data_17856 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17856 _Entry.PDB_ID 2LHK 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 17856 _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 SER N N 2 116.304 116.304 117.597 -1.293 17856 2 1 1 . 1 1 2 2 SER C C 2 174.710 174.710 173.045 1.665 17856 3 1 1 . 1 1 2 2 SER CA C 2 58.908 58.908 59.300 -0.392 17856 4 1 1 . 1 1 2 2 SER H H 2 8.003 8.003 8.505 -0.501 17856 5 1 1 . 1 1 3 3 ILE N N 3 122.062 122.062 126.294 -4.232 17856 6 1 1 . 1 1 3 3 ILE C C 3 176.750 176.750 174.996 1.754 17856 7 1 1 . 1 1 3 3 ILE CA C 3 61.786 61.786 61.769 0.017 17856 8 1 1 . 1 1 3 3 ILE H H 3 7.957 7.957 8.359 -0.402 17856 9 1 1 . 1 1 4 4 VAL N N 4 122.674 122.674 120.463 2.211 17856 10 1 1 . 1 1 4 4 VAL C C 4 176.221 176.221 177.641 -1.420 17856 11 1 1 . 1 1 4 4 VAL CA C 4 62.970 62.970 66.096 -3.126 17856 12 1 1 . 1 1 4 4 VAL H H 4 7.970 7.970 8.283 -0.313 17856 13 1 1 . 1 1 5 5 SER N N 5 117.750 117.750 113.870 3.880 17856 14 1 1 . 1 1 5 5 SER C C 5 174.858 174.858 175.754 -0.896 17856 15 1 1 . 1 1 5 5 SER CA C 5 58.630 58.630 60.423 -1.794 17856 16 1 1 . 1 1 5 5 SER H H 5 8.093 8.093 8.592 -0.499 17856 17 1 1 . 1 1 6 6 GLN N N 6 121.961 121.961 119.996 1.965 17856 18 1 1 . 1 1 6 6 GLN C C 6 176.467 176.467 176.778 -0.311 17856 19 1 1 . 1 1 6 6 GLN CA C 6 56.226 56.226 56.397 -0.171 17856 20 1 1 . 1 1 6 6 GLN H H 6 8.371 8.371 8.342 0.029 17856 21 1 1 . 1 1 7 7 THR N N 7 115.325 115.325 111.772 3.553 17856 22 1 1 . 1 1 7 7 THR C C 7 174.752 174.752 175.717 -0.965 17856 23 1 1 . 1 1 7 7 THR H H 7 8.152 8.152 7.703 0.449 17856 24 1 1 . 1 1 8 8 ARG N N 8 122.530 122.530 119.770 2.760 17856 25 1 1 . 1 1 8 8 ARG C C 8 176.200 176.200 176.396 -0.196 17856 26 1 1 . 1 1 8 8 ARG CA C 8 56.570 56.570 55.358 1.212 17856 27 1 1 . 1 1 8 8 ARG H H 8 8.211 8.211 8.263 -0.052 17856 28 1 1 . 1 1 9 9 ASN N N 9 119.600 119.600 119.889 -0.289 17856 29 1 1 . 1 1 9 9 ASN C C 9 177.164 177.164 176.407 0.757 17856 30 1 1 . 1 1 9 9 ASN H H 9 8.398 8.398 8.190 0.208 17856 31 1 1 . 1 1 10 10 LYS N N 10 121.600 121.600 119.736 1.864 17856 32 1 1 . 1 1 10 10 LYS C C 10 176.845 176.845 178.521 -1.676 17856 33 1 1 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.374 -2.264 17856 34 1 1 . 1 1 10 10 LYS H H 10 8.190 8.190 8.341 -0.151 17856 35 1 1 . 1 1 11 11 GLU N N 11 120.700 120.700 118.914 1.786 17856 36 1 1 . 1 1 11 11 GLU C C 11 176.825 176.825 178.757 -1.932 17856 37 1 1 . 1 1 11 11 GLU CA C 11 56.690 56.690 59.237 -2.547 17856 38 1 1 . 1 1 11 11 GLU H H 11 8.323 8.323 7.739 0.584 17856 39 1 1 . 1 1 12 12 LEU N N 12 122.390 122.390 121.242 1.148 17856 40 1 1 . 1 1 12 12 LEU C C 12 177.670 177.670 178.894 -1.224 17856 41 1 1 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.151 -2.680 17856 42 1 1 . 1 1 12 12 LEU H H 12 8.155 8.155 7.519 0.636 17856 43 1 1 . 1 1 13 13 LEU N N 13 122.570 122.570 116.658 5.912 17856 44 1 1 . 1 1 13 13 LEU C C 13 177.510 177.510 178.642 -1.132 17856 45 1 1 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.502 -2.921 17856 46 1 1 . 1 1 13 13 LEU H H 13 8.220 8.220 8.071 0.149 17856 47 1 1 . 1 1 14 14 ASP N N 14 120.780 120.780 120.845 -0.065 17856 48 1 1 . 1 1 14 14 ASP C C 14 176.480 176.480 178.776 -2.296 17856 49 1 1 . 1 1 14 14 ASP CA C 14 54.650 54.650 58.139 -3.489 17856 50 1 1 . 1 1 14 14 ASP H H 14 8.243 8.243 8.471 -0.228 17856 51 1 1 . 1 1 15 15 LYS N N 15 120.900 120.900 119.024 1.876 17856 52 1 1 . 1 1 15 15 LYS C C 15 175.580 175.580 179.055 -3.475 17856 53 1 1 . 1 1 15 15 LYS H H 15 8.052 8.052 8.007 0.045 17856 54 1 1 . 1 1 16 16 LYS N N 16 121.980 121.980 120.521 1.459 17856 55 1 1 . 1 1 16 16 LYS C C 16 176.887 176.887 179.173 -2.286 17856 56 1 1 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.605 -2.271 17856 57 1 1 . 1 1 16 16 LYS H H 16 8.243 8.243 7.693 0.550 17856 58 1 1 . 1 1 17 17 ILE N N 17 121.940 121.940 118.869 3.071 17856 59 1 1 . 1 1 17 17 ILE H H 17 8.110 8.110 8.350 -0.239 17856 60 1 1 . 1 1 18 18 ARG C C 18 176.520 176.520 178.296 -1.776 17856 61 1 1 . 1 1 19 19 SER N N 19 117.150 117.150 115.207 1.943 17856 62 1 1 . 1 1 19 19 SER C C 19 175.167 175.167 176.192 -1.025 17856 63 1 1 . 1 1 19 19 SER CA C 19 58.840 58.840 61.304 -2.464 17856 64 1 1 . 1 1 19 19 SER H H 19 8.396 8.396 7.735 0.661 17856 65 1 1 . 1 1 20 20 GLU N N 20 123.176 123.176 121.722 1.454 17856 66 1 1 . 1 1 20 20 GLU C C 20 176.921 176.921 178.951 -2.030 17856 67 1 1 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.239 -2.380 17856 68 1 1 . 1 1 20 20 GLU H H 20 8.478 8.478 7.676 0.802 17856 69 1 1 . 1 1 21 21 ILE N N 21 120.550 120.550 115.779 4.771 17856 70 1 1 . 1 1 21 21 ILE C C 21 176.550 176.550 178.342 -1.792 17856 71 1 1 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.900 -3.270 17856 72 1 1 . 1 1 21 21 ILE H H 21 8.080 8.080 7.441 0.639 17856 73 1 1 . 1 1 22 22 GLU N N 22 123.685 123.685 120.446 3.239 17856 74 1 1 . 1 1 22 22 GLU C C 22 176.109 176.109 178.940 -2.831 17856 75 1 1 . 1 1 22 22 GLU H H 22 8.309 8.309 7.567 0.742 17856 76 1 1 . 1 1 23 23 ALA N N 23 124.280 124.280 123.107 1.173 17856 77 1 1 . 1 1 23 23 ALA C C 23 178.474 178.474 179.755 -1.281 17856 78 1 1 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.145 -1.739 17856 79 1 1 . 1 1 23 23 ALA H H 23 8.088 8.088 8.314 -0.226 17856 80 1 1 . 1 1 24 24 ILE N N 24 120.330 120.330 118.512 1.818 17856 81 1 1 . 1 1 24 24 ILE C C 24 176.309 176.309 177.863 -1.554 17856 82 1 1 . 1 1 24 24 ILE CA C 24 61.540 61.540 65.092 -3.552 17856 83 1 1 . 1 1 24 24 ILE H H 24 7.980 7.980 8.583 -0.603 17856 84 1 1 . 1 1 25 25 LYS N N 25 124.310 124.310 119.945 4.365 17856 85 1 1 . 1 1 25 25 LYS C C 25 176.365 176.365 178.703 -2.338 17856 86 1 1 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.164 -2.830 17856 87 1 1 . 1 1 25 25 LYS H H 25 8.198 8.198 7.718 0.480 17856 88 1 1 . 1 1 26 26 LYS N N 26 122.518 122.518 119.107 3.411 17856 89 1 1 . 1 1 26 26 LYS C C 26 176.365 176.365 178.809 -2.444 17856 90 1 1 . 1 1 26 26 LYS CA C 26 56.175 56.175 59.023 -2.848 17856 91 1 1 . 1 1 26 26 LYS H H 26 8.125 8.125 7.484 0.641 17856 92 1 1 . 1 1 27 27 ILE N N 27 122.670 122.670 119.957 2.713 17856 93 1 1 . 1 1 27 27 ILE C C 27 176.261 176.261 178.338 -2.077 17856 94 1 1 . 1 1 27 27 ILE CA C 27 61.294 61.294 65.118 -3.824 17856 95 1 1 . 1 1 27 27 ILE H H 27 8.114 8.114 7.603 0.511 17856 96 1 1 . 1 1 28 28 ILE N N 28 125.178 125.178 119.267 5.911 17856 97 1 1 . 1 1 28 28 ILE C C 28 175.803 175.803 177.826 -2.023 17856 98 1 1 . 1 1 28 28 ILE CA C 28 61.080 61.080 65.291 -4.211 17856 99 1 1 . 1 1 28 28 ILE H H 28 8.220 8.220 7.793 0.427 17856 100 1 1 . 1 1 29 29 ALA N N 29 127.850 127.850 121.511 6.339 17856 101 1 1 . 1 1 29 29 ALA C C 29 177.627 177.627 179.678 -2.051 17856 102 1 1 . 1 1 29 29 ALA CA C 29 53.684 53.684 55.125 -1.441 17856 103 1 1 . 1 1 29 29 ALA H H 29 8.300 8.300 7.589 0.711 17856 104 1 1 . 1 1 30 30 GLU N N 30 120.000 120.000 118.680 1.320 17856 105 1 1 . 1 1 30 30 GLU C C 30 176.321 176.321 178.799 -2.478 17856 106 1 1 . 1 1 30 30 GLU H H 30 8.258 8.258 8.088 0.170 17856 107 1 1 . 1 1 31 31 PHE N N 31 119.128 119.128 117.792 1.336 17856 108 1 1 . 1 1 31 31 PHE C C 31 175.180 175.180 178.054 -2.874 17856 109 1 1 . 1 1 31 31 PHE CA C 31 57.540 57.540 61.630 -4.090 17856 110 1 1 . 1 1 31 31 PHE H H 31 8.061 8.061 7.466 0.595 17856 111 1 1 . 1 1 32 32 ASP N N 32 121.800 121.800 119.045 2.755 17856 112 1 1 . 1 1 32 32 ASP C C 32 175.894 175.894 177.468 -1.574 17856 113 1 1 . 1 1 32 32 ASP CA C 32 54.529 54.529 56.499 -1.970 17856 114 1 1 . 1 1 32 32 ASP H H 32 8.275 8.275 7.713 0.562 17856 115 1 1 . 1 1 33 33 VAL N N 33 119.648 119.648 118.088 1.560 17856 116 1 1 . 1 1 33 33 VAL C C 33 176.268 176.268 178.570 -2.302 17856 117 1 1 . 1 1 33 33 VAL CA C 33 62.500 62.500 65.604 -3.104 17856 118 1 1 . 1 1 33 33 VAL H H 33 8.059 8.059 7.738 0.321 17856 119 1 1 . 1 1 34 34 VAL N N 34 123.882 123.882 119.442 4.440 17856 120 1 1 . 1 1 34 34 VAL H H 34 7.774 7.774 8.147 -0.373 17856 121 1 1 . 1 1 35 35 LYS N N 35 125.250 125.250 118.318 6.932 17856 122 1 1 . 1 1 35 35 LYS C C 35 176.719 176.719 175.849 0.870 17856 123 1 1 . 1 1 35 35 LYS CA C 35 56.502 56.502 56.364 0.138 17856 124 1 1 . 1 1 35 35 LYS H H 35 8.357 8.357 7.814 0.543 17856 125 1 1 . 1 1 36 36 GLU N N 36 121.850 121.850 121.077 0.773 17856 126 1 1 . 1 1 36 36 GLU C C 36 176.426 176.426 176.858 -0.432 17856 127 1 1 . 1 1 36 36 GLU H H 36 8.423 8.423 8.129 0.294 17856 128 1 1 . 1 1 37 37 SER N N 37 117.100 117.100 117.282 -0.182 17856 129 1 1 . 1 1 37 37 SER C C 37 174.854 174.854 174.850 0.004 17856 130 1 1 . 1 1 37 37 SER CA C 37 58.850 58.850 59.340 -0.491 17856 131 1 1 . 1 1 37 37 SER H H 37 8.362 8.362 8.616 -0.254 17856 132 1 1 . 1 1 38 38 VAL N N 38 121.625 121.625 121.125 0.500 17856 133 1 1 . 1 1 38 38 VAL C C 38 176.246 176.246 176.587 -0.341 17856 134 1 1 . 1 1 38 38 VAL CA C 38 63.043 63.043 63.208 -0.165 17856 135 1 1 . 1 1 38 38 VAL H H 38 8.225 8.225 8.005 0.220 17856 136 1 1 . 1 1 39 39 ASN N N 39 121.150 121.150 118.278 2.872 17856 137 1 1 . 1 1 39 39 ASN C C 39 175.459 175.459 176.286 -0.827 17856 138 1 1 . 1 1 39 39 ASN CA C 39 53.568 53.568 55.792 -2.224 17856 139 1 1 . 1 1 39 39 ASN H H 39 8.366 8.366 8.416 -0.050 17856 140 1 1 . 1 1 40 40 GLU N N 40 121.500 121.500 116.415 5.085 17856 141 1 1 . 1 1 40 40 GLU C C 40 175.459 175.459 176.311 -0.852 17856 142 1 1 . 1 1 40 40 GLU CA C 40 56.860 56.860 56.962 -0.102 17856 143 1 1 . 1 1 40 40 GLU H H 40 8.370 8.370 8.444 -0.074 17856 144 1 1 . 1 1 41 41 LEU N N 41 121.950 121.950 118.095 3.855 17856 145 1 1 . 1 1 41 41 LEU C C 41 177.939 177.939 178.148 -0.209 17856 146 1 1 . 1 1 41 41 LEU CA C 41 56.040 56.040 55.736 0.304 17856 147 1 1 . 1 1 41 41 LEU H H 41 8.152 8.152 7.474 0.678 17856 148 1 1 . 1 1 42 42 SER N N 42 113.326 113.326 115.322 -1.996 17856 149 1 1 . 1 1 42 42 SER C C 42 174.660 174.660 177.274 -2.614 17856 150 1 1 . 1 1 42 42 SER CA C 42 58.940 58.940 61.780 -2.840 17856 151 1 1 . 1 1 42 42 SER H H 42 8.373 8.373 7.985 0.388 17856 152 1 1 . 1 1 43 43 GLU N N 43 121.521 121.521 121.077 0.444 17856 153 1 1 . 1 1 43 43 GLU C C 43 177.349 177.349 178.549 -1.200 17856 154 1 1 . 1 1 43 43 GLU H H 43 7.329 7.329 7.660 -0.331 17856 155 1 1 . 1 1 44 44 LYS N N 44 121.240 121.240 119.072 2.168 17856 156 1 1 . 1 1 44 44 LYS C C 44 177.246 177.246 178.039 -0.793 17856 157 1 1 . 1 1 44 44 LYS CA C 44 56.397 56.397 57.839 -1.442 17856 158 1 1 . 1 1 44 44 LYS H H 44 8.103 8.103 8.068 0.035 17856 159 1 1 . 1 1 45 45 ALA N N 45 119.568 119.568 122.680 -3.112 17856 160 1 1 . 1 1 45 45 ALA C C 45 177.853 177.853 178.363 -0.510 17856 161 1 1 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.815 -2.255 17856 162 1 1 . 1 1 45 45 ALA H H 45 8.541 8.541 7.664 0.877 17856 163 1 1 . 1 1 46 46 LYS N N 46 115.235 115.235 117.186 -1.951 17856 164 1 1 . 1 1 46 46 LYS C C 46 177.110 177.110 178.053 -0.943 17856 165 1 1 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.568 -1.772 17856 166 1 1 . 1 1 46 46 LYS H H 46 7.257 7.257 7.944 -0.687 17856 167 1 1 . 1 1 47 47 THR N N 47 103.239 103.239 115.016 -11.777 17856 168 1 1 . 1 1 47 47 THR C C 47 173.973 173.973 174.751 -0.778 17856 169 1 1 . 1 1 47 47 THR CA C 47 62.740 62.740 64.459 -1.718 17856 170 1 1 . 1 1 47 47 THR H H 47 7.381 7.381 7.667 -0.286 17856 171 1 1 . 1 1 48 48 ASP N N 48 122.976 122.976 120.694 2.282 17856 172 1 1 . 1 1 48 48 ASP H H 48 8.031 8.031 7.971 0.060 17856 173 1 1 . 1 1 49 49 PRO C C 49 178.106 178.106 178.362 -0.256 17856 174 1 1 . 1 1 49 49 PRO CA C 49 64.219 64.219 65.007 -0.788 17856 175 1 1 . 1 1 50 50 GLN N N 50 118.351 118.351 118.476 -0.125 17856 176 1 1 . 1 1 50 50 GLN C C 50 176.944 176.944 178.242 -1.298 17856 177 1 1 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.450 -1.650 17856 178 1 1 . 1 1 50 50 GLN H H 50 8.304 8.304 7.975 0.329 17856 179 1 1 . 1 1 51 51 ALA N N 51 124.206 124.206 122.157 2.049 17856 180 1 1 . 1 1 51 51 ALA C C 51 178.490 178.490 179.266 -0.776 17856 181 1 1 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.829 -1.405 17856 182 1 1 . 1 1 51 51 ALA H H 51 7.547 7.547 8.436 -0.889 17856 183 1 1 . 1 1 52 52 ALA N N 52 118.686 118.686 119.688 -1.002 17856 184 1 1 . 1 1 52 52 ALA C C 52 177.953 177.953 179.138 -1.185 17856 185 1 1 . 1 1 52 52 ALA H H 52 7.931 7.931 7.695 0.236 17856 186 1 1 . 1 1 53 53 GLU N N 53 120.075 120.075 118.400 1.675 17856 187 1 1 . 1 1 53 53 GLU H H 53 7.729 7.729 7.666 0.063 17856 188 1 1 . 1 1 55 55 LEU N N 55 123.640 123.640 119.334 4.306 17856 189 1 1 . 1 1 55 55 LEU C C 55 177.587 177.587 178.282 -0.695 17856 190 1 1 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.310 -1.524 17856 191 1 1 . 1 1 55 55 LEU H H 55 8.215 8.215 8.003 0.212 17856 192 1 1 . 1 1 56 56 ASN N N 56 118.520 118.520 116.500 2.020 17856 193 1 1 . 1 1 56 56 ASN C C 56 175.700 175.700 175.702 -0.002 17856 194 1 1 . 1 1 56 56 ASN CA C 56 54.132 54.132 54.904 -0.772 17856 195 1 1 . 1 1 56 56 ASN H H 56 8.250 8.250 7.703 0.547 17856 196 1 1 . 1 1 57 57 LYS N N 57 120.960 120.960 118.401 2.559 17856 197 1 1 . 1 1 57 57 LYS C C 57 176.637 176.637 176.384 0.253 17856 198 1 1 . 1 1 57 57 LYS H H 57 8.065 8.065 7.767 0.298 17856 199 1 1 . 1 1 58 58 LEU N N 58 122.610 122.610 121.292 1.318 17856 200 1 1 . 1 1 58 58 LEU C C 58 177.433 177.433 175.026 2.407 17856 201 1 1 . 1 1 58 58 LEU CA C 58 55.120 55.120 54.352 0.768 17856 202 1 1 . 1 1 58 58 LEU H H 58 8.135 8.135 7.995 0.140 17856 203 1 1 . 1 1 59 59 ILE N N 59 122.045 122.045 123.482 -1.437 17856 204 1 1 . 1 1 59 59 ILE CA C 59 61.535 61.535 60.624 0.910 17856 205 1 1 . 1 1 59 59 ILE H H 59 8.220 8.220 8.415 -0.195 17856 206 1 1 . 1 1 60 60 GLU N N 60 124.000 124.000 121.629 2.371 17856 207 1 1 . 1 1 60 60 GLU C C 60 177.007 177.007 175.380 1.627 17856 208 1 1 . 1 1 60 60 GLU CA C 60 56.722 56.722 56.390 0.332 17856 209 1 1 . 1 1 60 60 GLU H H 60 8.340 8.340 8.107 0.233 17856 210 1 1 . 1 1 61 61 GLY N N 61 110.520 110.520 112.930 -2.410 17856 211 1 1 . 1 1 61 61 GLY C C 61 174.002 174.002 173.167 0.835 17856 212 1 1 . 1 1 61 61 GLY CA C 61 45.405 45.405 45.115 0.290 17856 213 1 1 . 1 1 61 61 GLY H H 61 8.557 8.557 8.234 0.323 17856 214 1 1 . 1 1 62 62 TYR N N 62 119.600 119.600 118.636 0.964 17856 215 1 1 . 1 1 62 62 TYR C C 62 175.940 175.940 175.888 0.052 17856 216 1 1 . 1 1 62 62 TYR CA C 62 58.108 58.108 56.796 1.312 17856 217 1 1 . 1 1 62 62 TYR H H 62 7.980 7.980 7.838 0.142 17856 218 1 1 . 1 1 63 63 THR N N 63 116.304 116.304 111.977 4.327 17856 219 1 1 . 1 1 63 63 THR C C 63 173.796 173.796 174.320 -0.524 17856 220 1 1 . 1 1 63 63 THR H H 63 8.049 8.049 8.170 -0.121 17856 221 1 1 . 1 1 64 64 TYR N N 64 122.050 122.050 125.444 -3.394 17856 222 1 1 . 1 1 64 64 TYR C C 64 176.290 176.290 174.993 1.297 17856 223 1 1 . 1 1 64 64 TYR CA C 64 58.533 58.533 58.075 0.458 17856 224 1 1 . 1 1 64 64 TYR H H 64 8.133 8.133 8.299 -0.166 17856 225 1 1 . 1 1 65 65 GLY N N 65 110.456 110.456 108.654 1.802 17856 226 1 1 . 1 1 65 65 GLY C C 65 174.340 174.340 173.551 0.789 17856 227 1 1 . 1 1 65 65 GLY CA C 65 45.328 45.328 45.287 0.041 17856 228 1 1 . 1 1 65 65 GLY H H 65 7.747 7.747 8.067 -0.320 17856 229 1 1 . 1 1 66 66 GLU N N 66 120.783 120.783 120.077 0.706 17856 230 1 1 . 1 1 66 66 GLU C C 66 176.895 176.895 175.879 1.016 17856 231 1 1 . 1 1 66 66 GLU CA C 66 56.804 56.804 55.907 0.897 17856 232 1 1 . 1 1 66 66 GLU H H 66 8.243 8.243 8.598 -0.355 17856 233 1 1 . 1 1 67 67 GLU N N 67 121.587 121.587 118.330 3.257 17856 234 1 1 . 1 1 67 67 GLU C C 67 176.340 176.340 175.527 0.813 17856 235 1 1 . 1 1 67 67 GLU H H 67 8.611 8.611 8.048 0.563 17856 236 1 1 . 1 1 68 68 ARG N N 68 121.790 121.790 120.477 1.313 17856 237 1 1 . 1 1 68 68 ARG C C 68 176.350 176.350 175.652 0.698 17856 238 1 1 . 1 1 68 68 ARG H H 68 8.267 8.267 7.934 0.333 17856 239 1 1 . 1 1 69 69 LYS N N 69 118.431 118.431 123.112 -4.681 17856 240 1 1 . 1 1 69 69 LYS H H 69 7.567 7.567 8.180 -0.613 17856 241 1 1 . 1 1 70 70 LEU C C 70 177.338 177.338 179.245 -1.907 17856 242 1 1 . 1 1 70 70 LEU CA C 70 55.533 55.533 55.910 -0.377 17856 243 1 1 . 1 1 71 71 TYR N N 71 119.504 119.504 118.884 0.620 17856 244 1 1 . 1 1 71 71 TYR H H 71 7.997 7.997 8.224 -0.227 17856 245 1 1 . 1 1 72 72 ASP C C 72 176.528 176.528 178.557 -2.029 17856 246 1 1 . 1 1 72 72 ASP CA C 72 54.693 54.693 57.973 -3.280 17856 247 1 1 . 1 1 73 73 SER N N 73 117.000 117.000 115.142 1.858 17856 248 1 1 . 1 1 73 73 SER C C 73 174.950 174.950 175.974 -1.024 17856 249 1 1 . 1 1 73 73 SER CA C 73 58.997 58.997 61.591 -2.594 17856 250 1 1 . 1 1 73 73 SER H H 73 8.282 8.282 7.936 0.346 17856 251 1 1 . 1 1 74 74 ALA N N 74 125.422 125.422 124.319 1.103 17856 252 1 1 . 1 1 74 74 ALA C C 74 178.389 178.389 179.668 -1.279 17856 253 1 1 . 1 1 74 74 ALA CA C 74 53.433 53.433 55.022 -1.589 17856 254 1 1 . 1 1 74 74 ALA H H 74 8.339 8.339 7.543 0.796 17856 255 1 1 . 1 1 75 75 LEU N N 75 120.019 120.019 118.610 1.409 17856 256 1 1 . 1 1 75 75 LEU C C 75 177.954 177.954 179.041 -1.087 17856 257 1 1 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.303 -1.523 17856 258 1 1 . 1 1 75 75 LEU H H 75 7.948 7.948 7.419 0.529 17856 259 1 1 . 1 1 76 76 SER N N 76 113.321 113.321 115.191 -1.870 17856 260 1 1 . 1 1 76 76 SER C C 76 174.784 174.784 176.936 -2.152 17856 261 1 1 . 1 1 76 76 SER CA C 76 59.173 59.173 61.356 -2.183 17856 262 1 1 . 1 1 76 76 SER H H 76 7.951 7.951 8.245 -0.294 17856 263 1 1 . 1 1 77 77 LYS N N 77 122.710 122.710 120.937 1.773 17856 264 1 1 . 1 1 77 77 LYS C C 77 176.734 176.734 178.731 -1.997 17856 265 1 1 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.417 -1.027 17856 266 1 1 . 1 1 77 77 LYS H H 77 8.170 8.170 7.509 0.661 17856 267 1 1 . 1 1 78 78 ILE N N 78 121.521 121.521 119.606 1.915 17856 268 1 1 . 1 1 78 78 ILE C C 78 176.512 176.512 178.007 -1.495 17856 269 1 1 . 1 1 78 78 ILE H H 78 8.160 8.160 7.221 0.939 17856 270 1 1 . 1 1 79 79 GLU N N 79 123.840 123.840 120.476 3.364 17856 271 1 1 . 1 1 79 79 GLU CA C 79 55.478 55.478 60.074 -4.596 17856 272 1 1 . 1 1 79 79 GLU H H 79 8.360 8.360 7.892 0.468 17856 273 1 1 . 1 1 80 80 LYS N N 80 122.143 122.143 119.415 2.728 17856 274 1 1 . 1 1 80 80 LYS C C 80 176.937 176.937 178.959 -2.022 17856 275 1 1 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.637 -3.137 17856 276 1 1 . 1 1 80 80 LYS H H 80 8.231 8.231 7.717 0.514 17856 277 1 1 . 1 1 81 81 LEU N N 81 122.095 122.095 121.835 0.260 17856 278 1 1 . 1 1 81 81 LEU C C 81 177.531 177.531 178.879 -1.348 17856 279 1 1 . 1 1 81 81 LEU H H 81 8.050 8.050 7.772 0.278 17856 280 1 1 . 1 1 82 82 ILE N N 82 120.609 120.609 118.724 1.885 17856 281 1 1 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.644 -4.285 17856 282 1 1 . 1 1 82 82 ILE H H 82 8.000 8.000 8.245 -0.245 17856 283 1 1 . 1 1 83 83 GLU N N 83 124.611 124.611 120.039 4.572 17856 284 1 1 . 1 1 83 83 GLU C C 83 177.298 177.298 179.601 -2.303 17856 285 1 1 . 1 1 83 83 GLU H H 83 8.380 8.380 8.651 -0.271 17856 286 1 1 . 1 1 84 84 THR N N 84 115.107 115.107 114.868 0.239 17856 287 1 1 . 1 1 84 84 THR C C 84 174.400 174.400 175.319 -0.919 17856 288 1 1 . 1 1 84 84 THR CA C 84 62.659 62.659 65.559 -2.900 17856 289 1 1 . 1 1 84 84 THR H H 84 8.064 8.064 8.152 -0.088 17856 290 1 1 . 1 1 85 85 LEU N N 85 124.150 124.150 119.823 4.327 17856 291 1 1 . 1 1 85 85 LEU C C 85 177.120 177.120 176.519 0.601 17856 292 1 1 . 1 1 85 85 LEU CA C 85 55.020 55.020 54.500 0.520 17856 293 1 1 . 1 1 85 85 LEU H H 85 8.238 8.238 7.214 1.024 17856 294 1 1 . 1 1 86 86 SER N N 86 114.913 114.913 115.238 -0.325 17856 295 1 1 . 1 1 86 86 SER H H 86 7.678 7.678 7.521 0.157 17856 296 1 1 . 1 1 87 87 PRO CA C 87 63.550 63.550 63.624 -0.074 17856 297 1 1 . 1 1 88 88 ALA N N 88 123.767 123.767 121.231 2.536 17856 298 1 1 . 1 1 88 88 ALA C C 88 178.131 178.131 178.444 -0.313 17856 299 1 1 . 1 1 88 88 ALA CA C 88 52.878 52.878 54.336 -1.458 17856 300 1 1 . 1 1 88 88 ALA H H 88 8.342 8.342 8.133 0.209 17856 301 1 1 . 1 1 89 89 ARG N N 89 119.159 119.159 121.956 -2.797 17856 302 1 1 . 1 1 89 89 ARG C C 89 176.620 176.620 177.683 -1.063 17856 303 1 1 . 1 1 89 89 ARG H H 89 8.133 8.133 8.727 -0.594 17856 304 1 1 . 1 1 90 90 SER N N 90 116.910 116.910 117.749 -0.839 17856 305 1 1 . 1 1 90 90 SER C C 90 174.887 174.887 173.907 0.980 17856 306 1 1 . 1 1 90 90 SER H H 90 8.322 8.322 7.975 0.347 17856 307 1 1 . 1 1 91 91 LYS N N 91 123.457 123.457 125.320 -1.863 17856 308 1 1 . 1 1 91 91 LYS C C 91 176.970 176.970 175.663 1.307 17856 309 1 1 . 1 1 91 91 LYS H H 91 8.396 8.396 8.159 0.237 17856 310 1 1 . 1 1 92 92 SER N N 92 116.692 116.692 114.717 1.975 17856 311 1 1 . 1 1 92 92 SER C C 92 174.573 174.573 174.529 0.044 17856 312 1 1 . 1 1 92 92 SER CA C 92 58.600 58.600 57.775 0.825 17856 313 1 1 . 1 1 92 92 SER H H 92 8.297 8.297 8.369 -0.072 17856 314 1 1 . 1 1 93 93 GLN N N 93 121.916 121.916 123.865 -1.949 17856 315 1 1 . 1 1 93 93 GLN C C 93 175.971 175.971 175.515 0.456 17856 316 1 1 . 1 1 93 93 GLN H H 93 8.325 8.325 7.910 0.415 17856 317 1 1 . 1 1 94 94 SER N N 94 117.385 117.385 116.220 1.165 17856 318 1 1 . 1 1 94 94 SER C C 94 173.940 173.940 173.815 0.125 17856 319 1 1 . 1 1 94 94 SER CA C 94 58.520 58.520 59.667 -1.147 17856 320 1 1 . 1 1 94 94 SER H H 94 8.352 8.352 8.833 -0.481 17856 321 1 1 . 1 1 95 95 THR N N 95 120.756 120.756 114.284 6.472 17856 322 1 1 . 1 1 95 95 THR H H 95 7.805 7.805 7.502 0.303 17856 323 1 1 . 1 1 99 99 ARG C C 99 176.250 176.250 175.582 0.668 17856 324 1 1 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.358 -0.201 17856 325 1 1 . 1 1 100 100 ASN N N 100 118.482 118.482 119.265 -0.783 17856 326 1 1 . 1 1 100 100 ASN H H 100 8.272 8.272 8.515 -0.243 17856 327 1 1 . 1 1 101 101 ARG C C 101 176.280 176.280 174.287 1.993 17856 328 1 1 . 1 1 102 102 ASN N N 102 118.688 118.688 124.279 -5.591 17856 329 1 1 . 1 1 102 102 ASN C C 102 174.996 174.996 174.491 0.505 17856 330 1 1 . 1 1 102 102 ASN CA C 102 53.609 53.609 53.415 0.194 17856 331 1 1 . 1 1 102 102 ASN H H 102 8.424 8.424 8.658 -0.234 17856 332 1 1 . 1 1 103 103 ASN N N 103 118.865 118.865 119.361 -0.496 17856 333 1 1 . 1 1 103 103 ASN C C 103 175.040 175.040 174.268 0.772 17856 334 1 1 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.670 0.142 17856 335 1 1 . 1 1 103 103 ASN H H 103 8.282 8.282 8.488 -0.206 17856 336 1 1 . 1 1 104 104 ARG N N 104 120.875 120.875 115.311 5.564 17856 337 1 1 . 1 1 104 104 ARG H H 104 8.140 8.140 8.435 -0.295 17856 338 1 1 . 1 1 106 106 ILE C C 106 175.408 175.408 175.674 -0.266 17856 339 1 1 . 1 1 106 106 ILE CA C 106 61.395 61.395 62.137 -0.742 17856 340 1 2 . 1 1 2 2 SER N N 2 116.304 116.304 116.923 -0.619 17856 341 1 2 . 1 1 2 2 SER C C 2 174.710 174.710 173.677 1.033 17856 342 1 2 . 1 1 2 2 SER CA C 2 58.908 58.908 57.998 0.910 17856 343 1 2 . 1 1 2 2 SER H H 2 8.003 8.003 8.849 -0.846 17856 344 1 2 . 1 1 3 3 ILE N N 3 122.062 122.062 124.465 -2.403 17856 345 1 2 . 1 1 3 3 ILE C C 3 176.750 176.750 176.676 0.074 17856 346 1 2 . 1 1 3 3 ILE CA C 3 61.786 61.786 62.651 -0.865 17856 347 1 2 . 1 1 3 3 ILE H H 3 7.957 7.957 8.890 -0.933 17856 348 1 2 . 1 1 4 4 VAL N N 4 122.674 122.674 121.244 1.430 17856 349 1 2 . 1 1 4 4 VAL C C 4 176.221 176.221 176.078 0.143 17856 350 1 2 . 1 1 4 4 VAL CA C 4 62.970 62.970 64.339 -1.369 17856 351 1 2 . 1 1 4 4 VAL H H 4 7.970 7.970 7.820 0.150 17856 352 1 2 . 1 1 5 5 SER N N 5 117.750 117.750 114.518 3.232 17856 353 1 2 . 1 1 5 5 SER C C 5 174.858 174.858 175.283 -0.425 17856 354 1 2 . 1 1 5 5 SER CA C 5 58.630 58.630 59.758 -1.127 17856 355 1 2 . 1 1 5 5 SER H H 5 8.093 8.093 8.176 -0.083 17856 356 1 2 . 1 1 6 6 GLN N N 6 121.961 121.961 121.206 0.755 17856 357 1 2 . 1 1 6 6 GLN C C 6 176.467 176.467 177.459 -0.992 17856 358 1 2 . 1 1 6 6 GLN CA C 6 56.226 56.226 57.699 -1.473 17856 359 1 2 . 1 1 6 6 GLN H H 6 8.371 8.371 7.820 0.551 17856 360 1 2 . 1 1 7 7 THR N N 7 115.325 115.325 117.222 -1.897 17856 361 1 2 . 1 1 7 7 THR C C 7 174.752 174.752 176.949 -2.197 17856 362 1 2 . 1 1 7 7 THR H H 7 8.152 8.152 8.581 -0.429 17856 363 1 2 . 1 1 8 8 ARG N N 8 122.530 122.530 120.760 1.770 17856 364 1 2 . 1 1 8 8 ARG C C 8 176.200 176.200 178.370 -2.170 17856 365 1 2 . 1 1 8 8 ARG CA C 8 56.570 56.570 59.687 -3.117 17856 366 1 2 . 1 1 8 8 ARG H H 8 8.211 8.211 8.368 -0.157 17856 367 1 2 . 1 1 9 9 ASN N N 9 119.600 119.600 117.747 1.853 17856 368 1 2 . 1 1 9 9 ASN C C 9 177.164 177.164 177.174 -0.010 17856 369 1 2 . 1 1 9 9 ASN H H 9 8.398 8.398 7.865 0.533 17856 370 1 2 . 1 1 10 10 LYS N N 10 121.600 121.600 120.608 0.992 17856 371 1 2 . 1 1 10 10 LYS C C 10 176.845 176.845 178.748 -1.903 17856 372 1 2 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.167 -2.057 17856 373 1 2 . 1 1 10 10 LYS H H 10 8.190 8.190 7.766 0.424 17856 374 1 2 . 1 1 11 11 GLU N N 11 120.700 120.700 119.460 1.240 17856 375 1 2 . 1 1 11 11 GLU C C 11 176.825 176.825 178.746 -1.921 17856 376 1 2 . 1 1 11 11 GLU CA C 11 56.690 56.690 59.183 -2.493 17856 377 1 2 . 1 1 11 11 GLU H H 11 8.323 8.323 7.839 0.484 17856 378 1 2 . 1 1 12 12 LEU N N 12 122.390 122.390 121.708 0.682 17856 379 1 2 . 1 1 12 12 LEU C C 12 177.670 177.670 178.831 -1.161 17856 380 1 2 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.347 -2.877 17856 381 1 2 . 1 1 12 12 LEU H H 12 8.155 8.155 8.064 0.091 17856 382 1 2 . 1 1 13 13 LEU N N 13 122.570 122.570 116.502 6.068 17856 383 1 2 . 1 1 13 13 LEU C C 13 177.510 177.510 178.585 -1.075 17856 384 1 2 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.539 -2.958 17856 385 1 2 . 1 1 13 13 LEU H H 13 8.220 8.220 8.252 -0.032 17856 386 1 2 . 1 1 14 14 ASP N N 14 120.780 120.780 120.716 0.064 17856 387 1 2 . 1 1 14 14 ASP C C 14 176.480 176.480 178.633 -2.153 17856 388 1 2 . 1 1 14 14 ASP CA C 14 54.650 54.650 58.087 -3.437 17856 389 1 2 . 1 1 14 14 ASP H H 14 8.243 8.243 7.923 0.320 17856 390 1 2 . 1 1 15 15 LYS N N 15 120.900 120.900 119.117 1.783 17856 391 1 2 . 1 1 15 15 LYS C C 15 175.580 175.580 179.163 -3.583 17856 392 1 2 . 1 1 15 15 LYS H H 15 8.052 8.052 8.164 -0.112 17856 393 1 2 . 1 1 16 16 LYS N N 16 121.980 121.980 119.697 2.283 17856 394 1 2 . 1 1 16 16 LYS C C 16 176.887 176.887 178.921 -2.034 17856 395 1 2 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.590 -2.256 17856 396 1 2 . 1 1 16 16 LYS H H 16 8.243 8.243 7.656 0.587 17856 397 1 2 . 1 1 17 17 ILE N N 17 121.940 121.940 119.237 2.703 17856 398 1 2 . 1 1 17 17 ILE H H 17 8.110 8.110 8.185 -0.075 17856 399 1 2 . 1 1 18 18 ARG C C 18 176.520 176.520 178.526 -2.006 17856 400 1 2 . 1 1 19 19 SER N N 19 117.150 117.150 113.930 3.220 17856 401 1 2 . 1 1 19 19 SER C C 19 175.167 175.167 176.180 -1.013 17856 402 1 2 . 1 1 19 19 SER CA C 19 58.840 58.840 60.963 -2.123 17856 403 1 2 . 1 1 19 19 SER H H 19 8.396 8.396 7.739 0.657 17856 404 1 2 . 1 1 20 20 GLU N N 20 123.176 123.176 122.388 0.788 17856 405 1 2 . 1 1 20 20 GLU C C 20 176.921 176.921 178.857 -1.936 17856 406 1 2 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.199 -2.339 17856 407 1 2 . 1 1 20 20 GLU H H 20 8.478 8.478 7.423 1.055 17856 408 1 2 . 1 1 21 21 ILE N N 21 120.550 120.550 115.970 4.580 17856 409 1 2 . 1 1 21 21 ILE C C 21 176.550 176.550 177.868 -1.318 17856 410 1 2 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.821 -3.191 17856 411 1 2 . 1 1 21 21 ILE H H 21 8.080 8.080 7.447 0.633 17856 412 1 2 . 1 1 22 22 GLU N N 22 123.685 123.685 120.940 2.745 17856 413 1 2 . 1 1 22 22 GLU C C 22 176.109 176.109 178.779 -2.670 17856 414 1 2 . 1 1 22 22 GLU H H 22 8.309 8.309 7.732 0.577 17856 415 1 2 . 1 1 23 23 ALA N N 23 124.280 124.280 122.576 1.704 17856 416 1 2 . 1 1 23 23 ALA C C 23 178.474 178.474 179.761 -1.287 17856 417 1 2 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.129 -1.723 17856 418 1 2 . 1 1 23 23 ALA H H 23 8.088 8.088 7.953 0.135 17856 419 1 2 . 1 1 24 24 ILE N N 24 120.330 120.330 118.744 1.586 17856 420 1 2 . 1 1 24 24 ILE C C 24 176.309 176.309 177.821 -1.512 17856 421 1 2 . 1 1 24 24 ILE CA C 24 61.540 61.540 65.058 -3.518 17856 422 1 2 . 1 1 24 24 ILE H H 24 7.980 7.980 7.916 0.064 17856 423 1 2 . 1 1 25 25 LYS N N 25 124.310 124.310 120.025 4.285 17856 424 1 2 . 1 1 25 25 LYS C C 25 176.365 176.365 178.875 -2.510 17856 425 1 2 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.108 -2.775 17856 426 1 2 . 1 1 25 25 LYS H H 25 8.198 8.198 8.138 0.060 17856 427 1 2 . 1 1 26 26 LYS N N 26 122.518 122.518 118.719 3.799 17856 428 1 2 . 1 1 26 26 LYS C C 26 176.365 176.365 178.773 -2.408 17856 429 1 2 . 1 1 26 26 LYS CA C 26 56.175 56.175 58.421 -2.246 17856 430 1 2 . 1 1 26 26 LYS H H 26 8.125 8.125 7.490 0.635 17856 431 1 2 . 1 1 27 27 ILE N N 27 122.670 122.670 120.197 2.473 17856 432 1 2 . 1 1 27 27 ILE C C 27 176.261 176.261 177.862 -1.601 17856 433 1 2 . 1 1 27 27 ILE CA C 27 61.294 61.294 65.003 -3.709 17856 434 1 2 . 1 1 27 27 ILE H H 27 8.114 8.114 7.736 0.378 17856 435 1 2 . 1 1 28 28 ILE N N 28 125.178 125.178 119.167 6.011 17856 436 1 2 . 1 1 28 28 ILE C C 28 175.803 175.803 176.484 -0.681 17856 437 1 2 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.796 -2.716 17856 438 1 2 . 1 1 28 28 ILE H H 28 8.220 8.220 8.065 0.155 17856 439 1 2 . 1 1 29 29 ALA N N 29 127.850 127.850 121.022 6.828 17856 440 1 2 . 1 1 29 29 ALA C C 29 177.627 177.627 179.517 -1.890 17856 441 1 2 . 1 1 29 29 ALA CA C 29 53.684 53.684 54.747 -1.063 17856 442 1 2 . 1 1 29 29 ALA H H 29 8.300 8.300 7.128 1.172 17856 443 1 2 . 1 1 30 30 GLU N N 30 120.000 120.000 119.365 0.635 17856 444 1 2 . 1 1 30 30 GLU C C 30 176.321 176.321 178.791 -2.470 17856 445 1 2 . 1 1 30 30 GLU H H 30 8.258 8.258 7.566 0.692 17856 446 1 2 . 1 1 31 31 PHE N N 31 119.128 119.128 117.297 1.831 17856 447 1 2 . 1 1 31 31 PHE C C 31 175.180 175.180 178.204 -3.024 17856 448 1 2 . 1 1 31 31 PHE CA C 31 57.540 57.540 59.982 -2.442 17856 449 1 2 . 1 1 31 31 PHE H H 31 8.061 8.061 7.354 0.707 17856 450 1 2 . 1 1 32 32 ASP N N 32 121.800 121.800 119.777 2.023 17856 451 1 2 . 1 1 32 32 ASP C C 32 175.894 175.894 178.535 -2.641 17856 452 1 2 . 1 1 32 32 ASP CA C 32 54.529 54.529 57.209 -2.680 17856 453 1 2 . 1 1 32 32 ASP H H 32 8.275 8.275 7.608 0.667 17856 454 1 2 . 1 1 33 33 VAL N N 33 119.648 119.648 120.008 -0.360 17856 455 1 2 . 1 1 33 33 VAL C C 33 176.268 176.268 178.155 -1.887 17856 456 1 2 . 1 1 33 33 VAL CA C 33 62.500 62.500 66.308 -3.808 17856 457 1 2 . 1 1 33 33 VAL H H 33 8.059 8.059 7.671 0.388 17856 458 1 2 . 1 1 34 34 VAL N N 34 123.882 123.882 117.787 6.095 17856 459 1 2 . 1 1 34 34 VAL H H 34 7.774 7.774 8.079 -0.305 17856 460 1 2 . 1 1 35 35 LYS N N 35 125.250 125.250 120.838 4.412 17856 461 1 2 . 1 1 35 35 LYS C C 35 176.719 176.719 178.623 -1.904 17856 462 1 2 . 1 1 35 35 LYS CA C 35 56.502 56.502 59.436 -2.934 17856 463 1 2 . 1 1 35 35 LYS H H 35 8.357 8.357 7.592 0.765 17856 464 1 2 . 1 1 36 36 GLU N N 36 121.850 121.850 117.335 4.515 17856 465 1 2 . 1 1 36 36 GLU C C 36 176.426 176.426 177.943 -1.517 17856 466 1 2 . 1 1 36 36 GLU H H 36 8.423 8.423 8.375 0.048 17856 467 1 2 . 1 1 37 37 SER N N 37 117.100 117.100 114.214 2.886 17856 468 1 2 . 1 1 37 37 SER C C 37 174.854 174.854 174.604 0.250 17856 469 1 2 . 1 1 37 37 SER CA C 37 58.850 58.850 60.614 -1.764 17856 470 1 2 . 1 1 37 37 SER H H 37 8.362 8.362 7.729 0.633 17856 471 1 2 . 1 1 38 38 VAL N N 38 121.625 121.625 117.520 4.105 17856 472 1 2 . 1 1 38 38 VAL C C 38 176.246 176.246 173.974 2.272 17856 473 1 2 . 1 1 38 38 VAL CA C 38 63.043 63.043 59.969 3.074 17856 474 1 2 . 1 1 38 38 VAL H H 38 8.225 8.225 7.441 0.784 17856 475 1 2 . 1 1 39 39 ASN N N 39 121.150 121.150 123.169 -2.019 17856 476 1 2 . 1 1 39 39 ASN C C 39 175.459 175.459 175.639 -0.180 17856 477 1 2 . 1 1 39 39 ASN CA C 39 53.568 53.568 53.962 -0.395 17856 478 1 2 . 1 1 39 39 ASN H H 39 8.366 8.366 8.467 -0.101 17856 479 1 2 . 1 1 40 40 GLU N N 40 121.500 121.500 120.384 1.116 17856 480 1 2 . 1 1 40 40 GLU C C 40 175.459 175.459 176.012 -0.553 17856 481 1 2 . 1 1 40 40 GLU CA C 40 56.860 56.860 56.262 0.598 17856 482 1 2 . 1 1 40 40 GLU H H 40 8.370 8.370 8.674 -0.304 17856 483 1 2 . 1 1 41 41 LEU N N 41 121.950 121.950 121.589 0.361 17856 484 1 2 . 1 1 41 41 LEU C C 41 177.939 177.939 176.225 1.714 17856 485 1 2 . 1 1 41 41 LEU CA C 41 56.040 56.040 54.025 2.015 17856 486 1 2 . 1 1 41 41 LEU H H 41 8.152 8.152 7.868 0.284 17856 487 1 2 . 1 1 42 42 SER N N 42 113.326 113.326 116.057 -2.731 17856 488 1 2 . 1 1 42 42 SER C C 42 174.660 174.660 175.876 -1.216 17856 489 1 2 . 1 1 42 42 SER CA C 42 58.940 58.940 59.304 -0.364 17856 490 1 2 . 1 1 42 42 SER H H 42 8.373 8.373 7.521 0.852 17856 491 1 2 . 1 1 43 43 GLU N N 43 121.521 121.521 122.387 -0.866 17856 492 1 2 . 1 1 43 43 GLU C C 43 177.349 177.349 178.442 -1.093 17856 493 1 2 . 1 1 43 43 GLU H H 43 7.329 7.329 8.645 -1.316 17856 494 1 2 . 1 1 44 44 LYS N N 44 121.240 121.240 119.354 1.886 17856 495 1 2 . 1 1 44 44 LYS C C 44 177.246 177.246 178.249 -1.003 17856 496 1 2 . 1 1 44 44 LYS CA C 44 56.397 56.397 58.989 -2.592 17856 497 1 2 . 1 1 44 44 LYS H H 44 8.103 8.103 8.330 -0.227 17856 498 1 2 . 1 1 45 45 ALA N N 45 119.568 119.568 120.889 -1.321 17856 499 1 2 . 1 1 45 45 ALA C C 45 177.853 177.853 179.191 -1.338 17856 500 1 2 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.667 -2.107 17856 501 1 2 . 1 1 45 45 ALA H H 45 8.541 8.541 7.393 1.148 17856 502 1 2 . 1 1 46 46 LYS N N 46 115.235 115.235 117.407 -2.172 17856 503 1 2 . 1 1 46 46 LYS C C 46 177.110 177.110 178.780 -1.670 17856 504 1 2 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.635 -1.839 17856 505 1 2 . 1 1 46 46 LYS H H 46 7.257 7.257 7.537 -0.280 17856 506 1 2 . 1 1 47 47 THR N N 47 103.239 103.239 109.541 -6.302 17856 507 1 2 . 1 1 47 47 THR C C 47 173.973 173.973 174.833 -0.860 17856 508 1 2 . 1 1 47 47 THR CA C 47 62.740 62.740 63.110 -0.370 17856 509 1 2 . 1 1 47 47 THR H H 47 7.381 7.381 7.737 -0.356 17856 510 1 2 . 1 1 48 48 ASP N N 48 122.976 122.976 121.713 1.263 17856 511 1 2 . 1 1 48 48 ASP H H 48 8.031 8.031 7.905 0.126 17856 512 1 2 . 1 1 49 49 PRO C C 49 178.106 178.106 178.275 -0.169 17856 513 1 2 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.899 -0.680 17856 514 1 2 . 1 1 50 50 GLN N N 50 118.351 118.351 118.662 -0.311 17856 515 1 2 . 1 1 50 50 GLN C C 50 176.944 176.944 178.195 -1.251 17856 516 1 2 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.779 -1.979 17856 517 1 2 . 1 1 50 50 GLN H H 50 8.304 8.304 8.071 0.233 17856 518 1 2 . 1 1 51 51 ALA N N 51 124.206 124.206 121.968 2.238 17856 519 1 2 . 1 1 51 51 ALA C C 51 178.490 178.490 179.342 -0.852 17856 520 1 2 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.733 -1.309 17856 521 1 2 . 1 1 51 51 ALA H H 51 7.547 7.547 8.696 -1.149 17856 522 1 2 . 1 1 52 52 ALA N N 52 118.686 118.686 119.938 -1.252 17856 523 1 2 . 1 1 52 52 ALA C C 52 177.953 177.953 179.165 -1.212 17856 524 1 2 . 1 1 52 52 ALA H H 52 7.931 7.931 7.888 0.043 17856 525 1 2 . 1 1 53 53 GLU N N 53 120.075 120.075 118.779 1.296 17856 526 1 2 . 1 1 53 53 GLU H H 53 7.729 7.729 7.596 0.133 17856 527 1 2 . 1 1 55 55 LEU N N 55 123.640 123.640 120.047 3.593 17856 528 1 2 . 1 1 55 55 LEU C C 55 177.587 177.587 179.033 -1.446 17856 529 1 2 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.524 -1.737 17856 530 1 2 . 1 1 55 55 LEU H H 55 8.215 8.215 8.508 -0.293 17856 531 1 2 . 1 1 56 56 ASN N N 56 118.520 118.520 116.431 2.089 17856 532 1 2 . 1 1 56 56 ASN C C 56 175.700 175.700 177.256 -1.556 17856 533 1 2 . 1 1 56 56 ASN CA C 56 54.132 54.132 55.377 -1.245 17856 534 1 2 . 1 1 56 56 ASN H H 56 8.250 8.250 7.807 0.443 17856 535 1 2 . 1 1 57 57 LYS N N 57 120.960 120.960 118.509 2.451 17856 536 1 2 . 1 1 57 57 LYS C C 57 176.637 176.637 177.696 -1.059 17856 537 1 2 . 1 1 57 57 LYS H H 57 8.065 8.065 7.906 0.159 17856 538 1 2 . 1 1 58 58 LEU N N 58 122.610 122.610 121.634 0.976 17856 539 1 2 . 1 1 58 58 LEU C C 58 177.433 177.433 175.378 2.055 17856 540 1 2 . 1 1 58 58 LEU CA C 58 55.120 55.120 53.680 1.440 17856 541 1 2 . 1 1 58 58 LEU H H 58 8.135 8.135 8.390 -0.255 17856 542 1 2 . 1 1 59 59 ILE N N 59 122.045 122.045 122.324 -0.279 17856 543 1 2 . 1 1 59 59 ILE CA C 59 61.535 61.535 61.433 0.102 17856 544 1 2 . 1 1 59 59 ILE H H 59 8.220 8.220 8.021 0.199 17856 545 1 2 . 1 1 60 60 GLU N N 60 124.000 124.000 120.486 3.514 17856 546 1 2 . 1 1 60 60 GLU C C 60 177.007 177.007 176.813 0.194 17856 547 1 2 . 1 1 60 60 GLU CA C 60 56.722 56.722 56.249 0.473 17856 548 1 2 . 1 1 60 60 GLU H H 60 8.340 8.340 8.011 0.329 17856 549 1 2 . 1 1 61 61 GLY N N 61 110.520 110.520 111.537 -1.017 17856 550 1 2 . 1 1 61 61 GLY C C 61 174.002 174.002 175.672 -1.670 17856 551 1 2 . 1 1 61 61 GLY CA C 61 45.405 45.405 45.214 0.191 17856 552 1 2 . 1 1 61 61 GLY H H 61 8.557 8.557 8.596 -0.039 17856 553 1 2 . 1 1 62 62 TYR N N 62 119.600 119.600 121.374 -1.774 17856 554 1 2 . 1 1 62 62 TYR C C 62 175.940 175.940 176.459 -0.519 17856 555 1 2 . 1 1 62 62 TYR CA C 62 58.108 58.108 58.614 -0.506 17856 556 1 2 . 1 1 62 62 TYR H H 62 7.980 7.980 8.329 -0.349 17856 557 1 2 . 1 1 63 63 THR N N 63 116.304 116.304 112.803 3.501 17856 558 1 2 . 1 1 63 63 THR C C 63 173.796 173.796 175.166 -1.370 17856 559 1 2 . 1 1 63 63 THR H H 63 8.049 8.049 7.773 0.276 17856 560 1 2 . 1 1 64 64 TYR N N 64 122.050 122.050 122.433 -0.383 17856 561 1 2 . 1 1 64 64 TYR C C 64 176.290 176.290 175.692 0.598 17856 562 1 2 . 1 1 64 64 TYR CA C 64 58.533 58.533 59.393 -0.860 17856 563 1 2 . 1 1 64 64 TYR H H 64 8.133 8.133 7.676 0.457 17856 564 1 2 . 1 1 65 65 GLY N N 65 110.456 110.456 112.854 -2.398 17856 565 1 2 . 1 1 65 65 GLY C C 65 174.340 174.340 173.945 0.395 17856 566 1 2 . 1 1 65 65 GLY CA C 65 45.328 45.328 45.781 -0.453 17856 567 1 2 . 1 1 65 65 GLY H H 65 7.747 7.747 8.520 -0.773 17856 568 1 2 . 1 1 66 66 GLU N N 66 120.783 120.783 121.805 -1.022 17856 569 1 2 . 1 1 66 66 GLU C C 66 176.895 176.895 176.187 0.708 17856 570 1 2 . 