023 1 17 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.767 -0.037 18517 20024 1 17 . 1 1 75 75 VAL C C 143 176.230 176.230 177.535 -1.305 18517 20025 1 17 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.672 0.968 18517 20026 1 17 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.616 -0.376 18517 20027 1 17 . 1 1 75 75 VAL H H 143 9.470 9.470 8.761 0.709 18517 20028 1 17 . 1 1 76 76 GLU N N 144 121.390 121.390 122.397 -1.007 18517 20029 1 17 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.140 -0.500 18517 20030 1 17 . 1 1 76 76 GLU C C 144 176.880 176.880 178.907 -2.027 18517 20031 1 17 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.902 3.408 18517 20032 1 17 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.039 0.031 18517 20033 1 17 . 1 1 76 76 GLU H H 144 9.640 9.640 8.827 0.813 18517 20034 1 17 . 1 1 77 77 ALA N N 145 118.770 118.770 121.218 -2.448 18517 20035 1 17 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.298 -0.038 18517 20036 1 17 . 1 1 77 77 ALA C C 145 180.350 180.350 179.518 0.832 18517 20037 1 17 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.439 0.341 18517 20038 1 17 . 1 1 77 77 ALA CB C 145 19.190 19.190 17.799 1.391 18517 20039 1 17 . 1 1 77 77 ALA H H 145 7.860 7.860 8.209 -0.349 18517 20040 1 17 . 1 1 78 78 ALA N N 146 120.920 120.920 122.857 -1.937 18517 20041 1 17 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.069 0.071 18517 20042 1 17 . 1 1 78 78 ALA C C 146 179.150 179.150 179.211 -0.061 18517 20043 1 17 . 1 1 78 78 ALA CA C 146 55.260 55.260 55.095 0.165 18517 20044 1 17 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.772 0.018 18517 20045 1 17 . 1 1 78 78 ALA H H 146 8.110 8.110 8.020 0.090 18517 20046 1 17 . 1 1 79 79 LEU N N 147 118.810 118.810 116.872 1.938 18517 20047 1 17 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.136 -0.256 18517 20048 1 17 . 1 1 79 79 LEU C C 147 179.080 179.080 178.458 0.622 18517 20049 1 17 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.764 0.625 18517 20050 1 17 . 1 1 79 79 LEU CB C 147 42.260 42.260 41.025 1.235 18517 20051 1 17 . 1 1 79 79 LEU H H 147 8.360 8.360 8.155 0.205 18517 20052 1 17 . 1 1 80 80 ASP N N 148 121.620 121.620 120.015 1.605 18517 20053 1 17 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.257 0.263 18517 20054 1 17 . 1 1 80 80 ASP C C 148 178.800 178.800 178.130 0.670 18517 20055 1 17 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.019 0.371 18517 20056 1 17 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.798 -0.048 18517 20057 1 17 . 1 1 80 80 ASP H H 148 8.770 8.770 8.500 0.270 18517 20058 1 17 . 1 1 81 81 ASN N N 149 118.630 118.630 118.121 0.509 18517 20059 1 17 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.448 0.122 18517 20060 1 17 . 1 1 81 81 ASN C C 149 177.970 177.970 177.621 0.349 18517 20061 1 17 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.183 -0.173 18517 20062 1 17 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.445 0.165 18517 20063 1 17 . 1 1 81 81 ASN H H 149 7.960 7.960 7.915 0.045 18517 20064 1 17 . 1 1 82 82 LEU N N 150 120.030 120.030 120.603 -0.573 18517 20065 1 17 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.834 0.226 18517 20066 1 17 . 1 1 82 82 LEU C C 150 177.790 177.790 179.074 -1.284 18517 20067 1 17 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.016 0.854 18517 20068 1 17 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.796 0.064 18517 20069 1 17 . 1 1 82 82 LEU H H 150 8.230 8.230 8.207 0.023 18517 20070 1 17 . 1 1 83 83 MET N N 151 115.820 115.820 118.346 -2.526 18517 20071 1 17 . 1 1 83 83 MET HA H 151 4.390 4.390 4.082 0.308 18517 20072 1 17 . 1 1 83 83 MET C C 151 179.760 179.760 178.714 1.046 18517 20073 1 17 . 1 1 83 83 MET CA C 151 57.400 57.400 58.929 -1.529 18517 20074 1 17 . 1 1 83 83 MET CB C 151 31.080 31.080 32.090 -1.010 18517 20075 1 17 . 1 1 83 83 MET H H 151 8.800 8.800 8.400 0.400 18517 20076 1 17 . 1 1 84 84 ILE N N 152 120.330 120.330 119.852 0.478 18517 20077 1 17 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.661 0.179 18517 20078 1 17 . 1 1 84 84 ILE C C 152 178.660 178.660 178.369 0.291 18517 20079 1 17 . 1 1 84 84 ILE CA C 152 65.800 65.800 65.616 0.184 18517 20080 1 17 . 1 1 84 84 ILE CB C 152 38.450 38.450 37.384 1.066 18517 20081 1 17 . 1 1 84 84 ILE H H 152 8.540 8.540 8.707 -0.167 18517 20082 1 17 . 1 1 85 85 LYS N N 153 118.930 118.930 118.615 0.315 18517 20083 1 17 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.113 0.087 18517 20084 1 17 . 1 1 85 85 LYS C C 153 179.650 179.650 179.390 0.260 18517 20085 1 17 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.209 1.770 18517 20086 1 17 . 1 1 85 85 LYS CB C 153 33.540 33.540 32.043 1.497 18517 20087 1 17 . 1 1 85 85 LYS H H 153 7.510 7.510 7.941 -0.431 18517 20088 1 17 . 1 1 86 86 VAL N N 154 119.810 119.810 120.930 -1.120 18517 20089 1 17 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.700 -0.070 18517 20090 1 17 . 1 1 86 86 VAL C C 154 178.350 178.350 177.987 0.363 18517 20091 1 17 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.503 0.727 18517 20092 1 17 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.616 1.124 18517 20093 1 17 . 1 1 86 86 VAL H H 154 8.740 8.740 8.318 0.422 18517 20094 1 17 . 1 1 87 87 TYR N N 155 118.370 118.370 118.584 -0.214 18517 20095 1 17 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.132 0.138 18517 20096 1 17 . 1 1 87 87 TYR C C 155 178.580 178.580 178.066 0.514 18517 20097 1 17 . 1 1 87 87 TYR CA C 155 62.910 62.910 61.801 1.109 18517 20098 1 17 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.513 0.467 18517 20099 1 17 . 1 1 87 87 TYR H H 155 8.520 8.520 8.550 -0.030 18517 20100 1 17 . 1 1 88 88 GLU N N 156 119.900 119.900 120.608 -0.708 18517 20101 1 17 . 1 1 88 88 GLU HA H 156 4.180 4.180 3.956 0.224 18517 20102 1 17 . 1 1 88 88 GLU C C 156 179.270 179.270 178.452 0.818 18517 20103 1 17 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.937 -0.557 18517 20104 1 17 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.460 0.750 18517 20105 1 17 . 1 1 88 88 GLU H H 156 8.250 8.250 8.294 -0.044 18517 20106 1 17 . 1 1 89 89 ILE N N 157 119.510 119.510 117.571 1.939 18517 20107 1 17 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.951 0.129 18517 20108 1 17 . 1 1 89 89 ILE C C 157 177.890 177.890 178.298 -0.408 18517 20109 1 17 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.301 0.009 18517 20110 1 17 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.454 0.756 18517 20111 1 17 . 1 1 89 89 ILE H H 157 7.630 7.630 7.774 -0.144 18517 20112 1 17 . 1 1 90 90 THR N N 158 114.240 114.240 114.674 -0.434 18517 20113 1 17 . 1 1 90 90 THR HA H 158 4.130 4.130 4.045 0.085 18517 20114 1 17 . 1 1 90 90 THR C C 158 175.530 175.530 175.953 -0.423 18517 20115 1 17 . 1 1 90 90 THR CA C 158 64.460 64.460 65.661 -1.201 18517 20116 1 17 . 1 1 90 90 THR CB C 158 69.610 69.610 68.995 0.615 18517 20117 1 17 . 1 1 90 90 THR H H 158 7.770 7.770 7.939 -0.169 18517 20118 1 17 . 1 1 91 91 LYS N N 159 120.280 120.280 120.863 -0.583 18517 20119 1 17 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.323 -0.013 18517 20120 1 17 . 1 1 91 91 LYS C C 159 177.420 177.420 177.452 -0.032 18517 20121 1 17 . 1 1 91 91 LYS CA C 159 57.400 57.400 57.232 0.168 18517 20122 1 17 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.421 -0.201 18517 20123 1 17 . 1 1 91 91 LYS H H 159 7.890 7.890 8.327 -0.437 18517 20124 1 17 . 1 1 92 92 GLY N N 160 107.910 107.910 111.101 -3.191 18517 20125 1 17 . 1 1 92 92 GLY C C 160 174.430 174.430 174.360 0.070 18517 20126 1 17 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.720 0.260 18517 20127 1 17 . 1 1 92 92 GLY H H 160 7.930 7.930 7.776 0.154 18517 20128 1 17 . 1 1 93 93 THR N N 161 113.570 113.570 115.614 -2.044 18517 20129 1 17 . 1 1 93 93 THR HA H 161 4.390 4.390 4.716 -0.326 18517 20130 1 17 . 1 1 93 93 THR C C 161 174.790 174.790 174.095 0.695 18517 20131 1 17 . 1 1 93 93 THR CA C 161 61.960 61.960 60.568 1.392 18517 20132 1 17 . 1 1 93 93 THR CB C 161 70.010 70.010 71.936 -1.926 18517 20133 1 17 . 1 1 93 93 THR H H 161 7.970 7.970 8.063 -0.093 18517 20134 1 17 . 1 1 94 94 VAL N N 162 121.980 121.980 116.637 5.343 18517 20135 1 17 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.449 -0.329 18517 20136 1 17 . 1 1 94 94 VAL C C 162 176.300 176.300 174.573 1.727 18517 20137 1 17 . 1 1 94 94 VAL CA C 162 62.830 62.830 60.862 1.968 18517 20138 1 17 . 1 1 94 94 VAL CB C 162 33.060 33.060 32.297 0.763 18517 20139 1 17 . 1 1 94 94 VAL H H 162 8.130 8.130 8.491 -0.361 18517 20140 1 17 . 1 1 95 95 GLU N N 163 124.140 124.140 119.157 4.983 18517 20141 1 17 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.117 0.193 18517 20142 1 17 . 1 1 95 95 GLU C C 163 176.870 176.870 175.233 1.637 18517 20143 1 17 . 1 1 95 95 GLU CA C 163 57.080 57.080 57.163 -0.083 18517 20144 1 17 . 1 1 95 95 GLU CB C 163 30.440 30.440 30.195 0.245 18517 20145 1 17 . 1 1 95 95 GLU H H 163 8.490 8.490 7.683 0.807 18517 20146 1 17 . 1 1 96 96 SER N N 164 116.800 116.800 119.835 -3.035 18517 20147 1 17 . 1 1 96 96 SER HA H 164 4.430 4.430 4.611 -0.181 18517 20148 1 17 . 1 1 96 96 SER C C 164 174.940 174.940 174.418 0.522 18517 20149 1 17 . 1 1 96 96 SER CA C 164 59.070 59.070 59.046 0.024 18517 20150 1 17 . 1 1 96 96 SER CB C 164 64.220 64.220 64.084 0.136 18517 20151 1 17 . 1 1 96 96 SER H H 164 8.300 8.300 8.603 -0.303 18517 20152 1 17 . 1 1 97 97 SER C C 165 174.660 174.660 174.136 0.524 18517 20153 1 17 . 1 1 97 97 SER CA C 165 58.870 58.870 60.115 -1.246 18517 20154 1 17 . 1 1 97 97 SER CB C 165 64.060 64.060 64.282 -0.222 18517 20155 1 17 . 1 1 98 98 ALA N N 166 125.490 125.490 121.488 4.002 18517 20156 1 17 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.489 -0.139 18517 20157 1 17 . 1 1 98 98 ALA C C 166 177.780 177.780 176.425 1.355 18517 20158 1 17 . 1 1 98 98 ALA CA C 166 53.000 53.000 52.276 0.724 18517 20159 1 17 . 1 1 98 98 ALA CB C 166 19.340 19.340 20.480 -1.140 18517 20160 1 17 . 1 1 98 98 ALA H H 166 8.180 8.180 7.497 0.683 18517 20161 1 17 . 1 1 99 99 GLN N N 167 118.690 118.690 123.198 -4.508 18517 20162 1 17 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.184 0.156 18517 20163 1 17 . 1 1 99 99 GLN C C 167 176.680 176.680 177.256 -0.576 18517 20164 1 17 . 1 1 99 99 GLN CA C 167 56.250 56.250 56.645 -0.395 18517 20165 1 17 . 1 1 99 99 GLN CB C 167 29.650 29.650 29.387 0.262 18517 20166 1 17 . 1 1 99 99 GLN H H 167 8.170 8.170 8.557 -0.387 18517 20167 1 17 . 1 1 100 100 GLY N N 168 109.670 109.670 108.956 0.714 18517 20168 1 17 . 1 1 100 100 GLY C C 168 174.460 174.460 173.711 0.749 18517 20169 1 17 . 1 1 100 100 GLY CA C 168 45.670 45.670 45.504 0.166 18517 20170 1 17 . 1 1 100 100 GLY H H 168 8.250 8.250 8.182 0.068 18517 20171 1 17 . 1 1 101 101 THR N N 169 112.660 112.660 113.484 -0.824 18517 20172 1 17 . 1 1 101 101 THR HA H 169 4.360 4.360 4.501 -0.141 18517 20173 1 17 . 1 1 101 101 THR C C 169 174.720 174.720 173.524 1.196 18517 20174 1 17 . 1 1 101 101 THR CA C 169 62.080 62.080 60.387 1.693 18517 20175 1 17 . 1 1 101 101 THR CB C 169 69.930 69.930 69.110 0.820 18517 20176 1 17 . 1 1 101 101 THR H H 169 8.070 8.070 8.185 -0.115 18517 20177 1 17 . 1 1 102 102 ASP N N 170 123.090 123.090 124.822 -1.732 18517 20178 1 17 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.723 -0.023 18517 20179 1 17 . 1 1 102 102 ASP C C 170 176.130 176.130 175.484 0.646 18517 20180 1 17 . 1 1 102 102 ASP CA C 170 54.780 54.780 53.087 1.693 18517 20181 1 17 . 1 1 102 102 ASP CB C 170 42.260 42.260 41.049 1.211 18517 20182 1 17 . 1 1 102 102 ASP H H 170 8.170 8.170 8.524 -0.354 18517 20183 1 17 . 1 1 103 103 SER N N 171 117.110 117.110 119.501 -2.391 18517 20184 1 17 . 1 1 103 103 SER HA H 171 4.430 4.430 4.417 0.013 18517 20185 1 17 . 1 1 103 103 SER C C 171 174.770 174.770 175.307 -0.537 18517 20186 1 17 . 1 1 103 103 SER CA C 171 57.960 57.960 57.684 0.276 18517 20187 1 17 . 1 1 103 103 SER CB C 171 64.940 64.940 64.374 0.566 18517 20188 1 17 . 1 1 103 103 SER H H 171 8.450 8.450 8.228 0.222 18517 20189 1 17 . 1 1 104 104 GLU N N 172 122.970 122.970 122.649 0.321 18517 20190 1 17 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.930 0.100 18517 20191 1 17 . 1 1 104 104 GLU C C 172 178.860 178.860 178.280 0.580 18517 20192 1 17 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.272 -0.572 18517 20193 1 17 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.794 -0.144 18517 20194 1 17 . 1 1 104 104 GLU H H 172 8.830 8.830 8.874 -0.044 18517 20195 1 17 . 1 1 105 105 GLU N N 173 119.750 119.750 119.538 0.212 18517 20196 1 17 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.017 -0.037 18517 20197 1 17 . 1 1 105 105 GLU C C 173 178.920 178.920 178.279 0.641 18517 20198 1 17 . 1 1 105 105 GLU CA C 173 60.060 60.060 59.502 0.558 18517 20199 1 17 . 1 1 105 105 GLU CB C 173 29.730 29.730 28.550 1.180 18517 20200 1 17 . 1 1 105 105 GLU H H 173 8.580 8.580 8.633 -0.053 18517 20201 1 17 . 1 1 106 106 LEU N N 174 121.860 121.860 119.818 2.042 18517 20202 1 17 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.098 0.082 18517 20203 1 17 . 1 1 106 106 LEU C C 174 178.210 178.210 178.638 -0.428 18517 20204 1 17 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.635 0.246 18517 20205 1 17 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.207 -0.057 18517 20206 1 17 . 1 1 106 106 LEU H H 174 7.920 7.920 7.658 0.262 18517 20207 1 17 . 1 1 107 107 LYS N N 175 118.740 118.740 119.035 -0.295 18517 20208 1 17 . 1 1 107 107 LYS HA H 175 3.780 3.780 4.017 -0.237 18517 20209 1 17 . 1 1 107 107 LYS C C 175 178.700 178.700 179.422 -0.722 18517 20210 1 17 . 1 1 107 107 LYS CA C 175 61.170 61.170 59.336 1.834 18517 20211 1 17 . 1 1 107 107 LYS CB C 175 32.430 32.430 31.920 0.510 18517 20212 1 17 . 1 1 107 107 LYS H H 175 8.340 8.340 8.659 -0.319 18517 20213 1 17 . 1 1 108 108 THR N N 176 113.820 113.820 117.057 -3.237 18517 20214 1 17 . 1 1 108 108 THR HA H 176 3.840 3.840 4.065 -0.225 18517 20215 1 17 . 1 1 108 108 THR C C 176 176.620 176.620 176.326 0.294 18517 20216 1 17 . 1 1 108 108 THR CA C 176 66.910 66.910 66.769 0.142 18517 20217 1 17 . 1 1 108 108 THR CB C 176 69.610 69.610 68.679 0.931 18517 20218 1 17 . 1 1 108 108 THR H H 176 7.950 7.950 8.288 -0.338 18517 20219 1 17 . 1 1 109 109 LEU N N 177 124.380 124.380 122.912 1.468 18517 20220 1 17 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.147 -0.317 18517 20221 1 17 . 1 1 109 109 LEU C C 177 177.790 177.790 177.865 -0.075 18517 20222 1 17 . 1 1 109 109 LEU CA C 177 57.990 57.990 58.301 -0.311 18517 20223 1 17 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.851 0.729 18517 20224 1 17 . 1 1 109 109 LEU H H 177 7.480 7.480 8.058 -0.578 18517 20225 1 17 . 1 1 110 110 LEU N N 178 117.230 117.230 118.422 -1.192 18517 20226 1 17 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.840 -0.000 18517 20227 1 17 . 1 1 110 110 LEU C C 178 179.540 179.540 179.008 0.532 18517 20228 1 17 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.303 1.087 18517 20229 1 17 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.269 1.071 18517 20230 1 17 . 1 1 110 110 LEU H H 178 8.670 8.670 8.424 0.246 18517 20231 1 17 . 1 1 111 111 LEU N N 179 119.230 119.230 123.131 -3.901 18517 20232 1 17 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.235 -0.155 18517 20233 1 17 . 1 1 111 111 LEU C C 179 179.310 179.310 178.629 0.681 18517 20234 1 17 . 1 1 111 111 LEU CA C 179 58.390 58.390 58.138 0.252 18517 20235 1 17 . 1 1 111 111 LEU CB C 179 42.020 42.020 41.066 0.954 18517 20236 1 17 . 1 1 111 111 LEU H H 179 7.940 7.940 8.269 -0.329 18517 20237 1 17 . 1 1 112 112 LYS N N 180 121.910 121.910 119.591 2.319 18517 20238 1 17 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.069 0.121 18517 20239 1 17 . 1 1 112 112 LYS C C 180 178.740 178.740 179.009 -0.269 18517 20240 1 17 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.816 -0.636 18517 20241 1 17 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.241 -0.371 18517 20242 1 17 . 1 1 112 112 LYS H H 180 7.420 7.420 8.045 -0.625 18517 20243 1 17 . 1 1 113 113 PHE N N 181 118.220 118.220 119.059 -0.839 18517 20244 1 17 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.215 0.535 18517 20245 1 17 . 1 1 113 113 PHE C C 181 178.520 178.520 177.905 0.615 18517 20246 1 17 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.420 -3.340 18517 20247 1 17 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.425 -0.445 18517 20248 1 17 . 1 1 113 113 PHE H H 181 9.000 9.000 8.549 0.451 18517 20249 1 17 . 1 1 114 114 SER N N 182 113.300 113.300 114.433 -1.133 18517 20250 1 17 . 1 1 114 114 SER HA H 182 3.930 3.930 4.107 -0.177 18517 20251 1 17 . 1 1 114 114 SER C C 182 177.080 177.080 177.082 -0.002 18517 20252 1 17 . 1 1 114 114 SER CA C 182 62.000 62.000 62.144 -0.144 18517 20253 1 17 . 1 1 114 114 SER CB C 182 63.510 63.510 62.711 0.799 18517 20254 1 17 . 1 1 114 114 SER H H 182 8.620 8.620 8.782 -0.162 18517 20255 1 17 . 1 1 115 115 GLU N N 183 121.540 121.540 123.296 -1.756 18517 20256 1 17 . 1 1 115 115 GLU HA H 183 4.070 4.070 3.905 0.165 18517 20257 1 17 . 1 1 115 115 GLU C C 183 179.860 179.860 178.385 1.475 18517 20258 1 17 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.748 0.032 18517 20259 1 17 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.611 0.279 18517 20260 1 17 . 1 1 115 115 GLU H H 183 8.250 8.250 8.615 -0.365 18517 20261 1 17 . 1 1 116 116 ASP N N 184 121.740 121.740 120.566 1.174 18517 20262 1 17 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.361 0.149 18517 20263 1 17 . 1 1 116 116 ASP C C 184 179.570 179.570 178.261 1.309 18517 20264 1 17 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.502 0.058 18517 20265 1 17 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.888 0.102 18517 20266 1 17 . 1 1 116 116 ASP H H 184 8.840 8.840 8.296 0.544 18517 20267 1 17 . 1 1 117 117 LEU N N 185 121.420 121.420 121.282 0.138 18517 20268 1 17 . 1 1 117 117 LEU HA H 185 4.130 4.130 3.951 0.178 18517 20269 1 17 . 1 1 117 117 LEU C C 185 178.840 178.840 178.372 0.468 18517 20270 1 17 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.268 -0.038 18517 20271 1 17 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.502 1.148 18517 20272 1 17 . 1 1 117 117 LEU H H 185 8.350 8.350 8.356 -0.006 18517 20273 1 17 . 1 1 118 118 LYS N N 186 119.640 119.640 118.859 0.781 18517 20274 1 17 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.773 0.347 18517 20275 1 17 . 1 1 118 118 LYS C C 186 178.820 178.820 178.928 -0.108 18517 20276 1 17 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.948 -0.208 18517 20277 1 17 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.409 0.101 18517 20278 1 17 . 1 1 118 118 LYS H H 186 8.220 8.220 8.294 -0.074 18517 20279 1 17 . 1 1 119 119 ALA N N 187 120.160 120.160 121.435 -1.275 18517 20280 1 17 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.239 -0.079 18517 20281 1 17 . 1 1 119 119 ALA C C 187 180.450 180.450 180.024 0.426 18517 20282 1 17 . 1 1 119 119 ALA CA C 187 55.140 55.140 54.935 0.205 18517 20283 1 17 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.281 0.189 18517 20284 1 17 . 1 1 119 119 ALA H H 187 8.010 8.010 8.041 -0.031 18517 20285 1 17 . 1 1 120 120 GLU N N 188 117.930 117.930 117.220 0.710 18517 20286 1 17 . 1 1 120 120 GLU HA H 188 4.180 4.180 3.878 0.302 18517 20287 1 17 . 1 1 120 120 GLU C C 188 178.780 178.780 179.084 -0.304 18517 20288 1 17 . 1 1 120 120 GLU CA C 188 58.830 58.830 58.844 -0.014 18517 20289 1 17 . 1 1 120 120 GLU CB C 188 29.970 29.970 28.752 1.218 18517 20290 1 17 . 1 1 120 120 GLU H H 188 7.640 7.640 8.291 -0.651 18517 20291 1 17 . 1 1 121 121 GLN N N 189 117.230 117.230 117.049 0.181 18517 20292 1 17 . 1 1 121 121 GLN HA H 189 4.230 4.230 3.890 0.340 18517 20293 1 17 . 1 1 121 121 GLN C C 189 179.190 179.190 178.227 0.963 18517 20294 1 17 . 1 1 121 121 GLN CA C 189 59.740 59.740 57.021 2.719 18517 20295 1 17 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.393 1.257 18517 20296 1 17 . 1 1 121 121 GLN H H 189 8.280 8.280 8.091 0.189 18517 20297 1 17 . 1 1 122 122 GLU N N 190 118.340 118.340 121.250 -2.910 18517 20298 1 17 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.868 0.252 18517 20299 1 17 . 1 1 122 122 GLU C C 190 178.210 178.210 178.778 -0.568 18517 20300 1 17 . 1 1 122 122 GLU CA C 190 58.750 58.750 59.265 -0.515 18517 20301 1 17 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.027 0.943 18517 20302 1 17 . 1 1 122 122 GLU H H 190 8.250 8.250 8.356 -0.106 18517 20303 1 17 . 1 1 123 123 LEU N N 191 118.930 118.930 120.896 -1.966 18517 20304 1 17 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.979 0.111 18517 20305 1 17 . 1 1 123 123 LEU C C 191 178.500 178.500 179.299 -0.799 18517 20306 1 17 . 1 1 123 123 LEU CA C 191 57.000 57.000 57.980 -0.980 18517 20307 1 17 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.768 0.732 18517 20308 1 17 . 1 1 123 123 LEU H H 191 7.530 7.530 7.991 -0.461 18517 20309 1 17 . 1 1 124 124 HIS N N 192 115.650 115.650 117.363 -1.713 18517 20310 1 17 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.164 0.556 18517 20311 1 17 . 1 1 124 124 HIS C C 192 176.090 176.090 177.792 -1.702 18517 20312 1 17 . 1 1 124 124 HIS CA C 192 56.690 56.690 58.692 -2.002 18517 20313 1 17 . 1 1 124 124 HIS CB C 192 30.760 30.760 29.704 1.056 18517 20314 1 17 . 1 1 124 124 HIS H H 192 7.450 7.450 8.166 -0.716 18517 20315 1 17 . 1 1 125 125 SER N N 193 115.480 115.480 114.799 0.681 18517 20316 1 17 . 1 1 125 125 SER HA H 193 4.310 4.310 4.098 0.212 18517 20317 1 17 . 1 1 125 125 SER CA C 193 60.180 60.180 61.856 -1.676 18517 20318 1 17 . 1 1 125 125 SER CB C 193 64.060 64.060 62.484 1.576 18517 20319 1 17 . 1 1 125 125 SER H H 193 8.020 8.020 7.824 0.196 18517 20320 1 17 . 1 1 126 126 GLU C C 194 177.410 177.410 179.322 -1.912 18517 20321 1 17 . 1 1 126 126 GLU CA C 194 57.840 57.840 59.212 -1.372 18517 20322 1 17 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.605 0.285 18517 20323 1 17 . 1 1 127 127 ALA N N 195 122.910 122.910 122.768 0.142 18517 20324 1 17 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.098 0.092 18517 20325 1 17 . 1 1 127 127 ALA C C 195 178.610 178.610 179.418 -0.808 18517 20326 1 17 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.916 -1.126 18517 20327 1 17 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.715 0.545 18517 20328 1 17 . 1 1 127 127 ALA H H 195 8.020 8.020 8.252 -0.232 18517 20329 1 17 . 1 1 128 128 LYS N N 196 117.770 117.770 115.137 2.633 18517 20330 1 17 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.456 -0.196 18517 20331 1 17 . 1 1 128 128 LYS C C 196 177.400 177.400 175.953 1.447 18517 20332 1 17 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.729 2.271 18517 20333 1 17 . 1 1 128 128 LYS CB C 196 32.740 32.740 33.089 -0.349 18517 20334 1 17 . 1 1 128 128 LYS H H 196 7.990 7.990 8.106 -0.116 18517 20335 1 17 . 1 1 129 129 GLY N N 197 109.010 109.010 108.303 0.707 18517 20336 1 17 . 1 1 129 129 GLY C C 197 175.770 175.770 175.803 -0.033 18517 20337 1 17 . 1 1 129 129 GLY CA C 197 46.100 46.100 45.078 1.022 18517 20338 1 17 . 1 1 129 129 GLY H H 197 8.220 8.220 7.554 0.666 18517 20339 1 17 . 1 1 130 130 GLY N N 198 109.150 109.150 110.533 -1.383 18517 20340 1 17 . 1 1 130 130 GLY C C 198 174.760 174.760 175.147 -0.387 18517 20341 1 17 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.807 -0.877 18517 20342 1 17 . 1 1 130 130 GLY H H 198 8.210 8.210 8.817 -0.607 18517 20343 1 17 . 1 1 131 131 GLU N N 199 121.560 121.560 121.947 -0.387 18517 20344 1 17 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.057 -0.037 18517 20345 1 17 . 1 1 131 131 GLU C C 199 178.500 178.500 178.614 -0.114 18517 20346 1 17 . 1 1 131 131 GLU CA C 199 59.900 59.900 58.791 1.109 18517 20347 1 17 . 1 1 131 131 GLU CB C 199 29.570 29.570 27.933 1.637 18517 20348 1 17 . 1 1 131 131 GLU H H 199 8.510 8.510 8.571 -0.061 18517 20349 1 17 . 1 1 132 132 ALA N N 200 122.390 122.390 122.674 -0.284 18517 20350 1 17 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.155 0.045 18517 20351 1 17 . 1 1 132 132 ALA C C 200 180.360 180.360 179.603 0.757 18517 20352 1 17 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.433 0.347 18517 20353 1 17 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.345 0.045 18517 20354 1 17 . 1 1 132 132 ALA H H 200 8.190 8.190 7.476 0.714 18517 20355 1 17 . 1 1 133 133 LEU N N 201 120.800 120.800 121.276 -0.476 18517 20356 1 17 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.033 0.177 18517 20357 1 17 . 1 1 133 133 LEU C C 201 179.270 179.270 178.477 0.793 18517 20358 1 17 . 1 1 133 133 LEU CA C 201 57.680 57.680 58.246 -0.566 18517 20359 1 17 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.877 0.303 18517 20360 1 17 . 1 1 133 133 LEU H H 201 7.720 7.720 8.562 -0.842 18517 20361 1 17 . 1 1 134 134 LEU N N 202 120.680 120.680 119.529 1.151 18517 20362 1 17 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.979 0.001 18517 20363 1 17 . 1 1 134 134 LEU C C 202 179.030 179.030 178.533 0.497 18517 20364 1 17 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.451 0.979 18517 20365 1 17 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.301 0.319 18517 20366 1 17 . 1 1 134 134 LEU H H 202 8.470 8.470 8.521 -0.051 18517 20367 1 17 . 1 1 135 135 SER N N 203 113.290 113.290 115.718 -2.428 18517 20368 1 17 . 1 1 135 135 SER HA H 203 4.180 4.180 4.054 0.126 18517 20369 1 17 . 1 1 135 135 SER C C 203 177.300 177.300 176.762 0.538 18517 20370 1 17 . 1 1 135 135 SER CA C 203 62.080 62.080 62.234 -0.154 18517 20371 1 17 . 1 1 135 135 SER CB C 203 63.030 63.030 62.901 0.129 18517 20372 1 17 . 1 1 135 135 SER H H 203 8.210 8.210 8.421 -0.211 18517 20373 1 17 . 1 1 136 136 SER N N 204 117.500 117.500 118.866 -1.366 18517 20374 1 17 . 1 1 136 136 SER HA H 204 4.050 4.050 4.172 -0.122 18517 20375 1 17 . 1 1 136 136 SER C C 204 177.570 177.570 176.358 1.212 18517 20376 1 17 . 1 1 136 136 SER CA C 204 61.880 61.880 62.077 -0.197 18517 20377 1 17 . 1 1 136 136 SER CB C 204 63.510 63.510 62.997 0.513 18517 20378 1 17 . 1 1 136 136 SER H H 204 7.730 7.730 8.010 -0.280 18517 20379 1 17 . 1 1 137 137 MET N N 205 122.500 122.500 122.026 0.474 18517 20380 1 17 . 1 1 137 137 MET HA H 205 4.140 4.140 4.062 0.078 18517 20381 1 17 . 1 1 137 137 MET C C 205 177.680 177.680 178.514 -0.834 18517 20382 1 17 . 1 1 137 137 MET CA C 205 60.140 60.140 59.479 0.661 18517 20383 1 17 . 1 1 137 137 MET CB C 205 33.460 33.460 32.547 0.912 18517 20384 1 17 . 1 1 137 137 MET H H 205 8.170 8.170 8.568 -0.398 18517 20385 1 17 . 1 1 138 138 LYS N N 206 121.410 121.410 118.923 2.487 18517 20386 1 17 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.883 -0.133 18517 20387 1 17 . 1 1 138 138 LYS C C 206 178.780 178.780 179.200 -0.420 18517 20388 1 17 . 1 1 138 138 LYS CA C 206 60.330 60.330 60.076 0.254 18517 20389 1 17 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.397 -0.126 18517 20390 1 17 . 1 1 138 138 LYS H H 206 8.810 8.810 8.383 0.427 18517 20391 1 17 . 1 1 139 139 THR N N 207 116.580 116.580 116.521 0.059 18517 20392 1 17 . 1 1 139 139 THR HA H 207 4.060 4.060 4.034 0.026 18517 20393 1 17 . 1 1 139 139 THR C C 207 176.730 176.730 177.153 -0.423 18517 20394 1 17 . 1 1 139 139 THR CA C 207 67.150 67.150 66.736 0.414 18517 20395 1 17 . 1 1 139 139 THR CB C 207 69.220 69.220 68.475 0.745 18517 20396 1 17 . 1 1 139 139 THR H H 207 7.930 7.930 8.099 -0.169 18517 20397 1 17 . 1 1 140 140 GLN N N 208 121.390 121.390 120.290 1.100 18517 20398 1 17 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.105 -0.045 18517 20399 1 17 . 1 1 140 140 GLN C C 208 178.550 178.550 178.497 0.053 18517 20400 1 17 . 1 1 140 140 GLN CA C 208 59.300 59.300 58.662 0.638 18517 20401 1 17 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.130 0.730 18517 20402 1 17 . 1 1 140 140 GLN H H 208 7.600 7.600 8.370 -0.770 18517 20403 1 17 . 1 1 141 141 HIS N N 209 122.360 122.360 119.583 2.777 18517 20404 1 17 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.332 -0.502 18517 20405 1 17 . 1 1 141 141 HIS C C 209 176.390 176.390 177.395 -1.005 18517 20406 1 17 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.154 1.566 18517 20407 1 17 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.244 -1.144 18517 20408 1 17 . 1 1 141 141 HIS H H 209 8.980 8.980 8.403 0.577 18517 20409 1 17 . 1 1 142 142 ASP N N 210 120.740 120.740 119.913 0.827 18517 20410 1 17 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.396 -0.047 18517 20411 1 17 . 1 1 142 142 ASP C C 210 179.490 179.490 178.331 1.159 18517 20412 1 17 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.604 0.316 18517 20413 1 17 . 1 1 142 142 ASP CB C 210 40.590 40.590 41.026 -0.436 18517 20414 1 17 . 1 1 142 142 ASP H H 210 8.770 8.770 8.256 0.514 18517 20415 1 17 . 1 1 143 143 GLU N N 211 119.010 119.010 121.230 -2.220 18517 20416 1 17 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.011 -0.041 18517 20417 1 17 . 1 1 143 143 GLU C C 211 179.070 179.070 178.893 0.177 18517 20418 1 17 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.296 0.004 18517 20419 1 17 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.383 0.107 18517 20420 1 17 . 1 1 143 143 GLU H H 211 7.850 7.850 8.080 -0.230 18517 20421 1 17 . 1 1 144 144 LEU N N 212 122.500 122.500 119.493 3.007 18517 20422 1 17 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.073 -0.003 18517 20423 1 17 . 1 1 144 144 LEU C C 212 179.340 179.340 179.327 0.013 18517 20424 1 17 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.309 0.081 18517 20425 1 17 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.181 0.999 18517 20426 1 17 . 1 1 144 144 LEU H H 212 8.070 8.070 8.031 0.039 18517 20427 1 17 . 1 1 145 145 LEU N N 213 118.110 118.110 118.141 -0.031 18517 20428 1 17 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.771 0.429 18517 20429 1 17 . 1 1 145 145 LEU C C 213 179.610 179.610 179.268 0.342 18517 20430 1 17 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.765 0.985 18517 20431 1 17 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.204 0.026 18517 20432 1 17 . 1 1 145 145 LEU H H 213 8.370 8.370 8.309 0.061 18517 20433 1 17 . 1 1 146 146 LYS N N 214 117.290 117.290 120.106 -2.816 18517 20434 1 17 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.976 -0.146 18517 20435 1 17 . 1 1 146 146 LYS C C 214 179.900 179.900 178.599 1.301 18517 20436 1 17 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.000 1.330 18517 20437 1 17 . 1 1 146 146 LYS CB C 214 32.350 32.350 31.930 0.419 18517 20438 1 17 . 1 1 146 146 LYS H H 214 7.560 7.560 8.316 -0.756 18517 20439 1 17 . 1 1 147 147 LYS N N 215 120.330 120.330 119.162 1.168 18517 20440 1 17 . 1 1 147 147 LYS HA H 215 4.020 4.020 3.986 0.034 18517 20441 1 17 . 1 1 147 147 LYS C C 215 180.550 180.550 179.392 1.158 18517 20442 1 17 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.521 0.579 18517 20443 1 17 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.290 0.450 18517 20444 1 17 . 1 1 147 147 LYS H H 215 7.830 7.830 7.893 -0.063 18517 20445 1 17 . 1 1 148 148 PHE N N 216 117.370 117.370 117.687 -0.317 18517 20446 1 17 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.235 -0.155 18517 20447 1 17 . 1 1 148 148 PHE C C 216 178.200 178.200 177.456 0.744 18517 20448 1 17 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.330 0.790 18517 20449 1 17 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.507 1.213 18517 20450 1 17 . 1 1 148 148 PHE H H 216 8.010 8.010 8.304 -0.294 18517 20451 1 17 . 1 1 149 149 ALA N N 217 118.990 118.990 119.885 -0.895 18517 20452 1 17 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.278 -0.168 18517 20453 1 17 . 1 1 149 149 ALA C C 217 177.330 177.330 177.694 -0.364 18517 20454 1 17 . 1 1 149 149 ALA CA C 217 53.750 53.750 52.892 0.859 18517 20455 1 17 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.730 -1.130 18517 20456 1 17 . 1 1 149 149 ALA H H 217 7.720 7.720 7.908 -0.188 18517 20457 1 17 . 1 1 150 150 ALA N N 218 118.690 118.690 120.966 -2.276 18517 20458 1 17 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.408 -0.048 18517 20459 1 17 . 1 1 150 150 ALA C C 218 177.930 177.930 177.538 0.392 18517 20460 1 17 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.574 -0.484 18517 20461 1 17 . 1 1 150 150 ALA CB C 218 19.740 19.740 20.123 -0.383 18517 20462 1 17 . 1 1 150 150 ALA H H 218 7.280 7.280 7.763 -0.483 18517 20463 1 17 . 1 1 151 151 LEU N N 219 119.980 119.980 121.095 -1.115 18517 20464 1 17 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.619 -0.349 18517 20465 1 17 . 1 1 151 151 LEU C C 219 176.150 176.150 175.353 0.797 18517 20466 1 17 . 1 1 151 151 LEU CA C 219 56.170 56.170 54.087 2.083 18517 20467 1 17 . 1 1 151 151 LEU CB C 219 42.810 42.810 44.138 -1.328 18517 20468 1 17 . 1 1 151 151 LEU H H 219 7.050 7.050 7.751 -0.701 18517 20469 1 17 . 1 1 152 152 THR N N 220 112.070 112.070 116.025 -3.955 18517 20470 1 17 . 1 1 152 152 THR HA H 220 4.700 4.700 4.870 -0.170 18517 20471 1 17 . 1 1 152 152 THR C C 220 173.400 173.400 173.243 0.157 18517 20472 1 17 . 1 1 152 152 THR CA C 220 58.190 58.190 58.478 -0.288 18517 20473 1 17 . 1 1 152 152 THR CB C 220 70.960 70.960 69.115 1.845 18517 20474 1 17 . 1 1 152 152 THR H H 220 8.040 8.040 8.258 -0.218 18517 20475 1 17 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.606 0.104 18517 20476 1 17 . 1 1 153 153 PRO C C 221 176.720 176.720 176.762 -0.042 18517 20477 1 17 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.406 0.504 18517 20478 1 17 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.442 1.808 18517 20479 1 17 . 1 1 154 154 THR N N 222 120.460 120.460 119.533 0.927 18517 20480 1 17 . 1 1 154 154 THR HA H 222 4.250 4.250 4.353 -0.103 18517 20481 1 17 . 1 1 154 154 THR C C 222 175.190 175.190 175.025 0.165 18517 20482 1 17 . 1 1 154 154 THR CA C 222 64.650 64.650 62.174 2.476 18517 20483 1 17 . 1 1 154 154 THR CB C 222 70.410 70.410 68.478 1.932 18517 20484 1 17 . 1 1 154 154 THR H H 222 8.530 8.530 8.332 0.198 18517 20485 1 17 . 1 1 155 155 PHE N N 223 122.260 122.260 123.121 -0.861 18517 20486 1 17 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.671 0.319 18517 20487 1 17 . 1 1 155 155 PHE C C 223 172.560 172.560 175.095 -2.535 18517 20488 1 17 . 1 1 155 155 PHE CA C 223 56.770 56.770 57.382 -0.612 18517 20489 1 17 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.380 1.210 18517 20490 1 17 . 1 1 155 155 PHE H H 223 8.950 8.950 7.561 1.389 18517 20491 1 17 . 1 1 156 156 LEU N N 224 123.440 123.440 121.220 2.220 18517 20492 1 17 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.304 0.366 18517 20493 1 17 . 1 1 156 156 LEU C C 224 175.090 175.090 177.663 -2.573 18517 20494 1 17 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.208 -0.178 18517 20495 1 17 . 1 1 156 156 LEU CB C 224 46.300 46.300 42.464 3.836 18517 20496 1 17 . 1 1 156 156 LEU H H 224 7.210 7.210 7.053 0.157 18517 20497 1 17 . 1 1 157 157 THR N N 225 113.010 113.010 112.998 0.012 18517 20498 1 17 . 1 1 157 157 THR HA H 225 4.790 4.790 4.534 0.256 18517 20499 1 17 . 1 1 157 157 THR C C 225 176.130 176.130 175.084 1.046 18517 20500 1 17 . 1 1 157 157 THR CA C 225 59.860 59.860 60.917 -1.057 18517 20501 1 17 . 1 1 157 157 THR CB C 225 72.860 72.860 69.738 3.122 18517 20502 1 17 . 1 1 157 157 THR H H 225 9.200 9.200 8.214 0.986 18517 20503 1 17 . 1 1 158 158 SER N N 226 115.350 115.350 118.971 -3.621 18517 20504 1 17 . 1 1 158 158 SER C C 226 177.410 177.410 175.781 1.629 18517 20505 1 17 . 1 1 158 158 SER CA C 226 57.400 57.400 58.215 -0.815 18517 20506 1 17 . 1 1 158 158 SER CB C 226 66.200 66.200 63.583 2.618 18517 20507 1 17 . 1 1 158 158 SER H H 226 8.830 8.830 8.643 0.187 18517 20508 1 17 . 1 1 159 159 GLU N N 227 121.200 121.200 122.782 -1.582 18517 20509 1 17 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.852 0.169 18517 20510 1 17 . 1 1 159 159 GLU C C 227 177.680 177.680 177.627 0.053 18517 20511 1 17 . 1 1 159 159 GLU CA C 227 59.500 59.500 59.054 0.446 18517 20512 1 17 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.401 0.169 18517 20513 1 17 . 1 1 159 159 GLU H H 227 8.320 8.320 9.000 -0.680 18517 20514 1 17 . 1 1 160 160 ASP N N 228 115.350 115.350 118.576 -3.226 18517 20515 1 17 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.428 0.122 18517 20516 1 17 . 1 1 160 160 ASP C C 228 177.640 177.640 178.227 -0.587 18517 20517 1 17 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.986 0.414 18517 20518 1 17 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.639 2.410 18517 20519 1 17 . 1 1 160 160 ASP H H 228 7.570 7.570 8.394 -0.824 18517 20520 1 17 . 1 1 161 161 ILE N N 229 108.150 108.150 115.499 -7.349 18517 20521 1 17 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.297 0.213 18517 20522 1 17 . 1 1 161 161 ILE C C 229 173.130 173.130 177.723 -4.593 18517 20523 1 17 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.788 -1.498 18517 20524 1 17 . 1 1 161 161 ILE CB C 229 39.400 39.400 38.660 0.740 18517 20525 1 17 . 1 1 161 161 ILE H H 229 7.190 7.190 7.753 -0.563 18517 20526 1 17 . 1 1 162 162 SER N N 230 115.290 115.290 117.217 -1.927 18517 20527 1 17 . 1 1 162 162 SER HA H 230 4.760 4.760 4.432 0.328 18517 20528 1 17 . 1 1 162 162 SER C C 230 176.060 176.060 173.994 2.066 18517 20529 1 17 . 1 1 162 162 SER CA C 230 57.920 57.920 58.336 -0.416 18517 20530 1 17 . 1 1 162 162 SER CB C 230 66.120 66.120 62.518 3.602 18517 20531 1 17 . 1 1 162 162 SER H H 230 7.460 7.460 8.360 -0.900 18517 20532 1 17 . 1 1 163 163 GLY C C 231 173.260 173.260 173.396 -0.136 18517 20533 1 17 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.654 0.896 18517 20534 1 17 . 1 1 164 164 TYR N N 232 115.290 115.290 119.559 -4.269 18517 20535 1 17 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.750 -0.050 18517 20536 1 17 . 1 1 164 164 TYR C C 232 172.820 172.820 174.481 -1.661 18517 20537 1 17 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.543 -0.443 18517 20538 1 17 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.511 0.288 18517 20539 1 17 . 1 1 164 164 TYR H H 232 7.370 7.370 7.129 0.241 18517 20540 1 17 . 1 1 165 165 LEU N N 233 120.980 120.980 122.532 -1.552 18517 20541 1 17 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.569 -0.139 18517 20542 1 17 . 1 1 165 165 LEU C C 233 176.360 176.360 177.720 -1.360 18517 20543 1 17 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.111 1.549 18517 20544 1 17 . 1 1 165 165 LEU CB C 233 40.430 40.430 39.960 0.470 18517 20545 1 17 . 1 1 165 165 LEU H H 233 8.830 8.830 8.893 -0.063 18517 20546 1 17 . 1 1 166 166 THR N N 234 116.170 116.170 114.864 1.306 18517 20547 1 17 . 1 1 166 166 THR HA H 234 4.010 4.010 3.483 0.527 18517 20548 1 17 . 1 1 166 166 THR C C 234 173.070 173.070 173.701 -0.631 18517 20549 1 17 . 1 1 166 166 THR CA C 234 62.910 62.910 63.724 -0.814 18517 20550 1 17 . 1 1 166 166 THR CB C 234 70.170 70.170 68.787 1.383 18517 20551 1 17 . 1 1 166 166 THR H H 234 8.050 8.050 7.897 0.153 18517 20552 1 17 . 1 1 167 167 VAL N N 235 117.640 117.640 115.752 1.888 18517 20553 1 17 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.352 -0.142 18517 20554 1 17 . 1 1 167 167 VAL C C 235 172.330 172.330 173.451 -1.121 18517 20555 1 17 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.491 1.259 18517 20556 1 17 . 1 1 167 167 VAL CB C 235 35.880 35.880 31.923 3.957 18517 20557 1 17 . 1 1 167 167 VAL H H 235 7.160 7.160 7.419 -0.259 18517 20558 1 17 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.531 -0.341 18517 20559 1 17 . 1 1 168 168 PRO C C 236 173.710 173.710 175.594 -1.884 18517 20560 1 17 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.617 1.214 18517 20561 1 17 . 1 1 168 168 PRO CB C 236 32.270 32.270 32.820 -0.550 18517 20562 1 17 . 1 1 169 169 GLU N N 237 113.540 113.540 118.641 -5.101 18517 20563 1 17 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.125 0.255 18517 20564 1 17 . 1 1 169 169 GLU C C 237 176.690 176.690 178.358 -1.668 18517 20565 1 17 . 1 1 169 169 GLU CA C 237 53.750 53.750 55.277 -1.527 18517 20566 1 17 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.632 2.588 18517 20567 1 17 . 1 1 169 169 GLU H H 237 7.930 7.930 8.306 -0.376 18517 20568 1 17 . 1 1 170 170 TYR N N 238 119.400 119.400 121.168 -1.768 18517 20569 1 17 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.310 -0.310 18517 20570 1 17 . 1 1 170 170 TYR C C 238 177.610 177.610 176.787 0.823 18517 20571 1 17 . 1 1 170 170 TYR CA C 238 62.630 62.630 60.098 2.532 18517 20572 1 17 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.587 -0.847 18517 20573 1 17 . 1 1 170 170 TYR H H 238 8.490 8.490 8.852 -0.362 18517 20574 1 17 . 1 1 171 171 GLY N N 239 104.160 104.160 104.789 -0.629 18517 20575 1 17 . 1 1 171 171 GLY C C 239 173.350 173.350 173.389 -0.039 18517 20576 1 17 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.130 1.139 18517 20577 1 17 . 1 1 171 171 GLY H H 239 7.960 7.960 8.161 -0.201 18517 20578 1 17 . 1 1 172 172 ALA N N 240 121.860 121.860 123.570 -1.710 18517 20579 1 17 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.803 -0.633 18517 20580 1 17 . 1 1 172 172 ALA C C 240 172.160 172.160 175.005 -2.845 18517 20581 1 17 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.224 0.887 18517 20582 1 17 . 1 1 172 172 ALA CB C 240 20.930 20.930 20.029 0.901 18517 20583 1 17 . 1 1 172 172 ALA H H 240 6.910 6.910 7.781 -0.871 18517 20584 1 17 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.729 0.821 18517 20585 1 17 . 1 1 173 173 PRO C C 241 176.610 176.610 175.113 1.497 18517 20586 1 17 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.162 -0.642 18517 20587 1 17 . 1 1 173 173 PRO CB C 241 33.300 33.300 31.496 1.804 18517 20588 1 17 . 1 1 174 174 MET N N 242 114.000 114.000 124.784 -10.784 18517 20589 1 17 . 1 1 174 174 MET HA H 242 4.390 4.390 4.359 0.031 18517 20590 1 17 . 1 1 174 174 MET C C 242 173.960 173.960 175.725 -1.765 18517 20591 1 17 . 1 1 174 174 MET CA C 242 54.660 54.660 53.917 0.743 18517 20592 1 17 . 1 1 174 174 MET CB C 242 34.170 34.170 33.836 0.334 18517 20593 1 17 . 1 1 174 174 MET H H 242 8.040 8.040 7.762 0.278 18517 20594 1 17 . 1 1 175 175 ASN N N 243 119.570 119.570 126.248 -6.678 18517 20595 1 17 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.581 0.359 18517 20596 1 17 . 1 1 175 175 ASN C C 243 174.320 174.320 175.235 -0.915 18517 20597 1 17 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.311 0.769 18517 20598 1 17 . 1 1 175 175 ASN CB C 243 38.850 38.850 38.154 0.696 18517 20599 1 17 . 1 1 175 175 ASN H H 243 7.960 7.960 8.622 -0.662 18517 20600 1 17 . 1 1 176 176 ALA N N 244 132.250 132.250 127.667 4.583 18517 20601 1 17 . 1 1 176 176 ALA C C 244 181.580 181.580 178.684 2.896 18517 20602 1 17 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.242 0.528 18517 20603 1 17 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.537 0.493 18517 20604 1 17 . 1 1 176 176 ALA H H 244 12.110 12.110 8.060 4.050 18517 20605 1 17 . 1 1 177 177 ALA N N 245 125.780 125.780 121.858 3.922 18517 20606 1 17 . 1 1 177 177 ALA HA H 245 3.870 3.870 4.023 -0.153 18517 20607 1 17 . 1 1 177 177 ALA C C 245 180.640 180.640 179.684 0.956 18517 20608 1 17 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.127 0.533 18517 20609 1 17 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.035 -0.195 18517 20610 1 17 . 1 1 177 177 ALA H H 245 10.240 10.240 8.347 1.893 18517 20611 1 17 . 1 1 178 178 LYS N N 246 119.810 119.810 119.174 0.636 18517 20612 1 17 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.139 -0.309 18517 20613 1 17 . 1 1 178 178 LYS C C 246 180.500 180.500 178.274 2.226 18517 20614 1 17 . 1 1 178 178 LYS CA C 246 59.900 59.900 58.715 1.185 18517 20615 1 17 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.190 -0.870 18517 20616 1 17 . 1 1 178 178 LYS H H 246 8.470 8.470 7.870 0.600 18517 20617 1 17 . 1 1 179 179 TRP N N 247 121.170 121.170 121.707 -0.537 18517 20618 1 17 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.415 0.205 18517 20619 1 17 . 1 1 179 179 TRP C C 247 176.510 176.510 178.186 -1.676 18517 20620 1 17 . 1 1 179 179 TRP CA C 247 59.820 59.820 60.090 -0.270 18517 20621 1 17 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.732 -0.162 18517 20622 1 17 . 1 1 179 179 TRP H H 247 8.330 8.330 8.259 0.071 18517 20623 1 17 . 1 1 180 180 ALA N N 248 119.130 119.130 120.453 -1.323 18517 20624 1 17 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.839 0.701 18517 20625 1 17 . 1 1 180 180 ALA C C 248 182.110 182.110 179.580 2.530 18517 20626 1 17 . 1 1 180 180 ALA CA C 248 54.190 54.190 55.298 -1.108 18517 20627 1 17 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.089 0.621 18517 20628 1 17 . 1 1 180 180 ALA H H 248 7.990 7.990 8.634 -0.644 18517 20629 1 17 . 1 1 181 181 LYS N N 249 116.000 116.000 119.370 -3.370 18517 20630 1 17 . 1 1 181 181 LYS HA H 249 3.970 3.970 3.976 -0.006 18517 20631 1 17 . 1 1 181 181 LYS C C 249 179.380 179.380 178.992 0.388 18517 20632 1 17 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.608 -0.898 18517 20633 1 17 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.547 -0.037 18517 20634 1 17 . 1 1 181 181 LYS H H 249 6.900 6.900 7.804 -0.904 18517 20635 1 17 . 1 1 182 182 VAL N N 250 122.270 122.270 116.325 5.945 18517 20636 1 17 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.837 -0.497 18517 20637 1 17 . 1 1 182 182 VAL C C 250 178.160 178.160 178.068 0.092 18517 20638 1 17 . 1 1 182 182 VAL CA C 250 66.760 66.760 65.539 1.221 18517 20639 1 17 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.153 -0.313 18517 20640 1 17 . 1 1 182 182 VAL H H 250 7.050 7.050 8.259 -1.209 18517 20641 1 17 . 1 1 183 183 GLU N N 251 120.520 120.520 120.637 -0.117 18517 20642 1 17 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.889 -0.709 18517 20643 1 17 . 1 1 183 183 GLU C C 251 179.480 179.480 178.901 0.579 18517 20644 1 17 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.383 1.308 18517 20645 1 17 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.715 -0.645 18517 20646 1 17 . 1 1 183 183 GLU H H 251 8.020 8.020 8.473 -0.453 18517 20647 1 17 . 1 1 184 184 GLY N N 252 102.930 102.930 106.875 -3.945 18517 20648 1 17 . 1 1 184 184 GLY C C 252 176.920 176.920 176.639 0.281 18517 20649 1 17 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.115 0.295 18517 20650 1 17 . 1 1 184 184 GLY H H 252 7.830 7.830 8.199 -0.369 18517 20651 1 17 . 1 1 185 185 MET N N 253 123.200 123.200 122.015 1.185 18517 20652 1 17 . 1 1 185 185 MET HA H 253 4.250 4.250 4.085 0.165 18517 20653 1 17 . 1 1 185 185 MET C C 253 179.370 179.370 178.437 0.933 18517 20654 1 17 . 1 1 185 185 MET CA C 253 59.300 59.300 59.451 -0.151 18517 20655 1 17 . 1 1 185 185 MET CB C 253 33.930 33.930 32.619 1.311 18517 20656 1 17 . 1 1 185 185 MET H H 253 7.890 7.890 7.938 -0.048 18517 20657 1 17 . 1 1 186 186 ILE N N 254 120.150 120.150 119.869 0.281 18517 20658 1 17 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.646 -0.086 18517 20659 1 17 . 1 1 186 186 ILE C C 254 177.250 177.250 178.089 -0.839 18517 20660 1 17 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.709 0.811 18517 20661 1 17 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.692 0.598 18517 20662 1 17 . 1 1 186 186 ILE H H 254 8.260 8.260 8.622 -0.362 18517 20663 1 17 . 1 1 187 187 HIS N N 255 119.810 119.810 119.018 0.792 18517 20664 1 17 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.206 -0.206 18517 20665 1 17 . 1 1 187 187 HIS C C 255 176.460 176.460 177.253 -0.793 18517 20666 1 17 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.779 0.551 18517 20667 1 17 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.824 1.806 18517 20668 1 17 . 1 1 187 187 HIS H H 255 8.900 8.900 8.873 0.027 18517 20669 1 17 . 1 1 188 188 GLY N N 256 103.160 103.160 107.059 -3.899 18517 20670 1 17 . 1 1 188 188 GLY C C 256 176.320 176.320 175.758 0.562 18517 20671 1 17 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.702 0.188 18517 20672 1 17 . 1 1 188 188 GLY H H 256 8.030 8.030 8.145 -0.115 18517 20673 1 17 . 1 1 189 189 LYS N N 257 119.510 119.510 120.759 -1.249 18517 20674 1 17 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.071 -0.071 18517 20675 1 17 . 1 1 189 189 LYS C C 257 178.660 178.660 178.849 -0.189 18517 20676 1 17 . 1 1 189 189 LYS CA C 257 56.490 56.490 56.644 -0.154 18517 20677 1 17 . 1 1 189 189 LYS CB C 257 31.550 31.550 32.009 -0.459 18517 20678 1 17 . 1 1 189 189 LYS H H 257 7.120 7.120 7.654 -0.534 18517 20679 1 17 . 1 1 190 190 LEU N N 258 120.570 120.570 120.311 0.259 18517 20680 1 17 . 1 1 190 190 LEU HA H 258 3.930 3.930 3.962 -0.032 18517 20681 1 17 . 1 1 190 190 LEU C C 258 177.230 177.230 177.088 0.142 18517 20682 1 17 . 1 1 190 190 LEU CA C 258 57.520 57.520 56.834 0.686 18517 20683 1 17 . 1 1 190 190 LEU CB C 258 42.970 42.970 41.846 1.123 18517 20684 1 17 . 1 1 190 190 LEU H H 258 8.060 8.060 8.245 -0.185 18517 20685 1 17 . 1 1 191 191 GLU N N 259 114.590 114.590 114.962 -0.372 18517 20686 1 17 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.010 0.270 18517 20687 1 17 . 1 1 191 191 GLU C C 259 176.230 176.230 176.719 -0.489 18517 20688 1 17 . 1 1 191 191 GLU CA C 259 55.340 55.340 56.620 -1.280 18517 20689 1 17 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.598 -0.268 18517 20690 1 17 . 1 1 191 191 GLU H H 259 7.330 7.330 7.753 -0.423 18517 20691 1 17 . 1 1 192 192 SER N N 260 115.240 115.240 117.687 -2.447 18517 20692 1 17 . 1 1 192 192 SER HA H 260 4.490 4.490 4.472 0.018 18517 20693 1 17 . 1 1 192 192 SER C C 260 173.770 173.770 175.032 -1.262 18517 20694 1 17 . 1 1 192 192 SER CA C 260 58.350 58.350 58.905 -0.555 18517 20695 1 17 . 1 1 192 192 SER CB C 260 65.090 65.090 63.820 1.270 18517 20696 1 17 . 1 1 192 192 SER H H 260 7.130 7.130 7.647 -0.517 18517 20697 1 17 . 1 1 193 193 SER C C 261 174.600 174.600 175.214 -0.614 18517 20698 1 17 . 1 1 193 193 SER CA C 261 59.980 59.980 60.553 -0.573 18517 20699 1 17 . 1 1 193 193 SER CB C 261 63.750 63.750 63.492 0.258 18517 20700 1 17 . 1 1 194 194 GLU N N 262 121.800 121.800 121.085 0.715 18517 20701 1 17 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.484 -0.014 18517 20702 1 17 . 1 1 194 194 GLU C C 262 174.650 174.650 174.836 -0.186 18517 20703 1 17 . 1 1 194 194 GLU CA C 262 55.620 55.620 55.623 -0.003 18517 20704 1 17 . 1 1 194 194 GLU CB C 262 30.210 30.210 30.496 -0.286 18517 20705 1 17 . 1 1 194 194 GLU H H 262 7.840 7.840 7.818 0.022 18517 20706 1 17 . 1 1 195 195 VAL N N 263 124.080 124.080 126.305 -2.225 18517 20707 1 17 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.439 -0.189 18517 20708 1 17 . 1 1 195 195 VAL C C 263 174.460 174.460 173.908 0.552 18517 20709 1 17 . 1 1 195 195 VAL CA C 263 59.820 59.820 58.102 1.718 18517 20710 1 17 . 1 1 195 195 VAL CB C 263 33.620 33.620 34.364 -0.744 18517 20711 1 17 . 1 1 195 195 VAL H H 263 8.020 8.020 8.219 -0.199 18517 20712 1 17 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.463 0.057 18517 20713 1 17 . 1 1 198 198 ASN C C 266 176.490 176.490 177.235 -0.745 18517 20714 1 17 . 1 1 198 198 ASN CA C 266 54.780 54.780 55.963 -1.183 18517 20715 1 17 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.768 0.292 18517 20716 1 17 . 1 1 199 199 LEU N N 267 120.680 120.680 121.570 -0.890 18517 20717 1 17 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.919 0.091 18517 20718 1 17 . 1 1 199 199 LEU C C 267 178.050 178.050 177.825 0.225 18517 20719 1 17 . 1 1 199 199 LEU CA C 267 58.830 58.830 57.262 1.568 18517 20720 1 17 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.646 0.694 18517 20721 1 17 . 1 1 199 199 LEU H H 267 7.660 7.660 7.347 0.313 18517 20722 1 17 . 1 1 200 200 LYS N N 268 116.740 116.740 119.815 -3.075 18517 20723 1 17 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.891 -0.161 18517 20724 1 17 . 1 1 200 200 LYS C C 268 178.520 178.520 178.704 -0.184 18517 20725 1 17 . 1 1 200 200 LYS CA C 268 61.800 61.800 59.825 1.974 18517 20726 1 17 . 1 1 200 200 LYS CB C 268 32.110 32.110 32.324 -0.214 18517 20727 1 17 . 1 1 200 200 LYS H H 268 8.280 8.280 8.662 -0.382 18517 20728 1 17 . 1 1 201 201 ALA N N 269 121.270 121.270 122.228 -0.958 18517 20729 1 17 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.119 0.121 18517 20730 1 17 . 1 1 201 201 ALA C C 269 180.890 180.890 179.680 1.210 18517 20731 1 17 . 