1 1 66 66 GLU CA C 66 56.804 56.804 55.641 1.163 17856 571 1 2 . 1 1 66 66 GLU H H 66 8.243 8.243 8.393 -0.150 17856 572 1 2 . 1 1 67 67 GLU N N 67 121.587 121.587 122.627 -1.040 17856 573 1 2 . 1 1 67 67 GLU C C 67 176.340 176.340 177.109 -0.769 17856 574 1 2 . 1 1 67 67 GLU H H 67 8.611 8.611 8.504 0.107 17856 575 1 2 . 1 1 68 68 ARG N N 68 121.790 121.790 120.522 1.268 17856 576 1 2 . 1 1 68 68 ARG C C 68 176.350 176.350 175.608 0.742 17856 577 1 2 . 1 1 68 68 ARG H H 68 8.267 8.267 7.925 0.342 17856 578 1 2 . 1 1 69 69 LYS N N 69 118.431 118.431 119.640 -1.209 17856 579 1 2 . 1 1 69 69 LYS H H 69 7.567 7.567 7.714 -0.147 17856 580 1 2 . 1 1 70 70 LEU C C 70 177.338 177.338 179.232 -1.894 17856 581 1 2 . 1 1 70 70 LEU CA C 70 55.533 55.533 56.877 -1.343 17856 582 1 2 . 1 1 71 71 TYR N N 71 119.504 119.504 117.091 2.413 17856 583 1 2 . 1 1 71 71 TYR H H 71 7.997 7.997 7.629 0.368 17856 584 1 2 . 1 1 72 72 ASP C C 72 176.528 176.528 177.823 -1.295 17856 585 1 2 . 1 1 72 72 ASP CA C 72 54.693 54.693 56.515 -1.822 17856 586 1 2 . 1 1 73 73 SER N N 73 117.000 117.000 115.550 1.450 17856 587 1 2 . 1 1 73 73 SER C C 73 174.950 174.950 175.908 -0.958 17856 588 1 2 . 1 1 73 73 SER CA C 73 58.997 58.997 60.953 -1.956 17856 589 1 2 . 1 1 73 73 SER H H 73 8.282 8.282 7.615 0.667 17856 590 1 2 . 1 1 74 74 ALA N N 74 125.422 125.422 124.764 0.658 17856 591 1 2 . 1 1 74 74 ALA C C 74 178.389 178.389 179.133 -0.744 17856 592 1 2 . 1 1 74 74 ALA CA C 74 53.433 53.433 54.839 -1.406 17856 593 1 2 . 1 1 74 74 ALA H H 74 8.339 8.339 7.584 0.755 17856 594 1 2 . 1 1 75 75 LEU N N 75 120.019 120.019 119.001 1.018 17856 595 1 2 . 1 1 75 75 LEU C C 75 177.954 177.954 179.120 -1.166 17856 596 1 2 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.441 -1.661 17856 597 1 2 . 1 1 75 75 LEU H H 75 7.948 7.948 7.625 0.323 17856 598 1 2 . 1 1 76 76 SER N N 76 113.321 113.321 114.816 -1.495 17856 599 1 2 . 1 1 76 76 SER C C 76 174.784 174.784 176.766 -1.982 17856 600 1 2 . 1 1 76 76 SER CA C 76 59.173 59.173 61.987 -2.814 17856 601 1 2 . 1 1 76 76 SER H H 76 7.951 7.951 7.728 0.223 17856 602 1 2 . 1 1 77 77 LYS N N 77 122.710 122.710 122.253 0.457 17856 603 1 2 . 1 1 77 77 LYS C C 77 176.734 176.734 179.186 -2.452 17856 604 1 2 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.156 -0.766 17856 605 1 2 . 1 1 77 77 LYS H H 77 8.170 8.170 7.302 0.868 17856 606 1 2 . 1 1 78 78 ILE N N 78 121.521 121.521 118.969 2.552 17856 607 1 2 . 1 1 78 78 ILE C C 78 176.512 176.512 178.113 -1.601 17856 608 1 2 . 1 1 78 78 ILE H H 78 8.160 8.160 7.930 0.230 17856 609 1 2 . 1 1 79 79 GLU N N 79 123.840 123.840 120.859 2.981 17856 610 1 2 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.342 -3.864 17856 611 1 2 . 1 1 79 79 GLU H H 79 8.360 8.360 8.087 0.273 17856 612 1 2 . 1 1 80 80 LYS N N 80 122.143 122.143 119.550 2.593 17856 613 1 2 . 1 1 80 80 LYS C C 80 176.937 176.937 178.909 -1.972 17856 614 1 2 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.079 -2.579 17856 615 1 2 . 1 1 80 80 LYS H H 80 8.231 8.231 7.547 0.684 17856 616 1 2 . 1 1 81 81 LEU N N 81 122.095 122.095 122.364 -0.269 17856 617 1 2 . 1 1 81 81 LEU C C 81 177.531 177.531 178.604 -1.073 17856 618 1 2 . 1 1 81 81 LEU H H 81 8.050 8.050 7.433 0.617 17856 619 1 2 . 1 1 82 82 ILE N N 82 120.609 120.609 117.799 2.810 17856 620 1 2 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.086 -3.726 17856 621 1 2 . 1 1 82 82 ILE H H 82 8.000 8.000 7.635 0.365 17856 622 1 2 . 1 1 83 83 GLU N N 83 124.611 124.611 120.896 3.715 17856 623 1 2 . 1 1 83 83 GLU C C 83 177.298 177.298 179.325 -2.027 17856 624 1 2 . 1 1 83 83 GLU H H 83 8.380 8.380 7.990 0.390 17856 625 1 2 . 1 1 84 84 THR N N 84 115.107 115.107 116.360 -1.253 17856 626 1 2 . 1 1 84 84 THR C C 84 174.400 174.400 175.612 -1.212 17856 627 1 2 . 1 1 84 84 THR CA C 84 62.659 62.659 65.901 -3.242 17856 628 1 2 . 1 1 84 84 THR H H 84 8.064 8.064 8.161 -0.097 17856 629 1 2 . 1 1 85 85 LEU N N 85 124.150 124.150 118.982 5.168 17856 630 1 2 . 1 1 85 85 LEU C C 85 177.120 177.120 176.433 0.687 17856 631 1 2 . 1 1 85 85 LEU CA C 85 55.020 55.020 54.950 0.070 17856 632 1 2 . 1 1 85 85 LEU H H 85 8.238 8.238 7.284 0.954 17856 633 1 2 . 1 1 86 86 SER N N 86 114.913 114.913 116.314 -1.401 17856 634 1 2 . 1 1 86 86 SER H H 86 7.678 7.678 7.548 0.130 17856 635 1 2 . 1 1 87 87 PRO CA C 87 63.550 63.550 64.783 -1.233 17856 636 1 2 . 1 1 88 88 ALA N N 88 123.767 123.767 119.164 4.603 17856 637 1 2 . 1 1 88 88 ALA C C 88 178.131 178.131 178.460 -0.329 17856 638 1 2 . 1 1 88 88 ALA CA C 88 52.878 52.878 54.240 -1.362 17856 639 1 2 . 1 1 88 88 ALA H H 88 8.342 8.342 8.192 0.150 17856 640 1 2 . 1 1 89 89 ARG N N 89 119.159 119.159 120.517 -1.358 17856 641 1 2 . 1 1 89 89 ARG C C 89 176.620 176.620 175.518 1.102 17856 642 1 2 . 1 1 89 89 ARG H H 89 8.133 8.133 8.856 -0.723 17856 643 1 2 . 1 1 90 90 SER N N 90 116.910 116.910 115.423 1.487 17856 644 1 2 . 1 1 90 90 SER C C 90 174.887 174.887 173.088 1.799 17856 645 1 2 . 1 1 90 90 SER H H 90 8.322 8.322 8.167 0.155 17856 646 1 2 . 1 1 91 91 LYS N N 91 123.457 123.457 122.691 0.766 17856 647 1 2 . 1 1 91 91 LYS C C 91 176.970 176.970 176.191 0.779 17856 648 1 2 . 1 1 91 91 LYS H H 91 8.396 8.396 8.553 -0.157 17856 649 1 2 . 1 1 92 92 SER N N 92 116.692 116.692 119.881 -3.189 17856 650 1 2 . 1 1 92 92 SER C C 92 174.573 174.573 174.920 -0.347 17856 651 1 2 . 1 1 92 92 SER CA C 92 58.600 58.600 57.975 0.625 17856 652 1 2 . 1 1 92 92 SER H H 92 8.297 8.297 8.882 -0.585 17856 653 1 2 . 1 1 93 93 GLN N N 93 121.916 121.916 121.309 0.607 17856 654 1 2 . 1 1 93 93 GLN C C 93 175.971 175.971 175.135 0.836 17856 655 1 2 . 1 1 93 93 GLN H H 93 8.325 8.325 7.823 0.502 17856 656 1 2 . 1 1 94 94 SER N N 94 117.385 117.385 114.497 2.888 17856 657 1 2 . 1 1 94 94 SER C C 94 173.940 173.940 173.807 0.133 17856 658 1 2 . 1 1 94 94 SER CA C 94 58.520 58.520 58.946 -0.426 17856 659 1 2 . 1 1 94 94 SER H H 94 8.352 8.352 8.087 0.265 17856 660 1 2 . 1 1 95 95 THR N N 95 120.756 120.756 115.106 5.650 17856 661 1 2 . 1 1 95 95 THR H H 95 7.805 7.805 8.120 -0.315 17856 662 1 2 . 1 1 99 99 ARG C C 99 176.250 176.250 176.399 -0.149 17856 663 1 2 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.450 -0.293 17856 664 1 2 . 1 1 100 100 ASN N N 100 118.482 118.482 116.320 2.162 17856 665 1 2 . 1 1 100 100 ASN H H 100 8.272 8.272 8.573 -0.301 17856 666 1 2 . 1 1 101 101 ARG C C 101 176.280 176.280 176.491 -0.211 17856 667 1 2 . 1 1 102 102 ASN N N 102 118.688 118.688 121.911 -3.223 17856 668 1 2 . 1 1 102 102 ASN C C 102 174.996 174.996 174.678 0.318 17856 669 1 2 . 1 1 102 102 ASN CA C 102 53.609 53.609 54.233 -0.624 17856 670 1 2 . 1 1 102 102 ASN H H 102 8.424 8.424 8.587 -0.163 17856 671 1 2 . 1 1 103 103 ASN N N 103 118.865 118.865 118.713 0.152 17856 672 1 2 . 1 1 103 103 ASN C C 103 175.040 175.040 174.486 0.554 17856 673 1 2 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.584 0.228 17856 674 1 2 . 1 1 103 103 ASN H H 103 8.282 8.282 8.329 -0.048 17856 675 1 2 . 1 1 104 104 ARG N N 104 120.875 120.875 117.981 2.894 17856 676 1 2 . 1 1 104 104 ARG H H 104 8.140 8.140 8.412 -0.272 17856 677 1 2 . 1 1 106 106 ILE C C 106 175.408 175.408 174.895 0.513 17856 678 1 2 . 1 1 106 106 ILE CA C 106 61.395 61.395 61.024 0.371 17856 679 1 3 . 1 1 2 2 SER N N 2 116.304 116.304 118.930 -2.626 17856 680 1 3 . 1 1 2 2 SER C C 2 174.710 174.710 176.349 -1.639 17856 681 1 3 . 1 1 2 2 SER CA C 2 58.908 58.908 60.160 -1.252 17856 682 1 3 . 1 1 2 2 SER H H 2 8.003 8.003 8.649 -0.646 17856 683 1 3 . 1 1 3 3 ILE N N 3 122.062 122.062 122.191 -0.129 17856 684 1 3 . 1 1 3 3 ILE C C 3 176.750 176.750 176.895 -0.145 17856 685 1 3 . 1 1 3 3 ILE CA C 3 61.786 61.786 63.285 -1.499 17856 686 1 3 . 1 1 3 3 ILE H H 3 7.957 7.957 7.899 0.058 17856 687 1 3 . 1 1 4 4 VAL N N 4 122.674 122.674 117.919 4.755 17856 688 1 3 . 1 1 4 4 VAL C C 4 176.221 176.221 176.780 -0.559 17856 689 1 3 . 1 1 4 4 VAL CA C 4 62.970 62.970 63.264 -0.294 17856 690 1 3 . 1 1 4 4 VAL H H 4 7.970 7.970 7.360 0.610 17856 691 1 3 . 1 1 5 5 SER N N 5 117.750 117.750 117.234 0.516 17856 692 1 3 . 1 1 5 5 SER C C 5 174.858 174.858 176.874 -2.016 17856 693 1 3 . 1 1 5 5 SER CA C 5 58.630 58.630 62.262 -3.632 17856 694 1 3 . 1 1 5 5 SER H H 5 8.093 8.093 7.619 0.474 17856 695 1 3 . 1 1 6 6 GLN N N 6 121.961 121.961 120.595 1.366 17856 696 1 3 . 1 1 6 6 GLN C C 6 176.467 176.467 177.396 -0.929 17856 697 1 3 . 1 1 6 6 GLN CA C 6 56.226 56.226 58.329 -2.103 17856 698 1 3 . 1 1 6 6 GLN H H 6 8.371 8.371 8.568 -0.197 17856 699 1 3 . 1 1 7 7 THR N N 7 115.325 115.325 111.026 4.299 17856 700 1 3 . 1 1 7 7 THR C C 7 174.752 174.752 176.375 -1.623 17856 701 1 3 . 1 1 7 7 THR H H 7 8.152 8.152 7.330 0.822 17856 702 1 3 . 1 1 8 8 ARG N N 8 122.530 122.530 121.613 0.917 17856 703 1 3 . 1 1 8 8 ARG C C 8 176.200 176.200 178.484 -2.284 17856 704 1 3 . 1 1 8 8 ARG CA C 8 56.570 56.570 58.619 -2.049 17856 705 1 3 . 1 1 8 8 ARG H H 8 8.211 8.211 8.065 0.146 17856 706 1 3 . 1 1 9 9 ASN N N 9 119.600 119.600 117.906 1.694 17856 707 1 3 . 1 1 9 9 ASN C C 9 177.164 177.164 176.955 0.209 17856 708 1 3 . 1 1 9 9 ASN H H 9 8.398 8.398 8.331 0.067 17856 709 1 3 . 1 1 10 10 LYS N N 10 121.600 121.600 120.554 1.046 17856 710 1 3 . 1 1 10 10 LYS C C 10 176.845 176.845 178.869 -2.024 17856 711 1 3 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.077 -1.967 17856 712 1 3 . 1 1 10 10 LYS H H 10 8.190 8.190 7.966 0.224 17856 713 1 3 . 1 1 11 11 GLU N N 11 120.700 120.700 119.449 1.251 17856 714 1 3 . 1 1 11 11 GLU C C 11 176.825 176.825 178.646 -1.821 17856 715 1 3 . 1 1 11 11 GLU CA C 11 56.690 56.690 58.988 -2.298 17856 716 1 3 . 1 1 11 11 GLU H H 11 8.323 8.323 7.957 0.366 17856 717 1 3 . 1 1 12 12 LEU N N 12 122.390 122.390 121.619 0.771 17856 718 1 3 . 1 1 12 12 LEU C C 12 177.670 177.670 178.808 -1.138 17856 719 1 3 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.239 -2.769 17856 720 1 3 . 1 1 12 12 LEU H H 12 8.155 8.155 8.001 0.154 17856 721 1 3 . 1 1 13 13 LEU N N 13 122.570 122.570 115.880 6.690 17856 722 1 3 . 1 1 13 13 LEU C C 13 177.510 177.510 178.539 -1.029 17856 723 1 3 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.161 -2.580 17856 724 1 3 . 1 1 13 13 LEU H H 13 8.220 8.220 7.896 0.324 17856 725 1 3 . 1 1 14 14 ASP N N 14 120.780 120.780 120.773 0.007 17856 726 1 3 . 1 1 14 14 ASP C C 14 176.480 176.480 178.377 -1.897 17856 727 1 3 . 1 1 14 14 ASP CA C 14 54.650 54.650 57.543 -2.893 17856 728 1 3 . 1 1 14 14 ASP H H 14 8.243 8.243 7.681 0.562 17856 729 1 3 . 1 1 15 15 LYS N N 15 120.900 120.900 119.296 1.604 17856 730 1 3 . 1 1 15 15 LYS C C 15 175.580 175.580 179.227 -3.647 17856 731 1 3 . 1 1 15 15 LYS H H 15 8.052 8.052 7.845 0.207 17856 732 1 3 . 1 1 16 16 LYS N N 16 121.980 121.980 119.997 1.983 17856 733 1 3 . 1 1 16 16 LYS C C 16 176.887 176.887 178.882 -1.995 17856 734 1 3 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.727 -2.393 17856 735 1 3 . 1 1 16 16 LYS H H 16 8.243 8.243 7.503 0.740 17856 736 1 3 . 1 1 17 17 ILE N N 17 121.940 121.940 119.503 2.437 17856 737 1 3 . 1 1 17 17 ILE H H 17 8.110 8.110 8.102 0.008 17856 738 1 3 . 1 1 18 18 ARG C C 18 176.520 176.520 178.615 -2.095 17856 739 1 3 . 1 1 19 19 SER N N 19 117.150 117.150 115.663 1.487 17856 740 1 3 . 1 1 19 19 SER C C 19 175.167 175.167 176.347 -1.180 17856 741 1 3 . 1 1 19 19 SER CA C 19 58.840 58.840 61.948 -3.108 17856 742 1 3 . 1 1 19 19 SER H H 19 8.396 8.396 7.837 0.559 17856 743 1 3 . 1 1 20 20 GLU N N 20 123.176 123.176 121.791 1.385 17856 744 1 3 . 1 1 20 20 GLU C C 20 176.921 176.921 179.024 -2.103 17856 745 1 3 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.153 -2.293 17856 746 1 3 . 1 1 20 20 GLU H H 20 8.478 8.478 7.765 0.713 17856 747 1 3 . 1 1 21 21 ILE N N 21 120.550 120.550 115.444 5.106 17856 748 1 3 . 1 1 21 21 ILE C C 21 176.550 176.550 178.048 -1.498 17856 749 1 3 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.602 -2.972 17856 750 1 3 . 1 1 21 21 ILE H H 21 8.080 8.080 7.449 0.631 17856 751 1 3 . 1 1 22 22 GLU N N 22 123.685 123.685 120.435 3.250 17856 752 1 3 . 1 1 22 22 GLU C C 22 176.109 176.109 178.752 -2.643 17856 753 1 3 . 1 1 22 22 GLU H H 22 8.309 8.309 7.673 0.636 17856 754 1 3 . 1 1 23 23 ALA N N 23 124.280 124.280 122.552 1.728 17856 755 1 3 . 1 1 23 23 ALA C C 23 178.474 178.474 179.788 -1.314 17856 756 1 3 . 1 1 23 23 ALA CA C 23 53.406 53.406 54.944 -1.538 17856 757 1 3 . 1 1 23 23 ALA H H 23 8.088 8.088 7.863 0.225 17856 758 1 3 . 1 1 24 24 ILE N N 24 120.330 120.330 119.308 1.022 17856 759 1 3 . 1 1 24 24 ILE C C 24 176.309 176.309 177.593 -1.284 17856 760 1 3 . 1 1 24 24 ILE CA C 24 61.540 61.540 63.977 -2.437 17856 761 1 3 . 1 1 24 24 ILE H H 24 7.980 7.980 7.989 -0.009 17856 762 1 3 . 1 1 25 25 LYS N N 25 124.310 124.310 119.225 5.085 17856 763 1 3 . 1 1 25 25 LYS C C 25 176.365 176.365 178.358 -1.993 17856 764 1 3 . 1 1 25 25 LYS CA C 25 56.334 56.334 58.829 -2.495 17856 765 1 3 . 1 1 25 25 LYS H H 25 8.198 8.198 7.826 0.372 17856 766 1 3 . 1 1 26 26 LYS N N 26 122.518 122.518 118.385 4.133 17856 767 1 3 . 1 1 26 26 LYS C C 26 176.365 176.365 178.246 -1.881 17856 768 1 3 . 1 1 26 26 LYS CA C 26 56.175 56.175 58.343 -2.168 17856 769 1 3 . 1 1 26 26 LYS H H 26 8.125 8.125 7.291 0.834 17856 770 1 3 . 1 1 27 27 ILE N N 27 122.670 122.670 120.704 1.966 17856 771 1 3 . 1 1 27 27 ILE C C 27 176.261 176.261 178.155 -1.894 17856 772 1 3 . 1 1 27 27 ILE CA C 27 61.294 61.294 64.597 -3.303 17856 773 1 3 . 1 1 27 27 ILE H H 27 8.114 8.114 8.031 0.083 17856 774 1 3 . 1 1 28 28 ILE N N 28 125.178 125.178 119.105 6.073 17856 775 1 3 . 1 1 28 28 ILE C C 28 175.803 175.803 176.860 -1.057 17856 776 1 3 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.651 -2.571 17856 777 1 3 . 1 1 28 28 ILE H H 28 8.220 8.220 7.791 0.429 17856 778 1 3 . 1 1 29 29 ALA N N 29 127.850 127.850 121.575 6.275 17856 779 1 3 . 1 1 29 29 ALA C C 29 177.627 177.627 179.702 -2.075 17856 780 1 3 . 1 1 29 29 ALA CA C 29 53.684 53.684 54.872 -1.188 17856 781 1 3 . 1 1 29 29 ALA H H 29 8.300 8.300 7.370 0.930 17856 782 1 3 . 1 1 30 30 GLU N N 30 120.000 120.000 118.943 1.057 17856 783 1 3 . 1 1 30 30 GLU C C 30 176.321 176.321 178.907 -2.586 17856 784 1 3 . 1 1 30 30 GLU H H 30 8.258 8.258 7.740 0.518 17856 785 1 3 . 1 1 31 31 PHE N N 31 119.128 119.128 118.215 0.913 17856 786 1 3 . 1 1 31 31 PHE C C 31 175.180 175.180 178.086 -2.906 17856 787 1 3 . 1 1 31 31 PHE CA C 31 57.540 57.540 61.038 -3.498 17856 788 1 3 . 1 1 31 31 PHE H H 31 8.061 8.061 7.416 0.645 17856 789 1 3 . 1 1 32 32 ASP N N 32 121.800 121.800 118.008 3.792 17856 790 1 3 . 1 1 32 32 ASP C C 32 175.894 175.894 177.631 -1.737 17856 791 1 3 . 1 1 32 32 ASP CA C 32 54.529 54.529 56.618 -2.089 17856 792 1 3 . 1 1 32 32 ASP H H 32 8.275 8.275 7.791 0.484 17856 793 1 3 . 1 1 33 33 VAL N N 33 119.648 119.648 118.226 1.422 17856 794 1 3 . 1 1 33 33 VAL C C 33 176.268 176.268 177.903 -1.635 17856 795 1 3 . 1 1 33 33 VAL CA C 33 62.500 62.500 65.451 -2.951 17856 796 1 3 . 1 1 33 33 VAL H H 33 8.059 8.059 7.380 0.679 17856 797 1 3 . 1 1 34 34 VAL N N 34 123.882 123.882 119.544 4.338 17856 798 1 3 . 1 1 34 34 VAL H H 34 7.774 7.774 7.984 -0.210 17856 799 1 3 . 1 1 35 35 LYS N N 35 125.250 125.250 118.658 6.592 17856 800 1 3 . 1 1 35 35 LYS C C 35 176.719 176.719 175.891 0.828 17856 801 1 3 . 1 1 35 35 LYS CA C 35 56.502 56.502 56.160 0.342 17856 802 1 3 . 1 1 35 35 LYS H H 35 8.357 8.357 7.878 0.479 17856 803 1 3 . 1 1 36 36 GLU N N 36 121.850 121.850 120.480 1.370 17856 804 1 3 . 1 1 36 36 GLU C C 36 176.426 176.426 177.643 -1.217 17856 805 1 3 . 1 1 36 36 GLU H H 36 8.423 8.423 8.279 0.144 17856 806 1 3 . 1 1 37 37 SER N N 37 117.100 117.100 117.779 -0.679 17856 807 1 3 . 1 1 37 37 SER C C 37 174.854 174.854 176.168 -1.314 17856 808 1 3 . 1 1 37 37 SER CA C 37 58.850 58.850 60.839 -1.989 17856 809 1 3 . 1 1 37 37 SER H H 37 8.362 8.362 8.041 0.321 17856 810 1 3 . 1 1 38 38 VAL N N 38 121.625 121.625 115.880 5.745 17856 811 1 3 . 1 1 38 38 VAL C C 38 176.246 176.246 175.587 0.659 17856 812 1 3 . 1 1 38 38 VAL CA C 38 63.043 63.043 61.177 1.866 17856 813 1 3 . 1 1 38 38 VAL H H 38 8.225 8.225 7.850 0.375 17856 814 1 3 . 1 1 39 39 ASN N N 39 121.150 121.150 121.004 0.146 17856 815 1 3 . 1 1 39 39 ASN C C 39 175.459 175.459 174.890 0.569 17856 816 1 3 . 1 1 39 39 ASN CA C 39 53.568 53.568 52.035 1.534 17856 817 1 3 . 1 1 39 39 ASN H H 39 8.366 8.366 7.981 0.385 17856 818 1 3 . 1 1 40 40 GLU N N 40 121.500 121.500 121.158 0.342 17856 819 1 3 . 1 1 40 40 GLU C C 40 175.459 175.459 175.432 0.027 17856 820 1 3 . 1 1 40 40 GLU CA C 40 56.860 56.860 56.149 0.711 17856 821 1 3 . 1 1 40 40 GLU H H 40 8.370 8.370 7.884 0.486 17856 822 1 3 . 1 1 41 41 LEU N N 41 121.950 121.950 120.620 1.330 17856 823 1 3 . 1 1 41 41 LEU C C 41 177.939 177.939 177.019 0.920 17856 824 1 3 . 1 1 41 41 LEU CA C 41 56.040 56.040 54.978 1.062 17856 825 1 3 . 1 1 41 41 LEU H H 41 8.152 8.152 7.779 0.373 17856 826 1 3 . 1 1 42 42 SER N N 42 113.326 113.326 116.246 -2.920 17856 827 1 3 . 1 1 42 42 SER C C 42 174.660 174.660 176.000 -1.340 17856 828 1 3 . 1 1 42 42 SER CA C 42 58.940 58.940 57.892 1.048 17856 829 1 3 . 1 1 42 42 SER H H 42 8.373 8.373 7.714 0.659 17856 830 1 3 . 1 1 43 43 GLU N N 43 121.521 121.521 121.451 0.070 17856 831 1 3 . 1 1 43 43 GLU C C 43 177.349 177.349 178.361 -1.012 17856 832 1 3 . 1 1 43 43 GLU H H 43 7.329 7.329 8.685 -1.356 17856 833 1 3 . 1 1 44 44 LYS N N 44 121.240 121.240 120.196 1.044 17856 834 1 3 . 1 1 44 44 LYS C C 44 177.246 177.246 178.015 -0.769 17856 835 1 3 . 1 1 44 44 LYS CA C 44 56.397 56.397 59.407 -3.010 17856 836 1 3 . 1 1 44 44 LYS H H 44 8.103 8.103 8.228 -0.125 17856 837 1 3 . 1 1 45 45 ALA N N 45 119.568 119.568 120.271 -0.703 17856 838 1 3 . 1 1 45 45 ALA C C 45 177.853 177.853 178.537 -0.684 17856 839 1 3 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.673 -2.113 17856 840 1 3 . 1 1 45 45 ALA H H 45 8.541 8.541 7.540 1.000 17856 841 1 3 . 1 1 46 46 LYS N N 46 115.235 115.235 115.694 -0.459 17856 842 1 3 . 1 1 46 46 LYS C C 46 177.110 177.110 178.605 -1.495 17856 843 1 3 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.664 -1.869 17856 844 1 3 . 1 1 46 46 LYS H H 46 7.257 7.257 7.570 -0.313 17856 845 1 3 . 1 1 47 47 THR N N 47 103.239 103.239 110.153 -6.914 17856 846 1 3 . 1 1 47 47 THR C C 47 173.973 173.973 175.287 -1.314 17856 847 1 3 . 1 1 47 47 THR CA C 47 62.740 62.740 63.107 -0.367 17856 848 1 3 . 1 1 47 47 THR H H 47 7.381 7.381 7.464 -0.083 17856 849 1 3 . 1 1 48 48 ASP N N 48 122.976 122.976 123.627 -0.651 17856 850 1 3 . 1 1 48 48 ASP H H 48 8.031 8.031 7.945 0.086 17856 851 1 3 . 1 1 49 49 PRO C C 49 178.106 178.106 178.410 -0.304 17856 852 1 3 . 1 1 49 49 PRO CA C 49 64.219 64.219 65.045 -0.826 17856 853 1 3 . 1 1 50 50 GLN N N 50 118.351 118.351 118.285 0.066 17856 854 1 3 . 1 1 50 50 GLN C C 50 176.944 176.944 178.241 -1.297 17856 855 1 3 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.960 -2.160 17856 856 1 3 . 1 1 50 50 GLN H H 50 8.304 8.304 8.585 -0.281 17856 857 1 3 . 1 1 51 51 ALA N N 51 124.206 124.206 121.729 2.477 17856 858 1 3 . 1 1 51 51 ALA C C 51 178.490 178.490 179.263 -0.773 17856 859 1 3 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.806 -1.382 17856 860 1 3 . 1 1 51 51 ALA H H 51 7.547 7.547 8.957 -1.410 17856 861 1 3 . 1 1 52 52 ALA N N 52 118.686 118.686 120.944 -2.258 17856 862 1 3 . 1 1 52 52 ALA C C 52 177.953 177.953 179.838 -1.885 17856 863 1 3 . 1 1 52 52 ALA H H 52 7.931 7.931 7.624 0.307 17856 864 1 3 . 1 1 53 53 GLU N N 53 120.075 120.075 117.890 2.185 17856 865 1 3 . 1 1 53 53 GLU H H 53 7.729 7.729 7.806 -0.077 17856 866 1 3 . 1 1 55 55 LEU N N 55 123.640 123.640 119.680 3.960 17856 867 1 3 . 1 1 55 55 LEU C C 55 177.587 177.587 178.930 -1.343 17856 868 1 3 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.239 -1.452 17856 869 1 3 . 1 1 55 55 LEU H H 55 8.215 8.215 8.059 0.156 17856 870 1 3 . 1 1 56 56 ASN N N 56 118.520 118.520 118.779 -0.259 17856 871 1 3 . 1 1 56 56 ASN C C 56 175.700 175.700 177.810 -2.110 17856 872 1 3 . 1 1 56 56 ASN CA C 56 54.132 54.132 56.058 -1.926 17856 873 1 3 . 1 1 56 56 ASN H H 56 8.250 8.250 7.845 0.405 17856 874 1 3 . 1 1 57 57 LYS N N 57 120.960 120.960 119.315 1.645 17856 875 1 3 . 1 1 57 57 LYS C C 57 176.637 176.637 178.565 -1.928 17856 876 1 3 . 1 1 57 57 LYS H H 57 8.065 8.065 7.793 0.272 17856 877 1 3 . 1 1 58 58 LEU N N 58 122.610 122.610 120.156 2.454 17856 878 1 3 . 1 1 58 58 LEU C C 58 177.433 177.433 177.756 -0.323 17856 879 1 3 . 1 1 58 58 LEU CA C 58 55.120 55.120 57.298 -2.178 17856 880 1 3 . 1 1 58 58 LEU H H 58 8.135 8.135 7.588 0.547 17856 881 1 3 . 1 1 59 59 ILE N N 59 122.045 122.045 115.300 6.745 17856 882 1 3 . 1 1 59 59 ILE CA C 59 61.535 61.535 62.008 -0.472 17856 883 1 3 . 1 1 59 59 ILE H H 59 8.220 8.220 7.713 0.507 17856 884 1 3 . 1 1 60 60 GLU N N 60 124.000 124.000 118.667 5.333 17856 885 1 3 . 1 1 60 60 GLU C C 60 177.007 177.007 177.088 -0.081 17856 886 1 3 . 1 1 60 60 GLU CA C 60 56.722 56.722 57.013 -0.291 17856 887 1 3 . 1 1 60 60 GLU H H 60 8.340 8.340 7.455 0.885 17856 888 1 3 . 1 1 61 61 GLY N N 61 110.520 110.520 107.763 2.757 17856 889 1 3 . 1 1 61 61 GLY C C 61 174.002 174.002 174.182 -0.180 17856 890 1 3 . 1 1 61 61 GLY CA C 61 45.405 45.405 44.553 0.852 17856 891 1 3 . 1 1 61 61 GLY H H 61 8.557 8.557 7.700 0.857 17856 892 1 3 . 1 1 62 62 TYR N N 62 119.600 119.600 120.875 -1.275 17856 893 1 3 . 1 1 62 62 TYR C C 62 175.940 175.940 177.150 -1.210 17856 894 1 3 . 1 1 62 62 TYR CA C 62 58.108 58.108 60.603 -2.495 17856 895 1 3 . 1 1 62 62 TYR H H 62 7.980 7.980 8.070 -0.090 17856 896 1 3 . 1 1 63 63 THR N N 63 116.304 116.304 113.795 2.509 17856 897 1 3 . 1 1 63 63 THR C C 63 173.796 173.796 173.633 0.163 17856 898 1 3 . 1 1 63 63 THR H H 63 8.049 8.049 8.350 -0.301 17856 899 1 3 . 1 1 64 64 TYR N N 64 122.050 122.050 121.889 0.161 17856 900 1 3 . 1 1 64 64 TYR C C 64 176.290 176.290 175.790 0.500 17856 901 1 3 . 1 1 64 64 TYR CA C 64 58.533 58.533 57.866 0.667 17856 902 1 3 . 1 1 64 64 TYR H H 64 8.133 8.133 7.870 0.263 17856 903 1 3 . 1 1 65 65 GLY N N 65 110.456 110.456 108.486 1.970 17856 904 1 3 . 1 1 65 65 GLY C C 65 174.340 174.340 174.724 -0.384 17856 905 1 3 . 1 1 65 65 GLY CA C 65 45.328 45.328 44.801 0.527 17856 906 1 3 . 1 1 65 65 GLY H H 65 7.747 7.747 7.607 0.140 17856 907 1 3 . 1 1 66 66 GLU N N 66 120.783 120.783 124.652 -3.869 17856 908 1 3 . 1 1 66 66 GLU C C 66 176.895 176.895 177.977 -1.082 17856 909 1 3 . 1 1 66 66 GLU CA C 66 56.804 56.804 57.267 -0.463 17856 910 1 3 . 1 1 66 66 GLU H H 66 8.243 8.243 8.813 -0.570 17856 911 1 3 . 1 1 67 67 GLU N N 67 121.587 121.587 120.188 1.399 17856 912 1 3 . 1 1 67 67 GLU C C 67 176.340 176.340 178.218 -1.878 17856 913 1 3 . 1 1 67 67 GLU H H 67 8.611 8.611 8.353 0.258 17856 914 1 3 . 1 1 68 68 ARG N N 68 121.790 121.790 119.434 2.356 17856 915 1 3 . 1 1 68 68 ARG C C 68 176.350 176.350 178.392 -2.042 17856 916 1 3 . 1 1 68 68 ARG H H 68 8.267 8.267 8.428 -0.161 17856 917 1 3 . 1 1 69 69 LYS N N 69 118.431 118.431 119.831 -1.400 17856 918 1 3 . 1 1 69 69 LYS H H 69 7.567 7.567 7.775 -0.208 17856 919 1 3 . 1 1 70 70 LEU C C 70 177.338 177.338 179.181 -1.843 17856 920 1 3 . 1 1 70 70 LEU CA C 70 55.533 55.533 58.222 -2.689 17856 921 1 3 . 1 1 71 71 TYR N N 71 119.504 119.504 117.126 2.378 17856 922 1 3 . 1 1 71 71 TYR H H 71 7.997 7.997 8.268 -0.271 17856 923 1 3 . 1 1 72 72 ASP C C 72 176.528 176.528 178.363 -1.835 17856 924 1 3 . 1 1 72 72 ASP CA C 72 54.693 54.693 56.991 -2.298 17856 925 1 3 . 1 1 73 73 SER N N 73 117.000 117.000 115.055 1.945 17856 926 1 3 . 1 1 73 73 SER C C 73 174.950 174.950 175.589 -0.639 17856 927 1 3 . 1 1 73 73 SER CA C 73 58.997 58.997 60.967 -1.970 17856 928 1 3 . 1 1 73 73 SER H H 73 8.282 8.282 7.785 0.497 17856 929 1 3 . 1 1 74 74 ALA N N 74 125.422 125.422 125.080 0.342 17856 930 1 3 . 1 1 74 74 ALA C C 74 178.389 178.389 179.469 -1.080 17856 931 1 3 . 1 1 74 74 ALA CA C 74 53.433 53.433 55.062 -1.629 17856 932 1 3 . 1 1 74 74 ALA H H 74 8.339 8.339 7.310 1.029 17856 933 1 3 . 1 1 75 75 LEU N N 75 120.019 120.019 118.449 1.570 17856 934 1 3 . 1 1 75 75 LEU C C 75 177.954 177.954 178.962 -1.008 17856 935 1 3 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.544 -1.764 17856 936 1 3 . 1 1 75 75 LEU H H 75 7.948 7.948 7.857 0.091 17856 937 1 3 . 1 1 76 76 SER N N 76 113.321 113.321 114.801 -1.480 17856 938 1 3 . 1 1 76 76 SER C C 76 174.784 174.784 176.825 -2.041 17856 939 1 3 . 1 1 76 76 SER CA C 76 59.173 59.173 61.995 -2.822 17856 940 1 3 . 1 1 76 76 SER H H 76 7.951 7.951 7.749 0.202 17856 941 1 3 . 1 1 77 77 LYS N N 77 122.710 122.710 122.088 0.622 17856 942 1 3 . 1 1 77 77 LYS C C 77 176.734 176.734 179.109 -2.375 17856 943 1 3 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.128 -0.738 17856 944 1 3 . 1 1 77 77 LYS H H 77 8.170 8.170 7.341 0.829 17856 945 1 3 . 1 1 78 78 ILE N N 78 121.521 121.521 119.121 2.400 17856 946 1 3 . 1 1 78 78 ILE C C 78 176.512 176.512 178.073 -1.561 17856 947 1 3 . 1 1 78 78 ILE H H 78 8.160 8.160 7.716 0.444 17856 948 1 3 . 1 1 79 79 GLU N N 79 123.840 123.840 120.929 2.911 17856 949 1 3 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.506 -4.028 17856 950 1 3 . 1 1 79 79 GLU H H 79 8.360 8.360 8.102 0.258 17856 951 1 3 . 1 1 80 80 LYS N N 80 122.143 122.143 119.595 2.548 17856 952 1 3 . 1 1 80 80 LYS C C 80 176.937 176.937 178.788 -1.851 17856 953 1 3 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.390 -2.890 17856 954 1 3 . 1 1 80 80 LYS H H 80 8.231 8.231 7.478 0.753 17856 955 1 3 . 1 1 81 81 LEU N N 81 122.095 122.095 121.531 0.564 17856 956 1 3 . 1 1 81 81 LEU C C 81 177.531 177.531 178.753 -1.222 17856 957 1 3 . 1 1 81 81 LEU H H 81 8.050 8.050 7.264 0.786 17856 958 1 3 . 1 1 82 82 ILE N N 82 120.609 120.609 118.156 2.453 17856 959 1 3 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.271 -3.911 17856 960 1 3 . 1 1 82 82 ILE H H 82 8.000 8.000 7.635 0.365 17856 961 1 3 . 1 1 83 83 GLU N N 83 124.611 124.611 120.637 3.974 17856 962 1 3 . 1 1 83 83 GLU C C 83 177.298 177.298 179.513 -2.215 17856 963 1 3 . 1 1 83 83 GLU H H 83 8.380 8.380 8.130 0.250 17856 964 1 3 . 1 1 84 84 THR N N 84 115.107 115.107 115.453 -0.346 17856 965 1 3 . 1 1 84 84 THR C C 84 174.400 174.400 175.327 -0.927 17856 966 1 3 . 1 1 84 84 THR CA C 84 62.659 62.659 65.849 -3.190 17856 967 1 3 . 1 1 84 84 THR H H 84 8.064 8.064 8.220 -0.156 17856 968 1 3 . 1 1 85 85 LEU N N 85 124.150 124.150 119.471 4.679 17856 969 1 3 . 1 1 85 85 LEU C C 85 177.120 177.120 176.758 0.362 17856 970 1 3 . 1 1 85 85 LEU CA C 85 55.020 55.020 55.301 -0.281 17856 971 1 3 . 1 1 85 85 LEU H H 85 8.238 8.238 7.202 1.036 17856 972 1 3 . 1 1 86 86 SER N N 86 114.913 114.913 114.729 0.184 17856 973 1 3 . 1 1 86 86 SER H H 86 7.678 7.678 7.525 0.153 17856 974 1 3 . 1 1 87 87 PRO CA C 87 63.550 63.550 64.161 -0.611 17856 975 1 3 . 1 1 88 88 ALA N N 88 123.767 123.767 120.273 3.494 17856 976 1 3 . 1 1 88 88 ALA C C 88 178.131 178.131 176.800 1.331 17856 977 1 3 . 1 1 88 88 ALA CA C 88 52.878 52.878 53.779 -0.902 17856 978 1 3 . 1 1 88 88 ALA H H 88 8.342 8.342 8.328 0.014 17856 979 1 3 . 1 1 89 89 ARG N N 89 119.159 119.159 120.280 -1.121 17856 980 1 3 . 1 1 89 89 ARG C C 89 176.620 176.620 174.150 2.470 17856 981 1 3 . 1 1 89 89 ARG H H 89 8.133 8.133 8.413 -0.280 17856 982 1 3 . 1 1 90 90 SER N N 90 116.910 116.910 118.347 -1.437 17856 983 1 3 . 1 1 90 90 SER C C 90 174.887 174.887 174.740 0.147 17856 984 1 3 . 1 1 90 90 SER H H 90 8.322 8.322 8.682 -0.360 17856 985 1 3 . 1 1 91 91 LYS N N 91 123.457 123.457 127.831 -4.374 17856 986 1 3 . 1 1 91 91 LYS C C 91 176.970 176.970 175.463 1.507 17856 987 1 3 . 1 1 91 91 LYS H H 91 8.396 8.396 8.556 -0.160 17856 988 1 3 . 1 1 92 92 SER N N 92 116.692 116.692 118.958 -2.266 17856 989 1 3 . 1 1 92 92 SER C C 92 174.573 174.573 174.294 0.279 17856 990 1 3 . 1 1 92 92 SER CA C 92 58.600 58.600 58.839 -0.239 17856 991 1 3 . 1 1 92 92 SER H H 92 8.297 8.297 8.219 0.078 17856 992 1 3 . 1 1 93 93 GLN N N 93 121.916 121.916 124.460 -2.544 17856 993 1 3 . 1 1 93 93 GLN C C 93 175.971 175.971 176.766 -0.795 17856 994 1 3 . 1 1 93 93 GLN H H 93 8.325 8.325 8.379 -0.054 17856 995 1 3 . 1 1 94 94 SER N N 94 117.385 117.385 113.968 3.417 17856 996 1 3 . 1 1 94 94 SER C C 94 173.940 173.940 173.557 0.383 17856 997 1 3 . 1 1 94 94 SER CA C 94 58.520 58.520 58.644 -0.124 17856 998 1 3 . 1 1 94 94 SER H H 94 8.352 8.352 8.437 -0.085 17856 999 1 3 . 1 1 95 95 THR N N 95 120.756 120.756 116.224 4.532 17856 1000 1 3 . 1 1 95 95 THR H H 95 7.805 7.805 7.926 -0.121 17856 1001 1 3 . 1 1 99 99 ARG C C 99 176.250 176.250 174.093 2.157 17856 1002 1 3 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.094 0.063 17856 1003 1 3 . 1 1 100 100 ASN N N 100 118.482 118.482 117.154 1.328 17856 1004 1 3 . 1 1 100 100 ASN H H 100 8.272 8.272 8.120 0.152 17856 1005 1 3 . 1 1 101 101 ARG C C 101 176.280 176.280 175.209 1.071 17856 1006 1 3 . 1 1 102 102 ASN N N 102 118.688 118.688 119.013 -0.325 17856 1007 1 3 . 1 1 102 102 ASN C C 102 174.996 174.996 175.759 -0.763 17856 1008 1 3 . 1 1 102 102 ASN CA C 102 53.609 53.609 53.946 -0.337 17856 1009 1 3 . 1 1 102 102 ASN H H 102 8.424 8.424 8.304 0.120 17856 1010 1 3 . 1 1 103 103 ASN N N 103 118.865 118.865 117.283 1.582 17856 1011 1 3 . 1 1 103 103 ASN C C 103 175.040 175.040 174.182 0.858 17856 1012 1 3 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.222 0.590 17856 1013 1 3 . 1 1 103 103 ASN H H 103 8.282 8.282 8.372 -0.090 17856 1014 1 3 . 1 1 104 104 ARG N N 104 120.875 120.875 117.019 3.856 17856 1015 1 3 . 1 1 104 104 ARG H H 104 8.140 8.140 8.235 -0.095 17856 1016 1 3 . 1 1 106 106 ILE C C 106 175.408 175.408 176.564 -1.156 17856 1017 1 3 . 1 1 106 106 ILE CA C 106 61.395 61.395 62.860 -1.465 17856 1018 1 4 . 1 1 2 2 SER N N 2 116.304 116.304 117.762 -1.458 17856 1019 1 4 . 1 1 2 2 SER C C 2 174.710 174.710 175.673 -0.963 17856 1020 1 4 . 1 1 2 2 SER CA C 2 58.908 58.908 59.862 -0.954 17856 1021 1 4 . 1 1 2 2 SER H H 2 8.003 8.003 8.476 -0.473 17856 1022 1 4 . 1 1 3 3 ILE N N 3 122.062 122.062 117.915 4.147 17856 1023 1 4 . 1 1 3 3 ILE C C 3 176.750 176.750 177.282 -0.532 17856 1024 1 4 . 1 1 3 3 ILE CA C 3 61.786 61.786 63.280 -1.494 17856 1025 1 4 . 1 1 3 3 ILE H H 3 7.957 7.957 8.137 -0.180 17856 1026 1 4 . 1 1 4 4 VAL N N 4 122.674 122.674 119.141 3.533 17856 1027 1 4 . 1 1 4 4 VAL C C 4 176.221 176.221 176.033 0.188 17856 1028 1 4 . 1 1 4 4 VAL CA C 4 62.970 62.970 64.382 -1.412 17856 1029 1 4 . 1 1 4 4 VAL H H 4 7.970 7.970 7.898 0.072 17856 1030 1 4 . 1 1 5 5 SER N N 5 117.750 117.750 111.816 5.934 17856 1031 1 4 . 1 1 5 5 SER C C 5 174.858 174.858 176.182 -1.324 17856 1032 1 4 . 1 1 5 5 SER CA C 5 58.630 58.630 58.799 -0.169 17856 1033 1 4 . 1 1 5 5 SER H H 5 8.093 8.093 7.891 0.202 17856 1034 1 4 . 1 1 6 6 GLN N N 6 121.961 121.961 123.024 -1.063 17856 1035 1 4 . 1 1 6 6 GLN C C 6 176.467 176.467 177.552 -1.085 17856 1036 1 4 . 1 1 6 6 GLN CA C 6 56.226 56.226 60.169 -3.943 17856 1037 1 4 . 1 1 6 6 GLN H H 6 8.371 8.371 8.509 -0.138 17856 1038 1 4 . 1 1 7 7 THR N N 7 115.325 115.325 113.228 2.097 17856 1039 1 4 . 1 1 7 7 THR C C 7 174.752 174.752 176.874 -2.122 17856 1040 1 4 . 1 1 7 7 THR H H 7 8.152 8.152 8.443 -0.291 17856 1041 1 4 . 1 1 8 8 ARG N N 8 122.530 122.530 122.031 0.499 17856 1042 1 4 . 1 1 8 8 ARG C C 8 176.200 176.200 178.136 -1.936 17856 1043 1 4 . 1 1 8 8 ARG CA C 8 56.570 56.570 59.065 -2.495 17856 1044 1 4 . 1 1 8 8 ARG H H 8 8.211 8.211 8.111 0.100 17856 1045 1 4 . 1 1 9 9 ASN N N 9 119.600 119.600 117.382 2.218 17856 1046 1 4 . 1 1 9 9 ASN C C 9 177.164 177.164 177.140 0.024 17856 1047 1 4 . 1 1 9 9 ASN H H 9 8.398 8.398 8.037 0.361 17856 1048 1 4 . 1 1 10 10 LYS N N 10 121.600 121.600 120.331 1.269 17856 1049 1 4 . 1 1 10 10 LYS C C 10 176.845 176.845 178.912 -2.067 17856 1050 1 4 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.163 -2.054 17856 1051 1 4 . 1 1 10 10 LYS H H 10 8.190 8.190 7.563 0.627 17856 1052 1 4 . 1 1 11 11 GLU N N 11 120.700 120.700 119.188 1.512 17856 1053 1 4 . 1 1 11 11 GLU C C 11 176.825 176.825 178.612 -1.787 17856 1054 1 4 . 1 1 11 11 GLU CA C 11 56.690 56.690 58.918 -2.228 17856 1055 1 4 . 1 1 11 11 GLU H H 11 8.323 8.323 7.672 0.651 17856 1056 1 4 . 1 1 12 12 LEU N N 12 122.390 122.390 122.093 0.297 17856 1057 1 4 . 1 1 12 12 LEU C C 12 177.670 177.670 178.848 -1.178 17856 1058 1 4 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.182 -2.712 17856 1059 1 4 . 1 1 12 12 LEU H H 12 8.155 8.155 7.932 0.223 17856 1060 1 4 . 1 1 13 13 LEU N N 13 122.570 122.570 116.554 6.016 17856 1061 1 4 . 1 1 13 13 LEU C C 13 177.510 177.510 178.551 -1.041 17856 1062 1 4 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.567 -2.986 17856 1063 1 4 . 1 1 13 13 LEU H H 13 8.220 8.220 8.290 -0.070 17856 1064 1 4 . 1 1 14 14 ASP N N 14 120.780 120.780 120.259 0.521 17856 1065 1 4 . 1 1 14 14 ASP C C 14 176.480 176.480 178.526 -2.046 17856 1066 1 4 . 1 1 14 14 ASP CA C 14 54.650 54.650 57.849 -3.199 17856 1067 1 4 . 1 1 14 14 ASP H H 14 8.243 8.243 7.755 0.488 17856 1068 1 4 . 1 1 15 15 LYS N N 15 120.900 120.900 119.396 1.504 17856 1069 1 4 . 1 1 15 15 LYS C C 15 175.580 175.580 179.069 -3.489 17856 1070 1 4 . 1 1 15 15 LYS H H 15 8.052 8.052 8.083 -0.031 17856 1071 1 4 . 1 1 16 16 LYS N N 16 121.980 121.980 120.203 1.777 17856 1072 1 4 . 1 1 16 16 LYS C C 16 176.887 176.887 179.110 -2.223 17856 1073 1 4 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.636 -2.302 17856 1074 1 4 . 1 1 16 16 LYS H H 16 8.243 8.243 7.860 0.383 17856 1075 1 4 . 1 1 17 17 ILE N N 17 121.940 121.940 119.594 2.346 17856 1076 1 4 . 1 1 17 17 ILE H H 17 8.110 8.110 8.421 -0.311 17856 1077 1 4 . 1 1 18 18 ARG C C 18 176.520 176.520 177.397 -0.877 17856 1078 1 4 . 1 1 19 19 SER N N 19 117.150 117.150 113.809 3.341 17856 1079 1 4 . 1 1 19 19 SER C C 19 175.167 175.167 175.647 -0.480 17856 1080 1 4 . 1 1 19 19 SER CA C 19 58.840 58.840 61.200 -2.360 17856 1081 1 4 . 1 1 19 19 SER H H 19 8.396 8.396 7.827 0.569 17856 1082 1 4 . 1 1 20 20 GLU N N 20 123.176 123.176 122.438 0.738 17856 1083 1 4 . 1 1 20 20 GLU C C 20 176.921 176.921 178.916 -1.995 17856 1084 1 4 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.258 -2.398 17856 1085 1 4 . 1 1 20 20 GLU H H 20 8.478 8.478 7.762 0.716 17856 1086 1 4 . 1 1 21 21 ILE N N 21 120.550 120.550 114.383 6.167 17856 1087 1 4 . 1 1 21 21 ILE C C 21 176.550 176.550 178.261 -1.711 17856 1088 1 4 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.674 -3.044 17856 1089 1 4 . 1 1 21 21 ILE H H 21 8.080 8.080 7.432 0.648 17856 1090 1 4 . 1 1 22 22 GLU N N 22 123.685 123.685 120.677 3.008 17856 1091 1 4 . 1 1 22 22 GLU C C 22 176.109 176.109 178.351 -2.242 17856 1092 1 4 . 1 1 22 22 GLU H H 22 8.309 8.309 7.831 0.478 17856 1093 1 4 . 1 1 23 23 ALA N N 23 124.280 124.280 123.213 1.067 17856 1094 1 4 . 1 1 23 23 ALA C C 23 178.474 178.474 179.685 -1.211 17856 1095 1 4 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.137 -1.731 17856 1096 1 4 . 1 1 23 23 ALA H H 23 8.088 8.088 8.317 -0.229 17856 1097 1 4 . 1 1 24 24 ILE N N 24 120.330 120.330 118.228 2.102 17856 1098 1 4 . 1 1 24 24 ILE C C 24 176.309 176.309 177.520 -1.211 17856 1099 1 4 . 1 1 24 24 ILE CA C 24 61.540 61.540 64.867 -3.327 17856 1100 1 4 . 1 1 24 24 ILE H H 24 7.980 7.980 8.586 -0.606 17856 1101 1 4 . 1 1 25 25 LYS N N 25 124.310 124.310 120.153 4.157 17856 1102 1 4 . 1 1 25 25 LYS C C 25 176.365 176.365 178.513 -2.148 17856 1103 1 4 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.276 -2.942 17856 1104 1 4 . 1 1 25 25 LYS H H 25 8.198 8.198 7.580 0.618 17856 1105 1 4 . 1 1 26 26 LYS N N 26 122.518 122.518 118.451 4.067 17856 1106 1 4 . 1 1 26 26 LYS C C 26 176.365 176.365 178.575 -2.210 17856 1107 1 4 . 1 1 26 26 LYS CA C 26 56.175 56.175 59.035 -2.860 17856 1108 1 4 . 1 1 26 26 LYS H H 26 8.125 8.125 7.235 0.890 17856 1109 1 4 . 1 1 27 27 ILE N N 27 122.670 122.670 120.599 2.071 17856 1110 1 4 . 1 1 27 27 ILE C C 27 176.261 176.261 178.033 -1.772 17856 1111 1 4 . 1 1 27 27 ILE CA C 27 61.294 61.294 64.591 -3.297 17856 1112 1 4 . 1 1 27 27 ILE H H 27 8.114 8.114 7.834 0.280 17856 1113 1 4 . 1 1 28 28 ILE N N 28 125.178 125.178 119.291 5.887 17856 1114 1 4 . 1 1 28 28 ILE C C 28 175.803 175.803 177.006 -1.203 17856 1115 1 4 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.459 -2.379 17856 1116 1 4 . 1 1 28 28 ILE H H 28 8.220 8.220 7.722 0.498 17856 1117 1 4 . 1 1 29 29 ALA N N 29 127.850 127.850 121.918 5.932 17856 1118 1 4 . 1 1 29 29 ALA C C 29 177.627 177.627 179.679 -2.052 17856 1119 1 4 . 1 1 29 29 ALA CA C 29 53.684 53.684 55.062 -1.378 17856 1120 1 4 . 1 1 29 29 ALA H H 29 8.300 8.300 7.276 1.024 17856 1121 1 4 . 1 1 30 30 GLU N N 30 120.000 120.000 118.708 1.292 17856 1122 1 4 . 1 1 30 30 GLU C C 30 176.321 176.321 178.906 -2.585 17856 1123 1 4 . 1 1 30 30 GLU H H 30 8.258 8.258 7.778 0.480 17856 1124 1 4 . 1 1 31 31 PHE N N 31 119.128 119.128 117.958 1.170 17856 1125 1 4 . 1 1 31 31 PHE C C 31 175.180 175.180 178.282 -3.102 17856 1126 1 4 . 1 1 31 31 PHE CA C 31 57.540 57.540 59.843 -2.303 17856 1127 1 4 . 1 1 31 31 PHE H H 31 8.061 8.061 7.414 0.647 17856 1128 1 4 . 1 1 32 32 ASP N N 32 121.800 121.800 119.501 2.299 17856 1129 1 4 . 1 1 32 32 ASP C C 32 175.894 175.894 178.733 -2.839 17856 1130 1 4 . 1 1 32 32 ASP CA C 32 54.529 54.529 57.178 -2.649 17856 1131 1 4 . 1 1 32 32 ASP H H 32 8.275 8.275 7.764 0.511 17856 1132 1 4 . 1 1 33 33 VAL N N 33 119.648 119.648 120.523 -0.875 17856 1133 1 4 . 1 1 33 33 VAL C C 33 176.268 176.268 178.291 -2.023 17856 1134 1 4 . 1 1 33 33 VAL CA C 33 62.500 62.500 66.230 -3.730 17856 1135 1 4 . 1 1 33 33 VAL H H 33 8.059 8.059 7.363 0.696 17856 1136 1 4 . 1 1 34 34 VAL N N 34 123.882 123.882 120.028 3.854 17856 1137 1 4 . 1 1 34 34 VAL H H 34 7.774 7.774 8.565 -0.791 17856 1138 1 4 . 