1 1 201 201 ALA CA C 269 55.180 55.180 54.975 0.205 18517 20732 1 17 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.153 0.317 18517 20733 1 17 . 1 1 201 201 ALA H H 269 7.710 7.710 7.840 -0.130 18517 20734 1 17 . 1 1 202 202 LEU N N 270 119.980 119.980 119.440 0.540 18517 20735 1 17 . 1 1 202 202 LEU HA H 270 4.090 4.090 4.138 -0.048 18517 20736 1 17 . 1 1 202 202 LEU C C 270 179.330 179.330 179.600 -0.270 18517 20737 1 17 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.620 0.450 18517 20738 1 17 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.137 1.283 18517 20739 1 17 . 1 1 202 202 LEU H H 270 7.750 7.750 7.962 -0.212 18517 20740 1 17 . 1 1 203 203 VAL N N 271 118.450 118.450 116.507 1.943 18517 20741 1 17 . 1 1 203 203 VAL HA H 271 3.830 3.830 4.006 -0.176 18517 20742 1 17 . 1 1 203 203 VAL C C 271 177.110 177.110 177.475 -0.365 18517 20743 1 17 . 1 1 203 203 VAL CA C 271 67.710 67.710 66.065 1.645 18517 20744 1 17 . 1 1 203 203 VAL CB C 271 31.710 31.710 30.556 1.154 18517 20745 1 17 . 1 1 203 203 VAL H H 271 8.560 8.560 8.344 0.216 18517 20746 1 17 . 1 1 204 204 ALA N N 272 122.560 122.560 122.880 -0.320 18517 20747 1 17 . 1 1 204 204 ALA HA H 272 3.880 3.880 3.978 -0.098 18517 20748 1 17 . 1 1 204 204 ALA C C 272 178.700 178.700 179.843 -1.143 18517 20749 1 17 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.397 0.733 18517 20750 1 17 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.037 0.353 18517 20751 1 17 . 1 1 204 204 ALA H H 272 8.120 8.120 8.051 0.069 18517 20752 1 17 . 1 1 205 205 GLU N N 273 117.290 117.290 119.078 -1.788 18517 20753 1 17 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.061 -0.071 18517 20754 1 17 . 1 1 205 205 GLU C C 273 178.630 178.630 178.950 -0.320 18517 20755 1 17 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.106 1.034 18517 20756 1 17 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.630 0.340 18517 20757 1 17 . 1 1 205 205 GLU H H 273 7.670 7.670 8.200 -0.530 18517 20758 1 17 . 1 1 206 206 LEU N N 274 120.450 120.450 122.140 -1.690 18517 20759 1 17 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.037 -0.037 18517 20760 1 17 . 1 1 206 206 LEU C C 274 178.400 178.400 178.424 -0.024 18517 20761 1 17 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.010 0.900 18517 20762 1 17 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.818 1.712 18517 20763 1 17 . 1 1 206 206 LEU H H 274 8.420 8.420 8.297 0.123 18517 20764 1 17 . 1 1 207 207 ILE N N 275 117.580 117.580 120.262 -2.682 18517 20765 1 17 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.503 0.027 18517 20766 1 17 . 1 1 207 207 ILE C C 275 178.850 178.850 177.908 0.942 18517 20767 1 17 . 1 1 207 207 ILE CA C 275 66.080 66.080 66.229 -0.149 18517 20768 1 17 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.681 1.089 18517 20769 1 17 . 1 1 207 207 ILE H H 275 8.700 8.700 8.647 0.053 18517 20770 1 17 . 1 1 208 208 GLU N N 276 119.100 119.100 120.437 -1.337 18517 20771 1 17 . 1 1 208 208 GLU HA H 276 4.000 4.000 3.964 0.036 18517 20772 1 17 . 1 1 208 208 GLU C C 276 178.540 178.540 179.220 -0.680 18517 20773 1 17 . 1 1 208 208 GLU CA C 276 60.450 60.450 60.004 0.446 18517 20774 1 17 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.780 0.740 18517 20775 1 17 . 1 1 208 208 GLU H H 276 7.950 7.950 8.055 -0.105 18517 20776 1 17 . 1 1 209 209 LEU N N 277 120.590 120.590 118.772 1.818 18517 20777 1 17 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.176 0.044 18517 20778 1 17 . 1 1 209 209 LEU C C 277 179.520 179.520 179.558 -0.038 18517 20779 1 17 . 1 1 209 209 LEU CA C 277 58.350 58.350 58.048 0.302 18517 20780 1 17 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.331 1.959 18517 20781 1 17 . 1 1 209 209 LEU H H 277 8.550 8.550 8.526 0.024 18517 20782 1 17 . 1 1 210 210 ARG N N 278 116.470 116.470 119.095 -2.625 18517 20783 1 17 . 1 1 210 210 ARG HA H 278 3.740 3.740 4.236 -0.496 18517 20784 1 17 . 1 1 210 210 ARG C C 278 179.190 179.190 178.767 0.423 18517 20785 1 17 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.190 2.490 18517 20786 1 17 . 1 1 210 210 ARG CB C 278 31.400 31.400 29.715 1.685 18517 20787 1 17 . 1 1 210 210 ARG H H 278 8.590 8.590 8.641 -0.051 18517 20788 1 17 . 1 1 211 211 ALA N N 279 120.470 120.470 124.055 -3.585 18517 20789 1 17 . 1 1 211 211 ALA HA H 279 3.910 3.910 3.991 -0.081 18517 20790 1 17 . 1 1 211 211 ALA C C 279 181.350 181.350 179.684 1.666 18517 20791 1 17 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.143 0.557 18517 20792 1 17 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.596 -1.315 18517 20793 1 17 . 1 1 211 211 ALA H H 279 8.050 8.050 8.384 -0.334 18517 20794 1 17 . 1 1 212 212 GLN N N 280 120.070 120.070 118.386 1.684 18517 20795 1 17 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.942 0.078 18517 20796 1 17 . 1 1 212 212 GLN C C 280 179.490 179.490 178.618 0.872 18517 20797 1 17 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.636 0.663 18517 20798 1 17 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.799 0.381 18517 20799 1 17 . 1 1 212 212 GLN H H 280 8.300 8.300 8.239 0.061 18517 20800 1 17 . 1 1 213 213 MET N N 281 119.810 119.810 119.848 -0.038 18517 20801 1 17 . 1 1 213 213 MET HA H 281 3.730 3.730 4.163 -0.433 18517 20802 1 17 . 1 1 213 213 MET C C 281 177.490 177.490 178.300 -0.810 18517 20803 1 17 . 1 1 213 213 MET CA C 281 60.690 60.690 58.346 2.345 18517 20804 1 17 . 1 1 213 213 MET CB C 281 33.930 33.930 32.557 1.373 18517 20805 1 17 . 1 1 213 213 MET H H 281 8.420 8.420 8.588 -0.168 18517 20806 1 17 . 1 1 214 214 MET N N 282 114.000 114.000 117.991 -3.991 18517 20807 1 17 . 1 1 214 214 MET HA H 282 3.880 3.880 4.266 -0.386 18517 20808 1 17 . 1 1 214 214 MET C C 282 177.650 177.650 177.942 -0.292 18517 20809 1 17 . 1 1 214 214 MET CA C 282 58.670 58.670 57.666 1.004 18517 20810 1 17 . 1 1 214 214 MET CB C 282 33.300 33.300 32.071 1.229 18517 20811 1 17 . 1 1 214 214 MET H H 282 7.890 7.890 8.201 -0.311 18517 20812 1 17 . 1 1 215 215 ALA N N 283 119.970 119.970 122.996 -3.026 18517 20813 1 17 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.252 -0.112 18517 20814 1 17 . 1 1 215 215 ALA C C 283 180.580 180.580 179.389 1.191 18517 20815 1 17 . 1 1 215 215 ALA CA C 283 54.110 54.110 54.865 -0.755 18517 20816 1 17 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.002 -0.322 18517 20817 1 17 . 1 1 215 215 ALA H H 283 7.580 7.580 8.176 -0.596 18517 20818 1 17 . 1 1 216 216 LEU N N 284 120.920 120.920 118.926 1.994 18517 20819 1 17 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.047 -0.087 18517 20820 1 17 . 1 1 216 216 LEU C C 284 177.910 177.910 179.419 -1.509 18517 20821 1 17 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.374 0.546 18517 20822 1 17 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.089 0.411 18517 20823 1 17 . 1 1 216 216 LEU H H 284 7.460 7.460 8.038 -0.578 18517 20824 1 17 . 1 1 217 217 LEU N N 285 116.470 116.470 121.801 -5.331 18517 20825 1 17 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.999 -0.319 18517 20826 1 17 . 1 1 217 217 LEU C C 285 178.310 178.310 178.285 0.025 18517 20827 1 17 . 1 1 217 217 LEU CA C 285 57.440 57.440 58.081 -0.641 18517 20828 1 17 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.506 1.544 18517 20829 1 17 . 1 1 217 217 LEU H H 285 6.980 6.980 8.528 -1.548 18517 20830 1 17 . 1 1 218 218 TYR N N 286 111.080 111.080 115.409 -4.329 18517 20831 1 17 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.937 -0.037 18517 20832 1 17 . 1 1 218 218 TYR C C 286 176.090 176.090 175.967 0.123 18517 20833 1 17 . 1 1 218 218 TYR CA C 286 56.050 56.050 56.888 -0.838 18517 20834 1 17 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.260 2.650 18517 20835 1 17 . 1 1 218 218 TYR H H 286 7.660 7.660 8.445 -0.785 18517 20836 1 17 . 1 1 219 219 GLY N N 287 108.260 108.260 110.435 -2.175 18517 20837 1 17 . 1 1 219 219 GLY CA C 287 44.320 44.320 42.909 1.411 18517 20838 1 17 . 1 1 219 219 GLY H H 287 7.750 7.750 7.568 0.182 18517 20839 1 17 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.791 -0.301 18517 20840 1 17 . 1 1 221 221 ILE CA C 289 63.580 63.580 63.030 0.550 18517 20841 1 17 . 1 1 221 221 ILE CB C 289 38.280 38.280 38.024 0.256 18517 20842 1 17 . 1 1 222 222 GLY CA C 290 45.740 45.740 44.550 1.190 18517 20843 1 18 . 1 1 2 2 LYS N N 70 126.600 126.600 123.802 2.798 18517 20844 1 18 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.872 -0.512 18517 20845 1 18 . 1 1 2 2 LYS C C 70 176.000 176.000 174.628 1.372 18517 20846 1 18 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.671 0.779 18517 20847 1 18 . 1 1 2 2 LYS CB C 70 33.850 33.850 34.983 -1.133 18517 20848 1 18 . 1 1 2 2 LYS H H 70 8.530 8.530 8.283 0.247 18517 20849 1 18 . 1 1 3 3 THR N N 71 111.030 111.030 114.439 -3.409 18517 20850 1 18 . 1 1 3 3 THR HA H 71 4.400 4.400 4.395 0.005 18517 20851 1 18 . 1 1 3 3 THR C C 71 175.650 175.650 174.610 1.040 18517 20852 1 18 . 1 1 3 3 THR CA C 71 60.610 60.610 61.367 -0.757 18517 20853 1 18 . 1 1 3 3 THR CB C 71 71.520 71.520 69.647 1.873 18517 20854 1 18 . 1 1 3 3 THR H H 71 7.390 7.390 8.100 -0.710 18517 20855 1 18 . 1 1 4 4 LEU N N 72 121.560 121.560 121.993 -0.433 18517 20856 1 18 . 1 1 4 4 LEU C C 72 177.870 177.870 178.284 -0.414 18517 20857 1 18 . 1 1 4 4 LEU CA C 72 58.480 58.480 59.148 -0.668 18517 20858 1 18 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.767 0.413 18517 20859 1 18 . 1 1 4 4 LEU H H 72 8.980 8.980 8.576 0.404 18517 20860 1 18 . 1 1 5 5 ASP N N 73 115.530 115.530 117.724 -2.194 18517 20861 1 18 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.336 -0.006 18517 20862 1 18 . 1 1 5 5 ASP C C 73 179.290 179.290 178.464 0.826 18517 20863 1 18 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.255 0.585 18517 20864 1 18 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.532 0.298 18517 20865 1 18 . 1 1 5 5 ASP H H 73 8.270 8.270 8.705 -0.435 18517 20866 1 18 . 1 1 6 6 VAL N N 74 122.330 122.330 118.867 3.463 18517 20867 1 18 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.633 0.107 18517 20868 1 18 . 1 1 6 6 VAL C C 74 178.970 178.970 177.928 1.042 18517 20869 1 18 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.681 0.679 18517 20870 1 18 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.812 0.138 18517 20871 1 18 . 1 1 6 6 VAL H H 74 7.400 7.400 7.144 0.256 18517 20872 1 18 . 1 1 7 7 LEU N N 75 121.360 121.360 120.636 0.724 18517 20873 1 18 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.909 0.121 18517 20874 1 18 . 1 1 7 7 LEU C C 75 179.240 179.240 179.155 0.085 18517 20875 1 18 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.429 -0.199 18517 20876 1 18 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.329 1.561 18517 20877 1 18 . 1 1 7 7 LEU H H 75 8.300 8.300 8.585 -0.285 18517 20878 1 18 . 1 1 8 8 ARG N N 76 117.230 117.230 118.120 -0.890 18517 20879 1 18 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.108 -0.188 18517 20880 1 18 . 1 1 8 8 ARG C C 76 178.290 178.290 179.198 -0.908 18517 20881 1 18 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.475 1.295 18517 20882 1 18 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.810 0.400 18517 20883 1 18 . 1 1 8 8 ARG H H 76 8.520 8.520 8.841 -0.321 18517 20884 1 18 . 1 1 9 9 GLY N N 77 104.570 104.570 108.583 -4.013 18517 20885 1 18 . 1 1 9 9 GLY C C 77 176.180 176.180 176.116 0.064 18517 20886 1 18 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.814 0.356 18517 20887 1 18 . 1 1 9 9 GLY H H 77 7.620 7.620 8.500 -0.880 18517 20888 1 18 . 1 1 10 10 GLU N N 78 120.270 120.270 123.140 -2.870 18517 20889 1 18 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.163 0.107 18517 20890 1 18 . 1 1 10 10 GLU C C 78 179.030 179.030 179.197 -0.167 18517 20891 1 18 . 1 1 10 10 GLU CA C 78 58.870 58.870 58.864 0.006 18517 20892 1 18 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.244 2.156 18517 20893 1 18 . 1 1 10 10 GLU H H 78 8.100 8.100 8.330 -0.230 18517 20894 1 18 . 1 1 11 11 LEU N N 79 116.000 116.000 120.379 -4.379 18517 20895 1 18 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.954 0.556 18517 20896 1 18 . 1 1 11 11 LEU C C 79 179.630 179.630 178.890 0.740 18517 20897 1 18 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.019 -1.329 18517 20898 1 18 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.508 3.292 18517 20899 1 18 . 1 1 11 11 LEU H H 79 8.230 8.230 8.479 -0.249 18517 20900 1 18 . 1 1 12 12 ARG N N 80 120.020 120.020 119.684 0.336 18517 20901 1 18 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.876 -0.126 18517 20902 1 18 . 1 1 12 12 ARG C C 80 178.490 178.490 178.644 -0.154 18517 20903 1 18 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.855 2.146 18517 20904 1 18 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.971 1.269 18517 20905 1 18 . 1 1 12 12 ARG H H 80 8.210 8.210 8.285 -0.075 18517 20906 1 18 . 1 1 13 13 GLY N N 81 108.090 108.090 107.112 0.978 18517 20907 1 18 . 1 1 13 13 GLY C C 81 173.540 173.540 176.590 -3.050 18517 20908 1 18 . 1 1 13 13 GLY CA C 81 48.000 48.000 47.181 0.819 18517 20909 1 18 . 1 1 13 13 GLY H H 81 8.890 8.890 8.679 0.211 18517 20910 1 18 . 1 1 14 14 GLN C C 82 179.540 179.540 178.520 1.020 18517 20911 1 18 . 1 1 14 14 GLN CA C 82 58.710 58.710 58.657 0.053 18517 20912 1 18 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.136 0.964 18517 20913 1 18 . 1 1 15 15 ARG N N 83 118.220 118.220 120.982 -2.762 18517 20914 1 18 . 1 1 15 15 ARG HA H 83 3.950 3.950 3.936 0.014 18517 20915 1 18 . 1 1 15 15 ARG C C 83 177.710 177.710 178.470 -0.760 18517 20916 1 18 . 1 1 15 15 ARG CA C 83 59.900 59.900 60.343 -0.443 18517 20917 1 18 . 1 1 15 15 ARG CB C 83 29.650 29.650 30.163 -0.513 18517 20918 1 18 . 1 1 15 15 ARG H H 83 7.320 7.320 8.554 -1.234 18517 20919 1 18 . 1 1 16 16 GLU N N 84 118.810 118.810 118.858 -0.048 18517 20920 1 18 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.103 -0.253 18517 20921 1 18 . 1 1 16 16 GLU C C 84 178.750 178.750 178.933 -0.183 18517 20922 1 18 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.465 1.545 18517 20923 1 18 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.641 -0.231 18517 20924 1 18 . 1 1 16 16 GLU H H 84 8.450 8.450 8.458 -0.008 18517 20925 1 18 . 1 1 17 17 ALA N N 85 122.790 122.790 122.590 0.200 18517 20926 1 18 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.113 0.077 18517 20927 1 18 . 1 1 17 17 ALA C C 85 180.360 180.360 179.282 1.078 18517 20928 1 18 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.247 0.213 18517 20929 1 18 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.480 -0.400 18517 20930 1 18 . 1 1 17 17 ALA H H 85 8.420 8.420 8.371 0.049 18517 20931 1 18 . 1 1 18 18 PHE N N 86 119.400 119.400 120.594 -1.194 18517 20932 1 18 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.172 0.118 18517 20933 1 18 . 1 1 18 18 PHE C C 86 177.560 177.560 177.637 -0.077 18517 20934 1 18 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.813 -0.173 18517 20935 1 18 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.287 0.353 18517 20936 1 18 . 1 1 18 18 PHE H H 86 7.490 7.490 8.372 -0.882 18517 20937 1 18 . 1 1 19 19 LEU N N 87 117.470 117.470 120.182 -2.712 18517 20938 1 18 . 1 1 19 19 LEU HA H 87 4.070 4.070 3.829 0.241 18517 20939 1 18 . 1 1 19 19 LEU C C 87 178.880 178.880 178.306 0.574 18517 20940 1 18 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.819 -0.859 18517 20941 1 18 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.938 0.162 18517 20942 1 18 . 1 1 19 19 LEU H H 87 8.010 8.010 9.061 -1.051 18517 20943 1 18 . 1 1 20 20 SER N N 88 113.770 113.770 114.628 -0.858 18517 20944 1 18 . 1 1 20 20 SER HA H 88 4.070 4.070 4.073 -0.003 18517 20945 1 18 . 1 1 20 20 SER C C 88 175.680 175.680 176.942 -1.262 18517 20946 1 18 . 1 1 20 20 SER CA C 88 63.070 63.070 62.317 0.753 18517 20947 1 18 . 1 1 20 20 SER H H 88 8.100 8.100 8.273 -0.173 18517 20948 1 18 . 1 1 21 21 GLU N N 89 120.570 120.570 120.882 -0.312 18517 20949 1 18 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.086 -0.116 18517 20950 1 18 . 1 1 21 21 GLU C C 89 178.940 178.940 179.287 -0.347 18517 20951 1 18 . 1 1 21 21 GLU CA C 89 59.260 59.260 58.708 0.552 18517 20952 1 18 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.043 0.287 18517 20953 1 18 . 1 1 21 21 GLU H H 89 7.400 7.400 7.928 -0.528 18517 20954 1 18 . 1 1 22 22 ILE N N 90 119.350 119.350 120.381 -1.031 18517 20955 1 18 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.798 -0.108 18517 20956 1 18 . 1 1 22 22 ILE C C 90 177.230 177.230 178.396 -1.166 18517 20957 1 18 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.991 0.479 18517 20958 1 18 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.638 -0.248 18517 20959 1 18 . 1 1 22 22 ILE H H 90 7.250 7.250 8.180 -0.930 18517 20960 1 18 . 1 1 23 23 ILE N N 91 116.350 116.350 119.529 -3.179 18517 20961 1 18 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.780 -0.380 18517 20962 1 18 . 1 1 23 23 ILE C C 91 176.690 176.690 177.388 -0.698 18517 20963 1 18 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.249 2.481 18517 20964 1 18 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.435 0.335 18517 20965 1 18 . 1 1 23 23 ILE H H 91 7.860 7.860 8.377 -0.517 18517 20966 1 18 . 1 1 24 24 LYS N N 92 116.000 116.000 118.872 -2.872 18517 20967 1 18 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.134 0.006 18517 20968 1 18 . 1 1 24 24 LYS C C 92 176.270 176.270 177.764 -1.494 18517 20969 1 18 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.605 -0.125 18517 20970 1 18 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.009 1.291 18517 20971 1 18 . 1 1 24 24 LYS H H 92 7.170 7.170 8.066 -0.896 18517 20972 1 18 . 1 1 25 25 SER N N 93 114.650 114.650 114.144 0.506 18517 20973 1 18 . 1 1 25 25 SER HA H 93 4.550 4.550 4.359 0.191 18517 20974 1 18 . 1 1 25 25 SER C C 93 173.370 173.370 173.461 -0.091 18517 20975 1 18 . 1 1 25 25 SER CA C 93 57.240 57.240 58.930 -1.690 18517 20976 1 18 . 1 1 25 25 SER CB C 93 65.650 65.650 64.339 1.311 18517 20977 1 18 . 1 1 25 25 SER H H 93 7.730 7.730 8.040 -0.310 18517 20978 1 18 . 1 1 26 26 ASP N N 94 121.230 121.230 114.764 6.466 18517 20979 1 18 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.688 0.242 18517 20980 1 18 . 1 1 26 26 ASP C C 94 176.560 176.560 175.766 0.794 18517 20981 1 18 . 1 1 26 26 ASP CA C 94 54.510 54.510 54.326 0.184 18517 20982 1 18 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.742 0.908 18517 20983 1 18 . 1 1 26 26 ASP H H 94 8.280 8.280 8.269 0.011 18517 20984 1 18 . 1 1 27 27 GLY N N 95 109.310 109.310 108.634 0.676 18517 20985 1 18 . 1 1 27 27 GLY C C 95 171.080 171.080 172.251 -1.171 18517 20986 1 18 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.810 -1.040 18517 20987 1 18 . 1 1 27 27 GLY H H 95 8.160 8.160 7.705 0.455 18517 20988 1 18 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.718 0.422 18517 20989 1 18 . 1 1 29 29 PHE C C 97 175.230 175.230 174.886 0.344 18517 20990 1 18 . 1 1 29 29 PHE CA C 97 56.490 56.490 55.940 0.550 18517 20991 1 18 . 1 1 29 29 PHE CB C 97 41.620 41.620 43.138 -1.518 18517 20992 1 18 . 1 1 30 30 THR N N 98 112.600 112.600 113.061 -0.461 18517 20993 1 18 . 1 1 30 30 THR HA H 98 4.570 4.570 4.442 0.128 18517 20994 1 18 . 1 1 30 30 THR C C 98 176.690 176.690 174.167 2.523 18517 20995 1 18 . 1 1 30 30 THR CA C 98 60.290 60.290 60.576 -0.286 18517 20996 1 18 . 1 1 30 30 THR CB C 98 71.600 71.600 71.959 -0.359 18517 20997 1 18 . 1 1 30 30 THR H H 98 8.990 8.990 8.775 0.215 18517 20998 1 18 . 1 1 31 31 ILE N N 99 119.240 119.240 124.540 -5.300 18517 20999 1 18 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.544 0.276 18517 21000 1 18 . 1 1 31 31 ILE C C 99 176.090 176.090 176.350 -0.260 18517 21001 1 18 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.979 -3.839 18517 21002 1 18 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.823 -0.873 18517 21003 1 18 . 1 1 31 31 ILE H H 99 9.230 9.230 8.052 1.178 18517 21004 1 18 . 1 1 32 32 LEU N N 100 119.660 119.660 120.429 -0.769 18517 21005 1 18 . 1 1 32 32 LEU HA H 100 4.030 4.030 3.923 0.107 18517 21006 1 18 . 1 1 32 32 LEU C C 100 181.050 181.050 178.544 2.506 18517 21007 1 18 . 1 1 32 32 LEU CA C 100 57.560 57.560 58.411 -0.851 18517 21008 1 18 . 1 1 32 32 LEU CB C 100 40.120 40.120 40.776 -0.656 18517 21009 1 18 . 1 1 32 32 LEU H H 100 7.310 7.310 8.251 -0.941 18517 21010 1 18 . 1 1 33 33 GLN N N 101 121.450 121.450 118.333 3.117 18517 21011 1 18 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.195 0.055 18517 21012 1 18 . 1 1 33 33 GLN CA C 101 59.700 59.700 59.090 0.610 18517 21013 1 18 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.216 3.574 18517 21014 1 18 . 1 1 33 33 GLN H H 101 7.790 7.790 8.068 -0.278 18517 21015 1 18 . 1 1 34 34 LEU C C 102 178.590 178.590 179.216 -0.626 18517 21016 1 18 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.011 0.619 18517 21017 1 18 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.479 -0.169 18517 21018 1 18 . 1 1 35 35 VAL N N 103 118.520 118.520 118.510 0.010 18517 21019 1 18 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.631 -0.211 18517 21020 1 18 . 1 1 35 35 VAL C C 103 177.930 177.930 178.205 -0.275 18517 21021 1 18 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.566 -0.526 18517 21022 1 18 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.562 1.068 18517 21023 1 18 . 1 1 35 35 VAL H H 103 8.670 8.670 8.298 0.372 18517 21024 1 18 . 1 1 36 36 GLY N N 104 109.430 109.430 108.955 0.475 18517 21025 1 18 . 1 1 36 36 GLY C C 104 174.600 174.600 175.603 -1.003 18517 21026 1 18 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.266 0.774 18517 21027 1 18 . 1 1 36 36 GLY H H 104 7.880 7.880 8.153 -0.273 18517 21028 1 18 . 1 1 37 37 TYR N N 105 122.270 122.270 124.148 -1.878 18517 21029 1 18 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.473 -0.593 18517 21030 1 18 . 1 1 37 37 TYR C C 105 176.310 176.310 177.084 -0.774 18517 21031 1 18 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.082 4.018 18517 21032 1 18 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.618 -0.249 18517 21033 1 18 . 1 1 37 37 TYR H H 105 8.170 8.170 8.263 -0.093 18517 21034 1 18 . 1 1 38 38 LEU N N 106 120.100 120.100 120.739 -0.639 18517 21035 1 18 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.714 0.026 18517 21036 1 18 . 1 1 38 38 LEU C C 106 178.280 178.280 178.499 -0.219 18517 21037 1 18 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.147 0.483 18517 21038 1 18 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.763 0.967 18517 21039 1 18 . 1 1 38 38 LEU H H 106 7.610 7.610 8.412 -0.802 18517 21040 1 18 . 1 1 39 39 ARG N N 107 116.670 116.670 119.083 -2.413 18517 21041 1 18 . 1 1 39 39 ARG HA H 107 3.680 3.680 4.012 -0.332 18517 21042 1 18 . 1 1 39 39 ARG C C 107 179.480 179.480 178.457 1.023 18517 21043 1 18 . 1 1 39 39 ARG CA C 107 59.580 59.580 58.095 1.485 18517 21044 1 18 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.225 2.015 18517 21045 1 18 . 1 1 39 39 ARG H H 107 8.240 8.240 7.963 0.277 18517 21046 1 18 . 1 1 40 40 VAL N N 108 121.970 121.970 120.124 1.846 18517 21047 1 18 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.617 -0.217 18517 21048 1 18 . 1 1 40 40 VAL C C 108 178.440 178.440 177.723 0.717 18517 21049 1 18 . 1 1 40 40 VAL CA C 108 67.950 67.950 67.507 0.442 18517 21050 1 18 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.676 -1.236 18517 21051 1 18 . 1 1 40 40 VAL H H 108 8.200 8.200 7.944 0.256 18517 21052 1 18 . 1 1 41 41 VAL N N 109 108.940 108.940 115.916 -6.976 18517 21053 1 18 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.893 0.347 18517 21054 1 18 . 1 1 41 41 VAL C C 109 175.070 175.070 177.662 -2.592 18517 21055 1 18 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.229 -2.639 18517 21056 1 18 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.834 -1.184 18517 21057 1 18 . 1 1 41 41 VAL H H 109 7.760 7.760 7.974 -0.214 18517 21058 1 18 . 1 1 42 42 ASP N N 110 124.670 124.670 120.534 4.136 18517 21059 1 18 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.209 0.411 18517 21060 1 18 . 1 1 42 42 ASP C C 110 177.310 177.310 178.024 -0.714 18517 21061 1 18 . 1 1 42 42 ASP CA C 110 59.980 59.980 58.192 1.788 18517 21062 1 18 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.775 4.176 18517 21063 1 18 . 1 1 42 42 ASP H H 110 7.360 7.360 8.051 -0.691 18517 21064 1 18 . 1 1 43 43 THR N N 111 102.340 102.340 114.138 -11.798 18517 21065 1 18 . 1 1 43 43 THR HA H 111 5.100 5.100 4.101 0.999 18517 21066 1 18 . 1 1 43 43 THR C C 111 174.940 174.940 176.568 -1.628 18517 21067 1 18 . 1 1 43 43 THR CA C 111 60.650 60.650 65.656 -5.006 18517 21068 1 18 . 1 1 43 43 THR CB C 111 69.610 69.610 68.637 0.973 18517 21069 1 18 . 1 1 43 43 THR H H 111 6.380 6.380 7.750 -1.370 18517 21070 1 18 . 1 1 44 44 ASP N N 112 119.750 119.750 122.379 -2.629 18517 21071 1 18 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.309 -0.449 18517 21072 1 18 . 1 1 44 44 ASP C C 112 178.850 178.850 178.332 0.518 18517 21073 1 18 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.575 0.655 18517 21074 1 18 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.254 -0.854 18517 21075 1 18 . 1 1 44 44 ASP H H 112 9.050 9.050 8.254 0.796 18517 21076 1 18 . 1 1 45 45 LEU N N 113 123.910 123.910 121.000 2.910 18517 21077 1 18 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.863 -0.053 18517 21078 1 18 . 1 1 45 45 LEU C C 113 182.040 182.040 178.453 3.587 18517 21079 1 18 . 1 1 45 45 LEU CA C 113 57.320 57.320 58.125 -0.805 18517 21080 1 18 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.696 -0.946 18517 21081 1 18 . 1 1 45 45 LEU H H 113 9.710 9.710 7.793 1.917 18517 21082 1 18 . 1 1 46 46 LEU N N 114 117.640 117.640 113.865 3.775 18517 21083 1 18 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.251 -0.141 18517 21084 1 18 . 1 1 46 46 LEU C C 114 179.540 179.540 178.343 1.197 18517 21085 1 18 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.313 0.247 18517 21086 1 18 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.758 -0.288 18517 21087 1 18 . 1 1 46 46 LEU H H 114 8.270 8.270 7.231 1.039 18517 21088 1 18 . 1 1 47 47 LEU N N 115 116.520 116.520 116.857 -0.337 18517 21089 1 18 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.363 -0.223 18517 21090 1 18 . 1 1 47 47 LEU C C 115 173.850 173.850 176.942 -3.092 18517 21091 1 18 . 1 1 47 47 LEU CA C 115 55.420 55.420 55.213 0.207 18517 21092 1 18 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.462 3.258 18517 21093 1 18 . 1 1 47 47 LEU H H 115 8.160 8.160 7.909 0.251 18517 21094 1 18 . 1 1 48 48 LYS N N 116 114.710 114.710 116.010 -1.300 18517 21095 1 18 . 1 1 48 48 LYS HA H 116 3.810 3.810 3.987 -0.177 18517 21096 1 18 . 1 1 48 48 LYS C C 116 176.510 176.510 176.174 0.336 18517 21097 1 18 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.788 0.412 18517 21098 1 18 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.461 -0.441 18517 21099 1 18 . 1 1 48 48 LYS H H 116 7.580 7.580 7.738 -0.158 18517 21100 1 18 . 1 1 49 49 VAL N N 117 119.050 119.050 115.750 3.300 18517 21101 1 18 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.230 -0.620 18517 21102 1 18 . 1 1 49 49 VAL C C 117 175.860 175.860 176.037 -0.177 18517 21103 1 18 . 1 1 49 49 VAL CA C 117 63.510 63.510 61.041 2.469 18517 21104 1 18 . 1 1 49 49 VAL CB C 117 32.350 32.350 33.222 -0.872 18517 21105 1 18 . 1 1 49 49 VAL H H 117 7.980 7.980 7.798 0.182 18517 21106 1 18 . 1 1 50 50 ASP N N 118 126.900 126.900 122.298 4.602 18517 21107 1 18 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.478 -0.228 18517 21108 1 18 . 1 1 50 50 ASP C C 118 177.700 177.700 177.124 0.576 18517 21109 1 18 . 1 1 50 50 ASP CA C 118 56.050 56.050 56.094 -0.044 18517 21110 1 18 . 1 1 50 50 ASP CB C 118 42.580 42.580 40.526 2.054 18517 21111 1 18 . 1 1 50 50 ASP H H 118 8.930 8.930 8.694 0.236 18517 21112 1 18 . 1 1 51 51 SER N N 119 124.790 124.790 119.559 5.231 18517 21113 1 18 . 1 1 51 51 SER HA H 119 4.070 4.070 4.188 -0.118 18517 21114 1 18 . 1 1 51 51 SER C C 119 177.220 177.220 176.171 1.049 18517 21115 1 18 . 1 1 51 51 SER CA C 119 61.640 61.640 61.740 -0.100 18517 21116 1 18 . 1 1 51 51 SER CB C 119 63.510 63.510 63.086 0.424 18517 21117 1 18 . 1 1 51 51 SER H H 119 8.560 8.560 8.765 -0.205 18517 21118 1 18 . 1 1 52 52 THR N N 120 119.880 119.880 113.063 6.817 18517 21119 1 18 . 1 1 52 52 THR HA H 120 4.190 4.190 4.142 0.048 18517 21120 1 18 . 1 1 52 52 THR C C 120 177.120 177.120 176.124 0.996 18517 21121 1 18 . 1 1 52 52 THR CA C 120 66.280 66.280 65.155 1.125 18517 21122 1 18 . 1 1 52 52 THR CB C 120 68.420 68.420 68.357 0.063 18517 21123 1 18 . 1 1 52 52 THR H H 120 8.310 8.310 8.127 0.183 18517 21124 1 18 . 1 1 53 53 LYS N N 121 122.270 122.270 121.785 0.485 18517 21125 1 18 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.273 -0.153 18517 21126 1 18 . 1 1 53 53 LYS C C 121 178.970 178.970 178.594 0.376 18517 21127 1 18 . 1 1 53 53 LYS CA C 121 59.580 59.580 58.764 0.816 18517 21128 1 18 . 1 1 53 53 LYS CB C 121 34.250 34.250 31.576 2.674 18517 21129 1 18 . 1 1 53 53 LYS H H 121 7.700 7.700 7.942 -0.242 18517 21130 1 18 . 1 1 54 54 VAL N N 122 120.070 120.070 121.922 -1.852 18517 21131 1 18 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.838 -0.408 18517 21132 1 18 . 1 1 54 54 VAL C C 122 179.860 179.860 177.265 2.595 18517 21133 1 18 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.850 2.730 18517 21134 1 18 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.468 1.352 18517 21135 1 18 . 1 1 54 54 VAL H H 122 7.890 7.890 8.363 -0.473 18517 21136 1 18 . 1 1 55 55 ASP N N 123 122.270 122.270 119.783 2.487 18517 21137 1 18 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.279 0.191 18517 21138 1 18 . 1 1 55 55 ASP C C 123 178.630 178.630 178.513 0.117 18517 21139 1 18 . 1 1 55 55 ASP CA C 123 57.800 57.800 58.285 -0.485 18517 21140 1 18 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.835 1.185 18517 21141 1 18 . 1 1 55 55 ASP H H 123 8.270 8.270 8.053 0.217 18517 21142 1 18 . 1 1 56 56 GLU N N 124 119.600 119.600 119.162 0.438 18517 21143 1 18 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.037 -0.067 18517 21144 1 18 . 1 1 56 56 GLU C C 124 179.920 179.920 178.982 0.938 18517 21145 1 18 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.190 0.870 18517 21146 1 18 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.404 0.566 18517 21147 1 18 . 1 1 56 56 GLU H H 124 8.610 8.610 8.082 0.528 18517 21148 1 18 . 1 1 57 57 ALA N N 125 120.070 120.070 122.212 -2.142 18517 21149 1 18 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.029 -0.199 18517 21150 1 18 . 1 1 57 57 ALA C C 125 178.760 178.760 179.711 -0.951 18517 21151 1 18 . 1 1 57 57 ALA CA C 125 55.380 55.380 55.010 0.370 18517 21152 1 18 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.514 1.626 18517 21153 1 18 . 1 1 57 57 ALA H H 125 8.420 8.420 8.402 0.018 18517 21154 1 18 . 1 1 58 58 GLY N N 126 106.740 106.740 106.053 0.687 18517 21155 1 18 . 1 1 58 58 GLY C C 126 175.740 175.740 175.978 -0.238 18517 21156 1 18 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.612 0.678 18517 21157 1 18 . 1 1 58 58 GLY H H 126 8.200 8.200 8.679 -0.479 18517 21158 1 18 . 1 1 59 59 LYS N N 127 120.920 120.920 121.704 -0.784 18517 21159 1 18 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.047 -0.117 18517 21160 1 18 . 1 1 59 59 LYS C C 127 180.320 180.320 178.693 1.627 18517 21161 1 18 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.125 1.085 18517 21162 1 18 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.392 0.588 18517 21163 1 18 . 1 1 59 59 LYS H H 127 8.000 8.000 8.244 -0.244 18517 21164 1 18 . 1 1 60 60 LYS N N 128 118.400 118.400 119.736 -1.336 18517 21165 1 18 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.140 0.030 18517 21166 1 18 . 1 1 60 60 LYS C C 128 180.030 180.030 179.031 0.999 18517 21167 1 18 . 1 1 60 60 LYS CA C 128 58.750 58.750 58.635 0.115 18517 21168 1 18 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.020 0.250 18517 21169 1 18 . 1 1 60 60 LYS H H 128 7.170 7.170 7.837 -0.667 18517 21170 1 18 . 1 1 61 61 VAL N N 129 121.050 121.050 120.487 0.563 18517 21171 1 18 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.290 -0.010 18517 21172 1 18 . 1 1 61 61 VAL C C 129 177.120 177.120 177.867 -0.747 18517 21173 1 18 . 1 1 61 61 VAL CA C 129 67.350 67.350 67.110 0.240 18517 21174 1 18 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.315 0.315 18517 21175 1 18 . 1 1 61 61 VAL H H 129 7.980 7.980 8.045 -0.065 18517 21176 1 18 . 1 1 62 62 LYS N N 130 120.040 120.040 119.292 0.748 18517 21177 1 18 . 1 1 62 62 LYS HA H 130 3.700 3.700 4.026 -0.326 18517 21178 1 18 . 1 1 62 62 LYS C C 130 178.550 178.550 178.679 -0.129 18517 21179 1 18 . 1 1 62 62 LYS CA C 130 60.330 60.330 59.372 0.958 18517 21180 1 18 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.281 1.489 18517 21181 1 18 . 1 1 62 62 LYS H H 130 8.910 8.910 8.340 0.570 18517 21182 1 18 . 1 1 63 63 ALA N N 131 119.570 119.570 123.042 -3.472 18517 21183 1 18 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.093 0.127 18517 21184 1 18 . 1 1 63 63 ALA C C 131 180.520 180.520 179.438 1.082 18517 21185 1 18 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.113 0.107 18517 21186 1 18 . 1 1 63 63 ALA CB C 131 18.470 18.470 17.875 0.595 18517 21187 1 18 . 1 1 63 63 ALA H H 131 7.920 7.920 8.028 -0.108 18517 21188 1 18 . 1 1 64 64 TYR N N 132 120.510 120.510 120.766 -0.256 18517 21189 1 18 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.185 0.275 18517 21190 1 18 . 1 1 64 64 TYR C C 132 176.510 176.510 177.920 -1.410 18517 21191 1 18 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.689 -0.049 18517 21192 1 18 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.678 0.012 18517 21193 1 18 . 1 1 64 64 TYR H H 132 7.930 7.930 8.216 -0.286 18517 21194 1 18 . 1 1 65 65 LEU N N 133 117.290 117.290 119.752 -2.462 18517 21195 1 18 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.690 0.150 18517 21196 1 18 . 1 1 65 65 LEU C C 133 178.610 178.610 178.965 -0.355 18517 21197 1 18 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.154 -0.434 18517 21198 1 18 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.828 -1.398 18517 21199 1 18 . 1 1 65 65 LEU H H 133 8.240 8.240 8.576 -0.336 18517 21200 1 18 . 1 1 66 66 GLU N N 134 119.140 119.140 117.842 1.298 18517 21201 1 18 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.217 -0.357 18517 21202 1 18 . 1 1 66 66 GLU C C 134 180.200 180.200 179.039 1.161 18517 21203 1 18 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.916 1.024 18517 21204 1 18 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.355 0.455 18517 21205 1 18 . 1 1 66 66 GLU H H 134 8.370 8.370 8.475 -0.105 18517 21206 1 18 . 1 1 67 67 LYS N N 135 121.390 121.390 119.770 1.620 18517 21207 1 18 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.044 -0.044 18517 21208 1 18 . 1 1 67 67 LYS C C 135 179.080 179.080 178.663 0.417 18517 21209 1 18 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.993 0.627 18517 21210 1 18 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.465 -0.195 18517 21211 1 18 . 1 1 67 67 LYS H H 135 7.820 7.820 7.759 0.061 18517 21212 1 18 . 1 1 68 68 ILE N N 136 110.310 110.310 112.233 -1.923 18517 21213 1 18 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.025 0.275 18517 21214 1 18 . 1 1 68 68 ILE C C 136 175.520 175.520 176.295 -0.775 18517 21215 1 18 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.882 0.548 18517 21216 1 18 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.632 -0.652 18517 21217 1 18 . 1 1 68 68 ILE H H 136 7.380 7.380 7.522 -0.142 18517 21218 1 18 . 1 1 69 69 GLY N N 137 106.680 106.680 108.065 -1.385 18517 21219 1 18 . 1 1 69 69 GLY C C 137 174.160 174.160 173.118 1.042 18517 21220 1 18 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.697 0.773 18517 21221 1 18 . 1 1 69 69 GLY H H 137 7.470 7.470 7.809 -0.339 18517 21222 1 18 . 1 1 70 70 ILE N N 138 124.310 124.310 119.945 4.365 18517 21223 1 18 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.476 -0.276 18517 21224 1 18 . 1 1 70 70 ILE C C 138 174.190 174.190 175.571 -1.381 18517 21225 1 18 . 1 1 70 70 ILE CA C 138 59.380 59.380 58.774 0.606 18517 21226 1 18 . 1 1 70 70 ILE CB C 138 37.340 37.340 38.992 -1.652 18517 21227 1 18 . 1 1 70 70 ILE H H 138 8.530 8.530 8.170 0.360 18517 21228 1 18 . 1 1 71 71 ARG N N 139 125.490 125.490 125.973 -0.483 18517 21229 1 18 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.567 0.053 18517 21230 1 18 . 1 1 71 71 ARG C C 139 175.750 175.750 175.895 -0.145 18517 21231 1 18 . 1 1 71 71 ARG CA C 139 54.660 54.660 54.450 0.210 18517 21232 1 18 . 1 1 71 71 ARG CB C 139 33.140 33.140 32.595 0.545 18517 21233 1 18 . 1 1 71 71 ARG H H 139 8.240 8.240 8.568 -0.328 18517 21234 1 18 . 1 1 72 72 GLY N N 140 104.750 104.750 106.175 -1.425 18517 21235 1 18 . 1 1 72 72 GLY C C 140 172.920 172.920 172.992 -0.072 18517 21236 1 18 . 1 1 72 72 GLY CA C 140 45.430 45.430 45.033 0.397 18517 21237 1 18 . 1 1 72 72 GLY H H 140 7.900 7.900 8.137 -0.237 18517 21238 1 18 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.740 -0.230 18517 21239 1 18 . 1 1 73 73 ASP C C 141 175.060 175.060 176.702 -1.642 18517 21240 1 18 . 1 1 73 73 ASP CA C 141 56.170 56.170 55.436 0.734 18517 21241 1 18 . 1 1 73 73 ASP CB C 141 40.830 40.830 42.008 -1.178 18517 21242 1 18 . 1 1 74 74 SER N N 142 110.240 110.240 113.324 -3.084 18517 21243 1 18 . 1 1 74 74 SER HA H 142 4.740 4.740 4.691 0.049 18517 21244 1 18 . 1 1 74 74 SER C C 142 175.110 175.110 175.677 -0.567 18517 21245 1 18 . 1 1 74 74 SER CA C 142 55.700 55.700 55.915 -0.215 18517 21246 1 18 . 1 1 74 74 SER CB C 142 67.390 67.390 65.097 2.293 18517 21247 1 18 . 1 1 74 74 SER H H 142 7.560 7.560 7.537 0.023 18517 21248 1 18 . 1 1 75 75 VAL N N 143 122.950 122.950 121.065 1.885 18517 21249 1 18 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.905 -0.175 18517 21250 1 18 . 1 1 75 75 VAL C C 143 176.230 176.230 177.068 -0.838 18517 21251 1 18 . 1 1 75 75 VAL CA C 143 66.640 66.640 64.926 1.714 18517 21252 1 18 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.931 -0.691 18517 21253 1 18 . 1 1 75 75 VAL H H 143 9.470 9.470 8.882 0.588 18517 21254 1 18 . 1 1 76 76 GLU N N 144 121.390 121.390 121.708 -0.318 18517 21255 1 18 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.028 -0.388 18517 21256 1 18 . 1 1 76 76 GLU C C 144 176.880 176.880 178.762 -1.882 18517 21257 1 18 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.551 3.759 18517 21258 1 18 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.996 -0.926 18517 21259 1 18 . 1 1 76 76 GLU H H 144 9.640 9.640 7.870 1.770 18517 21260 1 18 . 1 1 77 77 ALA N N 145 118.770 118.770 121.959 -3.189 18517 21261 1 18 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.265 -0.005 18517 21262 1 18 . 1 1 77 77 ALA C C 145 180.350 180.350 179.517 0.833 18517 21263 1 18 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.577 0.203 18517 21264 1 18 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.023 1.167 18517 21265 1 18 . 1 1 77 77 ALA H H 145 7.860 7.860 8.078 -0.218 18517 21266 1 18 . 1 1 78 78 ALA N N 146 120.920 120.920 122.863 -1.943 18517 21267 1 18 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.050 0.090 18517 21268 1 18 . 1 1 78 78 ALA C C 146 179.150 179.150 179.478 -0.328 18517 21269 1 18 . 1 1 78 78 ALA CA C 146 55.260 55.260 54.906 0.354 18517 21270 1 18 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.496 0.294 18517 21271 1 18 . 1 1 78 78 ALA H H 146 8.110 8.110 8.170 -0.060 18517 21272 1 18 . 1 1 79 79 LEU N N 147 118.810 118.810 119.221 -0.411 18517 21273 1 18 . 1 1 79 79 LEU HA H 147 3.880 3.880 3.998 -0.118 18517 21274 1 18 . 1 1 79 79 LEU C C 147 179.080 179.080 178.802 0.278 18517 21275 1 18 . 1 1 79 79 LEU CA C 147 58.390 58.390 58.194 0.196 18517 21276 1 18 . 1 1 79 79 LEU CB C 147 42.260 42.260 41.311 0.949 18517 21277 1 18 . 1 1 79 79 LEU H H 147 8.360 8.360 8.322 0.038 18517 21278 1 18 . 1 1 80 80 ASP N N 148 121.620 121.620 119.142 2.478 18517 21279 1 18 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.222 0.298 18517 21280 1 18 . 1 1 80 80 ASP C C 148 178.800 178.800 178.534 0.266 18517 21281 1 18 . 1 1 80 80 ASP CA C 148 58.390 58.390 57.854 0.536 18517 21282 1 18 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.847 -0.097 18517 21283 1 18 . 1 1 80 80 ASP H H 148 8.770 8.770 8.431 0.339 18517 21284 1 18 . 1 1 81 81 ASN N N 149 118.630 118.630 118.511 0.119 18517 21285 1 18 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.489 0.081 18517 21286 1 18 . 1 1 81 81 ASN C C 149 177.970 177.970 177.762 0.208 18517 21287 1 18 . 1 1 81 81 ASN CA C 149 56.010 56.010 55.955 0.055 18517 21288 1 18 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.535 0.075 18517 21289 1 18 . 1 1 81 81 ASN H H 149 7.960 7.960 8.162 -0.202 18517 21290 1 18 . 1 1 82 82 LEU N N 150 120.030 120.030 118.666 1.364 18517 21291 1 18 . 1 1 82 82 LEU HA H 150 4.060 4.060 4.340 -0.280 18517 21292 1 18 . 1 1 82 82 LEU C C 150 177.790 177.790 179.099 -1.309 18517 21293 1 18 . 1 1 82 82 LEU CA C 150 58.870 58.870 57.844 1.026 18517 21294 1 18 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.348 0.512 18517 21295 1 18 . 1 1 82 82 LEU H H 150 8.230 8.230 8.190 0.040 18517 21296 1 18 . 1 1 83 83 MET N N 151 115.820 115.820 119.761 -3.941 18517 21297 1 18 . 1 1 83 83 MET HA H 151 4.390 4.390 4.057 0.333 18517 21298 1 18 . 1 1 83 83 MET C C 151 179.760 179.760 178.962 0.798 18517 21299 1 18 . 1 1 83 83 MET CA C 151 57.400 57.400 58.102 -0.702 18517 21300 1 18 . 1 1 83 83 MET CB C 151 31.080 31.080 31.601 -0.521 18517 21301 1 18 . 1 1 83 83 MET H H 151 8.800 8.800 8.568 0.232 18517 21302 1 18 . 1 1 84 84 ILE N N 152 120.330 120.330 120.387 -0.057 18517 21303 1 18 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.759 0.081 18517 21304 1 18 . 1 1 84 84 ILE C C 152 178.660 178.660 178.393 0.267 18517 21305 1 18 . 1 1 84 84 ILE CA C 152 65.800 65.800 65.862 -0.062 18517 21306 1 18 . 1 1 84 84 ILE CB C 152 38.450 38.450 37.492 0.958 18517 21307 1 18 . 1 1 84 84 ILE H H 152 8.540 8.540 8.743 -0.203 18517 21308 1 18 . 1 1 85 85 LYS N N 153 118.930 118.930 119.166 -0.236 18517 21309 1 18 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.091 0.109 18517 21310 1 18 . 1 1 85 85 LYS C C 153 179.650 179.650 179.261 0.389 18517 21311 1 18 . 1 1 85 85 LYS CA C 153 59.980 59.980 59.410 0.570 18517 21312 1 18 . 1 1 85 85 LYS CB C 153 33.540 33.540 32.363 1.177 18517 21313 1 18 . 1 1 85 85 LYS H H 153 7.510 7.510 8.022 -0.512 18517 21314 1 18 . 1 1 86 86 VAL N N 154 119.810 119.810 121.381 -1.571 18517 21315 1 18 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.752 -0.122 18517 21316 1 18 . 1 1 86 86 VAL C C 154 178.350 178.350 177.927 0.423 18517 21317 1 18 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.497 0.733 18517 21318 1 18 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.741 0.999 18517 21319 1 18 . 1 1 86 86 VAL H H 154 8.740 8.740 8.091 0.649 18517 21320 1 18 . 1 1 87 87 TYR N N 155 118.370 118.370 119.054 -0.684 18517 21321 1 18 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.193 0.077 18517 21322 1 18 . 1 1 87 87 TYR C C 155 178.580 178.580 178.049 0.531 18517 21323 1 18 . 1 1 87 87 TYR CA C 155 62.910 62.910 61.412 1.498 18517 21324 1 18 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.324 0.656 18517 21325 1 18 . 1 1 87 87 TYR H H 155 8.520 8.520 8.500 0.020 18517 21326 1 18 . 1 1 88 88 GLU N N 156 119.900 119.900 121.243 -1.343 18517 21327 1 18 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.195 -0.015 18517 21328 1 18 . 1 1 88 88 GLU C C 156 179.270 179.270 179.037 0.233 18517 21329 1 18 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.557 -0.177 18517 21330 1 18 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.622 0.588 18517 21331 1 18 . 1 1 88 88 GLU H H 156 8.250 8.250 8.578 -0.328 18517 21332 1 18 . 1 1 89 89 ILE N N 157 119.510 119.510 118.047 1.463 18517 21333 1 18 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.911 0.169 18517 21334 1 18 . 1 1 89 89 ILE C C 157 177.890 177.890 178.290 -0.400 18517 21335 1 18 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.493 -0.183 18517 21336 1 18 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.206 1.004 18517 21337 1 18 . 1 1 89 89 ILE H H 157 7.630 7.630 7.883 -0.253 18517 21338 1 18 . 1 1 90 90 THR N N 158 114.240 114.240 114.028 0.212 18517 21339 1 18 . 1 1 90 90 THR HA H 158 4.130 4.130 4.118 0.012 18517 21340 1 18 . 1 1 90 90 THR C C 158 175.530 175.530 175.560 -0.030 18517 21341 1 18 . 1 1 90 90 THR CA C 158 64.460 64.460 65.668 -1.208 18517 21342 1 18 . 1 1 90 90 THR CB C 158 69.610 69.610 69.195 0.415 18517 21343 1 18 . 1 1 90 90 THR H H 158 7.770 7.770 8.109 -0.339 18517 21344 1 18 . 1 1 91 91 LYS N N 159 120.280 120.280 119.137 1.143 18517 21345 1 18 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.299 0.011 18517 21346 1 18 . 1 1 91 91 LYS C C 159 177.420 177.420 177.416 0.004 18517 21347 1 18 . 1 1 91 91 LYS CA C 159 57.400 57.400 56.829 0.571 18517 21348 1 18 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.483 -0.263 18517 21349 1 18 . 1 1 91 91 LYS H H 159 7.890 7.890 8.299 -0.409 18517 21350 1 18 . 1 1 92 92 GLY N N 160 107.910 107.910 109.101 -1.191 18517 21351 1 18 . 1 1 92 92 GLY C C 160 174.430 174.430 174.267 0.163 18517 21352 1 18 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.502 0.478 18517 21353 1 18 . 1 1 92 92 GLY H H 160 7.930 7.930 8.007 -0.077 18517 21354 1 18 . 1 1 93 93 THR N N 161 113.570 113.570 116.731 -3.161 18517 21355 1 18 . 1 1 93 93 THR HA H 161 4.390 4.390 4.640 -0.250 18517 21356 1 18 . 1 1 93 93 THR C C 161 174.790 174.790 173.419 1.371 18517 21357 1 18 . 1 1 93 93 THR CA C 161 61.960 61.960 61.044 0.916 18517 21358 1 18 . 1 1 93 93 THR CB C 161 70.010 70.010 71.365 -1.355 18517 21359 1 18 . 1 1 93 93 THR H H 161 7.970 7.970 7.641 0.329 18517 21360 1 18 . 1 1 94 94 VAL N N 162 121.980 121.980 121.971 0.009 18517 21361 1 18 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.155 -0.035 18517 21362 1 18 . 1 1 94 94 VAL C C 162 176.300 176.300 174.982 1.318 18517 21363 1 18 . 1 1 94 94 VAL CA C 162 62.830 62.830 62.219 0.611 18517 21364 1 18 . 1 1 94 94 VAL CB C 162 33.060 33.060 31.385 1.675 18517 21365 1 18 . 1 1 94 94 VAL H H 162 8.130 8.130 8.454 -0.324 18517 21366 1 18 . 1 1 95 95 GLU N N 163 124.140 124.140 126.792 -2.652 18517 21367 1 18 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.485 -0.175 18517 21368 1 18 . 1 1 95 95 GLU C C 163 176.870 176.870 175.407 1.463 18517 21369 1 18 . 1 1 95 95 GLU CA C 163 57.080 57.080 54.835 2.245 18517 21370 1 18 . 1 1 95 95 GLU CB C 163 30.440 30.440 32.467 -2.027 18517 21371 1 18 . 1 1 95 95 GLU H H 163 8.490 8.490 8.282 0.208 18517 21372 1 18 . 1 1 96 96 SER N N 164 116.800 116.800 115.179 1.621 18517 21373 1 18 . 1 1 96 96 SER HA H 164 4.430 4.430 4.233 0.197 18517 21374 1 18 . 1 1 96 96 SER C C 164 174.940 174.940 175.376 -0.436 18517 21375 1 18 . 1 1 96 96 SER CA C 164 59.070 59.070 59.151 -0.081 18517 21376 1 18 . 1 1 96 96 SER CB C 164 64.220 64.220 62.164 2.056 18517 21377 1 18 . 1 1 96 96 SER H H 164 8.300 8.300 8.757 -0.457 18517 21378 1 18 . 1 1 97 97 SER C C 165 174.660 174.660 175.734 -1.074 18517 21379 1 18 . 1 1 97 97 SER CA C 165 58.870 58.870 59.394 -0.524 18517 21380 1 18 . 1 1 97 97 SER CB C 165 64.060 64.060 62.800 1.260 18517 21381 1 18 . 1 1 98 98 ALA N N 166 125.490 125.490 122.612 2.878 18517 21382 1 18 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.252 0.098 18517 21383 1 18 . 1 1 98 98 ALA C C 166 177.780 177.780 177.550 0.230 18517 21384 1 18 . 1 1 98 98 ALA CA C 166 53.000 53.000 53.303 -0.303 18517 21385 1 18 . 1 1 98 98 ALA CB C 166 19.340 19.340 19.234 0.106 18517 21386 1 18 . 1 1 98 98 ALA H H 166 8.180 8.180 7.920 0.260 18517 21387 1 18 . 1 1 99 99 GLN N N 167 118.690 118.690 118.643 0.047 18517 21388 1 18 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.478 -0.138 18517 21389 1 18 . 1 1 99 99 GLN C C 167 176.680 176.680 175.776 0.904 18517 21390 1 18 . 1 1 99 99 GLN CA C 167 56.250 56.250 54.642 1.608 18517 21391 1 18 . 1 1 99 99 GLN CB C 167 29.650 29.650 30.089 -0.439 18517 21392 1 18 . 1 1 99 99 GLN H H 167 8.170 8.170 7.658 0.512 18517 21393 1 18 . 1 1 100 100 GLY N N 168 109.670 109.670 113.769 -4.099 18517 21394 1 18 . 1 1 100 100 GLY C C 168 174.460 174.460 174.606 -0.146 18517 21395 1 18 . 1 1 100 100 GLY CA C 168 45.670 45.670 45.119 0.551 18517 21396 1 18 . 1 1 100 100 GLY H H 168 8.250 8.250 8.895 -0.645 18517 21397 1 18 . 1 1 101 101 THR N N 169 112.660 112.660 114.997 -2.337 18517 21398 1 18 . 1 1 101 101 THR HA H 169 4.360 4.360 4.491 -0.131 18517 21399 1 18 . 1 1 101 101 THR C C 169 174.720 174.720 174.060 0.660 18517 21400 1 18 . 1 1 101 101 THR CA C 169 62.080 62.080 61.500 0.580 18517 21401 1 18 . 1 1 101 101 THR CB C 169 69.930 69.930 69.397 0.533 18517 21402 1 18 . 1 1 101 101 THR H H 169 8.070 8.070 7.785 0.285 18517 21403 1 18 . 1 1 102 102 ASP N N 170 123.090 123.090 123.552 -0.462 18517 21404 1 18 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.755 -0.055 18517 21405 1 18 . 1 1 102 102 ASP C C 170 176.130 176.130 175.778 0.352 18517 21406 1 18 . 1 1 102 102 ASP CA C 170 54.780 54.780 54.059 0.721 18517 21407 1 18 . 1 1 102 102 ASP CB C 170 42.260 42.260 39.741 2.519 18517 21408 1 18 . 1 1 102 102 ASP H H 170 8.170 8.170 8.148 0.022 18517 21409 1 18 . 1 1 103 103 SER N N 171 117.110 117.110 118.459 -1.349 18517 21410 1 18 . 1 1 103 103 SER HA H 171 4.430 4.430 4.414 0.016 18517 21411 1 18 . 1 1 103 103 SER C C 171 174.770 174.770 175.271 -0.501 18517 21412 1 18 . 1 1 103 103 SER CA C 171 57.960 57.960 58.471 -0.511 18517 21413 1 18 . 1 1 103 103 SER CB C 171 64.940 64.940 64.449 0.491 18517 21414 1 18 . 1 1 103 103 SER H H 171 8.450 8.450 7.917 0.533 18517 21415 1 18 . 1 1 104 104 GLU N N 172 122.970 122.970 122.771 0.199 18517 21416 1 18 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.952 0.078 18517 21417 1 18 . 1 1 104 104 GLU C C 172 178.860 178.860 178.271 0.589 18517 21418 1 18 . 1 1 104 104 GLU CA C 172 59.700 59.700 59.889 -0.189 18517 21419 1 18 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.722 -0.072 18517 21420 1 18 . 1 1 104 104 GLU H H 172 8.830 8.830 8.960 -0.130 18517 21421 1 18 . 1 1 105 105 GLU N N 173 119.750 119.750 118.899 0.851 18517 21422 1 18 . 1 1 105 105 GLU HA H 173 3.980 3.980 3.979 0.001 18517 21423 1 18 . 1 1 105 105 GLU C C 173 178.920 178.920 178.983 -0.063 18517 21424 1 18 . 1 1 105 105 GLU CA C 173 60.060 60.060 59.086 0.975 18517 21425 1 18 . 1 1 105 105 GLU CB C 173 29.730 29.730 29.041 0.689 18517 21426 1 18 . 1 1 105 105 GLU H H 173 8.580 8.580 8.621 -0.041 18517 21427 1 18 . 1 1 106 106 LEU N N 174 121.860 121.860 120.725 1.135 18517 21428 1 18 . 1 1 106 106 LEU HA H 174 4.180 4.180 3.998 0.182 18517 21429 1 18 . 1 1 106 106 LEU C C 174 178.210 178.210 178.380 -0.170 18517 21430 1 18 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.867 0.013 18517 21431 1 18 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.755 -0.605 18517 21432 1 18 . 1 1 106 106 LEU H H 174 7.920 7.920 7.258 0.662 18517 21433 1 18 . 1 1 107 107 LYS N N 175 118.740 118.740 119.041 -0.301 18517 21434 1 18 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.980 -0.200 18517 21435 1 18 . 1 1 107 107 LYS C C 175 178.700 178.700 179.182 -0.482 18517 21436 1 18 . 1 1 107 107 LYS CA C 175 61.170 61.170 59.481 1.689 18517 21437 1 18 . 1 1 107 107 LYS CB C 175 32.430 32.430 31.805 0.625 18517 21438 1 18 . 1 1 107 107 LYS H H 175 8.340 8.340 8.218 0.122 18517 21439 1 18 . 1 1 108 108 THR N N 176 113.820 113.820 116.716 -2.896 18517 21440 1 18 . 1 1 108 108 THR HA H 176 3.840 3.840 4.039 -0.199 18517 21441 1 18 . 1 1 108 108 THR C C 176 176.620 176.620 176.664 -0.044 18517 21442 1 18 . 1 1 108 108 THR CA C 176 66.910 66.910 66.784 0.126 18517 21443 1 18 . 1 1 108 108 THR CB C 176 69.610 69.610 68.686 0.924 18517 21444 1 18 . 1 1 108 108 THR H H 176 7.950 7.950 8.393 -0.443 18517 21445 1 18 . 1 1 109 109 LEU N N 177 124.380 124.380 123.004 1.376 18517 21446 1 18 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.122 -0.292 18517 21447 1 18 . 1 1 109 109 LEU C C 177 177.790 177.790 177.754 0.036 18517 21448 1 18 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.989 0.001 18517 21449 1 18 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.615 0.965 18517 21450 1 18 . 1 1 109 109 LEU H H 177 7.480 7.480 7.786 -0.306 18517 21451 1 18 . 1 1 110 110 LEU N N 178 117.230 117.230 119.137 -1.907 18517 21452 1 18 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.765 0.074 18517 21453 1 18 . 1 1 110 110 LEU C C 178 179.540 179.540 179.298 0.242 18517 21454 1 18 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.945 0.445 18517 21455 1 18 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.336 1.004 18517 21456 1 18 . 1 1 110 110 LEU H H 178 8.670 8.670 8.510 0.160 18517 21457 1 18 . 1 1 111 111 LEU N N 179 119.230 119.230 120.903 -1.673 18517 21458 1 18 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.011 0.069 18517 21459 1 18 . 1 1 111 111 LEU C C 179 179.310 179.310 177.921 1.389 18517 21460 1 18 . 1 1 111 111 LEU CA C 179 58.390 58.390 58.522 -0.132 18517 21461 1 18 . 1 1 111 111 LEU CB C 179 42.020 42.020 41.478 0.542 18517 21462 1 18 . 1 1 111 111 LEU H H 179 7.940 7.940 8.283 -0.343 18517 21463 1 18 . 1 1 112 112 LYS N N 180 121.910 121.910 119.847 2.063 18517 21464 1 18 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.012 0.178 18517 21465 1 18 . 1 1 112 112 LYS C C 180 178.740 178.740 179.122 -0.382 18517 21466 1 18 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.909 -0.729 18517 21467 1 18 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.309 -0.439 18517 21468 1 18 . 1 1 112 112 LYS H H 180 7.420 7.420 7.893 -0.473 18517 21469 1 18 . 1 1 113 113 PHE N N 181 118.220 118.220 118.413 -0.193 18517 21470 1 18 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.298 0.452 18517 21471 1 18 . 1 1 113 113 PHE C C 181 178.520 178.520 178.107 0.413 18517 21472 1 18 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.340 -3.260 18517 21473 1 18 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.207 -0.227 18517 21474 1 18 . 1 1 113 113 PHE H H 181 9.000 9.000 8.671 0.329 18517 21475 1 18 . 1 1 114 114 SER N N 182 113.300 113.300 115.231 -1.931 18517 21476 1 18 . 1 1 114 114 SER HA H 182 3.930 3.930 4.133 -0.203 18517 21477 1 18 . 1 1 114 114 SER C C 182 177.080 177.080 176.934 0.146 18517 21478 1 18 . 1 1 114 114 SER CA C 182 62.000 62.000 62.166 -0.166 18517 21479 1 18 . 1 1 114 114 SER CB C 182 63.510 63.510 63.329 0.181 18517 21480 1 18 . 1 1 114 114 SER H H 182 8.620 8.620 8.730 -0.110 18517 21481 1 18 . 1 1 115 115 GLU N N 183 121.540 121.540 120.273 1.267 18517 21482 1 18 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.096 -0.026 18517 21483 1 18 . 1 1 115 115 GLU C C 183 179.860 179.860 179.061 0.799 18517 21484 1 18 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.022 0.758 18517 21485 1 18 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.352 0.537 18517 21486 1 18 . 1 1 115 115 GLU H H 183 8.250 8.250 8.137 0.113 18517 21487 1 18 . 1 1 116 116 ASP N N 184 121.740 121.740 120.790 0.950 18517 21488 1 18 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.473 0.037 18517 21489 1 18 . 1 1 116 116 ASP C C 184 179.570 179.570 178.407 1.163 18517 21490 1 18 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.082 0.478 18517 21491 1 18 . 1 1 116 116 ASP CB C 184 40.990 40.990 41.028 -0.038 18517 21492 1 18 . 1 1 116 116 ASP H H 184 8.840 8.840 8.483 0.357 18517 21493 1 18 . 1 1 117 117 LEU N N 185 121.420 121.420 121.544 -0.124 18517 21494 1 18 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.009 0.121 18517 21495 1 18 . 1 1 117 117 LEU C C 185 178.840 178.840 178.230 0.610 18517 21496 1 18 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.020 0.210 18517 21497 1 18 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.948 0.702 18517 21498 1 18 . 1 1 117 117 LEU H H 185 8.350 8.350 7.981 0.369 18517 21499 1 18 . 1 1 118 118 LYS N N 186 119.640 119.640 119.163 0.477 18517 21500 1 18 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.862 0.258 18517 21501 1 18 . 1 1 118 118 LYS C C 186 178.820 178.820 178.621 0.199 18517 21502 1 18 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.765 -0.025 18517 21503 1 18 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.344 0.166 18517 21504 1 18 . 1 1 118 118 LYS H H 186 8.220 8.220 8.146 0.074 18517 21505 1 18 . 1 1 119 119 ALA N N 187 120.160 120.160 121.293 -1.133 18517 21506 1 18 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.024 0.136 18517 21507 1 18 . 1 1 119 119 ALA C C 187 180.450 180.450 179.798 0.652 18517 21508 1 18 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.207 -0.067 18517 21509 1 18 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.105 0.364 18517 21510 1 18 . 1 1 119 119 ALA H H 187 8.010 8.010 7.945 0.065 18517 21511 1 18 . 1 1 120 120 GLU N N 188 117.930 117.930 118.245 -0.315 18517 21512 1 18 . 1 1 120 120 GLU HA H 188 4.180 4.180 3.901 0.279 18517 21513 1 18 . 1 1 120 120 GLU C C 188 178.780 178.780 179.346 -0.566 18517 21514 1 18 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.604 -0.774 18517 21515 1 18 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.496 0.474 18517 21516 1 18 . 1 1 120 120 GLU H H 188 7.640 7.640 8.188 -0.548 18517 21517 1 18 . 1 1 121 121 GLN N N 189 117.230 117.230 118.331 -1.101 18517 21518 1 18 . 1 1 121 121 GLN HA H 189 4.230 4.230 4.064 0.166 18517 21519 1 18 . 1 1 121 121 GLN C C 189 179.190 179.190 178.214 0.976 18517 21520 1 18 . 1 1 121 121 GLN CA C 189 59.740 59.740 59.034 0.706 18517 21521 1 18 . 1 1 121 121 GLN CB C 189 29.650 29.650 29.094 0.556 18517 21522 1 18 . 1 1 121 121 GLN H H 189 8.280 8.280 8.229 0.051 18517 21523 1 18 . 1 1 122 122 GLU N N 190 118.340 118.340 120.512 -2.172 18517 21524 1 18 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.748 0.372 18517 21525 1 18 . 1 1 122 122 GLU C C 190 178.210 178.210 178.917 -0.707 18517 21526 1 18 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.925 -0.175 18517 21527 1 18 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.160 0.810 18517 21528 1 18 . 1 1 122 122 GLU H H 190 8.250 8.250 8.144 0.106 18517 21529 1 18 . 1 1 123 123 LEU N N 191 118.930 118.930 121.022 -2.092 18517 21530 1 18 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.912 0.178 18517 21531 1 18 . 1 1 123 123 LEU C C 191 178.500 178.500 178.928 -0.428 18517 21532 1 18 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.309 -1.309 18517 21533 1 18 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.613 0.887 18517 21534 1 18 . 1 1 123 123 LEU H H 191 7.530 7.530 8.163 -0.633 18517 21535 1 18 . 1 1 124 124 HIS N N 192 115.650 115.650 119.153 -3.503 18517 21536 1 18 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.454 0.266 18517 21537 1 18 . 1 1 124 124 HIS C C 192 176.090 176.090 177.636 -1.546 18517 21538 1 18 . 1 1 124 124 HIS CA C 192 56.690 56.690 59.134 -2.444 18517 21539 1 18 . 1 1 124 124 HIS CB C 192 30.760 30.760 30.369 0.391 18517 21540 1 18 . 1 1 124 124 HIS H H 192 7.450 7.450 8.622 -1.172 18517 21541 1 18 . 1 1 125 125 SER N N 193 115.480 115.480 115.864 -0.384 18517 21542 1 18 . 1 1 125 125 SER HA H 193 4.310 4.310 3.978 0.332 18517 21543 1 18 . 1 1 125 125 SER CA C 193 60.180 60.180 61.894 -1.714 18517 21544 1 18 . 1 1 125 125 SER CB C 193 64.060 64.060 62.795 1.265 18517 21545 1 18 . 1 1 125 125 SER H H 193 8.020 8.020 8.180 -0.160 18517 21546 1 18 . 1 1 126 126 GLU C C 194 177.410 177.410 179.032 -1.622 18517 21547 1 18 . 1 1 126 126 GLU CA C 194 57.840 57.840 59.127 -1.287 18517 21548 1 18 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.736 0.154 18517 21549 1 18 . 1 1 127 127 ALA N N 195 122.910 122.910 123.151 -0.241 18517 21550 1 18 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.118 0.072 18517 21551 1 18 . 1 1 127 127 ALA C C 195 178.610 178.610 179.405 -0.795 18517 21552 1 18 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.970 -1.180 18517 21553 1 18 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.797 0.463 18517 21554 1 18 . 1 1 127 127 ALA H H 195 8.020 8.020 8.091 -0.071 18517 21555 1 18 . 1 1 128 128 LYS N N 196 117.770 117.770 116.221 1.549 18517 21556 1 18 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.392 -0.132 18517 21557 1 18 . 1 1 128 128 LYS C C 196 177.400 177.400 176.545 0.855 18517 21558 1 18 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.735 2.265 18517 21559 1 18 . 1 1 128 128 LYS CB C 196 32.740 32.740 33.235 -0.495 18517 21560 1 18 . 1 1 128 128 LYS H H 196 7.990 7.990 7.951 0.039 18517 21561 1 18 . 1 1 129 129 GLY N N 197 109.010 109.010 108.538 0.472 18517 21562 1 18 . 1 1 129 129 GLY C C 197 175.770 175.770 175.439 0.331 18517 21563 1 18 . 1 1 129 129 GLY CA C 197 46.100 46.100 45.210 0.890 18517 21564 1 18 . 1 1 129 129 GLY H H 197 8.220 8.220 7.617 0.603 18517 21565 1 18 . 1 1 130 130 GLY N N 198 109.150 109.150 108.956 0.194 18517 21566 1 18 . 1 1 130 130 GLY C C 198 174.760 174.760 175.443 -0.683 18517 21567 1 18 . 1 1 130 130 GLY CA C 198 46.930 46.930 46.604 0.326 18517 21568 1 18 . 1 1 130 130 GLY H H 198 8.210 8.210 8.967 -0.757 18517 21569 1 18 . 1 1 131 131 GLU N N 199 121.560 121.560 121.760 -0.200 18517 21570 1 18 . 1 1 131 131 GLU HA H 199 4.020 4.020 3.995 0.025 18517 21571 1 18 . 1 1 131 131 GLU C C 199 178.500 178.500 178.860 -0.360 18517 21572 1 18 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.330 0.570 18517 21573 1 18 . 1 1 131 131 GLU CB C 199 29.570 29.570 29.394 0.176 18517 21574 1 18 . 1 1 131 131 GLU H H 199 8.510 8.510 8.578 -0.068 18517 21575 1 18 . 1 1 132 132 ALA N N 200 122.390 122.390 123.117 -0.727 18517 21576 1 18 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.192 0.008 18517 21577 1 18 . 1 1 132 132 ALA C C 200 180.360 180.360 179.661 0.699 18517 21578 1 18 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.780 0.000 18517 21579 1 18 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.070 0.320 18517 21580 1 18 . 1 1 132 132 ALA H H 200 8.190 8.190 7.504 0.686 18517 21581 1 18 . 1 1 133 133 LEU N N 201 120.800 120.800 120.417 0.383 18517 21582 1 18 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.096 0.114 18517 21583 1 18 . 1 1 133 133 LEU C C 201 179.270 179.270 178.732 0.538 18517 21584 1 18 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.662 0.018 18517 21585 1 18 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.120 1.060 18517 21586 1 18 . 1 1 133 133 LEU H H 201 7.720 7.720 8.168 -0.448 18517 21587 1 18 . 1 1 134 134 LEU N N 202 120.680 120.680 119.968 0.712 18517 21588 1 18 . 1 1 134 134 LEU HA H 202 3.980 3.980 4.012 -0.032 18517 21589 1 18 . 1 1 134 134 LEU C C 202 179.030 179.030 178.449 0.581 18517 21590 1 18 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.746 0.684 18517 21591 1 18 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.300 0.320 18517 21592 1 18 . 1 1 134 134 LEU H H 202 8.470 8.470 8.654 -0.184 18517 21593 1 18 . 1 1 135 135 SER N N 203 113.290 113.290 114.657 -1.367 18517 21594 1 18 . 1 1 135 135 SER HA H 203 4.180 4.180 4.060 0.120 18517 21595 1 18 . 1 1 135 135 SER C C 203 177.300 177.300 176.533 0.767 18517 21596 1 18 . 1 1 135 135 SER CA C 203 62.080 62.080 62.282 -0.202 18517 21597 1 18 . 1 1 135 135 SER CB C 203 63.030 63.030 62.796 0.234 18517 21598 1 18 . 1 1 135 135 SER H H 203 8.210 8.210 8.215 -0.005 18517 21599 1 18 . 1 1 136 136 SER N N 204 117.500 117.500 117.997 -0.497 18517 21600 1 18 . 1 1 136 136 SER HA H 204 4.050 4.050 4.121 -0.071 18517 21601 1 18 . 1 1 136 136 SER C C 204 177.570 177.570 176.611 0.959 18517 21602 1 18 . 1 1 136 136 SER CA C 204 61.880 61.880 61.493 0.387 18517 21603 1 18 . 1 1 136 136 SER CB C 204 63.510 63.510 62.996 0.514 18517 21604 1 18 . 1 1 136 136 SER H H 204 7.730 7.730 8.082 -0.352 18517 21605 1 18 . 1 1 137 137 MET N N 205 122.500 122.500 121.868 0.632 18517 21606 1 18 . 1 1 137 137 MET HA H 205 4.140 4.140 4.091 0.049 18517 21607 1 18 . 1 1 137 137 MET C C 205 177.680 177.680 177.652 0.028 18517 21608 1 18 . 1 1 137 137 MET CA C 205 60.140 60.140 59.220 0.920 18517 21609 1 18 . 1 1 137 137 MET CB C 205 33.460 33.460 32.633 0.827 18517 21610 1 18 . 1 1 137 137 MET H H 205 8.170 8.170 8.432 -0.262 18517 21611 1 18 . 1 1 138 138 LYS N N 206 121.410 121.410 119.337 2.073 18517 21612 1 18 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.914 -0.164 18517 21613 1 18 . 1 1 138 138 LYS C C 206 178.780 178.780 179.014 -0.234 18517 21614 1 18 . 1 1 138 138 LYS CA C 206 60.330 60.330 60.167 0.163 18517 21615 1 18 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.523 -0.253 18517 21616 1 18 . 1 1 138 138 LYS H H 206 8.810 8.810 8.476 0.334 18517 21617 1 18 . 1 1 139 139 THR N N 207 116.580 116.580 116.935 -0.355 18517 21618 1 18 . 1 1 139 139 THR HA H 207 4.060 4.060 3.945 0.115 18517 21619 1 18 . 1 1 139 139 THR C C 207 176.730 176.730 177.152 -0.422 18517 21620 1 18 . 1 1 139 139 THR CA C 207 67.150 67.150 66.767 0.383 18517 21621 1 18 . 1 1 139 139 THR CB C 207 69.220 69.220 68.741 0.479 18517 21622 1 18 . 1 1 139 139 THR H H 207 7.930 7.930 8.397 -0.467 18517 21623 1 18 . 1 1 140 140 GLN N N 208 121.390 121.390 119.728 1.662 18517 21624 1 18 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.053 0.007 18517 21625 1 18 . 1 1 140 140 GLN C C 208 178.550 178.550 177.979 0.571 18517 21626 1 18 . 1 1 140 140 GLN CA C 208 59.300 59.300 58.940 0.360 18517 21627 1 18 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.077 0.783 18517 21628 1 18 . 1 1 140 140 GLN H H 208 7.600 7.600 8.377 -0.777 18517 21629 1 18 . 1 1 141 141 HIS N N 209 122.360 122.360 119.553 2.807 18517 21630 1 18 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.295 -0.465 18517 21631 1 18 . 1 1 141 141 HIS C C 209 176.390 176.390 177.494 -1.104 18517 21632 1 18 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.087 1.633 18517 21633 1 18 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.175 -1.075 18517 21634 1 18 . 1 1 141 141 HIS H H 209 8.980 8.980 8.486 0.494 18517 21635 1 18 . 1 1 142 142 ASP N N 210 120.740 120.740 120.560 0.180 18517 21636 1 18 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.370 -0.020 18517 21637 1 18 . 1 1 142 142 ASP C C 210 179.490 179.490 178.241 1.249 18517 21638 1 18 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.867 0.053 18517 21639 1 18 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.830 -0.240 18517 21640 1 18 . 1 1 142 142 ASP H H 210 8.770 8.770 8.508 0.262 18517 21641 1 18 . 1 1 143 143 GLU N N 211 119.010 119.010 120.690 -1.680 18517 21642 1 18 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.038 -0.068 18517 21643 1 18 . 1 1 143 143 GLU C C 211 179.070 179.070 179.083 -0.013 18517 21644 1 18 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.148 0.152 18517 21645 1 18 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.370 0.120 18517 21646 1 18 . 1 1 143 143 GLU H H 211 7.850 7.850 8.159 -0.309 18517 21647 1 18 . 1 1 144 144 LEU N N 212 122.500 122.500 119.874 2.626 18517 21648 1 18 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.142 -0.072 18517 21649 1 18 . 1 1 144 144 LEU C C 212 179.340 179.340 179.518 -0.178 18517 21650 1 18 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.153 0.237 18517 21651 1 18 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.114 1.066 18517 21652 1 18 . 1 1 144 144 LEU H H 212 8.070 8.070 8.330 -0.260 18517 21653 1 18 . 1 1 145 145 LEU N N 213 118.110 118.110 118.314 -0.204 18517 21654 1 18 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.785 0.415 18517 21655 1 18 . 1 1 145 145 LEU C C 213 179.610 179.610 179.258 0.352 18517 21656 1 18 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.939 0.811 18517 21657 1 18 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.268 -0.038 18517 21658 1 18 . 1 1 145 145 LEU H H 213 8.370 8.370 8.444 -0.074 18517 21659 1 18 . 1 1 146 146 LYS N N 214 117.290 117.290 119.947 -2.657 18517 21660 1 18 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.885 -0.055 18517 21661 1 18 . 1 1 146 146 LYS C C 214 179.900 179.900 178.908 0.992 18517 21662 1 18 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.857 0.473 18517 21663 1 18 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.279 0.071 18517 21664 1 18 . 1 1 146 146 LYS H H 214 7.560 7.560 8.552 -0.992 18517 21665 1 18 . 1 1 147 147 LYS N N 215 120.330 120.330 118.452 1.878 18517 21666 1 18 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.065 -0.045 18517 21667 1 18 . 1 1 147 147 LYS C C 215 180.550 180.550 179.453 1.097 18517 21668 1 18 . 1 1 147 147 LYS CA C 215 60.100 60.100 58.625 1.475 18517 21669 1 18 . 1 1 147 147 LYS CB C 215 32.740 32.740 31.925 0.815 18517 21670 1 18 . 1 1 147 147 LYS H H 215 7.830 7.830 7.923 -0.093 18517 21671 1 18 . 1 1 148 148 PHE N N 216 117.370 117.370 118.650 -1.280 18517 21672 1 18 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.233 -0.153 18517 21673 1 18 . 1 1 148 148 PHE C C 216 178.200 178.200 177.261 0.939 18517 21674 1 18 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.257 0.863 18517 21675 1 18 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.315 1.405 18517 21676 1 18 . 1 1 148 148 PHE H H 216 8.010 8.010 8.454 -0.444 18517 21677 1 18 . 1 1 149 149 ALA N N 217 118.990 118.990 121.509 -2.519 18517 21678 1 18 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.289 -0.179 18517 21679 1 18 . 1 1 149 149 ALA C C 217 177.330 177.330 178.317 -0.987 18517 21680 1 18 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.493 0.257 18517 21681 1 18 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.424 -0.824 18517 21682 1 18 . 1 1 149 149 ALA H H 217 7.720 7.720 7.978 -0.258 18517 21683 1 18 . 1 1 150 150 ALA N N 218 118.690 118.690 120.779 -2.089 18517 21684 1 18 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.318 0.042 18517 21685 1 18 . 1 1 150 150 ALA C C 218 177.930 177.930 177.833 0.097 18517 21686 1 18 . 1 1 150 150 ALA CA C 218 52.090 52.090 53.014 -0.924 18517 21687 1 18 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.529 0.211 18517 21688 1 18 . 1 1 150 150 ALA H H 218 7.280 7.280 7.730 -0.450 18517 21689 1 18 . 1 1 151 151 LEU N N 219 119.980 119.980 119.772 0.208 18517 21690 1 18 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.171 0.099 18517 21691 1 18 . 1 1 151 151 LEU C C 219 176.150 176.150 174.855 1.295 18517 21692 1 18 . 1 1 151 151 LEU CA C 219 56.170 56.170 55.483 0.687 18517 21693 1 18 . 1 1 151 151 LEU CB C 219 42.810 42.810 42.630 0.180 18517 21694 1 18 . 1 1 151 151 LEU H H 219 7.050 7.050 7.637 -0.587 18517 21695 1 18 . 1 1 152 152 THR N N 220 112.070 112.070 116.797 -4.727 18517 21696 1 18 . 1 1 152 152 THR HA H 220 4.700 4.700 4.823 -0.123 18517 21697 1 18 . 1 1 152 152 THR C C 220 173.400 173.400 172.910 0.490 18517 21698 1 18 . 1 1 152 152 THR CA C 220 58.190 58.190 58.605 -0.415 18517 21699 1 18 . 1 1 152 152 THR CB C 220 70.960 70.960 69.780 1.180 18517 21700 1 18 . 1 1 152 152 THR H H 220 8.040 8.040 7.808 0.232 18517 21701 1 18 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.731 -0.021 18517 21702 1 18 . 1 1 153 153 PRO C C 221 176.720 176.720 175.879 0.841 18517 21703 1 18 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.426 0.484 18517 21704 1 18 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.826 1.424 18517 21705 1 18 . 1 1 154 154 THR N N 222 120.460 120.460 113.557 6.903 18517 21706 1 18 . 1 1 154 154 THR HA H 222 4.250 4.250 4.348 -0.098 18517 21707 1 18 . 1 1 154 154 THR C C 222 175.190 175.190 174.779 0.411 18517 21708 1 18 . 1 1 154 154 THR CA C 222 64.650 64.650 61.213 3.437 18517 21709 1 18 . 1 1 154 154 THR CB C 222 70.410 70.410 69.745 0.665 18517 21710 1 18 . 1 1 154 154 THR H H 222 8.530 8.530 8.228 0.302 18517 21711 1 18 . 1 1 155 155 PHE N N 223 122.260 122.260 120.188 2.072 18517 21712 1 18 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.941 0.049 18517 21713 1 18 . 1 1 155 155 PHE C C 223 172.560 172.560 174.394 -1.834 18517 21714 1 18 . 1 1 155 155 PHE CA C 223 56.770 56.770 56.182 0.588 18517 21715 1 18 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.259 1.331 18517 21716 1 18 . 1 1 155 155 PHE H H 223 8.950 8.950 7.841 1.109 18517 21717 1 18 . 1 1 156 156 LEU N N 224 123.440 123.440 120.927 2.513 18517 21718 1 18 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.540 0.130 18517 21719 1 18 . 1 1 156 156 LEU C C 224 175.090 175.090 177.386 -2.296 18517 21720 1 18 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.281 -0.251 18517 21721 1 18 . 1 1 156 156 LEU CB C 224 46.300 46.300 43.024 3.276 18517 21722 1 18 . 1 1 156 156 LEU H H 224 7.210 7.210 7.230 -0.020 18517 21723 1 18 . 1 1 157 157 THR N N 225 113.010 113.010 112.179 0.831 18517 21724 1 18 . 1 1 157 157 THR HA H 225 4.790 4.790 4.661 0.129 18517 21725 1 18 . 1 1 157 157 THR C C 225 176.130 176.130 173.552 2.578 18517 21726 1 18 . 1 1 157 157 THR CA C 225 59.860 59.860 61.038 -1.178 18517 21727 1 18 . 1 1 157 157 THR CB C 225 72.860 72.860 70.353 2.507 18517 21728 1 18 . 1 1 157 157 THR H H 225 9.200 9.200 8.110 1.090 18517 21729 1 18 . 1 1 158 158 SER N N 226 115.350 115.350 116.242 -0.892 18517 21730 1 18 . 1 1 158 158 SER C C 226 177.410 177.410 175.556 1.854 18517 21731 1 18 . 1 1 158 158 SER CA C 226 57.400 57.400 57.162 0.238 18517 21732 1 18 . 1 1 158 158 SER CB C 226 66.200 66.200 64.918 1.282 18517 21733 1 18 . 1 1 158 158 SER H H 226 8.830 8.830 8.245 0.585 18517 21734 1 18 . 1 1 159 159 GLU N N 227 121.200 121.200 122.100 -0.900 18517 21735 1 18 . 1 1 159 159 GLU HA H 227 4.020 4.020 4.051 -0.031 18517 21736 1 18 . 1 1 159 159 GLU C C 227 177.680 177.680 177.416 0.264 18517 21737 1 18 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.820 0.680 18517 21738 1 18 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.666 -0.096 18517 21739 1 18 . 1 1 159 159 GLU H H 227 8.320 8.320 8.904 -0.584 18517 21740 1 18 . 1 1 160 160 ASP N N 228 115.350 115.350 117.515 -2.165 18517 21741 1 18 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.379 0.171 18517 21742 1 18 . 1 1 160 160 ASP C C 228 177.640 177.640 177.608 0.032 18517 21743 1 18 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.928 0.472 18517 21744 1 18 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.373 2.677 18517 21745 1 18 . 1 1 160 160 ASP H H 228 7.570 7.570 8.411 -0.841 18517 21746 1 18 . 1 1 161 161 ILE N N 229 108.150 108.150 112.978 -4.828 18517 21747 1 18 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.358 0.152 18517 21748 1 18 . 1 1 161 161 ILE C C 229 173.130 173.130 176.664 -3.534 18517 21749 1 18 . 1 1 161 161 ILE CA C 229 61.290 61.290 61.897 -0.607 18517 21750 1 18 . 1 1 161 161 ILE CB C 229 39.400 39.400 39.497 -0.097 18517 21751 1 18 . 1 1 161 161 ILE H H 229 7.190 7.190 7.596 -0.406 18517 21752 1 18 . 1 1 162 162 SER N N 230 115.290 115.290 118.752 -3.462 18517 21753 1 18 . 1 1 162 162 SER HA H 230 4.760 4.760 4.465 0.295 18517 21754 1 18 . 1 1 162 162 SER C C 230 176.060 176.060 174.658 1.402 18517 21755 1 18 . 1 1 162 162 SER CA C 230 57.920 57.920 58.989 -1.069 18517 21756 1 18 . 1 1 162 162 SER CB C 230 66.120 66.120 61.431 4.689 18517 21757 1 18 . 1 1 162 162 SER H H 230 7.460 7.460 8.151 -0.691 18517 21758 1 18 . 1 1 163 163 GLY C C 231 173.260 173.260 173.059 0.201 18517 21759 1 18 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.790 0.760 18517 21760 1 18 . 1 1 164 164 TYR N N 232 115.290 115.290 119.158 -3.868 18517 21761 1 18 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.691 0.009 18517 21762 1 18 . 1 1 164 164 TYR C C 232 172.820 172.820 173.870 -1.050 18517 21763 1 18 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.259 -0.159 18517 21764 1 18 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.514 0.286 18517 21765 1 18 . 1 1 164 164 TYR H H 232 7.370 7.370 7.125 0.245 18517 21766 1 18 . 1 1 165 165 LEU N N 233 120.980 120.980 122.579 -1.599 18517 21767 1 18 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.496 -0.066 18517 21768 1 18 . 1 1 165 165 LEU C C 233 176.360 176.360 177.562 -1.202 18517 21769 1 18 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.289 1.371 18517 21770 1 18 . 1 1 165 165 LEU CB C 233 40.430 40.430 42.336 -1.905 18517 21771 1 18 . 1 1 165 165 LEU H H 233 8.830 8.830 8.802 0.028 18517 21772 1 18 . 1 1 166 166 THR N N 234 116.170 116.170 114.704 1.466 18517 21773 1 18 . 1 1 166 166 THR HA H 234 4.010 4.010 3.491 0.519 18517 21774 1 18 . 1 1 166 166 THR C C 234 173.070 173.070 174.057 -0.987 18517 21775 1 18 . 1 1 166 166 THR CA C 234 62.910 62.910 63.440 -0.530 18517 21776 1 18 . 1 1 166 166 THR CB C 234 70.170 70.170 68.925 1.245 18517 21777 1 18 . 1 1 166 166 THR H H 234 8.050 8.050 8.298 -0.248 18517 21778 1 18 . 1 1 167 167 VAL N N 235 117.640 117.640 120.946 -3.306 18517 21779 1 18 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.206 0.004 18517 21780 1 18 . 1 1 167 167 VAL C C 235 172.330 172.330 174.096 -1.766 18517 21781 1 18 . 1 1 167 167 VAL CA C 235 58.750 58.750 58.069 0.681 18517 21782 1 18 . 1 1 167 167 VAL CB C 235 35.880 35.880 32.384 3.496 18517 21783 1 18 . 1 1 167 167 VAL H H 235 7.160 7.160 7.351 -0.191 18517 21784 1 18 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.539 -0.349 18517 21785 1 18 . 1 1 168 168 PRO C C 236 173.710 173.710 175.356 -1.646 18517 21786 1 18 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.982 0.848 18517 21787 1 18 . 1 1 168 168 PRO CB C 236 32.270 32.270 33.783 -1.513 18517 21788 1 18 . 1 1 169 169 GLU N N 237 113.540 113.540 117.182 -3.642 18517 21789 1 18 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.136 0.244 18517 21790 1 18 . 1 1 169 169 GLU C C 237 176.690 176.690 178.069 -1.379 18517 21791 1 18 . 1 1 169 169 GLU CA C 237 53.750 53.750 54.040 -0.290 18517 21792 1 18 . 1 1 169 169 GLU CB C 237 33.220 33.220 32.056 1.163 18517 21793 1 18 . 1 1 169 169 GLU H H 237 7.930 7.930 8.151 -0.221 18517 21794 1 18 . 1 1 170 170 TYR N N 238 119.400 119.400 120.358 -0.958 18517 21795 1 18 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.458 -0.458 18517 21796 1 18 . 1 1 170 170 TYR C C 238 177.610 177.610 176.979 0.631 18517 21797 1 18 . 1 1 170 170 TYR CA C 238 62.630 62.630 60.274 2.356 18517 21798 1 18 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.766 -1.026 18517 21799 1 18 . 1 1 170 170 TYR H H 238 8.490 8.490 8.208 0.282 18517 21800 1 18 . 1 1 171 171 GLY N N 239 104.160 104.160 104.168 -0.008 18517 21801 1 18 . 1 1 171 171 GLY C C 239 173.350 173.350 172.889 0.461 18517 21802 1 18 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.494 0.776 18517 21803 1 18 . 1 1 171 171 GLY H H 239 7.960 7.960 8.780 -0.820 18517 21804 1 18 . 1 1 172 172 ALA N N 240 121.860 121.860 123.350 -1.490 18517 21805 1 18 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.833 -0.663 18517 21806 1 18 . 1 1 172 172 ALA C C 240 172.160 172.160 174.703 -2.543 18517 21807 1 18 . 1 1 172 172 ALA CA C 240 50.110 50.110 48.919 1.191 18517 21808 1 18 . 1 1 172 172 ALA CB C 240 20.930 20.930 20.122 0.808 18517 21809 1 18 . 1 1 172 172 ALA H H 240 6.910 6.910 7.810 -0.900 18517 21810 1 18 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.503 1.047 18517 21811 1 18 . 1 1 173 173 PRO C C 241 176.610 176.610 175.605 1.005 18517 21812 1 18 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.361 -0.841 18517 21813 1 18 . 1 1 173 173 PRO CB C 241 33.300 33.300 32.315 0.985 18517 21814 1 18 . 1 1 174 174 MET N N 242 114.000 114.000 122.408 -8.408 18517 21815 1 18 . 1 1 174 174 MET HA H 242 4.390 4.390 4.424 -0.034 18517 21816 1 18 . 1 1 174 174 MET C C 242 173.960 173.960 174.909 -0.949 18517 21817 1 18 . 1 1 174 174 MET CA C 242 54.660 54.660 54.804 -0.144 18517 21818 1 18 . 1 1 174 174 MET CB C 242 34.170 34.170 34.961 -0.791 18517 21819 1 18 . 1 1 174 174 MET H H 242 8.040 8.040 7.754 0.286 18517 21820 1 18 . 1 1 175 175 ASN N N 243 119.570 119.570 122.214 -2.644 18517 21821 1 18 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.812 0.128 18517 21822 1 18 . 1 1 175 175 ASN C C 243 174.320 174.320 175.004 -0.684 18517 21823 1 18 . 1 1 175 175 ASN CA C 243 53.080 53.080 51.972 1.108 18517 21824 1 18 . 1 1 175 175 ASN CB C 243 38.850 38.850 37.203 1.647 18517 21825 1 18 . 1 1 175 175 ASN H H 243 7.960 7.960 8.633 -0.673 18517 21826 1 18 . 1 1 176 176 ALA N N 244 132.250 132.250 128.324 3.926 18517 21827 1 18 . 1 1 176 176 ALA C C 244 181.580 181.580 178.461 3.119 18517 21828 1 18 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.258 0.512 18517 21829 1 18 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.600 0.430 18517 21830 1 18 . 1 1 176 176 ALA H H 244 12.110 12.110 8.014 4.096 18517 21831 1 18 . 1 1 177 177 ALA N N 245 125.780 125.780 121.850 3.930 18517 21832 1 18 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.899 -0.029 18517 21833 1 18 . 1 1 177 177 ALA C C 245 180.640 180.640 179.662 0.978 18517 21834 1 18 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.352 0.308 18517 21835 1 18 . 1 1 177 177 ALA CB C 245 17.840 17.840 17.696 0.144 18517 21836 1 18 . 1 1 177 177 ALA H H 245 10.240 10.240 8.532 1.708 18517 21837 1 18 . 1 1 178 178 LYS N N 246 119.810 119.810 119.034 0.776 18517 21838 1 18 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.064 -0.234 18517 21839 1 18 . 1 1 178 178 LYS C C 246 180.500 180.500 178.300 2.200 18517 21840 1 18 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.091 0.809 18517 21841 1 18 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.324 -1.004 18517 21842 1 18 . 1 1 178 178 LYS H H 246 8.470 8.470 7.714 0.756 18517 21843 1 18 . 1 1 179 179 TRP N N 247 121.170 121.170 121.521 -0.351 18517 21844 1 18 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.211 0.409 18517 21845 1 18 . 1 1 179 179 TRP C C 247 176.510 176.510 177.833 -1.323 18517 21846 1 18 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.860 -0.040 18517 21847 1 18 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.534 0.036 18517 21848 1 18 . 1 1 179 179 TRP H H 247 8.330 8.330 8.167 0.163 18517 21849 1 18 . 1 1 180 180 ALA N N 248 119.130 119.130 119.877 -0.747 18517 21850 1 18 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.783 0.757 18517 21851 1 18 . 1 1 180 180 ALA C C 248 182.110 182.110 179.484 2.626 18517 21852 1 18 . 1 1 180 180 ALA CA C 248 54.190 54.190 54.757 -0.567 18517 21853 1 18 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.147 0.563 18517 21854 1 18 . 1 1 180 180 ALA H H 248 7.990 7.990 8.729 -0.739 18517 21855 1 18 . 1 1 181 181 LYS N N 249 116.000 116.000 119.746 -3.746 18517 21856 1 18 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.085 -0.115 18517 21857 1 18 . 1 1 181 181 LYS C C 249 179.380 179.380 178.785 0.595 18517 21858 1 18 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.363 -0.653 18517 21859 1 18 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.711 -0.201 18517 21860 1 18 . 1 1 181 181 LYS H H 249 6.900 6.900 7.785 -0.885 18517 21861 1 18 . 1 1 182 182 VAL N N 250 122.270 122.270 115.641 6.629 18517 21862 1 18 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.699 -0.359 18517 21863 1 18 . 1 1 182 182 VAL C C 250 178.160 178.160 177.682 0.478 18517 21864 1 18 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.285 0.475 18517 21865 1 18 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.614 -0.774 18517 21866 1 18 . 1 1 182 182 VAL H H 250 7.050 7.050 8.319 -1.269 18517 21867 1 18 . 1 1 183 183 GLU N N 251 120.520 120.520 120.408 0.112 18517 21868 1 18 . 1 1 183 183 GLU HA H 251 3.180 3.180 4.000 -0.820 18517 21869 1 18 . 1 1 183 183 GLU C C 251 179.480 179.480 178.908 0.572 18517 21870 1 18 . 1 1 183 183 GLU CA C 251 60.690 60.690 58.439 2.251 18517 21871 1 18 . 1 1 183 183 GLU CB C 251 28.070 28.070 29.092 -1.022 18517 21872 1 18 . 1 1 183 183 GLU H H 251 8.020 8.020 8.584 -0.564 18517 21873 1 18 . 1 1 184 184 GLY N N 252 102.930 102.930 108.068 -5.138 18517 21874 1 18 . 1 1 184 184 GLY C C 252 176.920 176.920 176.283 0.637 18517 21875 1 18 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.152 0.258 18517 21876 1 18 . 1 1 184 184 GLY H H 252 7.830 7.830 8.074 -0.244 18517 21877 1 18 . 1 1 185 185 MET N N 253 123.200 123.200 121.708 1.492 18517 21878 1 18 . 1 1 185 185 MET HA H 253 4.250 4.250 4.058 0.192 18517 21879 1 18 . 1 1 185 185 MET C C 253 179.370 179.370 178.462 0.908 18517 21880 1 18 . 1 1 185 185 MET CA C 253 59.300 59.300 59.353 -0.053 18517 21881 1 18 . 1 1 185 185 MET CB C 253 33.930 33.930 32.429 1.501 18517 21882 1 18 . 1 1 185 185 MET H H 253 7.890 7.890 7.847 0.043 18517 21883 1 18 . 1 1 186 186 ILE N N 254 120.150 120.150 119.690 0.460 18517 21884 1 18 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.856 -0.296 18517 21885 1 18 . 1 1 186 186 ILE C C 254 177.250 177.250 178.310 -1.060 18517 21886 1 18 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.031 1.489 18517 21887 1 18 . 1 1 186 186 ILE CB C 254 38.290 38.290 36.655 1.635 18517 21888 1 18 . 1 1 186 186 ILE H H 254 8.260 8.260 8.071 0.189 18517 21889 1 18 . 1 1 187 187 HIS N N 255 119.810 119.810 119.563 0.247 18517 21890 1 18 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.321 -0.321 18517 21891 1 18 . 1 1 187 187 HIS C C 255 176.460 176.460 177.591 -1.131 18517 21892 1 18 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.822 0.508 18517 21893 1 18 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.641 1.989 18517 21894 1 18 . 1 1 187 187 HIS H H 255 8.900 8.900 8.552 0.348 18517 21895 1 18 . 1 1 188 188 GLY N N 256 103.160 103.160 107.204 -4.044 18517 21896 1 18 . 1 1 188 188 GLY C C 256 176.320 176.320 176.061 0.259 18517 21897 1 18 . 1 1 188 188 GLY CA C 256 46.890 46.890 47.058 -0.168 18517 21898 1 18 . 1 1 188 188 GLY H H 256 8.030 8.030 8.621 -0.591 18517 21899 1 18 . 1 1 189 189 LYS N N 257 119.510 119.510 122.801 -3.291 18517 21900 1 18 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.069 -0.069 18517 21901 1 18 . 1 1 189 189 LYS C C 257 178.660 178.660 179.351 -0.691 18517 21902 1 18 . 1 1 189 189 LYS CA C 257 56.490 56.490 58.015 -1.525 18517 21903 1 18 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.852 -0.302 18517 21904 1 18 . 1 1 189 189 LYS H H 257 7.120 7.120 7.804 -0.684 18517 21905 1 18 . 1 1 190 190 LEU N N 258 120.570 120.570 117.899 2.671 18517 21906 1 18 . 1 1 190 190 LEU HA H 258 3.930 3.930 4.093 -0.163 18517 21907 1 18 . 1 1 190 190 LEU C C 258 177.230 177.230 177.888 -0.658 18517 21908 1 18 . 1 1 190 190 LEU CA C 258 57.520 57.520 56.719 0.801 18517 21909 1 18 . 1 1 190 190 LEU CB C 258 42.970 42.970 41.169 1.801 18517 21910 1 18 . 1 1 190 190 LEU H H 258 8.060 8.060 8.284 -0.224 18517 21911 1 18 . 1 1 191 191 GLU N N 259 114.590 114.590 115.218 -0.628 18517 21912 1 18 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.227 0.053 18517 21913 1 18 . 1 1 191 191 GLU C C 259 176.230 176.230 176.365 -0.135 18517 21914 1 18 . 1 1 191 191 GLU CA C 259 55.340 55.340 55.788 -0.448 18517 21915 1 18 . 1 1 191 191 GLU CB C 259 29.330 29.330 30.105 -0.775 18517 21916 1 18 . 1 1 191 191 GLU H H 259 7.330 7.330 8.000 -0.670 18517 21917 1 18 . 1 1 192 192 SER N N 260 115.240 115.240 117.163 -1.923 18517 21918 1 18 . 1 1 192 192 SER HA H 260 4.490 4.490 4.553 -0.063 18517 21919 1 18 . 1 1 192 192 SER C C 260 173.770 173.770 173.953 -0.183 18517 21920 1 18 . 1 1 192 192 SER CA C 260 58.350 58.350 57.581 0.769 18517 21921 1 18 . 1 1 192 192 SER CB C 260 65.090 65.090 64.187 0.903 18517 21922 1 18 . 1 1 192 192 SER H H 260 7.130 7.130 7.547 -0.417 18517 21923 1 18 . 1 1 193 193 SER C C 261 174.600 174.600 174.718 -0.118 18517 21924 1 18 . 1 1 193 193 SER CA C 261 59.980 59.980 58.091 1.889 18517 21925 1 18 . 1 1 193 193 SER CB C 261 63.750 63.750 62.304 1.446 18517 21926 1 18 . 1 1 194 194 GLU N N 262 121.800 121.800 120.907 0.893 18517 21927 1 18 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.298 0.172 18517 21928 1 18 . 1 1 194 194 GLU C C 262 174.650 174.650 176.390 -1.740 18517 21929 1 18 . 1 1 194 194 GLU CA C 262 55.620 55.620 56.186 -0.566 18517 21930 1 18 . 1 1 194 194 GLU CB C 262 30.210 30.210 30.263 -0.053 18517 21931 1 18 . 1 1 194 194 GLU H H 262 7.840 7.840 8.007 -0.167 18517 21932 1 18 . 1 1 195 195 VAL N N 263 124.080 124.080 122.997 1.083 18517 21933 1 18 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.126 0.124 18517 21934 1 18 . 1 1 195 195 VAL C C 263 174.460 174.460 175.684 -1.224 18517 21935 1 18 . 1 1 195 195 VAL CA C 263 59.820 59.820 60.617 -0.797 18517 21936 1 18 . 1 1 195 195 VAL CB C 263 33.620 33.620 32.274 1.346 18517 21937 1 18 . 1 1 195 195 VAL H H 263 8.020 8.020 8.466 -0.446 18517 21938 1 18 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.604 -0.084 18517 21939 1 18 . 1 1 198 198 ASN C C 266 176.490 176.490 177.228 -0.738 18517 21940 1 18 . 1 1 198 198 ASN CA C 266 54.780 54.780 56.541 -1.761 18517 21941 1 18 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.874 0.186 18517 21942 1 18 . 1 1 199 199 LEU N N 267 120.680 120.680 121.658 -0.978 18517 21943 1 18 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.813 0.197 18517 21944 1 18 . 1 1 199 199 LEU C C 267 178.050 178.050 178.529 -0.479 18517 21945 1 18 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.501 0.329 18517 21946 1 18 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.275 1.065 18517 21947 1 18 . 1 1 199 199 LEU H H 267 7.660 7.660 8.038 -0.378 18517 21948 1 18 . 1 1 200 200 LYS N N 268 116.740 116.740 119.100 -2.360 18517 21949 1 18 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.935 -0.205 18517 21950 1 18 . 1 1 200 200 LYS C C 268 178.520 178.520 178.617 -0.097 18517 21951 1 18 . 1 1 200 200 LYS CA C 268 61.800 61.800 59.466 2.334 18517 21952 1 18 . 1 1 200 200 LYS CB C 268 32.110 32.110 32.224 -0.113 18517 21953 1 18 . 1 1 200 200 LYS H H 268 8.280 8.280 7.673 0.607 18517 21954 1 18 . 1 1 201 201 ALA N N 269 121.270 121.270 122.521 -1.251 18517 21955 1 18 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.014 0.226 18517 21956 1 18 . 1 1 201 201 ALA C C 269 180.890 180.890 179.809 1.081 18517 21957 1 18 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.267 -0.087 18517 21958 1 18 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.375 0.095 18517 21959 1 18 . 1 1 201 201 ALA H H 269 7.710 7.710 7.905 -0.195 18517 21960 1 18 . 1 1 202 202 LEU N N 270 119.980 119.980 118.685 1.295 18517 21961 1 18 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.918 0.172 18517 21962 1 18 . 1 1 202 202 LEU C C 270 179.330 179.330 179.372 -0.042 18517 21963 1 18 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.767 0.303 18517 21964 1 18 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.373 1.047 18517 21965 1 18 . 1 1 202 202 LEU H H 270 7.750 7.750 8.458 -0.708 18517 21966 1 18 . 1 1 203 203 VAL N N 271 118.450 118.450 120.205 -1.755 18517 21967 1 18 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.864 -0.034 18517 21968 1 18 . 1 1 203 203 VAL C C 271 177.110 177.110 177.876 -0.766 18517 21969 1 18 . 1 1 203 203 VAL CA C 271 67.710 67.710 67.192 0.518 18517 21970 1 18 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.140 0.570 18517 21971 1 18 . 1 1 203 203 VAL H H 271 8.560 8.560 8.208 0.352 18517 21972 1 18 . 1 1 204 204 ALA N N 272 122.560 122.560 121.732 0.828 18517 21973 1 18 . 1 1 204 204 ALA HA H 272 3.880 3.880 4.011 -0.131 18517 21974 1 18 . 1 1 204 204 ALA C C 272 178.700 178.700 179.834 -1.134 18517 21975 1 18 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.640 0.490 18517 21976 1 18 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.082 0.308 18517 21977 1 18 . 1 1 204 204 ALA H H 272 8.120 8.120 8.736 -0.616 18517 21978 1 18 . 1 1 205 205 GLU N N 273 117.290 117.290 119.319 -2.029 18517 21979 1 18 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.127 -0.137 18517 21980 1 18 . 1 1 205 205 GLU C C 273 178.630 178.630 179.402 -0.772 18517 21981 1 18 . 1 1 205 205 GLU CA C 273 60.140 60.140 58.912 1.228 18517 21982 1 18 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.409 0.561 18517 21983 1 18 . 1 1 205 205 GLU H H 273 7.670 7.670 8.272 -0.602 18517 21984 1 18 . 1 1 206 206 LEU N N 274 120.450 120.450 121.666 -1.216 18517 21985 1 18 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.023 -0.023 18517 21986 1 18 . 1 1 206 206 LEU C C 274 178.400 178.400 178.948 -0.548 18517 21987 1 18 . 1 1 206 206 LEU CA C 274 58.910 58.910 57.973 0.937 18517 21988 1 18 . 1 1 206 206 LEU CB C 274 43.530 43.530 42.038 1.492 18517 21989 1 18 . 1 1 206 206 LEU H H 274 8.420 8.420 8.332 0.088 18517 21990 1 18 . 1 1 207 207 ILE N N 275 117.580 117.580 120.414 -2.834 18517 21991 1 18 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.627 -0.097 18517 21992 1 18 . 1 1 207 207 ILE C C 275 178.850 178.850 178.272 0.578 18517 21993 1 18 . 1 1 207 207 ILE CA C 275 66.080 66.080 64.637 1.443 18517 21994 1 18 . 1 1 207 207 ILE CB C 275 38.770 38.770 36.693 2.077 18517 21995 1 18 . 1 1 207 207 ILE H H 275 8.700 8.700 8.447 0.253 18517 21996 1 18 . 1 1 208 208 GLU N N 276 119.100 119.100 119.737 -0.637 18517 21997 1 18 . 1 1 208 208 GLU HA H 276 4.000 4.000 3.976 0.024 18517 21998 1 18 . 1 1 208 208 GLU C C 276 178.540 178.540 179.527 -0.987 18517 21999 1 18 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.714 0.736 18517 22000 1 18 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.637 0.883 18517 22001 1 18 . 1 1 208 208 GLU H H 276 7.950 7.950 8.104 -0.154 18517 22002 1 18 . 1 1 209 209 LEU N N 277 120.590 120.590 119.654 0.936 18517 22003 1 18 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.152 0.068 18517 22004 1 18 . 1 1 209 209 LEU C C 277 179.520 179.520 179.442 0.078 18517 22005 1 18 . 1 1 209 209 LEU CA C 277 58.350 58.350 58.010 0.340 18517 22006 1 18 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.079 2.211 18517 22007 1 18 . 1 1 209 209 LEU H H 277 8.550 8.550 8.634 -0.084 18517 22008 1 18 . 1 1 210 210 ARG N N 278 116.470 116.470 119.946 -3.476 18517 22009 1 18 . 1 1 210 210 ARG HA H 278 3.740 3.740 4.086 -0.346 18517 22010 1 18 . 1 1 210 210 ARG C C 278 179.190 179.190 179.099 0.091 18517 22011 1 18 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.597 2.083 18517 22012 1 18 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.304 1.096 18517 22013 1 18 . 1 1 210 210 ARG H H 278 8.590 8.590 8.784 -0.194 18517 22014 1 18 . 1 1 211 211 ALA N N 279 120.470 120.470 122.399 -1.929 18517 22015 1 18 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.092 -0.182 18517 22016 1 18 . 1 1 211 211 ALA C C 279 181.350 181.350 179.897 1.453 18517 22017 1 18 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.136 0.564 18517 22018 1 18 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.128 -0.848 18517 22019 1 18 . 1 1 211 211 ALA H H 279 8.050 8.050 8.344 -0.294 18517 22020 1 18 . 1 1 212 212 GLN N N 280 120.070 120.070 118.391 1.679 18517 22021 1 18 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.983 0.037 18517 22022 1 18 . 1 1 212 212 GLN C C 280 179.490 179.490 178.825 0.665 18517 22023 1 18 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.912 0.388 18517 22024 1 18 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.755 0.425 18517 22025 1 18 . 1 1 212 212 GLN H H 280 8.300 8.300 8.472 -0.172 18517 22026 1 18 . 1 1 213 213 MET N N 281 119.810 119.810 118.300 1.510 18517 22027 1 18 . 1 1 213 213 MET HA H 281 3.730 3.730 4.253 -0.523 18517 22028 1 18 . 1 1 213 213 MET C C 281 177.490 177.490 178.849 -1.359 18517 22029 1 18 . 1 1 213 213 MET CA C 281 60.690 60.690 57.953 2.737 18517 22030 1 18 . 1 1 213 213 MET CB C 281 33.930 33.930 32.265 1.665 18517 22031 1 18 . 1 1 213 213 MET H H 281 8.420 8.420 8.769 -0.349 18517 22032 1 18 . 1 1 214 214 MET N N 282 114.000 114.000 118.354 -4.354 18517 22033 1 18 . 1 1 214 214 MET HA H 282 3.880 3.880 4.386 -0.506 18517 22034 1 18 . 1 1 214 214 MET C C 282 177.650 177.650 178.372 -0.722 18517 22035 1 18 . 1 1 214 214 MET CA C 282 58.670 58.670 57.544 1.126 18517 22036 1 18 . 1 1 214 214 MET CB C 282 33.300 33.300 31.704 1.596 18517 22037 1 18 . 1 1 214 214 MET H H 282 7.890 7.890 8.315 -0.425 18517 22038 1 18 . 1 1 215 215 ALA N N 283 119.970 119.970 122.860 -2.890 18517 22039 1 18 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.126 0.014 18517 22040 1 18 . 1 1 215 215 ALA C C 283 180.580 180.580 179.016 1.564 18517 22041 1 18 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.046 -0.936 18517 22042 1 18 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.427 -0.747 18517 22043 1 18 . 1 1 215 215 ALA H H 283 7.580 7.580 8.187 -0.607 18517 22044 1 18 . 1 1 216 216 LEU N N 284 120.920 120.920 117.871 3.049 18517 22045 1 18 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.289 -0.329 18517 22046 1 18 . 1 1 216 216 LEU C C 284 177.910 177.910 179.512 -1.602 18517 22047 1 18 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.664 0.255 18517 22048 1 18 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.174 0.326 18517 22049 1 18 . 1 1 216 216 LEU H H 284 7.460 7.460 8.094 -0.634 18517 22050 1 18 . 1 1 217 217 LEU N N 285 116.470 116.470 121.842 -5.372 18517 22051 1 18 . 1 1 217 217 LEU HA H 285 3.680 3.680 4.125 -0.445 18517 22052 1 18 . 1 1 217 217 LEU C C 285 178.310 178.310 177.485 0.825 18517 22053 1 18 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.528 -0.088 18517 22054 1 18 . 1 1 217 217 LEU CB C 285 43.050 43.050 42.138 0.912 18517 22055 1 18 . 1 1 217 217 LEU H H 285 6.980 6.980 8.249 -1.269 18517 22056 1 18 . 1 1 218 218 TYR N N 286 111.080 111.080 116.048 -4.968 18517 22057 1 18 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.643 0.257 18517 22058 1 18 . 1 1 218 218 TYR C C 286 176.090 176.090 176.096 -0.006 18517 22059 1 18 . 1 1 218 218 TYR CA C 286 56.050 56.050 57.096 -1.046 18517 22060 1 18 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.209 2.701 18517 22061 1 18 . 1 1 218 218 TYR H H 286 7.660 7.660 7.982 -0.322 18517 22062 1 18 . 1 1 219 219 GLY N N 287 108.260 108.260 109.607 -1.347 18517 22063 1 18 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.391 0.929 18517 22064 1 18 . 1 1 219 219 GLY H H 287 7.750 7.750 7.724 0.026 18517 22065 1 18 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.797 -0.307 18517 22066 1 18 . 1 1 221 221 ILE CA C 289 63.580 63.580 63.941 -0.361 18517 22067 1 18 . 1 1 221 221 ILE CB C 289 38.280 38.280 38.196 0.084 18517 22068 1 18 . 1 1 222 222 GLY CA C 290 45.740 45.740 45.532 0.208 18517 22069 1 19 . 1 1 2 2 LYS N N 70 126.600 126.600 125.864 0.736 18517 22070 1 19 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.793 -0.433 18517 22071 1 19 . 1 1 2 2 LYS C C 70 176.000 176.000 175.093 0.907 18517 22072 1 19 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.728 0.722 18517 22073 1 19 . 1 1 2 2 LYS CB C 70 33.850 33.850 33.908 -0.059 18517 22074 1 19 . 1 1 2 2 LYS H H 70 8.530 8.530 8.310 0.220 18517 22075 1 19 . 1 1 3 3 THR N N 71 111.030 111.030 114.282 -3.252 18517 22076 1 19 . 1 1 3 3 THR HA H 71 4.400 4.400 4.479 -0.079 18517 22077 1 19 . 1 1 3 3 THR C C 71 175.650 175.650 175.624 0.026 18517 22078 1 19 . 1 1 3 3 THR CA C 71 60.610 60.610 60.465 0.145 18517 22079 1 19 . 1 1 3 3 THR CB C 71 71.520 71.520 70.336 1.184 18517 22080 1 19 . 1 1 3 3 THR H H 71 7.390 7.390 8.284 -0.894 18517 22081 1 19 . 1 1 4 4 LEU N N 72 121.560 121.560 122.263 -0.703 18517 22082 1 19 . 1 1 4 4 LEU C C 72 177.870 177.870 179.042 -1.172 18517 22083 1 19 . 1 1 4 4 LEU CA C 72 58.480 58.480 59.020 -0.540 18517 22084 1 19 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.105 1.075 18517 22085 1 19 . 1 1 4 4 LEU H H 72 8.980 8.980 8.561 0.419 18517 22086 1 19 . 1 1 5 5 ASP N N 73 115.530 115.530 118.463 -2.933 18517 22087 1 19 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.389 -0.059 18517 22088 1 19 . 1 1 5 5 ASP C C 73 179.290 179.290 178.806 0.484 18517 22089 1 19 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.777 0.063 18517 22090 1 19 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.552 0.278 18517 22091 1 19 . 1 1 5 5 ASP H H 73 8.270 8.270 8.522 -0.252 18517 22092 1 19 . 1 1 6 6 VAL N N 74 122.330 122.330 119.537 2.793 18517 22093 1 19 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.582 0.158 18517 22094 1 19 . 1 1 6 6 VAL C C 74 178.970 178.970 177.888 1.082 18517 22095 1 19 . 1 1 6 6 VAL CA C 74 66.360 66.360 66.473 -0.113 18517 22096 1 19 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.872 0.078 18517 22097 1 19 . 1 1 6 6 VAL H H 74 7.400 7.400 7.532 -0.132 18517 22098 1 19 . 1 1 7 7 LEU N N 75 121.360 121.360 120.450 0.910 18517 22099 1 19 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.884 0.146 18517 22100 1 19 . 1 1 7 7 LEU C C 75 179.240 179.240 179.234 0.006 18517 22101 1 19 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.153 0.077 18517 22102 1 19 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.246 1.643 18517 22103 1 19 . 1 1 7 7 LEU H H 75 8.300 8.300 8.439 -0.139 18517 22104 1 19 . 1 1 8 8 ARG N N 76 117.230 117.230 118.522 -1.292 18517 22105 1 19 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.060 -0.140 18517 22106 1 19 . 1 1 8 8 ARG C C 76 178.290 178.290 178.837 -0.547 18517 22107 1 19 . 1 1 8 8 ARG CA C 76 60.770 60.770 58.720 2.050 18517 22108 1 19 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.123 1.087 18517 22109 1 19 . 1 1 8 8 ARG H H 76 8.520 8.520 8.903 -0.383 18517 22110 1 19 . 1 1 9 9 GLY N N 77 104.570 104.570 107.465 -2.895 18517 22111 1 19 . 1 1 9 9 GLY C C 77 176.180 176.180 176.789 -0.609 18517 22112 1 19 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.952 0.218 18517 22113 1 19 . 1 1 9 9 GLY H H 77 7.620 7.620 8.587 -0.967 18517 22114 1 19 . 1 1 10 10 GLU N N 78 120.270 120.270 122.781 -2.511 18517 22115 1 19 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.169 0.101 18517 22116 1 19 . 1 1 10 10 GLU C C 78 179.030 179.030 179.252 -0.222 18517 22117 1 19 . 1 1 10 10 GLU CA C 78 58.870 58.870 58.754 0.116 18517 22118 1 19 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.216 2.184 18517 22119 1 19 . 1 1 10 10 GLU H H 78 8.100 8.100 8.288 -0.188 18517 22120 1 19 . 1 1 11 11 LEU N N 79 116.000 116.000 120.627 -4.627 18517 22121 1 19 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.901 0.609 18517 22122 1 19 . 1 1 11 11 LEU C C 79 179.630 179.630 179.221 0.409 18517 22123 1 19 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.688 -1.998 18517 22124 1 19 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.639 3.161 18517 22125 1 19 . 1 1 11 11 LEU H H 79 8.230 8.230 8.329 -0.099 18517 22126 1 19 . 1 1 12 12 ARG N N 80 120.020 120.020 118.721 1.299 18517 22127 1 19 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.945 -0.195 18517 22128 1 19 . 1 1 12 12 ARG C C 80 178.490 178.490 178.858 -0.368 18517 22129 1 19 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.964 2.036 18517 22130 1 19 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.941 1.300 18517 22131 1 19 . 1 1 12 12 ARG H H 80 8.210 8.210 8.768 -0.558 18517 22132 1 19 . 1 1 13 13 GLY N N 81 108.090 108.090 106.590 1.500 18517 22133 1 19 . 1 1 13 13 GLY C C 81 173.540 173.540 175.856 -2.316 18517 22134 1 19 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.921 1.079 18517 22135 1 19 . 1 1 13 13 GLY H H 81 8.890 8.890 8.375 0.515 18517 22136 1 19 . 1 1 14 14 GLN C C 82 179.540 179.540 178.313 1.227 18517 22137 1 19 . 1 1 14 14 GLN CA C 82 58.710 58.710 58.948 -0.238 18517 22138 1 19 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.793 0.308 18517 22139 1 19 . 1 1 15 15 ARG N N 83 118.220 118.220 119.395 -1.175 18517 22140 1 19 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.124 -0.174 18517 22141 1 19 . 1 1 15 15 ARG C C 83 177.710 177.710 178.566 -0.856 18517 22142 1 19 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.506 0.394 18517 22143 1 19 . 1 1 15 15 ARG CB C 83 29.650 29.650 29.774 -0.124 18517 22144 1 19 . 1 1 15 15 ARG H H 83 7.320 7.320 8.168 -0.848 18517 22145 1 19 . 1 1 16 16 GLU N N 84 118.810 118.810 120.840 -2.030 18517 22146 1 19 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.055 -0.205 18517 22147 1 19 . 1 1 16 16 GLU C C 84 178.750 178.750 179.162 -0.412 18517 22148 1 19 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.372 1.638 18517 22149 1 19 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.180 0.230 18517 22150 1 19 . 1 1 16 16 GLU H H 84 8.450 8.450 8.602 -0.152 18517 22151 1 19 . 1 1 17 17 ALA N N 85 122.790 122.790 122.447 0.343 18517 22152 1 19 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.124 0.066 18517 22153 1 19 . 