1 1 35 35 LYS N N 35 125.250 125.250 119.261 5.989 17856 1139 1 4 . 1 1 35 35 LYS C C 35 176.719 176.719 177.741 -1.022 17856 1140 1 4 . 1 1 35 35 LYS CA C 35 56.502 56.502 59.665 -3.163 17856 1141 1 4 . 1 1 35 35 LYS H H 35 8.357 8.357 7.742 0.615 17856 1142 1 4 . 1 1 36 36 GLU N N 36 121.850 121.850 116.685 5.165 17856 1143 1 4 . 1 1 36 36 GLU C C 36 176.426 176.426 179.742 -3.316 17856 1144 1 4 . 1 1 36 36 GLU H H 36 8.423 8.423 7.570 0.853 17856 1145 1 4 . 1 1 37 37 SER N N 37 117.100 117.100 116.543 0.557 17856 1146 1 4 . 1 1 37 37 SER C C 37 174.854 174.854 176.224 -1.370 17856 1147 1 4 . 1 1 37 37 SER CA C 37 58.850 58.850 61.543 -2.693 17856 1148 1 4 . 1 1 37 37 SER H H 37 8.362 8.362 8.251 0.111 17856 1149 1 4 . 1 1 38 38 VAL N N 38 121.625 121.625 113.732 7.893 17856 1150 1 4 . 1 1 38 38 VAL C C 38 176.246 176.246 176.152 0.094 17856 1151 1 4 . 1 1 38 38 VAL CA C 38 63.043 63.043 60.938 2.104 17856 1152 1 4 . 1 1 38 38 VAL H H 38 8.225 8.225 7.551 0.674 17856 1153 1 4 . 1 1 39 39 ASN N N 39 121.150 121.150 120.874 0.276 17856 1154 1 4 . 1 1 39 39 ASN C C 39 175.459 175.459 176.915 -1.456 17856 1155 1 4 . 1 1 39 39 ASN CA C 39 53.568 53.568 56.693 -3.125 17856 1156 1 4 . 1 1 39 39 ASN H H 39 8.366 8.366 7.820 0.546 17856 1157 1 4 . 1 1 40 40 GLU N N 40 121.500 121.500 119.512 1.988 17856 1158 1 4 . 1 1 40 40 GLU C C 40 175.459 175.459 178.242 -2.783 17856 1159 1 4 . 1 1 40 40 GLU CA C 40 56.860 56.860 58.291 -1.431 17856 1160 1 4 . 1 1 40 40 GLU H H 40 8.370 8.370 8.160 0.210 17856 1161 1 4 . 1 1 41 41 LEU N N 41 121.950 121.950 120.000 1.950 17856 1162 1 4 . 1 1 41 41 LEU C C 41 177.939 177.939 178.477 -0.538 17856 1163 1 4 . 1 1 41 41 LEU CA C 41 56.040 56.040 57.464 -1.424 17856 1164 1 4 . 1 1 41 41 LEU H H 41 8.152 8.152 8.022 0.130 17856 1165 1 4 . 1 1 42 42 SER N N 42 113.326 113.326 113.024 0.302 17856 1166 1 4 . 1 1 42 42 SER C C 42 174.660 174.660 176.126 -1.466 17856 1167 1 4 . 1 1 42 42 SER CA C 42 58.940 58.940 61.543 -2.603 17856 1168 1 4 . 1 1 42 42 SER H H 42 8.373 8.373 7.735 0.638 17856 1169 1 4 . 1 1 43 43 GLU N N 43 121.521 121.521 120.824 0.697 17856 1170 1 4 . 1 1 43 43 GLU C C 43 177.349 177.349 178.532 -1.183 17856 1171 1 4 . 1 1 43 43 GLU H H 43 7.329 7.329 7.726 -0.397 17856 1172 1 4 . 1 1 44 44 LYS N N 44 121.240 121.240 118.964 2.276 17856 1173 1 4 . 1 1 44 44 LYS C C 44 177.246 177.246 177.851 -0.605 17856 1174 1 4 . 1 1 44 44 LYS CA C 44 56.397 56.397 57.882 -1.485 17856 1175 1 4 . 1 1 44 44 LYS H H 44 8.103 8.103 7.586 0.517 17856 1176 1 4 . 1 1 45 45 ALA N N 45 119.568 119.568 121.490 -1.922 17856 1177 1 4 . 1 1 45 45 ALA C C 45 177.853 177.853 178.812 -0.959 17856 1178 1 4 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.556 -1.996 17856 1179 1 4 . 1 1 45 45 ALA H H 45 8.541 8.541 7.280 1.261 17856 1180 1 4 . 1 1 46 46 LYS N N 46 115.235 115.235 117.338 -2.103 17856 1181 1 4 . 1 1 46 46 LYS C C 46 177.110 177.110 178.074 -0.964 17856 1182 1 4 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.879 -2.083 17856 1183 1 4 . 1 1 46 46 LYS H H 46 7.257 7.257 7.872 -0.615 17856 1184 1 4 . 1 1 47 47 THR N N 47 103.239 103.239 112.918 -9.679 17856 1185 1 4 . 1 1 47 47 THR C C 47 173.973 173.973 174.548 -0.575 17856 1186 1 4 . 1 1 47 47 THR CA C 47 62.740 62.740 64.019 -1.279 17856 1187 1 4 . 1 1 47 47 THR H H 47 7.381 7.381 7.643 -0.262 17856 1188 1 4 . 1 1 48 48 ASP N N 48 122.976 122.976 121.218 1.758 17856 1189 1 4 . 1 1 48 48 ASP H H 48 8.031 8.031 7.951 0.080 17856 1190 1 4 . 1 1 49 49 PRO C C 49 178.106 178.106 178.227 -0.121 17856 1191 1 4 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.707 -0.488 17856 1192 1 4 . 1 1 50 50 GLN N N 50 118.351 118.351 119.078 -0.727 17856 1193 1 4 . 1 1 50 50 GLN C C 50 176.944 176.944 178.340 -1.396 17856 1194 1 4 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.375 -1.575 17856 1195 1 4 . 1 1 50 50 GLN H H 50 8.304 8.304 8.065 0.239 17856 1196 1 4 . 1 1 51 51 ALA N N 51 124.206 124.206 121.859 2.347 17856 1197 1 4 . 1 1 51 51 ALA C C 51 178.490 178.490 179.203 -0.713 17856 1198 1 4 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.740 -1.316 17856 1199 1 4 . 1 1 51 51 ALA H H 51 7.547 7.547 8.962 -1.415 17856 1200 1 4 . 1 1 52 52 ALA N N 52 118.686 118.686 120.874 -2.188 17856 1201 1 4 . 1 1 52 52 ALA C C 52 177.953 177.953 179.406 -1.453 17856 1202 1 4 . 1 1 52 52 ALA H H 52 7.931 7.931 7.496 0.435 17856 1203 1 4 . 1 1 53 53 GLU N N 53 120.075 120.075 118.015 2.060 17856 1204 1 4 . 1 1 53 53 GLU H H 53 7.729 7.729 7.771 -0.042 17856 1205 1 4 . 1 1 55 55 LEU N N 55 123.640 123.640 120.744 2.896 17856 1206 1 4 . 1 1 55 55 LEU C C 55 177.587 177.587 177.979 -0.392 17856 1207 1 4 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.386 -1.599 17856 1208 1 4 . 1 1 55 55 LEU H H 55 8.215 8.215 7.990 0.225 17856 1209 1 4 . 1 1 56 56 ASN N N 56 118.520 118.520 115.232 3.288 17856 1210 1 4 . 1 1 56 56 ASN C C 56 175.700 175.700 176.354 -0.654 17856 1211 1 4 . 1 1 56 56 ASN CA C 56 54.132 54.132 55.329 -1.197 17856 1212 1 4 . 1 1 56 56 ASN H H 56 8.250 8.250 8.019 0.231 17856 1213 1 4 . 1 1 57 57 LYS N N 57 120.960 120.960 115.648 5.312 17856 1214 1 4 . 1 1 57 57 LYS C C 57 176.637 176.637 176.336 0.301 17856 1215 1 4 . 1 1 57 57 LYS H H 57 8.065 8.065 7.596 0.469 17856 1216 1 4 . 1 1 58 58 LEU N N 58 122.610 122.610 119.029 3.581 17856 1217 1 4 . 1 1 58 58 LEU C C 58 177.433 177.433 178.695 -1.262 17856 1218 1 4 . 1 1 58 58 LEU CA C 58 55.120 55.120 54.575 0.545 17856 1219 1 4 . 1 1 58 58 LEU H H 58 8.135 8.135 7.522 0.613 17856 1220 1 4 . 1 1 59 59 ILE N N 59 122.045 122.045 121.417 0.628 17856 1221 1 4 . 1 1 59 59 ILE CA C 59 61.535 61.535 65.038 -3.503 17856 1222 1 4 . 1 1 59 59 ILE H H 59 8.220 8.220 8.080 0.140 17856 1223 1 4 . 1 1 60 60 GLU N N 60 124.000 124.000 120.094 3.906 17856 1224 1 4 . 1 1 60 60 GLU C C 60 177.007 177.007 177.713 -0.706 17856 1225 1 4 . 1 1 60 60 GLU CA C 60 56.722 56.722 59.212 -2.490 17856 1226 1 4 . 1 1 60 60 GLU H H 60 8.340 8.340 8.604 -0.264 17856 1227 1 4 . 1 1 61 61 GLY N N 61 110.520 110.520 104.168 6.352 17856 1228 1 4 . 1 1 61 61 GLY C C 61 174.002 174.002 173.943 0.059 17856 1229 1 4 . 1 1 61 61 GLY CA C 61 45.405 45.405 45.266 0.139 17856 1230 1 4 . 1 1 61 61 GLY H H 61 8.557 8.557 7.862 0.695 17856 1231 1 4 . 1 1 62 62 TYR N N 62 119.600 119.600 119.324 0.276 17856 1232 1 4 . 1 1 62 62 TYR C C 62 175.940 175.940 175.842 0.098 17856 1233 1 4 . 1 1 62 62 TYR CA C 62 58.108 58.108 58.907 -0.799 17856 1234 1 4 . 1 1 62 62 TYR H H 62 7.980 7.980 7.603 0.377 17856 1235 1 4 . 1 1 63 63 THR N N 63 116.304 116.304 118.859 -2.555 17856 1236 1 4 . 1 1 63 63 THR C C 63 173.796 173.796 173.700 0.096 17856 1237 1 4 . 1 1 63 63 THR H H 63 8.049 8.049 7.760 0.289 17856 1238 1 4 . 1 1 64 64 TYR N N 64 122.050 122.050 125.645 -3.595 17856 1239 1 4 . 1 1 64 64 TYR C C 64 176.290 176.290 175.170 1.120 17856 1240 1 4 . 1 1 64 64 TYR CA C 64 58.533 58.533 58.240 0.293 17856 1241 1 4 . 1 1 64 64 TYR H H 64 8.133 8.133 8.158 -0.025 17856 1242 1 4 . 1 1 65 65 GLY N N 65 110.456 110.456 109.563 0.893 17856 1243 1 4 . 1 1 65 65 GLY C C 65 174.340 174.340 175.385 -1.045 17856 1244 1 4 . 1 1 65 65 GLY CA C 65 45.328 45.328 45.844 -0.516 17856 1245 1 4 . 1 1 65 65 GLY H H 65 7.747 7.747 8.630 -0.883 17856 1246 1 4 . 1 1 66 66 GLU N N 66 120.783 120.783 121.766 -0.983 17856 1247 1 4 . 1 1 66 66 GLU C C 66 176.895 176.895 177.979 -1.084 17856 1248 1 4 . 1 1 66 66 GLU CA C 66 56.804 56.804 58.235 -1.431 17856 1249 1 4 . 1 1 66 66 GLU H H 66 8.243 8.243 9.035 -0.792 17856 1250 1 4 . 1 1 67 67 GLU N N 67 121.587 121.587 119.782 1.805 17856 1251 1 4 . 1 1 67 67 GLU C C 67 176.340 176.340 178.583 -2.243 17856 1252 1 4 . 1 1 67 67 GLU H H 67 8.611 8.611 8.775 -0.164 17856 1253 1 4 . 1 1 68 68 ARG N N 68 121.790 121.790 121.014 0.776 17856 1254 1 4 . 1 1 68 68 ARG C C 68 176.350 176.350 177.747 -1.397 17856 1255 1 4 . 1 1 68 68 ARG H H 68 8.267 8.267 7.659 0.608 17856 1256 1 4 . 1 1 69 69 LYS N N 69 118.431 118.431 118.528 -0.097 17856 1257 1 4 . 1 1 69 69 LYS H H 69 7.567 7.567 7.706 -0.139 17856 1258 1 4 . 1 1 70 70 LEU C C 70 177.338 177.338 176.645 0.693 17856 1259 1 4 . 1 1 70 70 LEU CA C 70 55.533 55.533 55.803 -0.270 17856 1260 1 4 . 1 1 71 71 TYR N N 71 119.504 119.504 116.503 3.001 17856 1261 1 4 . 1 1 71 71 TYR H H 71 7.997 7.997 7.320 0.677 17856 1262 1 4 . 1 1 72 72 ASP C C 72 176.528 176.528 178.074 -1.546 17856 1263 1 4 . 1 1 72 72 ASP CA C 72 54.693 54.693 58.362 -3.669 17856 1264 1 4 . 1 1 73 73 SER N N 73 117.000 117.000 114.058 2.942 17856 1265 1 4 . 1 1 73 73 SER C C 73 174.950 174.950 176.211 -1.261 17856 1266 1 4 . 1 1 73 73 SER CA C 73 58.997 58.997 61.029 -2.031 17856 1267 1 4 . 1 1 73 73 SER H H 73 8.282 8.282 8.372 -0.090 17856 1268 1 4 . 1 1 74 74 ALA N N 74 125.422 125.422 125.790 -0.368 17856 1269 1 4 . 1 1 74 74 ALA C C 74 178.389 178.389 179.670 -1.281 17856 1270 1 4 . 1 1 74 74 ALA CA C 74 53.433 53.433 54.778 -1.345 17856 1271 1 4 . 1 1 74 74 ALA H H 74 8.339 8.339 7.900 0.439 17856 1272 1 4 . 1 1 75 75 LEU N N 75 120.019 120.019 118.549 1.470 17856 1273 1 4 . 1 1 75 75 LEU C C 75 177.954 177.954 179.172 -1.218 17856 1274 1 4 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.383 -1.603 17856 1275 1 4 . 1 1 75 75 LEU H H 75 7.948 7.948 7.722 0.226 17856 1276 1 4 . 1 1 76 76 SER N N 76 113.321 113.321 115.334 -2.013 17856 1277 1 4 . 1 1 76 76 SER C C 76 174.784 174.784 176.924 -2.140 17856 1278 1 4 . 1 1 76 76 SER CA C 76 59.173 59.173 61.965 -2.792 17856 1279 1 4 . 1 1 76 76 SER H H 76 7.951 7.951 7.862 0.089 17856 1280 1 4 . 1 1 77 77 LYS N N 77 122.710 122.710 121.541 1.169 17856 1281 1 4 . 1 1 77 77 LYS C C 77 176.734 176.734 179.139 -2.405 17856 1282 1 4 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.259 -0.869 17856 1283 1 4 . 1 1 77 77 LYS H H 77 8.170 8.170 7.698 0.472 17856 1284 1 4 . 1 1 78 78 ILE N N 78 121.521 121.521 119.091 2.430 17856 1285 1 4 . 1 1 78 78 ILE C C 78 176.512 176.512 177.916 -1.404 17856 1286 1 4 . 1 1 78 78 ILE H H 78 8.160 8.160 7.580 0.580 17856 1287 1 4 . 1 1 79 79 GLU N N 79 123.840 123.840 121.168 2.672 17856 1288 1 4 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.813 -4.335 17856 1289 1 4 . 1 1 79 79 GLU H H 79 8.360 8.360 8.002 0.358 17856 1290 1 4 . 1 1 80 80 LYS N N 80 122.143 122.143 119.564 2.579 17856 1291 1 4 . 1 1 80 80 LYS C C 80 176.937 176.937 179.086 -2.149 17856 1292 1 4 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.304 -2.804 17856 1293 1 4 . 1 1 80 80 LYS H H 80 8.231 8.231 7.739 0.492 17856 1294 1 4 . 1 1 81 81 LEU N N 81 122.095 122.095 120.982 1.113 17856 1295 1 4 . 1 1 81 81 LEU C C 81 177.531 177.531 178.751 -1.220 17856 1296 1 4 . 1 1 81 81 LEU H H 81 8.050 8.050 7.473 0.577 17856 1297 1 4 . 1 1 82 82 ILE N N 82 120.609 120.609 119.277 1.332 17856 1298 1 4 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.673 -4.313 17856 1299 1 4 . 1 1 82 82 ILE H H 82 8.000 8.000 7.413 0.587 17856 1300 1 4 . 1 1 83 83 GLU N N 83 124.611 124.611 120.589 4.022 17856 1301 1 4 . 1 1 83 83 GLU C C 83 177.298 177.298 178.576 -1.278 17856 1302 1 4 . 1 1 83 83 GLU H H 83 8.380 8.380 8.044 0.336 17856 1303 1 4 . 1 1 84 84 THR N N 84 115.107 115.107 114.093 1.014 17856 1304 1 4 . 1 1 84 84 THR C C 84 174.400 174.400 175.666 -1.266 17856 1305 1 4 . 1 1 84 84 THR CA C 84 62.659 62.659 65.676 -3.017 17856 1306 1 4 . 1 1 84 84 THR H H 84 8.064 8.064 7.926 0.138 17856 1307 1 4 . 1 1 85 85 LEU N N 85 124.150 124.150 120.274 3.876 17856 1308 1 4 . 1 1 85 85 LEU C C 85 177.120 177.120 177.257 -0.137 17856 1309 1 4 . 1 1 85 85 LEU CA C 85 55.020 55.020 56.061 -1.041 17856 1310 1 4 . 1 1 85 85 LEU H H 85 8.238 8.238 7.737 0.501 17856 1311 1 4 . 1 1 86 86 SER N N 86 114.913 114.913 115.112 -0.199 17856 1312 1 4 . 1 1 86 86 SER H H 86 7.678 7.678 7.494 0.184 17856 1313 1 4 . 1 1 87 87 PRO CA C 87 63.550 63.550 63.757 -0.207 17856 1314 1 4 . 1 1 88 88 ALA N N 88 123.767 123.767 120.596 3.171 17856 1315 1 4 . 1 1 88 88 ALA C C 88 178.131 178.131 176.903 1.228 17856 1316 1 4 . 1 1 88 88 ALA CA C 88 52.878 52.878 52.644 0.234 17856 1317 1 4 . 1 1 88 88 ALA H H 88 8.342 8.342 7.838 0.504 17856 1318 1 4 . 1 1 89 89 ARG N N 89 119.159 119.159 120.778 -1.619 17856 1319 1 4 . 1 1 89 89 ARG C C 89 176.620 176.620 176.378 0.242 17856 1320 1 4 . 1 1 89 89 ARG H H 89 8.133 8.133 8.535 -0.402 17856 1321 1 4 . 1 1 90 90 SER N N 90 116.910 116.910 120.753 -3.843 17856 1322 1 4 . 1 1 90 90 SER C C 90 174.887 174.887 174.072 0.815 17856 1323 1 4 . 1 1 90 90 SER H H 90 8.322 8.322 8.768 -0.446 17856 1324 1 4 . 1 1 91 91 LYS N N 91 123.457 123.457 122.251 1.206 17856 1325 1 4 . 1 1 91 91 LYS C C 91 176.970 176.970 174.804 2.166 17856 1326 1 4 . 1 1 91 91 LYS H H 91 8.396 8.396 7.921 0.475 17856 1327 1 4 . 1 1 92 92 SER N N 92 116.692 116.692 116.574 0.118 17856 1328 1 4 . 1 1 92 92 SER C C 92 174.573 174.573 174.763 -0.190 17856 1329 1 4 . 1 1 92 92 SER CA C 92 58.600 58.600 57.870 0.730 17856 1330 1 4 . 1 1 92 92 SER H H 92 8.297 8.297 8.483 -0.186 17856 1331 1 4 . 1 1 93 93 GLN N N 93 121.916 121.916 124.537 -2.621 17856 1332 1 4 . 1 1 93 93 GLN C C 93 175.971 175.971 176.291 -0.320 17856 1333 1 4 . 1 1 93 93 GLN H H 93 8.325 8.325 8.614 -0.289 17856 1334 1 4 . 1 1 94 94 SER N N 94 117.385 117.385 119.065 -1.680 17856 1335 1 4 . 1 1 94 94 SER C C 94 173.940 173.940 173.998 -0.058 17856 1336 1 4 . 1 1 94 94 SER CA C 94 58.520 58.520 59.218 -0.698 17856 1337 1 4 . 1 1 94 94 SER H H 94 8.352 8.352 8.872 -0.520 17856 1338 1 4 . 1 1 95 95 THR N N 95 120.756 120.756 115.440 5.316 17856 1339 1 4 . 1 1 95 95 THR H H 95 7.805 7.805 7.876 -0.071 17856 1340 1 4 . 1 1 99 99 ARG C C 99 176.250 176.250 175.903 0.347 17856 1341 1 4 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.163 -0.006 17856 1342 1 4 . 1 1 100 100 ASN N N 100 118.482 118.482 118.749 -0.267 17856 1343 1 4 . 1 1 100 100 ASN H H 100 8.272 8.272 8.776 -0.504 17856 1344 1 4 . 1 1 101 101 ARG C C 101 176.280 176.280 176.968 -0.688 17856 1345 1 4 . 1 1 102 102 ASN N N 102 118.688 118.688 121.065 -2.377 17856 1346 1 4 . 1 1 102 102 ASN C C 102 174.996 174.996 175.179 -0.183 17856 1347 1 4 . 1 1 102 102 ASN CA C 102 53.609 53.609 54.697 -1.088 17856 1348 1 4 . 1 1 102 102 ASN H H 102 8.424 8.424 8.682 -0.258 17856 1349 1 4 . 1 1 103 103 ASN N N 103 118.865 118.865 117.304 1.561 17856 1350 1 4 . 1 1 103 103 ASN C C 103 175.040 175.040 174.396 0.644 17856 1351 1 4 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.321 0.491 17856 1352 1 4 . 1 1 103 103 ASN H H 103 8.282 8.282 8.473 -0.191 17856 1353 1 4 . 1 1 104 104 ARG N N 104 120.875 120.875 117.121 3.754 17856 1354 1 4 . 1 1 104 104 ARG H H 104 8.140 8.140 8.239 -0.099 17856 1355 1 4 . 1 1 106 106 ILE C C 106 175.408 175.408 175.197 0.211 17856 1356 1 4 . 1 1 106 106 ILE CA C 106 61.395 61.395 62.099 -0.704 17856 1357 1 5 . 1 1 2 2 SER N N 2 116.304 116.304 117.236 -0.932 17856 1358 1 5 . 1 1 2 2 SER C C 2 174.710 174.710 173.074 1.636 17856 1359 1 5 . 1 1 2 2 SER CA C 2 58.908 58.908 58.051 0.857 17856 1360 1 5 . 1 1 2 2 SER H H 2 8.003 8.003 8.471 -0.468 17856 1361 1 5 . 1 1 3 3 ILE N N 3 122.062 122.062 122.974 -0.912 17856 1362 1 5 . 1 1 3 3 ILE C C 3 176.750 176.750 175.821 0.929 17856 1363 1 5 . 1 1 3 3 ILE CA C 3 61.786 61.786 62.627 -0.841 17856 1364 1 5 . 1 1 3 3 ILE H H 3 7.957 7.957 8.627 -0.670 17856 1365 1 5 . 1 1 4 4 VAL N N 4 122.674 122.674 122.530 0.144 17856 1366 1 5 . 1 1 4 4 VAL C C 4 176.221 176.221 176.811 -0.590 17856 1367 1 5 . 1 1 4 4 VAL CA C 4 62.970 62.970 64.171 -1.201 17856 1368 1 5 . 1 1 4 4 VAL H H 4 7.970 7.970 8.207 -0.237 17856 1369 1 5 . 1 1 5 5 SER N N 5 117.750 117.750 113.889 3.861 17856 1370 1 5 . 1 1 5 5 SER C C 5 174.858 174.858 175.248 -0.390 17856 1371 1 5 . 1 1 5 5 SER CA C 5 58.630 58.630 60.129 -1.499 17856 1372 1 5 . 1 1 5 5 SER H H 5 8.093 8.093 7.927 0.166 17856 1373 1 5 . 1 1 6 6 GLN N N 6 121.961 121.961 121.402 0.559 17856 1374 1 5 . 1 1 6 6 GLN C C 6 176.467 176.467 175.084 1.383 17856 1375 1 5 . 1 1 6 6 GLN CA C 6 56.226 56.226 55.446 0.780 17856 1376 1 5 . 1 1 6 6 GLN H H 6 8.371 8.371 7.851 0.520 17856 1377 1 5 . 1 1 7 7 THR N N 7 115.325 115.325 112.537 2.788 17856 1378 1 5 . 1 1 7 7 THR C C 7 174.752 174.752 175.576 -0.824 17856 1379 1 5 . 1 1 7 7 THR H H 7 8.152 8.152 8.143 0.009 17856 1380 1 5 . 1 1 8 8 ARG N N 8 122.530 122.530 122.376 0.154 17856 1381 1 5 . 1 1 8 8 ARG C C 8 176.200 176.200 177.907 -1.707 17856 1382 1 5 . 1 1 8 8 ARG CA C 8 56.570 56.570 58.911 -2.341 17856 1383 1 5 . 1 1 8 8 ARG H H 8 8.211 8.211 8.651 -0.440 17856 1384 1 5 . 1 1 9 9 ASN N N 9 119.600 119.600 118.114 1.486 17856 1385 1 5 . 1 1 9 9 ASN C C 9 177.164 177.164 176.583 0.581 17856 1386 1 5 . 1 1 9 9 ASN H H 9 8.398 8.398 8.565 -0.167 17856 1387 1 5 . 1 1 10 10 LYS N N 10 121.600 121.600 119.449 2.151 17856 1388 1 5 . 1 1 10 10 LYS C C 10 176.845 176.845 178.544 -1.699 17856 1389 1 5 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.142 -2.032 17856 1390 1 5 . 1 1 10 10 LYS H H 10 8.190 8.190 8.280 -0.090 17856 1391 1 5 . 1 1 11 11 GLU N N 11 120.700 120.700 119.054 1.646 17856 1392 1 5 . 1 1 11 11 GLU C C 11 176.825 176.825 178.496 -1.671 17856 1393 1 5 . 1 1 11 11 GLU CA C 11 56.690 56.690 58.901 -2.211 17856 1394 1 5 . 1 1 11 11 GLU H H 11 8.323 8.323 7.341 0.982 17856 1395 1 5 . 1 1 12 12 LEU N N 12 122.390 122.390 121.978 0.412 17856 1396 1 5 . 1 1 12 12 LEU C C 12 177.670 177.670 178.872 -1.202 17856 1397 1 5 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.317 -2.847 17856 1398 1 5 . 1 1 12 12 LEU H H 12 8.155 8.155 8.370 -0.215 17856 1399 1 5 . 1 1 13 13 LEU N N 13 122.570 122.570 116.295 6.275 17856 1400 1 5 . 1 1 13 13 LEU C C 13 177.510 177.510 178.426 -0.916 17856 1401 1 5 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.577 -2.996 17856 1402 1 5 . 1 1 13 13 LEU H H 13 8.220 8.220 7.892 0.328 17856 1403 1 5 . 1 1 14 14 ASP N N 14 120.780 120.780 120.288 0.492 17856 1404 1 5 . 1 1 14 14 ASP C C 14 176.480 176.480 178.265 -1.785 17856 1405 1 5 . 1 1 14 14 ASP CA C 14 54.650 54.650 57.731 -3.081 17856 1406 1 5 . 1 1 14 14 ASP H H 14 8.243 8.243 7.605 0.638 17856 1407 1 5 . 1 1 15 15 LYS N N 15 120.900 120.900 120.425 0.475 17856 1408 1 5 . 1 1 15 15 LYS C C 15 175.580 175.580 178.939 -3.359 17856 1409 1 5 . 1 1 15 15 LYS H H 15 8.052 8.052 8.352 -0.300 17856 1410 1 5 . 1 1 16 16 LYS N N 16 121.980 121.980 119.058 2.922 17856 1411 1 5 . 1 1 16 16 LYS C C 16 176.887 176.887 179.036 -2.149 17856 1412 1 5 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.822 -2.488 17856 1413 1 5 . 1 1 16 16 LYS H H 16 8.243 8.243 7.924 0.319 17856 1414 1 5 . 1 1 17 17 ILE N N 17 121.940 121.940 120.004 1.936 17856 1415 1 5 . 1 1 17 17 ILE H H 17 8.110 8.110 8.040 0.070 17856 1416 1 5 . 1 1 18 18 ARG C C 18 176.520 176.520 177.966 -1.446 17856 1417 1 5 . 1 1 19 19 SER N N 19 117.150 117.150 114.178 2.972 17856 1418 1 5 . 1 1 19 19 SER C C 19 175.167 175.167 176.031 -0.864 17856 1419 1 5 . 1 1 19 19 SER CA C 19 58.840 58.840 61.263 -2.423 17856 1420 1 5 . 1 1 19 19 SER H H 19 8.396 8.396 7.788 0.608 17856 1421 1 5 . 1 1 20 20 GLU N N 20 123.176 123.176 122.238 0.938 17856 1422 1 5 . 1 1 20 20 GLU C C 20 176.921 176.921 179.021 -2.100 17856 1423 1 5 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.346 -2.486 17856 1424 1 5 . 1 1 20 20 GLU H H 20 8.478 8.478 8.362 0.116 17856 1425 1 5 . 1 1 21 21 ILE N N 21 120.550 120.550 113.551 6.999 17856 1426 1 5 . 1 1 21 21 ILE C C 21 176.550 176.550 177.887 -1.337 17856 1427 1 5 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.281 -2.651 17856 1428 1 5 . 1 1 21 21 ILE H H 21 8.080 8.080 7.448 0.632 17856 1429 1 5 . 1 1 22 22 GLU N N 22 123.685 123.685 121.206 2.479 17856 1430 1 5 . 1 1 22 22 GLU C C 22 176.109 176.109 178.478 -2.369 17856 1431 1 5 . 1 1 22 22 GLU H H 22 8.309 8.309 7.378 0.931 17856 1432 1 5 . 1 1 23 23 ALA N N 23 124.280 124.280 122.730 1.550 17856 1433 1 5 . 1 1 23 23 ALA C C 23 178.474 178.474 179.732 -1.258 17856 1434 1 5 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.185 -1.779 17856 1435 1 5 . 1 1 23 23 ALA H H 23 8.088 8.088 7.940 0.148 17856 1436 1 5 . 1 1 24 24 ILE N N 24 120.330 120.330 118.003 2.327 17856 1437 1 5 . 1 1 24 24 ILE C C 24 176.309 176.309 177.744 -1.435 17856 1438 1 5 . 1 1 24 24 ILE CA C 24 61.540 61.540 64.798 -3.258 17856 1439 1 5 . 1 1 24 24 ILE H H 24 7.980 7.980 7.694 0.286 17856 1440 1 5 . 1 1 25 25 LYS N N 25 124.310 124.310 120.241 4.069 17856 1441 1 5 . 1 1 25 25 LYS C C 25 176.365 176.365 178.807 -2.442 17856 1442 1 5 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.008 -2.674 17856 1443 1 5 . 1 1 25 25 LYS H H 25 8.198 8.198 7.682 0.516 17856 1444 1 5 . 1 1 26 26 LYS N N 26 122.518 122.518 119.246 3.272 17856 1445 1 5 . 1 1 26 26 LYS C C 26 176.365 176.365 178.549 -2.184 17856 1446 1 5 . 1 1 26 26 LYS CA C 26 56.175 56.175 58.542 -2.367 17856 1447 1 5 . 1 1 26 26 LYS H H 26 8.125 8.125 7.589 0.536 17856 1448 1 5 . 1 1 27 27 ILE N N 27 122.670 122.670 120.424 2.246 17856 1449 1 5 . 1 1 27 27 ILE C C 27 176.261 176.261 178.234 -1.973 17856 1450 1 5 . 1 1 27 27 ILE CA C 27 61.294 61.294 64.510 -3.216 17856 1451 1 5 . 1 1 27 27 ILE H H 27 8.114 8.114 7.807 0.307 17856 1452 1 5 . 1 1 28 28 ILE N N 28 125.178 125.178 119.858 5.320 17856 1453 1 5 . 1 1 28 28 ILE C C 28 175.803 175.803 177.079 -1.276 17856 1454 1 5 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.983 -2.903 17856 1455 1 5 . 1 1 28 28 ILE H H 28 8.220 8.220 7.708 0.512 17856 1456 1 5 . 1 1 29 29 ALA N N 29 127.850 127.850 121.279 6.571 17856 1457 1 5 . 1 1 29 29 ALA C C 29 177.627 177.627 179.744 -2.117 17856 1458 1 5 . 1 1 29 29 ALA CA C 29 53.684 53.684 54.981 -1.298 17856 1459 1 5 . 1 1 29 29 ALA H H 29 8.300 8.300 7.195 1.105 17856 1460 1 5 . 1 1 30 30 GLU N N 30 120.000 120.000 119.424 0.576 17856 1461 1 5 . 1 1 30 30 GLU C C 30 176.321 176.321 178.998 -2.677 17856 1462 1 5 . 1 1 30 30 GLU H H 30 8.258 8.258 8.178 0.080 17856 1463 1 5 . 1 1 31 31 PHE N N 31 119.128 119.128 118.066 1.062 17856 1464 1 5 . 1 1 31 31 PHE C C 31 175.180 175.180 178.176 -2.996 17856 1465 1 5 . 1 1 31 31 PHE CA C 31 57.540 57.540 61.352 -3.812 17856 1466 1 5 . 1 1 31 31 PHE H H 31 8.061 8.061 7.691 0.370 17856 1467 1 5 . 1 1 32 32 ASP N N 32 121.800 121.800 118.882 2.918 17856 1468 1 5 . 1 1 32 32 ASP C C 32 175.894 175.894 178.495 -2.601 17856 1469 1 5 . 1 1 32 32 ASP CA C 32 54.529 54.529 57.388 -2.859 17856 1470 1 5 . 1 1 32 32 ASP H H 32 8.275 8.275 7.800 0.475 17856 1471 1 5 . 1 1 33 33 VAL N N 33 119.648 119.648 120.186 -0.538 17856 1472 1 5 . 1 1 33 33 VAL C C 33 176.268 176.268 178.295 -2.027 17856 1473 1 5 . 1 1 33 33 VAL CA C 33 62.500 62.500 66.328 -3.828 17856 1474 1 5 . 1 1 33 33 VAL H H 33 8.059 8.059 7.697 0.362 17856 1475 1 5 . 1 1 34 34 VAL N N 34 123.882 123.882 119.842 4.040 17856 1476 1 5 . 1 1 34 34 VAL H H 34 7.774 7.774 8.214 -0.440 17856 1477 1 5 . 1 1 35 35 LYS N N 35 125.250 125.250 119.884 5.366 17856 1478 1 5 . 1 1 35 35 LYS C C 35 176.719 176.719 178.303 -1.584 17856 1479 1 5 . 1 1 35 35 LYS CA C 35 56.502 56.502 59.936 -3.434 17856 1480 1 5 . 1 1 35 35 LYS H H 35 8.357 8.357 7.853 0.504 17856 1481 1 5 . 1 1 36 36 GLU N N 36 121.850 121.850 117.649 4.201 17856 1482 1 5 . 1 1 36 36 GLU C C 36 176.426 176.426 179.581 -3.155 17856 1483 1 5 . 1 1 36 36 GLU H H 36 8.423 8.423 7.869 0.554 17856 1484 1 5 . 1 1 37 37 SER N N 37 117.100 117.100 116.201 0.899 17856 1485 1 5 . 1 1 37 37 SER C C 37 174.854 174.854 176.716 -1.862 17856 1486 1 5 . 1 1 37 37 SER CA C 37 58.850 58.850 61.749 -2.899 17856 1487 1 5 . 1 1 37 37 SER H H 37 8.362 8.362 8.226 0.136 17856 1488 1 5 . 1 1 38 38 VAL N N 38 121.625 121.625 121.537 0.088 17856 1489 1 5 . 1 1 38 38 VAL C C 38 176.246 176.246 174.926 1.320 17856 1490 1 5 . 1 1 38 38 VAL CA C 38 63.043 63.043 62.014 1.029 17856 1491 1 5 . 1 1 38 38 VAL H H 38 8.225 8.225 8.037 0.188 17856 1492 1 5 . 1 1 39 39 ASN N N 39 121.150 121.150 119.851 1.299 17856 1493 1 5 . 1 1 39 39 ASN C C 39 175.459 175.459 175.872 -0.413 17856 1494 1 5 . 1 1 39 39 ASN CA C 39 53.568 53.568 54.258 -0.690 17856 1495 1 5 . 1 1 39 39 ASN H H 39 8.366 8.366 7.895 0.471 17856 1496 1 5 . 1 1 40 40 GLU N N 40 121.500 121.500 118.747 2.753 17856 1497 1 5 . 1 1 40 40 GLU C C 40 175.459 175.459 174.894 0.565 17856 1498 1 5 . 1 1 40 40 GLU CA C 40 56.860 56.860 56.008 0.852 17856 1499 1 5 . 1 1 40 40 GLU H H 40 8.370 8.370 8.250 0.120 17856 1500 1 5 . 1 1 41 41 LEU N N 41 121.950 121.950 122.968 -1.018 17856 1501 1 5 . 1 1 41 41 LEU C C 41 177.939 177.939 177.463 0.476 17856 1502 1 5 . 1 1 41 41 LEU CA C 41 56.040 56.040 55.543 0.497 17856 1503 1 5 . 1 1 41 41 LEU H H 41 8.152 8.152 8.449 -0.297 17856 1504 1 5 . 1 1 42 42 SER N N 42 113.326 113.326 116.623 -3.297 17856 1505 1 5 . 1 1 42 42 SER C C 42 174.660 174.660 176.138 -1.478 17856 1506 1 5 . 1 1 42 42 SER CA C 42 58.940 58.940 62.044 -3.104 17856 1507 1 5 . 1 1 42 42 SER H H 42 8.373 8.373 8.431 -0.058 17856 1508 1 5 . 1 1 43 43 GLU N N 43 121.521 121.521 120.483 1.038 17856 1509 1 5 . 1 1 43 43 GLU C C 43 177.349 177.349 178.983 -1.634 17856 1510 1 5 . 1 1 43 43 GLU H H 43 7.329 7.329 8.267 -0.938 17856 1511 1 5 . 1 1 44 44 LYS N N 44 121.240 121.240 120.242 0.998 17856 1512 1 5 . 1 1 44 44 LYS C C 44 177.246 177.246 177.902 -0.656 17856 1513 1 5 . 1 1 44 44 LYS CA C 44 56.397 56.397 58.189 -1.792 17856 1514 1 5 . 1 1 44 44 LYS H H 44 8.103 8.103 7.619 0.484 17856 1515 1 5 . 1 1 45 45 ALA N N 45 119.568 119.568 120.534 -0.966 17856 1516 1 5 . 1 1 45 45 ALA C C 45 177.853 177.853 178.741 -0.888 17856 1517 1 5 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.044 -1.484 17856 1518 1 5 . 1 1 45 45 ALA H H 45 8.541 8.541 7.493 1.048 17856 1519 1 5 . 1 1 46 46 LYS N N 46 115.235 115.235 118.311 -3.076 17856 1520 1 5 . 1 1 46 46 LYS C C 46 177.110 177.110 178.147 -1.037 17856 1521 1 5 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.734 -1.938 17856 1522 1 5 . 1 1 46 46 LYS H H 46 7.257 7.257 7.633 -0.376 17856 1523 1 5 . 1 1 47 47 THR N N 47 103.239 103.239 110.547 -7.308 17856 1524 1 5 . 1 1 47 47 THR C C 47 173.973 173.973 174.660 -0.687 17856 1525 1 5 . 1 1 47 47 THR CA C 47 62.740 62.740 63.131 -0.391 17856 1526 1 5 . 1 1 47 47 THR H H 47 7.381 7.381 7.623 -0.242 17856 1527 1 5 . 1 1 48 48 ASP N N 48 122.976 122.976 122.996 -0.020 17856 1528 1 5 . 1 1 48 48 ASP H H 48 8.031 8.031 8.106 -0.075 17856 1529 1 5 . 1 1 49 49 PRO C C 49 178.106 178.106 178.532 -0.426 17856 1530 1 5 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.660 -0.441 17856 1531 1 5 . 1 1 50 50 GLN N N 50 118.351 118.351 118.615 -0.264 17856 1532 1 5 . 1 1 50 50 GLN C C 50 176.944 176.944 178.531 -1.587 17856 1533 1 5 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.375 -1.575 17856 1534 1 5 . 1 1 50 50 GLN H H 50 8.304 8.304 8.257 0.047 17856 1535 1 5 . 1 1 51 51 ALA N N 51 124.206 124.206 122.802 1.404 17856 1536 1 5 . 1 1 51 51 ALA C C 51 178.490 178.490 179.042 -0.552 17856 1537 1 5 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.791 -1.367 17856 1538 1 5 . 1 1 51 51 ALA H H 51 7.547 7.547 7.968 -0.421 17856 1539 1 5 . 1 1 52 52 ALA N N 52 118.686 118.686 120.452 -1.766 17856 1540 1 5 . 1 1 52 52 ALA C C 52 177.953 177.953 179.148 -1.195 17856 1541 1 5 . 1 1 52 52 ALA H H 52 7.931 7.931 7.729 0.202 17856 1542 1 5 . 1 1 53 53 GLU N N 53 120.075 120.075 116.855 3.220 17856 1543 1 5 . 1 1 53 53 GLU H H 53 7.729 7.729 7.791 -0.062 17856 1544 1 5 . 1 1 55 55 LEU N N 55 123.640 123.640 120.881 2.759 17856 1545 1 5 . 1 1 55 55 LEU C C 55 177.587 177.587 178.625 -1.038 17856 1546 1 5 . 1 1 55 55 LEU CA C 55 55.787 55.787 56.932 -1.145 17856 1547 1 5 . 1 1 55 55 LEU H H 55 8.215 8.215 8.136 0.079 17856 1548 1 5 . 1 1 56 56 ASN N N 56 118.520 118.520 117.989 0.531 17856 1549 1 5 . 1 1 56 56 ASN C C 56 175.700 175.700 176.389 -0.689 17856 1550 1 5 . 1 1 56 56 ASN CA C 56 54.132 54.132 55.436 -1.304 17856 1551 1 5 . 1 1 56 56 ASN H H 56 8.250 8.250 7.820 0.430 17856 1552 1 5 . 1 1 57 57 LYS N N 57 120.960 120.960 116.731 4.229 17856 1553 1 5 . 1 1 57 57 LYS C C 57 176.637 176.637 177.534 -0.897 17856 1554 1 5 . 1 1 57 57 LYS H H 57 8.065 8.065 7.617 0.448 17856 1555 1 5 . 1 1 58 58 LEU N N 58 122.610 122.610 121.194 1.416 17856 1556 1 5 . 1 1 58 58 LEU C C 58 177.433 177.433 178.292 -0.859 17856 1557 1 5 . 1 1 58 58 LEU CA C 58 55.120 55.120 55.719 -0.599 17856 1558 1 5 . 1 1 58 58 LEU H H 58 8.135 8.135 7.662 0.473 17856 1559 1 5 . 1 1 59 59 ILE N N 59 122.045 122.045 121.758 0.287 17856 1560 1 5 . 1 1 59 59 ILE CA C 59 61.535 61.535 65.015 -3.480 17856 1561 1 5 . 1 1 59 59 ILE H H 59 8.220 8.220 7.659 0.561 17856 1562 1 5 . 1 1 60 60 GLU N N 60 124.000 124.000 119.441 4.559 17856 1563 1 5 . 1 1 60 60 GLU C C 60 177.007 177.007 178.288 -1.281 17856 1564 1 5 . 1 1 60 60 GLU CA C 60 56.722 56.722 58.254 -1.532 17856 1565 1 5 . 1 1 60 60 GLU H H 60 8.340 8.340 8.141 0.199 17856 1566 1 5 . 1 1 61 61 GLY N N 61 110.520 110.520 106.883 3.637 17856 1567 1 5 . 1 1 61 61 GLY C C 61 174.002 174.002 175.009 -1.007 17856 1568 1 5 . 1 1 61 61 GLY CA C 61 45.405 45.405 46.304 -0.900 17856 1569 1 5 . 1 1 61 61 GLY H H 61 8.557 8.557 7.692 0.865 17856 1570 1 5 . 1 1 62 62 TYR N N 62 119.600 119.600 117.379 2.221 17856 1571 1 5 . 1 1 62 62 TYR C C 62 175.940 175.940 177.101 -1.161 17856 1572 1 5 . 1 1 62 62 TYR CA C 62 58.108 58.108 58.875 -0.767 17856 1573 1 5 . 1 1 62 62 TYR H H 62 7.980 7.980 7.092 0.888 17856 1574 1 5 . 1 1 63 63 THR N N 63 116.304 116.304 115.379 0.925 17856 1575 1 5 . 1 1 63 63 THR C C 63 173.796 173.796 175.214 -1.418 17856 1576 1 5 . 1 1 63 63 THR H H 63 8.049 8.049 7.026 1.023 17856 1577 1 5 . 1 1 64 64 TYR N N 64 122.050 122.050 122.205 -0.155 17856 1578 1 5 . 1 1 64 64 TYR C C 64 176.290 176.290 175.942 0.348 17856 1579 1 5 . 1 1 64 64 TYR CA C 64 58.533 58.533 57.031 1.502 17856 1580 1 5 . 1 1 64 64 TYR H H 64 8.133 8.133 7.328 0.805 17856 1581 1 5 . 1 1 65 65 GLY N N 65 110.456 110.456 111.174 -0.718 17856 1582 1 5 . 1 1 65 65 GLY C C 65 174.340 174.340 174.508 -0.168 17856 1583 1 5 . 1 1 65 65 GLY CA C 65 45.328 45.328 45.888 -0.560 17856 1584 1 5 . 1 1 65 65 GLY H H 65 7.747 7.747 8.098 -0.351 17856 1585 1 5 . 1 1 66 66 GLU N N 66 120.783 120.783 120.682 0.101 17856 1586 1 5 . 1 1 66 66 GLU C C 66 176.895 176.895 177.794 -0.899 17856 1587 1 5 . 1 1 66 66 GLU CA C 66 56.804 56.804 57.385 -0.581 17856 1588 1 5 . 1 1 66 66 GLU H H 66 8.243 8.243 8.515 -0.272 17856 1589 1 5 . 1 1 67 67 GLU N N 67 121.587 121.587 119.871 1.716 17856 1590 1 5 . 1 1 67 67 GLU C C 67 176.340 176.340 178.169 -1.829 17856 1591 1 5 . 1 1 67 67 GLU H H 67 8.611 8.611 8.816 -0.205 17856 1592 1 5 . 1 1 68 68 ARG N N 68 121.790 121.790 119.415 2.375 17856 1593 1 5 . 1 1 68 68 ARG C C 68 176.350 176.350 178.004 -1.654 17856 1594 1 5 . 1 1 68 68 ARG H H 68 8.267 8.267 8.531 -0.264 17856 1595 1 5 . 1 1 69 69 LYS N N 69 118.431 118.431 120.363 -1.932 17856 1596 1 5 . 1 1 69 69 LYS H H 69 7.567 7.567 7.655 -0.088 17856 1597 1 5 . 1 1 70 70 LEU C C 70 177.338 177.338 178.140 -0.802 17856 1598 1 5 . 1 1 70 70 LEU CA C 70 55.533 55.533 56.312 -0.779 17856 1599 1 5 . 1 1 71 71 TYR N N 71 119.504 119.504 115.734 3.770 17856 1600 1 5 . 1 1 71 71 TYR H H 71 7.997 7.997 7.293 0.704 17856 1601 1 5 . 1 1 72 72 ASP C C 72 176.528 176.528 178.177 -1.649 17856 1602 1 5 . 1 1 72 72 ASP CA C 72 54.693 54.693 57.289 -2.596 17856 1603 1 5 . 1 1 73 73 SER N N 73 117.000 117.000 115.540 1.460 17856 1604 1 5 . 1 1 73 73 SER C C 73 174.950 174.950 176.251 -1.301 17856 1605 1 5 . 1 1 73 73 SER CA C 73 58.997 58.997 61.266 -2.269 17856 1606 1 5 . 1 1 73 73 SER H H 73 8.282 8.282 7.677 0.605 17856 1607 1 5 . 1 1 74 74 ALA N N 74 125.422 125.422 124.861 0.561 17856 1608 1 5 . 1 1 74 74 ALA C C 74 178.389 178.389 179.542 -1.153 17856 1609 1 5 . 1 1 74 74 ALA CA C 74 53.433 53.433 55.048 -1.615 17856 1610 1 5 . 1 1 74 74 ALA H H 74 8.339 8.339 7.672 0.667 17856 1611 1 5 . 1 1 75 75 LEU N N 75 120.019 120.019 118.409 1.610 17856 1612 1 5 . 1 1 75 75 LEU C C 75 177.954 177.954 178.971 -1.017 17856 1613 1 5 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.303 -1.523 17856 1614 1 5 . 1 1 75 75 LEU H H 75 7.948 7.948 7.695 0.253 17856 1615 1 5 . 1 1 76 76 SER N N 76 113.321 113.321 115.122 -1.801 17856 1616 1 5 . 1 1 76 76 SER C C 76 174.784 174.784 176.673 -1.889 17856 1617 1 5 . 1 1 76 76 SER CA C 76 59.173 59.173 61.615 -2.442 17856 1618 1 5 . 1 1 76 76 SER H H 76 7.951 7.951 7.697 0.254 17856 1619 1 5 . 1 1 77 77 LYS N N 77 122.710 122.710 121.529 1.181 17856 1620 1 5 . 1 1 77 77 LYS C C 77 176.734 176.734 178.604 -1.870 17856 1621 1 5 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.553 -1.163 17856 1622 1 5 . 1 1 77 77 LYS H H 77 8.170 8.170 7.642 0.528 17856 1623 1 5 . 1 1 78 78 ILE N N 78 121.521 121.521 118.222 3.299 17856 1624 1 5 . 1 1 78 78 ILE C C 78 176.512 176.512 178.328 -1.816 17856 1625 1 5 . 1 1 78 78 ILE H H 78 8.160 8.160 7.204 0.956 17856 1626 1 5 . 1 1 79 79 GLU N N 79 123.840 123.840 120.845 2.995 17856 1627 1 5 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.548 -4.070 17856 1628 1 5 . 1 1 79 79 GLU H H 79 8.360 8.360 7.834 0.526 17856 1629 1 5 . 1 1 80 80 LYS N N 80 122.143 122.143 119.553 2.590 17856 1630 1 5 . 1 1 80 80 LYS C C 80 176.937 176.937 179.059 -2.122 17856 1631 1 5 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.242 -2.742 17856 1632 1 5 . 1 1 80 80 LYS H H 80 8.231 8.231 7.516 0.715 17856 1633 1 5 . 1 1 81 81 LEU N N 81 122.095 122.095 121.613 0.482 17856 1634 1 5 . 1 1 81 81 LEU C C 81 177.531 177.531 178.697 -1.166 17856 1635 1 5 . 1 1 81 81 LEU H H 81 8.050 8.050 7.428 0.622 17856 1636 1 5 . 1 1 82 82 ILE N N 82 120.609 120.609 118.228 2.381 17856 1637 1 5 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.235 -3.875 17856 1638 1 5 . 1 1 82 82 ILE H H 82 8.000 8.000 7.585 0.415 17856 1639 1 5 . 1 1 83 83 GLU N N 83 124.611 124.611 120.638 3.973 17856 1640 1 5 . 1 1 83 83 GLU C C 83 177.298 177.298 179.441 -2.143 17856 1641 1 5 . 1 1 83 83 GLU H H 83 8.380 8.380 7.992 0.388 17856 1642 1 5 . 1 1 84 84 THR N N 84 115.107 115.107 114.921 0.186 17856 1643 1 5 . 1 1 84 84 THR C C 84 174.400 174.400 175.117 -0.717 17856 1644 1 5 . 1 1 84 84 THR CA C 84 62.659 62.659 65.330 -2.671 17856 1645 1 5 . 1 1 84 84 THR H H 84 8.064 8.064 8.064 0.000 17856 1646 1 5 . 1 1 85 85 LEU N N 85 124.150 124.150 120.415 3.735 17856 1647 1 5 . 1 1 85 85 LEU C C 85 177.120 177.120 176.229 0.891 17856 1648 1 5 . 1 1 85 85 LEU CA C 85 55.020 55.020 54.433 0.587 17856 1649 1 5 . 1 1 85 85 LEU H H 85 8.238 8.238 7.108 1.130 17856 1650 1 5 . 1 1 86 86 SER N N 86 114.913 114.913 116.487 -1.574 17856 1651 1 5 . 1 1 86 86 SER H H 86 7.678 7.678 7.508 0.170 17856 1652 1 5 . 1 1 87 87 PRO CA C 87 63.550 63.550 64.084 -0.534 17856 1653 1 5 . 1 1 88 88 ALA N N 88 123.767 123.767 119.807 3.960 17856 1654 1 5 . 1 1 88 88 ALA C C 88 178.131 178.131 177.020 1.111 17856 1655 1 5 . 1 1 88 88 ALA CA C 88 52.878 52.878 53.413 -0.536 17856 1656 1 5 . 1 1 88 88 ALA H H 88 8.342 8.342 8.516 -0.174 17856 1657 1 5 . 1 1 89 89 ARG N N 89 119.159 119.159 120.567 -1.408 17856 1658 1 5 . 1 1 89 89 ARG C C 89 176.620 176.620 175.637 0.983 17856 1659 1 5 . 1 1 89 89 ARG H H 89 8.133 8.133 8.066 0.067 17856 1660 1 5 . 1 1 90 90 SER N N 90 116.910 116.910 119.736 -2.826 17856 1661 1 5 . 1 1 90 90 SER C C 90 174.887 174.887 174.040 0.847 17856 1662 1 5 . 1 1 90 90 SER H H 90 8.322 8.322 8.603 -0.281 17856 1663 1 5 . 1 1 91 91 LYS N N 91 123.457 123.457 127.174 -3.717 17856 1664 1 5 . 1 1 91 91 LYS C C 91 176.970 176.970 176.231 0.739 17856 1665 1 5 . 1 1 91 91 LYS H H 91 8.396 8.396 8.430 -0.034 17856 1666 1 5 . 1 1 92 92 SER N N 92 116.692 116.692 122.129 -5.437 17856 1667 1 5 . 1 1 92 92 SER C C 92 174.573 174.573 174.436 0.137 17856 1668 1 5 . 1 1 92 92 SER CA C 92 58.600 58.600 57.809 0.791 17856 1669 1 5 . 1 1 92 92 SER H H 92 8.297 8.297 8.565 -0.268 17856 1670 1 5 . 1 1 93 93 GLN N N 93 121.916 121.916 123.199 -1.283 17856 1671 1 5 . 1 1 93 93 GLN C C 93 175.971 175.971 175.655 0.316 17856 1672 1 5 . 1 1 93 93 GLN H H 93 8.325 8.325 8.433 -0.108 17856 1673 1 5 . 1 1 94 94 SER N N 94 117.385 117.385 115.901 1.484 17856 1674 1 5 . 1 1 94 94 SER C C 94 173.940 173.940 173.646 0.294 17856 1675 1 5 . 1 1 94 94 SER CA C 94 58.520 58.520 58.692 -0.172 17856 1676 1 5 . 1 1 94 94 SER H H 94 8.352 8.352 8.760 -0.408 17856 1677 1 5 . 1 1 95 95 THR N N 95 120.756 120.756 115.057 5.699 17856 1678 1 5 . 1 1 95 95 THR H H 95 7.805 7.805 8.196 -0.391 17856 1679 1 5 . 1 1 99 99 ARG C C 99 176.250 176.250 175.762 0.488 17856 1680 1 5 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.600 -0.443 17856 1681 1 5 . 1 1 100 100 ASN N N 100 118.482 118.482 120.573 -2.091 17856 1682 1 5 . 1 1 100 100 ASN H H 100 8.272 8.272 8.658 -0.386 17856 1683 1 5 . 1 1 101 101 ARG C C 101 176.280 176.280 176.144 0.136 17856 1684 1 5 . 1 1 102 102 ASN N N 102 118.688 118.688 122.721 -4.033 17856 1685 1 5 . 1 1 102 102 ASN C C 102 174.996 174.996 175.085 -0.089 17856 1686 1 5 . 1 1 102 102 ASN CA C 102 53.609 53.609 54.081 -0.472 17856 1687 1 5 . 1 1 102 102 ASN H H 102 8.424 8.424 8.654 -0.230 17856 1688 1 5 . 1 1 103 103 ASN N N 103 118.865 118.865 117.076 1.789 17856 1689 1 5 . 1 1 103 103 ASN C C 103 175.040 175.040 173.810 1.230 17856 1690 1 5 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.676 0.136 17856 1691 1 5 . 1 1 103 103 ASN H H 103 8.282 8.282 8.565 -0.283 17856 1692 1 5 . 1 1 104 104 ARG N N 104 120.875 120.875 113.980 6.895 17856 1693 1 5 . 1 1 104 104 ARG H H 104 8.140 8.140 8.503 -0.363 17856 1694 1 5 . 1 1 106 106 ILE C C 106 175.408 175.408 175.092 0.316 17856 1695 1 5 . 1 1 106 106 ILE CA C 106 61.395 61.395 61.629 -0.234 17856 1696 1 6 . 1 1 2 2 SER N N 2 116.304 116.304 118.716 -2.412 17856 1697 1 6 . 1 1 2 2 SER C C 2 174.710 174.710 175.865 -1.155 17856 1698 1 6 . 1 1 2 2 SER CA C 2 58.908 58.908 60.247 -1.339 17856 1699 1 6 . 