1 1 17 17 ALA C C 85 180.360 180.360 179.824 0.536 18517 22154 1 19 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.090 0.370 18517 22155 1 19 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.298 -0.218 18517 22156 1 19 . 1 1 17 17 ALA H H 85 8.420 8.420 8.193 0.227 18517 22157 1 19 . 1 1 18 18 PHE N N 86 119.400 119.400 119.609 -0.209 18517 22158 1 19 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.182 0.108 18517 22159 1 19 . 1 1 18 18 PHE C C 86 177.560 177.560 177.402 0.158 18517 22160 1 19 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.802 -0.162 18517 22161 1 19 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.407 0.232 18517 22162 1 19 . 1 1 18 18 PHE H H 86 7.490 7.490 8.192 -0.702 18517 22163 1 19 . 1 1 19 19 LEU N N 87 117.470 117.470 119.727 -2.257 18517 22164 1 19 . 1 1 19 19 LEU HA H 87 4.070 4.070 4.054 0.016 18517 22165 1 19 . 1 1 19 19 LEU C C 87 178.880 178.880 178.534 0.346 18517 22166 1 19 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.125 -0.165 18517 22167 1 19 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.670 0.430 18517 22168 1 19 . 1 1 19 19 LEU H H 87 8.010 8.010 8.889 -0.879 18517 22169 1 19 . 1 1 20 20 SER N N 88 113.770 113.770 115.096 -1.326 18517 22170 1 19 . 1 1 20 20 SER HA H 88 4.070 4.070 4.068 0.002 18517 22171 1 19 . 1 1 20 20 SER C C 88 175.680 175.680 176.544 -0.864 18517 22172 1 19 . 1 1 20 20 SER CA C 88 63.070 63.070 62.833 0.237 18517 22173 1 19 . 1 1 20 20 SER H H 88 8.100 8.100 8.254 -0.154 18517 22174 1 19 . 1 1 21 21 GLU N N 89 120.570 120.570 122.194 -1.624 18517 22175 1 19 . 1 1 21 21 GLU HA H 89 3.970 3.970 3.901 0.069 18517 22176 1 19 . 1 1 21 21 GLU C C 89 178.940 178.940 178.651 0.289 18517 22177 1 19 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.378 -0.118 18517 22178 1 19 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.264 0.066 18517 22179 1 19 . 1 1 21 21 GLU H H 89 7.400 7.400 7.864 -0.464 18517 22180 1 19 . 1 1 22 22 ILE N N 90 119.350 119.350 118.829 0.521 18517 22181 1 19 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.967 -0.278 18517 22182 1 19 . 1 1 22 22 ILE C C 90 177.230 177.230 178.388 -1.158 18517 22183 1 19 . 1 1 22 22 ILE CA C 90 63.470 63.470 63.086 0.384 18517 22184 1 19 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.725 -0.335 18517 22185 1 19 . 1 1 22 22 ILE H H 90 7.250 7.250 7.991 -0.741 18517 22186 1 19 . 1 1 23 23 ILE N N 91 116.350 116.350 118.463 -2.113 18517 22187 1 19 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.816 -0.416 18517 22188 1 19 . 1 1 23 23 ILE C C 91 176.690 176.690 176.787 -0.097 18517 22189 1 19 . 1 1 23 23 ILE CA C 91 65.730 65.730 62.902 2.828 18517 22190 1 19 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.254 0.516 18517 22191 1 19 . 1 1 23 23 ILE H H 91 7.860 7.860 8.260 -0.400 18517 22192 1 19 . 1 1 24 24 LYS N N 92 116.000 116.000 118.064 -2.064 18517 22193 1 19 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.223 -0.083 18517 22194 1 19 . 1 1 24 24 LYS C C 92 176.270 176.270 177.124 -0.854 18517 22195 1 19 . 1 1 24 24 LYS CA C 92 57.480 57.480 56.593 0.887 18517 22196 1 19 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.573 0.727 18517 22197 1 19 . 1 1 24 24 LYS H H 92 7.170 7.170 7.914 -0.744 18517 22198 1 19 . 1 1 25 25 SER N N 93 114.650 114.650 115.948 -1.298 18517 22199 1 19 . 1 1 25 25 SER HA H 93 4.550 4.550 4.273 0.277 18517 22200 1 19 . 1 1 25 25 SER C C 93 173.370 173.370 173.255 0.115 18517 22201 1 19 . 1 1 25 25 SER CA C 93 57.240 57.240 60.279 -3.039 18517 22202 1 19 . 1 1 25 25 SER CB C 93 65.650 65.650 63.547 2.103 18517 22203 1 19 . 1 1 25 25 SER H H 93 7.730 7.730 7.780 -0.050 18517 22204 1 19 . 1 1 26 26 ASP N N 94 121.230 121.230 122.897 -1.667 18517 22205 1 19 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.804 0.126 18517 22206 1 19 . 1 1 26 26 ASP C C 94 176.560 176.560 174.682 1.878 18517 22207 1 19 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.755 0.755 18517 22208 1 19 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.484 1.166 18517 22209 1 19 . 1 1 26 26 ASP H H 94 8.280 8.280 8.304 -0.024 18517 22210 1 19 . 1 1 27 27 GLY N N 95 109.310 109.310 108.012 1.298 18517 22211 1 19 . 1 1 27 27 GLY C C 95 171.080 171.080 171.651 -0.571 18517 22212 1 19 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.186 -0.416 18517 22213 1 19 . 1 1 27 27 GLY H H 95 8.160 8.160 7.473 0.687 18517 22214 1 19 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.817 0.323 18517 22215 1 19 . 1 1 29 29 PHE C C 97 175.230 175.230 175.789 -0.559 18517 22216 1 19 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.378 0.112 18517 22217 1 19 . 1 1 29 29 PHE CB C 97 41.620 41.620 42.308 -0.688 18517 22218 1 19 . 1 1 30 30 THR N N 98 112.600 112.600 116.699 -4.099 18517 22219 1 19 . 1 1 30 30 THR HA H 98 4.570 4.570 4.324 0.246 18517 22220 1 19 . 1 1 30 30 THR C C 98 176.690 176.690 174.575 2.115 18517 22221 1 19 . 1 1 30 30 THR CA C 98 60.290 60.290 60.982 -0.692 18517 22222 1 19 . 1 1 30 30 THR CB C 98 71.600 71.600 70.968 0.632 18517 22223 1 19 . 1 1 30 30 THR H H 98 8.990 8.990 9.169 -0.179 18517 22224 1 19 . 1 1 31 31 ILE N N 99 119.240 119.240 125.499 -6.259 18517 22225 1 19 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.713 0.107 18517 22226 1 19 . 1 1 31 31 ILE C C 99 176.090 176.090 176.388 -0.298 18517 22227 1 19 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.951 -3.811 18517 22228 1 19 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.872 -0.922 18517 22229 1 19 . 1 1 31 31 ILE H H 99 9.230 9.230 8.195 1.035 18517 22230 1 19 . 1 1 32 32 LEU N N 100 119.660 119.660 120.234 -0.574 18517 22231 1 19 . 1 1 32 32 LEU HA H 100 4.030 4.030 3.929 0.101 18517 22232 1 19 . 1 1 32 32 LEU C C 100 181.050 181.050 178.636 2.414 18517 22233 1 19 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.849 -0.289 18517 22234 1 19 . 1 1 32 32 LEU CB C 100 40.120 40.120 40.666 -0.546 18517 22235 1 19 . 1 1 32 32 LEU H H 100 7.310 7.310 8.221 -0.911 18517 22236 1 19 . 1 1 33 33 GLN N N 101 121.450 121.450 118.623 2.827 18517 22237 1 19 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.406 -0.156 18517 22238 1 19 . 1 1 33 33 GLN CA C 101 59.700 59.700 59.294 0.406 18517 22239 1 19 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.822 2.968 18517 22240 1 19 . 1 1 33 33 GLN H H 101 7.790 7.790 7.769 0.021 18517 22241 1 19 . 1 1 34 34 LEU C C 102 178.590 178.590 179.103 -0.513 18517 22242 1 19 . 1 1 34 34 LEU CA C 102 58.630 58.630 57.659 0.971 18517 22243 1 19 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.640 -0.330 18517 22244 1 19 . 1 1 35 35 VAL N N 103 118.520 118.520 118.748 -0.228 18517 22245 1 19 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.492 -0.072 18517 22246 1 19 . 1 1 35 35 VAL C C 103 177.930 177.930 177.946 -0.016 18517 22247 1 19 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.595 -0.555 18517 22248 1 19 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.983 0.647 18517 22249 1 19 . 1 1 35 35 VAL H H 103 8.670 8.670 8.623 0.047 18517 22250 1 19 . 1 1 36 36 GLY N N 104 109.430 109.430 108.302 1.128 18517 22251 1 19 . 1 1 36 36 GLY C C 104 174.600 174.600 175.599 -0.999 18517 22252 1 19 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.065 0.975 18517 22253 1 19 . 1 1 36 36 GLY H H 104 7.880 7.880 8.325 -0.445 18517 22254 1 19 . 1 1 37 37 TYR N N 105 122.270 122.270 124.145 -1.875 18517 22255 1 19 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.516 -0.636 18517 22256 1 19 . 1 1 37 37 TYR C C 105 176.310 176.310 177.146 -0.836 18517 22257 1 19 . 1 1 37 37 TYR CA C 105 64.100 64.100 59.882 4.218 18517 22258 1 19 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.801 -0.431 18517 22259 1 19 . 1 1 37 37 TYR H H 105 8.170 8.170 8.135 0.035 18517 22260 1 19 . 1 1 38 38 LEU N N 106 120.100 120.100 120.842 -0.742 18517 22261 1 19 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.797 -0.057 18517 22262 1 19 . 1 1 38 38 LEU C C 106 178.280 178.280 178.522 -0.242 18517 22263 1 19 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.022 0.608 18517 22264 1 19 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.177 1.553 18517 22265 1 19 . 1 1 38 38 LEU H H 106 7.610 7.610 8.351 -0.741 18517 22266 1 19 . 1 1 39 39 ARG N N 107 116.670 116.670 118.763 -2.093 18517 22267 1 19 . 1 1 39 39 ARG HA H 107 3.680 3.680 3.903 -0.223 18517 22268 1 19 . 1 1 39 39 ARG C C 107 179.480 179.480 178.364 1.116 18517 22269 1 19 . 1 1 39 39 ARG CA C 107 59.580 59.580 59.569 0.011 18517 22270 1 19 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.924 1.316 18517 22271 1 19 . 1 1 39 39 ARG H H 107 8.240 8.240 8.037 0.203 18517 22272 1 19 . 1 1 40 40 VAL N N 108 121.970 121.970 119.585 2.385 18517 22273 1 19 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.655 -0.255 18517 22274 1 19 . 1 1 40 40 VAL C C 108 178.440 178.440 178.349 0.091 18517 22275 1 19 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.924 1.026 18517 22276 1 19 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.771 -1.331 18517 22277 1 19 . 1 1 40 40 VAL H H 108 8.200 8.200 7.824 0.376 18517 22278 1 19 . 1 1 41 41 VAL N N 109 108.940 108.940 116.546 -7.606 18517 22279 1 19 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.520 0.720 18517 22280 1 19 . 1 1 41 41 VAL C C 109 175.070 175.070 177.492 -2.422 18517 22281 1 19 . 1 1 41 41 VAL CA C 109 62.590 62.590 66.008 -3.418 18517 22282 1 19 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.919 -1.269 18517 22283 1 19 . 1 1 41 41 VAL H H 109 7.760 7.760 7.949 -0.189 18517 22284 1 19 . 1 1 42 42 ASP N N 110 124.670 124.670 120.309 4.361 18517 22285 1 19 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.280 0.340 18517 22286 1 19 . 1 1 42 42 ASP C C 110 177.310 177.310 177.641 -0.331 18517 22287 1 19 . 1 1 42 42 ASP CA C 110 59.980 59.980 57.793 2.187 18517 22288 1 19 . 1 1 42 42 ASP CB C 110 44.950 44.950 41.022 3.928 18517 22289 1 19 . 1 1 42 42 ASP H H 110 7.360 7.360 8.519 -1.159 18517 22290 1 19 . 1 1 43 43 THR N N 111 102.340 102.340 111.106 -8.766 18517 22291 1 19 . 1 1 43 43 THR HA H 111 5.100 5.100 4.049 1.051 18517 22292 1 19 . 1 1 43 43 THR C C 111 174.940 174.940 176.646 -1.706 18517 22293 1 19 . 1 1 43 43 THR CA C 111 60.650 60.650 65.083 -4.433 18517 22294 1 19 . 1 1 43 43 THR CB C 111 69.610 69.610 68.542 1.068 18517 22295 1 19 . 1 1 43 43 THR H H 111 6.380 6.380 7.910 -1.530 18517 22296 1 19 . 1 1 44 44 ASP N N 112 119.750 119.750 124.099 -4.349 18517 22297 1 19 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.263 -0.403 18517 22298 1 19 . 1 1 44 44 ASP C C 112 178.850 178.850 177.795 1.055 18517 22299 1 19 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.899 0.331 18517 22300 1 19 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.819 -1.419 18517 22301 1 19 . 1 1 44 44 ASP H H 112 9.050 9.050 8.074 0.976 18517 22302 1 19 . 1 1 45 45 LEU N N 113 123.910 123.910 121.159 2.751 18517 22303 1 19 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.828 -0.018 18517 22304 1 19 . 1 1 45 45 LEU C C 113 182.040 182.040 178.481 3.559 18517 22305 1 19 . 1 1 45 45 LEU CA C 113 57.320 57.320 57.862 -0.542 18517 22306 1 19 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.601 -0.851 18517 22307 1 19 . 1 1 45 45 LEU H H 113 9.710 9.710 7.743 1.967 18517 22308 1 19 . 1 1 46 46 LEU N N 114 117.640 117.640 116.552 1.088 18517 22309 1 19 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.092 0.018 18517 22310 1 19 . 1 1 46 46 LEU C C 114 179.540 179.540 178.258 1.282 18517 22311 1 19 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.351 0.209 18517 22312 1 19 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.969 -0.499 18517 22313 1 19 . 1 1 46 46 LEU H H 114 8.270 8.270 7.593 0.677 18517 22314 1 19 . 1 1 47 47 LEU N N 115 116.520 116.520 115.736 0.784 18517 22315 1 19 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.547 -0.407 18517 22316 1 19 . 1 1 47 47 LEU C C 115 173.850 173.850 176.020 -2.170 18517 22317 1 19 . 1 1 47 47 LEU CA C 115 55.420 55.420 53.994 1.426 18517 22318 1 19 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.480 3.240 18517 22319 1 19 . 1 1 47 47 LEU H H 115 8.160 8.160 7.814 0.346 18517 22320 1 19 . 1 1 48 48 LYS N N 116 114.710 114.710 117.521 -2.811 18517 22321 1 19 . 1 1 48 48 LYS HA H 116 3.810 3.810 3.976 -0.166 18517 22322 1 19 . 1 1 48 48 LYS C C 116 176.510 176.510 175.638 0.872 18517 22323 1 19 . 1 1 48 48 LYS CA C 116 57.200 57.200 57.025 0.175 18517 22324 1 19 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.350 -0.330 18517 22325 1 19 . 1 1 48 48 LYS H H 116 7.580 7.580 7.940 -0.360 18517 22326 1 19 . 1 1 49 49 VAL N N 117 119.050 119.050 117.904 1.146 18517 22327 1 19 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.147 -0.537 18517 22328 1 19 . 1 1 49 49 VAL C C 117 175.860 175.860 175.293 0.567 18517 22329 1 19 . 1 1 49 49 VAL CA C 117 63.510 63.510 60.837 2.673 18517 22330 1 19 . 1 1 49 49 VAL CB C 117 32.350 32.350 33.544 -1.194 18517 22331 1 19 . 1 1 49 49 VAL H H 117 7.980 7.980 7.996 -0.016 18517 22332 1 19 . 1 1 50 50 ASP N N 118 126.900 126.900 120.596 6.304 18517 22333 1 19 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.544 -0.294 18517 22334 1 19 . 1 1 50 50 ASP C C 118 177.700 177.700 176.756 0.944 18517 22335 1 19 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.190 0.860 18517 22336 1 19 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.597 0.983 18517 22337 1 19 . 1 1 50 50 ASP H H 118 8.930 8.930 8.627 0.303 18517 22338 1 19 . 1 1 51 51 SER N N 119 124.790 124.790 121.605 3.185 18517 22339 1 19 . 1 1 51 51 SER HA H 119 4.070 4.070 4.165 -0.095 18517 22340 1 19 . 1 1 51 51 SER C C 119 177.220 177.220 175.888 1.332 18517 22341 1 19 . 1 1 51 51 SER CA C 119 61.640 61.640 61.259 0.381 18517 22342 1 19 . 1 1 51 51 SER CB C 119 63.510 63.510 62.851 0.659 18517 22343 1 19 . 1 1 51 51 SER H H 119 8.560 8.560 8.833 -0.273 18517 22344 1 19 . 1 1 52 52 THR N N 120 119.880 119.880 112.613 7.267 18517 22345 1 19 . 1 1 52 52 THR HA H 120 4.190 4.190 4.137 0.053 18517 22346 1 19 . 1 1 52 52 THR C C 120 177.120 177.120 176.322 0.798 18517 22347 1 19 . 1 1 52 52 THR CA C 120 66.280 66.280 64.639 1.641 18517 22348 1 19 . 1 1 52 52 THR CB C 120 68.420 68.420 68.380 0.040 18517 22349 1 19 . 1 1 52 52 THR H H 120 8.310 8.310 8.152 0.158 18517 22350 1 19 . 1 1 53 53 LYS N N 121 122.270 122.270 122.826 -0.556 18517 22351 1 19 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.188 -0.068 18517 22352 1 19 . 1 1 53 53 LYS C C 121 178.970 178.970 179.098 -0.128 18517 22353 1 19 . 1 1 53 53 LYS CA C 121 59.580 59.580 58.918 0.662 18517 22354 1 19 . 1 1 53 53 LYS CB C 121 34.250 34.250 32.074 2.176 18517 22355 1 19 . 1 1 53 53 LYS H H 121 7.700 7.700 8.453 -0.753 18517 22356 1 19 . 1 1 54 54 VAL N N 122 120.070 120.070 114.896 5.174 18517 22357 1 19 . 1 1 54 54 VAL HA H 122 3.430 3.430 4.108 -0.678 18517 22358 1 19 . 1 1 54 54 VAL C C 122 179.860 179.860 178.169 1.691 18517 22359 1 19 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.371 3.209 18517 22360 1 19 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.493 1.327 18517 22361 1 19 . 1 1 54 54 VAL H H 122 7.890 7.890 8.096 -0.206 18517 22362 1 19 . 1 1 55 55 ASP N N 123 122.270 122.270 121.395 0.875 18517 22363 1 19 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.372 0.098 18517 22364 1 19 . 1 1 55 55 ASP C C 123 178.630 178.630 178.300 0.330 18517 22365 1 19 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.751 0.049 18517 22366 1 19 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.946 1.075 18517 22367 1 19 . 1 1 55 55 ASP H H 123 8.270 8.270 8.195 0.075 18517 22368 1 19 . 1 1 56 56 GLU N N 124 119.600 119.600 119.337 0.263 18517 22369 1 19 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.081 -0.111 18517 22370 1 19 . 1 1 56 56 GLU C C 124 179.920 179.920 179.074 0.846 18517 22371 1 19 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.073 0.987 18517 22372 1 19 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.419 0.551 18517 22373 1 19 . 1 1 56 56 GLU H H 124 8.610 8.610 8.413 0.197 18517 22374 1 19 . 1 1 57 57 ALA N N 125 120.070 120.070 121.465 -1.395 18517 22375 1 19 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.171 -0.341 18517 22376 1 19 . 1 1 57 57 ALA C C 125 178.760 178.760 179.567 -0.807 18517 22377 1 19 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.805 0.575 18517 22378 1 19 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.463 1.677 18517 22379 1 19 . 1 1 57 57 ALA H H 125 8.420 8.420 8.499 -0.079 18517 22380 1 19 . 1 1 58 58 GLY N N 126 106.740 106.740 106.357 0.383 18517 22381 1 19 . 1 1 58 58 GLY C C 126 175.740 175.740 175.875 -0.135 18517 22382 1 19 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.608 0.682 18517 22383 1 19 . 1 1 58 58 GLY H H 126 8.200 8.200 8.455 -0.255 18517 22384 1 19 . 1 1 59 59 LYS N N 127 120.920 120.920 122.068 -1.148 18517 22385 1 19 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.008 -0.078 18517 22386 1 19 . 1 1 59 59 LYS C C 127 180.320 180.320 178.508 1.812 18517 22387 1 19 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.245 0.965 18517 22388 1 19 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.282 0.698 18517 22389 1 19 . 1 1 59 59 LYS H H 127 8.000 8.000 8.120 -0.120 18517 22390 1 19 . 1 1 60 60 LYS N N 128 118.400 118.400 118.668 -0.268 18517 22391 1 19 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.177 -0.007 18517 22392 1 19 . 1 1 60 60 LYS C C 128 180.030 180.030 179.167 0.863 18517 22393 1 19 . 1 1 60 60 LYS CA C 128 58.750 58.750 58.748 0.002 18517 22394 1 19 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.086 0.184 18517 22395 1 19 . 1 1 60 60 LYS H H 128 7.170 7.170 7.861 -0.691 18517 22396 1 19 . 1 1 61 61 VAL N N 129 121.050 121.050 120.815 0.235 18517 22397 1 19 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.481 -0.201 18517 22398 1 19 . 1 1 61 61 VAL C C 129 177.120 177.120 177.753 -0.633 18517 22399 1 19 . 1 1 61 61 VAL CA C 129 67.350 67.350 67.240 0.109 18517 22400 1 19 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.424 0.206 18517 22401 1 19 . 1 1 61 61 VAL H H 129 7.980 7.980 8.165 -0.185 18517 22402 1 19 . 1 1 62 62 LYS N N 130 120.040 120.040 120.011 0.029 18517 22403 1 19 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.986 -0.286 18517 22404 1 19 . 1 1 62 62 LYS C C 130 178.550 178.550 178.676 -0.126 18517 22405 1 19 . 1 1 62 62 LYS CA C 130 60.330 60.330 59.606 0.724 18517 22406 1 19 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.287 1.483 18517 22407 1 19 . 1 1 62 62 LYS H H 130 8.910 8.910 8.504 0.406 18517 22408 1 19 . 1 1 63 63 ALA N N 131 119.570 119.570 123.514 -3.944 18517 22409 1 19 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.063 0.157 18517 22410 1 19 . 1 1 63 63 ALA C C 131 180.520 180.520 179.104 1.416 18517 22411 1 19 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.152 0.068 18517 22412 1 19 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.193 0.277 18517 22413 1 19 . 1 1 63 63 ALA H H 131 7.920 7.920 8.344 -0.424 18517 22414 1 19 . 1 1 64 64 TYR N N 132 120.510 120.510 120.467 0.043 18517 22415 1 19 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.192 0.268 18517 22416 1 19 . 1 1 64 64 TYR C C 132 176.510 176.510 177.589 -1.079 18517 22417 1 19 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.491 0.149 18517 22418 1 19 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.610 0.080 18517 22419 1 19 . 1 1 64 64 TYR H H 132 7.930 7.930 8.079 -0.149 18517 22420 1 19 . 1 1 65 65 LEU N N 133 117.290 117.290 119.812 -2.522 18517 22421 1 19 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.620 0.220 18517 22422 1 19 . 1 1 65 65 LEU C C 133 178.610 178.610 178.754 -0.144 18517 22423 1 19 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.305 -0.585 18517 22424 1 19 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.803 -1.373 18517 22425 1 19 . 1 1 65 65 LEU H H 133 8.240 8.240 8.670 -0.430 18517 22426 1 19 . 1 1 66 66 GLU N N 134 119.140 119.140 117.959 1.181 18517 22427 1 19 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.150 -0.290 18517 22428 1 19 . 1 1 66 66 GLU C C 134 180.200 180.200 178.862 1.338 18517 22429 1 19 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.701 1.239 18517 22430 1 19 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.462 0.347 18517 22431 1 19 . 1 1 66 66 GLU H H 134 8.370 8.370 8.254 0.116 18517 22432 1 19 . 1 1 67 67 LYS N N 135 121.390 121.390 119.454 1.936 18517 22433 1 19 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.074 -0.074 18517 22434 1 19 . 1 1 67 67 LYS C C 135 179.080 179.080 178.596 0.484 18517 22435 1 19 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.909 0.711 18517 22436 1 19 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.597 -0.327 18517 22437 1 19 . 1 1 67 67 LYS H H 135 7.820 7.820 7.897 -0.077 18517 22438 1 19 . 1 1 68 68 ILE N N 136 110.310 110.310 112.631 -2.321 18517 22439 1 19 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.214 0.086 18517 22440 1 19 . 1 1 68 68 ILE C C 136 175.520 175.520 176.896 -1.376 18517 22441 1 19 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.841 0.589 18517 22442 1 19 . 1 1 68 68 ILE CB C 136 37.980 37.980 39.058 -1.078 18517 22443 1 19 . 1 1 68 68 ILE H H 136 7.380 7.380 7.657 -0.277 18517 22444 1 19 . 1 1 69 69 GLY N N 137 106.680 106.680 108.567 -1.887 18517 22445 1 19 . 1 1 69 69 GLY C C 137 174.160 174.160 172.732 1.428 18517 22446 1 19 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.724 0.746 18517 22447 1 19 . 1 1 69 69 GLY H H 137 7.470 7.470 7.864 -0.394 18517 22448 1 19 . 1 1 70 70 ILE N N 138 124.310 124.310 120.060 4.250 18517 22449 1 19 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.438 -0.238 18517 22450 1 19 . 1 1 70 70 ILE C C 138 174.190 174.190 175.034 -0.844 18517 22451 1 19 . 1 1 70 70 ILE CA C 138 59.380 59.380 58.761 0.619 18517 22452 1 19 . 1 1 70 70 ILE CB C 138 37.340 37.340 39.392 -2.052 18517 22453 1 19 . 1 1 70 70 ILE H H 138 8.530 8.530 8.183 0.347 18517 22454 1 19 . 1 1 71 71 ARG N N 139 125.490 125.490 125.551 -0.061 18517 22455 1 19 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.543 0.077 18517 22456 1 19 . 1 1 71 71 ARG C C 139 175.750 175.750 175.557 0.193 18517 22457 1 19 . 1 1 71 71 ARG CA C 139 54.660 54.660 55.308 -0.648 18517 22458 1 19 . 1 1 71 71 ARG CB C 139 33.140 33.140 32.670 0.470 18517 22459 1 19 . 1 1 71 71 ARG H H 139 8.240 8.240 8.554 -0.314 18517 22460 1 19 . 1 1 72 72 GLY N N 140 104.750 104.750 110.269 -5.519 18517 22461 1 19 . 1 1 72 72 GLY C C 140 172.920 172.920 172.680 0.240 18517 22462 1 19 . 1 1 72 72 GLY CA C 140 45.430 45.430 43.612 1.818 18517 22463 1 19 . 1 1 72 72 GLY H H 140 7.900 7.900 8.280 -0.380 18517 22464 1 19 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.581 -0.071 18517 22465 1 19 . 1 1 73 73 ASP C C 141 175.060 175.060 175.939 -0.879 18517 22466 1 19 . 1 1 73 73 ASP CA C 141 56.170 56.170 55.745 0.424 18517 22467 1 19 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.933 -1.103 18517 22468 1 19 . 1 1 74 74 SER N N 142 110.240 110.240 111.761 -1.521 18517 22469 1 19 . 1 1 74 74 SER HA H 142 4.740 4.740 4.739 0.001 18517 22470 1 19 . 1 1 74 74 SER C C 142 175.110 175.110 175.413 -0.303 18517 22471 1 19 . 1 1 74 74 SER CA C 142 55.700 55.700 56.190 -0.490 18517 22472 1 19 . 1 1 74 74 SER CB C 142 67.390 67.390 64.754 2.636 18517 22473 1 19 . 1 1 74 74 SER H H 142 7.560 7.560 7.842 -0.282 18517 22474 1 19 . 1 1 75 75 VAL N N 143 122.950 122.950 119.136 3.814 18517 22475 1 19 . 1 1 75 75 VAL HA H 143 3.730 3.730 4.004 -0.274 18517 22476 1 19 . 1 1 75 75 VAL C C 143 176.230 176.230 177.264 -1.034 18517 22477 1 19 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.476 1.164 18517 22478 1 19 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.442 -0.202 18517 22479 1 19 . 1 1 75 75 VAL H H 143 9.470 9.470 8.951 0.519 18517 22480 1 19 . 1 1 76 76 GLU N N 144 121.390 121.390 120.939 0.451 18517 22481 1 19 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.224 -0.584 18517 22482 1 19 . 1 1 76 76 GLU C C 144 176.880 176.880 178.369 -1.489 18517 22483 1 19 . 1 1 76 76 GLU CA C 144 63.310 63.310 58.776 4.534 18517 22484 1 19 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.357 -0.287 18517 22485 1 19 . 1 1 76 76 GLU H H 144 9.640 9.640 8.477 1.163 18517 22486 1 19 . 1 1 77 77 ALA N N 145 118.770 118.770 122.569 -3.799 18517 22487 1 19 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.219 0.041 18517 22488 1 19 . 1 1 77 77 ALA C C 145 180.350 180.350 179.531 0.819 18517 22489 1 19 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.608 0.173 18517 22490 1 19 . 1 1 77 77 ALA CB C 145 19.190 19.190 17.961 1.229 18517 22491 1 19 . 1 1 77 77 ALA H H 145 7.860 7.860 8.342 -0.482 18517 22492 1 19 . 1 1 78 78 ALA N N 146 120.920 120.920 122.744 -1.824 18517 22493 1 19 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.001 0.139 18517 22494 1 19 . 1 1 78 78 ALA C C 146 179.150 179.150 179.089 0.061 18517 22495 1 19 . 1 1 78 78 ALA CA C 146 55.260 55.260 55.179 0.081 18517 22496 1 19 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.382 0.408 18517 22497 1 19 . 1 1 78 78 ALA H H 146 8.110 8.110 8.098 0.012 18517 22498 1 19 . 1 1 79 79 LEU N N 147 118.810 118.810 119.402 -0.592 18517 22499 1 19 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.031 -0.151 18517 22500 1 19 . 1 1 79 79 LEU C C 147 179.080 179.080 178.440 0.640 18517 22501 1 19 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.858 0.532 18517 22502 1 19 . 1 1 79 79 LEU CB C 147 42.260 42.260 40.903 1.357 18517 22503 1 19 . 1 1 79 79 LEU H H 147 8.360 8.360 8.228 0.132 18517 22504 1 19 . 1 1 80 80 ASP N N 148 121.620 121.620 120.346 1.274 18517 22505 1 19 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.229 0.291 18517 22506 1 19 . 1 1 80 80 ASP C C 148 178.800 178.800 178.071 0.729 18517 22507 1 19 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.185 0.205 18517 22508 1 19 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.958 -0.208 18517 22509 1 19 . 1 1 80 80 ASP H H 148 8.770 8.770 8.585 0.185 18517 22510 1 19 . 1 1 81 81 ASN N N 149 118.630 118.630 118.000 0.630 18517 22511 1 19 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.381 0.189 18517 22512 1 19 . 1 1 81 81 ASN C C 149 177.970 177.970 177.809 0.161 18517 22513 1 19 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.954 -0.944 18517 22514 1 19 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.697 -0.087 18517 22515 1 19 . 1 1 81 81 ASN H H 149 7.960 7.960 8.299 -0.339 18517 22516 1 19 . 1 1 82 82 LEU N N 150 120.030 120.030 121.003 -0.973 18517 22517 1 19 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.925 0.135 18517 22518 1 19 . 1 1 82 82 LEU C C 150 177.790 177.790 179.130 -1.340 18517 22519 1 19 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.114 0.756 18517 22520 1 19 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.842 0.018 18517 22521 1 19 . 1 1 82 82 LEU H H 150 8.230 8.230 8.328 -0.098 18517 22522 1 19 . 1 1 83 83 MET N N 151 115.820 115.820 118.106 -2.286 18517 22523 1 19 . 1 1 83 83 MET HA H 151 4.390 4.390 4.060 0.330 18517 22524 1 19 . 1 1 83 83 MET C C 151 179.760 179.760 179.031 0.729 18517 22525 1 19 . 1 1 83 83 MET CA C 151 57.400 57.400 58.135 -0.735 18517 22526 1 19 . 1 1 83 83 MET CB C 151 31.080 31.080 31.618 -0.538 18517 22527 1 19 . 1 1 83 83 MET H H 151 8.800 8.800 8.281 0.519 18517 22528 1 19 . 1 1 84 84 ILE N N 152 120.330 120.330 120.170 0.160 18517 22529 1 19 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.871 -0.031 18517 22530 1 19 . 1 1 84 84 ILE C C 152 178.660 178.660 178.605 0.055 18517 22531 1 19 . 1 1 84 84 ILE CA C 152 65.800 65.800 64.664 1.136 18517 22532 1 19 . 1 1 84 84 ILE CB C 152 38.450 38.450 36.313 2.137 18517 22533 1 19 . 1 1 84 84 ILE H H 152 8.540 8.540 8.953 -0.413 18517 22534 1 19 . 1 1 85 85 LYS N N 153 118.930 118.930 118.941 -0.011 18517 22535 1 19 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.148 0.052 18517 22536 1 19 . 1 1 85 85 LYS C C 153 179.650 179.650 179.526 0.124 18517 22537 1 19 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.070 1.910 18517 22538 1 19 . 1 1 85 85 LYS CB C 153 33.540 33.540 31.994 1.546 18517 22539 1 19 . 1 1 85 85 LYS H H 153 7.510 7.510 8.151 -0.641 18517 22540 1 19 . 1 1 86 86 VAL N N 154 119.810 119.810 120.792 -0.982 18517 22541 1 19 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.703 -0.073 18517 22542 1 19 . 1 1 86 86 VAL C C 154 178.350 178.350 177.935 0.415 18517 22543 1 19 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.002 1.228 18517 22544 1 19 . 1 1 86 86 VAL CB C 154 32.740 32.740 30.908 1.832 18517 22545 1 19 . 1 1 86 86 VAL H H 154 8.740 8.740 8.129 0.611 18517 22546 1 19 . 1 1 87 87 TYR N N 155 118.370 118.370 119.207 -0.837 18517 22547 1 19 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.068 0.202 18517 22548 1 19 . 1 1 87 87 TYR C C 155 178.580 178.580 178.380 0.200 18517 22549 1 19 . 1 1 87 87 TYR CA C 155 62.910 62.910 62.321 0.589 18517 22550 1 19 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.397 0.583 18517 22551 1 19 . 1 1 87 87 TYR H H 155 8.520 8.520 8.483 0.037 18517 22552 1 19 . 1 1 88 88 GLU N N 156 119.900 119.900 119.448 0.452 18517 22553 1 19 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.045 0.135 18517 22554 1 19 . 1 1 88 88 GLU C C 156 179.270 179.270 178.783 0.487 18517 22555 1 19 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.442 -0.062 18517 22556 1 19 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.431 0.779 18517 22557 1 19 . 1 1 88 88 GLU H H 156 8.250 8.250 8.621 -0.371 18517 22558 1 19 . 1 1 89 89 ILE N N 157 119.510 119.510 119.603 -0.093 18517 22559 1 19 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.892 0.188 18517 22560 1 19 . 1 1 89 89 ILE C C 157 177.890 177.890 178.448 -0.558 18517 22561 1 19 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.400 -0.090 18517 22562 1 19 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.177 1.033 18517 22563 1 19 . 1 1 89 89 ILE H H 157 7.630 7.630 7.811 -0.181 18517 22564 1 19 . 1 1 90 90 THR N N 158 114.240 114.240 115.857 -1.617 18517 22565 1 19 . 1 1 90 90 THR HA H 158 4.130 4.130 4.025 0.105 18517 22566 1 19 . 1 1 90 90 THR C C 158 175.530 175.530 176.409 -0.879 18517 22567 1 19 . 1 1 90 90 THR CA C 158 64.460 64.460 65.887 -1.427 18517 22568 1 19 . 1 1 90 90 THR CB C 158 69.610 69.610 68.930 0.680 18517 22569 1 19 . 1 1 90 90 THR H H 158 7.770 7.770 8.110 -0.340 18517 22570 1 19 . 1 1 91 91 LYS N N 159 120.280 120.280 119.156 1.124 18517 22571 1 19 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.278 0.032 18517 22572 1 19 . 1 1 91 91 LYS C C 159 177.420 177.420 177.474 -0.054 18517 22573 1 19 . 1 1 91 91 LYS CA C 159 57.400 57.400 57.129 0.271 18517 22574 1 19 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.117 0.103 18517 22575 1 19 . 1 1 91 91 LYS H H 159 7.890 7.890 8.289 -0.399 18517 22576 1 19 . 1 1 92 92 GLY N N 160 107.910 107.910 108.769 -0.859 18517 22577 1 19 . 1 1 92 92 GLY C C 160 174.430 174.430 174.286 0.144 18517 22578 1 19 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.610 0.370 18517 22579 1 19 . 1 1 92 92 GLY H H 160 7.930 7.930 7.846 0.084 18517 22580 1 19 . 1 1 93 93 THR N N 161 113.570 113.570 114.805 -1.235 18517 22581 1 19 . 1 1 93 93 THR HA H 161 4.390 4.390 4.537 -0.147 18517 22582 1 19 . 1 1 93 93 THR C C 161 174.790 174.790 173.283 1.507 18517 22583 1 19 . 1 1 93 93 THR CA C 161 61.960 61.960 61.482 0.478 18517 22584 1 19 . 1 1 93 93 THR CB C 161 70.010 70.010 72.774 -2.764 18517 22585 1 19 . 1 1 93 93 THR H H 161 7.970 7.970 7.956 0.014 18517 22586 1 19 . 1 1 94 94 VAL N N 162 121.980 121.980 125.328 -3.348 18517 22587 1 19 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.431 -0.311 18517 22588 1 19 . 1 1 94 94 VAL C C 162 176.300 176.300 174.910 1.390 18517 22589 1 19 . 1 1 94 94 VAL CA C 162 62.830 62.830 60.389 2.442 18517 22590 1 19 . 1 1 94 94 VAL CB C 162 33.060 33.060 33.303 -0.243 18517 22591 1 19 . 1 1 94 94 VAL H H 162 8.130 8.130 8.405 -0.275 18517 22592 1 19 . 1 1 95 95 GLU N N 163 124.140 124.140 127.892 -3.752 18517 22593 1 19 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.584 -0.274 18517 22594 1 19 . 1 1 95 95 GLU C C 163 176.870 176.870 175.520 1.350 18517 22595 1 19 . 1 1 95 95 GLU CA C 163 57.080 57.080 54.513 2.567 18517 22596 1 19 . 1 1 95 95 GLU CB C 163 30.440 30.440 32.924 -2.484 18517 22597 1 19 . 1 1 95 95 GLU H H 163 8.490 8.490 9.405 -0.915 18517 22598 1 19 . 1 1 96 96 SER N N 164 116.800 116.800 120.416 -3.616 18517 22599 1 19 . 1 1 96 96 SER HA H 164 4.430 4.430 4.476 -0.046 18517 22600 1 19 . 1 1 96 96 SER C C 164 174.940 174.940 173.802 1.138 18517 22601 1 19 . 1 1 96 96 SER CA C 164 59.070 59.070 59.365 -0.295 18517 22602 1 19 . 1 1 96 96 SER CB C 164 64.220 64.220 62.340 1.880 18517 22603 1 19 . 1 1 96 96 SER H H 164 8.300 8.300 8.490 -0.190 18517 22604 1 19 . 1 1 97 97 SER C C 165 174.660 174.660 173.117 1.543 18517 22605 1 19 . 1 1 97 97 SER CA C 165 58.870 58.870 58.164 0.706 18517 22606 1 19 . 1 1 97 97 SER CB C 165 64.060 64.060 64.927 -0.868 18517 22607 1 19 . 1 1 98 98 ALA N N 166 125.490 125.490 127.253 -1.763 18517 22608 1 19 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.037 0.313 18517 22609 1 19 . 1 1 98 98 ALA C C 166 177.780 177.780 177.746 0.034 18517 22610 1 19 . 1 1 98 98 ALA CA C 166 53.000 53.000 53.042 -0.042 18517 22611 1 19 . 1 1 98 98 ALA CB C 166 19.340 19.340 18.251 1.089 18517 22612 1 19 . 1 1 98 98 ALA H H 166 8.180 8.180 8.391 -0.211 18517 22613 1 19 . 1 1 99 99 GLN N N 167 118.690 118.690 121.480 -2.790 18517 22614 1 19 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.197 0.143 18517 22615 1 19 . 1 1 99 99 GLN C C 167 176.680 176.680 177.872 -1.192 18517 22616 1 19 . 1 1 99 99 GLN CA C 167 56.250 56.250 57.599 -1.349 18517 22617 1 19 . 1 1 99 99 GLN CB C 167 29.650 29.650 29.505 0.145 18517 22618 1 19 . 1 1 99 99 GLN H H 167 8.170 8.170 8.660 -0.490 18517 22619 1 19 . 1 1 100 100 GLY N N 168 109.670 109.670 106.866 2.804 18517 22620 1 19 . 1 1 100 100 GLY C C 168 174.460 174.460 174.767 -0.307 18517 22621 1 19 . 1 1 100 100 GLY CA C 168 45.670 45.670 45.560 0.110 18517 22622 1 19 . 1 1 100 100 GLY H H 168 8.250 8.250 8.648 -0.398 18517 22623 1 19 . 1 1 101 101 THR N N 169 112.660 112.660 118.725 -6.065 18517 22624 1 19 . 1 1 101 101 THR HA H 169 4.360 4.360 3.967 0.393 18517 22625 1 19 . 1 1 101 101 THR C C 169 174.720 174.720 173.590 1.130 18517 22626 1 19 . 1 1 101 101 THR CA C 169 62.080 62.080 62.934 -0.854 18517 22627 1 19 . 1 1 101 101 THR CB C 169 69.930 69.930 67.433 2.497 18517 22628 1 19 . 1 1 101 101 THR H H 169 8.070 8.070 8.225 -0.155 18517 22629 1 19 . 1 1 102 102 ASP N N 170 123.090 123.090 118.421 4.669 18517 22630 1 19 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.487 0.213 18517 22631 1 19 . 1 1 102 102 ASP C C 170 176.130 176.130 175.145 0.985 18517 22632 1 19 . 1 1 102 102 ASP CA C 170 54.780 54.780 54.206 0.574 18517 22633 1 19 . 1 1 102 102 ASP CB C 170 42.260 42.260 41.896 0.364 18517 22634 1 19 . 1 1 102 102 ASP H H 170 8.170 8.170 8.138 0.032 18517 22635 1 19 . 1 1 103 103 SER N N 171 117.110 117.110 111.823 5.287 18517 22636 1 19 . 1 1 103 103 SER HA H 171 4.430 4.430 4.456 -0.026 18517 22637 1 19 . 1 1 103 103 SER C C 171 174.770 174.770 174.243 0.527 18517 22638 1 19 . 1 1 103 103 SER CA C 171 57.960 57.960 57.502 0.458 18517 22639 1 19 . 1 1 103 103 SER CB C 171 64.940 64.940 64.354 0.586 18517 22640 1 19 . 1 1 103 103 SER H H 171 8.450 8.450 7.931 0.519 18517 22641 1 19 . 1 1 104 104 GLU N N 172 122.970 122.970 122.020 0.950 18517 22642 1 19 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.964 0.066 18517 22643 1 19 . 1 1 104 104 GLU C C 172 178.860 178.860 177.645 1.215 18517 22644 1 19 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.282 -0.582 18517 22645 1 19 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.705 -0.055 18517 22646 1 19 . 1 1 104 104 GLU H H 172 8.830 8.830 8.944 -0.114 18517 22647 1 19 . 1 1 105 105 GLU N N 173 119.750 119.750 119.739 0.011 18517 22648 1 19 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.076 -0.096 18517 22649 1 19 . 1 1 105 105 GLU C C 173 178.920 178.920 178.929 -0.009 18517 22650 1 19 . 1 1 105 105 GLU CA C 173 60.060 60.060 59.052 1.008 18517 22651 1 19 . 1 1 105 105 GLU CB C 173 29.730 29.730 29.477 0.253 18517 22652 1 19 . 1 1 105 105 GLU H H 173 8.580 8.580 8.641 -0.061 18517 22653 1 19 . 1 1 106 106 LEU N N 174 121.860 121.860 120.320 1.540 18517 22654 1 19 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.011 0.169 18517 22655 1 19 . 1 1 106 106 LEU C C 174 178.210 178.210 178.312 -0.102 18517 22656 1 19 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.966 -0.086 18517 22657 1 19 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.285 -0.135 18517 22658 1 19 . 1 1 106 106 LEU H H 174 7.920 7.920 7.800 0.120 18517 22659 1 19 . 1 1 107 107 LYS N N 175 118.740 118.740 119.189 -0.449 18517 22660 1 19 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.955 -0.175 18517 22661 1 19 . 1 1 107 107 LYS C C 175 178.700 178.700 179.110 -0.410 18517 22662 1 19 . 1 1 107 107 LYS CA C 175 61.170 61.170 60.196 0.974 18517 22663 1 19 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.342 0.088 18517 22664 1 19 . 1 1 107 107 LYS H H 175 8.340 8.340 8.198 0.142 18517 22665 1 19 . 1 1 108 108 THR N N 176 113.820 113.820 117.026 -3.206 18517 22666 1 19 . 1 1 108 108 THR HA H 176 3.840 3.840 4.012 -0.172 18517 22667 1 19 . 1 1 108 108 THR C C 176 176.620 176.620 176.347 0.273 18517 22668 1 19 . 1 1 108 108 THR CA C 176 66.910 66.910 67.010 -0.100 18517 22669 1 19 . 1 1 108 108 THR CB C 176 69.610 69.610 68.597 1.013 18517 22670 1 19 . 1 1 108 108 THR H H 176 7.950 7.950 8.475 -0.525 18517 22671 1 19 . 1 1 109 109 LEU N N 177 124.380 124.380 122.570 1.810 18517 22672 1 19 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.201 -0.371 18517 22673 1 19 . 1 1 109 109 LEU C C 177 177.790 177.790 177.679 0.111 18517 22674 1 19 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.738 0.252 18517 22675 1 19 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.619 0.961 18517 22676 1 19 . 1 1 109 109 LEU H H 177 7.480 7.480 7.891 -0.411 18517 22677 1 19 . 1 1 110 110 LEU N N 178 117.230 117.230 119.500 -2.270 18517 22678 1 19 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.895 -0.055 18517 22679 1 19 . 1 1 110 110 LEU C C 178 179.540 179.540 179.368 0.172 18517 22680 1 19 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.892 0.498 18517 22681 1 19 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.233 1.107 18517 22682 1 19 . 1 1 110 110 LEU H H 178 8.670 8.670 8.463 0.207 18517 22683 1 19 . 1 1 111 111 LEU N N 179 119.230 119.230 121.866 -2.636 18517 22684 1 19 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.268 -0.188 18517 22685 1 19 . 1 1 111 111 LEU C C 179 179.310 179.310 179.467 -0.157 18517 22686 1 19 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.576 0.814 18517 22687 1 19 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.791 1.229 18517 22688 1 19 . 1 1 111 111 LEU H H 179 7.940 7.940 8.476 -0.536 18517 22689 1 19 . 1 1 112 112 LYS N N 180 121.910 121.910 120.783 1.127 18517 22690 1 19 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.087 0.103 18517 22691 1 19 . 1 1 112 112 LYS C C 180 178.740 178.740 179.231 -0.491 18517 22692 1 19 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.163 0.017 18517 22693 1 19 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.050 -0.180 18517 22694 1 19 . 1 1 112 112 LYS H H 180 7.420 7.420 8.096 -0.676 18517 22695 1 19 . 1 1 113 113 PHE N N 181 118.220 118.220 118.952 -0.732 18517 22696 1 19 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.262 0.488 18517 22697 1 19 . 1 1 113 113 PHE C C 181 178.520 178.520 177.662 0.858 18517 22698 1 19 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.459 -3.380 18517 22699 1 19 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.434 -0.453 18517 22700 1 19 . 1 1 113 113 PHE H H 181 9.000 9.000 8.902 0.098 18517 22701 1 19 . 1 1 114 114 SER N N 182 113.300 113.300 114.566 -1.266 18517 22702 1 19 . 1 1 114 114 SER HA H 182 3.930 3.930 4.171 -0.241 18517 22703 1 19 . 1 1 114 114 SER C C 182 177.080 177.080 177.344 -0.264 18517 22704 1 19 . 1 1 114 114 SER CA C 182 62.000 62.000 62.205 -0.205 18517 22705 1 19 . 1 1 114 114 SER CB C 182 63.510 63.510 62.818 0.692 18517 22706 1 19 . 1 1 114 114 SER H H 182 8.620 8.620 8.650 -0.030 18517 22707 1 19 . 1 1 115 115 GLU N N 183 121.540 121.540 122.271 -0.731 18517 22708 1 19 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.215 -0.145 18517 22709 1 19 . 1 1 115 115 GLU C C 183 179.860 179.860 178.816 1.044 18517 22710 1 19 . 1 1 115 115 GLU CA C 183 59.780 59.780 58.942 0.838 18517 22711 1 19 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.314 0.576 18517 22712 1 19 . 1 1 115 115 GLU H H 183 8.250 8.250 8.466 -0.216 18517 22713 1 19 . 1 1 116 116 ASP N N 184 121.740 121.740 121.257 0.483 18517 22714 1 19 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.439 0.071 18517 22715 1 19 . 1 1 116 116 ASP C C 184 179.570 179.570 178.257 1.313 18517 22716 1 19 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.151 0.409 18517 22717 1 19 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.879 0.111 18517 22718 1 19 . 1 1 116 116 ASP H H 184 8.840 8.840 8.635 0.205 18517 22719 1 19 . 1 1 117 117 LEU N N 185 121.420 121.420 121.282 0.138 18517 22720 1 19 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.077 0.053 18517 22721 1 19 . 1 1 117 117 LEU C C 185 178.840 178.840 178.426 0.414 18517 22722 1 19 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.222 0.008 18517 22723 1 19 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.631 1.019 18517 22724 1 19 . 1 1 117 117 LEU H H 185 8.350 8.350 8.464 -0.114 18517 22725 1 19 . 1 1 118 118 LYS N N 186 119.640 119.640 118.903 0.737 18517 22726 1 19 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.865 0.255 18517 22727 1 19 . 1 1 118 118 LYS C C 186 178.820 178.820 178.838 -0.018 18517 22728 1 19 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.874 -0.134 18517 22729 1 19 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.284 0.226 18517 22730 1 19 . 1 1 118 118 LYS H H 186 8.220 8.220 8.103 0.117 18517 22731 1 19 . 1 1 119 119 ALA N N 187 120.160 120.160 122.023 -1.863 18517 22732 1 19 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.124 0.036 18517 22733 1 19 . 1 1 119 119 ALA C C 187 180.450 180.450 180.031 0.419 18517 22734 1 19 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.279 -0.139 18517 22735 1 19 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.129 0.341 18517 22736 1 19 . 1 1 119 119 ALA H H 187 8.010 8.010 8.052 -0.042 18517 22737 1 19 . 1 1 120 120 GLU N N 188 117.930 117.930 117.898 0.032 18517 22738 1 19 . 1 1 120 120 GLU HA H 188 4.180 4.180 4.014 0.166 18517 22739 1 19 . 1 1 120 120 GLU C C 188 178.780 178.780 179.127 -0.347 18517 22740 1 19 . 1 1 120 120 GLU CA C 188 58.830 58.830 58.682 0.148 18517 22741 1 19 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.014 0.956 18517 22742 1 19 . 1 1 120 120 GLU H H 188 7.640 7.640 8.179 -0.539 18517 22743 1 19 . 1 1 121 121 GLN N N 189 117.230 117.230 120.475 -3.245 18517 22744 1 19 . 1 1 121 121 GLN HA H 189 4.230 4.230 4.055 0.175 18517 22745 1 19 . 1 1 121 121 GLN C C 189 179.190 179.190 178.191 0.999 18517 22746 1 19 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.785 0.955 18517 22747 1 19 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.550 1.100 18517 22748 1 19 . 1 1 121 121 GLN H H 189 8.280 8.280 8.256 0.024 18517 22749 1 19 . 1 1 122 122 GLU N N 190 118.340 118.340 119.683 -1.343 18517 22750 1 19 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.762 0.358 18517 22751 1 19 . 1 1 122 122 GLU C C 190 178.210 178.210 178.905 -0.695 18517 22752 1 19 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.700 0.050 18517 22753 1 19 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.125 0.845 18517 22754 1 19 . 1 1 122 122 GLU H H 190 8.250 8.250 8.024 0.226 18517 22755 1 19 . 1 1 123 123 LEU N N 191 118.930 118.930 122.255 -3.325 18517 22756 1 19 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.894 0.196 18517 22757 1 19 . 1 1 123 123 LEU C C 191 178.500 178.500 178.322 0.178 18517 22758 1 19 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.658 -1.658 18517 22759 1 19 . 1 1 123 123 LEU CB C 191 42.500 42.500 42.022 0.478 18517 22760 1 19 . 1 1 123 123 LEU H H 191 7.530 7.530 7.936 -0.406 18517 22761 1 19 . 1 1 124 124 HIS N N 192 115.650 115.650 116.431 -0.781 18517 22762 1 19 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.400 0.320 18517 22763 1 19 . 1 1 124 124 HIS C C 192 176.090 176.090 177.391 -1.301 18517 22764 1 19 . 1 1 124 124 HIS CA C 192 56.690 56.690 58.450 -1.760 18517 22765 1 19 . 1 1 124 124 HIS CB C 192 30.760 30.760 30.491 0.270 18517 22766 1 19 . 1 1 124 124 HIS H H 192 7.450 7.450 8.309 -0.859 18517 22767 1 19 . 1 1 125 125 SER N N 193 115.480 115.480 116.534 -1.054 18517 22768 1 19 . 1 1 125 125 SER HA H 193 4.310 4.310 4.007 0.303 18517 22769 1 19 . 1 1 125 125 SER CA C 193 60.180 60.180 61.790 -1.610 18517 22770 1 19 . 1 1 125 125 SER CB C 193 64.060 64.060 62.926 1.134 18517 22771 1 19 . 1 1 125 125 SER H H 193 8.020 8.020 8.295 -0.275 18517 22772 1 19 . 1 1 126 126 GLU C C 194 177.410 177.410 178.996 -1.586 18517 22773 1 19 . 1 1 126 126 GLU CA C 194 57.840 57.840 59.172 -1.332 18517 22774 1 19 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.667 0.223 18517 22775 1 19 . 1 1 127 127 ALA N N 195 122.910 122.910 122.583 0.327 18517 22776 1 19 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.082 0.108 18517 22777 1 19 . 1 1 127 127 ALA C C 195 178.610 178.610 179.352 -0.742 18517 22778 1 19 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.777 -0.987 18517 22779 1 19 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.647 0.613 18517 22780 1 19 . 1 1 127 127 ALA H H 195 8.020 8.020 7.560 0.460 18517 22781 1 19 . 1 1 128 128 LYS N N 196 117.770 117.770 115.748 2.022 18517 22782 1 19 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.346 -0.086 18517 22783 1 19 . 1 1 128 128 LYS C C 196 177.400 177.400 176.095 1.305 18517 22784 1 19 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.515 2.485 18517 22785 1 19 . 1 1 128 128 LYS CB C 196 32.740 32.740 32.098 0.642 18517 22786 1 19 . 1 1 128 128 LYS H H 196 7.990 7.990 7.753 0.237 18517 22787 1 19 . 1 1 129 129 GLY N N 197 109.010 109.010 109.094 -0.084 18517 22788 1 19 . 1 1 129 129 GLY C C 197 175.770 175.770 175.461 0.309 18517 22789 1 19 . 1 1 129 129 GLY CA C 197 46.100 46.100 44.969 1.131 18517 22790 1 19 . 1 1 129 129 GLY H H 197 8.220 8.220 7.757 0.463 18517 22791 1 19 . 1 1 130 130 GLY N N 198 109.150 109.150 111.104 -1.954 18517 22792 1 19 . 1 1 130 130 GLY C C 198 174.760 174.760 175.253 -0.493 18517 22793 1 19 . 1 1 130 130 GLY CA C 198 46.930 46.930 46.965 -0.035 18517 22794 1 19 . 1 1 130 130 GLY H H 198 8.210 8.210 8.243 -0.033 18517 22795 1 19 . 1 1 131 131 GLU N N 199 121.560 121.560 121.015 0.545 18517 22796 1 19 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.149 -0.129 18517 22797 1 19 . 1 1 131 131 GLU C C 199 178.500 178.500 178.595 -0.095 18517 22798 1 19 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.523 0.377 18517 22799 1 19 . 1 1 131 131 GLU CB C 199 29.570 29.570 28.282 1.288 18517 22800 1 19 . 1 1 131 131 GLU H H 199 8.510 8.510 8.682 -0.172 18517 22801 1 19 . 1 1 132 132 ALA N N 200 122.390 122.390 123.927 -1.537 18517 22802 1 19 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.175 0.025 18517 22803 1 19 . 1 1 132 132 ALA C C 200 180.360 180.360 179.744 0.616 18517 22804 1 19 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.498 0.282 18517 22805 1 19 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.168 0.222 18517 22806 1 19 . 1 1 132 132 ALA H H 200 8.190 8.190 7.796 0.394 18517 22807 1 19 . 1 1 133 133 LEU N N 201 120.800 120.800 120.400 0.400 18517 22808 1 19 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.072 0.138 18517 22809 1 19 . 1 1 133 133 LEU C C 201 179.270 179.270 178.714 0.556 18517 22810 1 19 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.693 -0.013 18517 22811 1 19 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.233 0.947 18517 22812 1 19 . 1 1 133 133 LEU H H 201 7.720 7.720 8.522 -0.802 18517 22813 1 19 . 1 1 134 134 LEU N N 202 120.680 120.680 120.502 0.178 18517 22814 1 19 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.983 -0.003 18517 22815 1 19 . 1 1 134 134 LEU C C 202 179.030 179.030 178.940 0.090 18517 22816 1 19 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.613 0.817 18517 22817 1 19 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.492 0.128 18517 22818 1 19 . 1 1 134 134 LEU H H 202 8.470 8.470 8.604 -0.134 18517 22819 1 19 . 1 1 135 135 SER N N 203 113.290 113.290 113.591 -0.301 18517 22820 1 19 . 1 1 135 135 SER HA H 203 4.180 4.180 4.121 0.059 18517 22821 1 19 . 1 1 135 135 SER C C 203 177.300 177.300 176.729 0.571 18517 22822 1 19 . 1 1 135 135 SER CA C 203 62.080 62.080 62.067 0.013 18517 22823 1 19 . 1 1 135 135 SER CB C 203 63.030 63.030 62.709 0.321 18517 22824 1 19 . 1 1 135 135 SER H H 203 8.210 8.210 8.323 -0.113 18517 22825 1 19 . 1 1 136 136 SER N N 204 117.500 117.500 118.028 -0.528 18517 22826 1 19 . 1 1 136 136 SER HA H 204 4.050 4.050 4.291 -0.241 18517 22827 1 19 . 1 1 136 136 SER C C 204 177.570 177.570 176.774 0.796 18517 22828 1 19 . 1 1 136 136 SER CA C 204 61.880 61.880 61.670 0.210 18517 22829 1 19 . 1 1 136 136 SER CB C 204 63.510 63.510 63.006 0.504 18517 22830 1 19 . 1 1 136 136 SER H H 204 7.730 7.730 8.117 -0.387 18517 22831 1 19 . 1 1 137 137 MET N N 205 122.500 122.500 121.102 1.398 18517 22832 1 19 . 1 1 137 137 MET HA H 205 4.140 4.140 4.360 -0.220 18517 22833 1 19 . 1 1 137 137 MET C C 205 177.680 177.680 177.859 -0.179 18517 22834 1 19 . 1 1 137 137 MET CA C 205 60.140 60.140 58.903 1.237 18517 22835 1 19 . 1 1 137 137 MET CB C 205 33.460 33.460 32.442 1.018 18517 22836 1 19 . 1 1 137 137 MET H H 205 8.170 8.170 8.652 -0.482 18517 22837 1 19 . 1 1 138 138 LYS N N 206 121.410 121.410 120.635 0.775 18517 22838 1 19 . 1 1 138 138 LYS HA H 206 3.750 3.750 4.018 -0.268 18517 22839 1 19 . 1 1 138 138 LYS C C 206 178.780 178.780 178.933 -0.153 18517 22840 1 19 . 1 1 138 138 LYS CA C 206 60.330 60.330 60.121 0.209 18517 22841 1 19 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.566 -0.296 18517 22842 1 19 . 1 1 138 138 LYS H H 206 8.810 8.810 8.259 0.551 18517 22843 1 19 . 1 1 139 139 THR N N 207 116.580 116.580 117.080 -0.500 18517 22844 1 19 . 1 1 139 139 THR HA H 207 4.060 4.060 3.910 0.150 18517 22845 1 19 . 1 1 139 139 THR C C 207 176.730 176.730 176.754 -0.024 18517 22846 1 19 . 1 1 139 139 THR CA C 207 67.150 67.150 66.716 0.434 18517 22847 1 19 . 1 1 139 139 THR CB C 207 69.220 69.220 68.730 0.490 18517 22848 1 19 . 1 1 139 139 THR H H 207 7.930 7.930 8.164 -0.234 18517 22849 1 19 . 1 1 140 140 GLN N N 208 121.390 121.390 121.128 0.262 18517 22850 1 19 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.052 0.008 18517 22851 1 19 . 1 1 140 140 GLN C C 208 178.550 178.550 178.211 0.339 18517 22852 1 19 . 1 1 140 140 GLN CA C 208 59.300 59.300 58.750 0.550 18517 22853 1 19 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.258 0.602 18517 22854 1 19 . 1 1 140 140 GLN H H 208 7.600 7.600 8.498 -0.898 18517 22855 1 19 . 1 1 141 141 HIS N N 209 122.360 122.360 118.489 3.871 18517 22856 1 19 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.380 -0.550 18517 22857 1 19 . 1 1 141 141 HIS C C 209 176.390 176.390 177.481 -1.091 18517 22858 1 19 . 1 1 141 141 HIS CA C 209 61.720 61.720 59.575 2.145 18517 22859 1 19 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.307 -1.207 18517 22860 1 19 . 1 1 141 141 HIS H H 209 8.980 8.980 8.221 0.759 18517 22861 1 19 . 1 1 142 142 ASP N N 210 120.740 120.740 120.190 0.550 18517 22862 1 19 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.399 -0.049 18517 22863 1 19 . 1 1 142 142 ASP C C 210 179.490 179.490 178.418 1.072 18517 22864 1 19 . 1 1 142 142 ASP CA C 210 57.920 57.920 58.009 -0.089 18517 22865 1 19 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.957 -0.367 18517 22866 1 19 . 1 1 142 142 ASP H H 210 8.770 8.770 8.560 0.210 18517 22867 1 19 . 1 1 143 143 GLU N N 211 119.010 119.010 121.449 -2.439 18517 22868 1 19 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.092 -0.122 18517 22869 1 19 . 1 1 143 143 GLU C C 211 179.070 179.070 178.933 0.137 18517 22870 1 19 . 1 1 143 143 GLU CA C 211 59.300 59.300 58.937 0.363 18517 22871 1 19 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.359 0.131 18517 22872 1 19 . 1 1 143 143 GLU H H 211 7.850 7.850 8.377 -0.527 18517 22873 1 19 . 1 1 144 144 LEU N N 212 122.500 122.500 120.232 2.268 18517 22874 1 19 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.049 0.021 18517 22875 1 19 . 1 1 144 144 LEU C C 212 179.340 179.340 179.254 0.086 18517 22876 1 19 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.228 0.162 18517 22877 1 19 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.978 0.202 18517 22878 1 19 . 1 1 144 144 LEU H H 212 8.070 8.070 8.131 -0.061 18517 22879 1 19 . 1 1 145 145 LEU N N 213 118.110 118.110 118.241 -0.131 18517 22880 1 19 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.788 0.412 18517 22881 1 19 . 1 1 145 145 LEU C C 213 179.610 179.610 179.050 0.560 18517 22882 1 19 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.773 0.977 18517 22883 1 19 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.171 0.059 18517 22884 1 19 . 1 1 145 145 LEU H H 213 8.370 8.370 8.068 0.302 18517 22885 1 19 . 1 1 146 146 LYS N N 214 117.290 117.290 120.337 -3.047 18517 22886 1 19 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.926 -0.096 18517 22887 1 19 . 1 1 146 146 LYS C C 214 179.900 179.900 178.897 1.003 18517 22888 1 19 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.855 0.475 18517 22889 1 19 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.241 0.109 18517 22890 1 19 . 1 1 146 146 LYS H H 214 7.560 7.560 8.332 -0.772 18517 22891 1 19 . 1 1 147 147 LYS N N 215 120.330 120.330 119.532 0.798 18517 22892 1 19 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.039 -0.019 18517 22893 1 19 . 1 1 147 147 LYS C C 215 180.550 180.550 179.032 1.518 18517 22894 1 19 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.269 0.831 18517 22895 1 19 . 1 1 147 147 LYS CB C 215 32.740 32.740 31.954 0.786 18517 22896 1 19 . 1 1 147 147 LYS H H 215 7.830 7.830 8.096 -0.266 18517 22897 1 19 . 1 1 148 148 PHE N N 216 117.370 117.370 117.739 -0.369 18517 22898 1 19 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.208 -0.128 18517 22899 1 19 . 1 1 148 148 PHE C C 216 178.200 178.200 177.236 0.964 18517 22900 1 19 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.056 1.064 18517 22901 1 19 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.493 1.227 18517 22902 1 19 . 1 1 148 148 PHE H H 216 8.010 8.010 8.315 -0.305 18517 22903 1 19 . 1 1 149 149 ALA N N 217 118.990 118.990 120.346 -1.356 18517 22904 1 19 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.147 -0.037 18517 22905 1 19 . 1 1 149 149 ALA C C 217 177.330 177.330 178.219 -0.889 18517 22906 1 19 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.304 0.445 18517 22907 1 19 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.573 -0.973 18517 22908 1 19 . 1 1 149 149 ALA H H 217 7.720 7.720 7.904 -0.184 18517 22909 1 19 . 1 1 150 150 ALA N N 218 118.690 118.690 120.770 -2.080 18517 22910 1 19 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.328 0.032 18517 22911 1 19 . 1 1 150 150 ALA C C 218 177.930 177.930 177.958 -0.028 18517 22912 1 19 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.696 -0.606 18517 22913 1 19 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.488 0.252 18517 22914 1 19 . 1 1 150 150 ALA H H 218 7.280 7.280 7.669 -0.389 18517 22915 1 19 . 1 1 151 151 LEU N N 219 119.980 119.980 121.484 -1.504 18517 22916 1 19 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.360 -0.090 18517 22917 1 19 . 1 1 151 151 LEU C C 219 176.150 176.150 175.292 0.858 18517 22918 1 19 . 1 1 151 151 LEU CA C 219 56.170 56.170 55.378 0.792 18517 22919 1 19 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.563 -0.753 18517 22920 1 19 . 1 1 151 151 LEU H H 219 7.050 7.050 7.533 -0.483 18517 22921 1 19 . 1 1 152 152 THR N N 220 112.070 112.070 116.663 -4.593 18517 22922 1 19 . 1 1 152 152 THR HA H 220 4.700 4.700 4.956 -0.256 18517 22923 1 19 . 1 1 152 152 THR C C 220 173.400 173.400 173.143 0.257 18517 22924 1 19 . 1 1 152 152 THR CA C 220 58.190 58.190 58.101 0.089 18517 22925 1 19 . 1 1 152 152 THR CB C 220 70.960 70.960 70.050 0.910 18517 22926 1 19 . 1 1 152 152 THR H H 220 8.040 8.040 8.061 -0.021 18517 22927 1 19 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.590 0.120 18517 22928 1 19 . 1 1 153 153 PRO C C 221 176.720 176.720 175.886 0.834 18517 22929 1 19 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.197 0.713 18517 22930 1 19 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.710 1.540 18517 22931 1 19 . 1 1 154 154 THR N N 222 120.460 120.460 118.407 2.053 18517 22932 1 19 . 1 1 154 154 THR HA H 222 4.250 4.250 4.371 -0.121 18517 22933 1 19 . 1 1 154 154 THR C C 222 175.190 175.190 174.861 0.329 18517 22934 1 19 . 1 1 154 154 THR CA C 222 64.650 64.650 62.817 1.833 18517 22935 1 19 . 1 1 154 154 THR CB C 222 70.410 70.410 68.203 2.207 18517 22936 1 19 . 1 1 154 154 THR H H 222 8.530 8.530 8.345 0.185 18517 22937 1 19 . 1 1 155 155 PHE N N 223 122.260 122.260 123.790 -1.530 18517 22938 1 19 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.644 0.346 18517 22939 1 19 . 1 1 155 155 PHE C C 223 172.560 172.560 174.727 -2.167 18517 22940 1 19 . 1 1 155 155 PHE CA C 223 56.770 56.770 57.892 -1.122 18517 22941 1 19 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.410 1.180 18517 22942 1 19 . 1 1 155 155 PHE H H 223 8.950 8.950 7.742 1.208 18517 22943 1 19 . 1 1 156 156 LEU N N 224 123.440 123.440 120.252 3.188 18517 22944 1 19 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.548 0.122 18517 22945 1 19 . 1 1 156 156 LEU C C 224 175.090 175.090 176.771 -1.681 18517 22946 1 19 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.165 -0.135 18517 22947 1 19 . 1 1 156 156 LEU CB C 224 46.300 46.300 43.377 2.923 18517 22948 1 19 . 1 1 156 156 LEU H H 224 7.210 7.210 7.237 -0.026 18517 22949 1 19 . 1 1 157 157 THR N N 225 113.010 113.010 111.130 1.880 18517 22950 1 19 . 1 1 157 157 THR HA H 225 4.790 4.790 4.563 0.227 18517 22951 1 19 . 1 1 157 157 THR C C 225 176.130 176.130 173.936 2.194 18517 22952 1 19 . 1 1 157 157 THR CA C 225 59.860 59.860 60.310 -0.450 18517 22953 1 19 . 1 1 157 157 THR CB C 225 72.860 72.860 71.360 1.500 18517 22954 1 19 . 1 1 157 157 THR H H 225 9.200 9.200 8.173 1.027 18517 22955 1 19 . 1 1 158 158 SER N N 226 115.350 115.350 115.984 -0.634 18517 22956 1 19 . 1 1 158 158 SER C C 226 177.410 177.410 176.197 1.213 18517 22957 1 19 . 1 1 158 158 SER CA C 226 57.400 57.400 57.718 -0.318 18517 22958 1 19 . 1 1 158 158 SER CB C 226 66.200 66.200 64.228 1.972 18517 22959 1 19 . 1 1 158 158 SER H H 226 8.830 8.830 8.358 0.472 18517 22960 1 19 . 1 1 159 159 GLU N N 227 121.200 121.200 119.343 1.857 18517 22961 1 19 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.885 0.135 18517 22962 1 19 . 1 1 159 159 GLU C C 227 177.680 177.680 177.556 0.124 18517 22963 1 19 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.748 0.752 18517 22964 1 19 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.408 0.162 18517 22965 1 19 . 1 1 159 159 GLU H H 227 8.320 8.320 8.840 -0.520 18517 22966 1 19 . 1 1 160 160 ASP N N 228 115.350 115.350 118.039 -2.689 18517 22967 1 19 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.439 0.111 18517 22968 1 19 . 1 1 160 160 ASP C C 228 177.640 177.640 177.348 0.292 18517 22969 1 19 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.762 0.638 18517 22970 1 19 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.590 2.460 18517 22971 1 19 . 1 1 160 160 ASP H H 228 7.570 7.570 8.333 -0.763 18517 22972 1 19 . 1 1 161 161 ILE N N 229 108.150 108.150 113.040 -4.890 18517 22973 1 19 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.424 0.086 18517 22974 1 19 . 1 1 161 161 ILE C C 229 173.130 173.130 176.054 -2.924 18517 22975 1 19 . 1 1 161 161 ILE CA C 229 61.290 61.290 61.619 -0.329 18517 22976 1 19 . 1 1 161 161 ILE CB C 229 39.400 39.400 39.755 -0.355 18517 22977 1 19 . 1 1 161 161 ILE H H 229 7.190 7.190 7.781 -0.591 18517 22978 1 19 . 1 1 162 162 SER N N 230 115.290 115.290 117.651 -2.361 18517 22979 1 19 . 1 1 162 162 SER HA H 230 4.760 4.760 4.068 0.692 18517 22980 1 19 . 1 1 162 162 SER C C 230 176.060 176.060 175.051 1.009 18517 22981 1 19 . 1 1 162 162 SER CA C 230 57.920 57.920 56.647 1.274 18517 22982 1 19 . 1 1 162 162 SER CB C 230 66.120 66.120 61.226 4.894 18517 22983 1 19 . 1 1 162 162 SER H H 230 7.460 7.460 7.969 -0.509 18517 22984 1 19 . 1 1 163 163 GLY C C 231 173.260 173.260 172.918 0.342 18517 22985 1 19 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.935 0.615 18517 22986 1 19 . 1 1 164 164 TYR N N 232 115.290 115.290 116.453 -1.163 18517 22987 1 19 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.672 0.028 18517 22988 1 19 . 1 1 164 164 TYR C C 232 172.820 172.820 173.622 -0.802 18517 22989 1 19 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.831 -0.731 18517 22990 1 19 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.697 0.103 18517 22991 1 19 . 1 1 164 164 TYR H H 232 7.370 7.370 7.320 0.050 18517 22992 1 19 . 1 1 165 165 LEU N N 233 120.980 120.980 122.292 -1.312 18517 22993 1 19 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.752 -0.322 18517 22994 1 19 . 1 1 165 165 LEU C C 233 176.360 176.360 177.585 -1.225 18517 22995 1 19 . 1 1 165 165 LEU CA C 233 55.660 55.660 53.291 2.369 18517 22996 1 19 . 1 1 165 165 LEU CB C 233 40.430 40.430 41.623 -1.193 18517 22997 1 19 . 1 1 165 165 LEU H H 233 8.830 8.830 8.164 0.666 18517 22998 1 19 . 1 1 166 166 THR N N 234 116.170 116.170 114.646 1.524 18517 22999 1 19 . 1 1 166 166 THR HA H 234 4.010 4.010 3.738 0.272 18517 23000 1 19 . 1 1 166 166 THR C C 234 173.070 173.070 174.085 -1.015 18517 23001 1 19 . 1 1 166 166 THR CA C 234 62.910 62.910 64.042 -1.132 18517 23002 1 19 . 1 1 166 166 THR CB C 234 70.170 70.170 69.369 0.801 18517 23003 1 19 . 1 1 166 166 THR H H 234 8.050 8.050 8.606 -0.556 18517 23004 1 19 . 1 1 167 167 VAL N N 235 117.640 117.640 115.161 2.479 18517 23005 1 19 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.259 -0.049 18517 23006 1 19 . 1 1 167 167 VAL C C 235 172.330 172.330 173.371 -1.041 18517 23007 1 19 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.511 1.238 18517 23008 1 19 . 1 1 167 167 VAL CB C 235 35.880 35.880 32.088 3.792 18517 23009 1 19 . 1 1 167 167 VAL H H 235 7.160 7.160 7.551 -0.391 18517 23010 1 19 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.590 -0.400 18517 23011 1 19 . 1 1 168 168 PRO C C 236 173.710 173.710 175.649 -1.939 18517 23012 1 19 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.805 1.025 18517 23013 1 19 . 1 1 168 168 PRO CB C 236 32.270 32.270 33.003 -0.733 18517 23014 1 19 . 1 1 169 169 GLU N N 237 113.540 113.540 118.674 -5.134 18517 23015 1 19 . 1 1 169 169 GLU HA H 237 4.380 4.380 3.947 0.433 18517 23016 1 19 . 1 1 169 169 GLU C C 237 176.690 176.690 178.235 -1.545 18517 23017 1 19 . 1 1 169 169 GLU CA C 237 53.750 53.750 55.212 -1.462 18517 23018 1 19 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.847 2.373 18517 23019 1 19 . 1 1 169 169 GLU H H 237 7.930 7.930 8.301 -0.371 18517 23020 1 19 . 1 1 170 170 TYR N N 238 119.400 119.400 121.106 -1.706 18517 23021 1 19 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.220 -0.220 18517 23022 1 19 . 1 1 170 170 TYR C C 238 177.610 177.610 176.325 1.285 18517 23023 1 19 . 1 1 170 170 TYR CA C 238 62.630 62.630 59.885 2.745 18517 23024 1 19 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.130 -0.390 18517 23025 1 19 . 1 1 170 170 TYR H H 238 8.490 8.490 8.291 0.199 18517 23026 1 19 . 1 1 171 171 GLY N N 239 104.160 104.160 103.360 0.800 18517 23027 1 19 . 1 1 171 171 GLY C C 239 173.350 173.350 172.913 0.437 18517 23028 1 19 . 1 1 171 171 GLY CA C 239 45.270 45.270 45.000 0.270 18517 23029 1 19 . 1 1 171 171 GLY H H 239 7.960 7.960 7.816 0.144 18517 23030 1 19 . 1 1 172 172 ALA N N 240 121.860 121.860 124.160 -2.300 18517 23031 1 19 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.866 -0.696 18517 23032 1 19 . 1 1 172 172 ALA C C 240 172.160 172.160 174.883 -2.723 18517 23033 1 19 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.100 1.010 18517 23034 1 19 . 1 1 172 172 ALA CB C 240 20.930 20.930 19.630 1.300 18517 23035 1 19 . 1 1 172 172 ALA H H 240 6.910 6.910 7.858 -0.948 18517 23036 1 19 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.991 0.559 18517 23037 1 19 . 1 1 173 173 PRO C C 241 176.610 176.610 174.979 1.631 18517 23038 1 19 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.471 -0.951 18517 23039 1 19 . 1 1 173 173 PRO CB C 241 33.300 33.300 31.696 1.604 18517 23040 1 19 . 1 1 174 174 MET N N 242 114.000 114.000 124.047 -10.047 18517 23041 1 19 . 1 1 174 174 MET HA H 242 4.390 4.390 4.719 -0.329 18517 23042 1 19 . 1 1 174 174 MET C C 242 173.960 173.960 174.472 -0.512 18517 23043 1 19 . 1 1 174 174 MET CA C 242 54.660 54.660 53.538 1.122 18517 23044 1 19 . 1 1 174 174 MET CB C 242 34.170 34.170 36.243 -2.074 18517 23045 1 19 . 1 1 174 174 MET H H 242 8.040 8.040 8.213 -0.173 18517 23046 1 19 . 1 1 175 175 ASN N N 243 119.570 119.570 124.481 -4.911 18517 23047 1 19 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.819 0.121 18517 23048 1 19 . 1 1 175 175 ASN C C 243 174.320 174.320 175.462 -1.142 18517 23049 1 19 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.256 0.824 18517 23050 1 19 . 1 1 175 175 ASN CB C 243 38.850 38.850 38.848 0.002 18517 23051 1 19 . 1 1 175 175 ASN H H 243 7.960 7.960 8.356 -0.396 18517 23052 1 19 . 1 1 176 176 ALA N N 244 132.250 132.250 128.758 3.492 18517 23053 1 19 . 1 1 176 176 ALA C C 244 181.580 181.580 178.602 2.978 18517 23054 1 19 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.406 0.364 18517 23055 1 19 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.718 0.312 18517 23056 1 19 . 1 1 176 176 ALA H H 244 12.110 12.110 8.666 3.444 18517 23057 1 19 . 1 1 177 177 ALA N N 245 125.780 125.780 121.073 4.707 18517 23058 1 19 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.970 -0.100 18517 23059 1 19 . 1 1 177 177 ALA C C 245 180.640 180.640 179.460 1.180 18517 23060 1 19 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.128 0.532 18517 23061 1 19 . 1 1 177 177 ALA CB C 245 17.840 17.840 17.960 -0.120 18517 23062 1 19 . 1 1 177 177 ALA H H 245 10.240 10.240 8.362 1.878 18517 23063 1 19 . 1 1 178 178 LYS N N 246 119.810 119.810 119.120 0.690 18517 23064 1 19 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.055 -0.225 18517 23065 1 19 . 1 1 178 178 LYS C C 246 180.500 180.500 178.086 2.414 18517 23066 1 19 . 1 1 178 178 LYS CA C 246 59.900 59.900 58.980 0.920 18517 23067 1 19 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.131 -0.811 18517 23068 1 19 . 1 1 178 178 LYS H H 246 8.470 8.470 7.826 0.644 18517 23069 1 19 . 1 1 179 179 TRP N N 247 121.170 121.170 120.999 0.171 18517 23070 1 19 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.242 0.378 18517 23071 1 19 . 1 1 179 179 TRP C C 247 176.510 176.510 178.066 -1.556 18517 23072 1 19 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.841 -0.021 18517 23073 1 19 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.550 0.020 18517 23074 1 19 . 1 1 179 179 TRP H H 247 8.330 8.330 8.284 0.046 18517 23075 1 19 . 1 1 180 180 ALA N N 248 119.130 119.130 120.333 -1.203 18517 23076 1 19 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.719 0.821 18517 23077 1 19 . 1 1 180 180 ALA C C 248 182.110 182.110 179.358 2.752 18517 23078 1 19 . 1 1 180 180 ALA CA C 248 54.190 54.190 55.108 -0.918 18517 23079 1 19 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.110 0.600 18517 23080 1 19 . 1 1 180 180 ALA H H 248 7.990 7.990 8.651 -0.661 18517 23081 1 19 . 1 1 181 181 LYS N N 249 116.000 116.000 119.296 -3.296 18517 23082 1 19 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.090 -0.120 18517 23083 1 19 . 1 1 181 181 LYS C C 249 179.380 179.380 178.908 0.472 18517 23084 1 19 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.282 -0.573 18517 23085 1 19 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.821 -0.311 18517 23086 1 19 . 1 1 181 181 LYS H H 249 6.900 6.900 7.818 -0.918 18517 23087 1 19 . 1 1 182 182 VAL N N 250 122.270 122.270 115.447 6.823 18517 23088 1 19 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.796 -0.456 18517 23089 1 19 . 1 1 182 182 VAL C C 250 178.160 178.160 177.756 0.404 18517 23090 1 19 . 1 1 182 182 VAL CA C 250 66.760 66.760 65.798 0.962 18517 23091 1 19 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.608 -0.767 18517 23092 1 19 . 1 1 182 182 VAL H H 250 7.050 7.050 8.321 -1.271 18517 23093 1 19 . 1 1 183 183 GLU N N 251 120.520 120.520 120.835 -0.315 18517 23094 1 19 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.909 -0.729 18517 23095 1 19 . 1 1 183 183 GLU C C 251 179.480 179.480 178.889 0.591 18517 23096 1 19 . 1 1 183 183 GLU CA C 251 60.690 60.690 58.910 1.780 18517 23097 1 19 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.668 -0.598 18517 23098 1 19 . 1 1 183 183 GLU H H 251 8.020 8.020 8.591 -0.571 18517 23099 1 19 . 1 1 184 184 GLY N N 252 102.930 102.930 107.081 -4.151 18517 23100 1 19 . 1 1 184 184 GLY C C 252 176.920 176.920 176.513 0.407 18517 23101 1 19 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.080 0.330 18517 23102 1 19 . 1 1 184 184 GLY H H 252 7.830 7.830 8.071 -0.241 18517 23103 1 19 . 1 1 185 185 MET N N 253 123.200 123.200 121.906 1.294 18517 23104 1 19 . 1 1 185 185 MET HA H 253 4.250 4.250 4.040 0.210 18517 23105 1 19 . 1 1 185 185 MET C C 253 179.370 179.370 178.296 1.074 18517 23106 1 19 . 1 1 185 185 MET CA C 253 59.300 59.300 59.372 -0.072 18517 23107 1 19 . 1 1 185 185 MET CB C 253 33.930 33.930 32.508 1.422 18517 23108 1 19 . 1 1 185 185 MET H H 253 7.890 7.890 7.798 0.092 18517 23109 1 19 . 1 1 186 186 ILE N N 254 120.150 120.150 119.817 0.333 18517 23110 1 19 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.700 -0.140 18517 23111 1 19 . 1 1 186 186 ILE C C 254 177.250 177.250 178.197 -0.947 18517 23112 1 19 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.655 0.865 18517 23113 1 19 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.684 0.606 18517 23114 1 19 . 1 1 186 186 ILE H H 254 8.260 8.260 8.192 0.068 18517 23115 1 19 . 1 1 187 187 HIS N N 255 119.810 119.810 118.448 1.362 18517 23116 1 19 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.238 -0.238 18517 23117 1 19 . 1 1 187 187 HIS C C 255 176.460 176.460 177.410 -0.950 18517 23118 1 19 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.777 0.553 18517 23119 1 19 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.918 1.712 18517 23120 1 19 . 1 1 187 187 HIS H H 255 8.900 8.900 8.897 0.003 18517 23121 1 19 . 1 1 188 188 GLY N N 256 103.160 103.160 107.512 -4.352 18517 23122 1 19 . 1 1 188 188 GLY C C 256 176.320 176.320 176.159 0.161 18517 23123 1 19 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.896 -0.006 18517 23124 1 19 . 1 1 188 188 GLY H H 256 8.030 8.030 8.233 -0.203 18517 23125 1 19 . 1 1 189 189 LYS N N 257 119.510 119.510 122.759 -3.249 18517 23126 1 19 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.085 -0.085 18517 23127 1 19 . 1 1 189 189 LYS C C 257 178.660 178.660 179.437 -0.777 18517 23128 1 19 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.370 -0.880 18517 23129 1 19 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.551 -0.001 18517 23130 1 19 . 1 1 189 189 LYS H H 257 7.120 7.120 7.899 -0.779 18517 23131 1 19 . 1 1 190 190 LEU N N 258 120.570 120.570 119.870 0.700 18517 23132 1 19 . 1 1 190 190 LEU HA H 258 3.930 3.930 3.973 -0.043 18517 23133 1 19 . 1 1 190 190 LEU C C 258 177.230 177.230 176.513 0.717 18517 23134 1 19 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.455 0.066 18517 23135 1 19 . 1 1 190 190 LEU CB C 258 42.970 42.970 42.061 0.909 18517 23136 1 19 . 1 1 190 190 LEU H H 258 8.060 8.060 8.179 -0.119 18517 23137 1 19 . 1 1 191 191 GLU N N 259 114.590 114.590 114.446 0.144 18517 23138 1 19 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.280 -0.000 18517 23139 1 19 . 1 1 191 191 GLU C C 259 176.230 176.230 176.706 -0.476 18517 23140 1 19 . 1 1 191 191 GLU CA C 259 55.340 55.340 55.410 -0.070 18517 23141 1 19 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.372 -0.042 18517 23142 1 19 . 1 1 191 191 GLU H H 259 7.330 7.330 7.662 -0.333 18517 23143 1 19 . 1 1 192 192 SER N N 260 115.240 115.240 117.575 -2.335 18517 23144 1 19 . 1 1 192 192 SER HA H 260 4.490 4.490 4.408 0.082 18517 23145 1 19 . 1 1 192 192 SER C C 260 173.770 173.770 175.700 -1.930 18517 23146 1 19 . 1 1 192 192 SER CA C 260 58.350 58.350 58.138 0.212 18517 23147 1 19 . 1 1 192 192 SER CB C 260 65.090 65.090 63.917 1.173 18517 23148 1 19 . 1 1 192 192 SER H H 260 7.130 7.130 7.697 -0.567 18517 23149 1 19 . 1 1 193 193 SER C C 261 174.600 174.600 175.080 -0.480 18517 23150 1 19 . 1 1 193 193 SER CA C 261 59.980 59.980 60.916 -0.936 18517 23151 1 19 . 1 1 193 193 SER CB C 261 63.750 63.750 63.226 0.524 18517 23152 1 19 . 1 1 194 194 GLU N N 262 121.800 121.800 119.707 2.093 18517 23153 1 19 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.393 0.077 18517 23154 1 19 . 1 1 194 194 GLU C C 262 174.650 174.650 174.743 -0.093 18517 23155 1 19 . 1 1 194 194 GLU CA C 262 55.620 55.620 56.089 -0.469 18517 23156 1 19 . 1 1 194 194 GLU CB C 262 30.210 30.210 31.169 -0.959 18517 23157 1 19 . 1 1 194 194 GLU H H 262 7.840 7.840 7.915 -0.075 18517 23158 1 19 . 1 1 195 195 VAL N N 263 124.080 124.080 126.895 -2.815 18517 23159 1 19 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.267 -0.017 18517 23160 1 19 . 1 1 195 195 VAL C C 263 174.460 174.460 174.111 0.349 18517 23161 1 19 . 1 1 195 195 VAL CA C 263 59.820 59.820 59.642 0.178 18517 23162 1 19 . 1 1 195 195 VAL CB C 263 33.620 33.620 32.950 0.670 18517 23163 1 19 . 1 1 195 195 VAL H H 263 8.020 8.020 8.392 -0.372 18517 23164 1 19 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.471 0.049 18517 23165 1 19 . 1 1 198 198 ASN C C 266 176.490 176.490 177.446 -0.956 18517 23166 1 19 . 1 1 198 198 ASN CA C 266 54.780 54.780 55.192 -0.412 18517 23167 1 19 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.541 0.519 18517 23168 1 19 . 1 1 199 199 LEU N N 267 120.680 120.680 121.818 -1.138 18517 23169 1 19 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.942 0.068 18517 23170 1 19 . 1 1 199 199 LEU C C 267 178.050 178.050 178.401 -0.351 18517 23171 1 19 . 1 1 199 199 LEU CA C 267 58.830 58.830 57.745 1.085 18517 23172 1 19 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.604 0.736 18517 23173 1 19 . 1 1 199 199 LEU H H 267 7.660 7.660 7.834 -0.174 18517 23174 1 19 . 1 1 200 200 LYS N N 268 116.740 116.740 119.538 -2.798 18517 23175 1 19 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.899 -0.169 18517 23176 1 19 . 1 1 200 200 LYS C C 268 178.520 178.520 178.732 -0.212 18517 23177 1 19 . 1 1 200 200 LYS CA C 268 61.800 61.800 58.996 2.804 18517 23178 1 19 . 1 1 200 200 LYS CB C 268 32.110 32.110 31.803 0.307 18517 23179 1 19 . 1 1 200 200 LYS H H 268 8.280 8.280 8.612 -0.332 18517 23180 1 19 . 1 1 201 201 ALA N N 269 121.270 121.270 121.910 -0.640 18517 23181 1 19 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.097 0.143 18517 23182 1 19 . 1 1 201 201 ALA C C 269 180.890 180.890 179.546 1.344 18517 23183 1 19 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.102 0.078 18517 23184 1 19 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.386 0.084 18517 23185 1 19 . 1 1 201 201 ALA H H 269 7.710 7.710 7.826 -0.116 18517 23186 1 19 . 1 1 202 202 LEU N N 270 119.980 119.980 119.378 0.602 18517 23187 1 19 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.853 0.237 18517 23188 1 19 . 1 1 202 202 LEU C C 270 179.330 179.330 179.302 0.028 18517 23189 1 19 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.863 0.207 18517 23190 1 19 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.334 1.086 18517 23191 1 19 . 1 1 202 202 LEU H H 270 7.750 7.750 8.087 -0.337 18517 23192 1 19 . 1 1 203 203 VAL N N 271 118.450 118.450 119.231 -0.781 18517 23193 1 19 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.852 -0.022 18517 23194 1 19 . 1 1 203 203 VAL C C 271 177.110 177.110 177.934 -0.824 18517 23195 1 19 . 1 1 203 203 VAL CA C 271 67.710 67.710 67.096 0.614 18517 23196 1 19 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.558 0.152 18517 23197 1 19 . 1 1 203 203 VAL H H 271 8.560 8.560 8.623 -0.063 18517 23198 1 19 . 1 1 204 204 ALA N N 272 122.560 122.560 121.999 0.561 18517 23199 1 19 . 1 1 204 204 ALA HA H 272 3.880 3.880 4.011 -0.131 18517 23200 1 19 . 1 1 204 204 ALA C C 272 178.700 178.700 179.718 -1.018 18517 23201 1 19 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.663 0.467 18517 23202 1 19 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.016 0.374 18517 23203 1 19 . 1 1 204 204 ALA H H 272 8.120 8.120 8.286 -0.166 18517 23204 1 19 . 1 1 205 205 GLU N N 273 117.290 117.290 118.773 -1.483 18517 23205 1 19 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.085 -0.095 18517 23206 1 19 . 1 1 205 205 GLU C C 273 178.630 178.630 179.233 -0.603 18517 23207 1 19 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.188 0.952 18517 23208 1 19 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.387 0.582 18517 23209 1 19 . 1 1 205 205 GLU H H 273 7.670 7.670 8.261 -0.591 18517 23210 1 19 . 1 1 206 206 LEU N N 274 120.450 120.450 122.064 -1.614 18517 23211 1 19 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.150 -0.150 18517 23212 1 19 . 1 1 206 206 LEU C C 274 178.400 178.400 179.086 -0.686 18517 23213 1 19 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.263 0.647 18517 23214 1 19 . 1 1 206 206 LEU CB C 274 43.530 43.530 42.156 1.374 18517 23215 1 19 . 1 1 206 206 LEU H H 274 8.420 8.420 8.221 0.199 18517 23216 1 19 . 1 1 207 207 ILE N N 275 117.580 117.580 120.581 -3.001 18517 23217 1 19 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.596 -0.066 18517 23218 1 19 . 1 1 207 207 ILE C C 275 178.850 178.850 178.172 0.678 18517 23219 1 19 . 1 1 207 207 ILE CA C 275 66.080 66.080 66.153 -0.073 18517 23220 1 19 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.883 0.887 18517 23221 1 19 . 1 1 207 207 ILE H H 275 8.700 8.700 8.505 0.195 18517 23222 1 19 . 1 1 208 208 GLU N N 276 119.100 119.100 119.305 -0.205 18517 23223 1 19 . 1 1 208 208 GLU HA H 276 4.000 4.000 3.975 0.025 18517 23224 1 19 . 1 1 208 208 GLU C C 276 178.540 178.540 179.361 -0.821 18517 23225 1 19 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.840 0.610 18517 23226 1 19 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.643 0.877 18517 23227 1 19 . 1 1 208 208 GLU H H 276 7.950 7.950 8.417 -0.467 18517 23228 1 19 . 1 1 209 209 LEU N N 277 120.590 120.590 119.881 0.709 18517 23229 1 19 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.178 0.042 18517 23230 1 19 . 1 1 209 209 LEU C C 277 179.520 179.520 179.063 0.457 18517 23231 1 19 . 1 1 209 209 LEU CA C 277 58.350 58.350 57.770 0.580 18517 23232 1 19 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.000 2.290 18517 23233 1 19 . 1 1 209 209 LEU H H 277 8.550 8.550 8.432 0.118 18517 23234 1 19 . 1 1 210 210 ARG N N 278 116.470 116.470 120.531 -4.061 18517 23235 1 19 . 1 1 210 210 ARG HA H 278 3.740 3.740 3.982 -0.242 18517 23236 1 19 . 1 1 210 210 ARG C C 278 179.190 179.190 178.608 0.582 18517 23237 1 19 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.345 2.335 18517 23238 1 19 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.055 1.345 18517 23239 1 19 . 1 1 210 210 ARG H H 278 8.590 8.590 8.792 -0.202 18517 23240 1 19 . 1 1 211 211 ALA N N 279 120.470 120.470 122.507 -2.037 18517 23241 1 19 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.074 -0.164 18517 23242 1 19 . 1 1 211 211 ALA C C 279 181.350 181.350 179.907 1.443 18517 23243 1 19 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.194 0.506 18517 23244 1 19 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.530 -1.250 18517 23245 1 19 . 1 1 211 211 ALA H H 279 8.050 8.050 8.306 -0.256 18517 23246 1 19 . 1 1 212 212 GLN N N 280 120.070 120.070 118.130 1.940 18517 23247 1 19 . 1 1 212 212 GLN HA H 280 4.020 4.020 4.053 -0.033 18517 23248 1 19 . 1 1 212 212 GLN C C 280 179.490 179.490 178.823 0.667 18517 23249 1 19 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.745 0.555 18517 23250 1 19 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.772 0.408 18517 23251 1 19 . 1 1 212 212 GLN H H 280 8.300 8.300 8.111 0.189 18517 23252 1 19 . 1 1 213 213 MET N N 281 119.810 119.810 119.300 0.510 18517 23253 1 19 . 1 1 213 213 MET HA H 281 3.730 3.730 4.216 -0.486 18517 23254 1 19 . 1 1 213 213 MET C C 281 177.490 177.490 178.677 -1.187 18517 23255 1 19 . 1 1 213 213 MET CA C 281 60.690 60.690 58.374 2.316 18517 23256 1 19 . 1 1 213 213 MET CB C 281 33.930 33.930 32.322 1.608 18517 23257 1 19 . 1 1 213 213 MET H H 281 8.420 8.420 8.755 -0.335 18517 23258 1 19 . 1 1 214 214 MET N N 282 114.000 114.000 118.883 -4.883 18517 23259 1 19 . 1 1 214 214 MET HA H 282 3.880 3.880 4.285 -0.405 18517 23260 1 19 . 1 1 214 214 MET C C 282 177.650 177.650 178.275 -0.625 18517 23261 1 19 . 1 1 214 214 MET CA C 282 58.670 58.670 57.786 0.884 18517 23262 1 19 . 1 1 214 214 MET CB C 282 33.300 33.300 31.581 1.719 18517 23263 1 19 . 1 1 214 214 MET H H 282 7.890 7.890 8.419 -0.529 18517 23264 1 19 . 1 1 215 215 ALA N N 283 119.970 119.970 122.775 -2.805 18517 23265 1 19 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.069 0.071 18517 23266 1 19 . 1 1 215 215 ALA C C 283 180.580 180.580 179.251 1.329 18517 23267 1 19 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.113 -1.003 18517 23268 1 19 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.189 -0.509 18517 23269 1 19 . 1 1 215 215 ALA H H 283 7.580 7.580 8.093 -0.513 18517 23270 1 19 . 1 1 216 216 LEU N N 284 120.920 120.920 118.744 2.176 18517 23271 1 19 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.227 -0.267 18517 23272 1 19 . 1 1 216 216 LEU C C 284 177.910 177.910 179.190 -1.280 18517 23273 1 19 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.455 0.465 18517 23274 1 19 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.088 0.412 18517 23275 1 19 . 1 1 216 216 LEU H H 284 7.460 7.460 8.086 -0.626 18517 23276 1 19 . 1 1 217 217 LEU N N 285 116.470 116.470 121.821 -5.351 18517 23277 1 19 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.992 -0.312 18517 23278 1 19 . 1 1 217 217 LEU C C 285 178.310 178.310 177.715 0.595 18517 23279 1 19 . 1 1 217 217 LEU CA C 285 57.440 57.440 58.163 -0.723 18517 23280 1 19 . 1 1 217 217 LEU CB C 285 43.050 43.050 42.143 0.907 18517 23281 1 19 . 1 1 217 217 LEU H H 285 6.980 6.980 8.523 -1.543 18517 23282 1 19 . 1 1 218 218 TYR N N 286 111.080 111.080 113.280 -2.200 18517 23283 1 19 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.668 0.232 18517 23284 1 19 . 1 1 218 218 TYR C C 286 176.090 176.090 176.547 -0.457 18517 23285 1 19 . 1 1 218 218 TYR CA C 286 56.050 56.050 56.704 -0.654 18517 23286 1 19 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.055 2.855 18517 23287 1 19 . 1 1 218 218 TYR H H 286 7.660 7.660 8.156 -0.496 18517 23288 1 19 . 1 1 219 219 GLY N N 287 108.260 108.260 111.585 -3.325 18517 23289 1 19 . 1 1 219 219 GLY CA C 287 44.320 44.320 44.243 0.077 18517 23290 1 19 . 1 1 219 219 GLY H H 287 7.750 7.750 7.791 -0.041 18517 23291 1 19 . 1 1 221 221 ILE HA H 289 3.490 3.490 4.225 -0.735 18517 23292 1 19 . 1 1 221 221 ILE CA C 289 63.580 63.580 60.997 2.583 18517 23293 1 19 . 1 1 221 221 ILE CB C 289 38.280 38.280 37.553 0.727 18517 23294 1 19 . 1 1 222 222 GLY CA C 290 45.740 45.740 44.814 0.926 18517 23295 1 20 . 1 1 2 2 LYS N N 70 126.600 126.600 126.266 0.334 18517 23296 1 20 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.843 -0.483 18517 23297 1 20 . 1 1 2 2 LYS C C 70 176.000 176.000 174.736 1.264 18517 23298 1 20 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.515 0.935 18517 23299 1 20 . 1 1 2 2 LYS CB C 70 33.850 33.850 33.992 -0.142 18517 23300 1 20 . 1 1 2 2 LYS H H 70 8.530 8.530 8.369 0.161 18517 23301 1 20 . 1 1 3 3 THR N N 71 111.030 111.030 116.967 -5.937 18517 23302 1 20 . 1 1 3 3 THR HA H 71 4.400 4.400 4.564 -0.164 18517 23303 1 20 . 1 1 3 3 THR C C 71 175.650 175.650 174.768 0.882 18517 23304 1 20 . 1 1 3 3 THR CA C 71 60.610 60.610 60.129 0.481 18517 23305 1 20 . 1 1 3 3 THR CB C 71 71.520 71.520 70.163 1.357 18517 23306 1 20 . 1 1 3 3 THR H H 71 7.390 7.390 8.260 -0.870 18517 23307 1 20 . 1 1 4 4 LEU N N 72 121.560 121.560 122.847 -1.287 18517 23308 1 20 . 1 1 4 4 LEU C C 72 177.870 177.870 178.594 -0.724 18517 23309 1 20 . 1 1 4 4 LEU CA C 72 58.480 58.480 59.210 -0.730 18517 23310 1 20 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.646 0.534 18517 23311 1 20 . 1 1 4 4 LEU H H 72 8.980 8.980 8.622 0.358 18517 23312 1 20 . 1 1 5 5 ASP N N 73 115.530 115.530 116.806 -1.276 18517 23313 1 20 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.354 -0.024 18517 23314 1 20 . 1 1 5 5 ASP C C 73 179.290 179.290 178.353 0.937 18517 23315 1 20 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.297 0.543 18517 23316 1 20 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.758 0.072 18517 23317 1 20 . 1 1 5 5 ASP H H 73 8.270 8.270 8.595 -0.325 18517 23318 1 20 . 1 1 6 6 VAL N N 74 122.330 122.330 119.689 2.641 18517 23319 1 20 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.802 -0.062 18517 23320 1 20 . 1 1 6 6 VAL C C 74 178.970 178.970 177.983 0.987 18517 23321 1 20 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.564 0.796 18517 23322 1 20 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.582 0.368 18517 23323 1 20 . 1 1 6 6 VAL H H 74 7.400 7.400 7.498 -0.098 18517 23324 1 20 . 1 1 7 7 LEU N N 75 121.360 121.360 121.333 0.027 18517 23325 1 20 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.935 0.095 18517 23326 1 20 . 1 1 7 7 LEU C C 75 179.240 179.240 179.034 0.206 18517 23327 1 20 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.479 -0.249 18517 23328 1 20 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.188 1.702 18517 23329 1 20 . 1 1 7 7 LEU H H 75 8.300 8.300 8.634 -0.334 18517 23330 1 20 . 1 1 8 8 ARG N N 76 117.230 117.230 119.698 -2.468 18517 23331 1 20 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.115 -0.195 18517 23332 1 20 . 1 1 8 8 ARG C C 76 178.290 178.290 178.729 -0.439 18517 23333 1 20 . 1 1 8 8 ARG CA C 76 60.770 60.770 58.329 2.441 18517 23334 1 20 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.296 0.914 18517 23335 1 20 . 1 1 8 8 ARG H H 76 8.520 8.520 8.895 -0.375 18517 23336 1 20 . 1 1 9 9 GLY N N 77 104.570 104.570 107.757 -3.187 18517 23337 1 20 . 1 1 9 9 GLY C C 77 176.180 176.180 176.307 -0.127 18517 23338 1 20 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.962 0.208 18517 23339 1 20 . 1 1 9 9 GLY H H 77 7.620 7.620 8.184 -0.564 18517 23340 1 20 . 1 1 10 10 GLU N N 78 120.270 120.270 122.925 -2.655 18517 23341 1 20 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.025 0.245 18517 23342 1 20 . 1 1 10 10 GLU C C 78 179.030 179.030 179.144 -0.114 18517 23343 1 20 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.256 -0.386 18517 23344 1 20 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.552 1.848 18517 23345 1 20 . 1 1 10 10 GLU H H 78 8.100 8.100 8.163 -0.063 18517 23346 1 20 . 1 1 11 11 LEU N N 79 116.000 116.000 120.221 -4.221 18517 23347 1 20 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.922 0.588 18517 23348 1 20 . 1 1 11 11 LEU C C 79 179.630 179.630 178.704 0.926 18517 23349 1 20 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.511 -1.821 18517 23350 1 20 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.560 3.240 18517 23351 1 20 . 1 1 11 11 LEU H H 79 8.230 8.230 8.609 -0.379 18517 23352 1 20 . 1 1 12 12 ARG N N 80 120.020 120.020 119.629 0.391 18517 23353 1 20 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.987 -0.237 18517 23354 1 20 . 1 1 12 12 ARG C C 80 178.490 178.490 178.847 -0.357 18517 23355 1 20 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.086 2.914 18517 23356 1 20 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.599 1.641 18517 23357 1 20 . 1 1 12 12 ARG H H 80 8.210 8.210 8.681 -0.471 18517 23358 1 20 . 1 1 13 13 GLY N N 81 108.090 108.090 107.111 0.979 18517 23359 1 20 . 1 1 13 13 GLY C C 81 173.540 173.540 175.856 -2.316 18517 23360 1 20 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.747 1.253 18517 23361 1 20 . 1 1 13 13 GLY H H 81 8.890 8.890 8.229 0.661 18517 23362 1 20 . 1 1 14 14 GLN C C 82 179.540 179.540 178.043 1.497 18517 23363 1 20 . 1 1 14 14 GLN CA C 82 58.710 58.710 59.169 -0.459 18517 23364 1 20 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.677 0.423 18517 23365 1 20 . 1 1 15 15 ARG N N 83 118.220 118.220 119.639 -1.419 18517 23366 1 20 . 1 1 15 15 ARG HA H 83 3.950 3.950 3.974 -0.024 18517 23367 1 20 . 1 1 15 15 ARG C C 83 177.710 177.710 178.415 -0.705 18517 23368 1 20 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.188 0.712 18517 23369 1 20 . 1 1 15 15 ARG CB C 83 29.650 29.650 29.495 0.155 18517 23370 1 20 . 1 1 15 15 ARG H H 83 7.320 7.320 8.553 -1.233 18517 23371 1 20 . 1 1 16 16 GLU N N 84 118.810 118.810 119.966 -1.156 18517 23372 1 20 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.114 -0.264 18517 23373 1 20 . 1 1 16 16 GLU C C 84 178.750 178.750 178.628 0.122 18517 23374 1 20 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.536 1.474 18517 23375 1 20 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.607 -0.197 18517 23376 1 20 . 1 1 16 16 GLU H H 84 8.450 8.450 8.347 0.103 18517 23377 1 20 . 1 1 17 17 ALA N N 85 122.790 122.790 122.258 0.532 18517 23378 1 20 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.128 0.062 18517 23379 1 20 . 1 1 17 17 ALA C C 85 180.360 180.360 179.843 0.517 18517 23380 1 20 . 1 1 17 17 ALA CA C 85 55.460 55.460 54.991 0.469 18517 23381 1 20 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.214 -0.134 18517 23382 1 20 . 1 1 17 17 ALA H H 85 8.420 8.420 8.205 0.215 18517 23383 1 20 . 1 1 18 18 PHE N N 86 119.400 119.400 119.855 -0.455 18517 23384 1 20 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.211 0.079 18517 23385 1 20 . 1 1 18 18 PHE C C 86 177.560 177.560 177.246 0.314 18517 23386 1 20 . 1 1 18 18 PHE CA C 86 61.640 61.640 62.236 -0.596 18517 23387 1 20 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.468 0.172 18517 23388 1 20 . 1 1 18 18 PHE H H 86 7.490 7.490 8.369 -0.879 18517 23389 1 20 . 1 1 19 19 LEU N N 87 117.470 117.470 120.183 -2.713 18517 23390 1 20 . 1 1 19 19 LEU HA H 87 4.070 4.070 4.057 0.013 18517 23391 1 20 . 1 1 19 19 LEU C C 87 178.880 178.880 178.698 0.182 18517 23392 1 20 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.108 -0.148 18517 23393 1 20 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.604 0.496 18517 23394 1 20 . 1 1 19 19 LEU H H 87 8.010 8.010 8.539 -0.529 18517 23395 1 20 . 1 1 20 20 SER N N 88 113.770 113.770 114.442 -0.672 18517 23396 1 20 . 1 1 20 20 SER HA H 88 4.070 4.070 4.119 -0.049 18517 23397 1 20 . 1 1 20 20 SER C C 88 175.680 175.680 176.854 -1.174 18517 23398 1 20 . 1 1 20 20 SER CA C 88 63.070 63.070 62.036 1.034 18517 23399 1 20 . 1 1 20 20 SER H H 88 8.100 8.100 8.590 -0.490 18517 23400 1 20 . 1 1 21 21 GLU N N 89 120.570 120.570 121.903 -1.333 18517 23401 1 20 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.041 -0.071 18517 23402 1 20 . 1 1 21 21 GLU C C 89 178.940 178.940 179.076 -0.136 18517 23403 1 20 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.060 0.200 18517 23404 1 20 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.031 0.299 18517 23405 1 20 . 1 1 21 21 GLU H H 89 7.400 7.400 7.813 -0.413 18517 23406 1 20 . 1 1 22 22 ILE N N 90 119.350 119.350 119.025 0.325 18517 23407 1 20 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.981 -0.291 18517 23408 1 20 . 1 1 22 22 ILE C C 90 177.230 177.230 178.487 -1.257 18517 23409 1 20 . 1 1 22 22 ILE CA C 90 63.470 63.470 63.087 0.383 18517 23410 1 20 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.778 -0.388 18517 23411 1 20 . 1 1 22 22 ILE H H 90 7.250 7.250 8.053 -0.803 18517 23412 1 20 . 1 1 23 23 ILE N N 91 116.350 116.350 118.529 -2.179 18517 23413 1 20 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.833 -0.433 18517 23414 1 20 . 1 1 23 23 ILE C C 91 176.690 176.690 176.692 -0.002 18517 23415 1 20 . 1 1 23 23 ILE CA C 91 65.730 65.730 62.877 2.853 18517 23416 1 20 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.045 0.725 18517 23417 1 20 . 1 1 23 23 ILE H H 91 7.860 7.860 8.337 -0.477 18517 23418 1 20 . 1 1 24 24 LYS N N 92 116.000 116.000 118.339 -2.339 18517 23419 1 20 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.150 -0.010 18517 23420 1 20 . 1 1 24 24 LYS C C 92 176.270 176.270 176.863 -0.593 18517 23421 1 20 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.960 -0.480 18517 23422 1 20 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.977 0.323 18517 23423 1 20 . 1 1 24 24 LYS H H 92 7.170 7.170 8.023 -0.853 18517 23424 1 20 . 1 1 25 25 SER N N 93 114.650 114.650 114.942 -0.292 18517 23425 1 20 . 1 1 25 25 SER HA H 93 4.550 4.550 4.309 0.241 18517 23426 1 20 . 1 1 25 25 SER C C 93 173.370 173.370 173.010 0.360 18517 23427 1 20 . 1 1 25 25 SER CA C 93 57.240 57.240 59.520 -2.280 18517 23428 1 20 . 1 1 25 25 SER CB C 93 65.650 65.650 64.079 1.571 18517 23429 1 20 . 1 1 25 25 SER H H 93 7.730 7.730 7.785 -0.055 18517 23430 1 20 . 1 1 26 26 ASP N N 94 121.230 121.230 121.160 0.070 18517 23431 1 20 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.817 0.113 18517 23432 1 20 . 1 1 26 26 ASP C C 94 176.560 176.560 175.554 1.006 18517 23433 1 20 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.713 0.797 18517 23434 1 20 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.687 0.963 18517 23435 1 20 . 1 1 26 26 ASP H H 94 8.280 8.280 8.354 -0.074 18517 23436 1 20 . 1 1 27 27 GLY N N 95 109.310 109.310 108.662 0.648 18517 23437 1 20 . 1 1 27 27 GLY C C 95 171.080 171.080 171.747 -0.667 18517 23438 1 20 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.274 -0.504 18517 23439 1 20 . 1 1 27 27 GLY H H 95 8.160 8.160 7.539 0.621 18517 23440 1 20 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.596 0.544 18517 23441 1 20 . 1 1 29 29 PHE C C 97 175.230 175.230 175.235 -0.005 18517 23442 1 20 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.616 -0.126 18517 23443 1 20 . 1 1 29 29 PHE CB C 97 41.620 41.620 41.559 0.061 18517 23444 1 20 . 1 1 30 30 THR N N 98 112.600 112.600 110.681 1.919 18517 23445 1 20 . 1 1 30 30 THR HA H 98 4.570 4.570 4.279 0.291 18517 23446 1 20 . 1 1 30 30 THR C C 98 176.690 176.690 174.464 2.226 18517 23447 1 20 . 1 1 30 30 THR CA C 98 60.290 60.290 60.037 0.253 18517 23448 1 20 . 1 1 30 30 THR CB C 98 71.600 71.600 71.588 0.012 18517 23449 1 20 . 1 1 30 30 THR H H 98 8.990 8.990 8.181 0.809 18517 23450 1 20 . 1 1 31 31 ILE N N 99 119.240 119.240 122.371 -3.131 18517 23451 1 20 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.866 -0.046 18517 23452 1 20 . 1 1 31 31 ILE C C 99 176.090 176.090 176.517 -0.427 18517 23453 1 20 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.662 -3.522 18517 23454 1 20 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.947 -0.997 18517 23455 1 20 . 1 1 31 31 ILE H H 99 9.230 9.230 8.261 0.969 18517 23456 1 20 . 1 1 32 32 LEU N N 100 119.660 119.660 119.473 0.187 18517 23457 1 20 . 1 1 32 32 LEU HA H 100 4.030 4.030 4.135 -0.105 18517 23458 1 20 . 1 1 32 32 LEU C C 100 181.050 181.050 178.732 2.318 18517 23459 1 20 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.983 -0.423 18517 23460 1 20 . 1 1 32 32 LEU CB C 100 40.120 40.120 41.554 -1.434 18517 23461 1 20 . 1 1 32 32 LEU H H 100 7.310 7.310 8.262 -0.952 18517 23462 1 20 . 1 1 33 33 GLN N N 101 121.450 121.450 119.313 2.137 18517 23463 1 20 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.415 -0.165 18517 23464 1 20 . 1 1 33 33 GLN CA C 101 59.700 59.700 58.869 0.831 18517 23465 1 20 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.262 3.528 18517 23466 1 20 . 1 1 33 33 GLN H H 101 7.790 7.790 7.924 -0.134 18517 23467 1 20 . 1 1 34 34 LEU C C 102 178.590 178.590 179.272 -0.682 18517 23468 1 20 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.026 0.604 18517 23469 1 20 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.651 -0.341 18517 23470 1 20 . 1 1 35 35 VAL N N 103 118.520 118.520 118.085 0.435 18517 23471 1 20 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.875 -0.455 18517 23472 1 20 . 1 1 35 35 VAL C C 103 177.930 177.930 178.166 -0.236 18517 23473 1 20 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.784 -0.744 18517 23474 1 20 . 1 1 35 35 VAL CB C 103 31.630 31.630 31.306 0.324 18517 23475 1 20 . 1 1 35 35 VAL H H 103 8.670 8.670 8.879 -0.209 18517 23476 1 20 . 1 1 36 36 GLY N N 104 109.430 109.430 108.990 0.440 18517 23477 1 20 . 1 1 36 36 GLY C C 104 174.600 174.600 175.565 -0.965 18517 23478 1 20 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.166 0.874 18517 23479 1 20 . 1 1 36 36 GLY H H 104 7.880 7.880 8.172 -0.292 18517 23480 1 20 . 1 1 37 37 TYR N N 105 122.270 122.270 124.217 -1.947 18517 23481 1 20 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.324 -0.444 18517 23482 1 20 . 1 1 37 37 TYR C C 105 176.310 176.310 176.994 -0.684 18517 23483 1 20 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.446 3.654 18517 23484 1 20 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.714 -0.344 18517 23485 1 20 . 1 1 37 37 TYR H H 105 8.170 8.170 8.310 -0.140 18517 23486 1 20 . 1 1 38 38 LEU N N 106 120.100 120.100 121.278 -1.178 18517 23487 1 20 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.888 -0.148 18517 23488 1 20 . 1 1 38 38 LEU C C 106 178.280 178.280 178.155 0.125 18517 23489 1 20 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.143 0.487 18517 23490 1 20 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.532 1.198 18517 23491 1 20 . 1 1 38 38 LEU H H 106 7.610 7.610 8.338 -0.728 18517 23492 1 20 . 1 1 39 39 ARG N N 107 116.670 116.670 118.890 -2.220 18517 23493 1 20 . 1 1 39 39 ARG HA H 107 3.680 3.680 3.954 -0.274 18517 23494 1 20 . 1 1 39 39 ARG C C 107 179.480 179.480 178.531 0.949 18517 23495 1 20 . 1 1 39 39 ARG CA C 107 59.580 59.580 58.169 1.411 18517 23496 1 20 . 1 1 39 39 ARG CB C 107 31.240 31.240 28.919 2.321 18517 23497 1 20 . 1 1 39 39 ARG H H 107 8.240 8.240 7.802 0.438 18517 23498 1 20 . 1 1 40 40 VAL N N 108 121.970 121.970 119.941 2.029 18517 23499 1 20 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.492 -0.092 18517 23500 1 20 . 1 1 40 40 VAL C C 108 178.440 178.440 177.681 0.759 18517 23501 1 20 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.787 1.163 18517 23502 1 20 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.547 -1.107 18517 23503 1 20 . 1 1 40 40 VAL H H 108 8.200 8.200 7.867 0.333 18517 23504 1 20 . 1 1 41 41 VAL N N 109 108.940 108.940 116.280 -7.340 18517 23505 1 20 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.462 0.778 18517 23506 1 20 . 1 1 41 41 VAL C C 109 175.070 175.070 177.689 -2.619 18517 23507 1 20 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.986 -3.396 18517 23508 1 20 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.004 -0.354 18517 23509 1 20 . 1 1 41 41 VAL H H 109 7.760 7.760 7.928 -0.168 18517 23510 1 20 . 1 1 42 42 ASP N N 110 124.670 124.670 121.513 3.157 18517 23511 1 20 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.351 0.269 18517 23512 1 20 . 1 1 42 42 ASP C C 110 177.310 177.310 178.465 -1.155 18517 23513 1 20 . 1 1 42 42 ASP CA C 110 59.980 59.980 57.782 2.198 18517 23514 1 20 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.052 4.898 18517 23515 1 20 . 1 1 42 42 ASP H H 110 7.360 7.360 8.324 -0.964 18517 23516 1 20 . 1 1 43 43 THR N N 111 102.340 102.340 115.244 -12.904 18517 23517 1 20 . 1 1 43 43 THR HA H 111 5.100 5.100 4.119 0.981 18517 23518 1 20 . 1 1 43 43 THR C C 111 174.940 174.940 176.095 -1.155 18517 23519 1 20 . 1 1 43 43 THR CA C 111 60.650 60.650 65.360 -4.710 18517 23520 1 20 . 1 1 43 43 THR CB C 111 69.610 69.610 68.625 0.985 18517 23521 1 20 . 1 1 43 43 THR H H 111 6.380 6.380 7.924 -1.544 18517 23522 1 20 . 1 1 44 44 ASP N N 112 119.750 119.750 122.336 -2.586 18517 23523 1 20 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.471 -0.611 18517 23524 1 20 . 1 1 44 44 ASP C C 112 178.850 178.850 177.962 0.888 18517 23525 1 20 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.917 0.313 18517 23526 1 20 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.541 -1.141 18517 23527 1 20 . 1 1 44 44 ASP H H 112 9.050 9.050 8.588 0.462 18517 23528 1 20 . 1 1 45 45 LEU N N 113 123.910 123.910 122.054 1.856 18517 23529 1 20 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.956 -0.146 18517 23530 1 20 . 1 1 45 45 LEU C C 113 182.040 182.040 178.234 3.806 18517 23531 1 20 . 1 1 45 45 LEU CA C 113 57.320 57.320 58.077 -0.757 18517 23532 1 20 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.748 -0.999 18517 23533 1 20 . 1 1 45 45 LEU H H 113 9.710 9.710 7.855 1.855 18517 23534 1 20 . 1 1 46 46 LEU N N 114 117.640 117.640 118.364 -0.724 18517 23535 1 20 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.118 -0.008 18517 23536 1 20 . 1 1 46 46 LEU C C 114 179.540 179.540 178.431 1.109 18517 23537 1 20 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.645 -0.085 18517 23538 1 20 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.856 -0.386 18517 23539 1 20 . 1 1 46 46 LEU H H 114 8.270 8.270 7.769 0.501 18517 23540 1 20 . 1 1 47 47 LEU N N 115 116.520 116.520 115.350 1.170 18517 23541 1 20 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.430 -0.290 18517 23542 1 20 . 1 1 47 47 LEU C C 115 173.850 173.850 176.034 -2.184 18517 23543 1 20 . 1 1 47 47 LEU CA C 115 55.420 55.420 53.980 1.440 18517 23544 1 20 . 1 1 47 47 LEU CB C 115 44.720 44.720 40.635 4.085 18517 23545 1 20 . 1 1 47 47 LEU H H 115 8.160 8.160 7.943 0.217 18517 23546 1 20 . 1 1 48 48 LYS N N 116 114.710 114.710 115.785 -1.075 18517 23547 1 20 . 1 1 48 48 LYS HA H 116 3.810 3.810 3.967 -0.157 18517 23548 1 20 . 1 1 48 48 LYS C C 116 176.510 176.510 175.797 0.713 18517 23549 1 20 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.895 0.305 18517 23550 1 20 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.288 -0.268 18517 23551 1 20 . 1 1 48 48 LYS H H 116 7.580 7.580 7.825 -0.245 18517 23552 1 20 . 1 1 49 49 VAL N N 117 119.050 119.050 120.301 -1.251 18517 23553 1 20 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.042 -0.432 18517 23554 1 20 . 1 1 49 49 VAL C C 117 175.860 175.860 176.533 -0.673 18517 23555 1 20 . 1 1 49 49 VAL CA C 117 63.510 63.510 61.870 1.640 18517 23556 1 20 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.957 -0.607 18517 23557 1 20 . 1 1 49 49 VAL H H 117 7.980 7.980 8.127 -0.147 18517 23558 1 20 . 1 1 50 50 ASP N N 118 126.900 126.900 122.938 3.962 18517 23559 1 20 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.471 -0.221 18517 23560 1 20 . 1 1 50 50 ASP C C 118 177.700 177.700 177.267 0.433 18517 23561 1 20 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.638 0.412 18517 23562 1 20 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.337 1.242 18517 23563 1 20 . 1 1 50 50 ASP H H 118 8.930 8.930 8.561 0.369 18517 23564 1 20 . 1 1 51 51 SER N N 119 124.790 124.790 119.695 5.095 18517 23565 1 20 . 1 1 51 51 SER HA H 119 4.070 4.070 4.100 -0.030 18517 23566 1 20 . 1 1 51 51 SER C C 119 177.220 177.220 176.245 0.975 18517 23567 1 20 . 1 1 51 51 SER CA C 119 61.640 61.640 61.505 0.135 18517 23568 1 20 . 1 1 51 51 SER CB C 119 63.510 63.510 63.150 0.360 18517 23569 1 20 . 1 1 51 51 SER H H 119 8.560 8.560 8.816 -0.256 18517 23570 1 20 . 1 1 52 52 THR N N 120 119.880 119.880 116.225 3.655 18517 23571 1 20 . 1 1 52 52 THR HA H 120 4.190 4.190 4.240 -0.050 18517 23572 1 20 . 1 1 52 52 THR C C 120 177.120 177.120 176.791 0.329 18517 23573 1 20 . 1 1 52 52 THR CA C 120 66.280 66.280 65.796 0.484 18517 23574 1 20 . 1 1 52 52 THR CB C 120 68.420 68.420 68.425 -0.005 18517 23575 1 20 . 