1 1 2 2 SER H H 2 8.003 8.003 8.816 -0.813 17856 1700 1 6 . 1 1 3 3 ILE N N 3 122.062 122.062 123.408 -1.346 17856 1701 1 6 . 1 1 3 3 ILE C C 3 176.750 176.750 176.467 0.283 17856 1702 1 6 . 1 1 3 3 ILE CA C 3 61.786 61.786 63.463 -1.677 17856 1703 1 6 . 1 1 3 3 ILE H H 3 7.957 7.957 7.536 0.421 17856 1704 1 6 . 1 1 4 4 VAL N N 4 122.674 122.674 117.033 5.641 17856 1705 1 6 . 1 1 4 4 VAL C C 4 176.221 176.221 175.913 0.308 17856 1706 1 6 . 1 1 4 4 VAL CA C 4 62.970 62.970 63.279 -0.309 17856 1707 1 6 . 1 1 4 4 VAL H H 4 7.970 7.970 7.551 0.419 17856 1708 1 6 . 1 1 5 5 SER N N 5 117.750 117.750 114.435 3.315 17856 1709 1 6 . 1 1 5 5 SER C C 5 174.858 174.858 175.382 -0.524 17856 1710 1 6 . 1 1 5 5 SER CA C 5 58.630 58.630 59.701 -1.071 17856 1711 1 6 . 1 1 5 5 SER H H 5 8.093 8.093 7.719 0.374 17856 1712 1 6 . 1 1 6 6 GLN N N 6 121.961 121.961 122.368 -0.407 17856 1713 1 6 . 1 1 6 6 GLN C C 6 176.467 176.467 175.727 0.740 17856 1714 1 6 . 1 1 6 6 GLN CA C 6 56.226 56.226 55.214 1.012 17856 1715 1 6 . 1 1 6 6 GLN H H 6 8.371 8.371 8.519 -0.148 17856 1716 1 6 . 1 1 7 7 THR N N 7 115.325 115.325 115.525 -0.200 17856 1717 1 6 . 1 1 7 7 THR C C 7 174.752 174.752 175.880 -1.128 17856 1718 1 6 . 1 1 7 7 THR H H 7 8.152 8.152 8.017 0.135 17856 1719 1 6 . 1 1 8 8 ARG N N 8 122.530 122.530 123.318 -0.788 17856 1720 1 6 . 1 1 8 8 ARG C C 8 176.200 176.200 177.962 -1.762 17856 1721 1 6 . 1 1 8 8 ARG CA C 8 56.570 56.570 59.314 -2.744 17856 1722 1 6 . 1 1 8 8 ARG H H 8 8.211 8.211 8.654 -0.443 17856 1723 1 6 . 1 1 9 9 ASN N N 9 119.600 119.600 117.607 1.993 17856 1724 1 6 . 1 1 9 9 ASN C C 9 177.164 177.164 176.690 0.474 17856 1725 1 6 . 1 1 9 9 ASN H H 9 8.398 8.398 8.397 0.001 17856 1726 1 6 . 1 1 10 10 LYS N N 10 121.600 121.600 120.804 0.796 17856 1727 1 6 . 1 1 10 10 LYS C C 10 176.845 176.845 178.771 -1.926 17856 1728 1 6 . 1 1 10 10 LYS CA C 10 57.110 57.110 58.969 -1.859 17856 1729 1 6 . 1 1 10 10 LYS H H 10 8.190 8.190 8.274 -0.084 17856 1730 1 6 . 1 1 11 11 GLU N N 11 120.700 120.700 119.509 1.191 17856 1731 1 6 . 1 1 11 11 GLU C C 11 176.825 176.825 178.592 -1.767 17856 1732 1 6 . 1 1 11 11 GLU CA C 11 56.690 56.690 59.223 -2.533 17856 1733 1 6 . 1 1 11 11 GLU H H 11 8.323 8.323 7.698 0.625 17856 1734 1 6 . 1 1 12 12 LEU N N 12 122.390 122.390 121.512 0.878 17856 1735 1 6 . 1 1 12 12 LEU C C 12 177.670 177.670 178.883 -1.213 17856 1736 1 6 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.200 -2.730 17856 1737 1 6 . 1 1 12 12 LEU H H 12 8.155 8.155 7.947 0.208 17856 1738 1 6 . 1 1 13 13 LEU N N 13 122.570 122.570 116.136 6.434 17856 1739 1 6 . 1 1 13 13 LEU C C 13 177.510 177.510 178.622 -1.112 17856 1740 1 6 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.522 -2.941 17856 1741 1 6 . 1 1 13 13 LEU H H 13 8.220 8.220 7.979 0.241 17856 1742 1 6 . 1 1 14 14 ASP N N 14 120.780 120.780 120.771 0.009 17856 1743 1 6 . 1 1 14 14 ASP C C 14 176.480 176.480 178.564 -2.084 17856 1744 1 6 . 1 1 14 14 ASP CA C 14 54.650 54.650 57.904 -3.254 17856 1745 1 6 . 1 1 14 14 ASP H H 14 8.243 8.243 7.801 0.442 17856 1746 1 6 . 1 1 15 15 LYS N N 15 120.900 120.900 119.519 1.381 17856 1747 1 6 . 1 1 15 15 LYS C C 15 175.580 175.580 179.183 -3.603 17856 1748 1 6 . 1 1 15 15 LYS H H 15 8.052 8.052 8.067 -0.015 17856 1749 1 6 . 1 1 16 16 LYS N N 16 121.980 121.980 119.565 2.415 17856 1750 1 6 . 1 1 16 16 LYS C C 16 176.887 176.887 179.033 -2.146 17856 1751 1 6 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.638 -2.304 17856 1752 1 6 . 1 1 16 16 LYS H H 16 8.243 8.243 7.672 0.571 17856 1753 1 6 . 1 1 17 17 ILE N N 17 121.940 121.940 119.656 2.284 17856 1754 1 6 . 1 1 17 17 ILE H H 17 8.110 8.110 8.341 -0.231 17856 1755 1 6 . 1 1 18 18 ARG C C 18 176.520 176.520 178.466 -1.946 17856 1756 1 6 . 1 1 19 19 SER N N 19 117.150 117.150 113.621 3.529 17856 1757 1 6 . 1 1 19 19 SER C C 19 175.167 175.167 175.807 -0.640 17856 1758 1 6 . 1 1 19 19 SER CA C 19 58.840 58.840 61.231 -2.391 17856 1759 1 6 . 1 1 19 19 SER H H 19 8.396 8.396 7.701 0.695 17856 1760 1 6 . 1 1 20 20 GLU N N 20 123.176 123.176 122.091 1.085 17856 1761 1 6 . 1 1 20 20 GLU C C 20 176.921 176.921 178.817 -1.896 17856 1762 1 6 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.281 -2.421 17856 1763 1 6 . 1 1 20 20 GLU H H 20 8.478 8.478 7.471 1.007 17856 1764 1 6 . 1 1 21 21 ILE N N 21 120.550 120.550 115.464 5.086 17856 1765 1 6 . 1 1 21 21 ILE C C 21 176.550 176.550 177.989 -1.439 17856 1766 1 6 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.724 -3.094 17856 1767 1 6 . 1 1 21 21 ILE H H 21 8.080 8.080 7.427 0.653 17856 1768 1 6 . 1 1 22 22 GLU N N 22 123.685 123.685 120.695 2.990 17856 1769 1 6 . 1 1 22 22 GLU C C 22 176.109 176.109 178.830 -2.721 17856 1770 1 6 . 1 1 22 22 GLU H H 22 8.309 8.309 7.671 0.638 17856 1771 1 6 . 1 1 23 23 ALA N N 23 124.280 124.280 122.770 1.510 17856 1772 1 6 . 1 1 23 23 ALA C C 23 178.474 178.474 179.770 -1.296 17856 1773 1 6 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.056 -1.650 17856 1774 1 6 . 1 1 23 23 ALA H H 23 8.088 8.088 7.940 0.148 17856 1775 1 6 . 1 1 24 24 ILE N N 24 120.330 120.330 118.497 1.833 17856 1776 1 6 . 1 1 24 24 ILE C C 24 176.309 176.309 177.760 -1.451 17856 1777 1 6 . 1 1 24 24 ILE CA C 24 61.540 61.540 64.987 -3.447 17856 1778 1 6 . 1 1 24 24 ILE H H 24 7.980 7.980 8.070 -0.090 17856 1779 1 6 . 1 1 25 25 LYS N N 25 124.310 124.310 120.343 3.967 17856 1780 1 6 . 1 1 25 25 LYS C C 25 176.365 176.365 178.878 -2.513 17856 1781 1 6 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.202 -2.868 17856 1782 1 6 . 1 1 25 25 LYS H H 25 8.198 8.198 7.888 0.310 17856 1783 1 6 . 1 1 26 26 LYS N N 26 122.518 122.518 119.051 3.467 17856 1784 1 6 . 1 1 26 26 LYS C C 26 176.365 176.365 178.634 -2.269 17856 1785 1 6 . 1 1 26 26 LYS CA C 26 56.175 56.175 58.544 -2.369 17856 1786 1 6 . 1 1 26 26 LYS H H 26 8.125 8.125 7.479 0.646 17856 1787 1 6 . 1 1 27 27 ILE N N 27 122.670 122.670 120.751 1.919 17856 1788 1 6 . 1 1 27 27 ILE C C 27 176.261 176.261 178.420 -2.159 17856 1789 1 6 . 1 1 27 27 ILE CA C 27 61.294 61.294 64.548 -3.254 17856 1790 1 6 . 1 1 27 27 ILE H H 27 8.114 8.114 7.628 0.486 17856 1791 1 6 . 1 1 28 28 ILE N N 28 125.178 125.178 119.956 5.222 17856 1792 1 6 . 1 1 28 28 ILE C C 28 175.803 175.803 177.420 -1.617 17856 1793 1 6 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.921 -2.841 17856 1794 1 6 . 1 1 28 28 ILE H H 28 8.220 8.220 8.117 0.103 17856 1795 1 6 . 1 1 29 29 ALA N N 29 127.850 127.850 122.008 5.842 17856 1796 1 6 . 1 1 29 29 ALA C C 29 177.627 177.627 179.752 -2.125 17856 1797 1 6 . 1 1 29 29 ALA CA C 29 53.684 53.684 55.159 -1.475 17856 1798 1 6 . 1 1 29 29 ALA H H 29 8.300 8.300 7.510 0.790 17856 1799 1 6 . 1 1 30 30 GLU N N 30 120.000 120.000 119.169 0.831 17856 1800 1 6 . 1 1 30 30 GLU C C 30 176.321 176.321 178.907 -2.586 17856 1801 1 6 . 1 1 30 30 GLU H H 30 8.258 8.258 8.148 0.110 17856 1802 1 6 . 1 1 31 31 PHE N N 31 119.128 119.128 118.481 0.647 17856 1803 1 6 . 1 1 31 31 PHE C C 31 175.180 175.180 178.214 -3.034 17856 1804 1 6 . 1 1 31 31 PHE CA C 31 57.540 57.540 61.576 -4.036 17856 1805 1 6 . 1 1 31 31 PHE H H 31 8.061 8.061 7.776 0.285 17856 1806 1 6 . 1 1 32 32 ASP N N 32 121.800 121.800 118.817 2.983 17856 1807 1 6 . 1 1 32 32 ASP C C 32 175.894 175.894 178.288 -2.394 17856 1808 1 6 . 1 1 32 32 ASP CA C 32 54.529 54.529 56.793 -2.264 17856 1809 1 6 . 1 1 32 32 ASP H H 32 8.275 8.275 7.729 0.546 17856 1810 1 6 . 1 1 33 33 VAL N N 33 119.648 119.648 120.764 -1.116 17856 1811 1 6 . 1 1 33 33 VAL C C 33 176.268 176.268 178.349 -2.081 17856 1812 1 6 . 1 1 33 33 VAL CA C 33 62.500 62.500 66.286 -3.786 17856 1813 1 6 . 1 1 33 33 VAL H H 33 8.059 8.059 7.549 0.510 17856 1814 1 6 . 1 1 34 34 VAL N N 34 123.882 123.882 118.416 5.466 17856 1815 1 6 . 1 1 34 34 VAL H H 34 7.774 7.774 8.503 -0.729 17856 1816 1 6 . 1 1 35 35 LYS N N 35 125.250 125.250 118.870 6.380 17856 1817 1 6 . 1 1 35 35 LYS C C 35 176.719 176.719 177.844 -1.125 17856 1818 1 6 . 1 1 35 35 LYS CA C 35 56.502 56.502 59.338 -2.836 17856 1819 1 6 . 1 1 35 35 LYS H H 35 8.357 8.357 7.527 0.830 17856 1820 1 6 . 1 1 36 36 GLU N N 36 121.850 121.850 117.154 4.696 17856 1821 1 6 . 1 1 36 36 GLU C C 36 176.426 176.426 177.667 -1.241 17856 1822 1 6 . 1 1 36 36 GLU H H 36 8.423 8.423 7.789 0.634 17856 1823 1 6 . 1 1 37 37 SER N N 37 117.100 117.100 113.443 3.657 17856 1824 1 6 . 1 1 37 37 SER C C 37 174.854 174.854 175.622 -0.768 17856 1825 1 6 . 1 1 37 37 SER CA C 37 58.850 58.850 60.188 -1.338 17856 1826 1 6 . 1 1 37 37 SER H H 37 8.362 8.362 7.780 0.582 17856 1827 1 6 . 1 1 38 38 VAL N N 38 121.625 121.625 124.053 -2.428 17856 1828 1 6 . 1 1 38 38 VAL C C 38 176.246 176.246 175.192 1.054 17856 1829 1 6 . 1 1 38 38 VAL CA C 38 63.043 63.043 64.299 -1.256 17856 1830 1 6 . 1 1 38 38 VAL H H 38 8.225 8.225 7.631 0.594 17856 1831 1 6 . 1 1 39 39 ASN N N 39 121.150 121.150 124.081 -2.931 17856 1832 1 6 . 1 1 39 39 ASN C C 39 175.459 175.459 175.445 0.014 17856 1833 1 6 . 1 1 39 39 ASN CA C 39 53.568 53.568 53.563 0.005 17856 1834 1 6 . 1 1 39 39 ASN H H 39 8.366 8.366 8.195 0.171 17856 1835 1 6 . 1 1 40 40 GLU N N 40 121.500 121.500 123.620 -2.120 17856 1836 1 6 . 1 1 40 40 GLU C C 40 175.459 175.459 175.145 0.314 17856 1837 1 6 . 1 1 40 40 GLU CA C 40 56.860 56.860 55.907 0.953 17856 1838 1 6 . 1 1 40 40 GLU H H 40 8.370 8.370 8.463 -0.093 17856 1839 1 6 . 1 1 41 41 LEU N N 41 121.950 121.950 123.485 -1.535 17856 1840 1 6 . 1 1 41 41 LEU C C 41 177.939 177.939 177.947 -0.008 17856 1841 1 6 . 1 1 41 41 LEU CA C 41 56.040 56.040 56.836 -0.795 17856 1842 1 6 . 1 1 41 41 LEU H H 41 8.152 8.152 7.677 0.475 17856 1843 1 6 . 1 1 42 42 SER N N 42 113.326 113.326 117.542 -4.216 17856 1844 1 6 . 1 1 42 42 SER C C 42 174.660 174.660 176.197 -1.537 17856 1845 1 6 . 1 1 42 42 SER CA C 42 58.940 58.940 61.471 -2.530 17856 1846 1 6 . 1 1 42 42 SER H H 42 8.373 8.373 8.597 -0.224 17856 1847 1 6 . 1 1 43 43 GLU N N 43 121.521 121.521 120.597 0.924 17856 1848 1 6 . 1 1 43 43 GLU C C 43 177.349 177.349 178.152 -0.803 17856 1849 1 6 . 1 1 43 43 GLU H H 43 7.329 7.329 8.686 -1.357 17856 1850 1 6 . 1 1 44 44 LYS N N 44 121.240 121.240 119.845 1.395 17856 1851 1 6 . 1 1 44 44 LYS C C 44 177.246 177.246 178.361 -1.115 17856 1852 1 6 . 1 1 44 44 LYS CA C 44 56.397 56.397 58.891 -2.494 17856 1853 1 6 . 1 1 44 44 LYS H H 44 8.103 8.103 7.864 0.239 17856 1854 1 6 . 1 1 45 45 ALA N N 45 119.568 119.568 122.464 -2.896 17856 1855 1 6 . 1 1 45 45 ALA C C 45 177.853 177.853 179.289 -1.436 17856 1856 1 6 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.775 -2.215 17856 1857 1 6 . 1 1 45 45 ALA H H 45 8.541 8.541 7.448 1.093 17856 1858 1 6 . 1 1 46 46 LYS N N 46 115.235 115.235 117.748 -2.513 17856 1859 1 6 . 1 1 46 46 LYS C C 46 177.110 177.110 178.652 -1.542 17856 1860 1 6 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.777 -1.981 17856 1861 1 6 . 1 1 46 46 LYS H H 46 7.257 7.257 7.831 -0.574 17856 1862 1 6 . 1 1 47 47 THR N N 47 103.239 103.239 110.636 -7.397 17856 1863 1 6 . 1 1 47 47 THR C C 47 173.973 173.973 175.122 -1.149 17856 1864 1 6 . 1 1 47 47 THR CA C 47 62.740 62.740 63.715 -0.974 17856 1865 1 6 . 1 1 47 47 THR H H 47 7.381 7.381 7.600 -0.219 17856 1866 1 6 . 1 1 48 48 ASP N N 48 122.976 122.976 122.758 0.218 17856 1867 1 6 . 1 1 48 48 ASP H H 48 8.031 8.031 8.035 -0.004 17856 1868 1 6 . 1 1 49 49 PRO C C 49 178.106 178.106 178.709 -0.603 17856 1869 1 6 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.880 -0.661 17856 1870 1 6 . 1 1 50 50 GLN N N 50 118.351 118.351 118.469 -0.118 17856 1871 1 6 . 1 1 50 50 GLN C C 50 176.944 176.944 178.238 -1.294 17856 1872 1 6 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.643 -1.843 17856 1873 1 6 . 1 1 50 50 GLN H H 50 8.304 8.304 8.116 0.188 17856 1874 1 6 . 1 1 51 51 ALA N N 51 124.206 124.206 122.264 1.942 17856 1875 1 6 . 1 1 51 51 ALA C C 51 178.490 178.490 179.266 -0.776 17856 1876 1 6 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.825 -1.401 17856 1877 1 6 . 1 1 51 51 ALA H H 51 7.547 7.547 7.703 -0.156 17856 1878 1 6 . 1 1 52 52 ALA N N 52 118.686 118.686 120.741 -2.055 17856 1879 1 6 . 1 1 52 52 ALA C C 52 177.953 177.953 179.594 -1.641 17856 1880 1 6 . 1 1 52 52 ALA H H 52 7.931 7.931 7.696 0.235 17856 1881 1 6 . 1 1 53 53 GLU N N 53 120.075 120.075 118.569 1.506 17856 1882 1 6 . 1 1 53 53 GLU H H 53 7.729 7.729 7.926 -0.197 17856 1883 1 6 . 1 1 55 55 LEU N N 55 123.640 123.640 117.076 6.564 17856 1884 1 6 . 1 1 55 55 LEU C C 55 177.587 177.587 178.524 -0.937 17856 1885 1 6 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.332 -1.545 17856 1886 1 6 . 1 1 55 55 LEU H H 55 8.215 8.215 7.709 0.506 17856 1887 1 6 . 1 1 56 56 ASN N N 56 118.520 118.520 117.634 0.886 17856 1888 1 6 . 1 1 56 56 ASN C C 56 175.700 175.700 176.667 -0.967 17856 1889 1 6 . 1 1 56 56 ASN CA C 56 54.132 54.132 54.991 -0.859 17856 1890 1 6 . 1 1 56 56 ASN H H 56 8.250 8.250 7.985 0.265 17856 1891 1 6 . 1 1 57 57 LYS N N 57 120.960 120.960 117.228 3.732 17856 1892 1 6 . 1 1 57 57 LYS C C 57 176.637 176.637 176.361 0.276 17856 1893 1 6 . 1 1 57 57 LYS H H 57 8.065 8.065 7.515 0.550 17856 1894 1 6 . 1 1 58 58 LEU N N 58 122.610 122.610 122.026 0.584 17856 1895 1 6 . 1 1 58 58 LEU C C 58 177.433 177.433 176.218 1.215 17856 1896 1 6 . 1 1 58 58 LEU CA C 58 55.120 55.120 55.436 -0.316 17856 1897 1 6 . 1 1 58 58 LEU H H 58 8.135 8.135 7.088 1.047 17856 1898 1 6 . 1 1 59 59 ILE N N 59 122.045 122.045 123.969 -1.924 17856 1899 1 6 . 1 1 59 59 ILE CA C 59 61.535 61.535 61.609 -0.074 17856 1900 1 6 . 1 1 59 59 ILE H H 59 8.220 8.220 8.099 0.121 17856 1901 1 6 . 1 1 60 60 GLU N N 60 124.000 124.000 119.280 4.720 17856 1902 1 6 . 1 1 60 60 GLU C C 60 177.007 177.007 177.384 -0.377 17856 1903 1 6 . 1 1 60 60 GLU CA C 60 56.722 56.722 57.048 -0.327 17856 1904 1 6 . 1 1 60 60 GLU H H 60 8.340 8.340 8.464 -0.124 17856 1905 1 6 . 1 1 61 61 GLY N N 61 110.520 110.520 109.156 1.364 17856 1906 1 6 . 1 1 61 61 GLY C C 61 174.002 174.002 174.079 -0.077 17856 1907 1 6 . 1 1 61 61 GLY CA C 61 45.405 45.405 45.285 0.120 17856 1908 1 6 . 1 1 61 61 GLY H H 61 8.557 8.557 8.351 0.206 17856 1909 1 6 . 1 1 62 62 TYR N N 62 119.600 119.600 120.849 -1.249 17856 1910 1 6 . 1 1 62 62 TYR C C 62 175.940 175.940 176.225 -0.285 17856 1911 1 6 . 1 1 62 62 TYR CA C 62 58.108 58.108 57.999 0.109 17856 1912 1 6 . 1 1 62 62 TYR H H 62 7.980 7.980 7.861 0.119 17856 1913 1 6 . 1 1 63 63 THR N N 63 116.304 116.304 115.591 0.713 17856 1914 1 6 . 1 1 63 63 THR C C 63 173.796 173.796 173.381 0.415 17856 1915 1 6 . 1 1 63 63 THR H H 63 8.049 8.049 8.249 -0.200 17856 1916 1 6 . 1 1 64 64 TYR N N 64 122.050 122.050 125.060 -3.010 17856 1917 1 6 . 1 1 64 64 TYR C C 64 176.290 176.290 176.026 0.264 17856 1918 1 6 . 1 1 64 64 TYR CA C 64 58.533 58.533 57.997 0.536 17856 1919 1 6 . 1 1 64 64 TYR H H 64 8.133 8.133 8.787 -0.654 17856 1920 1 6 . 1 1 65 65 GLY N N 65 110.456 110.456 108.212 2.244 17856 1921 1 6 . 1 1 65 65 GLY C C 65 174.340 174.340 175.369 -1.029 17856 1922 1 6 . 1 1 65 65 GLY CA C 65 45.328 45.328 45.590 -0.262 17856 1923 1 6 . 1 1 65 65 GLY H H 65 7.747 7.747 8.391 -0.644 17856 1924 1 6 . 1 1 66 66 GLU N N 66 120.783 120.783 121.086 -0.303 17856 1925 1 6 . 1 1 66 66 GLU C C 66 176.895 176.895 179.068 -2.173 17856 1926 1 6 . 1 1 66 66 GLU CA C 66 56.804 56.804 59.797 -2.993 17856 1927 1 6 . 1 1 66 66 GLU H H 66 8.243 8.243 8.501 -0.258 17856 1928 1 6 . 1 1 67 67 GLU N N 67 121.587 121.587 117.779 3.808 17856 1929 1 6 . 1 1 67 67 GLU C C 67 176.340 176.340 178.144 -1.804 17856 1930 1 6 . 1 1 67 67 GLU H H 67 8.611 8.611 8.632 -0.021 17856 1931 1 6 . 1 1 68 68 ARG N N 68 121.790 121.790 118.402 3.388 17856 1932 1 6 . 1 1 68 68 ARG C C 68 176.350 176.350 178.401 -2.051 17856 1933 1 6 . 1 1 68 68 ARG H H 68 8.267 8.267 8.086 0.181 17856 1934 1 6 . 1 1 69 69 LYS N N 69 118.431 118.431 118.565 -0.134 17856 1935 1 6 . 1 1 69 69 LYS H H 69 7.567 7.567 7.606 -0.039 17856 1936 1 6 . 1 1 70 70 LEU C C 70 177.338 177.338 178.334 -0.996 17856 1937 1 6 . 1 1 70 70 LEU CA C 70 55.533 55.533 55.740 -0.207 17856 1938 1 6 . 1 1 71 71 TYR N N 71 119.504 119.504 117.641 1.863 17856 1939 1 6 . 1 1 71 71 TYR H H 71 7.997 7.997 7.321 0.676 17856 1940 1 6 . 1 1 72 72 ASP C C 72 176.528 176.528 178.287 -1.759 17856 1941 1 6 . 1 1 72 72 ASP CA C 72 54.693 54.693 57.166 -2.473 17856 1942 1 6 . 1 1 73 73 SER N N 73 117.000 117.000 115.362 1.638 17856 1943 1 6 . 1 1 73 73 SER C C 73 174.950 174.950 176.291 -1.341 17856 1944 1 6 . 1 1 73 73 SER CA C 73 58.997 58.997 61.302 -2.305 17856 1945 1 6 . 1 1 73 73 SER H H 73 8.282 8.282 7.596 0.686 17856 1946 1 6 . 1 1 74 74 ALA N N 74 125.422 125.422 124.984 0.438 17856 1947 1 6 . 1 1 74 74 ALA C C 74 178.389 178.389 179.489 -1.100 17856 1948 1 6 . 1 1 74 74 ALA CA C 74 53.433 53.433 54.731 -1.298 17856 1949 1 6 . 1 1 74 74 ALA H H 74 8.339 8.339 7.561 0.778 17856 1950 1 6 . 1 1 75 75 LEU N N 75 120.019 120.019 119.115 0.904 17856 1951 1 6 . 1 1 75 75 LEU C C 75 177.954 177.954 178.731 -0.777 17856 1952 1 6 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.273 -1.492 17856 1953 1 6 . 1 1 75 75 LEU H H 75 7.948 7.948 7.673 0.275 17856 1954 1 6 . 1 1 76 76 SER N N 76 113.321 113.321 114.803 -1.482 17856 1955 1 6 . 1 1 76 76 SER C C 76 174.784 174.784 176.528 -1.744 17856 1956 1 6 . 1 1 76 76 SER CA C 76 59.173 59.173 61.518 -2.345 17856 1957 1 6 . 1 1 76 76 SER H H 76 7.951 7.951 7.768 0.183 17856 1958 1 6 . 1 1 77 77 LYS N N 77 122.710 122.710 120.788 1.922 17856 1959 1 6 . 1 1 77 77 LYS C C 77 176.734 176.734 178.602 -1.868 17856 1960 1 6 . 1 1 77 77 LYS CA C 77 58.390 58.390 58.944 -0.554 17856 1961 1 6 . 1 1 77 77 LYS H H 77 8.170 8.170 7.376 0.794 17856 1962 1 6 . 1 1 78 78 ILE N N 78 121.521 121.521 119.489 2.032 17856 1963 1 6 . 1 1 78 78 ILE C C 78 176.512 176.512 177.948 -1.436 17856 1964 1 6 . 1 1 78 78 ILE H H 78 8.160 8.160 7.542 0.618 17856 1965 1 6 . 1 1 79 79 GLU N N 79 123.840 123.840 119.846 3.994 17856 1966 1 6 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.600 -4.122 17856 1967 1 6 . 1 1 79 79 GLU H H 79 8.360 8.360 7.712 0.648 17856 1968 1 6 . 1 1 80 80 LYS N N 80 122.143 122.143 119.084 3.059 17856 1969 1 6 . 1 1 80 80 LYS C C 80 176.937 176.937 178.697 -1.760 17856 1970 1 6 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.099 -2.599 17856 1971 1 6 . 1 1 80 80 LYS H H 80 8.231 8.231 7.457 0.774 17856 1972 1 6 . 1 1 81 81 LEU N N 81 122.095 122.095 121.612 0.483 17856 1973 1 6 . 1 1 81 81 LEU C C 81 177.531 177.531 178.705 -1.174 17856 1974 1 6 . 1 1 81 81 LEU H H 81 8.050 8.050 7.378 0.672 17856 1975 1 6 . 1 1 82 82 ILE N N 82 120.609 120.609 118.130 2.479 17856 1976 1 6 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.153 -3.793 17856 1977 1 6 . 1 1 82 82 ILE H H 82 8.000 8.000 7.461 0.539 17856 1978 1 6 . 1 1 83 83 GLU N N 83 124.611 124.611 120.025 4.586 17856 1979 1 6 . 1 1 83 83 GLU C C 83 177.298 177.298 179.273 -1.975 17856 1980 1 6 . 1 1 83 83 GLU H H 83 8.380 8.380 7.705 0.674 17856 1981 1 6 . 1 1 84 84 THR N N 84 115.107 115.107 115.868 -0.761 17856 1982 1 6 . 1 1 84 84 THR C C 84 174.400 174.400 175.527 -1.127 17856 1983 1 6 . 1 1 84 84 THR CA C 84 62.659 62.659 65.557 -2.898 17856 1984 1 6 . 1 1 84 84 THR H H 84 8.064 8.064 7.947 0.117 17856 1985 1 6 . 1 1 85 85 LEU N N 85 124.150 124.150 119.985 4.165 17856 1986 1 6 . 1 1 85 85 LEU C C 85 177.120 177.120 176.884 0.236 17856 1987 1 6 . 1 1 85 85 LEU CA C 85 55.020 55.020 55.095 -0.075 17856 1988 1 6 . 1 1 85 85 LEU H H 85 8.238 8.238 7.384 0.854 17856 1989 1 6 . 1 1 86 86 SER N N 86 114.913 114.913 114.880 0.033 17856 1990 1 6 . 1 1 86 86 SER H H 86 7.678 7.678 7.508 0.170 17856 1991 1 6 . 1 1 87 87 PRO CA C 87 63.550 63.550 63.798 -0.248 17856 1992 1 6 . 1 1 88 88 ALA N N 88 123.767 123.767 120.397 3.370 17856 1993 1 6 . 1 1 88 88 ALA C C 88 178.131 178.131 176.498 1.633 17856 1994 1 6 . 1 1 88 88 ALA CA C 88 52.878 52.878 52.380 0.498 17856 1995 1 6 . 1 1 88 88 ALA H H 88 8.342 8.342 8.049 0.293 17856 1996 1 6 . 1 1 89 89 ARG N N 89 119.159 119.159 119.838 -0.679 17856 1997 1 6 . 1 1 89 89 ARG C C 89 176.620 176.620 176.188 0.432 17856 1998 1 6 . 1 1 89 89 ARG H H 89 8.133 8.133 8.390 -0.257 17856 1999 1 6 . 1 1 90 90 SER N N 90 116.910 116.910 118.725 -1.815 17856 2000 1 6 . 1 1 90 90 SER C C 90 174.887 174.887 174.572 0.315 17856 2001 1 6 . 1 1 90 90 SER H H 90 8.322 8.322 8.486 -0.164 17856 2002 1 6 . 1 1 91 91 LYS N N 91 123.457 123.457 126.578 -3.121 17856 2003 1 6 . 1 1 91 91 LYS C C 91 176.970 176.970 175.719 1.251 17856 2004 1 6 . 1 1 91 91 LYS H H 91 8.396 8.396 8.425 -0.029 17856 2005 1 6 . 1 1 92 92 SER N N 92 116.692 116.692 118.726 -2.034 17856 2006 1 6 . 1 1 92 92 SER C C 92 174.573 174.573 173.762 0.811 17856 2007 1 6 . 1 1 92 92 SER CA C 92 58.600 58.600 58.044 0.556 17856 2008 1 6 . 1 1 92 92 SER H H 92 8.297 8.297 8.488 -0.191 17856 2009 1 6 . 1 1 93 93 GLN N N 93 121.916 121.916 123.910 -1.994 17856 2010 1 6 . 1 1 93 93 GLN C C 93 175.971 175.971 174.680 1.291 17856 2011 1 6 . 1 1 93 93 GLN H H 93 8.325 8.325 8.159 0.166 17856 2012 1 6 . 1 1 94 94 SER N N 94 117.385 117.385 115.782 1.603 17856 2013 1 6 . 1 1 94 94 SER C C 94 173.940 173.940 173.320 0.620 17856 2014 1 6 . 1 1 94 94 SER CA C 94 58.520 58.520 58.502 0.018 17856 2015 1 6 . 1 1 94 94 SER H H 94 8.352 8.352 8.491 -0.139 17856 2016 1 6 . 1 1 95 95 THR N N 95 120.756 120.756 113.991 6.765 17856 2017 1 6 . 1 1 95 95 THR H H 95 7.805 7.805 7.993 -0.188 17856 2018 1 6 . 1 1 99 99 ARG C C 99 176.250 176.250 177.611 -1.361 17856 2019 1 6 . 1 1 99 99 ARG CA C 99 56.157 56.157 58.853 -2.696 17856 2020 1 6 . 1 1 100 100 ASN N N 100 118.482 118.482 118.268 0.214 17856 2021 1 6 . 1 1 100 100 ASN H H 100 8.272 8.272 8.542 -0.270 17856 2022 1 6 . 1 1 101 101 ARG C C 101 176.280 176.280 175.461 0.819 17856 2023 1 6 . 1 1 102 102 ASN N N 102 118.688 118.688 121.578 -2.890 17856 2024 1 6 . 1 1 102 102 ASN C C 102 174.996 174.996 175.222 -0.226 17856 2025 1 6 . 1 1 102 102 ASN CA C 102 53.609 53.609 52.930 0.679 17856 2026 1 6 . 1 1 102 102 ASN H H 102 8.424 8.424 8.485 -0.061 17856 2027 1 6 . 1 1 103 103 ASN N N 103 118.865 118.865 119.263 -0.398 17856 2028 1 6 . 1 1 103 103 ASN C C 103 175.040 175.040 174.655 0.385 17856 2029 1 6 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.679 0.133 17856 2030 1 6 . 1 1 103 103 ASN H H 103 8.282 8.282 8.588 -0.306 17856 2031 1 6 . 1 1 104 104 ARG N N 104 120.875 120.875 115.864 5.011 17856 2032 1 6 . 1 1 104 104 ARG H H 104 8.140 8.140 8.148 -0.008 17856 2033 1 6 . 1 1 106 106 ILE C C 106 175.408 175.408 175.906 -0.498 17856 2034 1 6 . 1 1 106 106 ILE CA C 106 61.395 61.395 62.822 -1.427 17856 2035 1 7 . 1 1 2 2 SER N N 2 116.304 116.304 120.595 -4.291 17856 2036 1 7 . 1 1 2 2 SER C C 2 174.710 174.710 176.221 -1.511 17856 2037 1 7 . 1 1 2 2 SER CA C 2 58.908 58.908 59.895 -0.987 17856 2038 1 7 . 1 1 2 2 SER H H 2 8.003 8.003 8.785 -0.782 17856 2039 1 7 . 1 1 3 3 ILE N N 3 122.062 122.062 123.608 -1.546 17856 2040 1 7 . 1 1 3 3 ILE C C 3 176.750 176.750 175.846 0.904 17856 2041 1 7 . 1 1 3 3 ILE CA C 3 61.786 61.786 63.257 -1.471 17856 2042 1 7 . 1 1 3 3 ILE H H 3 7.957 7.957 7.764 0.193 17856 2043 1 7 . 1 1 4 4 VAL N N 4 122.674 122.674 117.320 5.354 17856 2044 1 7 . 1 1 4 4 VAL C C 4 176.221 176.221 176.289 -0.068 17856 2045 1 7 . 1 1 4 4 VAL CA C 4 62.970 62.970 62.349 0.621 17856 2046 1 7 . 1 1 4 4 VAL H H 4 7.970 7.970 7.383 0.587 17856 2047 1 7 . 1 1 5 5 SER N N 5 117.750 117.750 116.601 1.149 17856 2048 1 7 . 1 1 5 5 SER C C 5 174.858 174.858 175.044 -0.186 17856 2049 1 7 . 1 1 5 5 SER CA C 5 58.630 58.630 60.821 -2.191 17856 2050 1 7 . 1 1 5 5 SER H H 5 8.093 8.093 7.685 0.408 17856 2051 1 7 . 1 1 6 6 GLN N N 6 121.961 121.961 115.421 6.540 17856 2052 1 7 . 1 1 6 6 GLN C C 6 176.467 176.467 175.967 0.500 17856 2053 1 7 . 1 1 6 6 GLN CA C 6 56.226 56.226 56.190 0.037 17856 2054 1 7 . 1 1 6 6 GLN H H 6 8.371 8.371 8.479 -0.108 17856 2055 1 7 . 1 1 7 7 THR N N 7 115.325 115.325 117.409 -2.084 17856 2056 1 7 . 1 1 7 7 THR C C 7 174.752 174.752 175.892 -1.140 17856 2057 1 7 . 1 1 7 7 THR H H 7 8.152 8.152 8.179 -0.027 17856 2058 1 7 . 1 1 8 8 ARG N N 8 122.530 122.530 119.395 3.135 17856 2059 1 7 . 1 1 8 8 ARG C C 8 176.200 176.200 176.755 -0.555 17856 2060 1 7 . 1 1 8 8 ARG CA C 8 56.570 56.570 55.418 1.152 17856 2061 1 7 . 1 1 8 8 ARG H H 8 8.211 8.211 8.266 -0.055 17856 2062 1 7 . 1 1 9 9 ASN N N 9 119.600 119.600 119.592 0.008 17856 2063 1 7 . 1 1 9 9 ASN C C 9 177.164 177.164 176.530 0.634 17856 2064 1 7 . 1 1 9 9 ASN H H 9 8.398 8.398 7.709 0.689 17856 2065 1 7 . 1 1 10 10 LYS N N 10 121.600 121.600 120.261 1.339 17856 2066 1 7 . 1 1 10 10 LYS C C 10 176.845 176.845 178.564 -1.719 17856 2067 1 7 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.090 -1.980 17856 2068 1 7 . 1 1 10 10 LYS H H 10 8.190 8.190 7.935 0.255 17856 2069 1 7 . 1 1 11 11 GLU N N 11 120.700 120.700 119.549 1.151 17856 2070 1 7 . 1 1 11 11 GLU C C 11 176.825 176.825 178.801 -1.976 17856 2071 1 7 . 1 1 11 11 GLU CA C 11 56.690 56.690 59.196 -2.506 17856 2072 1 7 . 1 1 11 11 GLU H H 11 8.323 8.323 8.023 0.300 17856 2073 1 7 . 1 1 12 12 LEU N N 12 122.390 122.390 121.211 1.179 17856 2074 1 7 . 1 1 12 12 LEU C C 12 177.670 177.670 178.918 -1.248 17856 2075 1 7 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.173 -2.703 17856 2076 1 7 . 1 1 12 12 LEU H H 12 8.155 8.155 8.196 -0.041 17856 2077 1 7 . 1 1 13 13 LEU N N 13 122.570 122.570 117.038 5.532 17856 2078 1 7 . 1 1 13 13 LEU C C 13 177.510 177.510 178.606 -1.096 17856 2079 1 7 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.581 -3.000 17856 2080 1 7 . 1 1 13 13 LEU H H 13 8.220 8.220 8.195 0.025 17856 2081 1 7 . 1 1 14 14 ASP N N 14 120.780 120.780 120.464 0.316 17856 2082 1 7 . 1 1 14 14 ASP C C 14 176.480 176.480 178.781 -2.301 17856 2083 1 7 . 1 1 14 14 ASP CA C 14 54.650 54.650 58.033 -3.384 17856 2084 1 7 . 1 1 14 14 ASP H H 14 8.243 8.243 8.136 0.107 17856 2085 1 7 . 1 1 15 15 LYS N N 15 120.900 120.900 119.628 1.272 17856 2086 1 7 . 1 1 15 15 LYS C C 15 175.580 175.580 178.797 -3.217 17856 2087 1 7 . 1 1 15 15 LYS H H 15 8.052 8.052 8.033 0.019 17856 2088 1 7 . 1 1 16 16 LYS N N 16 121.980 121.980 120.236 1.744 17856 2089 1 7 . 1 1 16 16 LYS C C 16 176.887 176.887 178.992 -2.105 17856 2090 1 7 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.756 -2.422 17856 2091 1 7 . 1 1 16 16 LYS H H 16 8.243 8.243 7.892 0.351 17856 2092 1 7 . 1 1 17 17 ILE N N 17 121.940 121.940 118.790 3.150 17856 2093 1 7 . 1 1 17 17 ILE H H 17 8.110 8.110 8.323 -0.213 17856 2094 1 7 . 1 1 18 18 ARG C C 18 176.520 176.520 178.351 -1.831 17856 2095 1 7 . 1 1 19 19 SER N N 19 117.150 117.150 115.044 2.106 17856 2096 1 7 . 1 1 19 19 SER C C 19 175.167 175.167 176.193 -1.026 17856 2097 1 7 . 1 1 19 19 SER CA C 19 58.840 58.840 61.459 -2.619 17856 2098 1 7 . 1 1 19 19 SER H H 19 8.396 8.396 7.744 0.652 17856 2099 1 7 . 1 1 20 20 GLU N N 20 123.176 123.176 122.208 0.968 17856 2100 1 7 . 1 1 20 20 GLU C C 20 176.921 176.921 178.932 -2.011 17856 2101 1 7 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.324 -2.463 17856 2102 1 7 . 1 1 20 20 GLU H H 20 8.478 8.478 7.804 0.674 17856 2103 1 7 . 1 1 21 21 ILE N N 21 120.550 120.550 115.428 5.122 17856 2104 1 7 . 1 1 21 21 ILE C C 21 176.550 176.550 177.987 -1.437 17856 2105 1 7 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.585 -2.955 17856 2106 1 7 . 1 1 21 21 ILE H H 21 8.080 8.080 7.467 0.613 17856 2107 1 7 . 1 1 22 22 GLU N N 22 123.685 123.685 120.948 2.737 17856 2108 1 7 . 1 1 22 22 GLU C C 22 176.109 176.109 178.834 -2.725 17856 2109 1 7 . 1 1 22 22 GLU H H 22 8.309 8.309 7.693 0.616 17856 2110 1 7 . 1 1 23 23 ALA N N 23 124.280 124.280 122.391 1.889 17856 2111 1 7 . 1 1 23 23 ALA C C 23 178.474 178.474 179.749 -1.275 17856 2112 1 7 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.036 -1.630 17856 2113 1 7 . 1 1 23 23 ALA H H 23 8.088 8.088 8.229 -0.141 17856 2114 1 7 . 1 1 24 24 ILE N N 24 120.330 120.330 118.582 1.748 17856 2115 1 7 . 1 1 24 24 ILE C C 24 176.309 176.309 177.755 -1.446 17856 2116 1 7 . 1 1 24 24 ILE CA C 24 61.540 61.540 65.072 -3.531 17856 2117 1 7 . 1 1 24 24 ILE H H 24 7.980 7.980 7.963 0.017 17856 2118 1 7 . 1 1 25 25 LYS N N 25 124.310 124.310 119.955 4.355 17856 2119 1 7 . 1 1 25 25 LYS C C 25 176.365 176.365 178.892 -2.527 17856 2120 1 7 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.037 -2.703 17856 2121 1 7 . 1 1 25 25 LYS H H 25 8.198 8.198 8.011 0.187 17856 2122 1 7 . 1 1 26 26 LYS N N 26 122.518 122.518 119.242 3.276 17856 2123 1 7 . 1 1 26 26 LYS C C 26 176.365 176.365 178.458 -2.093 17856 2124 1 7 . 1 1 26 26 LYS CA C 26 56.175 56.175 58.381 -2.206 17856 2125 1 7 . 1 1 26 26 LYS H H 26 8.125 8.125 7.324 0.801 17856 2126 1 7 . 1 1 27 27 ILE N N 27 122.670 122.670 120.278 2.392 17856 2127 1 7 . 1 1 27 27 ILE C C 27 176.261 176.261 178.104 -1.843 17856 2128 1 7 . 1 1 27 27 ILE CA C 27 61.294 61.294 64.231 -2.937 17856 2129 1 7 . 1 1 27 27 ILE H H 27 8.114 8.114 7.599 0.515 17856 2130 1 7 . 1 1 28 28 ILE N N 28 125.178 125.178 119.108 6.070 17856 2131 1 7 . 1 1 28 28 ILE C C 28 175.803 175.803 176.751 -0.948 17856 2132 1 7 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.381 -2.301 17856 2133 1 7 . 1 1 28 28 ILE H H 28 8.220 8.220 8.015 0.204 17856 2134 1 7 . 1 1 29 29 ALA N N 29 127.850 127.850 121.545 6.305 17856 2135 1 7 . 1 1 29 29 ALA C C 29 177.627 177.627 179.505 -1.878 17856 2136 1 7 . 1 1 29 29 ALA CA C 29 53.684 53.684 54.748 -1.064 17856 2137 1 7 . 1 1 29 29 ALA H H 29 8.300 8.300 7.090 1.210 17856 2138 1 7 . 1 1 30 30 GLU N N 30 120.000 120.000 119.505 0.495 17856 2139 1 7 . 1 1 30 30 GLU C C 30 176.321 176.321 178.823 -2.502 17856 2140 1 7 . 1 1 30 30 GLU H H 30 8.258 8.258 7.740 0.518 17856 2141 1 7 . 1 1 31 31 PHE N N 31 119.128 119.128 117.548 1.580 17856 2142 1 7 . 1 1 31 31 PHE C C 31 175.180 175.180 178.182 -3.002 17856 2143 1 7 . 1 1 31 31 PHE CA C 31 57.540 57.540 60.166 -2.626 17856 2144 1 7 . 1 1 31 31 PHE H H 31 8.061 8.061 7.409 0.652 17856 2145 1 7 . 1 1 32 32 ASP N N 32 121.800 121.800 119.765 2.035 17856 2146 1 7 . 1 1 32 32 ASP C C 32 175.894 175.894 178.663 -2.769 17856 2147 1 7 . 1 1 32 32 ASP CA C 32 54.529 54.529 57.186 -2.657 17856 2148 1 7 . 1 1 32 32 ASP H H 32 8.275 8.275 7.700 0.575 17856 2149 1 7 . 1 1 33 33 VAL N N 33 119.648 119.648 119.547 0.101 17856 2150 1 7 . 1 1 33 33 VAL C C 33 176.268 176.268 178.475 -2.207 17856 2151 1 7 . 1 1 33 33 VAL CA C 33 62.500 62.500 66.008 -3.508 17856 2152 1 7 . 1 1 33 33 VAL H H 33 8.059 8.059 7.627 0.432 17856 2153 1 7 . 1 1 34 34 VAL N N 34 123.882 123.882 119.862 4.020 17856 2154 1 7 . 1 1 34 34 VAL H H 34 7.774 7.774 8.573 -0.799 17856 2155 1 7 . 1 1 35 35 LYS N N 35 125.250 125.250 120.114 5.136 17856 2156 1 7 . 1 1 35 35 LYS C C 35 176.719 176.719 177.359 -0.640 17856 2157 1 7 . 1 1 35 35 LYS CA C 35 56.502 56.502 58.751 -2.249 17856 2158 1 7 . 1 1 35 35 LYS H H 35 8.357 8.357 7.556 0.801 17856 2159 1 7 . 1 1 36 36 GLU N N 36 121.850 121.850 117.707 4.143 17856 2160 1 7 . 1 1 36 36 GLU C C 36 176.426 176.426 174.959 1.467 17856 2161 1 7 . 1 1 36 36 GLU H H 36 8.423 8.423 7.885 0.538 17856 2162 1 7 . 1 1 37 37 SER N N 37 117.100 117.100 115.396 1.704 17856 2163 1 7 . 1 1 37 37 SER C C 37 174.854 174.854 173.961 0.893 17856 2164 1 7 . 1 1 37 37 SER CA C 37 58.850 58.850 59.262 -0.412 17856 2165 1 7 . 1 1 37 37 SER H H 37 8.362 8.362 7.952 0.410 17856 2166 1 7 . 1 1 38 38 VAL N N 38 121.625 121.625 125.795 -4.170 17856 2167 1 7 . 1 1 38 38 VAL C C 38 176.246 176.246 175.054 1.192 17856 2168 1 7 . 1 1 38 38 VAL CA C 38 63.043 63.043 63.404 -0.361 17856 2169 1 7 . 1 1 38 38 VAL H H 38 8.225 8.225 7.676 0.549 17856 2170 1 7 . 1 1 39 39 ASN N N 39 121.150 121.150 125.015 -3.865 17856 2171 1 7 . 1 1 39 39 ASN C C 39 175.459 175.459 176.482 -1.023 17856 2172 1 7 . 1 1 39 39 ASN CA C 39 53.568 53.568 53.738 -0.170 17856 2173 1 7 . 1 1 39 39 ASN H H 39 8.366 8.366 8.205 0.161 17856 2174 1 7 . 1 1 40 40 GLU N N 40 121.500 121.500 122.657 -1.157 17856 2175 1 7 . 1 1 40 40 GLU C C 40 175.459 175.459 178.593 -3.134 17856 2176 1 7 . 1 1 40 40 GLU CA C 40 56.860 56.860 59.910 -3.050 17856 2177 1 7 . 1 1 40 40 GLU H H 40 8.370 8.370 8.537 -0.167 17856 2178 1 7 . 1 1 41 41 LEU N N 41 121.950 121.950 119.741 2.209 17856 2179 1 7 . 1 1 41 41 LEU C C 41 177.939 177.939 178.849 -0.910 17856 2180 1 7 . 1 1 41 41 LEU CA C 41 56.040 56.040 57.710 -1.670 17856 2181 1 7 . 1 1 41 41 LEU H H 41 8.152 8.152 8.233 -0.081 17856 2182 1 7 . 1 1 42 42 SER N N 42 113.326 113.326 115.357 -2.031 17856 2183 1 7 . 1 1 42 42 SER C C 42 174.660 174.660 176.923 -2.263 17856 2184 1 7 . 1 1 42 42 SER CA C 42 58.940 58.940 61.292 -2.352 17856 2185 1 7 . 1 1 42 42 SER H H 42 8.373 8.373 7.947 0.426 17856 2186 1 7 . 1 1 43 43 GLU N N 43 121.521 121.521 121.187 0.334 17856 2187 1 7 . 1 1 43 43 GLU C C 43 177.349 177.349 178.348 -0.999 17856 2188 1 7 . 1 1 43 43 GLU H H 43 7.329 7.329 8.276 -0.947 17856 2189 1 7 . 1 1 44 44 LYS N N 44 121.240 121.240 120.329 0.911 17856 2190 1 7 . 1 1 44 44 LYS C C 44 177.246 177.246 178.328 -1.082 17856 2191 1 7 . 1 1 44 44 LYS CA C 44 56.397 56.397 59.193 -2.796 17856 2192 1 7 . 1 1 44 44 LYS H H 44 8.103 8.103 7.772 0.331 17856 2193 1 7 . 1 1 45 45 ALA N N 45 119.568 119.568 120.420 -0.852 17856 2194 1 7 . 1 1 45 45 ALA C C 45 177.853 177.853 178.834 -0.981 17856 2195 1 7 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.653 -2.093 17856 2196 1 7 . 1 1 45 45 ALA H H 45 8.541 8.541 7.651 0.890 17856 2197 1 7 . 1 1 46 46 LYS N N 46 115.235 115.235 116.723 -1.488 17856 2198 1 7 . 1 1 46 46 LYS C C 46 177.110 177.110 178.044 -0.934 17856 2199 1 7 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.371 -1.575 17856 2200 1 7 . 1 1 46 46 LYS H H 46 7.257 7.257 7.511 -0.254 17856 2201 1 7 . 1 1 47 47 THR N N 47 103.239 103.239 109.281 -6.042 17856 2202 1 7 . 1 1 47 47 THR C C 47 173.973 173.973 174.428 -0.455 17856 2203 1 7 . 1 1 47 47 THR CA C 47 62.740 62.740 62.251 0.489 17856 2204 1 7 . 1 1 47 47 THR H H 47 7.381 7.381 7.437 -0.056 17856 2205 1 7 . 1 1 48 48 ASP N N 48 122.976 122.976 122.286 0.690 17856 2206 1 7 . 1 1 48 48 ASP H H 48 8.031 8.031 7.738 0.293 17856 2207 1 7 . 1 1 49 49 PRO C C 49 178.106 178.106 178.489 -0.383 17856 2208 1 7 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.911 -0.692 17856 2209 1 7 . 1 1 50 50 GLN N N 50 118.351 118.351 118.956 -0.605 17856 2210 1 7 . 1 1 50 50 GLN C C 50 176.944 176.944 178.388 -1.444 17856 2211 1 7 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.580 -1.780 17856 2212 1 7 . 1 1 50 50 GLN H H 50 8.304 8.304 8.037 0.267 17856 2213 1 7 . 1 1 51 51 ALA N N 51 124.206 124.206 122.018 2.188 17856 2214 1 7 . 1 1 51 51 ALA C C 51 178.490 178.490 179.244 -0.754 17856 2215 1 7 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.749 -1.325 17856 2216 1 7 . 1 1 51 51 ALA H H 51 7.547 7.547 8.932 -1.385 17856 2217 1 7 . 1 1 52 52 ALA N N 52 118.686 118.686 121.181 -2.495 17856 2218 1 7 . 1 1 52 52 ALA C C 52 177.953 177.953 179.826 -1.873 17856 2219 1 7 . 1 1 52 52 ALA H H 52 7.931 7.931 7.637 0.294 17856 2220 1 7 . 1 1 53 53 GLU N N 53 120.075 120.075 118.149 1.926 17856 2221 1 7 . 1 1 53 53 GLU H H 53 7.729 7.729 7.811 -0.082 17856 2222 1 7 . 1 1 55 55 LEU N N 55 123.640 123.640 119.880 3.760 17856 2223 1 7 . 1 1 55 55 LEU C C 55 177.587 177.587 178.957 -1.370 17856 2224 1 7 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.379 -1.592 17856 2225 1 7 . 1 1 55 55 LEU H H 55 8.215 8.215 8.399 -0.184 17856 2226 1 7 . 1 1 56 56 ASN N N 56 118.520 118.520 118.592 -0.072 17856 2227 1 7 . 1 1 56 56 ASN C C 56 175.700 175.700 177.851 -2.151 17856 2228 1 7 . 1 1 56 56 ASN CA C 56 54.132 54.132 56.175 -2.043 17856 2229 1 7 . 1 1 56 56 ASN H H 56 8.250 8.250 8.201 0.049 17856 2230 1 7 . 1 1 57 57 LYS N N 57 120.960 120.960 119.715 1.245 17856 2231 1 7 . 1 1 57 57 LYS C C 57 176.637 176.637 178.813 -2.176 17856 2232 1 7 . 1 1 57 57 LYS H H 57 8.065 8.065 8.168 -0.103 17856 2233 1 7 . 1 1 58 58 LEU N N 58 122.610 122.610 120.805 1.805 17856 2234 1 7 . 1 1 58 58 LEU C C 58 177.433 177.433 178.627 -1.194 17856 2235 1 7 . 1 1 58 58 LEU CA C 58 55.120 55.120 56.991 -1.871 17856 2236 1 7 . 1 1 58 58 LEU H H 58 8.135 8.135 8.126 0.009 17856 2237 1 7 . 1 1 59 59 ILE N N 59 122.045 122.045 117.873 4.172 17856 2238 1 7 . 1 1 59 59 ILE CA C 59 61.535 61.535 63.682 -2.147 17856 2239 1 7 . 1 1 59 59 ILE H H 59 8.220 8.220 7.662 0.558 17856 2240 1 7 . 1 1 60 60 GLU N N 60 124.000 124.000 119.774 4.226 17856 2241 1 7 . 1 1 60 60 GLU C C 60 177.007 177.007 178.669 -1.662 17856 2242 1 7 . 1 1 60 60 GLU CA C 60 56.722 56.722 58.628 -1.906 17856 2243 1 7 . 1 1 60 60 GLU H H 60 8.340 8.340 7.558 0.782 17856 2244 1 7 . 1 1 61 61 GLY N N 61 110.520 110.520 108.192 2.328 17856 2245 1 7 . 1 1 61 61 GLY C C 61 174.002 174.002 173.312 0.690 17856 2246 1 7 . 1 1 61 61 GLY CA C 61 45.405 45.405 44.184 1.221 17856 2247 1 7 . 1 1 61 61 GLY H H 61 8.557 8.557 7.856 0.701 17856 2248 1 7 . 1 1 62 62 TYR N N 62 119.600 119.600 124.189 -4.589 17856 2249 1 7 . 1 1 62 62 TYR C C 62 175.940 175.940 176.076 -0.136 17856 2250 1 7 . 1 1 62 62 TYR CA C 62 58.108 58.108 56.984 1.123 17856 2251 1 7 . 1 1 62 62 TYR H H 62 7.980 7.980 7.736 0.244 17856 2252 1 7 . 1 1 63 63 THR N N 63 116.304 116.304 124.163 -7.859 17856 2253 1 7 . 1 1 63 63 THR C C 63 173.796 173.796 173.468 0.328 17856 2254 1 7 . 1 1 63 63 THR H H 63 8.049 8.049 8.376 -0.327 17856 2255 1 7 . 1 1 64 64 TYR N N 64 122.050 122.050 121.143 0.907 17856 2256 1 7 . 1 1 64 64 TYR C C 64 176.290 176.290 177.395 -1.105 17856 2257 1 7 . 1 1 64 64 TYR CA C 64 58.533 58.533 58.459 0.074 17856 2258 1 7 . 1 1 64 64 TYR H H 64 8.133 8.133 7.943 0.190 17856 2259 1 7 . 1 1 65 65 GLY N N 65 110.456 110.456 107.565 2.891 17856 2260 1 7 . 1 1 65 65 GLY C C 65 174.340 174.340 175.755 -1.415 17856 2261 1 7 . 