1 1 52 52 THR H H 120 8.310 8.310 8.319 -0.009 18517 23576 1 20 . 1 1 53 53 LYS N N 121 122.270 122.270 123.365 -1.095 18517 23577 1 20 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.198 -0.078 18517 23578 1 20 . 1 1 53 53 LYS C C 121 178.970 178.970 179.092 -0.122 18517 23579 1 20 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.076 0.504 18517 23580 1 20 . 1 1 53 53 LYS CB C 121 34.250 34.250 31.618 2.632 18517 23581 1 20 . 1 1 53 53 LYS H H 121 7.700 7.700 7.410 0.290 18517 23582 1 20 . 1 1 54 54 VAL N N 122 120.070 120.070 120.533 -0.463 18517 23583 1 20 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.862 -0.432 18517 23584 1 20 . 1 1 54 54 VAL C C 122 179.860 179.860 177.630 2.230 18517 23585 1 20 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.719 2.861 18517 23586 1 20 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.902 0.918 18517 23587 1 20 . 1 1 54 54 VAL H H 122 7.890 7.890 8.261 -0.371 18517 23588 1 20 . 1 1 55 55 ASP N N 123 122.270 122.270 121.094 1.176 18517 23589 1 20 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.327 0.143 18517 23590 1 20 . 1 1 55 55 ASP C C 123 178.630 178.630 178.351 0.279 18517 23591 1 20 . 1 1 55 55 ASP CA C 123 57.800 57.800 58.125 -0.325 18517 23592 1 20 . 1 1 55 55 ASP CB C 123 42.020 42.020 41.051 0.969 18517 23593 1 20 . 1 1 55 55 ASP H H 123 8.270 8.270 8.229 0.041 18517 23594 1 20 . 1 1 56 56 GLU N N 124 119.600 119.600 119.856 -0.256 18517 23595 1 20 . 1 1 56 56 GLU HA H 124 3.970 3.970 3.992 -0.022 18517 23596 1 20 . 1 1 56 56 GLU C C 124 179.920 179.920 179.056 0.864 18517 23597 1 20 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.196 0.864 18517 23598 1 20 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.686 0.284 18517 23599 1 20 . 1 1 56 56 GLU H H 124 8.610 8.610 8.441 0.169 18517 23600 1 20 . 1 1 57 57 ALA N N 125 120.070 120.070 122.108 -2.038 18517 23601 1 20 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.032 -0.202 18517 23602 1 20 . 1 1 57 57 ALA C C 125 178.760 178.760 179.493 -0.733 18517 23603 1 20 . 1 1 57 57 ALA CA C 125 55.380 55.380 55.062 0.318 18517 23604 1 20 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.385 1.755 18517 23605 1 20 . 1 1 57 57 ALA H H 125 8.420 8.420 8.307 0.113 18517 23606 1 20 . 1 1 58 58 GLY N N 126 106.740 106.740 106.077 0.663 18517 23607 1 20 . 1 1 58 58 GLY C C 126 175.740 175.740 175.928 -0.188 18517 23608 1 20 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.654 0.637 18517 23609 1 20 . 1 1 58 58 GLY H H 126 8.200 8.200 8.458 -0.258 18517 23610 1 20 . 1 1 59 59 LYS N N 127 120.920 120.920 121.944 -1.024 18517 23611 1 20 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.034 -0.104 18517 23612 1 20 . 1 1 59 59 LYS C C 127 180.320 180.320 178.732 1.588 18517 23613 1 20 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.283 0.927 18517 23614 1 20 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.380 0.600 18517 23615 1 20 . 1 1 59 59 LYS H H 127 8.000 8.000 8.263 -0.263 18517 23616 1 20 . 1 1 60 60 LYS N N 128 118.400 118.400 119.517 -1.117 18517 23617 1 20 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.190 -0.020 18517 23618 1 20 . 1 1 60 60 LYS C C 128 180.030 180.030 179.070 0.960 18517 23619 1 20 . 1 1 60 60 LYS CA C 128 58.750 58.750 58.673 0.077 18517 23620 1 20 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.086 0.184 18517 23621 1 20 . 1 1 60 60 LYS H H 128 7.170 7.170 7.951 -0.781 18517 23622 1 20 . 1 1 61 61 VAL N N 129 121.050 121.050 120.785 0.265 18517 23623 1 20 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.466 -0.186 18517 23624 1 20 . 1 1 61 61 VAL C C 129 177.120 177.120 177.895 -0.775 18517 23625 1 20 . 1 1 61 61 VAL CA C 129 67.350 67.350 67.215 0.135 18517 23626 1 20 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.445 0.185 18517 23627 1 20 . 1 1 61 61 VAL H H 129 7.980 7.980 8.164 -0.184 18517 23628 1 20 . 1 1 62 62 LYS N N 130 120.040 120.040 119.334 0.706 18517 23629 1 20 . 1 1 62 62 LYS HA H 130 3.700 3.700 4.031 -0.331 18517 23630 1 20 . 1 1 62 62 LYS C C 130 178.550 178.550 178.710 -0.160 18517 23631 1 20 . 1 1 62 62 LYS CA C 130 60.330 60.330 59.402 0.928 18517 23632 1 20 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.384 1.386 18517 23633 1 20 . 1 1 62 62 LYS H H 130 8.910 8.910 8.449 0.461 18517 23634 1 20 . 1 1 63 63 ALA N N 131 119.570 119.570 123.751 -4.181 18517 23635 1 20 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.058 0.163 18517 23636 1 20 . 1 1 63 63 ALA C C 131 180.520 180.520 179.360 1.160 18517 23637 1 20 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.243 -0.023 18517 23638 1 20 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.100 0.370 18517 23639 1 20 . 1 1 63 63 ALA H H 131 7.920 7.920 8.134 -0.214 18517 23640 1 20 . 1 1 64 64 TYR N N 132 120.510 120.510 120.399 0.111 18517 23641 1 20 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.191 0.269 18517 23642 1 20 . 1 1 64 64 TYR C C 132 176.510 176.510 177.731 -1.221 18517 23643 1 20 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.514 0.126 18517 23644 1 20 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.647 0.043 18517 23645 1 20 . 1 1 64 64 TYR H H 132 7.930 7.930 8.134 -0.204 18517 23646 1 20 . 1 1 65 65 LEU N N 133 117.290 117.290 119.845 -2.555 18517 23647 1 20 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.608 0.232 18517 23648 1 20 . 1 1 65 65 LEU C C 133 178.610 178.610 178.956 -0.346 18517 23649 1 20 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.042 -0.322 18517 23650 1 20 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.830 -1.400 18517 23651 1 20 . 1 1 65 65 LEU H H 133 8.240 8.240 8.478 -0.238 18517 23652 1 20 . 1 1 66 66 GLU N N 134 119.140 119.140 117.704 1.436 18517 23653 1 20 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.147 -0.287 18517 23654 1 20 . 1 1 66 66 GLU C C 134 180.200 180.200 178.936 1.264 18517 23655 1 20 . 1 1 66 66 GLU CA C 134 59.940 59.940 59.032 0.907 18517 23656 1 20 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.288 0.522 18517 23657 1 20 . 1 1 66 66 GLU H H 134 8.370 8.370 8.716 -0.346 18517 23658 1 20 . 1 1 67 67 LYS N N 135 121.390 121.390 121.253 0.137 18517 23659 1 20 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.078 -0.078 18517 23660 1 20 . 1 1 67 67 LYS C C 135 179.080 179.080 178.362 0.718 18517 23661 1 20 . 1 1 67 67 LYS CA C 135 59.620 59.620 59.089 0.531 18517 23662 1 20 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.531 -0.261 18517 23663 1 20 . 1 1 67 67 LYS H H 135 7.820 7.820 7.702 0.118 18517 23664 1 20 . 1 1 68 68 ILE N N 136 110.310 110.310 112.105 -1.795 18517 23665 1 20 . 1 1 68 68 ILE HA H 136 4.300 4.300 3.984 0.316 18517 23666 1 20 . 1 1 68 68 ILE C C 136 175.520 175.520 176.523 -1.003 18517 23667 1 20 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.918 0.512 18517 23668 1 20 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.556 -0.576 18517 23669 1 20 . 1 1 68 68 ILE H H 136 7.380 7.380 7.614 -0.234 18517 23670 1 20 . 1 1 69 69 GLY N N 137 106.680 106.680 107.698 -1.018 18517 23671 1 20 . 1 1 69 69 GLY C C 137 174.160 174.160 173.150 1.010 18517 23672 1 20 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.655 0.815 18517 23673 1 20 . 1 1 69 69 GLY H H 137 7.470 7.470 7.986 -0.516 18517 23674 1 20 . 1 1 70 70 ILE N N 138 124.310 124.310 121.251 3.059 18517 23675 1 20 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.339 -0.139 18517 23676 1 20 . 1 1 70 70 ILE C C 138 174.190 174.190 174.877 -0.687 18517 23677 1 20 . 1 1 70 70 ILE CA C 138 59.380 59.380 58.681 0.699 18517 23678 1 20 . 1 1 70 70 ILE CB C 138 37.340 37.340 37.529 -0.189 18517 23679 1 20 . 1 1 70 70 ILE H H 138 8.530 8.530 8.245 0.285 18517 23680 1 20 . 1 1 71 71 ARG N N 139 125.490 125.490 127.173 -1.683 18517 23681 1 20 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.362 0.258 18517 23682 1 20 . 1 1 71 71 ARG C C 139 175.750 175.750 175.130 0.620 18517 23683 1 20 . 1 1 71 71 ARG CA C 139 54.660 54.660 55.581 -0.921 18517 23684 1 20 . 1 1 71 71 ARG CB C 139 33.140 33.140 31.799 1.341 18517 23685 1 20 . 1 1 71 71 ARG H H 139 8.240 8.240 8.190 0.050 18517 23686 1 20 . 1 1 72 72 GLY N N 140 104.750 104.750 108.614 -3.864 18517 23687 1 20 . 1 1 72 72 GLY C C 140 172.920 172.920 173.450 -0.530 18517 23688 1 20 . 1 1 72 72 GLY CA C 140 45.430 45.430 43.915 1.515 18517 23689 1 20 . 1 1 72 72 GLY H H 140 7.900 7.900 8.150 -0.250 18517 23690 1 20 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.295 0.215 18517 23691 1 20 . 1 1 73 73 ASP C C 141 175.060 175.060 176.292 -1.232 18517 23692 1 20 . 1 1 73 73 ASP CA C 141 56.170 56.170 57.986 -1.816 18517 23693 1 20 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.317 -0.487 18517 23694 1 20 . 1 1 74 74 SER N N 142 110.240 110.240 110.759 -0.519 18517 23695 1 20 . 1 1 74 74 SER HA H 142 4.740 4.740 4.706 0.034 18517 23696 1 20 . 1 1 74 74 SER C C 142 175.110 175.110 174.690 0.420 18517 23697 1 20 . 1 1 74 74 SER CA C 142 55.700 55.700 56.474 -0.773 18517 23698 1 20 . 1 1 74 74 SER CB C 142 67.390 67.390 64.367 3.023 18517 23699 1 20 . 1 1 74 74 SER H H 142 7.560 7.560 7.790 -0.230 18517 23700 1 20 . 1 1 75 75 VAL N N 143 122.950 122.950 118.971 3.979 18517 23701 1 20 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.934 -0.204 18517 23702 1 20 . 1 1 75 75 VAL C C 143 176.230 176.230 177.235 -1.005 18517 23703 1 20 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.685 0.955 18517 23704 1 20 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.475 -0.235 18517 23705 1 20 . 1 1 75 75 VAL H H 143 9.470 9.470 8.835 0.635 18517 23706 1 20 . 1 1 76 76 GLU N N 144 121.390 121.390 120.961 0.429 18517 23707 1 20 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.217 -0.577 18517 23708 1 20 . 1 1 76 76 GLU C C 144 176.880 176.880 178.222 -1.342 18517 23709 1 20 . 1 1 76 76 GLU CA C 144 63.310 63.310 58.891 4.419 18517 23710 1 20 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.374 -0.304 18517 23711 1 20 . 1 1 76 76 GLU H H 144 9.640 9.640 8.719 0.921 18517 23712 1 20 . 1 1 77 77 ALA N N 145 118.770 118.770 122.433 -3.663 18517 23713 1 20 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.207 0.053 18517 23714 1 20 . 1 1 77 77 ALA C C 145 180.350 180.350 179.600 0.750 18517 23715 1 20 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.576 0.204 18517 23716 1 20 . 1 1 77 77 ALA CB C 145 19.190 19.190 17.889 1.301 18517 23717 1 20 . 1 1 77 77 ALA H H 145 7.860 7.860 8.381 -0.521 18517 23718 1 20 . 1 1 78 78 ALA N N 146 120.920 120.920 122.972 -2.052 18517 23719 1 20 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.021 0.119 18517 23720 1 20 . 1 1 78 78 ALA C C 146 179.150 179.150 179.295 -0.145 18517 23721 1 20 . 1 1 78 78 ALA CA C 146 55.260 55.260 54.932 0.328 18517 23722 1 20 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.425 0.365 18517 23723 1 20 . 1 1 78 78 ALA H H 146 8.110 8.110 8.026 0.084 18517 23724 1 20 . 1 1 79 79 LEU N N 147 118.810 118.810 119.260 -0.450 18517 23725 1 20 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.015 -0.135 18517 23726 1 20 . 1 1 79 79 LEU C C 147 179.080 179.080 178.997 0.083 18517 23727 1 20 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.922 0.468 18517 23728 1 20 . 1 1 79 79 LEU CB C 147 42.260 42.260 40.554 1.706 18517 23729 1 20 . 1 1 79 79 LEU H H 147 8.360 8.360 8.196 0.164 18517 23730 1 20 . 1 1 80 80 ASP N N 148 121.620 121.620 120.086 1.534 18517 23731 1 20 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.222 0.298 18517 23732 1 20 . 1 1 80 80 ASP C C 148 178.800 178.800 177.987 0.813 18517 23733 1 20 . 1 1 80 80 ASP CA C 148 58.390 58.390 57.973 0.417 18517 23734 1 20 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.878 -0.128 18517 23735 1 20 . 1 1 80 80 ASP H H 148 8.770 8.770 8.772 -0.002 18517 23736 1 20 . 1 1 81 81 ASN N N 149 118.630 118.630 118.430 0.200 18517 23737 1 20 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.615 -0.045 18517 23738 1 20 . 1 1 81 81 ASN C C 149 177.970 177.970 177.839 0.131 18517 23739 1 20 . 1 1 81 81 ASN CA C 149 56.010 56.010 55.762 0.248 18517 23740 1 20 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.497 0.113 18517 23741 1 20 . 1 1 81 81 ASN H H 149 7.960 7.960 8.225 -0.265 18517 23742 1 20 . 1 1 82 82 LEU N N 150 120.030 120.030 120.702 -0.672 18517 23743 1 20 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.887 0.173 18517 23744 1 20 . 1 1 82 82 LEU C C 150 177.790 177.790 179.163 -1.373 18517 23745 1 20 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.153 0.717 18517 23746 1 20 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.779 0.081 18517 23747 1 20 . 1 1 82 82 LEU H H 150 8.230 8.230 8.468 -0.238 18517 23748 1 20 . 1 1 83 83 MET N N 151 115.820 115.820 118.179 -2.359 18517 23749 1 20 . 1 1 83 83 MET HA H 151 4.390 4.390 4.222 0.168 18517 23750 1 20 . 1 1 83 83 MET C C 151 179.760 179.760 179.089 0.671 18517 23751 1 20 . 1 1 83 83 MET CA C 151 57.400 57.400 58.151 -0.751 18517 23752 1 20 . 1 1 83 83 MET CB C 151 31.080 31.080 31.538 -0.458 18517 23753 1 20 . 1 1 83 83 MET H H 151 8.800 8.800 8.538 0.262 18517 23754 1 20 . 1 1 84 84 ILE N N 152 120.330 120.330 119.787 0.543 18517 23755 1 20 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.728 0.112 18517 23756 1 20 . 1 1 84 84 ILE C C 152 178.660 178.660 178.364 0.296 18517 23757 1 20 . 1 1 84 84 ILE CA C 152 65.800 65.800 64.069 1.731 18517 23758 1 20 . 1 1 84 84 ILE CB C 152 38.450 38.450 36.338 2.112 18517 23759 1 20 . 1 1 84 84 ILE H H 152 8.540 8.540 8.879 -0.339 18517 23760 1 20 . 1 1 85 85 LYS N N 153 118.930 118.930 120.048 -1.118 18517 23761 1 20 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.038 0.162 18517 23762 1 20 . 1 1 85 85 LYS C C 153 179.650 179.650 179.627 0.023 18517 23763 1 20 . 1 1 85 85 LYS CA C 153 59.980 59.980 59.312 0.668 18517 23764 1 20 . 1 1 85 85 LYS CB C 153 33.540 33.540 32.123 1.417 18517 23765 1 20 . 1 1 85 85 LYS H H 153 7.510 7.510 8.269 -0.759 18517 23766 1 20 . 1 1 86 86 VAL N N 154 119.810 119.810 119.873 -0.063 18517 23767 1 20 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.633 -0.003 18517 23768 1 20 . 1 1 86 86 VAL C C 154 178.350 178.350 177.917 0.433 18517 23769 1 20 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.213 1.017 18517 23770 1 20 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.361 1.379 18517 23771 1 20 . 1 1 86 86 VAL H H 154 8.740 8.740 8.503 0.237 18517 23772 1 20 . 1 1 87 87 TYR N N 155 118.370 118.370 117.859 0.511 18517 23773 1 20 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.286 -0.016 18517 23774 1 20 . 1 1 87 87 TYR C C 155 178.580 178.580 178.428 0.152 18517 23775 1 20 . 1 1 87 87 TYR CA C 155 62.910 62.910 60.672 2.238 18517 23776 1 20 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.271 0.709 18517 23777 1 20 . 1 1 87 87 TYR H H 155 8.520 8.520 8.478 0.042 18517 23778 1 20 . 1 1 88 88 GLU N N 156 119.900 119.900 121.443 -1.543 18517 23779 1 20 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.023 0.157 18517 23780 1 20 . 1 1 88 88 GLU C C 156 179.270 179.270 178.579 0.691 18517 23781 1 20 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.472 -0.092 18517 23782 1 20 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.651 0.559 18517 23783 1 20 . 1 1 88 88 GLU H H 156 8.250 8.250 8.497 -0.247 18517 23784 1 20 . 1 1 89 89 ILE N N 157 119.510 119.510 118.366 1.144 18517 23785 1 20 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.851 0.229 18517 23786 1 20 . 1 1 89 89 ILE C C 157 177.890 177.890 178.000 -0.110 18517 23787 1 20 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.702 -0.392 18517 23788 1 20 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.254 0.956 18517 23789 1 20 . 1 1 89 89 ILE H H 157 7.630 7.630 7.899 -0.269 18517 23790 1 20 . 1 1 90 90 THR N N 158 114.240 114.240 113.354 0.886 18517 23791 1 20 . 1 1 90 90 THR HA H 158 4.130 4.130 4.060 0.070 18517 23792 1 20 . 1 1 90 90 THR C C 158 175.530 175.530 175.943 -0.413 18517 23793 1 20 . 1 1 90 90 THR CA C 158 64.460 64.460 65.182 -0.722 18517 23794 1 20 . 1 1 90 90 THR CB C 158 69.610 69.610 69.025 0.585 18517 23795 1 20 . 1 1 90 90 THR H H 158 7.770 7.770 7.891 -0.121 18517 23796 1 20 . 1 1 91 91 LYS N N 159 120.280 120.280 119.983 0.297 18517 23797 1 20 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.446 -0.136 18517 23798 1 20 . 1 1 91 91 LYS C C 159 177.420 177.420 177.148 0.272 18517 23799 1 20 . 1 1 91 91 LYS CA C 159 57.400 57.400 56.050 1.349 18517 23800 1 20 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.583 -0.363 18517 23801 1 20 . 1 1 91 91 LYS H H 159 7.890 7.890 8.131 -0.241 18517 23802 1 20 . 1 1 92 92 GLY N N 160 107.910 107.910 110.522 -2.612 18517 23803 1 20 . 1 1 92 92 GLY C C 160 174.430 174.430 173.959 0.471 18517 23804 1 20 . 1 1 92 92 GLY CA C 160 45.980 45.980 46.151 -0.171 18517 23805 1 20 . 1 1 92 92 GLY H H 160 7.930 7.930 7.860 0.070 18517 23806 1 20 . 1 1 93 93 THR N N 161 113.570 113.570 111.765 1.805 18517 23807 1 20 . 1 1 93 93 THR HA H 161 4.390 4.390 4.473 -0.083 18517 23808 1 20 . 1 1 93 93 THR C C 161 174.790 174.790 173.511 1.279 18517 23809 1 20 . 1 1 93 93 THR CA C 161 61.960 61.960 60.894 1.067 18517 23810 1 20 . 1 1 93 93 THR CB C 161 70.010 70.010 71.284 -1.274 18517 23811 1 20 . 1 1 93 93 THR H H 161 7.970 7.970 7.776 0.194 18517 23812 1 20 . 1 1 94 94 VAL N N 162 121.980 121.980 121.236 0.744 18517 23813 1 20 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.335 -0.215 18517 23814 1 20 . 1 1 94 94 VAL C C 162 176.300 176.300 175.385 0.915 18517 23815 1 20 . 1 1 94 94 VAL CA C 162 62.830 62.830 62.360 0.470 18517 23816 1 20 . 1 1 94 94 VAL CB C 162 33.060 33.060 32.760 0.300 18517 23817 1 20 . 1 1 94 94 VAL H H 162 8.130 8.130 8.199 -0.069 18517 23818 1 20 . 1 1 95 95 GLU N N 163 124.140 124.140 123.680 0.460 18517 23819 1 20 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.397 -0.088 18517 23820 1 20 . 1 1 95 95 GLU C C 163 176.870 176.870 175.411 1.459 18517 23821 1 20 . 1 1 95 95 GLU CA C 163 57.080 57.080 56.344 0.736 18517 23822 1 20 . 1 1 95 95 GLU CB C 163 30.440 30.440 30.427 0.013 18517 23823 1 20 . 1 1 95 95 GLU H H 163 8.490 8.490 8.654 -0.164 18517 23824 1 20 . 1 1 96 96 SER N N 164 116.800 116.800 116.352 0.448 18517 23825 1 20 . 1 1 96 96 SER HA H 164 4.430 4.430 4.530 -0.100 18517 23826 1 20 . 1 1 96 96 SER C C 164 174.940 174.940 174.894 0.046 18517 23827 1 20 . 1 1 96 96 SER CA C 164 59.070 59.070 59.365 -0.295 18517 23828 1 20 . 1 1 96 96 SER CB C 164 64.220 64.220 63.769 0.451 18517 23829 1 20 . 1 1 96 96 SER H H 164 8.300 8.300 8.313 -0.013 18517 23830 1 20 . 1 1 97 97 SER C C 165 174.660 174.660 173.215 1.445 18517 23831 1 20 . 1 1 97 97 SER CA C 165 58.870 58.870 57.882 0.988 18517 23832 1 20 . 1 1 97 97 SER CB C 165 64.060 64.060 63.358 0.702 18517 23833 1 20 . 1 1 98 98 ALA N N 166 125.490 125.490 124.897 0.593 18517 23834 1 20 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.819 -0.469 18517 23835 1 20 . 1 1 98 98 ALA C C 166 177.780 177.780 177.747 0.033 18517 23836 1 20 . 1 1 98 98 ALA CA C 166 53.000 53.000 51.592 1.408 18517 23837 1 20 . 1 1 98 98 ALA CB C 166 19.340 19.340 18.737 0.603 18517 23838 1 20 . 1 1 98 98 ALA H H 166 8.180 8.180 7.966 0.214 18517 23839 1 20 . 1 1 99 99 GLN N N 167 118.690 118.690 123.554 -4.864 18517 23840 1 20 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.486 -0.146 18517 23841 1 20 . 1 1 99 99 GLN C C 167 176.680 176.680 175.244 1.436 18517 23842 1 20 . 1 1 99 99 GLN CA C 167 56.250 56.250 55.316 0.934 18517 23843 1 20 . 1 1 99 99 GLN CB C 167 29.650 29.650 29.916 -0.266 18517 23844 1 20 . 1 1 99 99 GLN H H 167 8.170 8.170 8.854 -0.684 18517 23845 1 20 . 1 1 100 100 GLY N N 168 109.670 109.670 106.390 3.280 18517 23846 1 20 . 1 1 100 100 GLY C C 168 174.460 174.460 173.339 1.121 18517 23847 1 20 . 1 1 100 100 GLY CA C 168 45.670 45.670 43.725 1.945 18517 23848 1 20 . 1 1 100 100 GLY H H 168 8.250 8.250 7.443 0.807 18517 23849 1 20 . 1 1 101 101 THR N N 169 112.660 112.660 115.802 -3.142 18517 23850 1 20 . 1 1 101 101 THR HA H 169 4.360 4.360 4.524 -0.164 18517 23851 1 20 . 1 1 101 101 THR C C 169 174.720 174.720 174.166 0.554 18517 23852 1 20 . 1 1 101 101 THR CA C 169 62.080 62.080 60.401 1.679 18517 23853 1 20 . 1 1 101 101 THR CB C 169 69.930 69.930 68.572 1.358 18517 23854 1 20 . 1 1 101 101 THR H H 169 8.070 8.070 7.891 0.179 18517 23855 1 20 . 1 1 102 102 ASP N N 170 123.090 123.090 126.736 -3.646 18517 23856 1 20 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.636 0.064 18517 23857 1 20 . 1 1 102 102 ASP C C 170 176.130 176.130 175.420 0.710 18517 23858 1 20 . 1 1 102 102 ASP CA C 170 54.780 54.780 53.319 1.461 18517 23859 1 20 . 1 1 102 102 ASP CB C 170 42.260 42.260 39.770 2.490 18517 23860 1 20 . 1 1 102 102 ASP H H 170 8.170 8.170 8.422 -0.252 18517 23861 1 20 . 1 1 103 103 SER N N 171 117.110 117.110 118.412 -1.302 18517 23862 1 20 . 1 1 103 103 SER HA H 171 4.430 4.430 4.438 -0.008 18517 23863 1 20 . 1 1 103 103 SER C C 171 174.770 174.770 175.411 -0.641 18517 23864 1 20 . 1 1 103 103 SER CA C 171 57.960 57.960 57.922 0.038 18517 23865 1 20 . 1 1 103 103 SER CB C 171 64.940 64.940 64.858 0.082 18517 23866 1 20 . 1 1 103 103 SER H H 171 8.450 8.450 7.907 0.543 18517 23867 1 20 . 1 1 104 104 GLU N N 172 122.970 122.970 121.415 1.555 18517 23868 1 20 . 1 1 104 104 GLU HA H 172 4.030 4.030 4.008 0.022 18517 23869 1 20 . 1 1 104 104 GLU C C 172 178.860 178.860 177.943 0.917 18517 23870 1 20 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.297 -0.597 18517 23871 1 20 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.506 0.144 18517 23872 1 20 . 1 1 104 104 GLU H H 172 8.830 8.830 8.996 -0.166 18517 23873 1 20 . 1 1 105 105 GLU N N 173 119.750 119.750 117.600 2.150 18517 23874 1 20 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.107 -0.127 18517 23875 1 20 . 1 1 105 105 GLU C C 173 178.920 178.920 178.309 0.611 18517 23876 1 20 . 1 1 105 105 GLU CA C 173 60.060 60.060 58.810 1.250 18517 23877 1 20 . 1 1 105 105 GLU CB C 173 29.730 29.730 28.677 1.053 18517 23878 1 20 . 1 1 105 105 GLU H H 173 8.580 8.580 8.588 -0.008 18517 23879 1 20 . 1 1 106 106 LEU N N 174 121.860 121.860 121.278 0.582 18517 23880 1 20 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.111 0.069 18517 23881 1 20 . 1 1 106 106 LEU C C 174 178.210 178.210 179.050 -0.840 18517 23882 1 20 . 1 1 106 106 LEU CA C 174 57.880 57.880 56.659 1.221 18517 23883 1 20 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.061 0.089 18517 23884 1 20 . 1 1 106 106 LEU H H 174 7.920 7.920 7.528 0.392 18517 23885 1 20 . 1 1 107 107 LYS N N 175 118.740 118.740 120.325 -1.585 18517 23886 1 20 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.920 -0.140 18517 23887 1 20 . 1 1 107 107 LYS C C 175 178.700 178.700 179.164 -0.464 18517 23888 1 20 . 1 1 107 107 LYS CA C 175 61.170 61.170 60.114 1.056 18517 23889 1 20 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.225 0.205 18517 23890 1 20 . 1 1 107 107 LYS H H 175 8.340 8.340 8.749 -0.409 18517 23891 1 20 . 1 1 108 108 THR N N 176 113.820 113.820 116.600 -2.780 18517 23892 1 20 . 1 1 108 108 THR HA H 176 3.840 3.840 4.015 -0.175 18517 23893 1 20 . 1 1 108 108 THR C C 176 176.620 176.620 176.216 0.404 18517 23894 1 20 . 1 1 108 108 THR CA C 176 66.910 66.910 67.175 -0.265 18517 23895 1 20 . 1 1 108 108 THR CB C 176 69.610 69.610 68.547 1.063 18517 23896 1 20 . 1 1 108 108 THR H H 176 7.950 7.950 8.408 -0.458 18517 23897 1 20 . 1 1 109 109 LEU N N 177 124.380 124.380 122.582 1.798 18517 23898 1 20 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.121 -0.291 18517 23899 1 20 . 1 1 109 109 LEU C C 177 177.790 177.790 178.129 -0.339 18517 23900 1 20 . 1 1 109 109 LEU CA C 177 57.990 57.990 58.069 -0.079 18517 23901 1 20 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.748 0.832 18517 23902 1 20 . 1 1 109 109 LEU H H 177 7.480 7.480 7.783 -0.303 18517 23903 1 20 . 1 1 110 110 LEU N N 178 117.230 117.230 119.501 -2.271 18517 23904 1 20 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.836 0.004 18517 23905 1 20 . 1 1 110 110 LEU C C 178 179.540 179.540 179.363 0.177 18517 23906 1 20 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.840 0.550 18517 23907 1 20 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.483 0.858 18517 23908 1 20 . 1 1 110 110 LEU H H 178 8.670 8.670 8.025 0.645 18517 23909 1 20 . 1 1 111 111 LEU N N 179 119.230 119.230 120.322 -1.092 18517 23910 1 20 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.029 0.051 18517 23911 1 20 . 1 1 111 111 LEU C C 179 179.310 179.310 178.831 0.479 18517 23912 1 20 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.609 0.781 18517 23913 1 20 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.573 1.447 18517 23914 1 20 . 1 1 111 111 LEU H H 179 7.940 7.940 8.794 -0.854 18517 23915 1 20 . 1 1 112 112 LYS N N 180 121.910 121.910 121.123 0.787 18517 23916 1 20 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.001 0.189 18517 23917 1 20 . 1 1 112 112 LYS C C 180 178.740 178.740 179.189 -0.449 18517 23918 1 20 . 1 1 112 112 LYS CA C 180 59.180 59.180 60.166 -0.986 18517 23919 1 20 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.385 -0.515 18517 23920 1 20 . 1 1 112 112 LYS H H 180 7.420 7.420 8.177 -0.757 18517 23921 1 20 . 1 1 113 113 PHE N N 181 118.220 118.220 118.051 0.169 18517 23922 1 20 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.260 0.490 18517 23923 1 20 . 1 1 113 113 PHE C C 181 178.520 178.520 178.318 0.202 18517 23924 1 20 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.499 -3.419 18517 23925 1 20 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.195 -0.215 18517 23926 1 20 . 1 1 113 113 PHE H H 181 9.000 9.000 8.596 0.404 18517 23927 1 20 . 1 1 114 114 SER N N 182 113.300 113.300 115.665 -2.365 18517 23928 1 20 . 1 1 114 114 SER HA H 182 3.930 3.930 3.974 -0.044 18517 23929 1 20 . 1 1 114 114 SER C C 182 177.080 177.080 176.393 0.687 18517 23930 1 20 . 1 1 114 114 SER CA C 182 62.000 62.000 62.486 -0.486 18517 23931 1 20 . 1 1 114 114 SER CB C 182 63.510 63.510 62.977 0.533 18517 23932 1 20 . 1 1 114 114 SER H H 182 8.620 8.620 8.626 -0.006 18517 23933 1 20 . 1 1 115 115 GLU N N 183 121.540 121.540 120.530 1.010 18517 23934 1 20 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.012 0.058 18517 23935 1 20 . 1 1 115 115 GLU C C 183 179.860 179.860 178.870 0.990 18517 23936 1 20 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.151 0.629 18517 23937 1 20 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.647 0.243 18517 23938 1 20 . 1 1 115 115 GLU H H 183 8.250 8.250 8.294 -0.044 18517 23939 1 20 . 1 1 116 116 ASP N N 184 121.740 121.740 121.323 0.417 18517 23940 1 20 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.377 0.133 18517 23941 1 20 . 1 1 116 116 ASP C C 184 179.570 179.570 178.053 1.517 18517 23942 1 20 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.596 -0.036 18517 23943 1 20 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.937 0.053 18517 23944 1 20 . 1 1 116 116 ASP H H 184 8.840 8.840 8.529 0.311 18517 23945 1 20 . 1 1 117 117 LEU N N 185 121.420 121.420 121.273 0.147 18517 23946 1 20 . 1 1 117 117 LEU HA H 185 4.130 4.130 3.865 0.265 18517 23947 1 20 . 1 1 117 117 LEU C C 185 178.840 178.840 178.480 0.360 18517 23948 1 20 . 1 1 117 117 LEU CA C 185 58.230 58.230 57.969 0.261 18517 23949 1 20 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.957 0.693 18517 23950 1 20 . 1 1 117 117 LEU H H 185 8.350 8.350 8.239 0.111 18517 23951 1 20 . 1 1 118 118 LYS N N 186 119.640 119.640 119.305 0.335 18517 23952 1 20 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.951 0.169 18517 23953 1 20 . 1 1 118 118 LYS C C 186 178.820 178.820 179.016 -0.196 18517 23954 1 20 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.253 0.487 18517 23955 1 20 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.000 0.510 18517 23956 1 20 . 1 1 118 118 LYS H H 186 8.220 8.220 8.187 0.033 18517 23957 1 20 . 1 1 119 119 ALA N N 187 120.160 120.160 121.722 -1.562 18517 23958 1 20 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.108 0.052 18517 23959 1 20 . 1 1 119 119 ALA C C 187 180.450 180.450 179.949 0.501 18517 23960 1 20 . 1 1 119 119 ALA CA C 187 55.140 55.140 54.919 0.221 18517 23961 1 20 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.412 0.058 18517 23962 1 20 . 1 1 119 119 ALA H H 187 8.010 8.010 7.961 0.049 18517 23963 1 20 . 1 1 120 120 GLU N N 188 117.930 117.930 118.061 -0.131 18517 23964 1 20 . 1 1 120 120 GLU HA H 188 4.180 4.180 3.786 0.394 18517 23965 1 20 . 1 1 120 120 GLU C C 188 178.780 178.780 178.771 0.009 18517 23966 1 20 . 1 1 120 120 GLU CA C 188 58.830 58.830 58.948 -0.118 18517 23967 1 20 . 1 1 120 120 GLU CB C 188 29.970 29.970 28.851 1.119 18517 23968 1 20 . 1 1 120 120 GLU H H 188 7.640 7.640 8.334 -0.694 18517 23969 1 20 . 1 1 121 121 GLN N N 189 117.230 117.230 118.937 -1.707 18517 23970 1 20 . 1 1 121 121 GLN HA H 189 4.230 4.230 4.117 0.113 18517 23971 1 20 . 1 1 121 121 GLN C C 189 179.190 179.190 178.275 0.915 18517 23972 1 20 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.083 1.657 18517 23973 1 20 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.830 0.820 18517 23974 1 20 . 1 1 121 121 GLN H H 189 8.280 8.280 8.253 0.027 18517 23975 1 20 . 1 1 122 122 GLU N N 190 118.340 118.340 121.109 -2.769 18517 23976 1 20 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.934 0.186 18517 23977 1 20 . 1 1 122 122 GLU C C 190 178.210 178.210 178.509 -0.299 18517 23978 1 20 . 1 1 122 122 GLU CA C 190 58.750 58.750 59.125 -0.375 18517 23979 1 20 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.242 0.728 18517 23980 1 20 . 1 1 122 122 GLU H H 190 8.250 8.250 8.233 0.017 18517 23981 1 20 . 1 1 123 123 LEU N N 191 118.930 118.930 122.038 -3.108 18517 23982 1 20 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.932 0.158 18517 23983 1 20 . 1 1 123 123 LEU C C 191 178.500 178.500 178.705 -0.205 18517 23984 1 20 . 1 1 123 123 LEU CA C 191 57.000 57.000 57.845 -0.845 18517 23985 1 20 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.224 1.276 18517 23986 1 20 . 1 1 123 123 LEU H H 191 7.530 7.530 8.100 -0.570 18517 23987 1 20 . 1 1 124 124 HIS N N 192 115.650 115.650 118.064 -2.414 18517 23988 1 20 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.175 0.545 18517 23989 1 20 . 1 1 124 124 HIS C C 192 176.090 176.090 177.740 -1.650 18517 23990 1 20 . 1 1 124 124 HIS CA C 192 56.690 56.690 58.617 -1.927 18517 23991 1 20 . 1 1 124 124 HIS CB C 192 30.760 30.760 29.771 0.989 18517 23992 1 20 . 1 1 124 124 HIS H H 192 7.450 7.450 8.338 -0.888 18517 23993 1 20 . 1 1 125 125 SER N N 193 115.480 115.480 114.156 1.324 18517 23994 1 20 . 1 1 125 125 SER HA H 193 4.310 4.310 3.402 0.908 18517 23995 1 20 . 1 1 125 125 SER CA C 193 60.180 60.180 61.393 -1.213 18517 23996 1 20 . 1 1 125 125 SER CB C 193 64.060 64.060 61.956 2.104 18517 23997 1 20 . 1 1 125 125 SER H H 193 8.020 8.020 8.093 -0.073 18517 23998 1 20 . 1 1 126 126 GLU C C 194 177.410 177.410 179.269 -1.859 18517 23999 1 20 . 1 1 126 126 GLU CA C 194 57.840 57.840 59.043 -1.203 18517 24000 1 20 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.131 0.759 18517 24001 1 20 . 1 1 127 127 ALA N N 195 122.910 122.910 121.431 1.479 18517 24002 1 20 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.137 0.053 18517 24003 1 20 . 1 1 127 127 ALA C C 195 178.610 178.610 179.233 -0.623 18517 24004 1 20 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.403 -0.612 18517 24005 1 20 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.475 0.785 18517 24006 1 20 . 1 1 127 127 ALA H H 195 8.020 8.020 7.587 0.433 18517 24007 1 20 . 1 1 128 128 LYS N N 196 117.770 117.770 115.819 1.951 18517 24008 1 20 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.336 -0.076 18517 24009 1 20 . 1 1 128 128 LYS C C 196 177.400 177.400 176.932 0.468 18517 24010 1 20 . 1 1 128 128 LYS CA C 196 57.000 57.000 55.095 1.905 18517 24011 1 20 . 1 1 128 128 LYS CB C 196 32.740 32.740 33.033 -0.293 18517 24012 1 20 . 1 1 128 128 LYS H H 196 7.990 7.990 8.005 -0.015 18517 24013 1 20 . 1 1 129 129 GLY N N 197 109.010 109.010 108.362 0.648 18517 24014 1 20 . 1 1 129 129 GLY C C 197 175.770 175.770 175.691 0.079 18517 24015 1 20 . 1 1 129 129 GLY CA C 197 46.100 46.100 45.066 1.034 18517 24016 1 20 . 1 1 129 129 GLY H H 197 8.220 8.220 7.667 0.553 18517 24017 1 20 . 1 1 130 130 GLY N N 198 109.150 109.150 109.563 -0.413 18517 24018 1 20 . 1 1 130 130 GLY C C 198 174.760 174.760 175.235 -0.475 18517 24019 1 20 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.285 -0.355 18517 24020 1 20 . 1 1 130 130 GLY H H 198 8.210 8.210 8.698 -0.488 18517 24021 1 20 . 1 1 131 131 GLU N N 199 121.560 121.560 121.903 -0.343 18517 24022 1 20 . 1 1 131 131 GLU HA H 199 4.020 4.020 3.978 0.042 18517 24023 1 20 . 1 1 131 131 GLU C C 199 178.500 178.500 178.379 0.121 18517 24024 1 20 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.051 0.849 18517 24025 1 20 . 1 1 131 131 GLU CB C 199 29.570 29.570 28.587 0.983 18517 24026 1 20 . 1 1 131 131 GLU H H 199 8.510 8.510 8.502 0.008 18517 24027 1 20 . 1 1 132 132 ALA N N 200 122.390 122.390 122.415 -0.025 18517 24028 1 20 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.206 -0.006 18517 24029 1 20 . 1 1 132 132 ALA C C 200 180.360 180.360 179.835 0.525 18517 24030 1 20 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.648 0.133 18517 24031 1 20 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.463 -0.073 18517 24032 1 20 . 1 1 132 132 ALA H H 200 8.190 8.190 7.670 0.520 18517 24033 1 20 . 1 1 133 133 LEU N N 201 120.800 120.800 120.583 0.217 18517 24034 1 20 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.118 0.092 18517 24035 1 20 . 1 1 133 133 LEU C C 201 179.270 179.270 178.765 0.505 18517 24036 1 20 . 1 1 133 133 LEU CA C 201 57.680 57.680 58.014 -0.334 18517 24037 1 20 . 1 1 133 133 LEU CB C 201 42.180 42.180 42.038 0.142 18517 24038 1 20 . 1 1 133 133 LEU H H 201 7.720 7.720 8.220 -0.500 18517 24039 1 20 . 1 1 134 134 LEU N N 202 120.680 120.680 120.030 0.650 18517 24040 1 20 . 1 1 134 134 LEU HA H 202 3.980 3.980 4.106 -0.126 18517 24041 1 20 . 1 1 134 134 LEU C C 202 179.030 179.030 178.411 0.619 18517 24042 1 20 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.740 0.690 18517 24043 1 20 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.477 0.143 18517 24044 1 20 . 1 1 134 134 LEU H H 202 8.470 8.470 8.869 -0.399 18517 24045 1 20 . 1 1 135 135 SER N N 203 113.290 113.290 115.319 -2.029 18517 24046 1 20 . 1 1 135 135 SER HA H 203 4.180 4.180 4.152 0.028 18517 24047 1 20 . 1 1 135 135 SER C C 203 177.300 177.300 176.696 0.604 18517 24048 1 20 . 1 1 135 135 SER CA C 203 62.080 62.080 62.678 -0.598 18517 24049 1 20 . 1 1 135 135 SER CB C 203 63.030 63.030 62.754 0.276 18517 24050 1 20 . 1 1 135 135 SER H H 203 8.210 8.210 8.283 -0.073 18517 24051 1 20 . 1 1 136 136 SER N N 204 117.500 117.500 119.091 -1.591 18517 24052 1 20 . 1 1 136 136 SER HA H 204 4.050 4.050 4.390 -0.340 18517 24053 1 20 . 1 1 136 136 SER C C 204 177.570 177.570 176.400 1.170 18517 24054 1 20 . 1 1 136 136 SER CA C 204 61.880 61.880 60.955 0.926 18517 24055 1 20 . 1 1 136 136 SER CB C 204 63.510 63.510 63.013 0.497 18517 24056 1 20 . 1 1 136 136 SER H H 204 7.730 7.730 8.412 -0.682 18517 24057 1 20 . 1 1 137 137 MET N N 205 122.500 122.500 123.073 -0.573 18517 24058 1 20 . 1 1 137 137 MET HA H 205 4.140 4.140 4.033 0.107 18517 24059 1 20 . 1 1 137 137 MET C C 205 177.680 177.680 178.263 -0.583 18517 24060 1 20 . 1 1 137 137 MET CA C 205 60.140 60.140 59.571 0.569 18517 24061 1 20 . 1 1 137 137 MET CB C 205 33.460 33.460 32.564 0.896 18517 24062 1 20 . 1 1 137 137 MET H H 205 8.170 8.170 8.548 -0.378 18517 24063 1 20 . 1 1 138 138 LYS N N 206 121.410 121.410 117.530 3.880 18517 24064 1 20 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.967 -0.217 18517 24065 1 20 . 1 1 138 138 LYS C C 206 178.780 178.780 179.364 -0.584 18517 24066 1 20 . 1 1 138 138 LYS CA C 206 60.330 60.330 59.771 0.559 18517 24067 1 20 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.316 -0.046 18517 24068 1 20 . 1 1 138 138 LYS H H 206 8.810 8.810 8.125 0.685 18517 24069 1 20 . 1 1 139 139 THR N N 207 116.580 116.580 117.306 -0.726 18517 24070 1 20 . 1 1 139 139 THR HA H 207 4.060 4.060 4.056 0.004 18517 24071 1 20 . 1 1 139 139 THR C C 207 176.730 176.730 177.138 -0.408 18517 24072 1 20 . 1 1 139 139 THR CA C 207 67.150 67.150 66.690 0.460 18517 24073 1 20 . 1 1 139 139 THR CB C 207 69.220 69.220 68.511 0.709 18517 24074 1 20 . 1 1 139 139 THR H H 207 7.930 7.930 8.113 -0.183 18517 24075 1 20 . 1 1 140 140 GLN N N 208 121.390 121.390 120.415 0.975 18517 24076 1 20 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.116 -0.056 18517 24077 1 20 . 1 1 140 140 GLN C C 208 178.550 178.550 178.501 0.049 18517 24078 1 20 . 1 1 140 140 GLN CA C 208 59.300 59.300 58.961 0.339 18517 24079 1 20 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.282 0.578 18517 24080 1 20 . 1 1 140 140 GLN H H 208 7.600 7.600 8.605 -1.005 18517 24081 1 20 . 1 1 141 141 HIS N N 209 122.360 122.360 119.638 2.722 18517 24082 1 20 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.285 -0.455 18517 24083 1 20 . 1 1 141 141 HIS C C 209 176.390 176.390 177.208 -0.818 18517 24084 1 20 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.120 1.600 18517 24085 1 20 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.247 -1.147 18517 24086 1 20 . 1 1 141 141 HIS H H 209 8.980 8.980 8.200 0.780 18517 24087 1 20 . 1 1 142 142 ASP N N 210 120.740 120.740 119.894 0.846 18517 24088 1 20 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.351 -0.001 18517 24089 1 20 . 1 1 142 142 ASP C C 210 179.490 179.490 178.170 1.320 18517 24090 1 20 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.833 0.087 18517 24091 1 20 . 1 1 142 142 ASP CB C 210 40.590 40.590 41.008 -0.418 18517 24092 1 20 . 1 1 142 142 ASP H H 210 8.770 8.770 8.313 0.457 18517 24093 1 20 . 1 1 143 143 GLU N N 211 119.010 119.010 120.343 -1.333 18517 24094 1 20 . 1 1 143 143 GLU HA H 211 3.970 3.970 3.978 -0.008 18517 24095 1 20 . 1 1 143 143 GLU C C 211 179.070 179.070 178.919 0.151 18517 24096 1 20 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.524 -0.224 18517 24097 1 20 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.688 -0.198 18517 24098 1 20 . 1 1 143 143 GLU H H 211 7.850 7.850 8.161 -0.311 18517 24099 1 20 . 1 1 144 144 LEU N N 212 122.500 122.500 120.179 2.321 18517 24100 1 20 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.028 0.042 18517 24101 1 20 . 1 1 144 144 LEU C C 212 179.340 179.340 179.354 -0.014 18517 24102 1 20 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.042 0.348 18517 24103 1 20 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.949 0.231 18517 24104 1 20 . 1 1 144 144 LEU H H 212 8.070 8.070 7.955 0.115 18517 24105 1 20 . 1 1 145 145 LEU N N 213 118.110 118.110 118.007 0.103 18517 24106 1 20 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.648 0.552 18517 24107 1 20 . 1 1 145 145 LEU C C 213 179.610 179.610 179.069 0.541 18517 24108 1 20 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.650 1.100 18517 24109 1 20 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.081 0.149 18517 24110 1 20 . 1 1 145 145 LEU H H 213 8.370 8.370 8.036 0.334 18517 24111 1 20 . 1 1 146 146 LYS N N 214 117.290 117.290 120.398 -3.108 18517 24112 1 20 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.909 -0.079 18517 24113 1 20 . 1 1 146 146 LYS C C 214 179.900 179.900 178.826 1.074 18517 24114 1 20 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.913 0.417 18517 24115 1 20 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.263 0.087 18517 24116 1 20 . 1 1 146 146 LYS H H 214 7.560 7.560 8.515 -0.955 18517 24117 1 20 . 1 1 147 147 LYS N N 215 120.330 120.330 118.533 1.797 18517 24118 1 20 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.032 -0.012 18517 24119 1 20 . 1 1 147 147 LYS C C 215 180.550 180.550 179.434 1.116 18517 24120 1 20 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.329 0.771 18517 24121 1 20 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.330 0.410 18517 24122 1 20 . 1 1 147 147 LYS H H 215 7.830 7.830 7.849 -0.019 18517 24123 1 20 . 1 1 148 148 PHE N N 216 117.370 117.370 117.965 -0.595 18517 24124 1 20 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.158 -0.078 18517 24125 1 20 . 1 1 148 148 PHE C C 216 178.200 178.200 177.320 0.880 18517 24126 1 20 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.246 0.874 18517 24127 1 20 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.382 1.338 18517 24128 1 20 . 1 1 148 148 PHE H H 216 8.010 8.010 8.379 -0.369 18517 24129 1 20 . 1 1 149 149 ALA N N 217 118.990 118.990 119.782 -0.792 18517 24130 1 20 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.332 -0.222 18517 24131 1 20 . 1 1 149 149 ALA C C 217 177.330 177.330 178.232 -0.902 18517 24132 1 20 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.009 0.741 18517 24133 1 20 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.665 -1.065 18517 24134 1 20 . 1 1 149 149 ALA H H 217 7.720 7.720 7.858 -0.138 18517 24135 1 20 . 1 1 150 150 ALA N N 218 118.690 118.690 120.594 -1.904 18517 24136 1 20 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.375 -0.015 18517 24137 1 20 . 1 1 150 150 ALA C C 218 177.930 177.930 177.600 0.330 18517 24138 1 20 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.737 -0.647 18517 24139 1 20 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.643 0.097 18517 24140 1 20 . 1 1 150 150 ALA H H 218 7.280 7.280 7.791 -0.511 18517 24141 1 20 . 1 1 151 151 LEU N N 219 119.980 119.980 121.197 -1.217 18517 24142 1 20 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.605 -0.335 18517 24143 1 20 . 1 1 151 151 LEU C C 219 176.150 176.150 175.014 1.136 18517 24144 1 20 . 1 1 151 151 LEU CA C 219 56.170 56.170 54.124 2.046 18517 24145 1 20 . 1 1 151 151 LEU CB C 219 42.810 42.810 44.446 -1.636 18517 24146 1 20 . 1 1 151 151 LEU H H 219 7.050 7.050 7.593 -0.543 18517 24147 1 20 . 1 1 152 152 THR N N 220 112.070 112.070 116.901 -4.831 18517 24148 1 20 . 1 1 152 152 THR HA H 220 4.700 4.700 4.896 -0.196 18517 24149 1 20 . 1 1 152 152 THR C C 220 173.400 173.400 173.388 0.012 18517 24150 1 20 . 1 1 152 152 THR CA C 220 58.190 58.190 58.357 -0.167 18517 24151 1 20 . 1 1 152 152 THR CB C 220 70.960 70.960 69.171 1.789 18517 24152 1 20 . 1 1 152 152 THR H H 220 8.040 8.040 8.235 -0.195 18517 24153 1 20 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.628 0.082 18517 24154 1 20 . 1 1 153 153 PRO C C 221 176.720 176.720 176.481 0.239 18517 24155 1 20 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.544 0.366 18517 24156 1 20 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.484 1.766 18517 24157 1 20 . 1 1 154 154 THR N N 222 120.460 120.460 118.261 2.199 18517 24158 1 20 . 1 1 154 154 THR HA H 222 4.250 4.250 4.451 -0.201 18517 24159 1 20 . 1 1 154 154 THR C C 222 175.190 175.190 175.377 -0.187 18517 24160 1 20 . 1 1 154 154 THR CA C 222 64.650 64.650 62.919 1.731 18517 24161 1 20 . 1 1 154 154 THR CB C 222 70.410 70.410 68.557 1.853 18517 24162 1 20 . 1 1 154 154 THR H H 222 8.530 8.530 8.402 0.128 18517 24163 1 20 . 1 1 155 155 PHE N N 223 122.260 122.260 123.720 -1.460 18517 24164 1 20 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.725 0.265 18517 24165 1 20 . 1 1 155 155 PHE C C 223 172.560 172.560 174.578 -2.018 18517 24166 1 20 . 1 1 155 155 PHE CA C 223 56.770 56.770 57.290 -0.520 18517 24167 1 20 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.262 1.328 18517 24168 1 20 . 1 1 155 155 PHE H H 223 8.950 8.950 7.724 1.226 18517 24169 1 20 . 1 1 156 156 LEU N N 224 123.440 123.440 119.650 3.790 18517 24170 1 20 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.442 0.228 18517 24171 1 20 . 1 1 156 156 LEU C C 224 175.090 175.090 177.037 -1.947 18517 24172 1 20 . 1 1 156 156 LEU CA C 224 54.030 54.030 53.669 0.361 18517 24173 1 20 . 1 1 156 156 LEU CB C 224 46.300 46.300 43.358 2.942 18517 24174 1 20 . 1 1 156 156 LEU H H 224 7.210 7.210 7.178 0.032 18517 24175 1 20 . 1 1 157 157 THR N N 225 113.010 113.010 116.119 -3.109 18517 24176 1 20 . 1 1 157 157 THR HA H 225 4.790 4.790 4.625 0.165 18517 24177 1 20 . 1 1 157 157 THR C C 225 176.130 176.130 174.687 1.443 18517 24178 1 20 . 1 1 157 157 THR CA C 225 59.860 59.860 61.092 -1.232 18517 24179 1 20 . 1 1 157 157 THR CB C 225 72.860 72.860 70.623 2.237 18517 24180 1 20 . 1 1 157 157 THR H H 225 9.200 9.200 8.471 0.729 18517 24181 1 20 . 1 1 158 158 SER N N 226 115.350 115.350 120.183 -4.833 18517 24182 1 20 . 1 1 158 158 SER C C 226 177.410 177.410 175.805 1.605 18517 24183 1 20 . 1 1 158 158 SER CA C 226 57.400 57.400 58.027 -0.627 18517 24184 1 20 . 1 1 158 158 SER CB C 226 66.200 66.200 63.687 2.513 18517 24185 1 20 . 1 1 158 158 SER H H 226 8.830 8.830 8.700 0.130 18517 24186 1 20 . 1 1 159 159 GLU N N 227 121.200 121.200 121.150 0.050 18517 24187 1 20 . 1 1 159 159 GLU HA H 227 4.020 4.020 4.013 0.007 18517 24188 1 20 . 1 1 159 159 GLU C C 227 177.680 177.680 177.585 0.095 18517 24189 1 20 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.682 0.818 18517 24190 1 20 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.502 0.068 18517 24191 1 20 . 1 1 159 159 GLU H H 227 8.320 8.320 8.798 -0.478 18517 24192 1 20 . 1 1 160 160 ASP N N 228 115.350 115.350 118.139 -2.789 18517 24193 1 20 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.407 0.143 18517 24194 1 20 . 1 1 160 160 ASP C C 228 177.640 177.640 178.082 -0.442 18517 24195 1 20 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.869 0.531 18517 24196 1 20 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.817 2.233 18517 24197 1 20 . 1 1 160 160 ASP H H 228 7.570 7.570 8.127 -0.557 18517 24198 1 20 . 1 1 161 161 ILE N N 229 108.150 108.150 114.626 -6.476 18517 24199 1 20 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.367 0.143 18517 24200 1 20 . 1 1 161 161 ILE C C 229 173.130 173.130 177.392 -4.262 18517 24201 1 20 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.424 -1.134 18517 24202 1 20 . 1 1 161 161 ILE CB C 229 39.400 39.400 39.255 0.145 18517 24203 1 20 . 1 1 161 161 ILE H H 229 7.190 7.190 7.692 -0.502 18517 24204 1 20 . 1 1 162 162 SER N N 230 115.290 115.290 117.701 -2.411 18517 24205 1 20 . 1 1 162 162 SER HA H 230 4.760 4.760 3.782 0.978 18517 24206 1 20 . 1 1 162 162 SER C C 230 176.060 176.060 174.645 1.415 18517 24207 1 20 . 1 1 162 162 SER CA C 230 57.920 57.920 58.132 -0.212 18517 24208 1 20 . 1 1 162 162 SER CB C 230 66.120 66.120 62.203 3.917 18517 24209 1 20 . 1 1 162 162 SER H H 230 7.460 7.460 8.284 -0.824 18517 24210 1 20 . 1 1 163 163 GLY C C 231 173.260 173.260 173.689 -0.429 18517 24211 1 20 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.806 0.744 18517 24212 1 20 . 1 1 164 164 TYR N N 232 115.290 115.290 117.291 -2.001 18517 24213 1 20 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.680 0.020 18517 24214 1 20 . 1 1 164 164 TYR C C 232 172.820 172.820 174.700 -1.880 18517 24215 1 20 . 1 1 164 164 TYR CA C 232 55.100 55.100 54.519 0.581 18517 24216 1 20 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.493 0.307 18517 24217 1 20 . 1 1 164 164 TYR H H 232 7.370 7.370 6.747 0.623 18517 24218 1 20 . 1 1 165 165 LEU N N 233 120.980 120.980 122.192 -1.212 18517 24219 1 20 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.418 0.012 18517 24220 1 20 . 1 1 165 165 LEU C C 233 176.360 176.360 177.370 -1.010 18517 24221 1 20 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.052 1.608 18517 24222 1 20 . 1 1 165 165 LEU CB C 233 40.430 40.430 39.470 0.960 18517 24223 1 20 . 1 1 165 165 LEU H H 233 8.830 8.830 8.711 0.119 18517 24224 1 20 . 1 1 166 166 THR N N 234 116.170 116.170 115.439 0.731 18517 24225 1 20 . 1 1 166 166 THR HA H 234 4.010 4.010 3.454 0.556 18517 24226 1 20 . 1 1 166 166 THR C C 234 173.070 173.070 173.951 -0.881 18517 24227 1 20 . 1 1 166 166 THR CA C 234 62.910 62.910 63.564 -0.654 18517 24228 1 20 . 1 1 166 166 THR CB C 234 70.170 70.170 68.726 1.444 18517 24229 1 20 . 1 1 166 166 THR H H 234 8.050 8.050 7.926 0.124 18517 24230 1 20 . 1 1 167 167 VAL N N 235 117.640 117.640 122.063 -4.423 18517 24231 1 20 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.203 0.007 18517 24232 1 20 . 1 1 167 167 VAL C C 235 172.330 172.330 173.247 -0.917 18517 24233 1 20 . 1 1 167 167 VAL CA C 235 58.750 58.750 58.142 0.608 18517 24234 1 20 . 1 1 167 167 VAL CB C 235 35.880 35.880 33.605 2.275 18517 24235 1 20 . 1 1 167 167 VAL H H 235 7.160 7.160 7.361 -0.201 18517 24236 1 20 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.534 -0.344 18517 24237 1 20 . 1 1 168 168 PRO C C 236 173.710 173.710 175.487 -1.777 18517 24238 1 20 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.633 1.197 18517 24239 1 20 . 1 1 168 168 PRO CB C 236 32.270 32.270 32.935 -0.665 18517 24240 1 20 . 1 1 169 169 GLU N N 237 113.540 113.540 119.689 -6.149 18517 24241 1 20 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.074 0.306 18517 24242 1 20 . 1 1 169 169 GLU C C 237 176.690 176.690 178.119 -1.429 18517 24243 1 20 . 1 1 169 169 GLU CA C 237 53.750 53.750 55.531 -1.781 18517 24244 1 20 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.628 2.592 18517 24245 1 20 . 1 1 169 169 GLU H H 237 7.930 7.930 8.457 -0.527 18517 24246 1 20 . 1 1 170 170 TYR N N 238 119.400 119.400 121.458 -2.058 18517 24247 1 20 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.252 -0.252 18517 24248 1 20 . 1 1 170 170 TYR C C 238 177.610 177.610 175.802 1.808 18517 24249 1 20 . 1 1 170 170 TYR CA C 238 62.630 62.630 59.891 2.740 18517 24250 1 20 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.385 -0.645 18517 24251 1 20 . 1 1 170 170 TYR H H 238 8.490 8.490 8.803 -0.313 18517 24252 1 20 . 1 1 171 171 GLY N N 239 104.160 104.160 102.571 1.589 18517 24253 1 20 . 1 1 171 171 GLY C C 239 173.350 173.350 172.977 0.373 18517 24254 1 20 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.956 0.314 18517 24255 1 20 . 1 1 171 171 GLY H H 239 7.960 7.960 7.827 0.133 18517 24256 1 20 . 1 1 172 172 ALA N N 240 121.860 121.860 123.403 -1.543 18517 24257 1 20 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.733 -0.563 18517 24258 1 20 . 1 1 172 172 ALA C C 240 172.160 172.160 174.575 -2.415 18517 24259 1 20 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.630 0.480 18517 24260 1 20 . 1 1 172 172 ALA CB C 240 20.930 20.930 19.855 1.075 18517 24261 1 20 . 1 1 172 172 ALA H H 240 6.910 6.910 7.731 -0.821 18517 24262 1 20 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.199 1.351 18517 24263 1 20 . 1 1 173 173 PRO C C 241 176.610 176.610 174.860 1.750 18517 24264 1 20 . 1 1 173 173 PRO CA C 241 61.520 61.520 61.833 -0.313 18517 24265 1 20 . 1 1 173 173 PRO CB C 241 33.300 33.300 32.217 1.083 18517 24266 1 20 . 1 1 174 174 MET N N 242 114.000 114.000 117.279 -3.279 18517 24267 1 20 . 1 1 174 174 MET HA H 242 4.390 4.390 4.399 -0.009 18517 24268 1 20 . 1 1 174 174 MET C C 242 173.960 173.960 173.803 0.157 18517 24269 1 20 . 1 1 174 174 MET CA C 242 54.660 54.660 53.886 0.774 18517 24270 1 20 . 1 1 174 174 MET CB C 242 34.170 34.170 36.107 -1.937 18517 24271 1 20 . 1 1 174 174 MET H H 242 8.040 8.040 7.501 0.539 18517 24272 1 20 . 1 1 175 175 ASN N N 243 119.570 119.570 122.475 -2.905 18517 24273 1 20 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.773 0.167 18517 24274 1 20 . 1 1 175 175 ASN C C 243 174.320 174.320 175.161 -0.841 18517 24275 1 20 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.318 0.762 18517 24276 1 20 . 1 1 175 175 ASN CB C 243 38.850 38.850 39.674 -0.824 18517 24277 1 20 . 1 1 175 175 ASN H H 243 7.960 7.960 8.410 -0.450 18517 24278 1 20 . 1 1 176 176 ALA N N 244 132.250 132.250 128.679 3.571 18517 24279 1 20 . 1 1 176 176 ALA C C 244 181.580 181.580 178.486 3.094 18517 24280 1 20 . 1 1 176 176 ALA CA C 244 55.770 55.770 54.818 0.952 18517 24281 1 20 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.810 0.220 18517 24282 1 20 . 1 1 176 176 ALA H H 244 12.110 12.110 8.689 3.421 18517 24283 1 20 . 1 1 177 177 ALA N N 245 125.780 125.780 122.126 3.654 18517 24284 1 20 . 1 1 177 177 ALA HA H 245 3.870 3.870 4.025 -0.155 18517 24285 1 20 . 