1 1 65 65 GLY CA C 65 45.328 45.328 45.634 -0.306 17856 2262 1 7 . 1 1 65 65 GLY H H 65 7.747 7.747 8.281 -0.534 17856 2263 1 7 . 1 1 66 66 GLU N N 66 120.783 120.783 120.985 -0.202 17856 2264 1 7 . 1 1 66 66 GLU C C 66 176.895 176.895 178.777 -1.882 17856 2265 1 7 . 1 1 66 66 GLU CA C 66 56.804 56.804 58.787 -1.983 17856 2266 1 7 . 1 1 66 66 GLU H H 66 8.243 8.243 8.605 -0.362 17856 2267 1 7 . 1 1 67 67 GLU N N 67 121.587 121.587 120.196 1.391 17856 2268 1 7 . 1 1 67 67 GLU C C 67 176.340 176.340 178.428 -2.088 17856 2269 1 7 . 1 1 67 67 GLU H H 67 8.611 8.611 7.986 0.625 17856 2270 1 7 . 1 1 68 68 ARG N N 68 121.790 121.790 116.705 5.085 17856 2271 1 7 . 1 1 68 68 ARG C C 68 176.350 176.350 177.745 -1.395 17856 2272 1 7 . 1 1 68 68 ARG H H 68 8.267 8.267 7.628 0.639 17856 2273 1 7 . 1 1 69 69 LYS N N 69 118.431 118.431 116.706 1.725 17856 2274 1 7 . 1 1 69 69 LYS H H 69 7.567 7.567 7.899 -0.332 17856 2275 1 7 . 1 1 70 70 LEU C C 70 177.338 177.338 177.525 -0.187 17856 2276 1 7 . 1 1 70 70 LEU CA C 70 55.533 55.533 56.388 -0.855 17856 2277 1 7 . 1 1 71 71 TYR N N 71 119.504 119.504 116.593 2.911 17856 2278 1 7 . 1 1 71 71 TYR H H 71 7.997 7.997 7.751 0.246 17856 2279 1 7 . 1 1 72 72 ASP C C 72 176.528 176.528 178.285 -1.757 17856 2280 1 7 . 1 1 72 72 ASP CA C 72 54.693 54.693 57.742 -3.049 17856 2281 1 7 . 1 1 73 73 SER N N 73 117.000 117.000 113.809 3.191 17856 2282 1 7 . 1 1 73 73 SER C C 73 174.950 174.950 175.286 -0.336 17856 2283 1 7 . 1 1 73 73 SER CA C 73 58.997 58.997 60.363 -1.366 17856 2284 1 7 . 1 1 73 73 SER H H 73 8.282 8.282 8.630 -0.348 17856 2285 1 7 . 1 1 74 74 ALA N N 74 125.422 125.422 123.981 1.441 17856 2286 1 7 . 1 1 74 74 ALA C C 74 178.389 178.389 179.048 -0.659 17856 2287 1 7 . 1 1 74 74 ALA CA C 74 53.433 53.433 54.357 -0.924 17856 2288 1 7 . 1 1 74 74 ALA H H 74 8.339 8.339 7.270 1.069 17856 2289 1 7 . 1 1 75 75 LEU N N 75 120.019 120.019 119.409 0.610 17856 2290 1 7 . 1 1 75 75 LEU C C 75 177.954 177.954 178.637 -0.683 17856 2291 1 7 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.149 -1.369 17856 2292 1 7 . 1 1 75 75 LEU H H 75 7.948 7.948 7.571 0.377 17856 2293 1 7 . 1 1 76 76 SER N N 76 113.321 113.321 114.604 -1.283 17856 2294 1 7 . 1 1 76 76 SER C C 76 174.784 174.784 176.680 -1.896 17856 2295 1 7 . 1 1 76 76 SER CA C 76 59.173 59.173 61.939 -2.766 17856 2296 1 7 . 1 1 76 76 SER H H 76 7.951 7.951 7.841 0.110 17856 2297 1 7 . 1 1 77 77 LYS N N 77 122.710 122.710 121.405 1.305 17856 2298 1 7 . 1 1 77 77 LYS C C 77 176.734 176.734 178.768 -2.034 17856 2299 1 7 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.220 -0.830 17856 2300 1 7 . 1 1 77 77 LYS H H 77 8.170 8.170 7.389 0.781 17856 2301 1 7 . 1 1 78 78 ILE N N 78 121.521 121.521 118.842 2.679 17856 2302 1 7 . 1 1 78 78 ILE C C 78 176.512 176.512 178.256 -1.744 17856 2303 1 7 . 1 1 78 78 ILE H H 78 8.160 8.160 7.199 0.961 17856 2304 1 7 . 1 1 79 79 GLU N N 79 123.840 123.840 120.834 3.006 17856 2305 1 7 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.613 -4.135 17856 2306 1 7 . 1 1 79 79 GLU H H 79 8.360 8.360 8.031 0.329 17856 2307 1 7 . 1 1 80 80 LYS N N 80 122.143 122.143 119.577 2.566 17856 2308 1 7 . 1 1 80 80 LYS C C 80 176.937 176.937 178.853 -1.916 17856 2309 1 7 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.522 -3.022 17856 2310 1 7 . 1 1 80 80 LYS H H 80 8.231 8.231 7.586 0.645 17856 2311 1 7 . 1 1 81 81 LEU N N 81 122.095 122.095 121.610 0.485 17856 2312 1 7 . 1 1 81 81 LEU C C 81 177.531 177.531 178.544 -1.013 17856 2313 1 7 . 1 1 81 81 LEU H H 81 8.050 8.050 7.269 0.781 17856 2314 1 7 . 1 1 82 82 ILE N N 82 120.609 120.609 118.720 1.889 17856 2315 1 7 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.484 -4.124 17856 2316 1 7 . 1 1 82 82 ILE H H 82 8.000 8.000 7.780 0.220 17856 2317 1 7 . 1 1 83 83 GLU N N 83 124.611 124.611 120.098 4.513 17856 2318 1 7 . 1 1 83 83 GLU C C 83 177.298 177.298 179.357 -2.059 17856 2319 1 7 . 1 1 83 83 GLU H H 83 8.380 8.380 8.195 0.185 17856 2320 1 7 . 1 1 84 84 THR N N 84 115.107 115.107 116.042 -0.935 17856 2321 1 7 . 1 1 84 84 THR C C 84 174.400 174.400 175.607 -1.207 17856 2322 1 7 . 1 1 84 84 THR CA C 84 62.659 62.659 66.055 -3.396 17856 2323 1 7 . 1 1 84 84 THR H H 84 8.064 8.064 8.064 -0.000 17856 2324 1 7 . 1 1 85 85 LEU N N 85 124.150 124.150 120.369 3.781 17856 2325 1 7 . 1 1 85 85 LEU C C 85 177.120 177.120 176.449 0.671 17856 2326 1 7 . 1 1 85 85 LEU CA C 85 55.020 55.020 54.946 0.074 17856 2327 1 7 . 1 1 85 85 LEU H H 85 8.238 8.238 7.460 0.778 17856 2328 1 7 . 1 1 86 86 SER N N 86 114.913 114.913 115.090 -0.177 17856 2329 1 7 . 1 1 86 86 SER H H 86 7.678 7.678 7.515 0.163 17856 2330 1 7 . 1 1 87 87 PRO CA C 87 63.550 63.550 63.118 0.431 17856 2331 1 7 . 1 1 88 88 ALA N N 88 123.767 123.767 119.299 4.468 17856 2332 1 7 . 1 1 88 88 ALA C C 88 178.131 178.131 176.392 1.739 17856 2333 1 7 . 1 1 88 88 ALA CA C 88 52.878 52.878 53.072 -0.194 17856 2334 1 7 . 1 1 88 88 ALA H H 88 8.342 8.342 8.234 0.108 17856 2335 1 7 . 1 1 89 89 ARG N N 89 119.159 119.159 120.862 -1.703 17856 2336 1 7 . 1 1 89 89 ARG C C 89 176.620 176.620 175.023 1.597 17856 2337 1 7 . 1 1 89 89 ARG H H 89 8.133 8.133 8.708 -0.575 17856 2338 1 7 . 1 1 90 90 SER N N 90 116.910 116.910 116.840 0.070 17856 2339 1 7 . 1 1 90 90 SER C C 90 174.887 174.887 173.144 1.743 17856 2340 1 7 . 1 1 90 90 SER H H 90 8.322 8.322 8.299 0.023 17856 2341 1 7 . 1 1 91 91 LYS N N 91 123.457 123.457 122.129 1.328 17856 2342 1 7 . 1 1 91 91 LYS C C 91 176.970 176.970 177.171 -0.201 17856 2343 1 7 . 1 1 91 91 LYS H H 91 8.396 8.396 8.414 -0.018 17856 2344 1 7 . 1 1 92 92 SER N N 92 116.692 116.692 122.952 -6.260 17856 2345 1 7 . 1 1 92 92 SER C C 92 174.573 174.573 175.683 -1.110 17856 2346 1 7 . 1 1 92 92 SER CA C 92 58.600 58.600 59.537 -0.937 17856 2347 1 7 . 1 1 92 92 SER H H 92 8.297 8.297 8.836 -0.539 17856 2348 1 7 . 1 1 93 93 GLN N N 93 121.916 121.916 119.724 2.192 17856 2349 1 7 . 1 1 93 93 GLN C C 93 175.971 175.971 174.429 1.542 17856 2350 1 7 . 1 1 93 93 GLN H H 93 8.325 8.325 7.992 0.333 17856 2351 1 7 . 1 1 94 94 SER N N 94 117.385 117.385 116.276 1.109 17856 2352 1 7 . 1 1 94 94 SER C C 94 173.940 173.940 173.513 0.427 17856 2353 1 7 . 1 1 94 94 SER CA C 94 58.520 58.520 58.852 -0.332 17856 2354 1 7 . 1 1 94 94 SER H H 94 8.352 8.352 8.436 -0.084 17856 2355 1 7 . 1 1 95 95 THR N N 95 120.756 120.756 116.350 4.406 17856 2356 1 7 . 1 1 95 95 THR H H 95 7.805 7.805 8.320 -0.515 17856 2357 1 7 . 1 1 99 99 ARG C C 99 176.250 176.250 175.210 1.040 17856 2358 1 7 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.313 -0.156 17856 2359 1 7 . 1 1 100 100 ASN N N 100 118.482 118.482 118.960 -0.478 17856 2360 1 7 . 1 1 100 100 ASN H H 100 8.272 8.272 8.519 -0.247 17856 2361 1 7 . 1 1 101 101 ARG C C 101 176.280 176.280 175.745 0.535 17856 2362 1 7 . 1 1 102 102 ASN N N 102 118.688 118.688 121.785 -3.097 17856 2363 1 7 . 1 1 102 102 ASN C C 102 174.996 174.996 174.750 0.246 17856 2364 1 7 . 1 1 102 102 ASN CA C 102 53.609 53.609 53.280 0.329 17856 2365 1 7 . 1 1 102 102 ASN H H 102 8.424 8.424 8.735 -0.311 17856 2366 1 7 . 1 1 103 103 ASN N N 103 118.865 118.865 117.453 1.412 17856 2367 1 7 . 1 1 103 103 ASN C C 103 175.040 175.040 174.561 0.479 17856 2368 1 7 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.716 0.096 17856 2369 1 7 . 1 1 103 103 ASN H H 103 8.282 8.282 8.317 -0.035 17856 2370 1 7 . 1 1 104 104 ARG N N 104 120.875 120.875 114.525 6.350 17856 2371 1 7 . 1 1 104 104 ARG H H 104 8.140 8.140 8.162 -0.022 17856 2372 1 7 . 1 1 106 106 ILE C C 106 175.408 175.408 175.947 -0.539 17856 2373 1 7 . 1 1 106 106 ILE CA C 106 61.395 61.395 61.942 -0.547 17856 2374 1 8 . 1 1 2 2 SER N N 2 116.304 116.304 117.233 -0.929 17856 2375 1 8 . 1 1 2 2 SER C C 2 174.710 174.710 174.902 -0.192 17856 2376 1 8 . 1 1 2 2 SER CA C 2 58.908 58.908 59.004 -0.096 17856 2377 1 8 . 1 1 2 2 SER H H 2 8.003 8.003 8.425 -0.422 17856 2378 1 8 . 1 1 3 3 ILE N N 3 122.062 122.062 124.137 -2.075 17856 2379 1 8 . 1 1 3 3 ILE C C 3 176.750 176.750 177.337 -0.587 17856 2380 1 8 . 1 1 3 3 ILE CA C 3 61.786 61.786 62.536 -0.750 17856 2381 1 8 . 1 1 3 3 ILE H H 3 7.957 7.957 8.271 -0.314 17856 2382 1 8 . 1 1 4 4 VAL N N 4 122.674 122.674 121.503 1.171 17856 2383 1 8 . 1 1 4 4 VAL C C 4 176.221 176.221 176.862 -0.641 17856 2384 1 8 . 1 1 4 4 VAL CA C 4 62.970 62.970 64.704 -1.734 17856 2385 1 8 . 1 1 4 4 VAL H H 4 7.970 7.970 8.105 -0.135 17856 2386 1 8 . 1 1 5 5 SER N N 5 117.750 117.750 114.943 2.807 17856 2387 1 8 . 1 1 5 5 SER C C 5 174.858 174.858 175.936 -1.078 17856 2388 1 8 . 1 1 5 5 SER CA C 5 58.630 58.630 61.278 -2.647 17856 2389 1 8 . 1 1 5 5 SER H H 5 8.093 8.093 7.811 0.282 17856 2390 1 8 . 1 1 6 6 GLN N N 6 121.961 121.961 120.520 1.441 17856 2391 1 8 . 1 1 6 6 GLN C C 6 176.467 176.467 177.173 -0.706 17856 2392 1 8 . 1 1 6 6 GLN CA C 6 56.226 56.226 56.439 -0.213 17856 2393 1 8 . 1 1 6 6 GLN H H 6 8.371 8.371 7.488 0.883 17856 2394 1 8 . 1 1 7 7 THR N N 7 115.325 115.325 111.540 3.785 17856 2395 1 8 . 1 1 7 7 THR C C 7 174.752 174.752 175.615 -0.863 17856 2396 1 8 . 1 1 7 7 THR H H 7 8.152 8.152 7.622 0.530 17856 2397 1 8 . 1 1 8 8 ARG N N 8 122.530 122.530 118.825 3.705 17856 2398 1 8 . 1 1 8 8 ARG C C 8 176.200 176.200 177.786 -1.586 17856 2399 1 8 . 1 1 8 8 ARG CA C 8 56.570 56.570 56.296 0.274 17856 2400 1 8 . 1 1 8 8 ARG H H 8 8.211 8.211 7.421 0.790 17856 2401 1 8 . 1 1 9 9 ASN N N 9 119.600 119.600 118.937 0.663 17856 2402 1 8 . 1 1 9 9 ASN C C 9 177.164 177.164 176.781 0.383 17856 2403 1 8 . 1 1 9 9 ASN H H 9 8.398 8.398 7.766 0.632 17856 2404 1 8 . 1 1 10 10 LYS N N 10 121.600 121.600 120.349 1.251 17856 2405 1 8 . 1 1 10 10 LYS C C 10 176.845 176.845 178.451 -1.606 17856 2406 1 8 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.510 -2.400 17856 2407 1 8 . 1 1 10 10 LYS H H 10 8.190 8.190 8.201 -0.011 17856 2408 1 8 . 1 1 11 11 GLU N N 11 120.700 120.700 120.027 0.673 17856 2409 1 8 . 1 1 11 11 GLU C C 11 176.825 176.825 178.943 -2.118 17856 2410 1 8 . 1 1 11 11 GLU CA C 11 56.690 56.690 59.414 -2.724 17856 2411 1 8 . 1 1 11 11 GLU H H 11 8.323 8.323 7.733 0.590 17856 2412 1 8 . 1 1 12 12 LEU N N 12 122.390 122.390 120.640 1.750 17856 2413 1 8 . 1 1 12 12 LEU C C 12 177.670 177.670 178.921 -1.251 17856 2414 1 8 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.300 -2.830 17856 2415 1 8 . 1 1 12 12 LEU H H 12 8.155 8.155 7.985 0.170 17856 2416 1 8 . 1 1 13 13 LEU N N 13 122.570 122.570 115.888 6.682 17856 2417 1 8 . 1 1 13 13 LEU C C 13 177.510 177.510 178.808 -1.298 17856 2418 1 8 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.084 -2.503 17856 2419 1 8 . 1 1 13 13 LEU H H 13 8.220 8.220 7.472 0.748 17856 2420 1 8 . 1 1 14 14 ASP N N 14 120.780 120.780 121.394 -0.614 17856 2421 1 8 . 1 1 14 14 ASP C C 14 176.480 176.480 178.791 -2.311 17856 2422 1 8 . 1 1 14 14 ASP CA C 14 54.650 54.650 58.277 -3.627 17856 2423 1 8 . 1 1 14 14 ASP H H 14 8.243 8.243 8.763 -0.520 17856 2424 1 8 . 1 1 15 15 LYS N N 15 120.900 120.900 119.037 1.863 17856 2425 1 8 . 1 1 15 15 LYS C C 15 175.580 175.580 178.969 -3.389 17856 2426 1 8 . 1 1 15 15 LYS H H 15 8.052 8.052 8.126 -0.074 17856 2427 1 8 . 1 1 16 16 LYS N N 16 121.980 121.980 120.622 1.358 17856 2428 1 8 . 1 1 16 16 LYS C C 16 176.887 176.887 178.826 -1.939 17856 2429 1 8 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.808 -2.474 17856 2430 1 8 . 1 1 16 16 LYS H H 16 8.243 8.243 7.452 0.791 17856 2431 1 8 . 1 1 17 17 ILE N N 17 121.940 121.940 119.050 2.890 17856 2432 1 8 . 1 1 17 17 ILE H H 17 8.110 8.110 8.084 0.026 17856 2433 1 8 . 1 1 18 18 ARG C C 18 176.520 176.520 178.379 -1.859 17856 2434 1 8 . 1 1 19 19 SER N N 19 117.150 117.150 114.555 2.595 17856 2435 1 8 . 1 1 19 19 SER C C 19 175.167 175.167 176.249 -1.082 17856 2436 1 8 . 1 1 19 19 SER CA C 19 58.840 58.840 61.568 -2.728 17856 2437 1 8 . 1 1 19 19 SER H H 19 8.396 8.396 7.767 0.629 17856 2438 1 8 . 1 1 20 20 GLU N N 20 123.176 123.176 122.234 0.942 17856 2439 1 8 . 1 1 20 20 GLU C C 20 176.921 176.921 178.911 -1.990 17856 2440 1 8 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.262 -2.402 17856 2441 1 8 . 1 1 20 20 GLU H H 20 8.478 8.478 7.793 0.685 17856 2442 1 8 . 1 1 21 21 ILE N N 21 120.550 120.550 114.997 5.553 17856 2443 1 8 . 1 1 21 21 ILE C C 21 176.550 176.550 178.303 -1.753 17856 2444 1 8 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.538 -2.908 17856 2445 1 8 . 1 1 21 21 ILE H H 21 8.080 8.080 7.539 0.541 17856 2446 1 8 . 1 1 22 22 GLU N N 22 123.685 123.685 120.566 3.119 17856 2447 1 8 . 1 1 22 22 GLU C C 22 176.109 176.109 178.693 -2.584 17856 2448 1 8 . 1 1 22 22 GLU H H 22 8.309 8.309 7.651 0.658 17856 2449 1 8 . 1 1 23 23 ALA N N 23 124.280 124.280 123.065 1.215 17856 2450 1 8 . 1 1 23 23 ALA C C 23 178.474 178.474 179.680 -1.206 17856 2451 1 8 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.069 -1.663 17856 2452 1 8 . 1 1 23 23 ALA H H 23 8.088 8.088 8.310 -0.222 17856 2453 1 8 . 1 1 24 24 ILE N N 24 120.330 120.330 118.361 1.969 17856 2454 1 8 . 1 1 24 24 ILE C C 24 176.309 176.309 177.652 -1.343 17856 2455 1 8 . 1 1 24 24 ILE CA C 24 61.540 61.540 65.351 -3.811 17856 2456 1 8 . 1 1 24 24 ILE H H 24 7.980 7.980 8.567 -0.587 17856 2457 1 8 . 1 1 25 25 LYS N N 25 124.310 124.310 119.843 4.467 17856 2458 1 8 . 1 1 25 25 LYS C C 25 176.365 176.365 178.491 -2.126 17856 2459 1 8 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.022 -2.688 17856 2460 1 8 . 1 1 25 25 LYS H H 25 8.198 8.198 7.697 0.501 17856 2461 1 8 . 1 1 26 26 LYS N N 26 122.518 122.518 118.573 3.945 17856 2462 1 8 . 1 1 26 26 LYS C C 26 176.365 176.365 178.602 -2.237 17856 2463 1 8 . 1 1 26 26 LYS CA C 26 56.175 56.175 58.158 -1.983 17856 2464 1 8 . 1 1 26 26 LYS H H 26 8.125 8.125 7.298 0.827 17856 2465 1 8 . 1 1 27 27 ILE N N 27 122.670 122.670 119.652 3.018 17856 2466 1 8 . 1 1 27 27 ILE C C 27 176.261 176.261 178.539 -2.278 17856 2467 1 8 . 1 1 27 27 ILE CA C 27 61.294 61.294 63.639 -2.345 17856 2468 1 8 . 1 1 27 27 ILE H H 27 8.114 8.114 7.922 0.192 17856 2469 1 8 . 1 1 28 28 ILE N N 28 125.178 125.178 120.594 4.584 17856 2470 1 8 . 1 1 28 28 ILE C C 28 175.803 175.803 175.946 -0.143 17856 2471 1 8 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.190 -2.110 17856 2472 1 8 . 1 1 28 28 ILE H H 28 8.220 8.220 7.908 0.312 17856 2473 1 8 . 1 1 29 29 ALA N N 29 127.850 127.850 118.735 9.115 17856 2474 1 8 . 1 1 29 29 ALA C C 29 177.627 177.627 177.790 -0.163 17856 2475 1 8 . 1 1 29 29 ALA CA C 29 53.684 53.684 52.470 1.214 17856 2476 1 8 . 1 1 29 29 ALA H H 29 8.300 8.300 7.096 1.204 17856 2477 1 8 . 1 1 30 30 GLU N N 30 120.000 120.000 117.971 2.029 17856 2478 1 8 . 1 1 30 30 GLU C C 30 176.321 176.321 177.841 -1.520 17856 2479 1 8 . 1 1 30 30 GLU H H 30 8.258 8.258 7.657 0.601 17856 2480 1 8 . 1 1 31 31 PHE N N 31 119.128 119.128 119.575 -0.447 17856 2481 1 8 . 1 1 31 31 PHE C C 31 175.180 175.180 177.527 -2.347 17856 2482 1 8 . 1 1 31 31 PHE CA C 31 57.540 57.540 62.517 -4.978 17856 2483 1 8 . 1 1 31 31 PHE H H 31 8.061 8.061 7.501 0.560 17856 2484 1 8 . 1 1 32 32 ASP N N 32 121.800 121.800 117.992 3.808 17856 2485 1 8 . 1 1 32 32 ASP C C 32 175.894 175.894 178.124 -2.230 17856 2486 1 8 . 1 1 32 32 ASP CA C 32 54.529 54.529 57.215 -2.686 17856 2487 1 8 . 1 1 32 32 ASP H H 32 8.275 8.275 8.657 -0.382 17856 2488 1 8 . 1 1 33 33 VAL N N 33 119.648 119.648 119.803 -0.155 17856 2489 1 8 . 1 1 33 33 VAL C C 33 176.268 176.268 177.776 -1.508 17856 2490 1 8 . 1 1 33 33 VAL CA C 33 62.500 62.500 65.238 -2.738 17856 2491 1 8 . 1 1 33 33 VAL H H 33 8.059 8.059 7.711 0.348 17856 2492 1 8 . 1 1 34 34 VAL N N 34 123.882 123.882 117.766 6.116 17856 2493 1 8 . 1 1 34 34 VAL H H 34 7.774 7.774 7.672 0.102 17856 2494 1 8 . 1 1 35 35 LYS N N 35 125.250 125.250 120.373 4.877 17856 2495 1 8 . 1 1 35 35 LYS C C 35 176.719 176.719 178.011 -1.292 17856 2496 1 8 . 1 1 35 35 LYS CA C 35 56.502 56.502 59.099 -2.597 17856 2497 1 8 . 1 1 35 35 LYS H H 35 8.357 8.357 8.283 0.074 17856 2498 1 8 . 1 1 36 36 GLU N N 36 121.850 121.850 115.667 6.183 17856 2499 1 8 . 1 1 36 36 GLU C C 36 176.426 176.426 177.762 -1.336 17856 2500 1 8 . 1 1 36 36 GLU H H 36 8.423 8.423 7.906 0.517 17856 2501 1 8 . 1 1 37 37 SER N N 37 117.100 117.100 114.888 2.212 17856 2502 1 8 . 1 1 37 37 SER C C 37 174.854 174.854 175.347 -0.493 17856 2503 1 8 . 1 1 37 37 SER CA C 37 58.850 58.850 60.297 -1.447 17856 2504 1 8 . 1 1 37 37 SER H H 37 8.362 8.362 7.591 0.771 17856 2505 1 8 . 1 1 38 38 VAL N N 38 121.625 121.625 123.037 -1.412 17856 2506 1 8 . 1 1 38 38 VAL C C 38 176.246 176.246 174.454 1.792 17856 2507 1 8 . 1 1 38 38 VAL CA C 38 63.043 63.043 63.812 -0.769 17856 2508 1 8 . 1 1 38 38 VAL H H 38 8.225 8.225 7.810 0.415 17856 2509 1 8 . 1 1 39 39 ASN N N 39 121.150 121.150 124.962 -3.812 17856 2510 1 8 . 1 1 39 39 ASN C C 39 175.459 175.459 175.612 -0.153 17856 2511 1 8 . 1 1 39 39 ASN CA C 39 53.568 53.568 53.886 -0.318 17856 2512 1 8 . 1 1 39 39 ASN H H 39 8.366 8.366 8.040 0.326 17856 2513 1 8 . 1 1 40 40 GLU N N 40 121.500 121.500 121.398 0.102 17856 2514 1 8 . 1 1 40 40 GLU C C 40 175.459 175.459 175.526 -0.067 17856 2515 1 8 . 1 1 40 40 GLU CA C 40 56.860 56.860 56.770 0.090 17856 2516 1 8 . 1 1 40 40 GLU H H 40 8.370 8.370 8.559 -0.189 17856 2517 1 8 . 1 1 41 41 LEU N N 41 121.950 121.950 122.574 -0.624 17856 2518 1 8 . 1 1 41 41 LEU C C 41 177.939 177.939 177.944 -0.005 17856 2519 1 8 . 1 1 41 41 LEU CA C 41 56.040 56.040 55.695 0.345 17856 2520 1 8 . 1 1 41 41 LEU H H 41 8.152 8.152 8.102 0.050 17856 2521 1 8 . 1 1 42 42 SER N N 42 113.326 113.326 116.331 -3.005 17856 2522 1 8 . 1 1 42 42 SER C C 42 174.660 174.660 175.584 -0.924 17856 2523 1 8 . 1 1 42 42 SER CA C 42 58.940 58.940 61.130 -2.190 17856 2524 1 8 . 1 1 42 42 SER H H 42 8.373 8.373 8.354 0.019 17856 2525 1 8 . 1 1 43 43 GLU N N 43 121.521 121.521 122.274 -0.753 17856 2526 1 8 . 1 1 43 43 GLU C C 43 177.349 177.349 178.870 -1.521 17856 2527 1 8 . 1 1 43 43 GLU H H 43 7.329 7.329 8.686 -1.357 17856 2528 1 8 . 1 1 44 44 LYS N N 44 121.240 121.240 119.698 1.542 17856 2529 1 8 . 1 1 44 44 LYS C C 44 177.246 177.246 178.384 -1.138 17856 2530 1 8 . 1 1 44 44 LYS CA C 44 56.397 56.397 58.883 -2.486 17856 2531 1 8 . 1 1 44 44 LYS H H 44 8.103 8.103 7.555 0.548 17856 2532 1 8 . 1 1 45 45 ALA N N 45 119.568 119.568 120.190 -0.622 17856 2533 1 8 . 1 1 45 45 ALA C C 45 177.853 177.853 179.113 -1.260 17856 2534 1 8 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.806 -2.246 17856 2535 1 8 . 1 1 45 45 ALA H H 45 8.541 8.541 7.446 1.095 17856 2536 1 8 . 1 1 46 46 LYS N N 46 115.235 115.235 116.442 -1.207 17856 2537 1 8 . 1 1 46 46 LYS C C 46 177.110 177.110 178.624 -1.514 17856 2538 1 8 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.427 -1.631 17856 2539 1 8 . 1 1 46 46 LYS H H 46 7.257 7.257 7.585 -0.328 17856 2540 1 8 . 1 1 47 47 THR N N 47 103.239 103.239 108.081 -4.842 17856 2541 1 8 . 1 1 47 47 THR C C 47 173.973 173.973 174.601 -0.628 17856 2542 1 8 . 1 1 47 47 THR CA C 47 62.740 62.740 62.569 0.171 17856 2543 1 8 . 1 1 47 47 THR H H 47 7.381 7.381 7.508 -0.127 17856 2544 1 8 . 1 1 48 48 ASP N N 48 122.976 122.976 122.289 0.687 17856 2545 1 8 . 1 1 48 48 ASP H H 48 8.031 8.031 7.658 0.373 17856 2546 1 8 . 1 1 49 49 PRO C C 49 178.106 178.106 178.586 -0.480 17856 2547 1 8 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.818 -0.599 17856 2548 1 8 . 1 1 50 50 GLN N N 50 118.351 118.351 118.926 -0.575 17856 2549 1 8 . 1 1 50 50 GLN C C 50 176.944 176.944 178.309 -1.365 17856 2550 1 8 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.496 -1.696 17856 2551 1 8 . 1 1 50 50 GLN H H 50 8.304 8.304 8.271 0.033 17856 2552 1 8 . 1 1 51 51 ALA N N 51 124.206 124.206 121.960 2.246 17856 2553 1 8 . 1 1 51 51 ALA C C 51 178.490 178.490 179.236 -0.746 17856 2554 1 8 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.754 -1.330 17856 2555 1 8 . 1 1 51 51 ALA H H 51 7.547 7.547 8.575 -1.028 17856 2556 1 8 . 1 1 52 52 ALA N N 52 118.686 118.686 120.497 -1.811 17856 2557 1 8 . 1 1 52 52 ALA C C 52 177.953 177.953 179.335 -1.382 17856 2558 1 8 . 1 1 52 52 ALA H H 52 7.931 7.931 7.859 0.072 17856 2559 1 8 . 1 1 53 53 GLU N N 53 120.075 120.075 118.442 1.633 17856 2560 1 8 . 1 1 53 53 GLU H H 53 7.729 7.729 7.780 -0.051 17856 2561 1 8 . 1 1 55 55 LEU N N 55 123.640 123.640 119.345 4.295 17856 2562 1 8 . 1 1 55 55 LEU C C 55 177.587 177.587 178.648 -1.061 17856 2563 1 8 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.306 -1.518 17856 2564 1 8 . 1 1 55 55 LEU H H 55 8.215 8.215 8.473 -0.258 17856 2565 1 8 . 1 1 56 56 ASN N N 56 118.520 118.520 116.544 1.976 17856 2566 1 8 . 1 1 56 56 ASN C C 56 175.700 175.700 175.899 -0.199 17856 2567 1 8 . 1 1 56 56 ASN CA C 56 54.132 54.132 55.069 -0.937 17856 2568 1 8 . 1 1 56 56 ASN H H 56 8.250 8.250 8.070 0.180 17856 2569 1 8 . 1 1 57 57 LYS N N 57 120.960 120.960 119.677 1.283 17856 2570 1 8 . 1 1 57 57 LYS C C 57 176.637 176.637 175.176 1.461 17856 2571 1 8 . 1 1 57 57 LYS H H 57 8.065 8.065 8.128 -0.063 17856 2572 1 8 . 1 1 58 58 LEU N N 58 122.610 122.610 127.162 -4.552 17856 2573 1 8 . 1 1 58 58 LEU C C 58 177.433 177.433 176.840 0.593 17856 2574 1 8 . 1 1 58 58 LEU CA C 58 55.120 55.120 55.146 -0.026 17856 2575 1 8 . 1 1 58 58 LEU H H 58 8.135 8.135 8.949 -0.814 17856 2576 1 8 . 1 1 59 59 ILE N N 59 122.045 122.045 123.513 -1.468 17856 2577 1 8 . 1 1 59 59 ILE CA C 59 61.535 61.535 61.348 0.187 17856 2578 1 8 . 1 1 59 59 ILE H H 59 8.220 8.220 7.973 0.247 17856 2579 1 8 . 1 1 60 60 GLU N N 60 124.000 124.000 119.711 4.289 17856 2580 1 8 . 1 1 60 60 GLU C C 60 177.007 177.007 176.218 0.789 17856 2581 1 8 . 1 1 60 60 GLU CA C 60 56.722 56.722 55.790 0.932 17856 2582 1 8 . 1 1 60 60 GLU H H 60 8.340 8.340 7.664 0.676 17856 2583 1 8 . 1 1 61 61 GLY N N 61 110.520 110.520 111.088 -0.568 17856 2584 1 8 . 1 1 61 61 GLY C C 61 174.002 174.002 173.949 0.053 17856 2585 1 8 . 1 1 61 61 GLY CA C 61 45.405 45.405 45.362 0.043 17856 2586 1 8 . 1 1 61 61 GLY H H 61 8.557 8.557 8.843 -0.286 17856 2587 1 8 . 1 1 62 62 TYR N N 62 119.600 119.600 120.016 -0.416 17856 2588 1 8 . 1 1 62 62 TYR C C 62 175.940 175.940 176.591 -0.651 17856 2589 1 8 . 1 1 62 62 TYR CA C 62 58.108 58.108 57.645 0.463 17856 2590 1 8 . 1 1 62 62 TYR H H 62 7.980 7.980 8.190 -0.210 17856 2591 1 8 . 1 1 63 63 THR N N 63 116.304 116.304 114.926 1.378 17856 2592 1 8 . 1 1 63 63 THR C C 63 173.796 173.796 174.678 -0.882 17856 2593 1 8 . 1 1 63 63 THR H H 63 8.049 8.049 7.628 0.421 17856 2594 1 8 . 1 1 64 64 TYR N N 64 122.050 122.050 121.356 0.694 17856 2595 1 8 . 1 1 64 64 TYR C C 64 176.290 176.290 174.501 1.789 17856 2596 1 8 . 1 1 64 64 TYR CA C 64 58.533 58.533 58.005 0.528 17856 2597 1 8 . 1 1 64 64 TYR H H 64 8.133 8.133 7.981 0.152 17856 2598 1 8 . 1 1 65 65 GLY N N 65 110.456 110.456 112.488 -2.032 17856 2599 1 8 . 1 1 65 65 GLY C C 65 174.340 174.340 175.084 -0.744 17856 2600 1 8 . 1 1 65 65 GLY CA C 65 45.328 45.328 45.754 -0.426 17856 2601 1 8 . 1 1 65 65 GLY H H 65 7.747 7.747 8.329 -0.582 17856 2602 1 8 . 1 1 66 66 GLU N N 66 120.783 120.783 121.114 -0.331 17856 2603 1 8 . 1 1 66 66 GLU C C 66 176.895 176.895 176.497 0.398 17856 2604 1 8 . 1 1 66 66 GLU CA C 66 56.804 56.804 57.858 -1.054 17856 2605 1 8 . 1 1 66 66 GLU H H 66 8.243 8.243 8.221 0.022 17856 2606 1 8 . 1 1 67 67 GLU N N 67 121.587 121.587 117.776 3.811 17856 2607 1 8 . 1 1 67 67 GLU C C 67 176.340 176.340 175.319 1.021 17856 2608 1 8 . 1 1 67 67 GLU H H 67 8.611 8.611 7.822 0.789 17856 2609 1 8 . 1 1 68 68 ARG N N 68 121.790 121.790 122.886 -1.096 17856 2610 1 8 . 1 1 68 68 ARG C C 68 176.350 176.350 176.101 0.249 17856 2611 1 8 . 1 1 68 68 ARG H H 68 8.267 8.267 8.722 -0.455 17856 2612 1 8 . 1 1 69 69 LYS N N 69 118.431 118.431 122.763 -4.332 17856 2613 1 8 . 1 1 69 69 LYS H H 69 7.567 7.567 8.571 -1.004 17856 2614 1 8 . 1 1 70 70 LEU C C 70 177.338 177.338 177.914 -0.576 17856 2615 1 8 . 1 1 70 70 LEU CA C 70 55.533 55.533 56.928 -1.395 17856 2616 1 8 . 1 1 71 71 TYR N N 71 119.504 119.504 114.385 5.119 17856 2617 1 8 . 1 1 71 71 TYR H H 71 7.997 7.997 7.754 0.243 17856 2618 1 8 . 1 1 72 72 ASP C C 72 176.528 176.528 178.330 -1.802 17856 2619 1 8 . 1 1 72 72 ASP CA C 72 54.693 54.693 56.905 -2.212 17856 2620 1 8 . 1 1 73 73 SER N N 73 117.000 117.000 115.259 1.741 17856 2621 1 8 . 1 1 73 73 SER C C 73 174.950 174.950 175.919 -0.969 17856 2622 1 8 . 1 1 73 73 SER CA C 73 58.997 58.997 61.279 -2.282 17856 2623 1 8 . 1 1 73 73 SER H H 73 8.282 8.282 7.854 0.428 17856 2624 1 8 . 1 1 74 74 ALA N N 74 125.422 125.422 124.785 0.637 17856 2625 1 8 . 1 1 74 74 ALA C C 74 178.389 178.389 179.467 -1.078 17856 2626 1 8 . 1 1 74 74 ALA CA C 74 53.433 53.433 54.774 -1.341 17856 2627 1 8 . 1 1 74 74 ALA H H 74 8.339 8.339 7.339 1.000 17856 2628 1 8 . 1 1 75 75 LEU N N 75 120.019 120.019 119.193 0.826 17856 2629 1 8 . 1 1 75 75 LEU C C 75 177.954 177.954 178.880 -0.926 17856 2630 1 8 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.458 -1.678 17856 2631 1 8 . 1 1 75 75 LEU H H 75 7.948 7.948 7.705 0.243 17856 2632 1 8 . 1 1 76 76 SER N N 76 113.321 113.321 115.285 -1.964 17856 2633 1 8 . 1 1 76 76 SER C C 76 174.784 174.784 176.975 -2.191 17856 2634 1 8 . 1 1 76 76 SER CA C 76 59.173 59.173 61.716 -2.543 17856 2635 1 8 . 1 1 76 76 SER H H 76 7.951 7.951 7.708 0.243 17856 2636 1 8 . 1 1 77 77 LYS N N 77 122.710 122.710 121.829 0.881 17856 2637 1 8 . 1 1 77 77 LYS C C 77 176.734 176.734 179.112 -2.378 17856 2638 1 8 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.227 -0.837 17856 2639 1 8 . 1 1 77 77 LYS H H 77 8.170 8.170 7.478 0.692 17856 2640 1 8 . 1 1 78 78 ILE N N 78 121.521 121.521 119.908 1.613 17856 2641 1 8 . 1 1 78 78 ILE C C 78 176.512 176.512 178.030 -1.518 17856 2642 1 8 . 1 1 78 78 ILE H H 78 8.160 8.160 7.943 0.217 17856 2643 1 8 . 1 1 79 79 GLU N N 79 123.840 123.840 120.646 3.194 17856 2644 1 8 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.824 -4.346 17856 2645 1 8 . 1 1 79 79 GLU H H 79 8.360 8.360 8.406 -0.046 17856 2646 1 8 . 1 1 80 80 LYS N N 80 122.143 122.143 119.866 2.277 17856 2647 1 8 . 1 1 80 80 LYS C C 80 176.937 176.937 179.088 -2.151 17856 2648 1 8 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.270 -2.770 17856 2649 1 8 . 1 1 80 80 LYS H H 80 8.231 8.231 7.723 0.508 17856 2650 1 8 . 1 1 81 81 LEU N N 81 122.095 122.095 121.283 0.812 17856 2651 1 8 . 1 1 81 81 LEU C C 81 177.531 177.531 178.680 -1.149 17856 2652 1 8 . 1 1 81 81 LEU H H 81 8.050 8.050 7.580 0.470 17856 2653 1 8 . 1 1 82 82 ILE N N 82 120.609 120.609 117.824 2.785 17856 2654 1 8 . 1 1 82 82 ILE CA C 82 61.360 61.360 64.889 -3.529 17856 2655 1 8 . 1 1 82 82 ILE H H 82 8.000 8.000 7.139 0.861 17856 2656 1 8 . 1 1 83 83 GLU N N 83 124.611 124.611 120.129 4.482 17856 2657 1 8 . 1 1 83 83 GLU C C 83 177.298 177.298 178.185 -0.887 17856 2658 1 8 . 1 1 83 83 GLU H H 83 8.380 8.380 8.018 0.362 17856 2659 1 8 . 1 1 84 84 THR N N 84 115.107 115.107 113.958 1.149 17856 2660 1 8 . 1 1 84 84 THR C C 84 174.400 174.400 175.287 -0.887 17856 2661 1 8 . 1 1 84 84 THR CA C 84 62.659 62.659 64.929 -2.270 17856 2662 1 8 . 1 1 84 84 THR H H 84 8.064 8.064 7.895 0.169 17856 2663 1 8 . 1 1 85 85 LEU N N 85 124.150 124.150 120.071 4.079 17856 2664 1 8 . 1 1 85 85 LEU C C 85 177.120 177.120 177.007 0.113 17856 2665 1 8 . 1 1 85 85 LEU CA C 85 55.020 55.020 55.393 -0.373 17856 2666 1 8 . 1 1 85 85 LEU H H 85 8.238 8.238 7.178 1.060 17856 2667 1 8 . 1 1 86 86 SER N N 86 114.913 114.913 114.973 -0.060 17856 2668 1 8 . 1 1 86 86 SER H H 86 7.678 7.678 7.461 0.217 17856 2669 1 8 . 1 1 87 87 PRO CA C 87 63.550 63.550 63.880 -0.330 17856 2670 1 8 . 1 1 88 88 ALA N N 88 123.767 123.767 120.174 3.593 17856 2671 1 8 . 1 1 88 88 ALA C C 88 178.131 178.131 176.988 1.143 17856 2672 1 8 . 1 1 88 88 ALA CA C 88 52.878 52.878 52.944 -0.066 17856 2673 1 8 . 1 1 88 88 ALA H H 88 8.342 8.342 7.907 0.435 17856 2674 1 8 . 1 1 89 89 ARG N N 89 119.159 119.159 119.349 -0.190 17856 2675 1 8 . 1 1 89 89 ARG C C 89 176.620 176.620 175.644 0.976 17856 2676 1 8 . 1 1 89 89 ARG H H 89 8.133 8.133 8.330 -0.197 17856 2677 1 8 . 1 1 90 90 SER N N 90 116.910 116.910 117.565 -0.655 17856 2678 1 8 . 1 1 90 90 SER C C 90 174.887 174.887 174.124 0.763 17856 2679 1 8 . 1 1 90 90 SER H H 90 8.322 8.322 8.395 -0.073 17856 2680 1 8 . 1 1 91 91 LYS N N 91 123.457 123.457 126.277 -2.820 17856 2681 1 8 . 1 1 91 91 LYS C C 91 176.970 176.970 175.582 1.388 17856 2682 1 8 . 1 1 91 91 LYS H H 91 8.396 8.396 8.361 0.035 17856 2683 1 8 . 1 1 92 92 SER N N 92 116.692 116.692 117.135 -0.443 17856 2684 1 8 . 1 1 92 92 SER C C 92 174.573 174.573 174.700 -0.127 17856 2685 1 8 . 1 1 92 92 SER CA C 92 58.600 58.600 57.537 1.063 17856 2686 1 8 . 1 1 92 92 SER H H 92 8.297 8.297 8.367 -0.070 17856 2687 1 8 . 1 1 93 93 GLN N N 93 121.916 121.916 123.231 -1.315 17856 2688 1 8 . 1 1 93 93 GLN C C 93 175.971 175.971 175.475 0.496 17856 2689 1 8 . 1 1 93 93 GLN H H 93 8.325 8.325 8.690 -0.365 17856 2690 1 8 . 1 1 94 94 SER N N 94 117.385 117.385 116.028 1.357 17856 2691 1 8 . 1 1 94 94 SER C C 94 173.940 173.940 174.118 -0.178 17856 2692 1 8 . 1 1 94 94 SER CA C 94 58.520 58.520 59.840 -1.321 17856 2693 1 8 . 1 1 94 94 SER H H 94 8.352 8.352 8.422 -0.070 17856 2694 1 8 . 1 1 95 95 THR N N 95 120.756 120.756 115.867 4.889 17856 2695 1 8 . 1 1 95 95 THR H H 95 7.805 7.805 8.088 -0.283 17856 2696 1 8 . 1 1 99 99 ARG C C 99 176.250 176.250 175.240 1.010 17856 2697 1 8 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.284 -0.127 17856 2698 1 8 . 1 1 100 100 ASN N N 100 118.482 118.482 120.841 -2.359 17856 2699 1 8 . 1 1 100 100 ASN H H 100 8.272 8.272 8.681 -0.409 17856 2700 1 8 . 1 1 101 101 ARG C C 101 176.280 176.280 174.827 1.453 17856 2701 1 8 . 1 1 102 102 ASN N N 102 118.688 118.688 123.056 -4.368 17856 2702 1 8 . 1 1 102 102 ASN C C 102 174.996 174.996 175.327 -0.331 17856 2703 1 8 . 1 1 102 102 ASN CA C 102 53.609 53.609 53.679 -0.070 17856 2704 1 8 . 1 1 102 102 ASN H H 102 8.424 8.424 8.782 -0.358 17856 2705 1 8 . 1 1 103 103 ASN N N 103 118.865 118.865 117.705 1.160 17856 2706 1 8 . 1 1 103 103 ASN C C 103 175.040 175.040 174.039 1.001 17856 2707 1 8 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.791 0.021 17856 2708 1 8 . 1 1 103 103 ASN H H 103 8.282 8.282 8.662 -0.380 17856 2709 1 8 . 1 1 104 104 ARG N N 104 120.875 120.875 115.127 5.748 17856 2710 1 8 . 1 1 104 104 ARG H H 104 8.140 8.140 8.002 0.138 17856 2711 1 8 . 1 1 106 106 ILE C C 106 175.408 175.408 175.971 -0.563 17856 2712 1 8 . 1 1 106 106 ILE CA C 106 61.395 61.395 62.027 -0.632 17856 2713 1 9 . 1 1 2 2 SER N N 2 116.304 116.304 118.138 -1.834 17856 2714 1 9 . 1 1 2 2 SER C C 2 174.710 174.710 176.606 -1.896 17856 2715 1 9 . 1 1 2 2 SER CA C 2 58.908 58.908 60.556 -1.648 17856 2716 1 9 . 1 1 2 2 SER H H 2 8.003 8.003 8.306 -0.303 17856 2717 1 9 . 1 1 3 3 ILE N N 3 122.062 122.062 122.114 -0.052 17856 2718 1 9 . 1 1 3 3 ILE C C 3 176.750 176.750 176.974 -0.224 17856 2719 1 9 . 1 1 3 3 ILE CA C 3 61.786 61.786 62.473 -0.687 17856 2720 1 9 . 1 1 3 3 ILE H H 3 7.957 7.957 8.133 -0.176 17856 2721 1 9 . 1 1 4 4 VAL N N 4 122.674 122.674 121.596 1.078 17856 2722 1 9 . 1 1 4 4 VAL C C 4 176.221 176.221 176.831 -0.610 17856 2723 1 9 . 1 1 4 4 VAL CA C 4 62.970 62.970 65.353 -2.383 17856 2724 1 9 . 1 1 4 4 VAL H H 4 7.970 7.970 8.229 -0.259 17856 2725 1 9 . 1 1 5 5 SER N N 5 117.750 117.750 114.027 3.723 17856 2726 1 9 . 1 1 5 5 SER C C 5 174.858 174.858 176.028 -1.170 17856 2727 1 9 . 1 1 5 5 SER CA C 5 58.630 58.630 61.372 -2.742 17856 2728 1 9 . 1 1 5 5 SER H H 5 8.093 8.093 7.930 0.163 17856 2729 1 9 . 1 1 6 6 GLN N N 6 121.961 121.961 122.895 -0.934 17856 2730 1 9 . 1 1 6 6 GLN C C 6 176.467 176.467 178.354 -1.887 17856 2731 1 9 . 1 1 6 6 GLN CA C 6 56.226 56.226 58.355 -2.129 17856 2732 1 9 . 1 1 6 6 GLN H H 6 8.371 8.371 7.547 0.824 17856 2733 1 9 . 1 1 7 7 THR N N 7 115.325 115.325 115.179 0.146 17856 2734 1 9 . 1 1 7 7 THR C C 7 174.752 174.752 174.040 0.712 17856 2735 1 9 . 1 1 7 7 THR H H 7 8.152 8.152 7.987 0.165 17856 2736 1 9 . 1 1 8 8 ARG N N 8 122.530 122.530 121.142 1.388 17856 2737 1 9 . 1 1 8 8 ARG C C 8 176.200 176.200 176.255 -0.055 17856 2738 1 9 . 1 1 8 8 ARG CA C 8 56.570 56.570 57.441 -0.871 17856 2739 1 9 . 1 1 8 8 ARG H H 8 8.211 8.211 8.168 0.043 17856 2740 1 9 . 1 1 9 9 ASN N N 9 119.600 119.600 119.509 0.091 17856 2741 1 9 . 1 1 9 9 ASN C C 9 177.164 177.164 176.570 0.594 17856 2742 1 9 . 1 1 9 9 ASN H H 9 8.398 8.398 7.885 0.513 17856 2743 1 9 . 1 1 10 10 LYS N N 10 121.600 121.600 120.141 1.459 17856 2744 1 9 . 1 1 10 10 LYS C C 10 176.845 176.845 178.770 -1.925 17856 2745 1 9 . 1 1 10 10 LYS CA C 10 57.110 57.110 58.737 -1.627 17856 2746 1 9 . 1 1 10 10 LYS H H 10 8.190 8.190 7.506 0.684 17856 2747 1 9 . 1 1 11 11 GLU N N 11 120.700 120.700 119.493 1.207 17856 2748 1 9 . 1 1 11 11 GLU C C 11 176.825 176.825 178.336 -1.511 17856 2749 1 9 . 1 1 11 11 GLU CA C 11 56.690 56.690 58.869 -2.179 17856 2750 1 9 . 1 1 11 11 GLU H H 11 8.323 8.323 7.911 0.412 17856 2751 1 9 . 1 1 12 12 LEU N N 12 122.390 122.390 121.944 0.446 17856 2752 1 9 . 1 1 12 12 LEU C C 12 177.670 177.670 178.802 -1.132 17856 2753 1 9 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.350 -2.880 17856 2754 1 9 . 1 1 12 12 LEU H H 12 8.155 8.155 7.955 0.200 17856 2755 1 9 . 1 1 13 13 LEU N N 13 122.570 122.570 115.794 6.776 17856 2756 1 9 . 1 1 13 13 LEU C C 13 177.510 177.510 178.634 -1.124 17856 2757 1 9 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.529 -2.948 17856 2758 1 9 . 1 1 13 13 LEU H H 13 8.220 8.220 7.693 0.527 17856 2759 1 9 . 1 1 14 14 ASP N N 14 120.780 120.780 120.640 0.140 17856 2760 1 9 . 1 1 14 14 ASP C C 14 176.480 176.480 178.722 -2.242 17856 2761 1 9 . 1 1 14 14 ASP CA C 14 54.650 54.650 57.891 -3.241 17856 2762 1 9 . 1 1 14 14 ASP H H 14 8.243 8.243 7.687 0.556 17856 2763 1 9 . 1 1 15 15 LYS N N 15 120.900 120.900 119.051 1.849 17856 2764 1 9 . 1 1 15 15 LYS C C 15 175.580 175.580 179.108 -3.528 17856 2765 1 9 . 1 1 15 15 LYS H H 15 8.052 8.052 8.072 -0.019 17856 2766 1 9 . 1 1 16 16 LYS N N 16 121.980 121.980 119.880 2.100 17856 2767 1 9 . 1 1 16 16 LYS C C 16 176.887 176.887 178.926 -2.039 17856 2768 1 9 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.386 -2.051 17856 2769 1 9 . 1 1 16 16 LYS H H 16 8.243 8.243 7.795 0.448 17856 2770 1 9 . 1 1 17 17 ILE N N 17 121.940 121.940 118.781 3.159 17856 2771 1 9 . 1 1 17 17 ILE H H 17 8.110 8.110 8.392 -0.282 17856 2772 1 9 . 1 1 18 18 ARG C C 18 176.520 176.520 178.471 -1.951 17856 2773 1 9 . 1 1 19 19 SER N N 19 117.150 117.150 115.144 2.006 17856 2774 1 9 . 1 1 19 19 SER C C 19 175.167 175.167 176.400 -1.233 17856 2775 1 9 . 1 1 19 19 SER CA C 19 58.840 58.840 61.149 -2.309 17856 2776 1 9 . 1 1 19 19 SER H H 19 8.396 8.396 7.758 0.638 17856 2777 1 9 . 1 1 20 20 GLU N N 20 123.176 123.176 121.846 1.330 17856 2778 1 9 . 1 1 20 20 GLU C C 20 176.921 176.921 178.946 -2.025 17856 2779 1 9 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.267 -2.408 17856 2780 1 9 . 1 1 20 20 GLU H H 20 8.478 8.478 7.491 0.987 17856 2781 1 9 . 1 1 21 21 ILE N N 21 120.550 120.550 115.369 5.181 17856 2782 1 9 . 1 1 21 21 ILE C C 21 176.550 176.550 178.030 -1.480 17856 2783 1 9 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.612 -2.982 17856 2784 1 9 . 1 1 21 21 ILE H H 21 8.080 8.080 7.459 0.621 17856 2785 1 9 . 1 1 22 22 GLU N N 22 123.685 123.685 120.717 2.968 17856 2786 1 9 . 1 1 22 22 GLU C C 22 176.109 176.109 178.214 -2.105 17856 2787 1 9 . 1 1 22 22 GLU H H 22 8.309 8.309 7.753 0.556 17856 2788 1 9 . 1 1 23 23 ALA N N 23 124.280 124.280 121.590 2.690 17856 2789 1 9 . 1 1 23 23 ALA C C 23 178.474 178.474 179.420 -0.946 17856 2790 1 9 . 1 1 23 23 ALA CA C 23 53.406 53.406 54.767 -1.361 17856 2791 1 9 . 1 1 23 23 ALA H H 23 8.088 8.088 7.624 0.464 17856 2792 1 9 . 1 1 24 24 ILE N N 24 120.330 120.330 119.115 1.215 17856 2793 1 9 . 1 1 24 24 ILE C C 24 176.309 176.309 177.794 -1.485 17856 2794 1 9 . 1 1 24 24 ILE CA C 24 61.540 61.540 65.140 -3.600 17856 2795 1 9 . 1 1 24 24 ILE H H 24 7.980 7.980 7.932 0.048 17856 2796 1 9 . 1 1 25 25 LYS N N 25 124.310 124.310 119.524 4.786 17856 2797 1 9 . 1 1 25 25 LYS C C 25 176.365 176.365 178.252 -1.887 17856 2798 1 9 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.170 -2.836 17856 2799 1 9 . 1 1 25 25 LYS H H 25 8.198 8.198 8.105 0.093 17856 2800 1 9 . 1 1 26 26 LYS N N 26 122.518 122.518 118.410 4.108 17856 2801 1 9 . 1 1 26 26 LYS C C 26 176.365 176.365 178.338 -1.973 17856 2802 1 9 . 1 1 26 26 LYS CA C 26 56.175 56.175 57.561 -1.386 17856 2803 1 9 . 1 1 26 26 LYS H H 26 8.125 8.125 7.442 0.683 17856 2804 1 9 . 1 1 27 27 ILE N N 27 122.670 122.670 120.717 1.953 17856 2805 1 9 . 1 1 27 27 ILE C C 27 176.261 176.261 177.999 -1.738 17856 2806 1 9 . 1 1 27 27 ILE CA C 27 61.294 61.294 65.232 -3.938 17856 2807 1 9 . 1 1 27 27 ILE H H 27 8.114 8.114 7.814 0.300 17856 2808 1 9 . 1 1 28 28 ILE N N 28 125.178 125.178 118.834 6.344 17856 2809 1 9 . 1 1 28 28 ILE C C 28 175.803 175.803 176.449 -0.646 17856 2810 1 9 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.128 -2.048 17856 2811 1 9 . 1 1 28 28 ILE H H 28 8.220 8.220 8.103 0.117 17856 2812 1 9 . 1 1 29 29 ALA N N 29 127.850 127.850 121.391 6.459 17856 2813 1 9 . 1 1 29 29 ALA C C 29 177.627 177.627 179.491 -1.864 17856 2814 1 9 . 1 1 29 29 ALA CA C 29 53.684 53.684 54.572 -0.888 17856 2815 1 9 . 1 1 29 29 ALA H H 29 8.300 8.300 7.351 0.950 17856 2816 1 9 . 1 1 30 30 GLU N N 30 120.000 120.000 119.498 0.502 17856 2817 1 9 . 1 1 30 30 GLU C C 30 176.321 176.321 178.760 -2.439 17856 2818 1 9 . 1 1 30 30 GLU H H 30 8.258 8.258 7.782 0.476 17856 2819 1 9 . 1 1 31 31 PHE N N 31 119.128 119.128 117.743 1.385 17856 2820 1 9 . 1 1 31 31 PHE C C 31 175.180 175.180 177.980 -2.800 17856 2821 1 9 . 1 1 31 31 PHE CA C 31 57.540 57.540 60.589 -3.049 17856 2822 1 9 . 1 1 31 31 PHE H H 31 8.061 8.061 7.390 0.671 17856 2823 1 9 . 1 1 32 32 ASP N N 32 121.800 121.800 119.897 1.903 17856 2824 1 9 . 1 1 32 32 ASP C C 32 175.894 175.894 177.910 -2.016 17856 2825 1 9 . 1 1 32 32 ASP CA C 32 54.529 54.529 57.080 -2.551 17856 2826 1 9 . 1 1 32 32 ASP H H 32 8.275 8.275 7.715 0.560 17856 2827 1 9 . 1 1 33 33 VAL N N 33 119.648 119.648 118.146 1.502 17856 2828 1 9 . 1 1 33 33 VAL C C 33 176.268 176.268 177.732 -1.464 17856 2829 1 9 . 1 1 33 33 VAL CA C 33 62.500 62.500 66.088 -3.588 17856 2830 1 9 . 1 1 33 33 VAL H H 33 8.059 8.059 7.489 0.570 17856 2831 1 9 . 1 1 34 34 VAL N N 34 123.882 123.882 119.289 4.593 17856 2832 1 9 . 1 1 34 34 VAL H H 34 7.774 7.774 7.943 -0.169 17856 2833 1 9 . 1 1 35 35 LYS N N 35 125.250 125.250 118.119 7.131 17856 2834 1 9 . 1 1 35 35 LYS C C 35 176.719 176.719 176.572 0.147 17856 2835 1 9 . 1 1 35 35 LYS CA C 35 56.502 56.502 56.883 -0.381 17856 2836 1 9 . 1 1 35 35 LYS H H 35 8.357 8.357 7.956 0.401 17856 2837 1 9 . 1 1 36 36 GLU N N 36 121.850 121.850 120.150 1.700 17856 2838 1 9 . 1 1 36 36 GLU C C 36 176.426 176.426 178.123 -1.697 17856 2839 1 9 . 1 1 36 36 GLU H H 36 8.423 8.423 7.798 0.625 17856 2840 1 9 . 1 1 37 37 SER N N 37 117.100 117.100 115.827 1.273 17856 2841 1 9 . 1 1 37 37 SER C C 37 174.854 174.854 176.643 -1.789 17856 2842 1 9 . 1 1 37 37 SER CA C 37 58.850 58.850 61.529 -2.679 17856 2843 1 9 . 1 1 37 37 SER H H 37 8.362 8.362 8.430 -0.068 17856 2844 1 9 . 1 1 38 38 VAL N N 38 121.625 121.625 114.376 7.249 17856 2845 1 9 . 1 1 38 38 VAL C C 38 176.246 176.246 176.014 0.232 17856 2846 1 9 . 1 1 38 38 VAL CA C 38 63.043 63.043 62.618 0.425 17856 2847 1 9 . 1 1 38 38 VAL H H 38 8.225 8.225 7.743 0.482 17856 2848 1 9 . 1 1 39 39 ASN N N 39 121.150 121.150 118.760 2.390 17856 2849 1 9 . 1 1 39 39 ASN C C 39 175.459 175.459 176.220 -0.761 17856 2850 1 9 . 1 1 39 39 ASN CA C 39 53.568 53.568 56.007 -2.439 17856 2851 1 9 . 1 1 39 39 ASN H H 39 8.366 8.366 7.908 0.458 17856 2852 1 9 . 1 1 40 40 GLU N N 40 121.500 121.500 119.118 2.382 17856 2853 1 9 . 1 1 40 40 GLU C C 40 175.459 175.459 177.583 -2.124 17856 2854 1 9 . 1 1 40 40 GLU CA C 40 56.860 56.860 56.167 0.693 17856 2855 1 9 . 1 1 40 40 GLU H H 40 8.370 8.370 7.774 0.596 17856 2856 1 9 . 1 1 41 41 LEU N N 41 121.950 121.950 120.199 1.751 17856 2857 1 9 . 1 1 41 41 LEU C C 41 177.939 177.939 177.135 0.804 17856 2858 1 9 . 1 1 41 41 LEU CA C 41 56.040 56.040 55.087 0.954 17856 2859 1 9 . 1 1 41 41 LEU H H 41 8.152 8.152 8.107 0.045 17856 2860 1 9 . 1 1 42 42 SER N N 42 113.326 113.326 116.339 -3.013 17856 2861 1 9 . 1 1 42 42 SER C C 42 174.660 174.660 176.885 -2.225 17856 2862 1 9 . 1 1 42 42 SER CA C 42 58.940 58.940 62.298 -3.358 17856 2863 1 9 . 1 1 42 42 SER H H 42 8.373 8.373 7.879 0.494 17856 2864 1 9 . 1 1 43 43 GLU N N 43 121.521 121.521 121.788 -0.267 17856 2865 1 9 . 1 1 43 43 GLU C C 43 177.349 177.349 178.309 -0.960 17856 2866 1 9 . 1 1 43 43 GLU H H 43 7.329 7.329 8.612 -1.283 17856 2867 1 9 . 1 1 44 44 LYS N N 44 121.240 121.240 119.831 1.409 17856 2868 1 9 . 1 1 44 44 LYS C C 44 177.246 177.246 178.476 -1.230 17856 2869 1 9 . 1 1 44 44 LYS CA C 44 56.397 56.397 58.227 -1.830 17856 2870 1 9 . 1 1 44 44 LYS H H 44 8.103 8.103 7.673 0.430 17856 2871 1 9 . 1 1 45 45 ALA N N 45 119.568 119.568 122.502 -2.934 17856 2872 1 9 . 1 1 45 45 ALA C C 45 177.853 177.853 178.892 -1.039 17856 2873 1 9 . 1 1 45 45 ALA CA C 45 52.560 52.560 55.044 -2.484 17856 2874 1 9 . 1 1 45 45 ALA H H 45 8.541 8.541 7.601 0.940 17856 2875 1 9 . 1 1 46 46 LYS N N 46 115.235 115.235 117.223 -1.988 17856 2876 1 9 . 1 1 46 46 LYS C C 46 177.110 177.110 178.450 -1.340 17856 2877 1 9 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.796 -2.000 17856 2878 1 9 . 1 1 46 46 LYS H H 46 7.257 7.257 8.204 -0.947 17856 2879 1 9 . 1 1 47 47 THR N N 47 103.239 103.239 109.449 -6.210 17856 2880 1 9 . 1 1 47 47 THR C C 47 173.973 173.973 174.978 -1.005 17856 2881 1 9 . 1 1 47 47 THR CA C 47 62.740 62.740 62.672 0.068 17856 2882 1 9 . 1 1 47 47 THR H H 47 7.381 7.381 7.711 -0.330 17856 2883 1 9 . 1 1 48 48 ASP N N 48 122.976 122.976 122.321 0.655 17856 2884 1 9 . 1 1 48 48 ASP H H 48 8.031 8.031 7.952 0.079 17856 2885 1 9 . 1 1 49 49 PRO C C 49 178.106 178.106 178.358 -0.252 17856 2886 1 9 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.961 -0.742 17856 2887 1 9 . 1 1 50 50 GLN N N 50 118.351 118.351 118.266 0.085 17856 2888 1 9 . 1 1 50 50 GLN C C 50 176.944 176.944 178.045 -1.101 17856 2889 1 9 . 1 1 50 50 GLN CA C 50 56.800 56.800 57.980 -1.180 17856 2890 1 9 . 1 1 50 50 GLN H H 50 8.304 8.304 8.284 0.020 17856 2891 1 9 . 1 1 51 51 ALA N N 51 124.206 124.206 121.870 2.336 17856 2892 1 9 . 1 1 51 51 ALA C C 51 178.490 178.490 179.292 -0.802 17856 2893 1 9 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.927 -1.503 17856 2894 1 9 . 1 1 51 51 ALA H H 51 7.547 7.547 7.829 -0.282 17856 2895 1 9 . 1 1 52 52 ALA N N 52 118.686 118.686 120.313 -1.627 17856 2896 1 9 . 1 1 52 52 ALA C C 52 177.953 177.953 179.551 -1.598 17856 2897 1 9 . 1 1 52 52 ALA H H 52 7.931 7.931 7.741 0.190 17856 2898 1 9 . 1 1 53 53 GLU N N 53 120.075 120.075 118.715 1.360 17856 2899 1 9 . 1 1 53 53 GLU H H 53 7.729 7.729 7.704 0.025 17856 2900 1 9 . 1 1 55 55 LEU N N 55 123.640 123.640 119.718 3.922 17856 2901 1 9 . 1 1 55 55 LEU C C 55 177.587 177.587 179.184 -1.597 17856 2902 1 9 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.366 -1.579 17856 2903 1 9 . 1 1 55 55 LEU H H 55 8.215 8.215 8.218 -0.003 17856 2904 1 9 . 1 1 56 56 ASN N N 56 118.520 118.520 117.376 1.144 17856 2905 1 9 . 1 1 56 56 ASN C C 56 175.700 175.700 176.278 -0.578 17856 2906 1 9 . 1 1 56 56 ASN CA C 56 54.132 54.132 56.030 -1.898 17856 2907 1 9 . 1 1 56 56 ASN H H 56 8.250 8.250 8.014 0.236 17856 2908 1 9 . 1 1 57 57 LYS N N 57 120.960 120.960 115.906 5.054 17856 2909 1 9 . 1 1 57 57 LYS C C 57 176.637 176.637 176.365 0.272 17856 2910 1 9 . 1 1 57 57 LYS H H 57 8.065 8.065 7.346 0.719 17856 2911 1 9 . 1 1 58 58 LEU N N 58 122.610 122.610 121.778 0.832 17856 2912 1 9 . 1 1 58 58 LEU C C 58 177.433 177.433 176.071 1.362 17856 2913 1 9 . 1 1 58 58 LEU CA C 58 55.120 55.120 54.165 0.955 17856 2914 1 9 . 1 1 58 58 LEU H H 58 8.135 8.135 7.347 0.788 17856 2915 1 9 . 1 1 59 59 ILE N N 59 122.045 122.045 118.015 4.030 17856 2916 1 9 . 1 1 59 59 ILE CA C 59 61.535 61.535 59.619 1.916 17856 2917 1 9 . 1 1 59 59 ILE H H 59 8.220 8.220 7.649 0.571 17856 2918 1 9 . 1 1 60 60 GLU N N 60 124.000 124.000 119.791 4.209 17856 2919 1 9 . 1 1 60 60 GLU C C 60 177.007 177.007 176.805 0.202 17856 2920 1 9 . 1 1 60 60 GLU CA C 60 56.722 56.722 57.239 -0.517 17856 2921 1 9 . 1 1 60 60 GLU H H 60 8.340 8.340 7.548 0.792 17856 2922 1 9 . 1 1 61 61 GLY N N 61 110.520 110.520 110.223 0.297 17856 2923 1 9 . 1 1 61 61 GLY C C 61 174.002 174.002 175.428 -1.426 17856 2924 1 9 . 1 1 61 61 GLY CA C 61 45.405 45.405 44.931 0.473 17856 2925 1 9 . 1 1 61 61 GLY H H 61 8.557 8.557 8.875 -0.318 17856 2926 1 9 . 1 1 62 62 TYR N N 62 119.600 119.600 119.271 0.329 17856 2927 1 9 . 1 1 62 62 TYR C C 62 175.940 175.940 176.022 -0.082 17856 2928 1 9 . 1 1 62 62 TYR CA C 62 58.108 58.108 55.399 2.709 17856 2929 1 9 . 1 1 62 62 TYR H H 62 7.980 7.980 8.502 -0.522 17856 2930 1 9 . 1 1 63 63 THR N N 63 116.304 116.304 112.547 3.757 17856 2931 1 9 . 1 1 63 63 THR C C 63 173.796 173.796 174.549 -0.753 17856 2932 1 9 . 1 1 63 63 THR H H 63 8.049 8.049 8.028 0.021 17856 2933 1 9 . 1 1 64 64 TYR N N 64 122.050 122.050 122.086 -0.036 17856 2934 1 9 . 1 1 64 64 TYR C C 64 176.290 176.290 177.008 -0.718 17856 2935 1 9 . 1 1 64 64 TYR CA C 64 58.533 58.533 57.719 0.814 17856 2936 1 9 . 1 1 64 64 TYR H H 64 8.133 8.133 7.942 0.191 17856 2937 1 9 . 1 1 65 65 GLY N N 65 110.456 110.456 109.696 0.760 17856 2938 1 9 . 1 1 65 65 GLY C C 65 174.340 174.340 174.257 0.083 17856 2939 1 9 . 1 1 65 65 GLY CA C 65 45.328 45.328 44.568 0.760 17856 2940 1 9 . 1 1 65 65 GLY H H 65 7.747 7.747 8.393 -0.646 17856 2941 1 9 . 1 1 66 66 GLU N N 66 120.783 120.783 122.011 -1.228 17856 2942 1 9 . 1 1 66 66 GLU C C 66 176.895 176.895 176.831 0.064 17856 2943 1 9 . 1 1 66 66 GLU CA C 66 56.804 56.804 56.482 0.322 17856 2944 1 9 . 1 1 66 66 GLU H H 66 8.243 8.243 8.744 -0.501 17856 2945 1 9 . 1 1 67 67 GLU N N 67 121.587 121.587 121.593 -0.006 17856 2946 1 9 . 1 1 67 67 GLU C C 67 176.340 176.340 177.362 -1.022 17856 2947 1 9 . 1 1 67 67 GLU H H 67 8.611 8.611 8.162 0.449 17856 2948 1 9 . 1 1 68 68 ARG N N 68 121.790 121.790 117.256 4.534 17856 2949 1 9 . 1 1 68 68 ARG C C 68 176.350 176.350 177.141 -0.791 17856 2950 1 9 . 1 1 68 68 ARG H H 68 8.267 8.267 8.335 -0.068 17856 2951 1 9 . 1 1 69 69 LYS N N 69 118.431 118.431 118.535 -0.104 17856 2952 1 9 . 1 1 69 69 LYS H H 69 7.567 7.567 7.575 -0.008 17856 2953 1 9 . 1 1 70 70 LEU C C 70 177.338 177.338 178.946 -1.608 17856 2954 1 9 . 1 1 70 70 LEU CA C 70 55.533 55.533 57.289 -1.756 17856 2955 1 9 . 1 1 71 71 TYR N N 71 119.504 119.504 116.188 3.316 17856 2956 1 9 . 1 1 71 71 TYR H H 71 7.997 7.997 7.547 0.450 17856 2957 1 9 . 1 1 72 72 ASP C C 72 176.528 176.528 178.159 -1.631 17856 2958 1 9 . 1 1 72 72 ASP CA C 72 54.693 54.693 56.823 -2.130 17856 2959 1 9 . 1 1 73 73 SER N N 73 117.000 117.000 115.270 1.730 17856 2960 1 9 . 1 1 73 73 SER C C 73 174.950 174.950 175.878 -0.928 17856 2961 1 9 . 1 1 73 73 SER CA C 73 58.997 58.997 60.698 -1.701 17856 2962 1 9 . 1 1 73 73 SER H H 73 8.282 8.282 7.648 0.634 17856 2963 1 9 . 1 1 74 74 ALA N N 74 125.422 125.422 125.232 0.190 17856 2964 1 9 . 1 1 74 74 ALA C C 74 178.389 178.389 179.233 -0.844 17856 2965 1 9 . 1 1 74 74 ALA CA C 74 53.433 53.433 55.152 -1.719 17856 2966 1 9 . 1 1 74 74 ALA H H 74 8.339 8.339 7.581 0.758 17856 2967 1 9 . 1 1 75 75 LEU N N 75 120.019 120.019 117.756 2.263 17856 2968 1 9 . 1 1 75 75 LEU C C 75 177.954 177.954 179.319 -1.365 17856 2969 1 9 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.358 -1.578 17856 2970 1 9 . 1 1 75 75 LEU H H 75 7.948 7.948 7.844 0.104 17856 2971 1 9 . 1 1 76 76 SER N N 76 113.321 113.321 114.607 -1.286 17856 2972 1 9 . 1 1 76 76 SER C C 76 174.784 174.784 176.670 -1.886 17856 2973 1 9 . 1 1 76 76 SER CA C 76 59.173 59.173 61.374 -2.201 17856 2974 1 9 . 1 1 76 76 SER H H 76 7.951 7.951 7.793 0.158 17856 2975 1 9 . 1 1 77 77 LYS N N 77 122.710 122.710 122.246 0.464 17856 2976 1 9 . 1 1 77 77 LYS C C 77 176.734 176.734 179.073 -2.339 17856 2977 1 9 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.283 -0.893 17856 2978 1 9 . 1 1 77 77 LYS H H 77 8.170 8.170 7.638 0.532 17856 2979 1 9 . 1 1 78 78 ILE N N 78 121.521 121.521 118.744 2.777 17856 2980 1 9 . 1 1 78 78 ILE C C 78 176.512 176.512 177.791 -1.279 17856 2981 1 9 . 1 1 78 78 ILE H H 78 8.160 8.160 7.801 0.359 17856 2982 1 9 . 1 1 79 79 GLU N N 79 123.840 123.840 120.699 3.141 17856 2983 1 9 . 1 1 79 79 GLU CA C 79 55.478 55.478 60.021 -4.543 17856 2984 1 9 . 1 1 79 79 GLU H H 79 8.360 8.360 7.744 0.616 17856 2985 1 9 . 1 1 80 80 LYS N N 80 122.143 122.143 118.798 3.345 17856 2986 1 9 . 1 1 80 80 LYS C C 80 176.937 176.937 178.781 -1.844 17856 2987 1 9 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.210 -2.710 17856 2988 1 9 . 1 1 80 80 LYS H H 80 8.231 8.231 7.380 0.851 17856 2989 1 9 . 1 1 81 81 LEU N N 81 122.095 122.095 121.696 0.399 17856 2990 1 9 . 1 1 81 81 LEU C C 81 177.531 177.531 178.587 -1.056 17856 2991 1 9 . 1 1 81 81 LEU H H 81 8.050 8.050 7.321 0.729 17856 2992 1 9 . 1 1 82 82 ILE N N 82 120.609 120.609 117.768 2.841 17856 2993 1 9 . 1 1 82 82 ILE CA C 82 61.360 61.360 64.649 -3.289 17856 2994 1 9 . 1 1 82 82 ILE H H 82 8.000 8.000 7.395 0.605 17856 2995 1 9 . 1 1 83 83 GLU N N 83 124.611 124.611 119.931 4.680 17856 2996 1 9 . 1 1 83 83 GLU C C 83 177.298 177.298 178.753 -1.455 17856 2997 1 9 . 1 1 83 83 GLU H H 83 8.380 8.380 7.863 0.517 17856 2998 1 9 . 1 1 84 84 THR N N 84 115.107 115.107 115.173 -0.066 17856 2999 1 9 . 1 1 84 84 THR C C 84 174.400 174.400 175.033 -0.633 17856 3000 1 9 . 1 1 84 84 THR CA C 84 62.659 62.659 65.271 -2.612 17856 3001 1 9 . 1 1 84 84 THR H H 84 8.064 8.064 7.745 0.319 17856 3002 1 9 . 1 1 85 85 LEU N N 85 124.150 124.150 121.258 2.892 17856 3003 1 9 . 1 1 85 85 LEU C C 85 177.120 177.120 176.169 0.951 17856 3004 1 9 . 1 1 85 85 LEU CA C 85 55.020 55.020 54.427 0.593 17856 3005 1 9 . 1 1 85 85 LEU H H 85 8.238 8.238 7.169 1.069 17856 3006 1 9 . 1 1 86 86 SER N N 86 114.913 114.913 115.374 -0.461 17856 3007 1 9 . 1 1 86 86 SER H H 86 7.678 7.678 7.486 0.192 17856 3008 1 9 . 1 1 87 87 PRO CA C 87 63.550 63.550 63.989 -0.439 17856 3009 1 9 . 1 1 88 88 ALA N N 88 123.767 123.767 119.918 3.849 17856 3010 1 9 . 1 1 88 88 ALA C C 88 178.131 178.131 176.924 1.207 17856 3011 1 9 . 1 1 88 88 ALA CA C 88 52.878 52.878 53.720 -0.842 17856 3012 1 9 . 1 1 88 88 ALA H H 88 8.342 8.342 8.227 0.115 17856 3013 1 9 . 1 1 89 89 ARG N N 89 119.159 119.159 122.321 -3.162 17856 3014 1 9 . 1 1 89 89 ARG C C 89 176.620 176.620 175.107 1.513 17856 3015 1 9 . 1 1 89 89 ARG H H 89 8.133 8.133 8.266 -0.133 17856 3016 1 9 . 1 1 90 90 SER N N 90 116.910 116.910 118.391 -1.481 17856 3017 1 9 . 1 1 90 90 SER C C 90 174.887 174.887 174.526 0.361 17856 3018 1 9 . 1 1 90 90 SER H H 90 8.322 8.322 8.621 -0.299 17856 3019 1 9 . 1 1 91 91 LYS N N 91 123.457 123.457 127.300 -3.843 17856 3020 1 9 . 1 1 91 91 LYS C C 91 176.970 176.970 175.348 1.622 17856 3021 1 9 . 1 1 91 91 LYS H H 91 8.396 8.396 8.689 -0.293 17856 3022 1 9 . 1 1 92 92 SER N N 92 116.692 116.692 116.932 -0.240 17856 3023 1 9 . 1 1 92 92 SER C C 92 174.573 174.573 173.467 1.106 17856 3024 1 9 . 1 1 92 92 SER CA C 92 58.600 58.600 58.293 0.307 17856 3025 1 9 . 1 1 92 92 SER H H 92 8.297 8.297 8.038 0.259 17856 3026 1 9 . 1 1 93 93 GLN N N 93 121.916 121.916 123.381 -1.465 17856 3027 1 9 . 1 1 93 93 GLN C C 93 175.971 175.971 174.881 1.090 17856 3028 1 9 . 1 1 93 93 GLN H H 93 8.325 8.325 8.059 0.266 17856 3029 1 9 . 1 1 94 94 SER N N 94 117.385 117.385 115.115 2.270 17856 3030 1 9 . 1 1 94 94 SER C C 94 173.940 173.940 173.275 0.665 17856 3031 1 9 . 1 1 94 94 SER CA C 94 58.520 58.520 58.671 -0.151 17856 3032 1 9 . 1 1 94 94 SER H H 94 8.352 8.352 8.652 -0.300 17856 3033 1 9 . 1 1 95 95 THR N N 95 120.756 120.756 115.073 5.683 17856 3034 1 9 . 1 1 95 95 THR H H 95 7.805 7.805 7.838 -0.033 17856 3035 1 9 . 1 1 99 99 ARG C C 99 176.250 176.250 176.560 -0.310 17856 3036 1 9 . 1 1 99 99 ARG CA C 99 56.157 56.157 58.938 -2.781 17856 3037 1 9 . 1 1 100 100 ASN N N 100 118.482 118.482 116.150 2.332 17856 3038 1 9 . 1 1 100 100 ASN H H 100 8.272 8.272 8.573 -0.301 17856 3039 1 9 . 1 1 101 101 ARG C C 101 176.280 176.280 175.098 1.182 17856 3040 1 9 . 1 1 102 102 ASN N N 102 118.688 118.688 122.335 -3.647 17856 3041 1 9 . 1 1 102 102 ASN C C 102 174.996 174.996 175.383 -0.387 17856 3042 1 9 . 1 1 102 102 ASN CA C 102 53.609 53.609 53.970 -0.361 17856 3043 1 9 . 1 1 102 102 ASN H H 102 8.424 8.424 8.702 -0.278 17856 3044 1 9 . 1 1 103 103 ASN N N 103 118.865 118.865 118.422 0.443 17856 3045 1 9 . 1 1 103 103 ASN C C 103 175.040 175.040 174.952 0.088 17856 3046 1 9 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.802 0.010 17856 3047 1 9 . 1 1 103 103 ASN H H 103 8.282 8.282 8.445 -0.163 17856 3048 1 9 . 1 1 104 104 ARG N N 104 120.875 120.875 117.122 3.753 17856 3049 1 9 . 1 1 104 104 ARG H H 104 8.140 8.140 8.458 -0.318 17856 3050 1 9 . 1 1 106 106 ILE C C 106 175.408 175.408 175.637 -0.229 17856 3051 1 9 . 1 1 106 106 ILE CA C 106 61.395 61.395 59.811 1.584 17856 3052 1 10 . 1 1 2 2 SER N N 2 116.304 116.304 118.917 -2.613 17856 3053 1 10 . 1 1 2 2 SER C C 2 174.710 174.710 174.024 0.686 17856 3054 1 10 . 1 1 2 2 SER CA C 2 58.908 58.908 57.654 1.254 17856 3055 1 10 . 1 1 2 2 SER H H 2 8.003 8.003 8.525 -0.522 17856 3056 1 10 . 1 1 3 3 ILE N N 3 122.062 122.062 123.682 -1.620 17856 3057 1 10 . 1 1 3 3 ILE C C 3 176.750 176.750 175.767 0.983 17856 3058 1 10 . 1 1 3 3 ILE CA C 3 61.786 61.786 62.691 -0.905 17856 3059 1 10 . 1 1 3 3 ILE H H 3 7.957 7.957 7.967 -0.010 17856 3060 1 10 . 1 1 4 4 VAL N N 4 122.674 122.674 116.011 6.663 17856 3061 1 10 . 1 1 4 4 VAL C C 4 176.221 176.221 176.709 -0.488 17856 3062 1 10 . 1 1 4 4 VAL CA C 4 62.970 62.970 63.911 -0.941 17856 3063 1 10 . 1 1 4 4 VAL H H 4 7.970 7.970 8.000 -0.030 17856 3064 1 10 . 1 1 5 5 SER N N 5 117.750 117.750 115.140 2.610 17856 3065 1 10 . 1 1 5 5 SER C C 5 174.858 174.858 175.424 -0.566 17856 3066 1 10 . 1 1 5 5 SER CA C 5 58.630 58.630 61.274 -2.644 17856 3067 1 10 . 1 1 5 5 SER H H 5 8.093 8.093 8.182 -0.089 17856 3068 1 10 . 1 1 6 6 GLN N N 6 121.961 121.961 118.863 3.098 17856 3069 1 10 . 1 1 6 6 GLN C C 6 176.467 176.467 175.292 1.175 17856 3070 1 10 . 1 1 6 6 GLN CA C 6 56.226 56.226 55.967 0.259 17856 3071 1 10 . 1 1 6 6 GLN H H 6 8.371 8.371 7.889 0.482 17856 3072 1 10 . 1 1 7 7 THR N N 7 115.325 115.325 115.004 0.321 17856 3073 1 10 . 1 1 7 7 THR C C 7 174.752 174.752 175.698 -0.946 17856 3074 1 10 . 1 1 7 7 THR H H 7 8.152 8.152 7.632 0.520 17856 3075 1 10 . 1 1 8 8 ARG N N 8 122.530 122.530 122.530 0.000 17856 3076 1 10 . 1 1 8 8 ARG C C 8 176.200 176.200 178.116 -1.916 17856 3077 1 10 . 1 1 8 8 ARG CA C 8 56.570 56.570 59.859 -3.289 17856 3078 1 10 . 1 1 8 8 ARG H H 8 8.211 8.211 7.744 0.467 17856 3079 1 10 . 1 1 9 9 ASN N N 9 119.600 119.600 118.077 1.523 17856 3080 1 10 . 1 1 9 9 ASN C C 9 177.164 177.164 176.727 0.437 17856 3081 1 10 . 1 1 9 9 ASN H H 9 8.398 8.398 7.811 0.587 17856 3082 1 10 . 1 1 10 10 LYS N N 10 121.600 121.600 120.614 0.986 17856 3083 1 10 . 1 1 10 10 LYS C C 10 176.845 176.845 178.921 -2.076 17856 3084 1 10 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.046 -1.936 17856 3085 1 10 . 1 1 10 10 LYS H H 10 8.190 8.190 8.078 0.112 17856 3086 1 10 . 1 1 11 11 GLU N N 11 120.700 120.700 119.556 1.144 17856 3087 1 10 . 1 1 11 11 GLU C C 11 176.825 176.825 178.950 -2.125 17856 3088 1 10 . 1 1 11 11 GLU CA C 11 56.690 56.690 59.403 -2.713 17856 3089 1 10 . 1 1 11 11 GLU H H 11 8.323 8.323 7.671 0.652 17856 3090 1 10 . 1 1 12 12 LEU N N 12 122.390 122.390 121.672 0.718 17856 3091 1 10 . 1 1 12 12 LEU C C 12 177.670 177.670 178.886 -1.216 17856 3092 1 10 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.230 -2.760 17856 3093 1 10 . 1 1 12 12 LEU H H 12 8.155 8.155 8.273 -0.118 17856 3094 1 10 . 1 1 13 13 LEU N N 13 122.570 122.570 116.970 5.600 17856 3095 1 10 . 1 1 13 13 LEU C C 13 177.510 177.510 178.569 -1.059 17856 3096 1 10 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.531 -2.950 17856 3097 1 10 . 1 1 13 13 LEU H H 13 8.220 8.220 8.198 0.022 17856 3098 1 10 . 1 1 14 14 ASP N N 14 120.780 120.780 120.623 0.157 17856 3099 1 10 . 1 1 14 14 ASP C C 14 176.480 176.480 178.656 -2.176 17856 3100 1 10 . 1 1 14 14 ASP CA C 14 54.650 54.650 58.087 -3.437 17856 3101 1 10 . 1 1 14 14 ASP H H 14 8.243 8.243 8.031 0.212 17856 3102 1 10 . 1 1 15 15 LYS N N 15 120.900 120.900 119.438 1.462 17856 3103 1 10 . 1 1 15 15 LYS C C 15 175.580 175.580 178.872 -3.292 17856 3104 1 10 . 1 1 15 15 LYS H H 15 8.052 8.052 7.856 0.196 17856 3105 1 10 . 1 1 16 16 LYS N N 16 121.980 121.980 120.339 1.641 17856 3106 1 10 . 1 1 16 16 LYS C C 16 176.887 176.887 178.902 -2.015 17856 3107 1 10 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.824 -2.490 17856 3108 1 10 . 1 1 16 16 LYS H H 16 8.243 8.243 7.828 0.415 17856 3109 1 10 . 1 1 17 17 ILE N N 17 121.940 121.940 119.143 2.797 17856 3110 1 10 . 1 1 17 17 ILE H H 17 8.110 8.110 8.162 -0.052 17856 3111 1 10 . 1 1 18 18 ARG C C 18 176.520 176.520 178.381 -1.861 17856 3112 1 10 . 1 1 19 19 SER N N 19 117.150 117.150 114.633 2.517 17856 3113 1 10 . 1 1 19 19 SER C C 19 175.167 175.167 176.270 -1.103 17856 3114 1 10 . 1 1 19 19 SER CA C 19 58.840 58.840 61.399 -2.559 17856 3115 1 10 . 1 1 19 19 SER H H 19 8.396 8.396 7.763 0.633 17856 3116 1 10 . 1 1 20 20 GLU N N 20 123.176 123.176 122.130 1.046 17856 3117 1 10 . 1 1 20 20 GLU C C 20 176.921 176.921 179.063 -2.142 17856 3118 1 10 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.317 -2.457 17856 3119 1 10 . 1 1 20 20 GLU H H 20 8.478 8.478 7.923 0.555 17856 3120 1 10 . 1 1 21 21 ILE N N 21 120.550 120.550 114.970 5.580 17856 3121 1 10 . 1 1 21 21 ILE C C 21 176.550 176.550 177.987 -1.437 17856 3122 1 10 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.839 -3.209 17856 3123 1 10 . 1 1 21 21 ILE H H 21 8.080 8.080 7.470 0.610 17856 3124 1 10 . 1 1 22 22 GLU N N 22 123.685 123.685 120.641 3.044 17856 3125 1 10 . 1 1 22 22 GLU C C 22 176.109 176.109 178.948 -2.839 17856 3126 1 10 . 1 1 22 22 GLU H H 22 8.309 8.309 7.644 0.665 17856 3127 1 10 . 1 1 23 23 ALA N N 23 124.280 124.280 122.994 1.286 17856 3128 1 10 . 1 1 23 23 ALA C C 23 178.474 178.474 179.639 -1.165 17856 3129 1 10 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.070 -1.664 17856 3130 1 10 . 1 1 23 23 ALA H H 23 8.088 8.088 8.503 -0.415 17856 3131 1 10 . 1 1 24 24 ILE N N 24 120.330 120.330 119.187 1.143 17856 3132 1 10 . 1 1 24 24 ILE C C 24 176.309 176.309 177.630 -1.321 17856 3133 1 10 . 1 1 24 24 ILE CA C 24 61.540 61.540 64.104 -2.564 17856 3134 1 10 . 1 1 24 24 ILE H H 24 7.980 7.980 7.891 0.089 17856 3135 1 10 . 1 1 25 25 LYS N N 25 124.310 124.310 119.906 4.404 17856 3136 1 10 . 1 1 25 25 LYS C C 25 176.365 176.365 178.670 -2.305 17856 3137 1 10 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.159 -2.825 17856 3138 1 10 . 1 1 25 25 LYS H H 25 8.198 8.198 7.845 0.353 17856 3139 1 10 . 1 1 26 26 LYS N N 26 122.518 122.518 118.134 4.384 17856 3140 1 10 . 1 1 26 26 LYS C C 26 176.365 176.365 178.447 -2.082 17856 3141 1 10 . 1 1 26 26 LYS CA C 26 56.175 56.175 58.633 -2.458 17856 3142 1 10 . 1 1 26 26 LYS H H 26 8.125 8.125 7.214 0.911 17856 3143 1 10 . 1 1 27 27 ILE N N 27 122.670 122.670 120.545 2.125 17856 3144 1 10 . 1 1 27 27 ILE C C 27 176.261 176.261 178.177 -1.916 17856 3145 1 10 . 1 1 27 27 ILE CA C 27 61.294 61.294 64.286 -2.992 17856 3146 1 10 . 1 1 27 27 ILE H H 27 8.114 8.114 7.887 0.227 17856 3147 1 10 . 1 1 28 28 ILE N N 28 125.178 125.178 118.965 6.213 17856 3148 1 10 . 1 1 28 28 ILE C C 28 175.803 175.803 176.720 -0.917 17856 3149 1 10 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.243 -2.163 17856 3150 1 10 . 1 1 28 28 ILE H H 28 8.220 8.220 8.140 0.080 17856 3151 1 10 . 1 1 29 29 ALA N N 29 127.850 127.850 121.566 6.284 17856 3152 1 10 . 1 1 29 29 ALA C C 29 177.627 177.627 179.491 -1.864 17856 3153 1 10 . 1 1 29 29 ALA CA C 29 53.684 53.684 54.706 -1.022 17856 3154 1 10 . 1 1 29 29 ALA H H 29 8.300 8.300 7.319 0.981 17856 3155 1 10 . 1 1 30 30 GLU N N 30 120.000 120.000 119.562 0.438 17856 3156 1 10 . 1 1 30 30 GLU C C 30 176.321 176.321 178.771 -2.450 17856 3157 1 10 . 1 1 30 30 GLU H H 30 8.258 8.258 7.648 0.610 17856 3158 1 10 . 1 1 31 31 PHE N N 31 119.128 119.128 117.854 1.274 17856 3159 1 10 . 1 1 31 31 PHE C C 31 175.180 175.180 178.147 -2.967 17856 3160 1 10 . 1 1 31 31 PHE CA C 31 57.540 57.540 60.986 -3.446 17856 3161 1 10 . 1 1 31 31 PHE H H 31 8.061 8.061 7.317 0.744 17856 3162 1 10 . 1 1 32 32 ASP N N 32 121.800 121.800 119.295 2.505 17856 3163 1 10 . 1 1 32 32 ASP C C 32 175.894 175.894 178.617 -2.723 17856 3164 1 10 . 1 1 32 32 ASP CA C 32 54.529 54.529 57.332 -2.803 17856 3165 1 10 . 1 1 32 32 ASP H H 32 8.275 8.275 7.818 0.457 17856 3166 1 10 . 1 1 33 33 VAL N N 33 119.648 119.648 119.389 0.259 17856 3167 1 10 . 1 1 33 33 VAL C C 33 176.268 176.268 178.339 -2.071 17856 3168 1 10 . 1 1 33 33 VAL CA C 33 62.500 62.500 66.202 -3.702 17856 3169 1 10 . 1 1 33 33 VAL H H 33 8.059 8.059 7.422 0.637 17856 3170 1 10 . 1 1 34 34 VAL N N 34 123.882 123.882 120.346 3.536 17856 3171 1 10 . 1 1 34 34 VAL H H 34 7.774 7.774 8.428 -0.654 17856 3172 1 10 . 1 1 35 35 LYS N N 35 125.250 125.250 119.681 5.569 17856 3173 1 10 . 1 1 35 35 LYS C C 35 176.719 176.719 177.412 -0.693 17856 3174 1 10 . 1 1 35 35 LYS CA C 35 56.502 56.502 59.636 -3.134 17856 3175 1 10 . 1 1 35 35 LYS H H 35 8.357 8.357 8.082 0.275 17856 3176 1 10 . 1 1 36 36 GLU N N 36 121.850 121.850 117.088 4.762 17856 3177 1 10 . 1 1 36 36 GLU C C 36 176.426 176.426 176.098 0.328 17856 3178 1 10 . 1 1 36 36 GLU H H 36 8.423 8.423 7.762 0.661 17856 3179 1 10 . 1 1 37 37 SER N N 37 117.100 117.100 113.680 3.420 17856 3180 1 10 . 1 1 37 37 SER C C 37 174.854 174.854 174.786 0.068 17856 3181 1 10 . 1 1 37 37 SER CA C 37 58.850 58.850 58.806 0.044 17856 3182 1 10 . 1 1 37 37 SER H H 37 8.362 8.362 8.131 0.231 17856 3183 1 10 . 1 1 38 38 VAL N N 38 121.625 121.625 125.094 -3.469 17856 3184 1 10 . 1 1 38 38 VAL C C 38 176.246 176.246 174.556 1.690 17856 3185 1 10 . 1 1 38 38 VAL CA C 38 63.043 63.043 62.215 0.828 17856 3186 1 10 . 1 1 38 38 VAL H H 38 8.225 8.225 7.666 0.559 17856 3187 1 10 . 1 1 39 39 ASN N N 39 121.150 121.150 124.750 -3.600 17856 3188 1 10 . 1 1 39 39 ASN C C 39 175.459 175.459 176.408 -0.949 17856 3189 1 10 . 1 1 39 39 ASN CA C 39 53.568 53.568 53.747 -0.179 17856 3190 1 10 . 1 1 39 39 ASN H H 39 8.366 8.366 8.505 -0.139 17856 3191 1 10 . 1 1 40 40 GLU N N 40 121.500 121.500 118.328 3.172 17856 3192 1 10 . 1 1 40 40 GLU C C 40 175.459 175.459 176.395 -0.936 17856 3193 1 10 . 1 1 40 40 GLU CA C 40 56.860 56.860 58.083 -1.223 17856 3194 1 10 . 1 1 40 40 GLU H H 40 8.370 8.370 8.721 -0.351 17856 3195 1 10 . 1 1 41 41 LEU N N 41 121.950 121.950 117.763 4.187 17856 3196 1 10 . 1 1 41 41 LEU C C 41 177.939 177.939 176.203 1.736 17856 3197 1 10 . 1 1 41 41 LEU CA C 41 56.040 56.040 54.713 1.327 17856 3198 1 10 . 1 1 41 41 LEU H H 41 8.152 8.152 7.605 0.547 17856 3199 1 10 . 1 1 42 42 SER N N 42 113.326 113.326 116.155 -2.829 17856 3200 1 10 . 1 1 42 42 SER C C 42 174.660 174.660 176.114 -1.454 17856 3201 1 10 . 1 1 42 42 SER CA C 42 58.940 58.940 59.437 -0.497 17856 3202 1 10 . 1 1 42 42 SER H H 42 8.373 8.373 7.904 0.469 17856 3203 1 10 . 1 1 43 43 GLU N N 43 121.521 121.521 122.249 -0.728 17856 3204 1 10 . 1 1 43 43 GLU C C 43 177.349 177.349 179.053 -1.704 17856 3205 1 10 . 1 1 43 43 GLU H H 43 7.329 7.329 7.846 -0.517 17856 3206 1 10 . 1 1 44 44 LYS N N 44 121.240 121.240 118.477 2.763 17856 3207 1 10 . 1 1 44 44 LYS C C 44 177.246 177.246 178.436 -1.190 17856 3208 1 10 . 1 1 44 44 LYS CA C 44 56.397 56.397 58.456 -2.059 17856 3209 1 10 . 1 1 44 44 LYS H H 44 8.103 8.103 7.456 0.647 17856 3210 1 10 . 1 1 45 45 ALA N N 45 119.568 119.568 121.754 -2.186 17856 3211 1 10 . 1 1 45 45 ALA C C 45 177.853 177.853 178.776 -0.923 17856 3212 1 10 . 1 1 45 45 ALA CA C 45 52.560 52.560 55.096 -2.536 17856 3213 1 10 . 1 1 45 45 ALA H H 45 8.541 8.541 7.369 1.172 17856 3214 1 10 . 1 1 46 46 LYS N N 46 115.235 115.235 116.129 -0.894 17856 3215 1 10 . 1 1 46 46 LYS C C 46 177.110 177.110 178.288 -1.178 17856 3216 1 10 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.536 -1.740 17856 3217 1 10 . 1 1 46 46 LYS H H 46 7.257 7.257 7.614 -0.357 17856 3218 1 10 . 1 1 47 47 THR N N 47 103.239 103.239 111.710 -8.471 17856 3219 1 10 . 1 1 47 47 THR C C 47 173.973 173.973 175.238 -1.265 17856 3220 1 10 . 1 1 47 47 THR CA C 47 62.740 62.740 63.356 -0.616 17856 3221 1 10 . 1 1 47 47 THR H H 47 7.381 7.381 7.523 -0.142 17856 3222 1 10 . 1 1 48 48 ASP N N 48 122.976 122.976 123.081 -0.105 17856 3223 1 10 . 1 1 48 48 ASP H H 48 8.031 8.031 7.922 0.109 17856 3224 1 10 . 1 1 49 49 PRO C C 49 178.106 178.106 178.695 -0.589 17856 3225 1 10 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.860 -0.641 17856 3226 1 10 . 1 1 50 50 GLN N N 50 118.351 118.351 118.799 -0.448 17856 3227 1 10 . 1 1 50 50 GLN C C 50 176.944 176.944 178.222 -1.278 17856 3228 1 10 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.488 -1.688 17856 3229 1 10 . 1 1 50 50 GLN H H 50 8.304 8.304 8.803 -0.499 17856 3230 1 10 . 1 1 51 51 ALA N N 51 124.206 124.206 122.276 1.930 17856 3231 1 10 . 1 1 51 51 ALA C C 51 178.490 178.490 179.356 -0.866 17856 3232 1 10 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.831 -1.407 17856 3233 1 10 . 1 1 51 51 ALA H H 51 7.547 7.547 7.960 -0.413 17856 3234 1 10 . 1 1 52 52 ALA N N 52 118.686 118.686 120.356 -1.670 17856 3235 1 10 . 1 1 52 52 ALA C C 52 177.953 177.953 179.512 -1.559 17856 3236 1 10 . 1 1 52 52 ALA H H 52 7.931 7.931 7.739 0.192 17856 3237 1 10 . 1 1 53 53 GLU N N 53 120.075 120.075 118.974 1.101 17856 3238 1 10 . 1 1 53 53 GLU H H 53 7.729 7.729 7.649 0.080 17856 3239 1 10 . 1 1 55 55 LEU N N 55 123.640 123.640 118.642 4.998 17856 3240 1 10 . 1 1 55 55 LEU C C 55 177.587 177.587 179.291 -1.704 17856 3241 1 10 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.452 -1.665 17856 3242 1 10 . 1 1 55 55 LEU H H 55 8.215 8.215 8.005 0.210 17856 3243 1 10 . 1 1 56 56 ASN N N 56 118.520 118.520 117.895 0.625 17856 3244 1 10 . 1 1 56 56 ASN C C 56 175.700 175.700 176.942 -1.242 17856 3245 1 10 . 1 1 56 56 ASN CA C 56 54.132 54.132 55.820 -1.688 17856 3246 1 10 . 1 1 56 56 ASN H H 56 8.250 8.250 8.003 0.247 17856 3247 1 10 . 1 1 57 57 LYS N N 57 120.960 120.960 119.524 1.436 17856 3248 1 10 . 1 1 57 57 LYS C C 57 176.637 176.637 177.046 -0.409 17856 3249 1 10 . 1 1 57 57 LYS H H 57 8.065 8.065 7.493 0.572 17856 3250 1 10 . 1 1 58 58 LEU N N 58 122.610 122.610 119.322 3.288 17856 3251 1 10 . 1 1 58 58 LEU C C 58 177.433 177.433 178.547 -1.114 17856 3252 1 10 . 1 1 58 58 LEU CA C 58 55.120 55.120 57.523 -2.403 17856 3253 1 10 . 1 1 58 58 LEU H H 58 8.135 8.135 7.412 0.723 17856 3254 1 10 . 1 1 59 59 ILE N N 59 122.045 122.045 118.447 3.598 17856 3255 1 10 . 1 1 59 59 ILE CA C 59 61.535 61.535 63.977 -2.442 17856 3256 1 10 . 1 1 59 59 ILE H H 59 8.220 8.220 7.504 0.716 17856 3257 1 10 . 1 1 60 60 GLU N N 60 124.000 124.000 118.824 5.176 17856 3258 1 10 . 1 1 60 60 GLU C C 60 177.007 177.007 177.460 -0.453 17856 3259 1 10 . 1 1 60 60 GLU CA C 60 56.722 56.722 58.251 -1.529 17856 3260 1 10 . 1 1 60 60 GLU H H 60 8.340 8.340 7.764 0.576 17856 3261 1 10 . 1 1 61 61 GLY N N 61 110.520 110.520 107.283 3.237 17856 3262 1 10 . 1 1 61 61 GLY C C 61 174.002 174.002 174.305 -0.303 17856 3263 1 10 . 1 1 61 61 GLY CA C 61 45.405 45.405 44.677 0.728 17856 3264 1 10 . 1 1 61 61 GLY H H 61 8.557 8.557 7.708 0.849 17856 3265 1 10 . 1 1 62 62 TYR N N 62 119.600 119.600 121.382 -1.782 17856 3266 1 10 . 1 1 62 62 TYR C C 62 175.940 175.940 176.306 -0.366 17856 3267 1 10 . 1 1 62 62 TYR CA C 62 58.108 58.108 58.943 -0.835 17856 3268 1 10 . 1 1 62 62 TYR H H 62 7.980 7.980 7.367 0.613 17856 3269 1 10 . 1 1 63 63 THR N N 63 116.304 116.304 119.219 -2.915 17856 3270 1 10 . 1 1 63 63 THR C C 63 173.796 173.796 174.208 -0.412 17856 3271 1 10 . 1 1 63 63 THR H H 63 8.049 8.049 8.258 -0.209 17856 3272 1 10 . 1 1 64 64 TYR N N 64 122.050 122.050 117.850 4.200 17856 3273 1 10 . 1 1 64 64 TYR C C 64 176.290 176.290 174.326 1.964 17856 3274 1 10 . 1 1 64 64 TYR CA C 64 58.533 58.533 56.277 2.256 17856 3275 1 10 . 1 1 64 64 TYR H H 64 8.133 8.133 7.708 0.425 17856 3276 1 10 . 1 1 65 65 GLY N N 65 110.456 110.456 107.500 2.956 17856 3277 1 10 . 1 1 65 65 GLY C C 65 174.340 174.340 174.283 0.057 17856 3278 1 10 . 1 1 65 65 GLY CA C 65 45.328 45.328 45.624 -0.296 17856 3279 1 10 . 1 1 65 65 GLY H H 65 7.747 7.747 8.522 -0.775 17856 3280 1 10 . 1 1 66 66 GLU N N 66 120.783 120.783 118.656 2.127 17856 3281 1 10 . 1 1 66 66 GLU C C 66 176.895 176.895 176.344 0.551 17856 3282 1 10 . 1 1 66 66 GLU CA C 66 56.804 56.804 56.505 0.299 17856 3283 1 10 . 1 1 66 66 GLU H H 66 8.243 8.243 8.321 -0.078 17856 3284 1 10 . 1 1 67 67 GLU N N 67 121.587 121.587 120.849 0.738 17856 3285 1 10 . 1 1 67 67 GLU C C 67 176.340 176.340 176.011 0.329 17856 3286 1 10 . 1 1 67 67 GLU H H 67 8.611 8.611 8.375 0.236 17856 3287 1 10 . 1 1 68 68 ARG N N 68 121.790 121.790 120.927 0.863 17856 3288 1 10 . 1 1 68 68 ARG C C 68 176.350 176.350 175.810 0.540 17856 3289 1 10 . 1 1 68 68 ARG H H 68 8.267 8.267 8.367 -0.100 17856 3290 1 10 . 1 1 69 69 LYS N N 69 118.431 118.431 118.690 -0.259 17856 3291 1 10 . 1 1 69 69 LYS H H 69 7.567 7.567 8.407 -0.840 17856 3292 1 10 . 1 1 70 70 LEU C C 70 177.338 177.338 177.874 -0.536 17856 3293 1 10 . 1 1 70 70 LEU CA C 70 55.533 55.533 56.613 -1.080 17856 3294 1 10 . 1 1 71 71 TYR N N 71 119.504 119.504 117.387 2.117 17856 3295 1 10 . 1 1 71 71 TYR H H 71 7.997 7.997 7.694 0.303 17856 3296 1 10 . 1 1 72 72 ASP C C 72 176.528 176.528 178.437 -1.909 17856 3297 1 10 . 1 1 72 72 ASP CA C 72 54.693 54.693 57.223 -2.530 17856 3298 1 10 . 1 1 73 73 SER N N 73 117.000 117.000 116.059 0.941 17856 3299 1 10 . 1 1 73 73 SER C C 73 174.950 174.950 176.398 -1.448 17856 3300 1 10 . 1 1 73 73 SER CA C 73 58.997 58.997 60.921 -1.924 17856 3301 1 10 . 1 1 73 73 SER H H 73 8.282 8.282 7.532 0.750 17856 3302 1 10 . 1 1 74 74 ALA N N 74 125.422 125.422 124.752 0.670 17856 3303 1 10 . 1 1 74 74 ALA C C 74 178.389 178.389 179.446 -1.057 17856 3304 1 10 . 1 1 74 74 ALA CA C 74 53.433 53.433 55.180 -1.747 17856 3305 1 10 . 1 1 74 74 ALA H H 74 8.339 8.339 7.996 0.343 17856 3306 1 10 . 1 1 75 75 LEU N N 75 120.019 120.019 118.332 1.687 17856 3307 1 10 . 1 1 75 75 LEU C C 75 177.954 177.954 178.956 -1.002 17856 3308 1 10 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.295 -1.515 17856 3309 1 10 . 1 1 75 75 LEU H H 75 7.948 7.948 7.634 0.314 17856 3310 1 10 . 1 1 76 76 SER N N 76 113.321 113.321 115.109 -1.788 17856 3311 1 10 . 1 1 76 76 SER C C 76 174.784 174.784 176.782 -1.998 17856 3312 1 10 . 1 1 76 76 SER CA C 76 59.173 59.173 61.958 -2.785 17856 3313 1 10 . 1 1 76 76 SER H H 76 7.951 7.951 7.662 0.289 17856 3314 1 10 . 1 1 77 77 LYS N N 77 122.710 122.710 121.038 1.672 17856 3315 1 10 . 1 1 77 77 LYS C C 77 176.734 176.734 178.724 -1.990 17856 3316 1 10 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.352 -0.962 17856 3317 1 10 . 1 1 77 77 LYS H H 77 8.170 8.170 7.655 0.515 17856 3318 1 10 . 1 1 78 78 ILE N N 78 121.521 121.521 119.080 2.441 17856 3319 1 10 . 1 1 78 78 ILE C C 78 176.512 176.512 177.915 -1.403 17856 3320 1 10 . 1 1 78 78 ILE H H 78 8.160 8.160 7.206 0.954 17856 3321 1 10 . 1 1 79 79 GLU N N 79 123.840 123.840 121.323 2.517 17856 3322 1 10 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.978 -4.500 17856 3323 1 10 . 1 1 79 79 GLU H H 79 8.360 8.360 8.029 0.331 17856 3324 1 10 . 1 1 80 80 LYS N N 80 122.143 122.143 119.507 2.636 17856 3325 1 10 . 1 1 80 80 LYS C C 80 176.937 176.937 179.239 -2.302 17856 3326 1 10 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.382 -2.882 17856 3327 1 10 . 1 1 80 80 LYS H H 80 8.231 8.231 7.640 0.591 17856 3328 1 10 . 1 1 81 81 LEU N N 81 122.095 122.095 121.199 0.896 17856 3329 1 10 . 1 1 81 81 LEU C C 81 177.531 177.531 178.890 -1.359 17856 3330 1 10 . 1 1 81 81 LEU H H 81 8.050 8.050 7.405 0.645 17856 3331 1 10 . 1 1 82 82 ILE N N 82 120.609 120.609 118.900 1.709 17856 3332 1 10 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.319 -3.959 17856 3333 1 10 . 1 1 82 82 ILE H H 82 8.000 8.000 7.639 0.361 17856 3334 1 10 . 1 1 83 83 GLU N N 83 124.611 124.611 118.243 6.368 17856 3335 1 10 . 1 1 83 83 GLU C C 83 177.298 177.298 178.304 -1.006 17856 3336 1 10 . 1 1 83 83 GLU H H 83 8.380 8.380 7.722 0.658 17856 3337 1 10 . 1 1 84 84 THR N N 84 115.107 115.107 113.690 1.417 17856 3338 1 10 . 1 1 84 84 THR C C 84 174.400 174.400 175.618 -1.218 17856 3339 1 10 . 1 1 84 84 THR CA C 84 62.659 62.659 64.440 -1.781 17856 3340 1 10 . 1 1 84 84 THR H H 84 8.064 8.064 7.285 0.779 17856 3341 1 10 . 1 1 85 85 LEU N N 85 124.150 124.150 120.390 3.760 17856 3342 1 10 . 1 1 85 85 LEU C C 85 177.120 177.120 176.751 0.369 17856 3343 1 10 . 1 1 85 85 LEU CA C 85 55.020 55.020 55.564 -0.544 17856 3344 1 10 . 1 1 85 85 LEU H H 85 8.238 8.238 7.326 0.912 17856 3345 1 10 . 1 1 86 86 SER N N 86 114.913 114.913 115.764 -0.851 17856 3346 1 10 . 1 1 86 86 SER H H 86 7.678 7.678 7.381 0.297 17856 3347 1 10 . 1 1 87 87 PRO CA C 87 63.550 63.550 63.933 -0.383 17856 3348 1 10 . 1 1 88 88 ALA N N 88 123.767 123.767 120.083 3.684 17856 3349 1 10 . 1 1 88 88 ALA C C 88 178.131 178.131 177.028 1.103 17856 3350 1 10 . 1 1 88 88 ALA CA C 88 52.878 52.878 53.733 -0.856 17856 3351 1 10 . 1 1 88 88 ALA H H 88 8.342 8.342 8.370 -0.028 17856 3352 1 10 . 1 1 89 89 ARG N N 89 119.159 119.159 120.181 -1.022 17856 3353 1 10 . 1 1 89 89 ARG C C 89 176.620 176.620 174.270 2.350 17856 3354 1 10 . 1 1 89 89 ARG H H 89 8.133 8.133 8.350 -0.217 17856 3355 1 10 . 1 1 90 90 SER N N 90 116.910 116.910 120.606 -3.696 17856 3356 1 10 . 1 1 90 90 SER C C 90 174.887 174.887 173.564 1.323 17856 3357 1 10 . 1 1 90 90 SER H H 90 8.322 8.322 8.419 -0.097 17856 3358 1 10 . 1 1 91 91 LYS N N 91 123.457 123.457 122.630 0.827 17856 3359 1 10 . 1 1 91 91 LYS C C 91 176.970 176.970 175.937 1.033 17856 3360 1 10 . 1 1 91 91 LYS H H 91 8.396 8.396 8.422 -0.026 17856 3361 1 10 . 1 1 92 92 SER N N 92 116.692 116.692 121.593 -4.901 17856 3362 1 10 . 1 1 92 92 SER C C 92 174.573 174.573 174.131 0.442 17856 3363 1 10 . 1 1 92 92 SER CA C 92 58.600 58.600 59.038 -0.438 17856 3364 1 10 . 1 1 92 92 SER H H 92 8.297 8.297 8.679 -0.382 17856 3365 1 10 . 1 1 93 93 GLN N N 93 121.916 121.916 122.058 -0.142 17856 3366 1 10 . 1 1 93 93 GLN C C 93 175.971 175.971 174.455 1.516 17856 3367 1 10 . 1 1 93 93 GLN H H 93 8.325 8.325 8.159 0.166 17856 3368 1 10 . 1 1 94 94 SER N N 94 117.385 117.385 116.569 0.816 17856 3369 1 10 . 1 1 94 94 SER C C 94 173.940 173.940 173.113 0.827 17856 3370 1 10 . 1 1 94 94 SER CA C 94 58.520 58.520 58.726 -0.206 17856 3371 1 10 . 1 1 94 94 SER H H 94 8.352 8.352 8.231 0.121 17856 3372 1 10 . 1 1 95 95 THR N N 95 120.756 120.756 113.886 6.870 17856 3373 1 10 . 1 1 95 95 THR H H 95 7.805 7.805 7.706 0.099 17856 3374 1 10 . 1 1 99 99 ARG C C 99 176.250 176.250 176.146 0.104 17856 3375 1 10 . 1 1 99 99 ARG CA C 99 56.157 56.157 58.429 -2.272 17856 3376 1 10 . 1 1 100 100 ASN N N 100 118.482 118.482 117.612 0.870 17856 3377 1 10 . 1 1 100 100 ASN H H 100 8.272 8.272 8.145 0.127 17856 3378 1 10 . 1 1 101 101 ARG C C 101 176.280 176.280 175.414 0.866 17856 3379 1 10 . 1 1 102 102 ASN N N 102 118.688 118.688 119.079 -0.391 17856 3380 1 10 . 