1 1 177 177 ALA C C 245 180.640 180.640 179.543 1.097 18517 24286 1 20 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.130 0.530 18517 24287 1 20 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.071 -0.231 18517 24288 1 20 . 1 1 177 177 ALA H H 245 10.240 10.240 8.221 2.019 18517 24289 1 20 . 1 1 178 178 LYS N N 246 119.810 119.810 119.328 0.482 18517 24290 1 20 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.066 -0.236 18517 24291 1 20 . 1 1 178 178 LYS C C 246 180.500 180.500 178.364 2.136 18517 24292 1 20 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.222 0.678 18517 24293 1 20 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.439 -1.119 18517 24294 1 20 . 1 1 178 178 LYS H H 246 8.470 8.470 8.177 0.293 18517 24295 1 20 . 1 1 179 179 TRP N N 247 121.170 121.170 121.656 -0.486 18517 24296 1 20 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.341 0.279 18517 24297 1 20 . 1 1 179 179 TRP C C 247 176.510 176.510 177.836 -1.326 18517 24298 1 20 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.821 -0.001 18517 24299 1 20 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.660 -0.090 18517 24300 1 20 . 1 1 179 179 TRP H H 247 8.330 8.330 8.176 0.154 18517 24301 1 20 . 1 1 180 180 ALA N N 248 119.130 119.130 120.293 -1.163 18517 24302 1 20 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.733 0.807 18517 24303 1 20 . 1 1 180 180 ALA C C 248 182.110 182.110 179.404 2.706 18517 24304 1 20 . 1 1 180 180 ALA CA C 248 54.190 54.190 55.125 -0.935 18517 24305 1 20 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.039 0.671 18517 24306 1 20 . 1 1 180 180 ALA H H 248 7.990 7.990 8.624 -0.634 18517 24307 1 20 . 1 1 181 181 LYS N N 249 116.000 116.000 119.394 -3.394 18517 24308 1 20 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.046 -0.076 18517 24309 1 20 . 1 1 181 181 LYS C C 249 179.380 179.380 178.799 0.581 18517 24310 1 20 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.517 -0.807 18517 24311 1 20 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.738 -0.228 18517 24312 1 20 . 1 1 181 181 LYS H H 249 6.900 6.900 7.744 -0.844 18517 24313 1 20 . 1 1 182 182 VAL N N 250 122.270 122.270 116.271 5.999 18517 24314 1 20 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.751 -0.411 18517 24315 1 20 . 1 1 182 182 VAL C C 250 178.160 178.160 177.965 0.195 18517 24316 1 20 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.082 0.678 18517 24317 1 20 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.254 -0.414 18517 24318 1 20 . 1 1 182 182 VAL H H 250 7.050 7.050 8.001 -0.951 18517 24319 1 20 . 1 1 183 183 GLU N N 251 120.520 120.520 120.334 0.186 18517 24320 1 20 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.867 -0.687 18517 24321 1 20 . 1 1 183 183 GLU C C 251 179.480 179.480 178.829 0.651 18517 24322 1 20 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.200 1.490 18517 24323 1 20 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.613 -0.543 18517 24324 1 20 . 1 1 183 183 GLU H H 251 8.020 8.020 8.584 -0.564 18517 24325 1 20 . 1 1 184 184 GLY N N 252 102.930 102.930 107.377 -4.447 18517 24326 1 20 . 1 1 184 184 GLY C C 252 176.920 176.920 176.555 0.365 18517 24327 1 20 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.206 0.204 18517 24328 1 20 . 1 1 184 184 GLY H H 252 7.830 7.830 7.995 -0.165 18517 24329 1 20 . 1 1 185 185 MET N N 253 123.200 123.200 121.628 1.572 18517 24330 1 20 . 1 1 185 185 MET HA H 253 4.250 4.250 4.127 0.123 18517 24331 1 20 . 1 1 185 185 MET C C 253 179.370 179.370 178.542 0.828 18517 24332 1 20 . 1 1 185 185 MET CA C 253 59.300 59.300 59.331 -0.032 18517 24333 1 20 . 1 1 185 185 MET CB C 253 33.930 33.930 32.629 1.302 18517 24334 1 20 . 1 1 185 185 MET H H 253 7.890 7.890 7.884 0.006 18517 24335 1 20 . 1 1 186 186 ILE N N 254 120.150 120.150 120.344 -0.194 18517 24336 1 20 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.652 -0.092 18517 24337 1 20 . 1 1 186 186 ILE C C 254 177.250 177.250 177.969 -0.719 18517 24338 1 20 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.530 0.990 18517 24339 1 20 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.655 0.635 18517 24340 1 20 . 1 1 186 186 ILE H H 254 8.260 8.260 8.237 0.023 18517 24341 1 20 . 1 1 187 187 HIS N N 255 119.810 119.810 119.590 0.220 18517 24342 1 20 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.167 -0.167 18517 24343 1 20 . 1 1 187 187 HIS C C 255 176.460 176.460 177.461 -1.001 18517 24344 1 20 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.866 0.464 18517 24345 1 20 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.499 2.131 18517 24346 1 20 . 1 1 187 187 HIS H H 255 8.900 8.900 8.891 0.009 18517 24347 1 20 . 1 1 188 188 GLY N N 256 103.160 103.160 106.545 -3.385 18517 24348 1 20 . 1 1 188 188 GLY C C 256 176.320 176.320 175.689 0.631 18517 24349 1 20 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.697 0.193 18517 24350 1 20 . 1 1 188 188 GLY H H 256 8.030 8.030 8.059 -0.029 18517 24351 1 20 . 1 1 189 189 LYS N N 257 119.510 119.510 119.345 0.165 18517 24352 1 20 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.088 -0.088 18517 24353 1 20 . 1 1 189 189 LYS C C 257 178.660 178.660 178.989 -0.329 18517 24354 1 20 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.208 -0.718 18517 24355 1 20 . 1 1 189 189 LYS CB C 257 31.550 31.550 32.287 -0.737 18517 24356 1 20 . 1 1 189 189 LYS H H 257 7.120 7.120 7.717 -0.597 18517 24357 1 20 . 1 1 190 190 LEU N N 258 120.570 120.570 120.228 0.342 18517 24358 1 20 . 1 1 190 190 LEU HA H 258 3.930 3.930 4.057 -0.127 18517 24359 1 20 . 1 1 190 190 LEU C C 258 177.230 177.230 176.998 0.232 18517 24360 1 20 . 1 1 190 190 LEU CA C 258 57.520 57.520 56.853 0.667 18517 24361 1 20 . 1 1 190 190 LEU CB C 258 42.970 42.970 41.986 0.984 18517 24362 1 20 . 1 1 190 190 LEU H H 258 8.060 8.060 8.257 -0.197 18517 24363 1 20 . 1 1 191 191 GLU N N 259 114.590 114.590 114.010 0.580 18517 24364 1 20 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.304 -0.024 18517 24365 1 20 . 1 1 191 191 GLU C C 259 176.230 176.230 176.562 -0.332 18517 24366 1 20 . 1 1 191 191 GLU CA C 259 55.340 55.340 55.323 0.017 18517 24367 1 20 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.150 0.180 18517 24368 1 20 . 1 1 191 191 GLU H H 259 7.330 7.330 7.612 -0.282 18517 24369 1 20 . 1 1 192 192 SER N N 260 115.240 115.240 115.762 -0.522 18517 24370 1 20 . 1 1 192 192 SER HA H 260 4.490 4.490 4.416 0.074 18517 24371 1 20 . 1 1 192 192 SER C C 260 173.770 173.770 175.154 -1.384 18517 24372 1 20 . 1 1 192 192 SER CA C 260 58.350 58.350 57.304 1.046 18517 24373 1 20 . 1 1 192 192 SER CB C 260 65.090 65.090 63.781 1.309 18517 24374 1 20 . 1 1 192 192 SER H H 260 7.130 7.130 7.584 -0.454 18517 24375 1 20 . 1 1 193 193 SER C C 261 174.600 174.600 174.446 0.154 18517 24376 1 20 . 1 1 193 193 SER CA C 261 59.980 59.980 58.233 1.747 18517 24377 1 20 . 1 1 193 193 SER CB C 261 63.750 63.750 63.266 0.484 18517 24378 1 20 . 1 1 194 194 GLU N N 262 121.800 121.800 121.882 -0.082 18517 24379 1 20 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.306 0.164 18517 24380 1 20 . 1 1 194 194 GLU C C 262 174.650 174.650 175.362 -0.712 18517 24381 1 20 . 1 1 194 194 GLU CA C 262 55.620 55.620 56.096 -0.476 18517 24382 1 20 . 1 1 194 194 GLU CB C 262 30.210 30.210 30.556 -0.346 18517 24383 1 20 . 1 1 194 194 GLU H H 262 7.840 7.840 7.560 0.280 18517 24384 1 20 . 1 1 195 195 VAL N N 263 124.080 124.080 124.143 -0.063 18517 24385 1 20 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.154 0.096 18517 24386 1 20 . 1 1 195 195 VAL C C 263 174.460 174.460 174.602 -0.142 18517 24387 1 20 . 1 1 195 195 VAL CA C 263 59.820 59.820 60.775 -0.955 18517 24388 1 20 . 1 1 195 195 VAL CB C 263 33.620 33.620 31.308 2.312 18517 24389 1 20 . 1 1 195 195 VAL H H 263 8.020 8.020 8.226 -0.206 18517 24390 1 20 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.341 0.179 18517 24391 1 20 . 1 1 198 198 ASN C C 266 176.490 176.490 177.220 -0.730 18517 24392 1 20 . 1 1 198 198 ASN CA C 266 54.780 54.780 56.830 -2.050 18517 24393 1 20 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.989 0.071 18517 24394 1 20 . 1 1 199 199 LEU N N 267 120.680 120.680 117.777 2.903 18517 24395 1 20 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.968 0.042 18517 24396 1 20 . 1 1 199 199 LEU C C 267 178.050 178.050 178.433 -0.383 18517 24397 1 20 . 1 1 199 199 LEU CA C 267 58.830 58.830 57.781 1.049 18517 24398 1 20 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.101 1.239 18517 24399 1 20 . 1 1 199 199 LEU H H 267 7.660 7.660 7.815 -0.155 18517 24400 1 20 . 1 1 200 200 LYS N N 268 116.740 116.740 120.335 -3.595 18517 24401 1 20 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.943 -0.213 18517 24402 1 20 . 1 1 200 200 LYS C C 268 178.520 178.520 178.463 0.057 18517 24403 1 20 . 1 1 200 200 LYS CA C 268 61.800 61.800 58.838 2.962 18517 24404 1 20 . 1 1 200 200 LYS CB C 268 32.110 32.110 31.868 0.242 18517 24405 1 20 . 1 1 200 200 LYS H H 268 8.280 8.280 7.659 0.621 18517 24406 1 20 . 1 1 201 201 ALA N N 269 121.270 121.270 122.393 -1.123 18517 24407 1 20 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.017 0.223 18517 24408 1 20 . 1 1 201 201 ALA C C 269 180.890 180.890 179.938 0.952 18517 24409 1 20 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.234 -0.054 18517 24410 1 20 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.283 0.187 18517 24411 1 20 . 1 1 201 201 ALA H H 269 7.710 7.710 7.937 -0.227 18517 24412 1 20 . 1 1 202 202 LEU N N 270 119.980 119.980 118.891 1.089 18517 24413 1 20 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.963 0.127 18517 24414 1 20 . 1 1 202 202 LEU C C 270 179.330 179.330 179.380 -0.050 18517 24415 1 20 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.699 0.371 18517 24416 1 20 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.221 1.199 18517 24417 1 20 . 1 1 202 202 LEU H H 270 7.750 7.750 8.394 -0.644 18517 24418 1 20 . 1 1 203 203 VAL N N 271 118.450 118.450 120.004 -1.554 18517 24419 1 20 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.952 -0.122 18517 24420 1 20 . 1 1 203 203 VAL C C 271 177.110 177.110 178.150 -1.040 18517 24421 1 20 . 1 1 203 203 VAL CA C 271 67.710 67.710 66.652 1.058 18517 24422 1 20 . 1 1 203 203 VAL CB C 271 31.710 31.710 30.792 0.918 18517 24423 1 20 . 1 1 203 203 VAL H H 271 8.560 8.560 8.284 0.276 18517 24424 1 20 . 1 1 204 204 ALA N N 272 122.560 122.560 121.683 0.877 18517 24425 1 20 . 1 1 204 204 ALA HA H 272 3.880 3.880 4.009 -0.129 18517 24426 1 20 . 1 1 204 204 ALA C C 272 178.700 178.700 179.905 -1.205 18517 24427 1 20 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.708 0.422 18517 24428 1 20 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.225 0.165 18517 24429 1 20 . 1 1 204 204 ALA H H 272 8.120 8.120 8.670 -0.550 18517 24430 1 20 . 1 1 205 205 GLU N N 273 117.290 117.290 119.040 -1.750 18517 24431 1 20 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.097 -0.107 18517 24432 1 20 . 1 1 205 205 GLU C C 273 178.630 178.630 179.167 -0.537 18517 24433 1 20 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.107 1.033 18517 24434 1 20 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.380 0.590 18517 24435 1 20 . 1 1 205 205 GLU H H 273 7.670 7.670 8.172 -0.502 18517 24436 1 20 . 1 1 206 206 LEU N N 274 120.450 120.450 121.616 -1.166 18517 24437 1 20 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.044 -0.044 18517 24438 1 20 . 1 1 206 206 LEU C C 274 178.400 178.400 179.139 -0.739 18517 24439 1 20 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.030 0.880 18517 24440 1 20 . 1 1 206 206 LEU CB C 274 43.530 43.530 42.099 1.431 18517 24441 1 20 . 1 1 206 206 LEU H H 274 8.420 8.420 8.465 -0.045 18517 24442 1 20 . 1 1 207 207 ILE N N 275 117.580 117.580 119.762 -2.182 18517 24443 1 20 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.753 -0.224 18517 24444 1 20 . 1 1 207 207 ILE C C 275 178.850 178.850 178.583 0.267 18517 24445 1 20 . 1 1 207 207 ILE CA C 275 66.080 66.080 63.873 2.207 18517 24446 1 20 . 1 1 207 207 ILE CB C 275 38.770 38.770 36.373 2.397 18517 24447 1 20 . 1 1 207 207 ILE H H 275 8.700 8.700 8.691 0.009 18517 24448 1 20 . 1 1 208 208 GLU N N 276 119.100 119.100 119.560 -0.460 18517 24449 1 20 . 1 1 208 208 GLU HA H 276 4.000 4.000 4.072 -0.072 18517 24450 1 20 . 1 1 208 208 GLU C C 276 178.540 178.540 179.072 -0.532 18517 24451 1 20 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.235 1.215 18517 24452 1 20 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.467 1.053 18517 24453 1 20 . 1 1 208 208 GLU H H 276 7.950 7.950 8.248 -0.298 18517 24454 1 20 . 1 1 209 209 LEU N N 277 120.590 120.590 120.780 -0.190 18517 24455 1 20 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.078 0.142 18517 24456 1 20 . 1 1 209 209 LEU C C 277 179.520 179.520 179.022 0.498 18517 24457 1 20 . 1 1 209 209 LEU CA C 277 58.350 58.350 58.281 0.069 18517 24458 1 20 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.593 1.698 18517 24459 1 20 . 1 1 209 209 LEU H H 277 8.550 8.550 8.594 -0.044 18517 24460 1 20 . 1 1 210 210 ARG N N 278 116.470 116.470 118.142 -1.672 18517 24461 1 20 . 1 1 210 210 ARG HA H 278 3.740 3.740 4.037 -0.297 18517 24462 1 20 . 1 1 210 210 ARG C C 278 179.190 179.190 178.431 0.759 18517 24463 1 20 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.994 1.686 18517 24464 1 20 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.124 1.276 18517 24465 1 20 . 1 1 210 210 ARG H H 278 8.590 8.590 8.747 -0.157 18517 24466 1 20 . 1 1 211 211 ALA N N 279 120.470 120.470 122.270 -1.800 18517 24467 1 20 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.064 -0.154 18517 24468 1 20 . 1 1 211 211 ALA C C 279 181.350 181.350 180.065 1.285 18517 24469 1 20 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.194 0.506 18517 24470 1 20 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.009 -0.729 18517 24471 1 20 . 1 1 211 211 ALA H H 279 8.050 8.050 8.195 -0.145 18517 24472 1 20 . 1 1 212 212 GLN N N 280 120.070 120.070 117.776 2.294 18517 24473 1 20 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.990 0.030 18517 24474 1 20 . 1 1 212 212 GLN C C 280 179.490 179.490 178.519 0.971 18517 24475 1 20 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.902 0.398 18517 24476 1 20 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.705 0.475 18517 24477 1 20 . 1 1 212 212 GLN H H 280 8.300 8.300 8.174 0.126 18517 24478 1 20 . 1 1 213 213 MET N N 281 119.810 119.810 120.908 -1.098 18517 24479 1 20 . 1 1 213 213 MET HA H 281 3.730 3.730 4.219 -0.489 18517 24480 1 20 . 1 1 213 213 MET C C 281 177.490 177.490 178.343 -0.853 18517 24481 1 20 . 1 1 213 213 MET CA C 281 60.690 60.690 58.255 2.435 18517 24482 1 20 . 1 1 213 213 MET CB C 281 33.930 33.930 32.575 1.355 18517 24483 1 20 . 1 1 213 213 MET H H 281 8.420 8.420 8.239 0.181 18517 24484 1 20 . 1 1 214 214 MET N N 282 114.000 114.000 118.130 -4.130 18517 24485 1 20 . 1 1 214 214 MET HA H 282 3.880 3.880 4.267 -0.387 18517 24486 1 20 . 1 1 214 214 MET C C 282 177.650 177.650 178.596 -0.946 18517 24487 1 20 . 1 1 214 214 MET CA C 282 58.670 58.670 56.426 2.244 18517 24488 1 20 . 1 1 214 214 MET CB C 282 33.300 33.300 30.833 2.467 18517 24489 1 20 . 1 1 214 214 MET H H 282 7.890 7.890 8.699 -0.809 18517 24490 1 20 . 1 1 215 215 ALA N N 283 119.970 119.970 123.323 -3.353 18517 24491 1 20 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.040 0.100 18517 24492 1 20 . 1 1 215 215 ALA C C 283 180.580 180.580 179.240 1.340 18517 24493 1 20 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.172 -1.062 18517 24494 1 20 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.145 -0.465 18517 24495 1 20 . 1 1 215 215 ALA H H 283 7.580 7.580 8.172 -0.592 18517 24496 1 20 . 1 1 216 216 LEU N N 284 120.920 120.920 116.438 4.482 18517 24497 1 20 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.097 -0.137 18517 24498 1 20 . 1 1 216 216 LEU C C 284 177.910 177.910 179.690 -1.780 18517 24499 1 20 . 1 1 216 216 LEU CA C 284 57.920 57.920 56.802 1.118 18517 24500 1 20 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.099 0.401 18517 24501 1 20 . 1 1 216 216 LEU H H 284 7.460 7.460 8.033 -0.573 18517 24502 1 20 . 1 1 217 217 LEU N N 285 116.470 116.470 121.878 -5.408 18517 24503 1 20 . 1 1 217 217 LEU HA H 285 3.680 3.680 4.057 -0.377 18517 24504 1 20 . 1 1 217 217 LEU C C 285 178.310 178.310 177.748 0.562 18517 24505 1 20 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.289 0.151 18517 24506 1 20 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.973 1.077 18517 24507 1 20 . 1 1 217 217 LEU H H 285 6.980 6.980 8.085 -1.105 18517 24508 1 20 . 1 1 218 218 TYR N N 286 111.080 111.080 115.613 -4.533 18517 24509 1 20 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.683 0.217 18517 24510 1 20 . 1 1 218 218 TYR C C 286 176.090 176.090 176.504 -0.414 18517 24511 1 20 . 1 1 218 218 TYR CA C 286 56.050 56.050 57.278 -1.228 18517 24512 1 20 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.247 2.663 18517 24513 1 20 . 1 1 218 218 TYR H H 286 7.660 7.660 8.536 -0.876 18517 24514 1 20 . 1 1 219 219 GLY N N 287 108.260 108.260 109.947 -1.687 18517 24515 1 20 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.466 0.854 18517 24516 1 20 . 1 1 219 219 GLY H H 287 7.750 7.750 7.446 0.304 18517 24517 1 20 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.724 -0.234 18517 24518 1 20 . 1 1 221 221 ILE CA C 289 63.580 63.580 64.462 -0.882 18517 24519 1 20 . 1 1 221 221 ILE CB C 289 38.280 38.280 37.815 0.466 18517 24520 1 20 . 1 1 222 222 GLY CA C 290 45.740 45.740 45.776 -0.036 18517 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 203 2.461 0.578 2.398 18517 2 1 1 "Average Difference" HA 222 0.335 0.014 0.336 18517 3 1 1 "Average Difference" C 212 1.063 -0.109 1.060 18517 4 1 1 "Average Difference" CA 217 1.177 -0.340 1.130 18517 5 1 1 "Average Difference" CB 199 1.239 -0.567 1.104 18517 6 1 1 "Average Difference" HN 203 0.573 0.109 0.564 18517 7 1 2 "Average Difference" N 203 2.415 0.732 2.307 18517 8 1 2 "Average Difference" HA 222 0.329 0.007 0.330 18517 9 1 2 "Average Difference" C 212 1.066 -0.050 1.067 18517 10 1 2 "Average Difference" CA 217 1.193 -0.323 1.151 18517 11 1 2 "Average Difference" CB 199 1.199 -0.584 1.050 18517 12 1 2 "Average Difference" HN 203 0.562 0.107 0.553 18517 13 1 3 "Average Difference" N 203 2.470 0.674 2.382 18517 14 1 3 "Average Difference" HA 222 0.334 0.005 0.335 18517 15 1 3 "Average Difference" C 212 1.045 -0.100 1.043 18517 16 1 3 "Average Difference" CA 217 1.195 -0.319 1.154 18517 17 1 3 "Average Difference" CB 199 1.235 -0.546 1.111 18517 18 1 3 "Average Difference" HN 203 0.537 0.089 0.531 18517 19 1 4 "Average Difference" N 203 2.653 0.821 2.529 18517 20 1 4 "Average Difference" HA 222 0.332 0.025 0.332 18517 21 1 4 "Average Difference" C 212 1.094 -0.087 1.093 18517 22 1 4 "Average Difference" CA 217 1.181 -0.330 1.136 18517 23 1 4 "Average Difference" CB 199 1.226 -0.571 1.088 18517 24 1 4 "Average Difference" HN 203 0.585 0.138 0.570 18517 25 1 5 "Average Difference" N 203 2.483 0.679 2.394 18517 26 1 5 "Average Difference" HA 222 0.346 0.015 0.346 18517 27 1 5 "Average Difference" C 212 1.064 -0.082 1.063 18517 28 1 5 "Average Difference" CA 217 1.196 -0.362 1.142 18517 29 1 5 "Average Difference" CB 199 1.221 -0.595 1.070 18517 30 1 5 "Average Difference" HN 203 0.573 0.084 0.568 18517 31 1 6 "Average Difference" N 203 2.569 0.640 2.494 18517 32 1 6 "Average Difference" HA 222 0.326 0.011 0.327 18517 33 1 6 "Average Difference" C 212 1.049 -0.070 1.049 18517 34 1 6 "Average Difference" CA 217 1.178 -0.285 1.145 18517 35 1 6 "Average Difference" CB 199 1.210 -0.548 1.081 18517 36 1 6 "Average Difference" HN 203 0.580 0.091 0.574 18517 37 1 7 "Average Difference" N 203 2.528 0.505 2.483 18517 38 1 7 "Average Difference" HA 222 0.352 0.015 0.353 18517 39 1 7 "Average Difference" C 212 1.065 -0.088 1.064 18517 40 1 7 "Average Difference" CA 217 1.223 -0.331 1.180 18517 41 1 7 "Average Difference" CB 199 1.224 -0.539 1.101 18517 42 1 7 "Average Difference" HN 203 0.566 0.099 0.558 18517 43 1 8 "Average Difference" N 203 2.428 0.677 2.337 18517 44 1 8 "Average Difference" HA 222 0.342 0.018 0.342 18517 45 1 8 "Average Difference" C 212 1.050 -0.067 1.051 18517 46 1 8 "Average Difference" CA 217 1.240 -0.333 1.197 18517 47 1 8 "Average Difference" CB 199 1.288 -0.591 1.148 18517 48 1 8 "Average Difference" HN 203 0.596 0.099 0.589 18517 49 1 9 "Average Difference" N 203 2.431 0.586 2.365 18517 50 1 9 "Average Difference" HA 222 0.330 0.004 0.331 18517 51 1 9 "Average Difference" C 212 1.068 -0.059 1.069 18517 52 1 9 "Average Difference" CA 217 1.188 -0.275 1.158 18517 53 1 9 "Average Difference" CB 199 1.244 -0.590 1.098 18517 54 1 9 "Average Difference" HN 203 0.571 0.115 0.560 18517 55 1 10 "Average Difference" N 203 2.340 0.593 2.269 18517 56 1 10 "Average Difference" HA 222 0.352 -0.001 0.353 18517 57 1 10 "Average Difference" C 212 1.076 -0.070 1.076 18517 58 1 10 "Average Difference" CA 217 1.167 -0.311 1.128 18517 59 1 10 "Average Difference" CB 199 1.240 -0.592 1.092 18517 60 1 10 "Average Difference" HN 203 0.605 0.094 0.599 18517 61 1 11 "Average Difference" N 203 2.514 0.610 2.445 18517 62 1 11 "Average Difference" HA 222 0.348 0.011 0.348 18517 63 1 11 "Average Difference" C 212 1.081 -0.109 1.078 18517 64 1 11 "Average Difference" CA 217 1.229 -0.357 1.179 18517 65 1 11 "Average Difference" CB 199 1.229 -0.585 1.083 18517 66 1 11 "Average Difference" HN 203 0.563 0.101 0.555 18517 67 1 12 "Average Difference" N 203 2.441 0.667 2.354 18517 68 1 12 "Average Difference" HA 222 0.336 -0.003 0.337 18517 69 1 12 "Average Difference" C 212 1.068 -0.054 1.069 18517 70 1 12 "Average Difference" CA 217 1.193 -0.362 1.139 18517 71 1 12 "Average Difference" CB 199 1.231 -0.600 1.078 18517 72 1 12 "Average Difference" HN 203 0.584 0.081 0.580 18517 73 1 13 "Average Difference" N 203 2.525 0.558 2.469 18517 74 1 13 "Average Difference" HA 222 0.323 0.011 0.323 18517 75 1 13 "Average Difference" C 212 1.090 -0.088 1.089 18517 76 1 13 "Average Difference" CA 217 1.216 -0.334 1.172 18517 77 1 13 "Average Difference" CB 199 1.235 -0.511 1.127 18517 78 1 13 "Average Difference" HN 203 0.587 0.095 0.580 18517 79 1 14 "Average Difference" N 203 2.459 0.743 2.350 18517 80 1 14 "Average Difference" HA 222 0.318 0.021 0.318 18517 81 1 14 "Average Difference" C 212 1.065 -0.054 1.066 18517 82 1 14 "Average Difference" CA 217 1.149 -0.342 1.099 18517 83 1 14 "Average Difference" CB 199 1.225 -0.546 1.099 18517 84 1 14 "Average Difference" HN 203 0.600 0.131 0.587 18517 85 1 15 "Average Difference" N 203 2.532 0.672 2.447 18517 86 1 15 "Average Difference" HA 222 0.334 0.021 0.334 18517 87 1 15 "Average Difference" C 212 1.075 -0.068 1.076 18517 88 1 15 "Average Difference" CA 217 1.214 -0.324 1.172 18517 89 1 15 "Average Difference" CB 199 1.251 -0.586 1.108 18517 90 1 15 "Average Difference" HN 203 0.585 0.117 0.574 18517 91 1 16 "Average Difference" N 203 2.565 0.624 2.494 18517 92 1 16 "Average Difference" HA 222 0.342 0.026 0.342 18517 93 1 16 "Average Difference" C 212 1.090 -0.096 1.088 18517 94 1 16 "Average Difference" CA 217 1.238 -0.335 1.195 18517 95 1 16 "Average Difference" CB 199 1.252 -0.575 1.115 18517 96 1 16 "Average Difference" HN 203 0.578 0.099 0.571 18517 97 1 17 "Average Difference" N 203 2.631 0.772 2.521 18517 98 1 17 "Average Difference" HA 222 0.332 0.018 0.332 18517 99 1 17 "Average Difference" C 212 1.086 -0.048 1.088 18517 100 1 17 "Average Difference" CA 217 1.171 -0.323 1.128 18517 101 1 17 "Average Difference" CB 199 1.197 -0.588 1.045 18517 102 1 17 "Average Difference" HN 203 0.610 0.109 0.602 18517 103 1 18 "Average Difference" N 203 2.619 0.511 2.575 18517 104 1 18 "Average Difference" HA 222 0.308 0.014 0.309 18517 105 1 18 "Average Difference" C 212 1.095 -0.027 1.097 18517 106 1 18 "Average Difference" CA 217 1.141 -0.305 1.102 18517 107 1 18 "Average Difference" CB 199 1.236 -0.542 1.113 18517 108 1 18 "Average Difference" HN 203 0.605 0.097 0.599 18517 109 1 19 "Average Difference" N 203 2.676 0.645 2.604 18517 110 1 19 "Average Difference" HA 222 0.338 0.015 0.338 18517 111 1 19 "Average Difference" C 212 1.049 -0.091 1.047 18517 112 1 19 "Average Difference" CA 217 1.208 -0.348 1.160 18517 113 1 19 "Average Difference" CB 199 1.236 -0.536 1.117 18517 114 1 19 "Average Difference" HN 203 0.572 0.129 0.559 18517 115 1 20 "Average Difference" N 203 2.479 0.647 2.399 18517 116 1 20 "Average Difference" HA 222 0.348 0.012 0.348 18517 117 1 20 "Average Difference" C 212 1.056 -0.084 1.055 18517 118 1 20 "Average Difference" CA 217 1.212 -0.372 1.156 18517 119 1 20 "Average Difference" CB 199 1.245 -0.618 1.083 18517 120 1 20 "Average Difference" HN 203 0.566 0.100 0.559 18517 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Model_type average _Entity_delta_chem_shifts.Entry_ID 18517 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 LYS N N 70 126.600 126.600 124.320 2.280 18517 2 1 . 1 1 2 2 LYS HA H 70 4.360 4.360 4.642 -0.282 18517 3 1 . 1 1 2 2 LYS C C 70 176.000 176.000 174.892 1.108 18517 4 1 . 1 1 2 2 LYS CA C 70 56.450 56.450 55.960 0.490 18517 5 1 . 1 1 2 2 LYS CB C 70 33.850 33.850 33.570 0.280 18517 6 1 . 1 1 2 2 LYS H H 70 8.530 8.530 8.385 0.145 18517 7 1 . 1 1 3 3 THR N N 71 111.030 111.030 115.479 -4.449 18517 8 1 . 1 1 3 3 THR HA H 71 4.400 4.400 4.477 -0.077 18517 9 1 . 1 1 3 3 THR C C 71 175.650 175.650 174.979 0.671 18517 10 1 . 1 1 3 3 THR CA C 71 60.610 60.610 60.603 0.007 18517 11 1 . 1 1 3 3 THR CB C 71 71.520 71.520 70.231 1.289 18517 12 1 . 1 1 3 3 THR H H 71 7.390 7.390 8.118 -0.728 18517 13 1 . 1 1 4 4 LEU N N 72 121.560 121.560 122.692 -1.132 18517 14 1 . 1 1 4 4 LEU C C 72 177.870 177.870 178.276 -0.406 18517 15 1 . 1 1 4 4 LEU CA C 72 58.480 58.480 58.859 -0.379 18517 16 1 . 1 1 4 4 LEU CB C 72 42.180 42.180 41.601 0.579 18517 17 1 . 1 1 4 4 LEU H H 72 8.980 8.980 8.598 0.381 18517 18 1 . 1 1 5 5 ASP N N 73 115.530 115.530 117.668 -2.138 18517 19 1 . 1 1 5 5 ASP HA H 73 4.330 4.330 4.386 -0.056 18517 20 1 . 1 1 5 5 ASP C C 73 179.290 179.290 178.465 0.825 18517 21 1 . 1 1 5 5 ASP CA C 73 57.840 57.840 57.415 0.425 18517 22 1 . 1 1 5 5 ASP CB C 73 40.830 40.830 40.591 0.239 18517 23 1 . 1 1 5 5 ASP H H 73 8.270 8.270 8.605 -0.335 18517 24 1 . 1 1 6 6 VAL N N 74 122.330 122.330 119.963 2.367 18517 25 1 . 1 1 6 6 VAL HA H 74 3.740 3.740 3.707 0.033 18517 26 1 . 1 1 6 6 VAL C C 74 178.970 178.970 177.865 1.105 18517 27 1 . 1 1 6 6 VAL CA C 74 66.360 66.360 65.936 0.424 18517 28 1 . 1 1 6 6 VAL CB C 74 31.950 31.950 31.769 0.181 18517 29 1 . 1 1 6 6 VAL H H 74 7.400 7.400 7.430 -0.030 18517 30 1 . 1 1 7 7 LEU N N 75 121.360 121.360 120.714 0.646 18517 31 1 . 1 1 7 7 LEU HA H 75 4.030 4.030 3.957 0.073 18517 32 1 . 1 1 7 7 LEU C C 75 179.240 179.240 179.213 0.027 18517 33 1 . 1 1 7 7 LEU CA C 75 58.230 58.230 58.357 -0.127 18517 34 1 . 1 1 7 7 LEU CB C 75 42.890 42.890 41.193 1.697 18517 35 1 . 1 1 7 7 LEU H H 75 8.300 8.300 8.583 -0.283 18517 36 1 . 1 1 8 8 ARG N N 76 117.230 117.230 118.855 -1.625 18517 37 1 . 1 1 8 8 ARG HA H 76 3.920 3.920 4.071 -0.151 18517 38 1 . 1 1 8 8 ARG C C 76 178.290 178.290 178.972 -0.682 18517 39 1 . 1 1 8 8 ARG CA C 76 60.770 60.770 59.350 1.420 18517 40 1 . 1 1 8 8 ARG CB C 76 30.210 30.210 29.686 0.524 18517 41 1 . 1 1 8 8 ARG H H 76 8.520 8.520 8.741 -0.221 18517 42 1 . 1 1 9 9 GLY N N 77 104.570 104.570 107.669 -3.099 18517 43 1 . 1 1 9 9 GLY C C 77 176.180 176.180 176.273 -0.093 18517 44 1 . 1 1 9 9 GLY CA C 77 47.170 47.170 46.878 0.292 18517 45 1 . 1 1 9 9 GLY H H 77 7.620 7.620 8.343 -0.723 18517 46 1 . 1 1 10 10 GLU N N 78 120.270 120.270 123.009 -2.739 18517 47 1 . 1 1 10 10 GLU HA H 78 4.270 4.270 4.094 0.176 18517 48 1 . 1 1 10 10 GLU C C 78 179.030 179.030 179.153 -0.123 18517 49 1 . 1 1 10 10 GLU CA C 78 58.870 58.870 59.079 -0.209 18517 50 1 . 1 1 10 10 GLU CB C 78 31.400 31.400 29.399 2.001 18517 51 1 . 1 1 10 10 GLU H H 78 8.100 8.100 8.274 -0.174 18517 52 1 . 1 1 11 11 LEU N N 79 116.000 116.000 120.439 -4.439 18517 53 1 . 1 1 11 11 LEU HA H 79 4.510 4.510 3.988 0.522 18517 54 1 . 1 1 11 11 LEU C C 79 179.630 179.630 179.030 0.600 18517 55 1 . 1 1 11 11 LEU CA C 79 56.690 56.690 58.229 -1.539 18517 56 1 . 1 1 11 11 LEU CB C 79 44.800 44.800 41.543 3.257 18517 57 1 . 1 1 11 11 LEU H H 79 8.230 8.230 8.514 -0.284 18517 58 1 . 1 1 12 12 ARG N N 80 120.020 120.020 119.390 0.630 18517 59 1 . 1 1 12 12 ARG HA H 80 3.750 3.750 3.954 -0.204 18517 60 1 . 1 1 12 12 ARG C C 80 178.490 178.490 178.768 -0.278 18517 61 1 . 1 1 12 12 ARG CA C 80 62.000 62.000 59.620 2.380 18517 62 1 . 1 1 12 12 ARG CB C 80 31.240 31.240 29.798 1.442 18517 63 1 . 1 1 12 12 ARG H H 80 8.210 8.210 8.584 -0.374 18517 64 1 . 1 1 13 13 GLY N N 81 108.090 108.090 107.090 1.000 18517 65 1 . 1 1 13 13 GLY C C 81 173.540 173.540 176.234 -2.694 18517 66 1 . 1 1 13 13 GLY CA C 81 48.000 48.000 46.960 1.040 18517 67 1 . 1 1 13 13 GLY H H 81 8.890 8.890 8.470 0.420 18517 68 1 . 1 1 14 14 GLN C C 82 179.540 179.540 178.500 1.040 18517 69 1 . 1 1 14 14 GLN CA C 82 58.710 58.710 59.028 -0.318 18517 70 1 . 1 1 14 14 GLN CB C 82 29.100 29.100 28.562 0.539 18517 71 1 . 1 1 15 15 ARG N N 83 118.220 118.220 119.404 -1.184 18517 72 1 . 1 1 15 15 ARG HA H 83 3.950 3.950 4.028 -0.078 18517 73 1 . 1 1 15 15 ARG C C 83 177.710 177.710 178.660 -0.950 18517 74 1 . 1 1 15 15 ARG CA C 83 59.900 59.900 59.652 0.248 18517 75 1 . 1 1 15 15 ARG CB C 83 29.650 29.650 29.911 -0.261 18517 76 1 . 1 1 15 15 ARG H H 83 7.320 7.320 8.483 -1.163 18517 77 1 . 1 1 16 16 GLU N N 84 118.810 118.810 120.142 -1.332 18517 78 1 . 1 1 16 16 GLU HA H 84 3.850 3.850 4.127 -0.277 18517 79 1 . 1 1 16 16 GLU C C 84 178.750 178.750 178.854 -0.104 18517 80 1 . 1 1 16 16 GLU CA C 84 61.010 61.010 59.376 1.634 18517 81 1 . 1 1 16 16 GLU CB C 84 29.410 29.410 29.459 -0.049 18517 82 1 . 1 1 16 16 GLU H H 84 8.450 8.450 8.555 -0.105 18517 83 1 . 1 1 17 17 ALA N N 85 122.790 122.790 122.742 0.048 18517 84 1 . 1 1 17 17 ALA HA H 85 4.190 4.190 4.131 0.059 18517 85 1 . 1 1 17 17 ALA C C 85 180.360 180.360 179.637 0.723 18517 86 1 . 1 1 17 17 ALA CA C 85 55.460 55.460 55.136 0.324 18517 87 1 . 1 1 17 17 ALA CB C 85 18.080 18.080 18.347 -0.267 18517 88 1 . 1 1 17 17 ALA H H 85 8.420 8.420 8.252 0.168 18517 89 1 . 1 1 18 18 PHE N N 86 119.400 119.400 119.983 -0.583 18517 90 1 . 1 1 18 18 PHE HA H 86 4.290 4.290 4.262 0.028 18517 91 1 . 1 1 18 18 PHE C C 86 177.560 177.560 177.545 0.015 18517 92 1 . 1 1 18 18 PHE CA C 86 61.640 61.640 61.563 0.077 18517 93 1 . 1 1 18 18 PHE CB C 86 39.640 39.640 39.261 0.379 18517 94 1 . 1 1 18 18 PHE H H 86 7.490 7.490 8.360 -0.870 18517 95 1 . 1 1 19 19 LEU N N 87 117.470 117.470 119.987 -2.517 18517 96 1 . 1 1 19 19 LEU HA H 87 4.070 4.070 4.007 0.063 18517 97 1 . 1 1 19 19 LEU C C 87 178.880 178.880 178.521 0.359 18517 98 1 . 1 1 19 19 LEU CA C 87 57.960 57.960 58.369 -0.409 18517 99 1 . 1 1 19 19 LEU CB C 87 42.100 42.100 41.682 0.418 18517 100 1 . 1 1 19 19 LEU H H 87 8.010 8.010 8.796 -0.786 18517 101 1 . 1 1 20 20 SER N N 88 113.770 113.770 114.961 -1.191 18517 102 1 . 1 1 20 20 SER HA H 88 4.070 4.070 4.109 -0.038 18517 103 1 . 1 1 20 20 SER C C 88 175.680 175.680 176.846 -1.166 18517 104 1 . 1 1 20 20 SER CA C 88 63.070 63.070 62.418 0.652 18517 105 1 . 1 1 20 20 SER H H 88 8.100 8.100 8.400 -0.300 18517 106 1 . 1 1 21 21 GLU N N 89 120.570 120.570 121.754 -1.184 18517 107 1 . 1 1 21 21 GLU HA H 89 3.970 3.970 4.023 -0.053 18517 108 1 . 1 1 21 21 GLU C C 89 178.940 178.940 178.954 -0.014 18517 109 1 . 1 1 21 21 GLU CA C 89 59.260 59.260 59.144 0.116 18517 110 1 . 1 1 21 21 GLU CB C 89 29.330 29.330 29.239 0.091 18517 111 1 . 1 1 21 21 GLU H H 89 7.400 7.400 7.888 -0.488 18517 112 1 . 1 1 22 22 ILE N N 90 119.350 119.350 119.454 -0.104 18517 113 1 . 1 1 22 22 ILE HA H 90 3.690 3.690 3.932 -0.242 18517 114 1 . 1 1 22 22 ILE C C 90 177.230 177.230 178.423 -1.193 18517 115 1 . 1 1 22 22 ILE CA C 90 63.470 63.470 62.938 0.532 18517 116 1 . 1 1 22 22 ILE CB C 90 36.390 36.390 36.707 -0.317 18517 117 1 . 1 1 22 22 ILE H H 90 7.250 7.250 8.082 -0.832 18517 118 1 . 1 1 23 23 ILE N N 91 116.350 116.350 118.950 -2.600 18517 119 1 . 1 1 23 23 ILE HA H 91 3.400 3.400 3.835 -0.435 18517 120 1 . 1 1 23 23 ILE C C 91 176.690 176.690 177.060 -0.370 18517 121 1 . 1 1 23 23 ILE CA C 91 65.730 65.730 63.111 2.619 18517 122 1 . 1 1 23 23 ILE CB C 91 38.770 38.770 38.254 0.516 18517 123 1 . 1 1 23 23 ILE H H 91 7.860 7.860 8.268 -0.408 18517 124 1 . 1 1 24 24 LYS N N 92 116.000 116.000 118.231 -2.231 18517 125 1 . 1 1 24 24 LYS HA H 92 4.140 4.140 4.196 -0.056 18517 126 1 . 1 1 24 24 LYS C C 92 176.270 176.270 177.031 -0.761 18517 127 1 . 1 1 24 24 LYS CA C 92 57.480 57.480 57.554 -0.074 18517 128 1 . 1 1 24 24 LYS CB C 92 33.300 33.300 32.935 0.365 18517 129 1 . 1 1 24 24 LYS H H 92 7.170 7.170 7.919 -0.749 18517 130 1 . 1 1 25 25 SER N N 93 114.650 114.650 115.117 -0.468 18517 131 1 . 1 1 25 25 SER HA H 93 4.550 4.550 4.399 0.151 18517 132 1 . 1 1 25 25 SER C C 93 173.370 173.370 173.236 0.134 18517 133 1 . 1 1 25 25 SER CA C 93 57.240 57.240 59.207 -1.967 18517 134 1 . 1 1 25 25 SER CB C 93 65.650 65.650 64.111 1.539 18517 135 1 . 1 1 25 25 SER H H 93 7.730 7.730 7.834 -0.104 18517 136 1 . 1 1 26 26 ASP N N 94 121.230 121.230 121.858 -0.628 18517 137 1 . 1 1 26 26 ASP HA H 94 4.930 4.930 4.760 0.170 18517 138 1 . 1 1 26 26 ASP C C 94 176.560 176.560 175.602 0.958 18517 139 1 . 1 1 26 26 ASP CA C 94 54.510 54.510 53.835 0.675 18517 140 1 . 1 1 26 26 ASP CB C 94 42.650 42.650 41.728 0.922 18517 141 1 . 1 1 26 26 ASP H H 94 8.280 8.280 8.418 -0.138 18517 142 1 . 1 1 27 27 GLY N N 95 109.310 109.310 108.595 0.715 18517 143 1 . 1 1 27 27 GLY C C 95 171.080 171.080 171.785 -0.705 18517 144 1 . 1 1 27 27 GLY CA C 95 42.770 42.770 43.471 -0.701 18517 145 1 . 1 1 27 27 GLY H H 95 8.160 8.160 7.609 0.551 18517 146 1 . 1 1 29 29 PHE HA H 97 5.140 5.140 4.677 0.463 18517 147 1 . 1 1 29 29 PHE C C 97 175.230 175.230 175.528 -0.298 18517 148 1 . 1 1 29 29 PHE CA C 97 56.490 56.490 56.334 0.156 18517 149 1 . 1 1 29 29 PHE CB C 97 41.620 41.620 41.809 -0.189 18517 150 1 . 1 1 30 30 THR N N 98 112.600 112.600 113.825 -1.225 18517 151 1 . 1 1 30 30 THR HA H 98 4.570 4.570 4.225 0.345 18517 152 1 . 1 1 30 30 THR C C 98 176.690 176.690 174.641 2.049 18517 153 1 . 1 1 30 30 THR CA C 98 60.290 60.290 60.247 0.043 18517 154 1 . 1 1 30 30 THR CB C 98 71.600 71.600 71.015 0.585 18517 155 1 . 1 1 30 30 THR H H 98 8.990 8.990 8.476 0.514 18517 156 1 . 1 1 31 31 ILE N N 99 119.240 119.240 122.820 -3.580 18517 157 1 . 1 1 31 31 ILE HA H 99 3.820 3.820 3.657 0.163 18517 158 1 . 1 1 31 31 ILE C C 99 176.090 176.090 176.560 -0.470 18517 159 1 . 1 1 31 31 ILE CA C 99 60.140 60.140 63.414 -3.274 18517 160 1 . 1 1 31 31 ILE CB C 99 36.950 36.950 37.844 -0.894 18517 161 1 . 1 1 31 31 ILE H H 99 9.230 9.230 8.023 1.207 18517 162 1 . 1 1 32 32 LEU N N 100 119.660 119.660 119.130 0.530 18517 163 1 . 1 1 32 32 LEU HA H 100 4.030 4.030 3.976 0.055 18517 164 1 . 1 1 32 32 LEU C C 100 181.050 181.050 179.016 2.034 18517 165 1 . 1 1 32 32 LEU CA C 100 57.560 57.560 57.956 -0.396 18517 166 1 . 1 1 32 32 LEU CB C 100 40.120 40.120 40.969 -0.849 18517 167 1 . 1 1 32 32 LEU H H 100 7.310 7.310 8.089 -0.779 18517 168 1 . 1 1 33 33 GLN N N 101 121.450 121.450 118.796 2.654 18517 169 1 . 1 1 33 33 GLN HA H 101 4.250 4.250 4.311 -0.061 18517 170 1 . 1 1 33 33 GLN CA C 101 59.700 59.700 58.919 0.781 18517 171 1 . 1 1 33 33 GLN CB C 101 31.790 31.790 28.493 3.297 18517 172 1 . 1 1 33 33 GLN H H 101 7.790 7.790 7.774 0.016 18517 173 1 . 1 1 34 34 LEU C C 102 178.590 178.590 179.026 -0.436 18517 174 1 . 1 1 34 34 LEU CA C 102 58.630 58.630 58.048 0.582 18517 175 1 . 1 1 34 34 LEU CB C 102 41.310 41.310 41.629 -0.319 18517 176 1 . 1 1 35 35 VAL N N 103 118.520 118.520 117.189 1.331 18517 177 1 . 1 1 35 35 VAL HA H 103 3.420 3.420 3.682 -0.262 18517 178 1 . 1 1 35 35 VAL C C 103 177.930 177.930 178.092 -0.162 18517 179 1 . 1 1 35 35 VAL CA C 103 66.040 66.040 66.129 -0.089 18517 180 1 . 1 1 35 35 VAL CB C 103 31.630 31.630 30.591 1.039 18517 181 1 . 1 1 35 35 VAL H H 103 8.670 8.670 8.473 0.197 18517 182 1 . 1 1 36 36 GLY N N 104 109.430 109.430 108.722 0.708 18517 183 1 . 1 1 36 36 GLY C C 104 174.600 174.600 175.585 -0.985 18517 184 1 . 1 1 36 36 GLY CA C 104 48.040 48.040 47.164 0.876 18517 185 1 . 1 1 36 36 GLY H H 104 7.880 7.880 8.165 -0.285 18517 186 1 . 1 1 37 37 TYR N N 105 122.270 122.270 124.102 -1.832 18517 187 1 . 1 1 37 37 TYR HA H 105 3.880 3.880 4.416 -0.536 18517 188 1 . 1 1 37 37 TYR C C 105 176.310 176.310 177.067 -0.757 18517 189 1 . 1 1 37 37 TYR CA C 105 64.100 64.100 60.238 3.862 18517 190 1 . 1 1 37 37 TYR CB C 105 38.370 38.370 38.732 -0.362 18517 191 1 . 1 1 37 37 TYR H H 105 8.170 8.170 8.267 -0.097 18517 192 1 . 1 1 38 38 LEU N N 106 120.100 120.100 121.117 -1.017 18517 193 1 . 1 1 38 38 LEU HA H 106 3.740 3.740 3.797 -0.057 18517 194 1 . 1 1 38 38 LEU C C 106 178.280 178.280 178.464 -0.184 18517 195 1 . 1 1 38 38 LEU CA C 106 58.630 58.630 58.148 0.483 18517 196 1 . 1 1 38 38 LEU CB C 106 42.730 42.730 41.618 1.112 18517 197 1 . 1 1 38 38 LEU H H 106 7.610 7.610 8.363 -0.753 18517 198 1 . 1 1 39 39 ARG N N 107 116.670 116.670 118.608 -1.938 18517 199 1 . 1 1 39 39 ARG HA H 107 3.680 3.680 4.062 -0.382 18517 200 1 . 1 1 39 39 ARG C C 107 179.480 179.480 178.573 0.907 18517 201 1 . 1 1 39 39 ARG CA C 107 59.580 59.580 58.695 0.885 18517 202 1 . 1 1 39 39 ARG CB C 107 31.240 31.240 29.529 1.711 18517 203 1 . 1 1 39 39 ARG H H 107 8.240 8.240 7.898 0.342 18517 204 1 . 1 1 40 40 VAL N N 108 121.970 121.970 119.889 2.081 18517 205 1 . 1 1 40 40 VAL HA H 108 3.400 3.400 3.630 -0.230 18517 206 1 . 1 1 40 40 VAL C C 108 178.440 178.440 178.116 0.324 18517 207 1 . 1 1 40 40 VAL CA C 108 67.950 67.950 66.744 1.206 18517 208 1 . 1 1 40 40 VAL CB C 108 30.440 30.440 31.461 -1.021 18517 209 1 . 1 1 40 40 VAL H H 108 8.200 8.200 7.924 0.276 18517 210 1 . 1 1 41 41 VAL N N 109 108.940 108.940 116.069 -7.129 18517 211 1 . 1 1 41 41 VAL HA H 109 4.240 4.240 3.531 0.709 18517 212 1 . 1 1 41 41 VAL C C 109 175.070 175.070 177.416 -2.346 18517 213 1 . 1 1 41 41 VAL CA C 109 62.590 62.590 65.782 -3.192 18517 214 1 . 1 1 41 41 VAL CB C 109 29.650 29.650 30.567 -0.917 18517 215 1 . 1 1 41 41 VAL H H 109 7.760 7.760 7.962 -0.202 18517 216 1 . 1 1 42 42 ASP N N 110 124.670 124.670 121.153 3.517 18517 217 1 . 1 1 42 42 ASP HA H 110 4.620 4.620 4.287 0.333 18517 218 1 . 1 1 42 42 ASP C C 110 177.310 177.310 178.218 -0.908 18517 219 1 . 1 1 42 42 ASP CA C 110 59.980 59.980 57.965 2.015 18517 220 1 . 1 1 42 42 ASP CB C 110 44.950 44.950 40.741 4.209 18517 221 1 . 1 1 42 42 ASP H H 110 7.360 7.360 8.356 -0.996 18517 222 1 . 1 1 43 43 THR N N 111 102.340 102.340 113.232 -10.892 18517 223 1 . 1 1 43 43 THR HA H 111 5.100 5.100 4.069 1.031 18517 224 1 . 1 1 43 43 THR C C 111 174.940 174.940 176.478 -1.538 18517 225 1 . 1 1 43 43 THR CA C 111 60.650 60.650 65.601 -4.951 18517 226 1 . 1 1 43 43 THR CB C 111 69.610 69.610 68.581 1.029 18517 227 1 . 1 1 43 43 THR H H 111 6.380 6.380 7.917 -1.537 18517 228 1 . 1 1 44 44 ASP N N 112 119.750 119.750 123.060 -3.310 18517 229 1 . 1 1 44 44 ASP HA H 112 3.860 3.860 4.368 -0.508 18517 230 1 . 1 1 44 44 ASP C C 112 178.850 178.850 178.109 0.741 18517 231 1 . 1 1 44 44 ASP CA C 112 58.230 58.230 57.858 0.372 18517 232 1 . 1 1 44 44 ASP CB C 112 39.400 39.400 40.650 -1.250 18517 233 1 . 1 1 44 44 ASP H H 112 9.050 9.050 8.309 0.741 18517 234 1 . 1 1 45 45 LEU N N 113 123.910 123.910 121.384 2.526 18517 235 1 . 1 1 45 45 LEU HA H 113 3.810 3.810 3.921 -0.111 18517 236 1 . 1 1 45 45 LEU C C 113 182.040 182.040 178.456 3.584 18517 237 1 . 1 1 45 45 LEU CA C 113 57.320 57.320 57.996 -0.676 18517 238 1 . 1 1 45 45 LEU CB C 113 40.750 40.750 41.724 -0.975 18517 239 1 . 1 1 45 45 LEU H H 113 9.710 9.710 7.836 1.874 18517 240 1 . 1 1 46 46 LEU N N 114 117.640 117.640 118.276 -0.636 18517 241 1 . 1 1 46 46 LEU HA H 114 4.110 4.110 4.117 -0.007 18517 242 1 . 1 1 46 46 LEU C C 114 179.540 179.540 178.663 0.877 18517 243 1 . 1 1 46 46 LEU CA C 114 57.560 57.560 57.594 -0.034 18517 244 1 . 1 1 46 46 LEU CB C 114 41.470 41.470 41.716 -0.246 18517 245 1 . 1 1 46 46 LEU H H 114 8.270 8.270 7.759 0.511 18517 246 1 . 1 1 47 47 LEU N N 115 116.520 116.520 115.634 0.886 18517 247 1 . 1 1 47 47 LEU HA H 115 4.140 4.140 4.417 -0.277 18517 248 1 . 1 1 47 47 LEU C C 115 173.850 173.850 176.312 -2.462 18517 249 1 . 1 1 47 47 LEU CA C 115 55.420 55.420 54.359 1.061 18517 250 1 . 1 1 47 47 LEU CB C 115 44.720 44.720 41.434 3.286 18517 251 1 . 1 1 47 47 LEU H H 115 8.160 8.160 8.018 0.142 18517 252 1 . 1 1 48 48 LYS N N 116 114.710 114.710 116.898 -2.188 18517 253 1 . 1 1 48 48 LYS HA H 116 3.810 3.810 4.024 -0.214 18517 254 1 . 1 1 48 48 LYS C C 116 176.510 176.510 175.901 0.609 18517 255 1 . 1 1 48 48 LYS CA C 116 57.200 57.200 56.874 0.326 18517 256 1 . 1 1 48 48 LYS CB C 116 29.020 29.020 29.530 -0.510 18517 257 1 . 1 1 48 48 LYS H H 116 7.580 7.580 7.820 -0.240 18517 258 1 . 1 1 49 49 VAL N N 117 119.050 119.050 118.360 0.690 18517 259 1 . 1 1 49 49 VAL HA H 117 3.610 3.610 4.097 -0.487 18517 260 1 . 1 1 49 49 VAL C C 117 175.860 175.860 175.998 -0.138 18517 261 1 . 1 1 49 49 VAL CA C 117 63.510 63.510 61.278 2.232 18517 262 1 . 1 1 49 49 VAL CB C 117 32.350 32.350 32.835 -0.485 18517 263 1 . 1 1 49 49 VAL H H 117 7.980 7.980 8.003 -0.023 18517 264 1 . 1 1 50 50 ASP N N 118 126.900 126.900 122.125 4.776 18517 265 1 . 1 1 50 50 ASP HA H 118 4.250 4.250 4.480 -0.230 18517 266 1 . 1 1 50 50 ASP C C 118 177.700 177.700 177.124 0.576 18517 267 1 . 1 1 50 50 ASP CA C 118 56.050 56.050 55.410 0.640 18517 268 1 . 1 1 50 50 ASP CB C 118 42.580 42.580 41.213 1.367 18517 269 1 . 1 1 50 50 ASP H H 118 8.930 8.930 8.588 0.342 18517 270 1 . 1 1 51 51 SER N N 119 124.790 124.790 120.993 3.797 18517 271 1 . 1 1 51 51 SER HA H 119 4.070 4.070 4.227 -0.157 18517 272 1 . 1 1 51 51 SER C C 119 177.220 177.220 176.179 1.041 18517 273 1 . 1 1 51 51 SER CA C 119 61.640 61.640 61.578 0.062 18517 274 1 . 1 1 51 51 SER CB C 119 63.510 63.510 63.245 0.265 18517 275 1 . 1 1 51 51 SER H H 119 8.560 8.560 8.785 -0.225 18517 276 1 . 1 1 52 52 THR N N 120 119.880 119.880 116.920 2.960 18517 277 1 . 1 1 52 52 THR HA H 120 4.190 4.190 4.175 0.015 18517 278 1 . 1 1 52 52 THR C C 120 177.120 177.120 176.302 0.818 18517 279 1 . 1 1 52 52 THR CA C 120 66.280 66.280 65.804 0.475 18517 280 1 . 1 1 52 52 THR CB C 120 68.420 68.420 68.512 -0.092 18517 281 1 . 1 1 52 52 THR H H 120 8.310 8.310 8.191 0.119 18517 282 1 . 1 1 53 53 LYS N N 121 122.270 122.270 122.722 -0.452 18517 283 1 . 1 1 53 53 LYS HA H 121 4.120 4.120 4.168 -0.048 18517 284 1 . 1 1 53 53 LYS C C 121 178.970 178.970 178.785 0.185 18517 285 1 . 1 1 53 53 LYS CA C 121 59.580 59.580 59.208 0.372 18517 286 1 . 1 1 53 53 LYS CB C 121 34.250 34.250 32.030 2.220 18517 287 1 . 1 1 53 53 LYS H H 121 7.700 7.700 8.202 -0.502 18517 288 1 . 1 1 54 54 VAL N N 122 120.070 120.070 119.257 0.813 18517 289 1 . 1 1 54 54 VAL HA H 122 3.430 3.430 3.926 -0.496 18517 290 1 . 1 1 54 54 VAL C C 122 179.860 179.860 177.694 2.166 18517 291 1 . 1 1 54 54 VAL CA C 122 68.580 68.580 65.650 2.930 18517 292 1 . 1 1 54 54 VAL CB C 122 32.820 32.820 31.611 1.209 18517 293 1 . 1 1 54 54 VAL H H 122 7.890 7.890 8.178 -0.288 18517 294 1 . 1 1 55 55 ASP N N 123 122.270 122.270 120.689 1.581 18517 295 1 . 1 1 55 55 ASP HA H 123 4.470 4.470 4.344 0.126 18517 296 1 . 1 1 55 55 ASP C C 123 178.630 178.630 178.397 0.233 18517 297 1 . 1 1 55 55 ASP CA C 123 57.800 57.800 57.919 -0.119 18517 298 1 . 1 1 55 55 ASP CB C 123 42.020 42.020 40.971 1.049 18517 299 1 . 1 1 55 55 ASP H H 123 8.270 8.270 8.107 0.163 18517 300 1 . 1 1 56 56 GLU N N 124 119.600 119.600 119.336 0.264 18517 301 1 . 1 1 56 56 GLU HA H 124 3.970 3.970 4.047 -0.077 18517 302 1 . 1 1 56 56 GLU C C 124 179.920 179.920 179.043 0.877 18517 303 1 . 1 1 56 56 GLU CA C 124 60.060 60.060 59.152 0.908 18517 304 1 . 1 1 56 56 GLU CB C 124 29.970 29.970 29.484 0.486 18517 305 1 . 1 1 56 56 GLU H H 124 8.610 8.610 8.315 0.295 18517 306 1 . 1 1 57 57 ALA N N 125 120.070 120.070 121.868 -1.798 18517 307 1 . 1 1 57 57 ALA HA H 125 3.830 3.830 4.096 -0.266 18517 308 1 . 1 1 57 57 ALA C C 125 178.760 178.760 179.561 -0.801 18517 309 1 . 1 1 57 57 ALA CA C 125 55.380 55.380 54.944 0.436 18517 310 1 . 1 1 57 57 ALA CB C 125 20.140 20.140 18.451 1.689 18517 311 1 . 1 1 57 57 ALA H H 125 8.420 8.420 8.446 -0.026 18517 312 1 . 1 1 58 58 GLY N N 126 106.740 106.740 106.326 0.414 18517 313 1 . 1 1 58 58 GLY C C 126 175.740 175.740 175.971 -0.231 18517 314 1 . 1 1 58 58 GLY CA C 126 47.290 47.290 46.785 0.505 18517 315 1 . 1 1 58 58 GLY H H 126 8.200 8.200 8.510 -0.310 18517 316 1 . 1 1 59 59 LYS N N 127 120.920 120.920 122.018 -1.098 18517 317 1 . 1 1 59 59 LYS HA H 127 3.930 3.930 4.035 -0.105 18517 318 1 . 1 1 59 59 LYS C C 127 180.320 180.320 178.763 1.557 18517 319 1 . 1 1 59 59 LYS CA C 127 60.210 60.210 59.291 0.919 18517 320 1 . 1 1 59 59 LYS CB C 127 32.980 32.980 32.360 0.620 18517 321 1 . 1 1 59 59 LYS H H 127 8.000 8.000 8.143 -0.143 18517 322 1 . 1 1 60 60 LYS N N 128 118.400 118.400 119.461 -1.061 18517 323 1 . 1 1 60 60 LYS HA H 128 4.170 4.170 4.151 0.019 18517 324 1 . 1 1 60 60 LYS C C 128 180.030 180.030 179.068 0.962 18517 325 1 . 1 1 60 60 LYS CA C 128 58.750 58.750 59.057 -0.307 18517 326 1 . 1 1 60 60 LYS CB C 128 32.270 32.270 32.163 0.107 18517 327 1 . 1 1 60 60 LYS H H 128 7.170 7.170 7.867 -0.697 18517 328 1 . 1 1 61 61 VAL N N 129 121.050 121.050 120.560 0.490 18517 329 1 . 1 1 61 61 VAL HA H 129 3.280 3.280 3.392 -0.112 18517 330 1 . 1 1 61 61 VAL C C 129 177.120 177.120 177.694 -0.574 18517 331 1 . 1 1 61 61 VAL CA C 129 67.350 67.350 67.043 0.307 18517 332 1 . 1 1 61 61 VAL CB C 129 31.630 31.630 31.199 0.431 18517 333 1 . 1 1 61 61 VAL H H 129 7.980 7.980 8.075 -0.095 18517 334 1 . 1 1 62 62 LYS N N 130 120.040 120.040 119.928 0.112 18517 335 1 . 1 1 62 62 LYS HA H 130 3.700 3.700 3.941 -0.241 18517 336 1 . 1 1 62 62 LYS C C 130 178.550 178.550 178.753 -0.203 18517 337 1 . 1 1 62 62 LYS CA C 130 60.330 60.330 59.836 0.494 18517 338 1 . 1 1 62 62 LYS CB C 130 33.770 33.770 32.311 1.459 18517 339 1 . 1 1 62 62 LYS H H 130 8.910 8.910 8.484 0.426 18517 340 1 . 1 1 63 63 ALA N N 131 119.570 119.570 122.561 -2.991 18517 341 1 . 1 1 63 63 ALA HA H 131 4.220 4.220 4.052 0.168 18517 342 1 . 1 1 63 63 ALA C C 131 180.520 180.520 179.346 1.174 18517 343 1 . 1 1 63 63 ALA CA C 131 55.220 55.220 55.170 0.050 18517 344 1 . 1 1 63 63 ALA CB C 131 18.470 18.470 18.095 0.375 18517 345 1 . 1 1 63 63 ALA H H 131 7.920 7.920 8.189 -0.269 18517 346 1 . 1 1 64 64 TYR N N 132 120.510 120.510 120.437 0.073 18517 347 1 . 1 1 64 64 TYR HA H 132 4.460 4.460 4.176 0.284 18517 348 1 . 1 1 64 64 TYR C C 132 176.510 176.510 177.807 -1.297 18517 349 1 . 1 1 64 64 TYR CA C 132 61.640 61.640 61.743 -0.103 18517 350 1 . 1 1 64 64 TYR CB C 132 38.690 38.690 38.661 0.029 18517 351 1 . 1 1 64 64 TYR H H 132 7.930 7.930 8.129 -0.199 18517 352 1 . 1 1 65 65 LEU N N 133 117.290 117.290 119.358 -2.068 18517 353 1 . 1 1 65 65 LEU HA H 133 3.840 3.840 3.642 0.198 18517 354 1 . 1 1 65 65 LEU C C 133 178.610 178.610 179.025 -0.415 18517 355 1 . 1 1 65 65 LEU CA C 133 57.720 57.720 58.066 -0.346 18517 356 1 . 1 1 65 65 LEU CB C 133 40.430 40.430 41.580 -1.150 18517 357 1 . 1 1 65 65 LEU H H 133 8.240 8.240 8.573 -0.333 18517 358 1 . 1 1 66 66 GLU N N 134 119.140 119.140 118.459 0.680 18517 359 1 . 1 1 66 66 GLU HA H 134 3.860 3.860 4.162 -0.302 18517 360 1 . 1 1 66 66 GLU C C 134 180.200 180.200 178.891 1.309 18517 361 1 . 1 1 66 66 GLU CA C 134 59.940 59.940 58.800 1.140 18517 362 1 . 1 1 66 66 GLU CB C 134 29.810 29.810 29.406 0.404 18517 363 1 . 1 1 66 66 GLU H H 134 8.370 8.370 8.588 -0.218 18517 364 1 . 1 1 67 67 LYS N N 135 121.390 121.390 120.130 1.260 18517 365 1 . 1 1 67 67 LYS HA H 135 4.000 4.000 4.076 -0.076 18517 366 1 . 1 1 67 67 LYS C C 135 179.080 179.080 178.557 0.523 18517 367 1 . 1 1 67 67 LYS CA C 135 59.620 59.620 58.886 0.734 18517 368 1 . 1 1 67 67 LYS CB C 135 32.270 32.270 32.478 -0.208 18517 369 1 . 1 1 67 67 LYS H H 135 7.820 7.820 7.738 0.082 18517 370 1 . 1 1 68 68 ILE N N 136 110.310 110.310 112.078 -1.768 18517 371 1 . 1 1 68 68 ILE HA H 136 4.300 4.300 4.049 0.251 18517 372 1 . 1 1 68 68 ILE C C 136 175.520 175.520 176.502 -0.981 18517 373 1 . 1 1 68 68 ILE CA C 136 62.430 62.430 61.988 0.442 18517 374 1 . 1 1 68 68 ILE CB C 136 37.980 37.980 38.658 -0.678 18517 375 1 . 1 1 68 68 ILE H H 136 7.380 7.380 7.591 -0.211 18517 376 1 . 1 1 69 69 GLY N N 137 106.680 106.680 107.881 -1.201 18517 377 1 . 1 1 69 69 GLY C C 137 174.160 174.160 173.616 0.544 18517 378 1 . 1 1 69 69 GLY CA C 137 45.470 45.470 44.512 0.958 18517 379 1 . 1 1 69 69 GLY H H 137 7.470 7.470 7.854 -0.384 18517 380 1 . 1 1 70 70 ILE N N 138 124.310 124.310 121.511 2.799 18517 381 1 . 1 1 70 70 ILE HA H 138 4.200 4.200 4.359 -0.159 18517 382 1 . 1 1 70 70 ILE C C 138 174.190 174.190 175.057 -0.867 18517 383 1 . 1 1 70 70 ILE CA C 138 59.380 59.380 59.075 0.305 18517 384 1 . 1 1 70 70 ILE CB C 138 37.340 37.340 38.231 -0.891 18517 385 1 . 1 1 70 70 ILE H H 138 8.530 8.530 8.251 0.279 18517 386 1 . 1 1 71 71 ARG N N 139 125.490 125.490 127.003 -1.513 18517 387 1 . 1 1 71 71 ARG HA H 139 4.620 4.620 4.545 0.075 18517 388 1 . 1 1 71 71 ARG C C 139 175.750 175.750 175.359 0.391 18517 389 1 . 1 1 71 71 ARG CA C 139 54.660 54.660 54.927 -0.267 18517 390 1 . 1 1 71 71 ARG CB C 139 33.140 33.140 32.039 1.101 18517 391 1 . 1 1 71 71 ARG H H 139 8.240 8.240 8.410 -0.170 18517 392 1 . 1 1 72 72 GLY N N 140 104.750 104.750 108.951 -4.201 18517 393 1 . 1 1 72 72 GLY C C 140 172.920 172.920 172.961 -0.041 18517 394 1 . 1 1 72 72 GLY CA C 140 45.430 45.430 44.648 0.782 18517 395 1 . 1 1 72 72 GLY H H 140 7.900 7.900 8.217 -0.318 18517 396 1 . 1 1 73 73 ASP HA H 141 4.510 4.510 4.575 -0.065 18517 397 1 . 1 1 73 73 ASP C C 141 175.060 175.060 176.270 -1.210 18517 398 1 . 1 1 73 73 ASP CA C 141 56.170 56.170 55.765 0.405 18517 399 1 . 1 1 73 73 ASP CB C 141 40.830 40.830 41.604 -0.774 18517 400 1 . 1 1 74 74 SER N N 142 110.240 110.240 112.444 -2.204 18517 401 1 . 1 1 74 74 SER HA H 142 4.740 4.740 4.708 0.032 18517 402 1 . 1 1 74 74 SER C C 142 175.110 175.110 175.023 0.087 18517 403 1 . 1 1 74 74 SER CA C 142 55.700 55.700 56.627 -0.927 18517 404 1 . 1 1 74 74 SER CB C 142 67.390 67.390 65.236 2.154 18517 405 1 . 1 1 74 74 SER H H 142 7.560 7.560 7.704 -0.144 18517 406 1 . 1 1 75 75 VAL N N 143 122.950 122.950 121.062 1.888 18517 407 1 . 1 1 75 75 VAL HA H 143 3.730 3.730 3.841 -0.111 18517 408 1 . 1 1 75 75 VAL C C 143 176.230 176.230 177.182 -0.952 18517 409 1 . 1 1 75 75 VAL CA C 143 66.640 66.640 65.511 1.129 18517 410 1 . 1 1 75 75 VAL CB C 143 31.240 31.240 31.660 -0.420 18517 411 1 . 1 1 75 75 VAL H H 143 9.470 9.470 8.856 0.614 18517 412 1 . 1 1 76 76 GLU N N 144 121.390 121.390 120.955 0.435 18517 413 1 . 1 1 76 76 GLU HA H 144 3.640 3.640 4.085 -0.445 18517 414 1 . 1 1 76 76 GLU C C 144 176.880 176.880 178.363 -1.483 18517 415 1 . 1 1 76 76 GLU CA C 144 63.310 63.310 59.376 3.934 18517 416 1 . 1 1 76 76 GLU CB C 144 28.070 28.070 28.427 -0.357 18517 417 1 . 1 1 76 76 GLU H H 144 9.640 9.640 8.528 1.112 18517 418 1 . 1 1 77 77 ALA N N 145 118.770 118.770 122.163 -3.393 18517 419 1 . 1 1 77 77 ALA HA H 145 4.260 4.260 4.260 0.000 18517 420 1 . 1 1 77 77 ALA C C 145 180.350 180.350 179.567 0.783 18517 421 1 . 1 1 77 77 ALA CA C 145 54.780 54.780 54.429 0.351 18517 422 1 . 1 1 77 77 ALA CB C 145 19.190 19.190 18.034 1.156 18517 423 1 . 1 1 77 77 ALA H H 145 7.860 7.860 7.905 -0.045 18517 424 1 . 1 1 78 78 ALA N N 146 120.920 120.920 122.708 -1.788 18517 425 1 . 1 1 78 78 ALA HA H 146 4.140 4.140 4.037 0.103 18517 426 1 . 1 1 78 78 ALA C C 146 179.150 179.150 179.274 -0.124 18517 427 1 . 1 1 78 78 ALA CA C 146 55.260 55.260 55.025 0.235 18517 428 1 . 1 1 78 78 ALA CB C 146 18.790 18.790 18.592 0.198 18517 429 1 . 1 1 78 78 ALA H H 146 8.110 8.110 8.240 -0.130 18517 430 1 . 1 1 79 79 LEU N N 147 118.810 118.810 118.170 0.640 18517 431 1 . 1 1 79 79 LEU HA H 147 3.880 3.880 4.032 -0.152 18517 432 1 . 1 1 79 79 LEU C C 147 179.080 179.080 178.651 0.429 18517 433 1 . 1 1 79 79 LEU CA C 147 58.390 58.390 57.951 0.439 18517 434 1 . 1 1 79 79 LEU CB C 147 42.260 42.260 41.055 1.205 18517 435 1 . 