1 1 102 102 ASN C C 102 174.996 174.996 175.068 -0.072 17856 3381 1 10 . 1 1 102 102 ASN CA C 102 53.609 53.609 53.374 0.235 17856 3382 1 10 . 1 1 102 102 ASN H H 102 8.424 8.424 8.074 0.350 17856 3383 1 10 . 1 1 103 103 ASN N N 103 118.865 118.865 116.571 2.294 17856 3384 1 10 . 1 1 103 103 ASN C C 103 175.040 175.040 174.615 0.425 17856 3385 1 10 . 1 1 103 103 ASN CA C 103 53.812 53.812 54.124 -0.312 17856 3386 1 10 . 1 1 103 103 ASN H H 103 8.282 8.282 8.480 -0.198 17856 3387 1 10 . 1 1 104 104 ARG N N 104 120.875 120.875 115.745 5.130 17856 3388 1 10 . 1 1 104 104 ARG H H 104 8.140 8.140 8.000 0.140 17856 3389 1 10 . 1 1 106 106 ILE C C 106 175.408 175.408 177.218 -1.810 17856 3390 1 10 . 1 1 106 106 ILE CA C 106 61.395 61.395 62.561 -1.166 17856 3391 1 11 . 1 1 2 2 SER N N 2 116.304 116.304 121.061 -4.757 17856 3392 1 11 . 1 1 2 2 SER C C 2 174.710 174.710 176.256 -1.546 17856 3393 1 11 . 1 1 2 2 SER CA C 2 58.908 58.908 61.145 -2.236 17856 3394 1 11 . 1 1 2 2 SER H H 2 8.003 8.003 8.771 -0.768 17856 3395 1 11 . 1 1 3 3 ILE N N 3 122.062 122.062 123.455 -1.393 17856 3396 1 11 . 1 1 3 3 ILE C C 3 176.750 176.750 176.863 -0.113 17856 3397 1 11 . 1 1 3 3 ILE CA C 3 61.786 61.786 63.310 -1.524 17856 3398 1 11 . 1 1 3 3 ILE H H 3 7.957 7.957 8.295 -0.338 17856 3399 1 11 . 1 1 4 4 VAL N N 4 122.674 122.674 114.431 8.243 17856 3400 1 11 . 1 1 4 4 VAL C C 4 176.221 176.221 175.437 0.784 17856 3401 1 11 . 1 1 4 4 VAL CA C 4 62.970 62.970 61.712 1.258 17856 3402 1 11 . 1 1 4 4 VAL H H 4 7.970 7.970 7.427 0.543 17856 3403 1 11 . 1 1 5 5 SER N N 5 117.750 117.750 115.188 2.562 17856 3404 1 11 . 1 1 5 5 SER C C 5 174.858 174.858 175.918 -1.060 17856 3405 1 11 . 1 1 5 5 SER CA C 5 58.630 58.630 59.855 -1.225 17856 3406 1 11 . 1 1 5 5 SER H H 5 8.093 8.093 7.842 0.251 17856 3407 1 11 . 1 1 6 6 GLN N N 6 121.961 121.961 121.924 0.037 17856 3408 1 11 . 1 1 6 6 GLN C C 6 176.467 176.467 178.087 -1.620 17856 3409 1 11 . 1 1 6 6 GLN CA C 6 56.226 56.226 58.126 -1.900 17856 3410 1 11 . 1 1 6 6 GLN H H 6 8.371 8.371 8.422 -0.051 17856 3411 1 11 . 1 1 7 7 THR N N 7 115.325 115.325 114.637 0.688 17856 3412 1 11 . 1 1 7 7 THR C C 7 174.752 174.752 174.235 0.517 17856 3413 1 11 . 1 1 7 7 THR H H 7 8.152 8.152 7.892 0.260 17856 3414 1 11 . 1 1 8 8 ARG N N 8 122.530 122.530 120.912 1.618 17856 3415 1 11 . 1 1 8 8 ARG C C 8 176.200 176.200 176.605 -0.405 17856 3416 1 11 . 1 1 8 8 ARG CA C 8 56.570 56.570 54.566 2.004 17856 3417 1 11 . 1 1 8 8 ARG H H 8 8.211 8.211 8.012 0.199 17856 3418 1 11 . 1 1 9 9 ASN N N 9 119.600 119.600 120.468 -0.868 17856 3419 1 11 . 1 1 9 9 ASN C C 9 177.164 177.164 177.235 -0.071 17856 3420 1 11 . 1 1 9 9 ASN H H 9 8.398 8.398 8.665 -0.267 17856 3421 1 11 . 1 1 10 10 LYS N N 10 121.600 121.600 120.070 1.530 17856 3422 1 11 . 1 1 10 10 LYS C C 10 176.845 176.845 178.679 -1.834 17856 3423 1 11 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.317 -2.207 17856 3424 1 11 . 1 1 10 10 LYS H H 10 8.190 8.190 8.473 -0.283 17856 3425 1 11 . 1 1 11 11 GLU N N 11 120.700 120.700 118.912 1.788 17856 3426 1 11 . 1 1 11 11 GLU C C 11 176.825 176.825 178.778 -1.953 17856 3427 1 11 . 1 1 11 11 GLU CA C 11 56.690 56.690 59.340 -2.650 17856 3428 1 11 . 1 1 11 11 GLU H H 11 8.323 8.323 7.682 0.641 17856 3429 1 11 . 1 1 12 12 LEU N N 12 122.390 122.390 121.216 1.174 17856 3430 1 11 . 1 1 12 12 LEU C C 12 177.670 177.670 178.925 -1.255 17856 3431 1 11 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.365 -2.896 17856 3432 1 11 . 1 1 12 12 LEU H H 12 8.155 8.155 7.531 0.624 17856 3433 1 11 . 1 1 13 13 LEU N N 13 122.570 122.570 116.391 6.179 17856 3434 1 11 . 1 1 13 13 LEU C C 13 177.510 177.510 178.578 -1.068 17856 3435 1 11 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.482 -2.901 17856 3436 1 11 . 1 1 13 13 LEU H H 13 8.220 8.220 8.091 0.129 17856 3437 1 11 . 1 1 14 14 ASP N N 14 120.780 120.780 120.837 -0.057 17856 3438 1 11 . 1 1 14 14 ASP C C 14 176.480 176.480 178.648 -2.168 17856 3439 1 11 . 1 1 14 14 ASP CA C 14 54.650 54.650 58.296 -3.646 17856 3440 1 11 . 1 1 14 14 ASP H H 14 8.243 8.243 8.431 -0.188 17856 3441 1 11 . 1 1 15 15 LYS N N 15 120.900 120.900 119.065 1.835 17856 3442 1 11 . 1 1 15 15 LYS C C 15 175.580 175.580 179.116 -3.536 17856 3443 1 11 . 1 1 15 15 LYS H H 15 8.052 8.052 8.094 -0.042 17856 3444 1 11 . 1 1 16 16 LYS N N 16 121.980 121.980 120.326 1.654 17856 3445 1 11 . 1 1 16 16 LYS C C 16 176.887 176.887 178.865 -1.978 17856 3446 1 11 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.581 -2.247 17856 3447 1 11 . 1 1 16 16 LYS H H 16 8.243 8.243 7.652 0.591 17856 3448 1 11 . 1 1 17 17 ILE N N 17 121.940 121.940 119.958 1.982 17856 3449 1 11 . 1 1 17 17 ILE H H 17 8.110 8.110 8.504 -0.394 17856 3450 1 11 . 1 1 18 18 ARG C C 18 176.520 176.520 178.683 -2.163 17856 3451 1 11 . 1 1 19 19 SER N N 19 117.150 117.150 116.045 1.105 17856 3452 1 11 . 1 1 19 19 SER C C 19 175.167 175.167 176.608 -1.441 17856 3453 1 11 . 1 1 19 19 SER CA C 19 58.840 58.840 62.316 -3.477 17856 3454 1 11 . 1 1 19 19 SER H H 19 8.396 8.396 7.849 0.547 17856 3455 1 11 . 1 1 20 20 GLU N N 20 123.176 123.176 121.779 1.397 17856 3456 1 11 . 1 1 20 20 GLU C C 20 176.921 176.921 178.995 -2.074 17856 3457 1 11 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.278 -2.418 17856 3458 1 11 . 1 1 20 20 GLU H H 20 8.478 8.478 8.009 0.469 17856 3459 1 11 . 1 1 21 21 ILE N N 21 120.550 120.550 115.737 4.813 17856 3460 1 11 . 1 1 21 21 ILE C C 21 176.550 176.550 178.275 -1.725 17856 3461 1 11 . 1 1 21 21 ILE CA C 21 61.630 61.630 65.024 -3.394 17856 3462 1 11 . 1 1 21 21 ILE H H 21 8.080 8.080 7.491 0.589 17856 3463 1 11 . 1 1 22 22 GLU N N 22 123.685 123.685 120.583 3.102 17856 3464 1 11 . 1 1 22 22 GLU C C 22 176.109 176.109 179.051 -2.942 17856 3465 1 11 . 1 1 22 22 GLU H H 22 8.309 8.309 7.721 0.588 17856 3466 1 11 . 1 1 23 23 ALA N N 23 124.280 124.280 122.854 1.426 17856 3467 1 11 . 1 1 23 23 ALA C C 23 178.474 178.474 179.634 -1.160 17856 3468 1 11 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.039 -1.633 17856 3469 1 11 . 1 1 23 23 ALA H H 23 8.088 8.088 8.187 -0.099 17856 3470 1 11 . 1 1 24 24 ILE N N 24 120.330 120.330 118.890 1.440 17856 3471 1 11 . 1 1 24 24 ILE C C 24 176.309 176.309 177.837 -1.528 17856 3472 1 11 . 1 1 24 24 ILE CA C 24 61.540 61.540 65.174 -3.634 17856 3473 1 11 . 1 1 24 24 ILE H H 24 7.980 7.980 8.389 -0.409 17856 3474 1 11 . 1 1 25 25 LYS N N 25 124.310 124.310 119.930 4.380 17856 3475 1 11 . 1 1 25 25 LYS C C 25 176.365 176.365 178.847 -2.482 17856 3476 1 11 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.224 -2.889 17856 3477 1 11 . 1 1 25 25 LYS H H 25 8.198 8.198 8.174 0.024 17856 3478 1 11 . 1 1 26 26 LYS N N 26 122.518 122.518 118.823 3.695 17856 3479 1 11 . 1 1 26 26 LYS C C 26 176.365 176.365 178.728 -2.363 17856 3480 1 11 . 1 1 26 26 LYS CA C 26 56.175 56.175 58.523 -2.348 17856 3481 1 11 . 1 1 26 26 LYS H H 26 8.125 8.125 7.307 0.818 17856 3482 1 11 . 1 1 27 27 ILE N N 27 122.670 122.670 120.513 2.157 17856 3483 1 11 . 1 1 27 27 ILE C C 27 176.261 176.261 177.782 -1.521 17856 3484 1 11 . 1 1 27 27 ILE CA C 27 61.294 61.294 64.986 -3.692 17856 3485 1 11 . 1 1 27 27 ILE H H 27 8.114 8.114 7.514 0.600 17856 3486 1 11 . 1 1 28 28 ILE N N 28 125.178 125.178 118.893 6.285 17856 3487 1 11 . 1 1 28 28 ILE C C 28 175.803 175.803 176.851 -1.048 17856 3488 1 11 . 1 1 28 28 ILE CA C 28 61.080 61.080 64.475 -3.394 17856 3489 1 11 . 1 1 28 28 ILE H H 28 8.220 8.220 8.035 0.185 17856 3490 1 11 . 1 1 29 29 ALA N N 29 127.850 127.850 120.995 6.855 17856 3491 1 11 . 1 1 29 29 ALA C C 29 177.627 177.627 179.520 -1.893 17856 3492 1 11 . 1 1 29 29 ALA CA C 29 53.684 53.684 54.558 -0.874 17856 3493 1 11 . 1 1 29 29 ALA H H 29 8.300 8.300 7.180 1.120 17856 3494 1 11 . 1 1 30 30 GLU N N 30 120.000 120.000 119.450 0.550 17856 3495 1 11 . 1 1 30 30 GLU C C 30 176.321 176.321 178.923 -2.602 17856 3496 1 11 . 1 1 30 30 GLU H H 30 8.258 8.258 7.678 0.580 17856 3497 1 11 . 1 1 31 31 PHE N N 31 119.128 119.128 117.737 1.391 17856 3498 1 11 . 1 1 31 31 PHE C C 31 175.180 175.180 178.130 -2.950 17856 3499 1 11 . 1 1 31 31 PHE CA C 31 57.540 57.540 60.805 -3.265 17856 3500 1 11 . 1 1 31 31 PHE H H 31 8.061 8.061 7.455 0.606 17856 3501 1 11 . 1 1 32 32 ASP N N 32 121.800 121.800 118.770 3.030 17856 3502 1 11 . 1 1 32 32 ASP C C 32 175.894 175.894 177.973 -2.079 17856 3503 1 11 . 1 1 32 32 ASP CA C 32 54.529 54.529 56.664 -2.135 17856 3504 1 11 . 1 1 32 32 ASP H H 32 8.275 8.275 7.744 0.531 17856 3505 1 11 . 1 1 33 33 VAL N N 33 119.648 119.648 118.374 1.274 17856 3506 1 11 . 1 1 33 33 VAL C C 33 176.268 176.268 177.736 -1.468 17856 3507 1 11 . 1 1 33 33 VAL CA C 33 62.500 62.500 65.099 -2.599 17856 3508 1 11 . 1 1 33 33 VAL H H 33 8.059 8.059 7.448 0.611 17856 3509 1 11 . 1 1 34 34 VAL N N 34 123.882 123.882 116.673 7.209 17856 3510 1 11 . 1 1 34 34 VAL H H 34 7.774 7.774 7.645 0.129 17856 3511 1 11 . 1 1 35 35 LYS N N 35 125.250 125.250 121.452 3.798 17856 3512 1 11 . 1 1 35 35 LYS C C 35 176.719 176.719 175.645 1.074 17856 3513 1 11 . 1 1 35 35 LYS CA C 35 56.502 56.502 56.896 -0.394 17856 3514 1 11 . 1 1 35 35 LYS H H 35 8.357 8.357 7.538 0.819 17856 3515 1 11 . 1 1 36 36 GLU N N 36 121.850 121.850 123.990 -2.140 17856 3516 1 11 . 1 1 36 36 GLU C C 36 176.426 176.426 177.505 -1.079 17856 3517 1 11 . 1 1 36 36 GLU H H 36 8.423 8.423 8.551 -0.128 17856 3518 1 11 . 1 1 37 37 SER N N 37 117.100 117.100 116.681 0.419 17856 3519 1 11 . 1 1 37 37 SER C C 37 174.854 174.854 176.790 -1.936 17856 3520 1 11 . 1 1 37 37 SER CA C 37 58.850 58.850 61.351 -2.501 17856 3521 1 11 . 1 1 37 37 SER H H 37 8.362 8.362 8.477 -0.115 17856 3522 1 11 . 1 1 38 38 VAL N N 38 121.625 121.625 123.238 -1.613 17856 3523 1 11 . 1 1 38 38 VAL C C 38 176.246 176.246 177.046 -0.800 17856 3524 1 11 . 1 1 38 38 VAL CA C 38 63.043 63.043 65.156 -2.113 17856 3525 1 11 . 1 1 38 38 VAL H H 38 8.225 8.225 8.220 0.005 17856 3526 1 11 . 1 1 39 39 ASN N N 39 121.150 121.150 114.750 6.400 17856 3527 1 11 . 1 1 39 39 ASN C C 39 175.459 175.459 174.892 0.567 17856 3528 1 11 . 1 1 39 39 ASN CA C 39 53.568 53.568 53.696 -0.128 17856 3529 1 11 . 1 1 39 39 ASN H H 39 8.366 8.366 7.652 0.714 17856 3530 1 11 . 1 1 40 40 GLU N N 40 121.500 121.500 118.827 2.673 17856 3531 1 11 . 1 1 40 40 GLU C C 40 175.459 175.459 175.067 0.392 17856 3532 1 11 . 1 1 40 40 GLU CA C 40 56.860 56.860 55.028 1.832 17856 3533 1 11 . 1 1 40 40 GLU H H 40 8.370 8.370 7.976 0.394 17856 3534 1 11 . 1 1 41 41 LEU N N 41 121.950 121.950 119.624 2.326 17856 3535 1 11 . 1 1 41 41 LEU C C 41 177.939 177.939 177.948 -0.009 17856 3536 1 11 . 1 1 41 41 LEU CA C 41 56.040 56.040 56.034 0.006 17856 3537 1 11 . 1 1 41 41 LEU H H 41 8.152 8.152 8.209 -0.057 17856 3538 1 11 . 1 1 42 42 SER N N 42 113.326 113.326 117.741 -4.415 17856 3539 1 11 . 1 1 42 42 SER C C 42 174.660 174.660 176.742 -2.082 17856 3540 1 11 . 1 1 42 42 SER CA C 42 58.940 58.940 61.792 -2.852 17856 3541 1 11 . 1 1 42 42 SER H H 42 8.373 8.373 8.156 0.217 17856 3542 1 11 . 1 1 43 43 GLU N N 43 121.521 121.521 120.443 1.078 17856 3543 1 11 . 1 1 43 43 GLU C C 43 177.349 177.349 178.770 -1.421 17856 3544 1 11 . 1 1 43 43 GLU H H 43 7.329 7.329 8.053 -0.724 17856 3545 1 11 . 1 1 44 44 LYS N N 44 121.240 121.240 119.499 1.741 17856 3546 1 11 . 1 1 44 44 LYS C C 44 177.246 177.246 178.693 -1.447 17856 3547 1 11 . 1 1 44 44 LYS CA C 44 56.397 56.397 59.345 -2.948 17856 3548 1 11 . 1 1 44 44 LYS H H 44 8.103 8.103 8.207 -0.104 17856 3549 1 11 . 1 1 45 45 ALA N N 45 119.568 119.568 121.946 -2.378 17856 3550 1 11 . 1 1 45 45 ALA C C 45 177.853 177.853 179.153 -1.300 17856 3551 1 11 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.728 -2.168 17856 3552 1 11 . 1 1 45 45 ALA H H 45 8.541 8.541 7.587 0.954 17856 3553 1 11 . 1 1 46 46 LYS N N 46 115.235 115.235 117.577 -2.342 17856 3554 1 11 . 1 1 46 46 LYS C C 46 177.110 177.110 178.602 -1.492 17856 3555 1 11 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.697 -1.901 17856 3556 1 11 . 1 1 46 46 LYS H H 46 7.257 7.257 7.580 -0.323 17856 3557 1 11 . 1 1 47 47 THR N N 47 103.239 103.239 110.164 -6.925 17856 3558 1 11 . 1 1 47 47 THR C C 47 173.973 173.973 174.884 -0.911 17856 3559 1 11 . 1 1 47 47 THR CA C 47 62.740 62.740 63.321 -0.581 17856 3560 1 11 . 1 1 47 47 THR H H 47 7.381 7.381 7.526 -0.145 17856 3561 1 11 . 1 1 48 48 ASP N N 48 122.976 122.976 121.942 1.034 17856 3562 1 11 . 1 1 48 48 ASP H H 48 8.031 8.031 7.923 0.108 17856 3563 1 11 . 1 1 49 49 PRO C C 49 178.106 178.106 178.281 -0.175 17856 3564 1 11 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.875 -0.656 17856 3565 1 11 . 1 1 50 50 GLN N N 50 118.351 118.351 118.753 -0.402 17856 3566 1 11 . 1 1 50 50 GLN C C 50 176.944 176.944 178.612 -1.668 17856 3567 1 11 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.460 -1.660 17856 3568 1 11 . 1 1 50 50 GLN H H 50 8.304 8.304 7.954 0.350 17856 3569 1 11 . 1 1 51 51 ALA N N 51 124.206 124.206 122.814 1.392 17856 3570 1 11 . 1 1 51 51 ALA C C 51 178.490 178.490 178.820 -0.330 17856 3571 1 11 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.959 -1.535 17856 3572 1 11 . 1 1 51 51 ALA H H 51 7.547 7.547 8.837 -1.290 17856 3573 1 11 . 1 1 52 52 ALA N N 52 118.686 118.686 119.937 -1.251 17856 3574 1 11 . 1 1 52 52 ALA C C 52 177.953 177.953 179.410 -1.457 17856 3575 1 11 . 1 1 52 52 ALA H H 52 7.931 7.931 7.857 0.074 17856 3576 1 11 . 1 1 53 53 GLU N N 53 120.075 120.075 117.661 2.414 17856 3577 1 11 . 1 1 53 53 GLU H H 53 7.729 7.729 7.850 -0.121 17856 3578 1 11 . 1 1 55 55 LEU N N 55 123.640 123.640 120.525 3.115 17856 3579 1 11 . 1 1 55 55 LEU C C 55 177.587 177.587 178.262 -0.675 17856 3580 1 11 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.249 -1.462 17856 3581 1 11 . 1 1 55 55 LEU H H 55 8.215 8.215 7.906 0.309 17856 3582 1 11 . 1 1 56 56 ASN N N 56 118.520 118.520 116.427 2.093 17856 3583 1 11 . 1 1 56 56 ASN C C 56 175.700 175.700 176.163 -0.463 17856 3584 1 11 . 1 1 56 56 ASN CA C 56 54.132 54.132 54.990 -0.858 17856 3585 1 11 . 1 1 56 56 ASN H H 56 8.250 8.250 8.022 0.228 17856 3586 1 11 . 1 1 57 57 LYS N N 57 120.960 120.960 117.475 3.485 17856 3587 1 11 . 1 1 57 57 LYS C C 57 176.637 176.637 176.443 0.194 17856 3588 1 11 . 1 1 57 57 LYS H H 57 8.065 8.065 7.622 0.443 17856 3589 1 11 . 1 1 58 58 LEU N N 58 122.610 122.610 120.160 2.450 17856 3590 1 11 . 1 1 58 58 LEU C C 58 177.433 177.433 176.575 0.858 17856 3591 1 11 . 1 1 58 58 LEU CA C 58 55.120 55.120 55.074 0.046 17856 3592 1 11 . 1 1 58 58 LEU H H 58 8.135 8.135 7.554 0.581 17856 3593 1 11 . 1 1 59 59 ILE N N 59 122.045 122.045 118.401 3.644 17856 3594 1 11 . 1 1 59 59 ILE CA C 59 61.535 61.535 62.420 -0.885 17856 3595 1 11 . 1 1 59 59 ILE H H 59 8.220 8.220 8.098 0.122 17856 3596 1 11 . 1 1 60 60 GLU N N 60 124.000 124.000 121.502 2.498 17856 3597 1 11 . 1 1 60 60 GLU C C 60 177.007 177.007 177.789 -0.782 17856 3598 1 11 . 1 1 60 60 GLU CA C 60 56.722 56.722 59.368 -2.646 17856 3599 1 11 . 1 1 60 60 GLU H H 60 8.340 8.340 8.712 -0.372 17856 3600 1 11 . 1 1 61 61 GLY N N 61 110.520 110.520 105.757 4.763 17856 3601 1 11 . 1 1 61 61 GLY C C 61 174.002 174.002 174.311 -0.309 17856 3602 1 11 . 1 1 61 61 GLY CA C 61 45.405 45.405 44.392 1.013 17856 3603 1 11 . 1 1 61 61 GLY H H 61 8.557 8.557 8.425 0.132 17856 3604 1 11 . 1 1 62 62 TYR N N 62 119.600 119.600 120.776 -1.176 17856 3605 1 11 . 1 1 62 62 TYR C C 62 175.940 175.940 176.316 -0.376 17856 3606 1 11 . 1 1 62 62 TYR CA C 62 58.108 58.108 60.563 -2.455 17856 3607 1 11 . 1 1 62 62 TYR H H 62 7.980 7.980 7.383 0.597 17856 3608 1 11 . 1 1 63 63 THR N N 63 116.304 116.304 115.581 0.723 17856 3609 1 11 . 1 1 63 63 THR C C 63 173.796 173.796 173.410 0.386 17856 3610 1 11 . 1 1 63 63 THR H H 63 8.049 8.049 7.901 0.148 17856 3611 1 11 . 1 1 64 64 TYR N N 64 122.050 122.050 126.488 -4.438 17856 3612 1 11 . 1 1 64 64 TYR C C 64 176.290 176.290 175.002 1.288 17856 3613 1 11 . 1 1 64 64 TYR CA C 64 58.533 58.533 57.867 0.666 17856 3614 1 11 . 1 1 64 64 TYR H H 64 8.133 8.133 8.804 -0.671 17856 3615 1 11 . 1 1 65 65 GLY N N 65 110.456 110.456 111.023 -0.567 17856 3616 1 11 . 1 1 65 65 GLY C C 65 174.340 174.340 175.243 -0.903 17856 3617 1 11 . 1 1 65 65 GLY CA C 65 45.328 45.328 45.497 -0.169 17856 3618 1 11 . 1 1 65 65 GLY H H 65 7.747 7.747 8.583 -0.836 17856 3619 1 11 . 1 1 66 66 GLU N N 66 120.783 120.783 120.900 -0.117 17856 3620 1 11 . 1 1 66 66 GLU C C 66 176.895 176.895 178.278 -1.383 17856 3621 1 11 . 1 1 66 66 GLU CA C 66 56.804 56.804 59.622 -2.818 17856 3622 1 11 . 1 1 66 66 GLU H H 66 8.243 8.243 8.559 -0.316 17856 3623 1 11 . 1 1 67 67 GLU N N 67 121.587 121.587 117.155 4.432 17856 3624 1 11 . 1 1 67 67 GLU C C 67 176.340 176.340 177.833 -1.493 17856 3625 1 11 . 1 1 67 67 GLU H H 67 8.611 8.611 8.479 0.132 17856 3626 1 11 . 1 1 68 68 ARG N N 68 121.790 121.790 121.076 0.714 17856 3627 1 11 . 1 1 68 68 ARG C C 68 176.350 176.350 178.347 -1.997 17856 3628 1 11 . 1 1 68 68 ARG H H 68 8.267 8.267 8.294 -0.027 17856 3629 1 11 . 1 1 69 69 LYS N N 69 118.431 118.431 119.468 -1.037 17856 3630 1 11 . 1 1 69 69 LYS H H 69 7.567 7.567 7.549 0.018 17856 3631 1 11 . 1 1 70 70 LEU C C 70 177.338 177.338 178.632 -1.294 17856 3632 1 11 . 1 1 70 70 LEU CA C 70 55.533 55.533 57.876 -2.343 17856 3633 1 11 . 1 1 71 71 TYR N N 71 119.504 119.504 115.910 3.594 17856 3634 1 11 . 1 1 71 71 TYR H H 71 7.997 7.997 7.515 0.482 17856 3635 1 11 . 1 1 72 72 ASP C C 72 176.528 176.528 178.557 -2.029 17856 3636 1 11 . 1 1 72 72 ASP CA C 72 54.693 54.693 57.016 -2.323 17856 3637 1 11 . 1 1 73 73 SER N N 73 117.000 117.000 115.684 1.316 17856 3638 1 11 . 1 1 73 73 SER C C 73 174.950 174.950 175.421 -0.471 17856 3639 1 11 . 1 1 73 73 SER CA C 73 58.997 58.997 60.793 -1.796 17856 3640 1 11 . 1 1 73 73 SER H H 73 8.282 8.282 8.246 0.036 17856 3641 1 11 . 1 1 74 74 ALA N N 74 125.422 125.422 124.748 0.674 17856 3642 1 11 . 1 1 74 74 ALA C C 74 178.389 178.389 179.183 -0.794 17856 3643 1 11 . 1 1 74 74 ALA CA C 74 53.433 53.433 54.823 -1.390 17856 3644 1 11 . 1 1 74 74 ALA H H 74 8.339 8.339 7.295 1.044 17856 3645 1 11 . 1 1 75 75 LEU N N 75 120.019 120.019 118.279 1.740 17856 3646 1 11 . 1 1 75 75 LEU C C 75 177.954 177.954 178.990 -1.036 17856 3647 1 11 . 1 1 75 75 LEU CA C 75 55.780 55.780 56.998 -1.218 17856 3648 1 11 . 1 1 75 75 LEU H H 75 7.948 7.948 7.754 0.194 17856 3649 1 11 . 1 1 76 76 SER N N 76 113.321 113.321 114.564 -1.243 17856 3650 1 11 . 1 1 76 76 SER C C 76 174.784 174.784 176.461 -1.677 17856 3651 1 11 . 1 1 76 76 SER CA C 76 59.173 59.173 61.793 -2.620 17856 3652 1 11 . 1 1 76 76 SER H H 76 7.951 7.951 7.746 0.205 17856 3653 1 11 . 1 1 77 77 LYS N N 77 122.710 122.710 121.841 0.869 17856 3654 1 11 . 1 1 77 77 LYS C C 77 176.734 176.734 178.833 -2.099 17856 3655 1 11 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.097 -0.707 17856 3656 1 11 . 1 1 77 77 LYS H H 77 8.170 8.170 7.249 0.921 17856 3657 1 11 . 1 1 78 78 ILE N N 78 121.521 121.521 119.538 1.983 17856 3658 1 11 . 1 1 78 78 ILE C C 78 176.512 176.512 178.092 -1.580 17856 3659 1 11 . 1 1 78 78 ILE H H 78 8.160 8.160 7.508 0.652 17856 3660 1 11 . 1 1 79 79 GLU N N 79 123.840 123.840 120.996 2.844 17856 3661 1 11 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.744 -4.266 17856 3662 1 11 . 1 1 79 79 GLU H H 79 8.360 8.360 8.107 0.253 17856 3663 1 11 . 1 1 80 80 LYS N N 80 122.143 122.143 119.967 2.176 17856 3664 1 11 . 1 1 80 80 LYS C C 80 176.937 176.937 179.102 -2.165 17856 3665 1 11 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.265 -2.765 17856 3666 1 11 . 1 1 80 80 LYS H H 80 8.231 8.231 7.462 0.769 17856 3667 1 11 . 1 1 81 81 LEU N N 81 122.095 122.095 122.133 -0.038 17856 3668 1 11 . 1 1 81 81 LEU C C 81 177.531 177.531 178.684 -1.153 17856 3669 1 11 . 1 1 81 81 LEU H H 81 8.050 8.050 7.824 0.226 17856 3670 1 11 . 1 1 82 82 ILE N N 82 120.609 120.609 118.070 2.539 17856 3671 1 11 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.364 -4.004 17856 3672 1 11 . 1 1 82 82 ILE H H 82 8.000 8.000 8.199 -0.199 17856 3673 1 11 . 1 1 83 83 GLU N N 83 124.611 124.611 120.232 4.379 17856 3674 1 11 . 1 1 83 83 GLU C C 83 177.298 177.298 179.553 -2.255 17856 3675 1 11 . 1 1 83 83 GLU H H 83 8.380 8.380 8.102 0.278 17856 3676 1 11 . 1 1 84 84 THR N N 84 115.107 115.107 116.095 -0.988 17856 3677 1 11 . 1 1 84 84 THR C C 84 174.400 174.400 175.608 -1.208 17856 3678 1 11 . 1 1 84 84 THR CA C 84 62.659 62.659 66.160 -3.501 17856 3679 1 11 . 1 1 84 84 THR H H 84 8.064 8.064 8.102 -0.038 17856 3680 1 11 . 1 1 85 85 LEU N N 85 124.150 124.150 119.508 4.642 17856 3681 1 11 . 1 1 85 85 LEU C C 85 177.120 177.120 176.923 0.197 17856 3682 1 11 . 1 1 85 85 LEU CA C 85 55.020 55.020 55.524 -0.504 17856 3683 1 11 . 1 1 85 85 LEU H H 85 8.238 8.238 7.366 0.872 17856 3684 1 11 . 1 1 86 86 SER N N 86 114.913 114.913 114.781 0.132 17856 3685 1 11 . 1 1 86 86 SER H H 86 7.678 7.678 7.484 0.194 17856 3686 1 11 . 1 1 87 87 PRO CA C 87 63.550 63.550 64.478 -0.929 17856 3687 1 11 . 1 1 88 88 ALA N N 88 123.767 123.767 119.800 3.967 17856 3688 1 11 . 1 1 88 88 ALA C C 88 178.131 178.131 176.983 1.148 17856 3689 1 11 . 1 1 88 88 ALA CA C 88 52.878 52.878 52.105 0.773 17856 3690 1 11 . 1 1 88 88 ALA H H 88 8.342 8.342 7.683 0.659 17856 3691 1 11 . 1 1 89 89 ARG N N 89 119.159 119.159 120.898 -1.739 17856 3692 1 11 . 1 1 89 89 ARG C C 89 176.620 176.620 176.528 0.092 17856 3693 1 11 . 1 1 89 89 ARG H H 89 8.133 8.133 8.516 -0.383 17856 3694 1 11 . 1 1 90 90 SER N N 90 116.910 116.910 117.302 -0.392 17856 3695 1 11 . 1 1 90 90 SER C C 90 174.887 174.887 173.906 0.981 17856 3696 1 11 . 1 1 90 90 SER H H 90 8.322 8.322 8.400 -0.078 17856 3697 1 11 . 1 1 91 91 LYS N N 91 123.457 123.457 125.373 -1.916 17856 3698 1 11 . 1 1 91 91 LYS C C 91 176.970 176.970 175.682 1.288 17856 3699 1 11 . 1 1 91 91 LYS H H 91 8.396 8.396 8.256 0.140 17856 3700 1 11 . 1 1 92 92 SER N N 92 116.692 116.692 117.622 -0.930 17856 3701 1 11 . 1 1 92 92 SER C C 92 174.573 174.573 175.029 -0.456 17856 3702 1 11 . 1 1 92 92 SER CA C 92 58.600 58.600 57.882 0.718 17856 3703 1 11 . 1 1 92 92 SER H H 92 8.297 8.297 8.542 -0.245 17856 3704 1 11 . 1 1 93 93 GLN N N 93 121.916 121.916 124.898 -2.982 17856 3705 1 11 . 1 1 93 93 GLN C C 93 175.971 175.971 175.320 0.651 17856 3706 1 11 . 1 1 93 93 GLN H H 93 8.325 8.325 8.938 -0.613 17856 3707 1 11 . 1 1 94 94 SER N N 94 117.385 117.385 113.064 4.321 17856 3708 1 11 . 1 1 94 94 SER C C 94 173.940 173.940 173.675 0.265 17856 3709 1 11 . 1 1 94 94 SER CA C 94 58.520 58.520 58.644 -0.124 17856 3710 1 11 . 1 1 94 94 SER H H 94 8.352 8.352 7.841 0.511 17856 3711 1 11 . 1 1 95 95 THR N N 95 120.756 120.756 115.658 5.098 17856 3712 1 11 . 1 1 95 95 THR H H 95 7.805 7.805 8.118 -0.313 17856 3713 1 11 . 1 1 99 99 ARG C C 99 176.250 176.250 175.304 0.946 17856 3714 1 11 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.141 0.016 17856 3715 1 11 . 1 1 100 100 ASN N N 100 118.482 118.482 115.183 3.299 17856 3716 1 11 . 1 1 100 100 ASN H H 100 8.272 8.272 8.425 -0.153 17856 3717 1 11 . 1 1 101 101 ARG C C 101 176.280 176.280 175.531 0.749 17856 3718 1 11 . 1 1 102 102 ASN N N 102 118.688 118.688 121.468 -2.780 17856 3719 1 11 . 1 1 102 102 ASN C C 102 174.996 174.996 174.991 0.005 17856 3720 1 11 . 1 1 102 102 ASN CA C 102 53.609 53.609 53.949 -0.340 17856 3721 1 11 . 1 1 102 102 ASN H H 102 8.424 8.424 8.774 -0.350 17856 3722 1 11 . 1 1 103 103 ASN N N 103 118.865 118.865 117.722 1.143 17856 3723 1 11 . 1 1 103 103 ASN C C 103 175.040 175.040 175.169 -0.129 17856 3724 1 11 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.675 0.137 17856 3725 1 11 . 1 1 103 103 ASN H H 103 8.282 8.282 8.468 -0.186 17856 3726 1 11 . 1 1 104 104 ARG N N 104 120.875 120.875 113.928 6.947 17856 3727 1 11 . 1 1 104 104 ARG H H 104 8.140 8.140 8.698 -0.558 17856 3728 1 11 . 1 1 106 106 ILE C C 106 175.408 175.408 175.855 -0.447 17856 3729 1 11 . 1 1 106 106 ILE CA C 106 61.395 61.395 61.796 -0.401 17856 3730 1 12 . 1 1 2 2 SER N N 2 116.304 116.304 120.624 -4.320 17856 3731 1 12 . 1 1 2 2 SER C C 2 174.710 174.710 172.869 1.841 17856 3732 1 12 . 1 1 2 2 SER CA C 2 58.908 58.908 58.285 0.623 17856 3733 1 12 . 1 1 2 2 SER H H 2 8.003 8.003 8.576 -0.573 17856 3734 1 12 . 1 1 3 3 ILE N N 3 122.062 122.062 126.194 -4.132 17856 3735 1 12 . 1 1 3 3 ILE C C 3 176.750 176.750 176.169 0.581 17856 3736 1 12 . 1 1 3 3 ILE CA C 3 61.786 61.786 62.411 -0.625 17856 3737 1 12 . 1 1 3 3 ILE H H 3 7.957 7.957 8.722 -0.765 17856 3738 1 12 . 1 1 4 4 VAL N N 4 122.674 122.674 121.664 1.010 17856 3739 1 12 . 1 1 4 4 VAL C C 4 176.221 176.221 175.737 0.484 17856 3740 1 12 . 1 1 4 4 VAL CA C 4 62.970 62.970 64.638 -1.669 17856 3741 1 12 . 1 1 4 4 VAL H H 4 7.970 7.970 8.464 -0.494 17856 3742 1 12 . 1 1 5 5 SER N N 5 117.750 117.750 112.365 5.385 17856 3743 1 12 . 1 1 5 5 SER C C 5 174.858 174.858 174.959 -0.101 17856 3744 1 12 . 1 1 5 5 SER CA C 5 58.630 58.630 59.690 -1.060 17856 3745 1 12 . 1 1 5 5 SER H H 5 8.093 8.093 8.256 -0.163 17856 3746 1 12 . 1 1 6 6 GLN N N 6 121.961 121.961 121.716 0.245 17856 3747 1 12 . 1 1 6 6 GLN C C 6 176.467 176.467 177.405 -0.938 17856 3748 1 12 . 1 1 6 6 GLN CA C 6 56.226 56.226 57.992 -1.766 17856 3749 1 12 . 1 1 6 6 GLN H H 6 8.371 8.371 7.591 0.780 17856 3750 1 12 . 1 1 7 7 THR N N 7 115.325 115.325 110.348 4.977 17856 3751 1 12 . 1 1 7 7 THR C C 7 174.752 174.752 175.929 -1.177 17856 3752 1 12 . 1 1 7 7 THR H H 7 8.152 8.152 7.964 0.188 17856 3753 1 12 . 1 1 8 8 ARG N N 8 122.530 122.530 121.974 0.556 17856 3754 1 12 . 1 1 8 8 ARG C C 8 176.200 176.200 178.117 -1.917 17856 3755 1 12 . 1 1 8 8 ARG CA C 8 56.570 56.570 58.434 -1.864 17856 3756 1 12 . 1 1 8 8 ARG H H 8 8.211 8.211 8.285 -0.074 17856 3757 1 12 . 1 1 9 9 ASN N N 9 119.600 119.600 118.435 1.165 17856 3758 1 12 . 1 1 9 9 ASN C C 9 177.164 177.164 176.859 0.305 17856 3759 1 12 . 1 1 9 9 ASN H H 9 8.398 8.398 8.099 0.299 17856 3760 1 12 . 1 1 10 10 LYS N N 10 121.600 121.600 120.537 1.063 17856 3761 1 12 . 1 1 10 10 LYS C C 10 176.845 176.845 178.673 -1.828 17856 3762 1 12 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.114 -2.003 17856 3763 1 12 . 1 1 10 10 LYS H H 10 8.190 8.190 7.576 0.614 17856 3764 1 12 . 1 1 11 11 GLU N N 11 120.700 120.700 119.431 1.269 17856 3765 1 12 . 1 1 11 11 GLU C C 11 176.825 176.825 178.931 -2.106 17856 3766 1 12 . 1 1 11 11 GLU CA C 11 56.690 56.690 59.092 -2.402 17856 3767 1 12 . 1 1 11 11 GLU H H 11 8.323 8.323 7.529 0.794 17856 3768 1 12 . 1 1 12 12 LEU N N 12 122.390 122.390 121.723 0.667 17856 3769 1 12 . 1 1 12 12 LEU C C 12 177.670 177.670 178.805 -1.135 17856 3770 1 12 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.334 -2.864 17856 3771 1 12 . 1 1 12 12 LEU H H 12 8.155 8.155 7.800 0.355 17856 3772 1 12 . 1 1 13 13 LEU N N 13 122.570 122.570 116.139 6.431 17856 3773 1 12 . 1 1 13 13 LEU C C 13 177.510 177.510 178.713 -1.203 17856 3774 1 12 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.543 -2.962 17856 3775 1 12 . 1 1 13 13 LEU H H 13 8.220 8.220 8.039 0.181 17856 3776 1 12 . 1 1 14 14 ASP N N 14 120.780 120.780 120.717 0.063 17856 3777 1 12 . 1 1 14 14 ASP C C 14 176.480 176.480 178.648 -2.168 17856 3778 1 12 . 1 1 14 14 ASP CA C 14 54.650 54.650 58.364 -3.714 17856 3779 1 12 . 1 1 14 14 ASP H H 14 8.243 8.243 8.368 -0.125 17856 3780 1 12 . 1 1 15 15 LYS N N 15 120.900 120.900 119.748 1.152 17856 3781 1 12 . 1 1 15 15 LYS C C 15 175.580 175.580 178.823 -3.243 17856 3782 1 12 . 1 1 15 15 LYS H H 15 8.052 8.052 8.120 -0.068 17856 3783 1 12 . 1 1 16 16 LYS N N 16 121.980 121.980 119.959 2.021 17856 3784 1 12 . 1 1 16 16 LYS C C 16 176.887 176.887 179.462 -2.575 17856 3785 1 12 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.777 -2.443 17856 3786 1 12 . 1 1 16 16 LYS H H 16 8.243 8.243 7.525 0.718 17856 3787 1 12 . 1 1 17 17 ILE N N 17 121.940 121.940 120.027 1.913 17856 3788 1 12 . 1 1 17 17 ILE H H 17 8.110 8.110 8.493 -0.383 17856 3789 1 12 . 1 1 18 18 ARG C C 18 176.520 176.520 177.377 -0.857 17856 3790 1 12 . 1 1 19 19 SER N N 19 117.150 117.150 114.077 3.073 17856 3791 1 12 . 1 1 19 19 SER C C 19 175.167 175.167 175.432 -0.265 17856 3792 1 12 . 1 1 19 19 SER CA C 19 58.840 58.840 61.526 -2.686 17856 3793 1 12 . 1 1 19 19 SER H H 19 8.396 8.396 7.989 0.407 17856 3794 1 12 . 1 1 20 20 GLU N N 20 123.176 123.176 122.500 0.676 17856 3795 1 12 . 1 1 20 20 GLU C C 20 176.921 176.921 178.749 -1.828 17856 3796 1 12 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.214 -2.354 17856 3797 1 12 . 1 1 20 20 GLU H H 20 8.478 8.478 7.687 0.791 17856 3798 1 12 . 1 1 21 21 ILE N N 21 120.550 120.550 113.129 7.421 17856 3799 1 12 . 1 1 21 21 ILE C C 21 176.550 176.550 176.981 -0.431 17856 3800 1 12 . 1 1 21 21 ILE CA C 21 61.630 61.630 63.234 -1.604 17856 3801 1 12 . 1 1 21 21 ILE H H 21 8.080 8.080 7.542 0.538 17856 3802 1 12 . 1 1 22 22 GLU N N 22 123.685 123.685 120.358 3.327 17856 3803 1 12 . 1 1 22 22 GLU C C 22 176.109 176.109 178.084 -1.975 17856 3804 1 12 . 1 1 22 22 GLU H H 22 8.309 8.309 7.568 0.741 17856 3805 1 12 . 1 1 23 23 ALA N N 23 124.280 124.280 123.542 0.738 17856 3806 1 12 . 1 1 23 23 ALA C C 23 178.474 178.474 179.585 -1.111 17856 3807 1 12 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.132 -1.726 17856 3808 1 12 . 1 1 23 23 ALA H H 23 8.088 8.088 8.376 -0.288 17856 3809 1 12 . 1 1 24 24 ILE N N 24 120.330 120.330 118.780 1.550 17856 3810 1 12 . 1 1 24 24 ILE C C 24 176.309 176.309 177.695 -1.386 17856 3811 1 12 . 1 1 24 24 ILE CA C 24 61.540 61.540 65.031 -3.491 17856 3812 1 12 . 1 1 24 24 ILE H H 24 7.980 7.980 8.397 -0.417 17856 3813 1 12 . 1 1 25 25 LYS N N 25 124.310 124.310 119.432 4.878 17856 3814 1 12 . 1 1 25 25 LYS C C 25 176.365 176.365 178.524 -2.159 17856 3815 1 12 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.066 -2.732 17856 3816 1 12 . 1 1 25 25 LYS H H 25 8.198 8.198 8.342 -0.144 17856 3817 1 12 . 1 1 26 26 LYS N N 26 122.518 122.518 118.929 3.589 17856 3818 1 12 . 1 1 26 26 LYS C C 26 176.365 176.365 178.353 -1.988 17856 3819 1 12 . 1 1 26 26 LYS CA C 26 56.175 56.175 58.520 -2.345 17856 3820 1 12 . 1 1 26 26 LYS H H 26 8.125 8.125 7.340 0.785 17856 3821 1 12 . 1 1 27 27 ILE N N 27 122.670 122.670 120.568 2.102 17856 3822 1 12 . 1 1 27 27 ILE C C 27 176.261 176.261 178.382 -2.121 17856 3823 1 12 . 1 1 27 27 ILE CA C 27 61.294 61.294 63.950 -2.656 17856 3824 1 12 . 1 1 27 27 ILE H H 27 8.114 8.114 7.839 0.275 17856 3825 1 12 . 1 1 28 28 ILE N N 28 125.178 125.178 119.795 5.383 17856 3826 1 12 . 1 1 28 28 ILE C C 28 175.803 175.803 176.855 -1.052 17856 3827 1 12 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.204 -2.124 17856 3828 1 12 . 1 1 28 28 ILE H H 28 8.220 8.220 7.970 0.250 17856 3829 1 12 . 1 1 29 29 ALA N N 29 127.850 127.850 121.748 6.102 17856 3830 1 12 . 1 1 29 29 ALA C C 29 177.627 177.627 179.609 -1.982 17856 3831 1 12 . 1 1 29 29 ALA CA C 29 53.684 53.684 54.881 -1.197 17856 3832 1 12 . 1 1 29 29 ALA H H 29 8.300 8.300 7.347 0.953 17856 3833 1 12 . 1 1 30 30 GLU N N 30 120.000 120.000 118.513 1.487 17856 3834 1 12 . 1 1 30 30 GLU C C 30 176.321 176.321 178.504 -2.183 17856 3835 1 12 . 1 1 30 30 GLU H H 30 8.258 8.258 7.765 0.493 17856 3836 1 12 . 1 1 31 31 PHE N N 31 119.128 119.128 117.578 1.550 17856 3837 1 12 . 1 1 31 31 PHE C C 31 175.180 175.180 178.160 -2.980 17856 3838 1 12 . 1 1 31 31 PHE CA C 31 57.540 57.540 60.873 -3.333 17856 3839 1 12 . 1 1 31 31 PHE H H 31 8.061 8.061 7.320 0.741 17856 3840 1 12 . 1 1 32 32 ASP N N 32 121.800 121.800 119.611 2.189 17856 3841 1 12 . 1 1 32 32 ASP C C 32 175.894 175.894 178.554 -2.660 17856 3842 1 12 . 1 1 32 32 ASP CA C 32 54.529 54.529 56.982 -2.453 17856 3843 1 12 . 1 1 32 32 ASP H H 32 8.275 8.275 7.664 0.611 17856 3844 1 12 . 1 1 33 33 VAL N N 33 119.648 119.648 119.736 -0.088 17856 3845 1 12 . 1 1 33 33 VAL C C 33 176.268 176.268 178.226 -1.958 17856 3846 1 12 . 1 1 33 33 VAL CA C 33 62.500 62.500 65.882 -3.382 17856 3847 1 12 . 1 1 33 33 VAL H H 33 8.059 8.059 7.543 0.516 17856 3848 1 12 . 1 1 34 34 VAL N N 34 123.882 123.882 117.001 6.881 17856 3849 1 12 . 1 1 34 34 VAL H H 34 7.774 7.774 8.084 -0.310 17856 3850 1 12 . 1 1 35 35 LYS N N 35 125.250 125.250 118.440 6.810 17856 3851 1 12 . 1 1 35 35 LYS C C 35 176.719 176.719 177.421 -0.702 17856 3852 1 12 . 1 1 35 35 LYS CA C 35 56.502 56.502 58.032 -1.530 17856 3853 1 12 . 1 1 35 35 LYS H H 35 8.357 8.357 7.540 0.817 17856 3854 1 12 . 1 1 36 36 GLU N N 36 121.850 121.850 118.020 3.830 17856 3855 1 12 . 1 1 36 36 GLU C C 36 176.426 176.426 176.584 -0.158 17856 3856 1 12 . 1 1 36 36 GLU H H 36 8.423 8.423 7.740 0.683 17856 3857 1 12 . 1 1 37 37 SER N N 37 117.100 117.100 115.356 1.744 17856 3858 1 12 . 1 1 37 37 SER C C 37 174.854 174.854 174.967 -0.113 17856 3859 1 12 . 1 1 37 37 SER CA C 37 58.850 58.850 57.308 1.542 17856 3860 1 12 . 1 1 37 37 SER H H 37 8.362 8.362 7.579 0.783 17856 3861 1 12 . 1 1 38 38 VAL N N 38 121.625 121.625 121.874 -0.249 17856 3862 1 12 . 1 1 38 38 VAL C C 38 176.246 176.246 174.823 1.423 17856 3863 1 12 . 1 1 38 38 VAL CA C 38 63.043 63.043 62.038 1.005 17856 3864 1 12 . 1 1 38 38 VAL H H 38 8.225 8.225 8.074 0.151 17856 3865 1 12 . 1 1 39 39 ASN N N 39 121.150 121.150 114.857 6.293 17856 3866 1 12 . 1 1 39 39 ASN C C 39 175.459 175.459 176.151 -0.692 17856 3867 1 12 . 1 1 39 39 ASN CA C 39 53.568 53.568 52.787 0.781 17856 3868 1 12 . 1 1 39 39 ASN H H 39 8.366 8.366 7.988 0.378 17856 3869 1 12 . 1 1 40 40 GLU N N 40 121.500 121.500 122.478 -0.978 17856 3870 1 12 . 1 1 40 40 GLU C C 40 175.459 175.459 178.318 -2.859 17856 3871 1 12 . 1 1 40 40 GLU CA C 40 56.860 56.860 59.569 -2.709 17856 3872 1 12 . 1 1 40 40 GLU H H 40 8.370 8.370 8.101 0.269 17856 3873 1 12 . 1 1 41 41 LEU N N 41 121.950 121.950 118.196 3.754 17856 3874 1 12 . 1 1 41 41 LEU C C 41 177.939 177.939 178.065 -0.126 17856 3875 1 12 . 1 1 41 41 LEU CA C 41 56.040 56.040 57.280 -1.240 17856 3876 1 12 . 1 1 41 41 LEU H H 41 8.152 8.152 8.261 -0.109 17856 3877 1 12 . 1 1 42 42 SER N N 42 113.326 113.326 114.795 -1.469 17856 3878 1 12 . 1 1 42 42 SER C C 42 174.660 174.660 176.600 -1.940 17856 3879 1 12 . 1 1 42 42 SER CA C 42 58.940 58.940 61.035 -2.095 17856 3880 1 12 . 1 1 42 42 SER H H 42 8.373 8.373 7.483 0.890 17856 3881 1 12 . 1 1 43 43 GLU N N 43 121.521 121.521 121.059 0.462 17856 3882 1 12 . 1 1 43 43 GLU C C 43 177.349 177.349 178.494 -1.145 17856 3883 1 12 . 1 1 43 43 GLU H H 43 7.329 7.329 7.998 -0.669 17856 3884 1 12 . 1 1 44 44 LYS N N 44 121.240 121.240 119.132 2.108 17856 3885 1 12 . 1 1 44 44 LYS C C 44 177.246 177.246 178.440 -1.194 17856 3886 1 12 . 1 1 44 44 LYS CA C 44 56.397 56.397 59.140 -2.743 17856 3887 1 12 . 1 1 44 44 LYS H H 44 8.103 8.103 7.528 0.575 17856 3888 1 12 . 1 1 45 45 ALA N N 45 119.568 119.568 121.838 -2.270 17856 3889 1 12 . 1 1 45 45 ALA C C 45 177.853 177.853 179.234 -1.381 17856 3890 1 12 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.837 -2.277 17856 3891 1 12 . 1 1 45 45 ALA H H 45 8.541 8.541 7.379 1.162 17856 3892 1 12 . 1 1 46 46 LYS N N 46 115.235 115.235 117.242 -2.007 17856 3893 1 12 . 1 1 46 46 LYS C C 46 177.110 177.110 178.643 -1.533 17856 3894 1 12 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.788 -1.992 17856 3895 1 12 . 1 1 46 46 LYS H H 46 7.257 7.257 7.540 -0.283 17856 3896 1 12 . 1 1 47 47 THR N N 47 103.239 103.239 111.181 -7.942 17856 3897 1 12 . 1 1 47 47 THR C C 47 173.973 173.973 175.133 -1.160 17856 3898 1 12 . 1 1 47 47 THR CA C 47 62.740 62.740 63.198 -0.458 17856 3899 1 12 . 1 1 47 47 THR H H 47 7.381 7.381 7.615 -0.234 17856 3900 1 12 . 1 1 48 48 ASP N N 48 122.976 122.976 122.639 0.337 17856 3901 1 12 . 1 1 48 48 ASP H H 48 8.031 8.031 7.934 0.097 17856 3902 1 12 . 1 1 49 49 PRO C C 49 178.106 178.106 178.430 -0.324 17856 3903 1 12 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.848 -0.629 17856 3904 1 12 . 1 1 50 50 GLN N N 50 118.351 118.351 118.196 0.155 17856 3905 1 12 . 1 1 50 50 GLN C C 50 176.944 176.944 178.270 -1.326 17856 3906 1 12 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.660 -1.860 17856 3907 1 12 . 1 1 50 50 GLN H H 50 8.304 8.304 8.082 0.222 17856 3908 1 12 . 1 1 51 51 ALA N N 51 124.206 124.206 121.896 2.310 17856 3909 1 12 . 1 1 51 51 ALA C C 51 178.490 178.490 179.046 -0.556 17856 3910 1 12 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.739 -1.315 17856 3911 1 12 . 1 1 51 51 ALA H H 51 7.547 7.547 7.528 0.019 17856 3912 1 12 . 1 1 52 52 ALA N N 52 118.686 118.686 119.815 -1.129 17856 3913 1 12 . 1 1 52 52 ALA C C 52 177.953 177.953 178.848 -0.895 17856 3914 1 12 . 1 1 52 52 ALA H H 52 7.931 7.931 7.518 0.413 17856 3915 1 12 . 1 1 53 53 GLU N N 53 120.075 120.075 117.958 2.117 17856 3916 1 12 . 1 1 53 53 GLU H H 53 7.729 7.729 7.699 0.030 17856 3917 1 12 . 1 1 55 55 LEU N N 55 123.640 123.640 118.134 5.506 17856 3918 1 12 . 1 1 55 55 LEU C C 55 177.587 177.587 177.462 0.125 17856 3919 1 12 . 1 1 55 55 LEU CA C 55 55.787 55.787 56.404 -0.617 17856 3920 1 12 . 1 1 55 55 LEU H H 55 8.215 8.215 8.390 -0.175 17856 3921 1 12 . 1 1 56 56 ASN N N 56 118.520 118.520 117.506 1.014 17856 3922 1 12 . 1 1 56 56 ASN C C 56 175.700 175.700 176.170 -0.470 17856 3923 1 12 . 1 1 56 56 ASN CA C 56 54.132 54.132 55.032 -0.900 17856 3924 1 12 . 1 1 56 56 ASN H H 56 8.250 8.250 7.557 0.693 17856 3925 1 12 . 1 1 57 57 LYS N N 57 120.960 120.960 114.952 6.008 17856 3926 1 12 . 1 1 57 57 LYS C C 57 176.637 176.637 177.884 -1.247 17856 3927 1 12 . 1 1 57 57 LYS H H 57 8.065 8.065 7.666 0.399 17856 3928 1 12 . 1 1 58 58 LEU N N 58 122.610 122.610 122.757 -0.147 17856 3929 1 12 . 1 1 58 58 LEU C C 58 177.433 177.433 176.610 0.823 17856 3930 1 12 . 1 1 58 58 LEU CA C 58 55.120 55.120 55.823 -0.703 17856 3931 1 12 . 1 1 58 58 LEU H H 58 8.135 8.135 7.945 0.190 17856 3932 1 12 . 1 1 59 59 ILE N N 59 122.045 122.045 117.630 4.415 17856 3933 1 12 . 