1 1 79 79 LEU H H 147 8.360 8.360 8.260 0.100 18517 436 1 . 1 1 80 80 ASP N N 148 121.620 121.620 119.956 1.664 18517 437 1 . 1 1 80 80 ASP HA H 148 4.520 4.520 4.237 0.283 18517 438 1 . 1 1 80 80 ASP C C 148 178.800 178.800 178.160 0.640 18517 439 1 . 1 1 80 80 ASP CA C 148 58.390 58.390 58.043 0.347 18517 440 1 . 1 1 80 80 ASP CB C 148 40.750 40.750 40.833 -0.083 18517 441 1 . 1 1 80 80 ASP H H 148 8.770 8.770 8.417 0.353 18517 442 1 . 1 1 81 81 ASN N N 149 118.630 118.630 118.482 0.148 18517 443 1 . 1 1 81 81 ASN HA H 149 4.570 4.570 4.475 0.095 18517 444 1 . 1 1 81 81 ASN C C 149 177.970 177.970 177.827 0.143 18517 445 1 . 1 1 81 81 ASN CA C 149 56.010 56.010 56.191 -0.181 18517 446 1 . 1 1 81 81 ASN CB C 149 38.610 38.610 38.564 0.046 18517 447 1 . 1 1 81 81 ASN H H 149 7.960 7.960 8.089 -0.129 18517 448 1 . 1 1 82 82 LEU N N 150 120.030 120.030 120.035 -0.005 18517 449 1 . 1 1 82 82 LEU HA H 150 4.060 4.060 3.984 0.076 18517 450 1 . 1 1 82 82 LEU C C 150 177.790 177.790 179.052 -1.262 18517 451 1 . 1 1 82 82 LEU CA C 150 58.870 58.870 58.013 0.857 18517 452 1 . 1 1 82 82 LEU CB C 150 41.860 41.860 41.686 0.174 18517 453 1 . 1 1 82 82 LEU H H 150 8.230 8.230 8.291 -0.061 18517 454 1 . 1 1 83 83 MET N N 151 115.820 115.820 118.726 -2.906 18517 455 1 . 1 1 83 83 MET HA H 151 4.390 4.390 4.066 0.324 18517 456 1 . 1 1 83 83 MET C C 151 179.760 179.760 178.744 1.016 18517 457 1 . 1 1 83 83 MET CA C 151 57.400 57.400 58.421 -1.021 18517 458 1 . 1 1 83 83 MET CB C 151 31.080 31.080 31.900 -0.820 18517 459 1 . 1 1 83 83 MET H H 151 8.800 8.800 8.334 0.466 18517 460 1 . 1 1 84 84 ILE N N 152 120.330 120.330 120.256 0.074 18517 461 1 . 1 1 84 84 ILE HA H 152 3.840 3.840 3.720 0.120 18517 462 1 . 1 1 84 84 ILE C C 152 178.660 178.660 178.289 0.371 18517 463 1 . 1 1 84 84 ILE CA C 152 65.800 65.800 65.082 0.719 18517 464 1 . 1 1 84 84 ILE CB C 152 38.450 38.450 36.904 1.546 18517 465 1 . 1 1 84 84 ILE H H 152 8.540 8.540 8.664 -0.124 18517 466 1 . 1 1 85 85 LYS N N 153 118.930 118.930 119.537 -0.607 18517 467 1 . 1 1 85 85 LYS HA H 153 4.200 4.200 4.122 0.078 18517 468 1 . 1 1 85 85 LYS C C 153 179.650 179.650 179.524 0.126 18517 469 1 . 1 1 85 85 LYS CA C 153 59.980 59.980 58.812 1.168 18517 470 1 . 1 1 85 85 LYS CB C 153 33.540 33.540 32.033 1.507 18517 471 1 . 1 1 85 85 LYS H H 153 7.510 7.510 8.074 -0.564 18517 472 1 . 1 1 86 86 VAL N N 154 119.810 119.810 120.192 -0.382 18517 473 1 . 1 1 86 86 VAL HA H 154 3.630 3.630 3.648 -0.018 18517 474 1 . 1 1 86 86 VAL C C 154 178.350 178.350 178.155 0.195 18517 475 1 . 1 1 86 86 VAL CA C 154 67.230 67.230 66.499 0.731 18517 476 1 . 1 1 86 86 VAL CB C 154 32.740 32.740 31.484 1.256 18517 477 1 . 1 1 86 86 VAL H H 154 8.740 8.740 8.240 0.500 18517 478 1 . 1 1 87 87 TYR N N 155 118.370 118.370 118.551 -0.181 18517 479 1 . 1 1 87 87 TYR HA H 155 4.270 4.270 4.225 0.045 18517 480 1 . 1 1 87 87 TYR C C 155 178.580 178.580 178.283 0.297 18517 481 1 . 1 1 87 87 TYR CA C 155 62.910 62.910 60.832 2.078 18517 482 1 . 1 1 87 87 TYR CB C 155 37.980 37.980 37.194 0.786 18517 483 1 . 1 1 87 87 TYR H H 155 8.520 8.520 8.370 0.150 18517 484 1 . 1 1 88 88 GLU N N 156 119.900 119.900 120.779 -0.879 18517 485 1 . 1 1 88 88 GLU HA H 156 4.180 4.180 4.111 0.069 18517 486 1 . 1 1 88 88 GLU C C 156 179.270 179.270 178.806 0.464 18517 487 1 . 1 1 88 88 GLU CA C 156 59.380 59.380 59.604 -0.224 18517 488 1 . 1 1 88 88 GLU CB C 156 30.210 30.210 29.516 0.694 18517 489 1 . 1 1 88 88 GLU H H 156 8.250 8.250 8.569 -0.319 18517 490 1 . 1 1 89 89 ILE N N 157 119.510 119.510 118.273 1.237 18517 491 1 . 1 1 89 89 ILE HA H 157 4.080 4.080 3.925 0.155 18517 492 1 . 1 1 89 89 ILE C C 157 177.890 177.890 178.279 -0.389 18517 493 1 . 1 1 89 89 ILE CA C 157 63.310 63.310 63.393 -0.083 18517 494 1 . 1 1 89 89 ILE CB C 157 38.210 38.210 37.229 0.981 18517 495 1 . 1 1 89 89 ILE H H 157 7.630 7.630 7.809 -0.179 18517 496 1 . 1 1 90 90 THR N N 158 114.240 114.240 115.021 -0.781 18517 497 1 . 1 1 90 90 THR HA H 158 4.130 4.130 4.097 0.033 18517 498 1 . 1 1 90 90 THR C C 158 175.530 175.530 175.957 -0.427 18517 499 1 . 1 1 90 90 THR CA C 158 64.460 64.460 65.616 -1.156 18517 500 1 . 1 1 90 90 THR CB C 158 69.610 69.610 69.049 0.561 18517 501 1 . 1 1 90 90 THR H H 158 7.770 7.770 8.129 -0.359 18517 502 1 . 1 1 91 91 LYS N N 159 120.280 120.280 118.972 1.308 18517 503 1 . 1 1 91 91 LYS HA H 159 4.310 4.310 4.382 -0.072 18517 504 1 . 1 1 91 91 LYS C C 159 177.420 177.420 177.304 0.117 18517 505 1 . 1 1 91 91 LYS CA C 159 57.400 57.400 56.492 0.908 18517 506 1 . 1 1 91 91 LYS CB C 159 33.220 33.220 33.635 -0.415 18517 507 1 . 1 1 91 91 LYS H H 159 7.890 7.890 8.208 -0.318 18517 508 1 . 1 1 92 92 GLY N N 160 107.910 107.910 108.930 -1.020 18517 509 1 . 1 1 92 92 GLY C C 160 174.430 174.430 174.183 0.247 18517 510 1 . 1 1 92 92 GLY CA C 160 45.980 45.980 45.403 0.577 18517 511 1 . 1 1 92 92 GLY H H 160 7.930 7.930 8.015 -0.085 18517 512 1 . 1 1 93 93 THR N N 161 113.570 113.570 115.720 -2.151 18517 513 1 . 1 1 93 93 THR HA H 161 4.390 4.390 4.493 -0.103 18517 514 1 . 1 1 93 93 THR C C 161 174.790 174.790 173.628 1.162 18517 515 1 . 1 1 93 93 THR CA C 161 61.960 61.960 61.704 0.256 18517 516 1 . 1 1 93 93 THR CB C 161 70.010 70.010 70.365 -0.355 18517 517 1 . 1 1 93 93 THR H H 161 7.970 7.970 7.794 0.176 18517 518 1 . 1 1 94 94 VAL N N 162 121.980 121.980 122.181 -0.201 18517 519 1 . 1 1 94 94 VAL HA H 162 4.120 4.120 4.282 -0.162 18517 520 1 . 1 1 94 94 VAL C C 162 176.300 176.300 175.396 0.904 18517 521 1 . 1 1 94 94 VAL CA C 162 62.830 62.830 61.738 1.092 18517 522 1 . 1 1 94 94 VAL CB C 162 33.060 33.060 32.957 0.103 18517 523 1 . 1 1 94 94 VAL H H 162 8.130 8.130 8.324 -0.194 18517 524 1 . 1 1 95 95 GLU N N 163 124.140 124.140 124.357 -0.217 18517 525 1 . 1 1 95 95 GLU HA H 163 4.310 4.310 4.335 -0.025 18517 526 1 . 1 1 95 95 GLU C C 163 176.870 176.870 175.808 1.062 18517 527 1 . 1 1 95 95 GLU CA C 163 57.080 57.080 56.533 0.547 18517 528 1 . 1 1 95 95 GLU CB C 163 30.440 30.440 30.310 0.130 18517 529 1 . 1 1 95 95 GLU H H 163 8.490 8.490 8.733 -0.243 18517 530 1 . 1 1 96 96 SER N N 164 116.800 116.800 117.372 -0.572 18517 531 1 . 1 1 96 96 SER HA H 164 4.430 4.430 4.558 -0.128 18517 532 1 . 1 1 96 96 SER C C 164 174.940 174.940 173.947 0.993 18517 533 1 . 1 1 96 96 SER CA C 164 59.070 59.070 58.657 0.413 18517 534 1 . 1 1 96 96 SER CB C 164 64.220 64.220 63.641 0.579 18517 535 1 . 1 1 96 96 SER H H 164 8.300 8.300 8.352 -0.052 18517 536 1 . 1 1 97 97 SER C C 165 174.660 174.660 173.698 0.962 18517 537 1 . 1 1 97 97 SER CA C 165 58.870 58.870 58.746 0.124 18517 538 1 . 1 1 97 97 SER CB C 165 64.060 64.060 63.941 0.119 18517 539 1 . 1 1 98 98 ALA N N 166 125.490 125.490 125.233 0.257 18517 540 1 . 1 1 98 98 ALA HA H 166 4.350 4.350 4.419 -0.069 18517 541 1 . 1 1 98 98 ALA C C 166 177.780 177.780 176.965 0.815 18517 542 1 . 1 1 98 98 ALA CA C 166 53.000 53.000 52.364 0.637 18517 543 1 . 1 1 98 98 ALA CB C 166 19.340 19.340 19.280 0.060 18517 544 1 . 1 1 98 98 ALA H H 166 8.180 8.180 8.196 -0.016 18517 545 1 . 1 1 99 99 GLN N N 167 118.690 118.690 121.029 -2.339 18517 546 1 . 1 1 99 99 GLN HA H 167 4.340 4.340 4.264 0.076 18517 547 1 . 1 1 99 99 GLN C C 167 176.680 176.680 176.127 0.553 18517 548 1 . 1 1 99 99 GLN CA C 167 56.250 56.250 56.203 0.047 18517 549 1 . 1 1 99 99 GLN CB C 167 29.650 29.650 29.350 0.300 18517 550 1 . 1 1 99 99 GLN H H 167 8.170 8.170 8.447 -0.277 18517 551 1 . 1 1 100 100 GLY N N 168 109.670 109.670 109.868 -0.198 18517 552 1 . 1 1 100 100 GLY C C 168 174.460 174.460 173.934 0.526 18517 553 1 . 1 1 100 100 GLY CA C 168 45.670 45.670 44.913 0.757 18517 554 1 . 1 1 100 100 GLY H H 168 8.250 8.250 8.257 -0.007 18517 555 1 . 1 1 101 101 THR N N 169 112.660 112.660 115.976 -3.317 18517 556 1 . 1 1 101 101 THR HA H 169 4.360 4.360 4.352 0.008 18517 557 1 . 1 1 101 101 THR C C 169 174.720 174.720 173.787 0.933 18517 558 1 . 1 1 101 101 THR CA C 169 62.080 62.080 61.473 0.607 18517 559 1 . 1 1 101 101 THR CB C 169 69.930 69.930 69.195 0.735 18517 560 1 . 1 1 101 101 THR H H 169 8.070 8.070 8.021 0.049 18517 561 1 . 1 1 102 102 ASP N N 170 123.090 123.090 123.008 0.082 18517 562 1 . 1 1 102 102 ASP HA H 170 4.700 4.700 4.691 0.008 18517 563 1 . 1 1 102 102 ASP C C 170 176.130 176.130 175.242 0.888 18517 564 1 . 1 1 102 102 ASP CA C 170 54.780 54.780 53.537 1.244 18517 565 1 . 1 1 102 102 ASP CB C 170 42.260 42.260 41.713 0.547 18517 566 1 . 1 1 102 102 ASP H H 170 8.170 8.170 8.199 -0.029 18517 567 1 . 1 1 103 103 SER N N 171 117.110 117.110 115.432 1.678 18517 568 1 . 1 1 103 103 SER HA H 171 4.430 4.430 4.523 -0.093 18517 569 1 . 1 1 103 103 SER C C 171 174.770 174.770 174.907 -0.137 18517 570 1 . 1 1 103 103 SER CA C 171 57.960 57.960 57.245 0.715 18517 571 1 . 1 1 103 103 SER CB C 171 64.940 64.940 65.023 -0.083 18517 572 1 . 1 1 103 103 SER H H 171 8.450 8.450 8.105 0.345 18517 573 1 . 1 1 104 104 GLU N N 172 122.970 122.970 122.587 0.383 18517 574 1 . 1 1 104 104 GLU HA H 172 4.030 4.030 3.978 0.052 18517 575 1 . 1 1 104 104 GLU C C 172 178.860 178.860 178.157 0.703 18517 576 1 . 1 1 104 104 GLU CA C 172 59.700 59.700 60.054 -0.354 18517 577 1 . 1 1 104 104 GLU CB C 172 29.650 29.650 29.619 0.031 18517 578 1 . 1 1 104 104 GLU H H 172 8.830 8.830 8.975 -0.145 18517 579 1 . 1 1 105 105 GLU N N 173 119.750 119.750 118.613 1.137 18517 580 1 . 1 1 105 105 GLU HA H 173 3.980 3.980 4.057 -0.077 18517 581 1 . 1 1 105 105 GLU C C 173 178.920 178.920 178.681 0.239 18517 582 1 . 1 1 105 105 GLU CA C 173 60.060 60.060 59.004 1.056 18517 583 1 . 1 1 105 105 GLU CB C 173 29.730 29.730 28.979 0.751 18517 584 1 . 1 1 105 105 GLU H H 173 8.580 8.580 8.544 0.036 18517 585 1 . 1 1 106 106 LEU N N 174 121.860 121.860 120.578 1.282 18517 586 1 . 1 1 106 106 LEU HA H 174 4.180 4.180 4.035 0.145 18517 587 1 . 1 1 106 106 LEU C C 174 178.210 178.210 178.599 -0.389 18517 588 1 . 1 1 106 106 LEU CA C 174 57.880 57.880 57.492 0.388 18517 589 1 . 1 1 106 106 LEU CB C 174 41.150 41.150 41.458 -0.308 18517 590 1 . 1 1 106 106 LEU H H 174 7.920 7.920 7.544 0.376 18517 591 1 . 1 1 107 107 LYS N N 175 118.740 118.740 119.424 -0.684 18517 592 1 . 1 1 107 107 LYS HA H 175 3.780 3.780 3.938 -0.158 18517 593 1 . 1 1 107 107 LYS C C 175 178.700 178.700 179.186 -0.486 18517 594 1 . 1 1 107 107 LYS CA C 175 61.170 61.170 59.908 1.262 18517 595 1 . 1 1 107 107 LYS CB C 175 32.430 32.430 32.036 0.394 18517 596 1 . 1 1 107 107 LYS H H 175 8.340 8.340 8.452 -0.112 18517 597 1 . 1 1 108 108 THR N N 176 113.820 113.820 116.822 -3.002 18517 598 1 . 1 1 108 108 THR HA H 176 3.840 3.840 4.024 -0.184 18517 599 1 . 1 1 108 108 THR C C 176 176.620 176.620 176.405 0.215 18517 600 1 . 1 1 108 108 THR CA C 176 66.910 66.910 66.749 0.161 18517 601 1 . 1 1 108 108 THR CB C 176 69.610 69.610 68.650 0.960 18517 602 1 . 1 1 108 108 THR H H 176 7.950 7.950 8.335 -0.385 18517 603 1 . 1 1 109 109 LEU N N 177 124.380 124.380 122.841 1.539 18517 604 1 . 1 1 109 109 LEU HA H 177 3.830 3.830 4.125 -0.295 18517 605 1 . 1 1 109 109 LEU C C 177 177.790 177.790 177.995 -0.205 18517 606 1 . 1 1 109 109 LEU CA C 177 57.990 57.990 57.862 0.128 18517 607 1 . 1 1 109 109 LEU CB C 177 42.580 42.580 41.433 1.147 18517 608 1 . 1 1 109 109 LEU H H 177 7.480 7.480 7.936 -0.456 18517 609 1 . 1 1 110 110 LEU N N 178 117.230 117.230 119.249 -2.019 18517 610 1 . 1 1 110 110 LEU HA H 178 3.840 3.840 3.823 0.017 18517 611 1 . 1 1 110 110 LEU C C 178 179.540 179.540 179.374 0.166 18517 612 1 . 1 1 110 110 LEU CA C 178 58.390 58.390 57.794 0.596 18517 613 1 . 1 1 110 110 LEU CB C 178 42.340 42.340 41.334 1.007 18517 614 1 . 1 1 110 110 LEU H H 178 8.670 8.670 8.209 0.461 18517 615 1 . 1 1 111 111 LEU N N 179 119.230 119.230 121.277 -2.047 18517 616 1 . 1 1 111 111 LEU HA H 179 4.080 4.080 4.174 -0.094 18517 617 1 . 1 1 111 111 LEU C C 179 179.310 179.310 179.127 0.183 18517 618 1 . 1 1 111 111 LEU CA C 179 58.390 58.390 57.755 0.635 18517 619 1 . 1 1 111 111 LEU CB C 179 42.020 42.020 40.839 1.181 18517 620 1 . 1 1 111 111 LEU H H 179 7.940 7.940 8.492 -0.552 18517 621 1 . 1 1 112 112 LYS N N 180 121.910 121.910 120.553 1.357 18517 622 1 . 1 1 112 112 LYS HA H 180 4.190 4.190 4.104 0.086 18517 623 1 . 1 1 112 112 LYS C C 180 178.740 178.740 179.204 -0.464 18517 624 1 . 1 1 112 112 LYS CA C 180 59.180 59.180 59.412 -0.232 18517 625 1 . 1 1 112 112 LYS CB C 180 31.870 31.870 32.154 -0.284 18517 626 1 . 1 1 112 112 LYS H H 180 7.420 7.420 8.088 -0.668 18517 627 1 . 1 1 113 113 PHE N N 181 118.220 118.220 119.071 -0.851 18517 628 1 . 1 1 113 113 PHE HA H 181 4.750 4.750 4.244 0.506 18517 629 1 . 1 1 113 113 PHE C C 181 178.520 178.520 177.953 0.567 18517 630 1 . 1 1 113 113 PHE CA C 181 57.080 57.080 60.545 -3.465 18517 631 1 . 1 1 113 113 PHE CB C 181 37.980 37.980 38.348 -0.368 18517 632 1 . 1 1 113 113 PHE H H 181 9.000 9.000 8.681 0.319 18517 633 1 . 1 1 114 114 SER N N 182 113.300 113.300 114.932 -1.632 18517 634 1 . 1 1 114 114 SER HA H 182 3.930 3.930 4.107 -0.177 18517 635 1 . 1 1 114 114 SER C C 182 177.080 177.080 176.927 0.153 18517 636 1 . 1 1 114 114 SER CA C 182 62.000 62.000 62.258 -0.258 18517 637 1 . 1 1 114 114 SER CB C 182 63.510 63.510 62.842 0.668 18517 638 1 . 1 1 114 114 SER H H 182 8.620 8.620 8.716 -0.096 18517 639 1 . 1 1 115 115 GLU N N 183 121.540 121.540 121.961 -0.421 18517 640 1 . 1 1 115 115 GLU HA H 183 4.070 4.070 4.049 0.021 18517 641 1 . 1 1 115 115 GLU C C 183 179.860 179.860 178.666 1.194 18517 642 1 . 1 1 115 115 GLU CA C 183 59.780 59.780 59.223 0.557 18517 643 1 . 1 1 115 115 GLU CB C 183 29.890 29.890 29.401 0.489 18517 644 1 . 1 1 115 115 GLU H H 183 8.250 8.250 8.410 -0.160 18517 645 1 . 1 1 116 116 ASP N N 184 121.740 121.740 120.969 0.771 18517 646 1 . 1 1 116 116 ASP HA H 184 4.510 4.510 4.397 0.113 18517 647 1 . 1 1 116 116 ASP C C 184 179.570 179.570 178.363 1.207 18517 648 1 . 1 1 116 116 ASP CA C 184 57.560 57.560 57.506 0.054 18517 649 1 . 1 1 116 116 ASP CB C 184 40.990 40.990 40.977 0.013 18517 650 1 . 1 1 116 116 ASP H H 184 8.840 8.840 8.438 0.402 18517 651 1 . 1 1 117 117 LEU N N 185 121.420 121.420 121.194 0.226 18517 652 1 . 1 1 117 117 LEU HA H 185 4.130 4.130 4.013 0.117 18517 653 1 . 1 1 117 117 LEU C C 185 178.840 178.840 178.490 0.350 18517 654 1 . 1 1 117 117 LEU CA C 185 58.230 58.230 58.122 0.108 18517 655 1 . 1 1 117 117 LEU CB C 185 42.650 42.650 41.864 0.786 18517 656 1 . 1 1 117 117 LEU H H 185 8.350 8.350 8.264 0.086 18517 657 1 . 1 1 118 118 LYS N N 186 119.640 119.640 118.949 0.691 18517 658 1 . 1 1 118 118 LYS HA H 186 4.120 4.120 3.949 0.171 18517 659 1 . 1 1 118 118 LYS C C 186 178.820 178.820 178.878 -0.058 18517 660 1 . 1 1 118 118 LYS CA C 186 59.740 59.740 59.454 0.286 18517 661 1 . 1 1 118 118 LYS CB C 186 32.510 32.510 32.189 0.321 18517 662 1 . 1 1 118 118 LYS H H 186 8.220 8.220 8.252 -0.032 18517 663 1 . 1 1 119 119 ALA N N 187 120.160 120.160 121.769 -1.609 18517 664 1 . 1 1 119 119 ALA HA H 187 4.160 4.160 4.108 0.052 18517 665 1 . 1 1 119 119 ALA C C 187 180.450 180.450 179.762 0.688 18517 666 1 . 1 1 119 119 ALA CA C 187 55.140 55.140 55.247 -0.107 18517 667 1 . 1 1 119 119 ALA CB C 187 18.470 18.470 18.249 0.221 18517 668 1 . 1 1 119 119 ALA H H 187 8.010 8.010 8.210 -0.199 18517 669 1 . 1 1 120 120 GLU N N 188 117.930 117.930 118.217 -0.287 18517 670 1 . 1 1 120 120 GLU HA H 188 4.180 4.180 3.971 0.209 18517 671 1 . 1 1 120 120 GLU C C 188 178.780 178.780 179.076 -0.296 18517 672 1 . 1 1 120 120 GLU CA C 188 58.830 58.830 59.175 -0.345 18517 673 1 . 1 1 120 120 GLU CB C 188 29.970 29.970 29.281 0.689 18517 674 1 . 1 1 120 120 GLU H H 188 7.640 7.640 8.217 -0.577 18517 675 1 . 1 1 121 121 GLN N N 189 117.230 117.230 119.149 -1.919 18517 676 1 . 1 1 121 121 GLN HA H 189 4.230 4.230 3.931 0.299 18517 677 1 . 1 1 121 121 GLN C C 189 179.190 179.190 178.153 1.037 18517 678 1 . 1 1 121 121 GLN CA C 189 59.740 59.740 58.632 1.108 18517 679 1 . 1 1 121 121 GLN CB C 189 29.650 29.650 28.836 0.814 18517 680 1 . 1 1 121 121 GLN H H 189 8.280 8.280 8.236 0.044 18517 681 1 . 1 1 122 122 GLU N N 190 118.340 118.340 120.253 -1.913 18517 682 1 . 1 1 122 122 GLU HA H 190 4.120 4.120 3.909 0.211 18517 683 1 . 1 1 122 122 GLU C C 190 178.210 178.210 178.932 -0.722 18517 684 1 . 1 1 122 122 GLU CA C 190 58.750 58.750 58.834 -0.084 18517 685 1 . 1 1 122 122 GLU CB C 190 29.970 29.970 29.194 0.776 18517 686 1 . 1 1 122 122 GLU H H 190 8.250 8.250 8.187 0.063 18517 687 1 . 1 1 123 123 LEU N N 191 118.930 118.930 121.519 -2.589 18517 688 1 . 1 1 123 123 LEU HA H 191 4.090 4.090 3.933 0.157 18517 689 1 . 1 1 123 123 LEU C C 191 178.500 178.500 178.760 -0.260 18517 690 1 . 1 1 123 123 LEU CA C 191 57.000 57.000 58.094 -1.094 18517 691 1 . 1 1 123 123 LEU CB C 191 42.500 42.500 41.612 0.888 18517 692 1 . 1 1 123 123 LEU H H 191 7.530 7.530 8.134 -0.604 18517 693 1 . 1 1 124 124 HIS N N 192 115.650 115.650 118.005 -2.355 18517 694 1 . 1 1 124 124 HIS HA H 192 4.720 4.720 4.258 0.462 18517 695 1 . 1 1 124 124 HIS C C 192 176.090 176.090 177.554 -1.464 18517 696 1 . 1 1 124 124 HIS CA C 192 56.690 56.690 59.413 -2.723 18517 697 1 . 1 1 124 124 HIS CB C 192 30.760 30.760 29.967 0.794 18517 698 1 . 1 1 124 124 HIS H H 192 7.450 7.450 8.336 -0.886 18517 699 1 . 1 1 125 125 SER N N 193 115.480 115.480 115.444 0.036 18517 700 1 . 1 1 125 125 SER HA H 193 4.310 4.310 4.031 0.279 18517 701 1 . 1 1 125 125 SER CA C 193 60.180 60.180 61.761 -1.581 18517 702 1 . 1 1 125 125 SER CB C 193 64.060 64.060 62.591 1.469 18517 703 1 . 1 1 125 125 SER H H 193 8.020 8.020 8.211 -0.191 18517 704 1 . 1 1 126 126 GLU C C 194 177.410 177.410 179.146 -1.736 18517 705 1 . 1 1 126 126 GLU CA C 194 57.840 57.840 58.941 -1.102 18517 706 1 . 1 1 126 126 GLU CB C 194 29.890 29.890 29.471 0.418 18517 707 1 . 1 1 127 127 ALA N N 195 122.910 122.910 122.834 0.076 18517 708 1 . 1 1 127 127 ALA HA H 195 4.190 4.190 4.065 0.125 18517 709 1 . 1 1 127 127 ALA C C 195 178.610 178.610 179.285 -0.675 18517 710 1 . 1 1 127 127 ALA CA C 195 53.790 53.790 54.858 -1.067 18517 711 1 . 1 1 127 127 ALA CB C 195 19.260 19.260 18.625 0.635 18517 712 1 . 1 1 127 127 ALA H H 195 8.020 8.020 7.946 0.074 18517 713 1 . 1 1 128 128 LYS N N 196 117.770 117.770 116.211 1.559 18517 714 1 . 1 1 128 128 LYS HA H 196 4.260 4.260 4.353 -0.093 18517 715 1 . 1 1 128 128 LYS C C 196 177.400 177.400 176.424 0.976 18517 716 1 . 1 1 128 128 LYS CA C 196 57.000 57.000 54.705 2.295 18517 717 1 . 1 1 128 128 LYS CB C 196 32.740 32.740 32.950 -0.210 18517 718 1 . 1 1 128 128 LYS H H 196 7.990 7.990 7.923 0.067 18517 719 1 . 1 1 129 129 GLY N N 197 109.010 109.010 108.554 0.456 18517 720 1 . 1 1 129 129 GLY C C 197 175.770 175.770 175.486 0.284 18517 721 1 . 1 1 129 129 GLY CA C 197 46.100 46.100 45.004 1.096 18517 722 1 . 1 1 129 129 GLY H H 197 8.220 8.220 7.606 0.614 18517 723 1 . 1 1 130 130 GLY N N 198 109.150 109.150 110.289 -1.139 18517 724 1 . 1 1 130 130 GLY C C 198 174.760 174.760 175.378 -0.618 18517 725 1 . 1 1 130 130 GLY CA C 198 46.930 46.930 47.088 -0.158 18517 726 1 . 1 1 130 130 GLY H H 198 8.210 8.210 8.683 -0.473 18517 727 1 . 1 1 131 131 GLU N N 199 121.560 121.560 121.530 0.030 18517 728 1 . 1 1 131 131 GLU HA H 199 4.020 4.020 4.034 -0.015 18517 729 1 . 1 1 131 131 GLU C C 199 178.500 178.500 178.486 0.014 18517 730 1 . 1 1 131 131 GLU CA C 199 59.900 59.900 59.099 0.801 18517 731 1 . 1 1 131 131 GLU CB C 199 29.570 29.570 28.664 0.906 18517 732 1 . 1 1 131 131 GLU H H 199 8.510 8.510 8.600 -0.090 18517 733 1 . 1 1 132 132 ALA N N 200 122.390 122.390 122.860 -0.470 18517 734 1 . 1 1 132 132 ALA HA H 200 4.200 4.200 4.168 0.032 18517 735 1 . 1 1 132 132 ALA C C 200 180.360 180.360 179.739 0.621 18517 736 1 . 1 1 132 132 ALA CA C 200 54.780 54.780 54.676 0.104 18517 737 1 . 1 1 132 132 ALA CB C 200 18.390 18.390 18.227 0.163 18517 738 1 . 1 1 132 132 ALA H H 200 8.190 8.190 7.604 0.586 18517 739 1 . 1 1 133 133 LEU N N 201 120.800 120.800 120.541 0.259 18517 740 1 . 1 1 133 133 LEU HA H 201 4.210 4.210 4.109 0.101 18517 741 1 . 1 1 133 133 LEU C C 201 179.270 179.270 178.925 0.345 18517 742 1 . 1 1 133 133 LEU CA C 201 57.680 57.680 57.816 -0.136 18517 743 1 . 1 1 133 133 LEU CB C 201 42.180 42.180 41.659 0.521 18517 744 1 . 1 1 133 133 LEU H H 201 7.720 7.720 8.302 -0.582 18517 745 1 . 1 1 134 134 LEU N N 202 120.680 120.680 120.112 0.568 18517 746 1 . 1 1 134 134 LEU HA H 202 3.980 3.980 3.965 0.015 18517 747 1 . 1 1 134 134 LEU C C 202 179.030 179.030 178.620 0.410 18517 748 1 . 1 1 134 134 LEU CA C 202 58.430 58.430 57.786 0.644 18517 749 1 . 1 1 134 134 LEU CB C 202 41.620 41.620 41.312 0.308 18517 750 1 . 1 1 134 134 LEU H H 202 8.470 8.470 8.627 -0.157 18517 751 1 . 1 1 135 135 SER N N 203 113.290 113.290 114.854 -1.564 18517 752 1 . 1 1 135 135 SER HA H 203 4.180 4.180 4.100 0.080 18517 753 1 . 1 1 135 135 SER C C 203 177.300 177.300 176.803 0.497 18517 754 1 . 1 1 135 135 SER CA C 203 62.080 62.080 62.338 -0.258 18517 755 1 . 1 1 135 135 SER CB C 203 63.030 63.030 62.780 0.250 18517 756 1 . 1 1 135 135 SER H H 203 8.210 8.210 8.368 -0.158 18517 757 1 . 1 1 136 136 SER N N 204 117.500 117.500 118.530 -1.030 18517 758 1 . 1 1 136 136 SER HA H 204 4.050 4.050 4.209 -0.159 18517 759 1 . 1 1 136 136 SER C C 204 177.570 177.570 176.544 1.026 18517 760 1 . 1 1 136 136 SER CA C 204 61.880 61.880 61.527 0.353 18517 761 1 . 1 1 136 136 SER CB C 204 63.510 63.510 62.891 0.619 18517 762 1 . 1 1 136 136 SER H H 204 7.730 7.730 8.144 -0.415 18517 763 1 . 1 1 137 137 MET N N 205 122.500 122.500 122.160 0.340 18517 764 1 . 1 1 137 137 MET HA H 205 4.140 4.140 4.092 0.048 18517 765 1 . 1 1 137 137 MET C C 205 177.680 177.680 178.226 -0.546 18517 766 1 . 1 1 137 137 MET CA C 205 60.140 60.140 59.407 0.733 18517 767 1 . 1 1 137 137 MET CB C 205 33.460 33.460 32.491 0.969 18517 768 1 . 1 1 137 137 MET H H 205 8.170 8.170 8.531 -0.361 18517 769 1 . 1 1 138 138 LYS N N 206 121.410 121.410 119.093 2.317 18517 770 1 . 1 1 138 138 LYS HA H 206 3.750 3.750 3.959 -0.210 18517 771 1 . 1 1 138 138 LYS C C 206 178.780 178.780 179.210 -0.430 18517 772 1 . 1 1 138 138 LYS CA C 206 60.330 60.330 59.872 0.458 18517 773 1 . 1 1 138 138 LYS CB C 206 32.270 32.270 32.335 -0.065 18517 774 1 . 1 1 138 138 LYS H H 206 8.810 8.810 8.368 0.442 18517 775 1 . 1 1 139 139 THR N N 207 116.580 116.580 116.883 -0.303 18517 776 1 . 1 1 139 139 THR HA H 207 4.060 4.060 3.988 0.072 18517 777 1 . 1 1 139 139 THR C C 207 176.730 176.730 177.000 -0.270 18517 778 1 . 1 1 139 139 THR CA C 207 67.150 67.150 66.862 0.288 18517 779 1 . 1 1 139 139 THR CB C 207 69.220 69.220 68.564 0.655 18517 780 1 . 1 1 139 139 THR H H 207 7.930 7.930 8.164 -0.234 18517 781 1 . 1 1 140 140 GLN N N 208 121.390 121.390 120.585 0.805 18517 782 1 . 1 1 140 140 GLN HA H 208 4.060 4.060 4.039 0.021 18517 783 1 . 1 1 140 140 GLN C C 208 178.550 178.550 178.194 0.356 18517 784 1 . 1 1 140 140 GLN CA C 208 59.300 59.300 59.117 0.183 18517 785 1 . 1 1 140 140 GLN CB C 208 28.860 28.860 28.497 0.363 18517 786 1 . 1 1 140 140 GLN H H 208 7.600 7.600 8.381 -0.781 18517 787 1 . 1 1 141 141 HIS N N 209 122.360 122.360 119.358 3.002 18517 788 1 . 1 1 141 141 HIS HA H 209 3.830 3.830 4.288 -0.458 18517 789 1 . 1 1 141 141 HIS C C 209 176.390 176.390 177.262 -0.872 18517 790 1 . 1 1 141 141 HIS CA C 209 61.720 61.720 60.114 1.606 18517 791 1 . 1 1 141 141 HIS CB C 209 29.100 29.100 30.193 -1.093 18517 792 1 . 1 1 141 141 HIS H H 209 8.980 8.980 8.384 0.596 18517 793 1 . 1 1 142 142 ASP N N 210 120.740 120.740 120.349 0.391 18517 794 1 . 1 1 142 142 ASP HA H 210 4.350 4.350 4.375 -0.025 18517 795 1 . 1 1 142 142 ASP C C 210 179.490 179.490 178.239 1.251 18517 796 1 . 1 1 142 142 ASP CA C 210 57.920 57.920 57.910 0.010 18517 797 1 . 1 1 142 142 ASP CB C 210 40.590 40.590 40.884 -0.294 18517 798 1 . 1 1 142 142 ASP H H 210 8.770 8.770 8.460 0.310 18517 799 1 . 1 1 143 143 GLU N N 211 119.010 119.010 120.731 -1.721 18517 800 1 . 1 1 143 143 GLU HA H 211 3.970 3.970 4.020 -0.050 18517 801 1 . 1 1 143 143 GLU C C 211 179.070 179.070 178.950 0.120 18517 802 1 . 1 1 143 143 GLU CA C 211 59.300 59.300 59.327 -0.027 18517 803 1 . 1 1 143 143 GLU CB C 211 29.490 29.490 29.566 -0.076 18517 804 1 . 1 1 143 143 GLU H H 211 7.850 7.850 8.135 -0.285 18517 805 1 . 1 1 144 144 LEU N N 212 122.500 122.500 120.094 2.406 18517 806 1 . 1 1 144 144 LEU HA H 212 4.070 4.070 4.042 0.028 18517 807 1 . 1 1 144 144 LEU C C 212 179.340 179.340 179.353 -0.013 18517 808 1 . 1 1 144 144 LEU CA C 212 58.390 58.390 58.116 0.274 18517 809 1 . 1 1 144 144 LEU CB C 212 42.180 42.180 41.557 0.623 18517 810 1 . 1 1 144 144 LEU H H 212 8.070 8.070 8.176 -0.106 18517 811 1 . 1 1 145 145 LEU N N 213 118.110 118.110 118.477 -0.367 18517 812 1 . 1 1 145 145 LEU HA H 213 4.200 4.200 3.701 0.499 18517 813 1 . 1 1 145 145 LEU C C 213 179.610 179.610 179.030 0.580 18517 814 1 . 1 1 145 145 LEU CA C 213 58.750 58.750 57.894 0.856 18517 815 1 . 1 1 145 145 LEU CB C 213 41.230 41.230 41.206 0.024 18517 816 1 . 1 1 145 145 LEU H H 213 8.370 8.370 8.170 0.200 18517 817 1 . 1 1 146 146 LYS N N 214 117.290 117.290 120.023 -2.733 18517 818 1 . 1 1 146 146 LYS HA H 214 3.830 3.830 3.904 -0.074 18517 819 1 . 1 1 146 146 LYS C C 214 179.900 179.900 178.827 1.073 18517 820 1 . 1 1 146 146 LYS CA C 214 60.330 60.330 59.673 0.657 18517 821 1 . 1 1 146 146 LYS CB C 214 32.350 32.350 32.178 0.172 18517 822 1 . 1 1 146 146 LYS H H 214 7.560 7.560 8.392 -0.832 18517 823 1 . 1 1 147 147 LYS N N 215 120.330 120.330 119.148 1.182 18517 824 1 . 1 1 147 147 LYS HA H 215 4.020 4.020 4.046 -0.026 18517 825 1 . 1 1 147 147 LYS C C 215 180.550 180.550 179.389 1.161 18517 826 1 . 1 1 147 147 LYS CA C 215 60.100 60.100 59.146 0.954 18517 827 1 . 1 1 147 147 LYS CB C 215 32.740 32.740 32.082 0.658 18517 828 1 . 1 1 147 147 LYS H H 215 7.830 7.830 7.971 -0.141 18517 829 1 . 1 1 148 148 PHE N N 216 117.370 117.370 117.867 -0.497 18517 830 1 . 1 1 148 148 PHE HA H 216 4.080 4.080 4.222 -0.142 18517 831 1 . 1 1 148 148 PHE C C 216 178.200 178.200 177.419 0.781 18517 832 1 . 1 1 148 148 PHE CA C 216 62.120 62.120 61.060 1.060 18517 833 1 . 1 1 148 148 PHE CB C 216 39.720 39.720 38.379 1.341 18517 834 1 . 1 1 148 148 PHE H H 216 8.010 8.010 8.420 -0.410 18517 835 1 . 1 1 149 149 ALA N N 217 118.990 118.990 120.561 -1.571 18517 836 1 . 1 1 149 149 ALA HA H 217 4.110 4.110 4.295 -0.185 18517 837 1 . 1 1 149 149 ALA C C 217 177.330 177.330 178.149 -0.819 18517 838 1 . 1 1 149 149 ALA CA C 217 53.750 53.750 53.301 0.449 18517 839 1 . 1 1 149 149 ALA CB C 217 17.600 17.600 18.627 -1.027 18517 840 1 . 1 1 149 149 ALA H H 217 7.720 7.720 7.934 -0.214 18517 841 1 . 1 1 150 150 ALA N N 218 118.690 118.690 120.673 -1.983 18517 842 1 . 1 1 150 150 ALA HA H 218 4.360 4.360 4.347 0.013 18517 843 1 . 1 1 150 150 ALA C C 218 177.930 177.930 177.797 0.133 18517 844 1 . 1 1 150 150 ALA CA C 218 52.090 52.090 52.858 -0.768 18517 845 1 . 1 1 150 150 ALA CB C 218 19.740 19.740 19.583 0.157 18517 846 1 . 1 1 150 150 ALA H H 218 7.280 7.280 7.750 -0.470 18517 847 1 . 1 1 151 151 LEU N N 219 119.980 119.980 120.929 -0.949 18517 848 1 . 1 1 151 151 LEU HA H 219 4.270 4.270 4.422 -0.152 18517 849 1 . 1 1 151 151 LEU C C 219 176.150 176.150 175.144 1.006 18517 850 1 . 1 1 151 151 LEU CA C 219 56.170 56.170 54.935 1.235 18517 851 1 . 1 1 151 151 LEU CB C 219 42.810 42.810 43.556 -0.746 18517 852 1 . 1 1 151 151 LEU H H 219 7.050 7.050 7.677 -0.627 18517 853 1 . 1 1 152 152 THR N N 220 112.070 112.070 116.210 -4.140 18517 854 1 . 1 1 152 152 THR HA H 220 4.700 4.700 4.844 -0.144 18517 855 1 . 1 1 152 152 THR C C 220 173.400 173.400 173.204 0.196 18517 856 1 . 1 1 152 152 THR CA C 220 58.190 58.190 58.340 -0.150 18517 857 1 . 1 1 152 152 THR CB C 220 70.960 70.960 69.451 1.509 18517 858 1 . 1 1 152 152 THR H H 220 8.040 8.040 8.097 -0.057 18517 859 1 . 1 1 153 153 PRO HA H 221 4.710 4.710 4.636 0.074 18517 860 1 . 1 1 153 153 PRO C C 221 176.720 176.720 176.272 0.448 18517 861 1 . 1 1 153 153 PRO CA C 221 62.910 62.910 62.267 0.643 18517 862 1 . 1 1 153 153 PRO CB C 221 34.250 34.250 32.713 1.537 18517 863 1 . 1 1 154 154 THR N N 222 120.460 120.460 117.389 3.071 18517 864 1 . 1 1 154 154 THR HA H 222 4.250 4.250 4.404 -0.154 18517 865 1 . 1 1 154 154 THR C C 222 175.190 175.190 175.002 0.188 18517 866 1 . 1 1 154 154 THR CA C 222 64.650 64.650 62.411 2.239 18517 867 1 . 1 1 154 154 THR CB C 222 70.410 70.410 68.593 1.817 18517 868 1 . 1 1 154 154 THR H H 222 8.530 8.530 8.360 0.171 18517 869 1 . 1 1 155 155 PHE N N 223 122.260 122.260 123.398 -1.138 18517 870 1 . 1 1 155 155 PHE HA H 223 4.990 4.990 4.692 0.298 18517 871 1 . 1 1 155 155 PHE C C 223 172.560 172.560 174.782 -2.222 18517 872 1 . 1 1 155 155 PHE CA C 223 56.770 56.770 57.514 -0.744 18517 873 1 . 1 1 155 155 PHE CB C 223 40.590 40.590 39.256 1.334 18517 874 1 . 1 1 155 155 PHE H H 223 8.950 8.950 7.762 1.188 18517 875 1 . 1 1 156 156 LEU N N 224 123.440 123.440 120.076 3.364 18517 876 1 . 1 1 156 156 LEU HA H 224 4.670 4.670 4.420 0.250 18517 877 1 . 1 1 156 156 LEU C C 224 175.090 175.090 177.001 -1.911 18517 878 1 . 1 1 156 156 LEU CA C 224 54.030 54.030 54.121 -0.091 18517 879 1 . 1 1 156 156 LEU CB C 224 46.300 46.300 42.953 3.347 18517 880 1 . 1 1 156 156 LEU H H 224 7.210 7.210 7.236 -0.026 18517 881 1 . 1 1 157 157 THR N N 225 113.010 113.010 113.636 -0.625 18517 882 1 . 1 1 157 157 THR HA H 225 4.790 4.790 4.580 0.210 18517 883 1 . 1 1 157 157 THR C C 225 176.130 176.130 174.417 1.713 18517 884 1 . 1 1 157 157 THR CA C 225 59.860 59.860 61.066 -1.206 18517 885 1 . 1 1 157 157 THR CB C 225 72.860 72.860 70.283 2.577 18517 886 1 . 1 1 157 157 THR H H 225 9.200 9.200 8.217 0.983 18517 887 1 . 1 1 158 158 SER N N 226 115.350 115.350 118.189 -2.839 18517 888 1 . 1 1 158 158 SER C C 226 177.410 177.410 175.866 1.544 18517 889 1 . 1 1 158 158 SER CA C 226 57.400 57.400 58.028 -0.628 18517 890 1 . 1 1 158 158 SER CB C 226 66.200 66.200 63.952 2.248 18517 891 1 . 1 1 158 158 SER H H 226 8.830 8.830 8.503 0.327 18517 892 1 . 1 1 159 159 GLU N N 227 121.200 121.200 122.092 -0.892 18517 893 1 . 1 1 159 159 GLU HA H 227 4.020 4.020 3.932 0.088 18517 894 1 . 1 1 159 159 GLU C C 227 177.680 177.680 177.367 0.313 18517 895 1 . 1 1 159 159 GLU CA C 227 59.500 59.500 58.826 0.674 18517 896 1 . 1 1 159 159 GLU CB C 227 29.570 29.570 29.433 0.137 18517 897 1 . 1 1 159 159 GLU H H 227 8.320 8.320 8.900 -0.580 18517 898 1 . 1 1 160 160 ASP N N 228 115.350 115.350 117.881 -2.531 18517 899 1 . 1 1 160 160 ASP HA H 228 4.550 4.550 4.403 0.147 18517 900 1 . 1 1 160 160 ASP C C 228 177.640 177.640 177.836 -0.196 18517 901 1 . 1 1 160 160 ASP CA C 228 57.400 57.400 56.797 0.603 18517 902 1 . 1 1 160 160 ASP CB C 228 43.050 43.050 40.634 2.416 18517 903 1 . 1 1 160 160 ASP H H 228 7.570 7.570 8.233 -0.663 18517 904 1 . 1 1 161 161 ILE N N 229 108.150 108.150 114.295 -6.145 18517 905 1 . 1 1 161 161 ILE HA H 229 4.510 4.510 4.332 0.178 18517 906 1 . 1 1 161 161 ILE C C 229 173.130 173.130 177.120 -3.990 18517 907 1 . 1 1 161 161 ILE CA C 229 61.290 61.290 62.366 -1.076 18517 908 1 . 1 1 161 161 ILE CB C 229 39.400 39.400 39.034 0.366 18517 909 1 . 1 1 161 161 ILE H H 229 7.190 7.190 7.613 -0.423 18517 910 1 . 1 1 162 162 SER N N 230 115.290 115.290 117.644 -2.354 18517 911 1 . 1 1 162 162 SER HA H 230 4.760 4.760 4.098 0.662 18517 912 1 . 1 1 162 162 SER C C 230 176.060 176.060 174.448 1.612 18517 913 1 . 1 1 162 162 SER CA C 230 57.920 57.920 57.837 0.082 18517 914 1 . 1 1 162 162 SER CB C 230 66.120 66.120 61.760 4.360 18517 915 1 . 1 1 162 162 SER H H 230 7.460 7.460 8.188 -0.728 18517 916 1 . 1 1 163 163 GLY C C 231 173.260 173.260 173.135 0.125 18517 917 1 . 1 1 163 163 GLY CA C 231 45.550 45.550 44.858 0.692 18517 918 1 . 1 1 164 164 TYR N N 232 115.290 115.290 117.831 -2.541 18517 919 1 . 1 1 164 164 TYR HA H 232 4.700 4.700 4.723 -0.023 18517 920 1 . 1 1 164 164 TYR C C 232 172.820 172.820 173.863 -1.043 18517 921 1 . 1 1 164 164 TYR CA C 232 55.100 55.100 55.142 -0.042 18517 922 1 . 1 1 164 164 TYR CB C 232 39.800 39.800 39.720 0.080 18517 923 1 . 1 1 164 164 TYR H H 232 7.370 7.370 7.288 0.082 18517 924 1 . 1 1 165 165 LEU N N 233 120.980 120.980 122.698 -1.718 18517 925 1 . 1 1 165 165 LEU HA H 233 4.430 4.430 4.505 -0.075 18517 926 1 . 1 1 165 165 LEU C C 233 176.360 176.360 177.503 -1.143 18517 927 1 . 1 1 165 165 LEU CA C 233 55.660 55.660 54.237 1.423 18517 928 1 . 1 1 165 165 LEU CB C 233 40.430 40.430 41.527 -1.097 18517 929 1 . 1 1 165 165 LEU H H 233 8.830 8.830 8.603 0.227 18517 930 1 . 1 1 166 166 THR N N 234 116.170 116.170 114.938 1.232 18517 931 1 . 1 1 166 166 THR HA H 234 4.010 4.010 3.528 0.482 18517 932 1 . 1 1 166 166 THR C C 234 173.070 173.070 173.915 -0.845 18517 933 1 . 1 1 166 166 THR CA C 234 62.910 62.910 63.848 -0.938 18517 934 1 . 1 1 166 166 THR CB C 234 70.170 70.170 69.000 1.170 18517 935 1 . 1 1 166 166 THR H H 234 8.050 8.050 8.191 -0.141 18517 936 1 . 1 1 167 167 VAL N N 235 117.640 117.640 117.225 0.415 18517 937 1 . 1 1 167 167 VAL HA H 235 4.210 4.210 4.295 -0.085 18517 938 1 . 1 1 167 167 VAL C C 235 172.330 172.330 173.756 -1.426 18517 939 1 . 1 1 167 167 VAL CA C 235 58.750 58.750 57.833 0.917 18517 940 1 . 1 1 167 167 VAL CB C 235 35.880 35.880 32.001 3.879 18517 941 1 . 1 1 167 167 VAL H H 235 7.160 7.160 7.439 -0.279 18517 942 1 . 1 1 168 168 PRO HA H 236 4.190 4.190 4.543 -0.353 18517 943 1 . 1 1 168 168 PRO C C 236 173.710 173.710 175.624 -1.914 18517 944 1 . 1 1 168 168 PRO CA C 236 62.830 62.830 61.643 1.188 18517 945 1 . 1 1 168 168 PRO CB C 236 32.270 32.270 33.081 -0.811 18517 946 1 . 1 1 169 169 GLU N N 237 113.540 113.540 118.364 -4.824 18517 947 1 . 1 1 169 169 GLU HA H 237 4.380 4.380 4.066 0.314 18517 948 1 . 1 1 169 169 GLU C C 237 176.690 176.690 178.179 -1.489 18517 949 1 . 1 1 169 169 GLU CA C 237 53.750 53.750 55.032 -1.282 18517 950 1 . 1 1 169 169 GLU CB C 237 33.220 33.220 30.979 2.241 18517 951 1 . 1 1 169 169 GLU H H 237 7.930 7.930 8.292 -0.362 18517 952 1 . 1 1 170 170 TYR N N 238 119.400 119.400 120.877 -1.476 18517 953 1 . 1 1 170 170 TYR HA H 238 4.000 4.000 4.240 -0.239 18517 954 1 . 1 1 170 170 TYR C C 238 177.610 177.610 176.569 1.041 18517 955 1 . 1 1 170 170 TYR CA C 238 62.630 62.630 60.147 2.483 18517 956 1 . 1 1 170 170 TYR CB C 238 37.740 37.740 38.357 -0.617 18517 957 1 . 1 1 170 170 TYR H H 238 8.490 8.490 8.522 -0.032 18517 958 1 . 1 1 171 171 GLY N N 239 104.160 104.160 103.701 0.459 18517 959 1 . 1 1 171 171 GLY C C 239 173.350 173.350 173.080 0.270 18517 960 1 . 1 1 171 171 GLY CA C 239 45.270 45.270 44.593 0.676 18517 961 1 . 1 1 171 171 GLY H H 239 7.960 7.960 8.046 -0.086 18517 962 1 . 1 1 172 172 ALA N N 240 121.860 121.860 123.560 -1.700 18517 963 1 . 1 1 172 172 ALA HA H 240 4.170 4.170 4.817 -0.647 18517 964 1 . 1 1 172 172 ALA C C 240 172.160 172.160 174.687 -2.527 18517 965 1 . 1 1 172 172 ALA CA C 240 50.110 50.110 49.197 0.913 18517 966 1 . 1 1 172 172 ALA CB C 240 20.930 20.930 19.831 1.099 18517 967 1 . 1 1 172 172 ALA H H 240 6.910 6.910 7.822 -0.911 18517 968 1 . 1 1 173 173 PRO HA H 241 4.550 4.550 3.468 1.082 18517 969 1 . 1 1 173 173 PRO C C 241 176.610 176.610 175.193 1.417 18517 970 1 . 1 1 173 173 PRO CA C 241 61.520 61.520 62.355 -0.835 18517 971 1 . 1 1 173 173 PRO CB C 241 33.300 33.300 32.076 1.224 18517 972 1 . 1 1 174 174 MET N N 242 114.000 114.000 120.745 -6.745 18517 973 1 . 1 1 174 174 MET HA H 242 4.390 4.390 4.489 -0.099 18517 974 1 . 1 1 174 174 MET C C 242 173.960 173.960 174.559 -0.599 18517 975 1 . 1 1 174 174 MET CA C 242 54.660 54.660 53.946 0.714 18517 976 1 . 1 1 174 174 MET CB C 242 34.170 34.170 35.474 -1.304 18517 977 1 . 1 1 174 174 MET H H 242 8.040 8.040 7.767 0.273 18517 978 1 . 1 1 175 175 ASN N N 243 119.570 119.570 122.723 -3.153 18517 979 1 . 1 1 175 175 ASN HA H 243 4.940 4.940 4.770 0.170 18517 980 1 . 1 1 175 175 ASN C C 243 174.320 174.320 175.258 -0.938 18517 981 1 . 1 1 175 175 ASN CA C 243 53.080 53.080 52.277 0.803 18517 982 1 . 1 1 175 175 ASN CB C 243 38.850 38.850 38.564 0.286 18517 983 1 . 1 1 175 175 ASN H H 243 7.960 7.960 8.381 -0.421 18517 984 1 . 1 1 176 176 ALA N N 244 132.250 132.250 128.951 3.300 18517 985 1 . 1 1 176 176 ALA C C 244 181.580 181.580 178.576 3.003 18517 986 1 . 1 1 176 176 ALA CA C 244 55.770 55.770 55.314 0.456 18517 987 1 . 1 1 176 176 ALA CB C 244 19.030 19.030 18.756 0.274 18517 988 1 . 1 1 176 176 ALA H H 244 12.110 12.110 8.415 3.695 18517 989 1 . 1 1 177 177 ALA N N 245 125.780 125.780 121.169 4.611 18517 990 1 . 1 1 177 177 ALA HA H 245 3.870 3.870 3.985 -0.115 18517 991 1 . 1 1 177 177 ALA C C 245 180.640 180.640 179.473 1.167 18517 992 1 . 1 1 177 177 ALA CA C 245 55.660 55.660 55.152 0.508 18517 993 1 . 1 1 177 177 ALA CB C 245 17.840 17.840 18.072 -0.232 18517 994 1 . 1 1 177 177 ALA H H 245 10.240 10.240 8.392 1.848 18517 995 1 . 1 1 178 178 LYS N N 246 119.810 119.810 119.164 0.646 18517 996 1 . 1 1 178 178 LYS HA H 246 3.830 3.830 4.073 -0.243 18517 997 1 . 1 1 178 178 LYS C C 246 180.500 180.500 178.321 2.179 18517 998 1 . 1 1 178 178 LYS CA C 246 59.900 59.900 59.089 0.811 18517 999 1 . 1 1 178 178 LYS CB C 246 31.320 31.320 32.321 -1.001 18517 1000 1 . 1 1 178 178 LYS H H 246 8.470 8.470 7.922 0.548 18517 1001 1 . 1 1 179 179 TRP N N 247 121.170 121.170 121.593 -0.423 18517 1002 1 . 1 1 179 179 TRP HA H 247 4.620 4.620 4.354 0.266 18517 1003 1 . 1 1 179 179 TRP C C 247 176.510 176.510 177.927 -1.417 18517 1004 1 . 1 1 179 179 TRP CA C 247 59.820 59.820 59.848 -0.028 18517 1005 1 . 1 1 179 179 TRP CB C 247 29.570 29.570 29.666 -0.096 18517 1006 1 . 1 1 179 179 TRP H H 247 8.330 8.330 8.323 0.007 18517 1007 1 . 1 1 180 180 ALA N N 248 119.130 119.130 120.410 -1.280 18517 1008 1 . 1 1 180 180 ALA HA H 248 4.540 4.540 3.813 0.727 18517 1009 1 . 1 1 180 180 ALA C C 248 182.110 182.110 179.444 2.666 18517 1010 1 . 1 1 180 180 ALA CA C 248 54.190 54.190 55.038 -0.848 18517 1011 1 . 1 1 180 180 ALA CB C 248 18.710 18.710 18.122 0.588 18517 1012 1 . 1 1 180 180 ALA H H 248 7.990 7.990 8.586 -0.596 18517 1013 1 . 1 1 181 181 LYS N N 249 116.000 116.000 119.245 -3.245 18517 1014 1 . 1 1 181 181 LYS HA H 249 3.970 3.970 4.058 -0.088 18517 1015 1 . 1 1 181 181 LYS C C 249 179.380 179.380 178.908 0.472 18517 1016 1 . 1 1 181 181 LYS CA C 249 58.710 58.710 59.400 -0.691 18517 1017 1 . 1 1 181 181 LYS CB C 249 32.510 32.510 32.590 -0.080 18517 1018 1 . 1 1 181 181 LYS H H 249 6.900 6.900 7.825 -0.925 18517 1019 1 . 1 1 182 182 VAL N N 250 122.270 122.270 116.167 6.103 18517 1020 1 . 1 1 182 182 VAL HA H 250 3.340 3.340 3.738 -0.398 18517 1021 1 . 1 1 182 182 VAL C C 250 178.160 178.160 177.797 0.363 18517 1022 1 . 1 1 182 182 VAL CA C 250 66.760 66.760 66.121 0.639 18517 1023 1 . 1 1 182 182 VAL CB C 250 30.840 30.840 31.339 -0.499 18517 1024 1 . 1 1 182 182 VAL H H 250 7.050 7.050 8.092 -1.042 18517 1025 1 . 1 1 183 183 GLU N N 251 120.520 120.520 120.444 0.076 18517 1026 1 . 1 1 183 183 GLU HA H 251 3.180 3.180 3.945 -0.765 18517 1027 1 . 1 1 183 183 GLU C C 251 179.480 179.480 179.002 0.478 18517 1028 1 . 1 1 183 183 GLU CA C 251 60.690 60.690 59.075 1.615 18517 1029 1 . 1 1 183 183 GLU CB C 251 28.070 28.070 28.807 -0.737 18517 1030 1 . 1 1 183 183 GLU H H 251 8.020 8.020 8.651 -0.631 18517 1031 1 . 1 1 184 184 GLY N N 252 102.930 102.930 107.734 -4.804 18517 1032 1 . 1 1 184 184 GLY C C 252 176.920 176.920 176.415 0.505 18517 1033 1 . 1 1 184 184 GLY CA C 252 47.410 47.410 47.160 0.250 18517 1034 1 . 1 1 184 184 GLY H H 252 7.830 7.830 8.100 -0.270 18517 1035 1 . 1 1 185 185 MET N N 253 123.200 123.200 121.731 1.469 18517 1036 1 . 1 1 185 185 MET HA H 253 4.250 4.250 4.084 0.166 18517 1037 1 . 1 1 185 185 MET C C 253 179.370 179.370 178.482 0.888 18517 1038 1 . 1 1 185 185 MET CA C 253 59.300 59.300 59.364 -0.064 18517 1039 1 . 1 1 185 185 MET CB C 253 33.930 33.930 32.546 1.384 18517 1040 1 . 1 1 185 185 MET H H 253 7.890 7.890 7.891 -0.001 18517 1041 1 . 1 1 186 186 ILE N N 254 120.150 120.150 120.014 0.136 18517 1042 1 . 1 1 186 186 ILE HA H 254 3.560 3.560 3.664 -0.104 18517 1043 1 . 1 1 186 186 ILE C C 254 177.250 177.250 178.066 -0.816 18517 1044 1 . 1 1 186 186 ILE CA C 254 66.520 66.520 65.483 1.037 18517 1045 1 . 1 1 186 186 ILE CB C 254 38.290 38.290 37.435 0.855 18517 1046 1 . 1 1 186 186 ILE H H 254 8.260 8.260 8.305 -0.045 18517 1047 1 . 1 1 187 187 HIS N N 255 119.810 119.810 119.361 0.449 18517 1048 1 . 1 1 187 187 HIS HA H 255 4.000 4.000 4.210 -0.210 18517 1049 1 . 1 1 187 187 HIS C C 255 176.460 176.460 177.484 -1.024 18517 1050 1 . 1 1 187 187 HIS CA C 255 60.330 60.330 59.826 0.504 18517 1051 1 . 1 1 187 187 HIS CB C 255 31.630 31.630 29.648 1.982 18517 1052 1 . 1 1 187 187 HIS H H 255 8.900 8.900 8.749 0.151 18517 1053 1 . 1 1 188 188 GLY N N 256 103.160 103.160 106.878 -3.718 18517 1054 1 . 1 1 188 188 GLY C C 256 176.320 176.320 176.018 0.302 18517 1055 1 . 1 1 188 188 GLY CA C 256 46.890 46.890 46.791 0.099 18517 1056 1 . 1 1 188 188 GLY H H 256 8.030 8.030 8.333 -0.303 18517 1057 1 . 1 1 189 189 LYS N N 257 119.510 119.510 121.406 -1.896 18517 1058 1 . 1 1 189 189 LYS HA H 257 4.000 4.000 4.092 -0.092 18517 1059 1 . 1 1 189 189 LYS C C 257 178.660 178.660 179.093 -0.433 18517 1060 1 . 1 1 189 189 LYS CA C 257 56.490 56.490 57.234 -0.744 18517 1061 1 . 1 1 189 189 LYS CB C 257 31.550 31.550 31.885 -0.335 18517 1062 1 . 1 1 189 189 LYS H H 257 7.120 7.120 7.775 -0.655 18517 1063 1 . 1 1 190 190 LEU N N 258 120.570 120.570 120.313 0.257 18517 1064 1 . 1 1 190 190 LEU HA H 258 3.930 3.930 4.011 -0.081 18517 1065 1 . 1 1 190 190 LEU C C 258 177.230 177.230 177.353 -0.123 18517 1066 1 . 1 1 190 190 LEU CA C 258 57.520 57.520 57.215 0.305 18517 1067 1 . 1 1 190 190 LEU CB C 258 42.970 42.970 41.845 1.125 18517 1068 1 . 1 1 190 190 LEU H H 258 8.060 8.060 8.303 -0.243 18517 1069 1 . 1 1 191 191 GLU N N 259 114.590 114.590 115.066 -0.476 18517 1070 1 . 1 1 191 191 GLU HA H 259 4.280 4.280 4.227 0.053 18517 1071 1 . 1 1 191 191 GLU C C 259 176.230 176.230 176.546 -0.315 18517 1072 1 . 1 1 191 191 GLU CA C 259 55.340 55.340 56.113 -0.772 18517 1073 1 . 1 1 191 191 GLU CB C 259 29.330 29.330 29.606 -0.277 18517 1074 1 . 1 1 191 191 GLU H H 259 7.330 7.330 7.799 -0.469 18517 1075 1 . 1 1 192 192 SER N N 260 115.240 115.240 116.208 -0.968 18517 1076 1 . 1 1 192 192 SER HA H 260 4.490 4.490 4.485 0.005 18517 1077 1 . 1 1 192 192 SER C C 260 173.770 173.770 174.634 -0.864 18517 1078 1 . 1 1 192 192 SER CA C 260 58.350 58.350 57.868 0.482 18517 1079 1 . 1 1 192 192 SER CB C 260 65.090 65.090 64.040 1.050 18517 1080 1 . 1 1 192 192 SER H H 260 7.130 7.130 7.570 -0.440 18517 1081 1 . 1 1 193 193 SER C C 261 174.600 174.600 174.507 0.093 18517 1082 1 . 1 1 193 193 SER CA C 261 59.980 59.980 59.249 0.731 18517 1083 1 . 1 1 193 193 SER CB C 261 63.750 63.750 63.228 0.522 18517 1084 1 . 1 1 194 194 GLU N N 262 121.800 121.800 121.251 0.549 18517 1085 1 . 1 1 194 194 GLU HA H 262 4.470 4.470 4.328 0.142 18517 1086 1 . 1 1 194 194 GLU C C 262 174.650 174.650 175.326 -0.676 18517 1087 1 . 1 1 194 194 GLU CA C 262 55.620 55.620 56.134 -0.514 18517 1088 1 . 1 1 194 194 GLU CB C 262 30.210 30.210 30.030 0.180 18517 1089 1 . 1 1 194 194 GLU H H 262 7.840 7.840 8.003 -0.163 18517 1090 1 . 1 1 195 195 VAL N N 263 124.080 124.080 124.425 -0.345 18517 1091 1 . 1 1 195 195 VAL HA H 263 4.250 4.250 4.305 -0.055 18517 1092 1 . 1 1 195 195 VAL C C 263 174.460 174.460 174.414 0.046 18517 1093 1 . 1 1 195 195 VAL CA C 263 59.820 59.820 59.387 0.433 18517 1094 1 . 1 1 195 195 VAL CB C 263 33.620 33.620 32.863 0.757 18517 1095 1 . 1 1 195 195 VAL H H 263 8.020 8.020 8.240 -0.220 18517 1096 1 . 1 1 196 196 PRO HA H 264 4.520 4.520 4.458 0.061 18517 1097 1 . 1 1 198 198 ASN C C 266 176.490 176.490 177.302 -0.812 18517 1098 1 . 1 1 198 198 ASN CA C 266 54.780 54.780 56.026 -1.246 18517 1099 1 . 1 1 198 198 ASN CB C 266 38.060 38.060 37.843 0.217 18517 1100 1 . 1 1 199 199 LEU N N 267 120.680 120.680 120.531 0.149 18517 1101 1 . 1 1 199 199 LEU HA H 267 4.010 4.010 3.886 0.124 18517 1102 1 . 1 1 199 199 LEU C C 267 178.050 178.050 178.253 -0.203 18517 1103 1 . 1 1 199 199 LEU CA C 267 58.830 58.830 58.003 0.827 18517 1104 1 . 1 1 199 199 LEU CB C 267 42.340 42.340 41.459 0.881 18517 1105 1 . 1 1 199 199 LEU H H 267 7.660 7.660 7.925 -0.265 18517 1106 1 . 1 1 200 200 LYS N N 268 116.740 116.740 119.424 -2.684 18517 1107 1 . 1 1 200 200 LYS HA H 268 3.730 3.730 3.924 -0.194 18517 1108 1 . 1 1 200 200 LYS C C 268 178.520 178.520 178.522 -0.002 18517 1109 1 . 1 1 200 200 LYS CA C 268 61.800 61.800 59.179 2.621 18517 1110 1 . 1 1 200 200 LYS CB C 268 32.110 32.110 31.997 0.113 18517 1111 1 . 1 1 200 200 LYS H H 268 8.280 8.280 8.105 0.175 18517 1112 1 . 1 1 201 201 ALA N N 269 121.270 121.270 122.365 -1.095 18517 1113 1 . 1 1 201 201 ALA HA H 269 4.240 4.240 4.075 0.165 18517 1114 1 . 1 1 201 201 ALA C C 269 180.890 180.890 179.700 1.190 18517 1115 1 . 1 1 201 201 ALA CA C 269 55.180 55.180 55.120 0.060 18517 1116 1 . 1 1 201 201 ALA CB C 269 18.470 18.470 18.290 0.180 18517 1117 1 . 1 1 201 201 ALA H H 269 7.710 7.710 7.944 -0.234 18517 1118 1 . 1 1 202 202 LEU N N 270 119.980 119.980 119.278 0.702 18517 1119 1 . 1 1 202 202 LEU HA H 270 4.090 4.090 3.947 0.143 18517 1120 1 . 1 1 202 202 LEU C C 270 179.330 179.330 179.429 -0.099 18517 1121 1 . 1 1 202 202 LEU CA C 270 58.070 58.070 57.786 0.284 18517 1122 1 . 1 1 202 202 LEU CB C 270 42.420 42.420 41.355 1.065 18517 1123 1 . 1 1 202 202 LEU H H 270 7.750 7.750 8.250 -0.500 18517 1124 1 . 1 1 203 203 VAL N N 271 118.450 118.450 119.350 -0.900 18517 1125 1 . 1 1 203 203 VAL HA H 271 3.830 3.830 3.866 -0.036 18517 1126 1 . 1 1 203 203 VAL C C 271 177.110 177.110 177.924 -0.814 18517 1127 1 . 1 1 203 203 VAL CA C 271 67.710 67.710 66.823 0.887 18517 1128 1 . 1 1 203 203 VAL CB C 271 31.710 31.710 31.087 0.623 18517 1129 1 . 1 1 203 203 VAL H H 271 8.560 8.560 8.334 0.226 18517 1130 1 . 1 1 204 204 ALA N N 272 122.560 122.560 122.042 0.518 18517 1131 1 . 1 1 204 204 ALA HA H 272 3.880 3.880 3.995 -0.115 18517 1132 1 . 1 1 204 204 ALA C C 272 178.700 178.700 179.712 -1.012 18517 1133 1 . 1 1 204 204 ALA CA C 272 56.130 56.130 55.573 0.557 18517 1134 1 . 1 1 204 204 ALA CB C 272 18.390 18.390 18.145 0.245 18517 1135 1 . 1 1 204 204 ALA H H 272 8.120 8.120 8.438 -0.318 18517 1136 1 . 1 1 205 205 GLU N N 273 117.290 117.290 119.028 -1.738 18517 1137 1 . 1 1 205 205 GLU HA H 273 3.990 3.990 4.091 -0.101 18517 1138 1 . 1 1 205 205 GLU C C 273 178.630 178.630 179.133 -0.503 18517 1139 1 . 1 1 205 205 GLU CA C 273 60.140 60.140 59.105 1.035 18517 1140 1 . 1 1 205 205 GLU CB C 273 29.970 29.970 29.515 0.455 18517 1141 1 . 1 1 205 205 GLU H H 273 7.670 7.670 8.162 -0.492 18517 1142 1 . 1 1 206 206 LEU N N 274 120.450 120.450 121.972 -1.522 18517 1143 1 . 1 1 206 206 LEU HA H 274 4.000 4.000 4.058 -0.058 18517 1144 1 . 1 1 206 206 LEU C C 274 178.400 178.400 178.677 -0.277 18517 1145 1 . 1 1 206 206 LEU CA C 274 58.910 58.910 58.013 0.897 18517 1146 1 . 1 1 206 206 LEU CB C 274 43.530 43.530 41.869 1.661 18517 1147 1 . 1 1 206 206 LEU H H 274 8.420 8.420 8.349 0.071 18517 1148 1 . 1 1 207 207 ILE N N 275 117.580 117.580 120.358 -2.778 18517 1149 1 . 1 1 207 207 ILE HA H 275 3.530 3.530 3.568 -0.038 18517 1150 1 . 1 1 207 207 ILE C C 275 178.850 178.850 178.178 0.672 18517 1151 1 . 1 1 207 207 ILE CA C 275 66.080 66.080 65.768 0.312 18517 1152 1 . 1 1 207 207 ILE CB C 275 38.770 38.770 37.516 1.254 18517 1153 1 . 1 1 207 207 ILE H H 275 8.700 8.700 8.559 0.141 18517 1154 1 . 1 1 208 208 GLU N N 276 119.100 119.100 119.394 -0.294 18517 1155 1 . 1 1 208 208 GLU HA H 276 4.000 4.000 4.015 -0.015 18517 1156 1 . 1 1 208 208 GLU C C 276 178.540 178.540 179.247 -0.707 18517 1157 1 . 1 1 208 208 GLU CA C 276 60.450 60.450 59.546 0.903 18517 1158 1 . 1 1 208 208 GLU CB C 276 30.520 30.520 29.482 1.038 18517 1159 1 . 1 1 208 208 GLU H H 276 7.950 7.950 8.214 -0.264 18517 1160 1 . 1 1 209 209 LEU N N 277 120.590 120.590 120.562 0.028 18517 1161 1 . 1 1 209 209 LEU HA H 277 4.220 4.220 4.114 0.106 18517 1162 1 . 1 1 209 209 LEU C C 277 179.520 179.520 178.893 0.627 18517 1163 1 . 1 1 209 209 LEU CA C 277 58.350 58.350 58.027 0.322 18517 1164 1 . 1 1 209 209 LEU CB C 277 43.290 43.290 41.456 1.834 18517 1165 1 . 1 1 209 209 LEU H H 277 8.550 8.550 8.430 0.120 18517 1166 1 . 1 1 210 210 ARG N N 278 116.470 116.470 119.459 -2.989 18517 1167 1 . 1 1 210 210 ARG HA H 278 3.740 3.740 4.027 -0.287 18517 1168 1 . 1 1 210 210 ARG C C 278 179.190 179.190 178.679 0.511 18517 1169 1 . 1 1 210 210 ARG CA C 278 61.680 61.680 59.499 2.181 18517 1170 1 . 1 1 210 210 ARG CB C 278 31.400 31.400 30.147 1.253 18517 1171 1 . 1 1 210 210 ARG H H 278 8.590 8.590 8.650 -0.060 18517 1172 1 . 1 1 211 211 ALA N N 279 120.470 120.470 122.392 -1.922 18517 1173 1 . 1 1 211 211 ALA HA H 279 3.910 3.910 4.047 -0.138 18517 1174 1 . 1 1 211 211 ALA C C 279 181.350 181.350 179.822 1.528 18517 1175 1 . 1 1 211 211 ALA CA C 279 55.700 55.700 55.182 0.518 18517 1176 1 . 1 1 211 211 ALA CB C 279 17.280 17.280 18.337 -1.057 18517 1177 1 . 1 1 211 211 ALA H H 279 8.050 8.050 8.307 -0.257 18517 1178 1 . 1 1 212 212 GLN N N 280 120.070 120.070 118.077 1.993 18517 1179 1 . 1 1 212 212 GLN HA H 280 4.020 4.020 3.985 0.035 18517 1180 1 . 1 1 212 212 GLN C C 280 179.490 179.490 178.672 0.818 18517 1181 1 . 1 1 212 212 GLN CA C 280 59.300 59.300 58.759 0.541 18517 1182 1 . 1 1 212 212 GLN CB C 280 29.180 29.180 28.675 0.505 18517 1183 1 . 1 1 212 212 GLN H H 280 8.300 8.300 8.184 0.116 18517 1184 1 . 1 1 213 213 MET N N 281 119.810 119.810 119.575 0.235 18517 1185 1 . 1 1 213 213 MET HA H 281 3.730 3.730 4.214 -0.484 18517 1186 1 . 1 1 213 213 MET C C 281 177.490 177.490 178.438 -0.948 18517 1187 1 . 1 1 213 213 MET CA C 281 60.690 60.690 57.826 2.864 18517 1188 1 . 1 1 213 213 MET CB C 281 33.930 33.930 32.278 1.652 18517 1189 1 . 1 1 213 213 MET H H 281 8.420 8.420 8.515 -0.095 18517 1190 1 . 1 1 214 214 MET N N 282 114.000 114.000 118.546 -4.546 18517 1191 1 . 1 1 214 214 MET HA H 282 3.880 3.880 4.214 -0.334 18517 1192 1 . 1 1 214 214 MET C C 282 177.650 177.650 178.188 -0.538 18517 1193 1 . 1 1 214 214 MET CA C 282 58.670 58.670 57.812 0.858 18517 1194 1 . 1 1 214 214 MET CB C 282 33.300 33.300 31.850 1.450 18517 1195 1 . 1 1 214 214 MET H H 282 7.890 7.890 8.339 -0.449 18517 1196 1 . 1 1 215 215 ALA N N 283 119.970 119.970 122.991 -3.021 18517 1197 1 . 1 1 215 215 ALA HA H 283 4.140 4.140 4.079 0.061 18517 1198 1 . 1 1 215 215 ALA C C 283 180.580 180.580 179.168 1.412 18517 1199 1 . 1 1 215 215 ALA CA C 283 54.110 54.110 55.023 -0.913 18517 1200 1 . 1 1 215 215 ALA CB C 283 17.680 17.680 18.249 -0.568 18517 1201 1 . 1 1 215 215 ALA H H 283 7.580 7.580 8.153 -0.573 18517 1202 1 . 1 1 216 216 LEU N N 284 120.920 120.920 117.981 2.939 18517 1203 1 . 1 1 216 216 LEU HA H 284 3.960 3.960 4.103 -0.143 18517 1204 1 . 1 1 216 216 LEU C C 284 177.910 177.910 179.404 -1.494 18517 1205 1 . 1 1 216 216 LEU CA C 284 57.920 57.920 57.155 0.765 18517 1206 1 . 1 1 216 216 LEU CB C 284 42.500 42.500 42.068 0.432 18517 1207 1 . 1 1 216 216 LEU H H 284 7.460 7.460 8.039 -0.579 18517 1208 1 . 1 1 217 217 LEU N N 285 116.470 116.470 120.963 -4.493 18517 1209 1 . 1 1 217 217 LEU HA H 285 3.680 3.680 3.872 -0.192 18517 1210 1 . 1 1 217 217 LEU C C 285 178.310 178.310 177.211 1.099 18517 1211 1 . 1 1 217 217 LEU CA C 285 57.440 57.440 57.509 -0.069 18517 1212 1 . 1 1 217 217 LEU CB C 285 43.050 43.050 41.891 1.159 18517 1213 1 . 1 1 217 217 LEU H H 285 6.980 6.980 8.227 -1.247 18517 1214 1 . 1 1 218 218 TYR N N 286 111.080 111.080 114.077 -2.997 18517 1215 1 . 1 1 218 218 TYR HA H 286 4.900 4.900 4.622 0.278 18517 1216 1 . 1 1 218 218 TYR C C 286 176.090 176.090 175.902 0.188 18517 1217 1 . 1 1 218 218 TYR CA C 286 56.050 56.050 57.024 -0.974 18517 1218 1 . 1 1 218 218 TYR CB C 286 40.910 40.910 38.071 2.839 18517 1219 1 . 1 1 218 218 TYR H H 286 7.660 7.660 7.903 -0.243 18517 1220 1 . 1 1 219 219 GLY N N 287 108.260 108.260 109.810 -1.550 18517 1221 1 . 1 1 219 219 GLY CA C 287 44.320 44.320 43.441 0.879 18517 1222 1 . 1 1 219 219 GLY H H 287 7.750 7.750 7.632 0.118 18517 1223 1 . 1 1 221 221 ILE HA H 289 3.490 3.490 3.837 -0.347 18517 1224 1 . 1 1 221 221 ILE CA C 289 63.580 63.580 62.442 1.138 18517 1225 1 . 1 1 221 221 ILE CB C 289 38.280 38.280 37.877 0.403 18517 1226 1 . 1 1 222 222 GLY CA C 290 45.740 45.740 45.099 0.641 18517 stop_ save_