1 1 59 59 ILE CA C 59 61.535 61.535 61.054 0.481 17856 3934 1 12 . 1 1 59 59 ILE H H 59 8.220 8.220 7.292 0.928 17856 3935 1 12 . 1 1 60 60 GLU N N 60 124.000 124.000 123.799 0.201 17856 3936 1 12 . 1 1 60 60 GLU C C 60 177.007 177.007 176.357 0.650 17856 3937 1 12 . 1 1 60 60 GLU CA C 60 56.722 56.722 56.806 -0.084 17856 3938 1 12 . 1 1 60 60 GLU H H 60 8.340 8.340 7.750 0.590 17856 3939 1 12 . 1 1 61 61 GLY N N 61 110.520 110.520 110.399 0.121 17856 3940 1 12 . 1 1 61 61 GLY C C 61 174.002 174.002 172.433 1.569 17856 3941 1 12 . 1 1 61 61 GLY CA C 61 45.405 45.405 44.554 0.851 17856 3942 1 12 . 1 1 61 61 GLY H H 61 8.557 8.557 8.051 0.506 17856 3943 1 12 . 1 1 62 62 TYR N N 62 119.600 119.600 121.627 -2.027 17856 3944 1 12 . 1 1 62 62 TYR C C 62 175.940 175.940 174.950 0.990 17856 3945 1 12 . 1 1 62 62 TYR CA C 62 58.108 58.108 57.106 1.002 17856 3946 1 12 . 1 1 62 62 TYR H H 62 7.980 7.980 8.310 -0.330 17856 3947 1 12 . 1 1 63 63 THR N N 63 116.304 116.304 116.362 -0.058 17856 3948 1 12 . 1 1 63 63 THR C C 63 173.796 173.796 173.609 0.187 17856 3949 1 12 . 1 1 63 63 THR H H 63 8.049 8.049 7.910 0.139 17856 3950 1 12 . 1 1 64 64 TYR N N 64 122.050 122.050 121.513 0.537 17856 3951 1 12 . 1 1 64 64 TYR C C 64 176.290 176.290 176.389 -0.099 17856 3952 1 12 . 1 1 64 64 TYR CA C 64 58.533 58.533 57.171 1.362 17856 3953 1 12 . 1 1 64 64 TYR H H 64 8.133 8.133 8.041 0.092 17856 3954 1 12 . 1 1 65 65 GLY N N 65 110.456 110.456 109.211 1.245 17856 3955 1 12 . 1 1 65 65 GLY C C 65 174.340 174.340 175.554 -1.214 17856 3956 1 12 . 1 1 65 65 GLY CA C 65 45.328 45.328 46.156 -0.828 17856 3957 1 12 . 1 1 65 65 GLY H H 65 7.747 7.747 8.018 -0.271 17856 3958 1 12 . 1 1 66 66 GLU N N 66 120.783 120.783 119.914 0.869 17856 3959 1 12 . 1 1 66 66 GLU C C 66 176.895 176.895 178.224 -1.329 17856 3960 1 12 . 1 1 66 66 GLU CA C 66 56.804 56.804 58.651 -1.847 17856 3961 1 12 . 1 1 66 66 GLU H H 66 8.243 8.243 8.418 -0.175 17856 3962 1 12 . 1 1 67 67 GLU N N 67 121.587 121.587 116.534 5.053 17856 3963 1 12 . 1 1 67 67 GLU C C 67 176.340 176.340 178.052 -1.712 17856 3964 1 12 . 1 1 67 67 GLU H H 67 8.611 8.611 8.348 0.263 17856 3965 1 12 . 1 1 68 68 ARG N N 68 121.790 121.790 120.366 1.424 17856 3966 1 12 . 1 1 68 68 ARG C C 68 176.350 176.350 178.880 -2.530 17856 3967 1 12 . 1 1 68 68 ARG H H 68 8.267 8.267 7.593 0.674 17856 3968 1 12 . 1 1 69 69 LYS N N 69 118.431 118.431 119.049 -0.618 17856 3969 1 12 . 1 1 69 69 LYS H H 69 7.567 7.567 7.736 -0.169 17856 3970 1 12 . 1 1 70 70 LEU C C 70 177.338 177.338 177.567 -0.229 17856 3971 1 12 . 1 1 70 70 LEU CA C 70 55.533 55.533 56.353 -0.820 17856 3972 1 12 . 1 1 71 71 TYR N N 71 119.504 119.504 116.594 2.910 17856 3973 1 12 . 1 1 71 71 TYR H H 71 7.997 7.997 7.331 0.666 17856 3974 1 12 . 1 1 72 72 ASP C C 72 176.528 176.528 178.202 -1.674 17856 3975 1 12 . 1 1 72 72 ASP CA C 72 54.693 54.693 56.781 -2.088 17856 3976 1 12 . 1 1 73 73 SER N N 73 117.000 117.000 114.570 2.430 17856 3977 1 12 . 1 1 73 73 SER C C 73 174.950 174.950 175.611 -0.661 17856 3978 1 12 . 1 1 73 73 SER CA C 73 58.997 58.997 60.498 -1.501 17856 3979 1 12 . 1 1 73 73 SER H H 73 8.282 8.282 7.583 0.699 17856 3980 1 12 . 1 1 74 74 ALA N N 74 125.422 125.422 124.583 0.839 17856 3981 1 12 . 1 1 74 74 ALA C C 74 178.389 178.389 179.332 -0.943 17856 3982 1 12 . 1 1 74 74 ALA CA C 74 53.433 53.433 54.728 -1.295 17856 3983 1 12 . 1 1 74 74 ALA H H 74 8.339 8.339 7.270 1.069 17856 3984 1 12 . 1 1 75 75 LEU N N 75 120.019 120.019 118.890 1.129 17856 3985 1 12 . 1 1 75 75 LEU C C 75 177.954 177.954 178.590 -0.636 17856 3986 1 12 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.259 -1.479 17856 3987 1 12 . 1 1 75 75 LEU H H 75 7.948 7.948 7.650 0.298 17856 3988 1 12 . 1 1 76 76 SER N N 76 113.321 113.321 114.874 -1.553 17856 3989 1 12 . 1 1 76 76 SER C C 76 174.784 174.784 176.709 -1.925 17856 3990 1 12 . 1 1 76 76 SER CA C 76 59.173 59.173 61.917 -2.744 17856 3991 1 12 . 1 1 76 76 SER H H 76 7.951 7.951 7.751 0.200 17856 3992 1 12 . 1 1 77 77 LYS N N 77 122.710 122.710 121.788 0.922 17856 3993 1 12 . 1 1 77 77 LYS C C 77 176.734 176.734 179.002 -2.268 17856 3994 1 12 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.197 -0.807 17856 3995 1 12 . 1 1 77 77 LYS H H 77 8.170 8.170 7.282 0.888 17856 3996 1 12 . 1 1 78 78 ILE N N 78 121.521 121.521 119.451 2.070 17856 3997 1 12 . 1 1 78 78 ILE C C 78 176.512 176.512 177.905 -1.393 17856 3998 1 12 . 1 1 78 78 ILE H H 78 8.160 8.160 7.471 0.689 17856 3999 1 12 . 1 1 79 79 GLU N N 79 123.840 123.840 120.971 2.869 17856 4000 1 12 . 1 1 79 79 GLU CA C 79 55.478 55.478 60.041 -4.563 17856 4001 1 12 . 1 1 79 79 GLU H H 79 8.360 8.360 8.054 0.306 17856 4002 1 12 . 1 1 80 80 LYS N N 80 122.143 122.143 119.563 2.580 17856 4003 1 12 . 1 1 80 80 LYS C C 80 176.937 176.937 179.117 -2.180 17856 4004 1 12 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.263 -2.763 17856 4005 1 12 . 1 1 80 80 LYS H H 80 8.231 8.231 7.600 0.631 17856 4006 1 12 . 1 1 81 81 LEU N N 81 122.095 122.095 121.681 0.414 17856 4007 1 12 . 1 1 81 81 LEU C C 81 177.531 177.531 178.730 -1.199 17856 4008 1 12 . 1 1 81 81 LEU H H 81 8.050 8.050 7.647 0.403 17856 4009 1 12 . 1 1 82 82 ILE N N 82 120.609 120.609 118.251 2.358 17856 4010 1 12 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.311 -3.951 17856 4011 1 12 . 1 1 82 82 ILE H H 82 8.000 8.000 8.052 -0.052 17856 4012 1 12 . 1 1 83 83 GLU N N 83 124.611 124.611 119.970 4.641 17856 4013 1 12 . 1 1 83 83 GLU C C 83 177.298 177.298 179.572 -2.274 17856 4014 1 12 . 1 1 83 83 GLU H H 83 8.380 8.380 7.999 0.381 17856 4015 1 12 . 1 1 84 84 THR N N 84 115.107 115.107 114.765 0.342 17856 4016 1 12 . 1 1 84 84 THR C C 84 174.400 174.400 175.097 -0.697 17856 4017 1 12 . 1 1 84 84 THR CA C 84 62.659 62.659 65.193 -2.534 17856 4018 1 12 . 1 1 84 84 THR H H 84 8.064 8.064 7.997 0.067 17856 4019 1 12 . 1 1 85 85 LEU N N 85 124.150 124.150 120.075 4.075 17856 4020 1 12 . 1 1 85 85 LEU C C 85 177.120 177.120 176.855 0.265 17856 4021 1 12 . 1 1 85 85 LEU CA C 85 55.020 55.020 55.019 0.001 17856 4022 1 12 . 1 1 85 85 LEU H H 85 8.238 8.238 7.155 1.083 17856 4023 1 12 . 1 1 86 86 SER N N 86 114.913 114.913 115.530 -0.617 17856 4024 1 12 . 1 1 86 86 SER H H 86 7.678 7.678 7.527 0.151 17856 4025 1 12 . 1 1 87 87 PRO CA C 87 63.550 63.550 63.853 -0.303 17856 4026 1 12 . 1 1 88 88 ALA N N 88 123.767 123.767 117.687 6.080 17856 4027 1 12 . 1 1 88 88 ALA C C 88 178.131 178.131 177.193 0.938 17856 4028 1 12 . 1 1 88 88 ALA CA C 88 52.878 52.878 53.666 -0.788 17856 4029 1 12 . 1 1 88 88 ALA H H 88 8.342 8.342 8.479 -0.137 17856 4030 1 12 . 1 1 89 89 ARG N N 89 119.159 119.159 123.126 -3.967 17856 4031 1 12 . 1 1 89 89 ARG C C 89 176.620 176.620 175.414 1.206 17856 4032 1 12 . 1 1 89 89 ARG H H 89 8.133 8.133 8.128 0.005 17856 4033 1 12 . 1 1 90 90 SER N N 90 116.910 116.910 120.728 -3.818 17856 4034 1 12 . 1 1 90 90 SER C C 90 174.887 174.887 174.679 0.208 17856 4035 1 12 . 1 1 90 90 SER H H 90 8.322 8.322 8.684 -0.362 17856 4036 1 12 . 1 1 91 91 LYS N N 91 123.457 123.457 126.853 -3.396 17856 4037 1 12 . 1 1 91 91 LYS C C 91 176.970 176.970 175.985 0.985 17856 4038 1 12 . 1 1 91 91 LYS H H 91 8.396 8.396 8.720 -0.324 17856 4039 1 12 . 1 1 92 92 SER N N 92 116.692 116.692 120.653 -3.961 17856 4040 1 12 . 1 1 92 92 SER C C 92 174.573 174.573 174.070 0.503 17856 4041 1 12 . 1 1 92 92 SER CA C 92 58.600 58.600 59.203 -0.603 17856 4042 1 12 . 1 1 92 92 SER H H 92 8.297 8.297 8.509 -0.212 17856 4043 1 12 . 1 1 93 93 GLN N N 93 121.916 121.916 123.390 -1.474 17856 4044 1 12 . 1 1 93 93 GLN C C 93 175.971 175.971 175.555 0.416 17856 4045 1 12 . 1 1 93 93 GLN H H 93 8.325 8.325 8.043 0.282 17856 4046 1 12 . 1 1 94 94 SER N N 94 117.385 117.385 115.626 1.759 17856 4047 1 12 . 1 1 94 94 SER C C 94 173.940 173.940 174.016 -0.076 17856 4048 1 12 . 1 1 94 94 SER CA C 94 58.520 58.520 58.728 -0.208 17856 4049 1 12 . 1 1 94 94 SER H H 94 8.352 8.352 8.357 -0.005 17856 4050 1 12 . 1 1 95 95 THR N N 95 120.756 120.756 115.471 5.285 17856 4051 1 12 . 1 1 95 95 THR H H 95 7.805 7.805 7.942 -0.137 17856 4052 1 12 . 1 1 99 99 ARG C C 99 176.250 176.250 174.807 1.443 17856 4053 1 12 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.235 -0.078 17856 4054 1 12 . 1 1 100 100 ASN N N 100 118.482 118.482 120.640 -2.158 17856 4055 1 12 . 1 1 100 100 ASN H H 100 8.272 8.272 8.649 -0.378 17856 4056 1 12 . 1 1 101 101 ARG C C 101 176.280 176.280 175.887 0.393 17856 4057 1 12 . 1 1 102 102 ASN N N 102 118.688 118.688 123.251 -4.563 17856 4058 1 12 . 1 1 102 102 ASN C C 102 174.996 174.996 175.099 -0.103 17856 4059 1 12 . 1 1 102 102 ASN CA C 102 53.609 53.609 54.553 -0.944 17856 4060 1 12 . 1 1 102 102 ASN H H 102 8.424 8.424 8.934 -0.510 17856 4061 1 12 . 1 1 103 103 ASN N N 103 118.865 118.865 117.244 1.621 17856 4062 1 12 . 1 1 103 103 ASN C C 103 175.040 175.040 174.656 0.384 17856 4063 1 12 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.573 0.239 17856 4064 1 12 . 1 1 103 103 ASN H H 103 8.282 8.282 8.266 0.016 17856 4065 1 12 . 1 1 104 104 ARG N N 104 120.875 120.875 120.273 0.602 17856 4066 1 12 . 1 1 104 104 ARG H H 104 8.140 8.140 8.566 -0.426 17856 4067 1 12 . 1 1 106 106 ILE C C 106 175.408 175.408 176.071 -0.663 17856 4068 1 12 . 1 1 106 106 ILE CA C 106 61.395 61.395 61.533 -0.138 17856 4069 1 13 . 1 1 2 2 SER N N 2 116.304 116.304 122.818 -6.514 17856 4070 1 13 . 1 1 2 2 SER C C 2 174.710 174.710 174.431 0.279 17856 4071 1 13 . 1 1 2 2 SER CA C 2 58.908 58.908 58.468 0.440 17856 4072 1 13 . 1 1 2 2 SER H H 2 8.003 8.003 8.715 -0.712 17856 4073 1 13 . 1 1 3 3 ILE N N 3 122.062 122.062 123.111 -1.049 17856 4074 1 13 . 1 1 3 3 ILE C C 3 176.750 176.750 175.453 1.297 17856 4075 1 13 . 1 1 3 3 ILE CA C 3 61.786 61.786 61.365 0.421 17856 4076 1 13 . 1 1 3 3 ILE H H 3 7.957 7.957 7.817 0.140 17856 4077 1 13 . 1 1 4 4 VAL N N 4 122.674 122.674 119.035 3.639 17856 4078 1 13 . 1 1 4 4 VAL C C 4 176.221 176.221 175.055 1.166 17856 4079 1 13 . 1 1 4 4 VAL CA C 4 62.970 62.970 61.985 0.985 17856 4080 1 13 . 1 1 4 4 VAL H H 4 7.970 7.970 7.970 -0.000 17856 4081 1 13 . 1 1 5 5 SER N N 5 117.750 117.750 120.978 -3.228 17856 4082 1 13 . 1 1 5 5 SER C C 5 174.858 174.858 173.890 0.968 17856 4083 1 13 . 1 1 5 5 SER CA C 5 58.630 58.630 58.189 0.441 17856 4084 1 13 . 1 1 5 5 SER H H 5 8.093 8.093 8.621 -0.528 17856 4085 1 13 . 1 1 6 6 GLN N N 6 121.961 121.961 120.294 1.667 17856 4086 1 13 . 1 1 6 6 GLN C C 6 176.467 176.467 174.644 1.823 17856 4087 1 13 . 1 1 6 6 GLN CA C 6 56.226 56.226 55.655 0.571 17856 4088 1 13 . 1 1 6 6 GLN H H 6 8.371 8.371 8.222 0.149 17856 4089 1 13 . 1 1 7 7 THR N N 7 115.325 115.325 114.240 1.085 17856 4090 1 13 . 1 1 7 7 THR C C 7 174.752 174.752 174.645 0.107 17856 4091 1 13 . 1 1 7 7 THR H H 7 8.152 8.152 8.369 -0.217 17856 4092 1 13 . 1 1 8 8 ARG N N 8 122.530 122.530 124.128 -1.598 17856 4093 1 13 . 1 1 8 8 ARG C C 8 176.200 176.200 175.663 0.537 17856 4094 1 13 . 1 1 8 8 ARG CA C 8 56.570 56.570 54.408 2.162 17856 4095 1 13 . 1 1 8 8 ARG H H 8 8.211 8.211 8.453 -0.242 17856 4096 1 13 . 1 1 9 9 ASN N N 9 119.600 119.600 122.343 -2.743 17856 4097 1 13 . 1 1 9 9 ASN C C 9 177.164 177.164 176.424 0.740 17856 4098 1 13 . 1 1 9 9 ASN H H 9 8.398 8.398 8.477 -0.079 17856 4099 1 13 . 1 1 10 10 LYS N N 10 121.600 121.600 119.946 1.654 17856 4100 1 13 . 1 1 10 10 LYS C C 10 176.845 176.845 178.798 -1.953 17856 4101 1 13 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.250 -2.140 17856 4102 1 13 . 1 1 10 10 LYS H H 10 8.190 8.190 8.375 -0.185 17856 4103 1 13 . 1 1 11 11 GLU N N 11 120.700 120.700 118.417 2.283 17856 4104 1 13 . 1 1 11 11 GLU C C 11 176.825 176.825 178.622 -1.797 17856 4105 1 13 . 1 1 11 11 GLU CA C 11 56.690 56.690 59.466 -2.776 17856 4106 1 13 . 1 1 11 11 GLU H H 11 8.323 8.323 8.098 0.225 17856 4107 1 13 . 1 1 12 12 LEU N N 12 122.390 122.390 121.515 0.875 17856 4108 1 13 . 1 1 12 12 LEU C C 12 177.670 177.670 179.011 -1.341 17856 4109 1 13 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.200 -2.730 17856 4110 1 13 . 1 1 12 12 LEU H H 12 8.155 8.155 7.959 0.196 17856 4111 1 13 . 1 1 13 13 LEU N N 13 122.570 122.570 116.590 5.980 17856 4112 1 13 . 1 1 13 13 LEU C C 13 177.510 177.510 178.555 -1.045 17856 4113 1 13 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.548 -2.967 17856 4114 1 13 . 1 1 13 13 LEU H H 13 8.220 8.220 8.438 -0.218 17856 4115 1 13 . 1 1 14 14 ASP N N 14 120.780 120.780 120.622 0.158 17856 4116 1 13 . 1 1 14 14 ASP C C 14 176.480 176.480 178.651 -2.171 17856 4117 1 13 . 1 1 14 14 ASP CA C 14 54.650 54.650 58.078 -3.428 17856 4118 1 13 . 1 1 14 14 ASP H H 14 8.243 8.243 8.098 0.145 17856 4119 1 13 . 1 1 15 15 LYS N N 15 120.900 120.900 119.273 1.627 17856 4120 1 13 . 1 1 15 15 LYS C C 15 175.580 175.580 178.949 -3.369 17856 4121 1 13 . 1 1 15 15 LYS H H 15 8.052 8.052 8.124 -0.072 17856 4122 1 13 . 1 1 16 16 LYS N N 16 121.980 121.980 120.181 1.799 17856 4123 1 13 . 1 1 16 16 LYS C C 16 176.887 176.887 178.985 -2.098 17856 4124 1 13 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.635 -2.301 17856 4125 1 13 . 1 1 16 16 LYS H H 16 8.243 8.243 7.716 0.527 17856 4126 1 13 . 1 1 17 17 ILE N N 17 121.940 121.940 119.597 2.343 17856 4127 1 13 . 1 1 17 17 ILE H H 17 8.110 8.110 8.093 0.017 17856 4128 1 13 . 1 1 18 18 ARG C C 18 176.520 176.520 178.579 -2.059 17856 4129 1 13 . 1 1 19 19 SER N N 19 117.150 117.150 114.699 2.451 17856 4130 1 13 . 1 1 19 19 SER C C 19 175.167 175.167 176.506 -1.339 17856 4131 1 13 . 1 1 19 19 SER CA C 19 58.840 58.840 62.000 -3.160 17856 4132 1 13 . 1 1 19 19 SER H H 19 8.396 8.396 7.803 0.593 17856 4133 1 13 . 1 1 20 20 GLU N N 20 123.176 123.176 121.883 1.293 17856 4134 1 13 . 1 1 20 20 GLU C C 20 176.921 176.921 178.929 -2.008 17856 4135 1 13 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.098 -2.238 17856 4136 1 13 . 1 1 20 20 GLU H H 20 8.478 8.478 7.641 0.837 17856 4137 1 13 . 1 1 21 21 ILE N N 21 120.550 120.550 116.168 4.382 17856 4138 1 13 . 1 1 21 21 ILE C C 21 176.550 176.550 178.258 -1.708 17856 4139 1 13 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.953 -3.323 17856 4140 1 13 . 1 1 21 21 ILE H H 21 8.080 8.080 7.610 0.470 17856 4141 1 13 . 1 1 22 22 GLU N N 22 123.685 123.685 120.457 3.228 17856 4142 1 13 . 1 1 22 22 GLU C C 22 176.109 176.109 178.886 -2.777 17856 4143 1 13 . 1 1 22 22 GLU H H 22 8.309 8.309 7.742 0.567 17856 4144 1 13 . 1 1 23 23 ALA N N 23 124.280 124.280 122.507 1.773 17856 4145 1 13 . 1 1 23 23 ALA C C 23 178.474 178.474 179.674 -1.200 17856 4146 1 13 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.002 -1.596 17856 4147 1 13 . 1 1 23 23 ALA H H 23 8.088 8.088 7.853 0.235 17856 4148 1 13 . 1 1 24 24 ILE N N 24 120.330 120.330 118.459 1.871 17856 4149 1 13 . 1 1 24 24 ILE C C 24 176.309 176.309 177.849 -1.540 17856 4150 1 13 . 1 1 24 24 ILE CA C 24 61.540 61.540 65.005 -3.465 17856 4151 1 13 . 1 1 24 24 ILE H H 24 7.980 7.980 8.500 -0.520 17856 4152 1 13 . 1 1 25 25 LYS N N 25 124.310 124.310 120.334 3.976 17856 4153 1 13 . 1 1 25 25 LYS C C 25 176.365 176.365 177.580 -1.215 17856 4154 1 13 . 1 1 25 25 LYS CA C 25 56.334 56.334 58.595 -2.261 17856 4155 1 13 . 1 1 25 25 LYS H H 25 8.198 8.198 7.925 0.273 17856 4156 1 13 . 1 1 26 26 LYS N N 26 122.518 122.518 118.497 4.021 17856 4157 1 13 . 1 1 26 26 LYS C C 26 176.365 176.365 178.076 -1.711 17856 4158 1 13 . 1 1 26 26 LYS CA C 26 56.175 56.175 57.376 -1.201 17856 4159 1 13 . 1 1 26 26 LYS H H 26 8.125 8.125 7.559 0.566 17856 4160 1 13 . 1 1 27 27 ILE N N 27 122.670 122.670 121.282 1.388 17856 4161 1 13 . 1 1 27 27 ILE C C 27 176.261 176.261 178.201 -1.940 17856 4162 1 13 . 1 1 27 27 ILE CA C 27 61.294 61.294 65.627 -4.333 17856 4163 1 13 . 1 1 27 27 ILE H H 27 8.114 8.114 8.088 0.026 17856 4164 1 13 . 1 1 28 28 ILE N N 28 125.178 125.178 118.505 6.673 17856 4165 1 13 . 1 1 28 28 ILE C C 28 175.803 175.803 176.214 -0.411 17856 4166 1 13 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.437 -2.357 17856 4167 1 13 . 1 1 28 28 ILE H H 28 8.220 8.220 8.230 -0.010 17856 4168 1 13 . 1 1 29 29 ALA N N 29 127.850 127.850 122.502 5.348 17856 4169 1 13 . 1 1 29 29 ALA C C 29 177.627 177.627 179.395 -1.768 17856 4170 1 13 . 1 1 29 29 ALA CA C 29 53.684 53.684 54.020 -0.337 17856 4171 1 13 . 1 1 29 29 ALA H H 29 8.300 8.300 7.441 0.859 17856 4172 1 13 . 1 1 30 30 GLU N N 30 120.000 120.000 119.500 0.500 17856 4173 1 13 . 1 1 30 30 GLU C C 30 176.321 176.321 178.740 -2.419 17856 4174 1 13 . 1 1 30 30 GLU H H 30 8.258 8.258 8.195 0.063 17856 4175 1 13 . 1 1 31 31 PHE N N 31 119.128 119.128 118.911 0.217 17856 4176 1 13 . 1 1 31 31 PHE C C 31 175.180 175.180 177.578 -2.398 17856 4177 1 13 . 1 1 31 31 PHE CA C 31 57.540 57.540 62.292 -4.752 17856 4178 1 13 . 1 1 31 31 PHE H H 31 8.061 8.061 7.765 0.296 17856 4179 1 13 . 1 1 32 32 ASP N N 32 121.800 121.800 118.730 3.070 17856 4180 1 13 . 1 1 32 32 ASP C C 32 175.894 175.894 178.143 -2.249 17856 4181 1 13 . 1 1 32 32 ASP CA C 32 54.529 54.529 57.003 -2.474 17856 4182 1 13 . 1 1 32 32 ASP H H 32 8.275 8.275 7.918 0.357 17856 4183 1 13 . 1 1 33 33 VAL N N 33 119.648 119.648 120.318 -0.670 17856 4184 1 13 . 1 1 33 33 VAL C C 33 176.268 176.268 177.420 -1.152 17856 4185 1 13 . 1 1 33 33 VAL CA C 33 62.500 62.500 65.242 -2.742 17856 4186 1 13 . 1 1 33 33 VAL H H 33 8.059 8.059 7.300 0.759 17856 4187 1 13 . 1 1 34 34 VAL N N 34 123.882 123.882 116.874 7.008 17856 4188 1 13 . 1 1 34 34 VAL H H 34 7.774 7.774 8.116 -0.342 17856 4189 1 13 . 1 1 35 35 LYS N N 35 125.250 125.250 119.431 5.819 17856 4190 1 13 . 1 1 35 35 LYS C C 35 176.719 176.719 177.368 -0.649 17856 4191 1 13 . 1 1 35 35 LYS CA C 35 56.502 56.502 59.034 -2.532 17856 4192 1 13 . 1 1 35 35 LYS H H 35 8.357 8.357 7.584 0.773 17856 4193 1 13 . 1 1 36 36 GLU N N 36 121.850 121.850 116.879 4.971 17856 4194 1 13 . 1 1 36 36 GLU C C 36 176.426 176.426 176.636 -0.210 17856 4195 1 13 . 1 1 36 36 GLU H H 36 8.423 8.423 7.715 0.708 17856 4196 1 13 . 1 1 37 37 SER N N 37 117.100 117.100 115.115 1.985 17856 4197 1 13 . 1 1 37 37 SER C C 37 174.854 174.854 174.928 -0.074 17856 4198 1 13 . 1 1 37 37 SER CA C 37 58.850 58.850 59.684 -0.834 17856 4199 1 13 . 1 1 37 37 SER H H 37 8.362 8.362 7.748 0.614 17856 4200 1 13 . 1 1 38 38 VAL N N 38 121.625 121.625 117.074 4.551 17856 4201 1 13 . 1 1 38 38 VAL C C 38 176.246 176.246 174.716 1.530 17856 4202 1 13 . 1 1 38 38 VAL CA C 38 63.043 63.043 61.240 1.803 17856 4203 1 13 . 1 1 38 38 VAL H H 38 8.225 8.225 7.430 0.795 17856 4204 1 13 . 1 1 39 39 ASN N N 39 121.150 121.150 123.751 -2.601 17856 4205 1 13 . 1 1 39 39 ASN C C 39 175.459 175.459 175.919 -0.460 17856 4206 1 13 . 1 1 39 39 ASN CA C 39 53.568 53.568 54.099 -0.531 17856 4207 1 13 . 1 1 39 39 ASN H H 39 8.366 8.366 8.765 -0.399 17856 4208 1 13 . 1 1 40 40 GLU N N 40 121.500 121.500 119.974 1.526 17856 4209 1 13 . 1 1 40 40 GLU C C 40 175.459 175.459 177.543 -2.084 17856 4210 1 13 . 1 1 40 40 GLU CA C 40 56.860 56.860 55.972 0.888 17856 4211 1 13 . 1 1 40 40 GLU H H 40 8.370 8.370 8.450 -0.080 17856 4212 1 13 . 1 1 41 41 LEU N N 41 121.950 121.950 121.243 0.707 17856 4213 1 13 . 1 1 41 41 LEU C C 41 177.939 177.939 177.353 0.586 17856 4214 1 13 . 1 1 41 41 LEU CA C 41 56.040 56.040 57.167 -1.127 17856 4215 1 13 . 1 1 41 41 LEU H H 41 8.152 8.152 8.004 0.148 17856 4216 1 13 . 1 1 42 42 SER N N 42 113.326 113.326 114.456 -1.130 17856 4217 1 13 . 1 1 42 42 SER C C 42 174.660 174.660 176.476 -1.816 17856 4218 1 13 . 1 1 42 42 SER CA C 42 58.940 58.940 61.481 -2.541 17856 4219 1 13 . 1 1 42 42 SER H H 42 8.373 8.373 8.291 0.082 17856 4220 1 13 . 1 1 43 43 GLU N N 43 121.521 121.521 120.617 0.904 17856 4221 1 13 . 1 1 43 43 GLU C C 43 177.349 177.349 177.583 -0.234 17856 4222 1 13 . 1 1 43 43 GLU H H 43 7.329 7.329 7.868 -0.539 17856 4223 1 13 . 1 1 44 44 LYS N N 44 121.240 121.240 119.564 1.676 17856 4224 1 13 . 1 1 44 44 LYS C C 44 177.246 177.246 178.254 -1.008 17856 4225 1 13 . 1 1 44 44 LYS CA C 44 56.397 56.397 58.166 -1.768 17856 4226 1 13 . 1 1 44 44 LYS H H 44 8.103 8.103 7.634 0.469 17856 4227 1 13 . 1 1 45 45 ALA N N 45 119.568 119.568 122.775 -3.207 17856 4228 1 13 . 1 1 45 45 ALA C C 45 177.853 177.853 179.410 -1.557 17856 4229 1 13 . 1 1 45 45 ALA CA C 45 52.560 52.560 55.011 -2.451 17856 4230 1 13 . 1 1 45 45 ALA H H 45 8.541 8.541 7.816 0.725 17856 4231 1 13 . 1 1 46 46 LYS N N 46 115.235 115.235 117.557 -2.322 17856 4232 1 13 . 1 1 46 46 LYS C C 46 177.110 177.110 177.911 -0.801 17856 4233 1 13 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.950 -2.154 17856 4234 1 13 . 1 1 46 46 LYS H H 46 7.257 7.257 8.211 -0.954 17856 4235 1 13 . 1 1 47 47 THR N N 47 103.239 103.239 111.240 -8.001 17856 4236 1 13 . 1 1 47 47 THR C C 47 173.973 173.973 175.016 -1.043 17856 4237 1 13 . 1 1 47 47 THR CA C 47 62.740 62.740 63.458 -0.718 17856 4238 1 13 . 1 1 47 47 THR H H 47 7.381 7.381 7.603 -0.222 17856 4239 1 13 . 1 1 48 48 ASP N N 48 122.976 122.976 122.541 0.435 17856 4240 1 13 . 1 1 48 48 ASP H H 48 8.031 8.031 8.179 -0.148 17856 4241 1 13 . 1 1 49 49 PRO C C 49 178.106 178.106 178.277 -0.171 17856 4242 1 13 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.709 -0.490 17856 4243 1 13 . 1 1 50 50 GLN N N 50 118.351 118.351 118.171 0.180 17856 4244 1 13 . 1 1 50 50 GLN C C 50 176.944 176.944 177.521 -0.577 17856 4245 1 13 . 1 1 50 50 GLN CA C 50 56.800 56.800 57.466 -0.666 17856 4246 1 13 . 1 1 50 50 GLN H H 50 8.304 8.304 9.065 -0.761 17856 4247 1 13 . 1 1 51 51 ALA N N 51 124.206 124.206 123.043 1.163 17856 4248 1 13 . 1 1 51 51 ALA C C 51 178.490 178.490 178.730 -0.240 17856 4249 1 13 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.973 -1.549 17856 4250 1 13 . 1 1 51 51 ALA H H 51 7.547 7.547 7.647 -0.100 17856 4251 1 13 . 1 1 52 52 ALA N N 52 118.686 118.686 120.719 -2.033 17856 4252 1 13 . 1 1 52 52 ALA C C 52 177.953 177.953 178.956 -1.003 17856 4253 1 13 . 1 1 52 52 ALA H H 52 7.931 7.931 7.777 0.154 17856 4254 1 13 . 1 1 53 53 GLU N N 53 120.075 120.075 118.142 1.933 17856 4255 1 13 . 1 1 53 53 GLU H H 53 7.729 7.729 7.928 -0.199 17856 4256 1 13 . 1 1 55 55 LEU N N 55 123.640 123.640 121.929 1.711 17856 4257 1 13 . 1 1 55 55 LEU C C 55 177.587 177.587 178.459 -0.872 17856 4258 1 13 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.604 -1.817 17856 4259 1 13 . 1 1 55 55 LEU H H 55 8.215 8.215 8.333 -0.118 17856 4260 1 13 . 1 1 56 56 ASN N N 56 118.520 118.520 117.149 1.371 17856 4261 1 13 . 1 1 56 56 ASN C C 56 175.700 175.700 177.196 -1.496 17856 4262 1 13 . 1 1 56 56 ASN CA C 56 54.132 54.132 56.043 -1.911 17856 4263 1 13 . 1 1 56 56 ASN H H 56 8.250 8.250 8.464 -0.214 17856 4264 1 13 . 1 1 57 57 LYS N N 57 120.960 120.960 117.058 3.902 17856 4265 1 13 . 1 1 57 57 LYS C C 57 176.637 176.637 176.798 -0.161 17856 4266 1 13 . 1 1 57 57 LYS H H 57 8.065 8.065 7.511 0.554 17856 4267 1 13 . 1 1 58 58 LEU N N 58 122.610 122.610 118.317 4.293 17856 4268 1 13 . 1 1 58 58 LEU C C 58 177.433 177.433 176.625 0.808 17856 4269 1 13 . 1 1 58 58 LEU CA C 58 55.120 55.120 54.094 1.026 17856 4270 1 13 . 1 1 58 58 LEU H H 58 8.135 8.135 7.454 0.681 17856 4271 1 13 . 1 1 59 59 ILE N N 59 122.045 122.045 119.103 2.942 17856 4272 1 13 . 1 1 59 59 ILE CA C 59 61.535 61.535 61.187 0.348 17856 4273 1 13 . 1 1 59 59 ILE H H 59 8.220 8.220 7.241 0.979 17856 4274 1 13 . 1 1 60 60 GLU N N 60 124.000 124.000 121.705 2.295 17856 4275 1 13 . 1 1 60 60 GLU C C 60 177.007 177.007 176.115 0.892 17856 4276 1 13 . 1 1 60 60 GLU CA C 60 56.722 56.722 55.971 0.751 17856 4277 1 13 . 1 1 60 60 GLU H H 60 8.340 8.340 8.311 0.029 17856 4278 1 13 . 1 1 61 61 GLY N N 61 110.520 110.520 111.399 -0.879 17856 4279 1 13 . 1 1 61 61 GLY C C 61 174.002 174.002 174.133 -0.131 17856 4280 1 13 . 1 1 61 61 GLY CA C 61 45.405 45.405 45.411 -0.006 17856 4281 1 13 . 1 1 61 61 GLY H H 61 8.557 8.557 8.468 0.089 17856 4282 1 13 . 1 1 62 62 TYR N N 62 119.600 119.600 119.442 0.158 17856 4283 1 13 . 1 1 62 62 TYR C C 62 175.940 175.940 176.170 -0.230 17856 4284 1 13 . 1 1 62 62 TYR CA C 62 58.108 58.108 57.362 0.746 17856 4285 1 13 . 1 1 62 62 TYR H H 62 7.980 7.980 8.519 -0.539 17856 4286 1 13 . 1 1 63 63 THR N N 63 116.304 116.304 116.321 -0.017 17856 4287 1 13 . 1 1 63 63 THR C C 63 173.796 173.796 173.895 -0.099 17856 4288 1 13 . 1 1 63 63 THR H H 63 8.049 8.049 7.949 0.100 17856 4289 1 13 . 1 1 64 64 TYR N N 64 122.050 122.050 126.936 -4.886 17856 4290 1 13 . 1 1 64 64 TYR C C 64 176.290 176.290 174.711 1.579 17856 4291 1 13 . 1 1 64 64 TYR CA C 64 58.533 58.533 58.456 0.077 17856 4292 1 13 . 1 1 64 64 TYR H H 64 8.133 8.133 8.128 0.005 17856 4293 1 13 . 1 1 65 65 GLY N N 65 110.456 110.456 110.471 -0.015 17856 4294 1 13 . 1 1 65 65 GLY C C 65 174.340 174.340 175.046 -0.706 17856 4295 1 13 . 1 1 65 65 GLY CA C 65 45.328 45.328 46.194 -0.866 17856 4296 1 13 . 1 1 65 65 GLY H H 65 7.747 7.747 8.366 -0.619 17856 4297 1 13 . 1 1 66 66 GLU N N 66 120.783 120.783 119.885 0.898 17856 4298 1 13 . 1 1 66 66 GLU C C 66 176.895 176.895 176.321 0.574 17856 4299 1 13 . 1 1 66 66 GLU CA C 66 56.804 56.804 57.164 -0.360 17856 4300 1 13 . 1 1 66 66 GLU H H 66 8.243 8.243 8.737 -0.494 17856 4301 1 13 . 1 1 67 67 GLU N N 67 121.587 121.587 119.878 1.709 17856 4302 1 13 . 1 1 67 67 GLU C C 67 176.340 176.340 177.283 -0.943 17856 4303 1 13 . 1 1 67 67 GLU H H 67 8.611 8.611 8.655 -0.044 17856 4304 1 13 . 1 1 68 68 ARG N N 68 121.790 121.790 121.227 0.563 17856 4305 1 13 . 1 1 68 68 ARG C C 68 176.350 176.350 176.274 0.076 17856 4306 1 13 . 1 1 68 68 ARG H H 68 8.267 8.267 7.796 0.471 17856 4307 1 13 . 1 1 69 69 LYS N N 69 118.431 118.431 120.723 -2.292 17856 4308 1 13 . 1 1 69 69 LYS H H 69 7.567 7.567 8.391 -0.824 17856 4309 1 13 . 1 1 70 70 LEU C C 70 177.338 177.338 179.213 -1.875 17856 4310 1 13 . 1 1 70 70 LEU CA C 70 55.533 55.533 57.106 -1.573 17856 4311 1 13 . 1 1 71 71 TYR N N 71 119.504 119.504 116.461 3.043 17856 4312 1 13 . 1 1 71 71 TYR H H 71 7.997 7.997 8.105 -0.108 17856 4313 1 13 . 1 1 72 72 ASP C C 72 176.528 176.528 178.417 -1.889 17856 4314 1 13 . 1 1 72 72 ASP CA C 72 54.693 54.693 57.205 -2.512 17856 4315 1 13 . 1 1 73 73 SER N N 73 117.000 117.000 115.805 1.195 17856 4316 1 13 . 1 1 73 73 SER C C 73 174.950 174.950 176.286 -1.336 17856 4317 1 13 . 1 1 73 73 SER CA C 73 58.997 58.997 61.296 -2.299 17856 4318 1 13 . 1 1 73 73 SER H H 73 8.282 8.282 7.791 0.491 17856 4319 1 13 . 1 1 74 74 ALA N N 74 125.422 125.422 124.379 1.043 17856 4320 1 13 . 1 1 74 74 ALA C C 74 178.389 178.389 179.458 -1.069 17856 4321 1 13 . 1 1 74 74 ALA CA C 74 53.433 53.433 55.088 -1.655 17856 4322 1 13 . 1 1 74 74 ALA H H 74 8.339 8.339 7.571 0.768 17856 4323 1 13 . 1 1 75 75 LEU N N 75 120.019 120.019 119.047 0.972 17856 4324 1 13 . 1 1 75 75 LEU C C 75 177.954 177.954 178.925 -0.971 17856 4325 1 13 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.427 -1.647 17856 4326 1 13 . 1 1 75 75 LEU H H 75 7.948 7.948 7.392 0.556 17856 4327 1 13 . 1 1 76 76 SER N N 76 113.321 113.321 114.973 -1.652 17856 4328 1 13 . 1 1 76 76 SER C C 76 174.784 174.784 177.052 -2.268 17856 4329 1 13 . 1 1 76 76 SER CA C 76 59.173 59.173 61.602 -2.429 17856 4330 1 13 . 1 1 76 76 SER H H 76 7.951 7.951 7.940 0.011 17856 4331 1 13 . 1 1 77 77 LYS N N 77 122.710 122.710 121.633 1.077 17856 4332 1 13 . 1 1 77 77 LYS C C 77 176.734 176.734 179.066 -2.332 17856 4333 1 13 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.191 -0.802 17856 4334 1 13 . 1 1 77 77 LYS H H 77 8.170 8.170 7.356 0.814 17856 4335 1 13 . 1 1 78 78 ILE N N 78 121.521 121.521 119.771 1.750 17856 4336 1 13 . 1 1 78 78 ILE C C 78 176.512 176.512 178.134 -1.622 17856 4337 1 13 . 1 1 78 78 ILE H H 78 8.160 8.160 7.604 0.556 17856 4338 1 13 . 1 1 79 79 GLU N N 79 123.840 123.840 120.258 3.582 17856 4339 1 13 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.907 -4.429 17856 4340 1 13 . 1 1 79 79 GLU H H 79 8.360 8.360 8.037 0.323 17856 4341 1 13 . 1 1 80 80 LYS N N 80 122.143 122.143 119.066 3.077 17856 4342 1 13 . 1 1 80 80 LYS C C 80 176.937 176.937 179.007 -2.070 17856 4343 1 13 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.342 -2.842 17856 4344 1 13 . 1 1 80 80 LYS H H 80 8.231 8.231 7.591 0.640 17856 4345 1 13 . 1 1 81 81 LEU N N 81 122.095 122.095 121.984 0.111 17856 4346 1 13 . 1 1 81 81 LEU C C 81 177.531 177.531 178.772 -1.241 17856 4347 1 13 . 1 1 81 81 LEU H H 81 8.050 8.050 7.830 0.220 17856 4348 1 13 . 1 1 82 82 ILE N N 82 120.609 120.609 118.968 1.641 17856 4349 1 13 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.549 -4.189 17856 4350 1 13 . 1 1 82 82 ILE H H 82 8.000 8.000 7.711 0.289 17856 4351 1 13 . 1 1 83 83 GLU N N 83 124.611 124.611 119.150 5.461 17856 4352 1 13 . 1 1 83 83 GLU C C 83 177.298 177.298 178.338 -1.040 17856 4353 1 13 . 1 1 83 83 GLU H H 83 8.380 8.380 7.713 0.667 17856 4354 1 13 . 1 1 84 84 THR N N 84 115.107 115.107 114.261 0.846 17856 4355 1 13 . 1 1 84 84 THR C C 84 174.400 174.400 175.384 -0.984 17856 4356 1 13 . 1 1 84 84 THR CA C 84 62.659 62.659 66.042 -3.383 17856 4357 1 13 . 1 1 84 84 THR H H 84 8.064 8.064 7.730 0.334 17856 4358 1 13 . 1 1 85 85 LEU N N 85 124.150 124.150 117.154 6.996 17856 4359 1 13 . 1 1 85 85 LEU C C 85 177.120 177.120 177.569 -0.449 17856 4360 1 13 . 1 1 85 85 LEU CA C 85 55.020 55.020 56.597 -1.577 17856 4361 1 13 . 1 1 85 85 LEU H H 85 8.238 8.238 7.247 0.991 17856 4362 1 13 . 1 1 86 86 SER N N 86 114.913 114.913 113.683 1.230 17856 4363 1 13 . 1 1 86 86 SER H H 86 7.678 7.678 7.661 0.017 17856 4364 1 13 . 1 1 87 87 PRO CA C 87 63.550 63.550 64.646 -1.096 17856 4365 1 13 . 1 1 88 88 ALA N N 88 123.767 123.767 119.951 3.816 17856 4366 1 13 . 1 1 88 88 ALA C C 88 178.131 178.131 176.826 1.305 17856 4367 1 13 . 1 1 88 88 ALA CA C 88 52.878 52.878 52.395 0.483 17856 4368 1 13 . 1 1 88 88 ALA H H 88 8.342 8.342 7.455 0.887 17856 4369 1 13 . 1 1 89 89 ARG N N 89 119.159 119.159 120.072 -0.913 17856 4370 1 13 . 1 1 89 89 ARG C C 89 176.620 176.620 174.801 1.819 17856 4371 1 13 . 1 1 89 89 ARG H H 89 8.133 8.133 8.575 -0.442 17856 4372 1 13 . 1 1 90 90 SER N N 90 116.910 116.910 113.787 3.123 17856 4373 1 13 . 1 1 90 90 SER C C 90 174.887 174.887 172.462 2.425 17856 4374 1 13 . 1 1 90 90 SER H H 90 8.322 8.322 7.693 0.629 17856 4375 1 13 . 1 1 91 91 LYS N N 91 123.457 123.457 121.565 1.892 17856 4376 1 13 . 1 1 91 91 LYS C C 91 176.970 176.970 176.367 0.603 17856 4377 1 13 . 1 1 91 91 LYS H H 91 8.396 8.396 8.475 -0.079 17856 4378 1 13 . 1 1 92 92 SER N N 92 116.692 116.692 118.492 -1.800 17856 4379 1 13 . 1 1 92 92 SER C C 92 174.573 174.573 175.078 -0.505 17856 4380 1 13 . 1 1 92 92 SER CA C 92 58.600 58.600 59.713 -1.113 17856 4381 1 13 . 1 1 92 92 SER H H 92 8.297 8.297 8.540 -0.243 17856 4382 1 13 . 1 1 93 93 GLN N N 93 121.916 121.916 120.240 1.676 17856 4383 1 13 . 1 1 93 93 GLN C C 93 175.971 175.971 175.354 0.617 17856 4384 1 13 . 1 1 93 93 GLN H H 93 8.325 8.325 7.825 0.500 17856 4385 1 13 . 1 1 94 94 SER N N 94 117.385 117.385 114.109 3.276 17856 4386 1 13 . 1 1 94 94 SER C C 94 173.940 173.940 173.884 0.056 17856 4387 1 13 . 1 1 94 94 SER CA C 94 58.520 58.520 59.585 -1.065 17856 4388 1 13 . 1 1 94 94 SER H H 94 8.352 8.352 8.709 -0.357 17856 4389 1 13 . 1 1 95 95 THR N N 95 120.756 120.756 115.885 4.871 17856 4390 1 13 . 1 1 95 95 THR H H 95 7.805 7.805 8.293 -0.488 17856 4391 1 13 . 1 1 99 99 ARG C C 99 176.250 176.250 175.622 0.628 17856 4392 1 13 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.332 -0.175 17856 4393 1 13 . 1 1 100 100 ASN N N 100 118.482 118.482 118.881 -0.399 17856 4394 1 13 . 1 1 100 100 ASN H H 100 8.272 8.272 8.535 -0.263 17856 4395 1 13 . 1 1 101 101 ARG C C 101 176.280 176.280 175.663 0.617 17856 4396 1 13 . 1 1 102 102 ASN N N 102 118.688 118.688 122.090 -3.402 17856 4397 1 13 . 1 1 102 102 ASN C C 102 174.996 174.996 175.285 -0.289 17856 4398 1 13 . 1 1 102 102 ASN CA C 102 53.609 53.609 52.938 0.671 17856 4399 1 13 . 1 1 102 102 ASN H H 102 8.424 8.424 8.707 -0.283 17856 4400 1 13 . 1 1 103 103 ASN N N 103 118.865 118.865 118.362 0.503 17856 4401 1 13 . 1 1 103 103 ASN C C 103 175.040 175.040 174.372 0.668 17856 4402 1 13 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.683 0.129 17856 4403 1 13 . 1 1 103 103 ASN H H 103 8.282 8.282 8.225 0.057 17856 4404 1 13 . 1 1 104 104 ARG N N 104 120.875 120.875 113.789 7.086 17856 4405 1 13 . 1 1 104 104 ARG H H 104 8.140 8.140 8.608 -0.468 17856 4406 1 13 . 1 1 106 106 ILE C C 106 175.408 175.408 175.772 -0.364 17856 4407 1 13 . 1 1 106 106 ILE CA C 106 61.395 61.395 62.145 -0.750 17856 4408 1 14 . 1 1 2 2 SER N N 2 116.304 116.304 116.466 -0.162 17856 4409 1 14 . 1 1 2 2 SER C C 2 174.710 174.710 175.157 -0.447 17856 4410 1 14 . 1 1 2 2 SER CA C 2 58.908 58.908 58.931 -0.023 17856 4411 1 14 . 1 1 2 2 SER H H 2 8.003 8.003 8.527 -0.524 17856 4412 1 14 . 1 1 3 3 ILE N N 3 122.062 122.062 122.726 -0.664 17856 4413 1 14 . 1 1 3 3 ILE C C 3 176.750 176.750 176.615 0.135 17856 4414 1 14 . 1 1 3 3 ILE CA C 3 61.786 61.786 63.742 -1.956 17856 4415 1 14 . 1 1 3 3 ILE H H 3 7.957 7.957 8.052 -0.095 17856 4416 1 14 . 1 1 4 4 VAL N N 4 122.674 122.674 119.042 3.632 17856 4417 1 14 . 1 1 4 4 VAL C C 4 176.221 176.221 176.985 -0.764 17856 4418 1 14 . 1 1 4 4 VAL CA C 4 62.970 62.970 64.036 -1.066 17856 4419 1 14 . 1 1 4 4 VAL H H 4 7.970 7.970 8.061 -0.091 17856 4420 1 14 . 1 1 5 5 SER N N 5 117.750 117.750 115.527 2.223 17856 4421 1 14 . 1 1 5 5 SER C C 5 174.858 174.858 175.749 -0.891 17856 4422 1 14 . 1 1 5 5 SER CA C 5 58.630 58.630 61.065 -2.435 17856 4423 1 14 . 1 1 5 5 SER H H 5 8.093 8.093 7.538 0.555 17856 4424 1 14 . 1 1 6 6 GLN N N 6 121.961 121.961 118.242 3.719 17856 4425 1 14 . 1 1 6 6 GLN C C 6 176.467 176.467 176.506 -0.039 17856 4426 1 14 . 1 1 6 6 GLN CA C 6 56.226 56.226 56.841 -0.615 17856 4427 1 14 . 1 1 6 6 GLN H H 6 8.371 8.371 7.760 0.611 17856 4428 1 14 . 1 1 7 7 THR N N 7 115.325 115.325 112.482 2.843 17856 4429 1 14 . 1 1 7 7 THR C C 7 174.752 174.752 175.959 -1.207 17856 4430 1 14 . 1 1 7 7 THR H H 7 8.152 8.152 7.344 0.808 17856 4431 1 14 . 1 1 8 8 ARG N N 8 122.530 122.530 122.578 -0.048 17856 4432 1 14 . 1 1 8 8 ARG C C 8 176.200 176.200 178.203 -2.003 17856 4433 1 14 . 1 1 8 8 ARG CA C 8 56.570 56.570 59.797 -3.227 17856 4434 1 14 . 1 1 8 8 ARG H H 8 8.211 8.211 7.923 0.288 17856 4435 1 14 . 1 1 9 9 ASN N N 9 119.600 119.600 117.236 2.364 17856 4436 1 14 . 1 1 9 9 ASN C C 9 177.164 177.164 177.102 0.062 17856 4437 1 14 . 1 1 9 9 ASN H H 9 8.398 8.398 7.932 0.466 17856 4438 1 14 . 1 1 10 10 LYS N N 10 121.600 121.600 120.530 1.070 17856 4439 1 14 . 1 1 10 10 LYS C C 10 176.845 176.845 178.763 -1.918 17856 4440 1 14 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.141 -2.031 17856 4441 1 14 . 1 1 10 10 LYS H H 10 8.190 8.190 8.083 0.107 17856 4442 1 14 . 1 1 11 11 GLU N N 11 120.700 120.700 119.554 1.146 17856 4443 1 14 . 1 1 11 11 GLU C C 11 176.825 176.825 178.749 -1.924 17856 4444 1 14 . 1 1 11 11 GLU CA C 11 56.690 56.690 59.075 -2.385 17856 4445 1 14 . 1 1 11 11 GLU H H 11 8.323 8.323 7.703 0.620 17856 4446 1 14 . 1 1 12 12 LEU N N 12 122.390 122.390 121.742 0.648 17856 4447 1 14 . 1 1 12 12 LEU C C 12 177.670 177.670 178.966 -1.296 17856 4448 1 14 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.313 -2.843 17856 4449 1 14 . 1 1 12 12 LEU H H 12 8.155 8.155 8.176 -0.021 17856 4450 1 14 . 1 1 13 13 LEU N N 13 122.570 122.570 116.680 5.890 17856 4451 1 14 . 1 1 13 13 LEU C C 13 177.510 177.510 178.501 -0.991 17856 4452 1 14 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.627 -3.046 17856 4453 1 14 . 1 1 13 13 LEU H H 13 8.220 8.220 8.441 -0.221 17856 4454 1 14 . 1 1 14 14 ASP N N 14 120.780 120.780 120.579 0.201 17856 4455 1 14 . 1 1 14 14 ASP C C 14 176.480 176.480 178.706 -2.226 17856 4456 1 14 . 1 1 14 14 ASP CA C 14 54.650 54.650 58.017 -3.367 17856 4457 1 14 . 1 1 14 14 ASP H H 14 8.243 8.243 7.839 0.404 17856 4458 1 14 . 1 1 15 15 LYS N N 15 120.900 120.900 119.371 1.529 17856 4459 1 14 . 1 1 15 15 LYS C C 15 175.580 175.580 178.816 -3.236 17856 4460 1 14 . 1 1 15 15 LYS H H 15 8.052 8.052 8.170 -0.118 17856 4461 1 14 . 1 1 16 16 LYS N N 16 121.980 121.980 120.288 1.692 17856 4462 1 14 . 1 1 16 16 LYS C C 16 176.887 176.887 178.983 -2.096 17856 4463 1 14 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.598 -2.264 17856 4464 1 14 . 1 1 16 16 LYS H H 16 8.243 8.243 7.787 0.456 17856 4465 1 14 . 1 1 17 17 ILE N N 17 121.940 121.940 118.989 2.951 17856 4466 1 14 . 1 1 17 17 ILE H H 17 8.110 8.110 8.332 -0.222 17856 4467 1 14 . 1 1 18 18 ARG C C 18 176.520 176.520 178.360 -1.840 17856 4468 1 14 . 1 1 19 19 SER N N 19 117.150 117.150 114.464 2.686 17856 4469 1 14 . 1 1 19 19 SER C C 19 175.167 175.167 176.528 -1.361 17856 4470 1 14 . 1 1 19 19 SER CA C 19 58.840 58.840 61.761 -2.921 17856 4471 1 14 . 1 1 19 19 SER H H 19 8.396 8.396 7.823 0.573 17856 4472 1 14 . 1 1 20 20 GLU N N 20 123.176 123.176 121.857 1.319 17856 4473 1 14 . 1 1 20 20 GLU C C 20 176.921 176.921 178.903 -1.982 17856 4474 1 14 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.253 -2.393 17856 4475 1 14 . 1 1 20 20 GLU H H 20 8.478 8.478 7.571 0.907 17856 4476 1 14 . 1 1 21 21 ILE N N 21 120.550 120.550 115.815 4.735 17856 4477 1 14 . 1 1 21 21 ILE C C 21 176.550 176.550 178.107 -1.557 17856 4478 1 14 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.760 -3.131 17856 4479 1 14 . 1 1 21 21 ILE H H 21 8.080 8.080 7.447 0.633 17856 4480 1 14 . 1 1 22 22 GLU N N 22 123.685 123.685 120.840 2.845 17856 4481 1 14 . 1 1 22 22 GLU C C 22 176.109 176.109 178.950 -2.841 17856 4482 1 14 . 1 1 22 22 GLU H H 22 8.309 8.309 7.753 0.556 17856 4483 1 14 . 1 1 23 23 ALA N N 23 124.280 124.280 122.464 1.816 17856 4484 1 14 . 1 1 23 23 ALA C C 23 178.474 178.474 179.605 -1.131 17856 4485 1 14 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.053 -1.647 17856 4486 1 14 . 1 1 23 23 ALA H H 23 8.088 8.088 8.025 0.063 17856 4487 1 14 . 1 1 24 24 ILE N N 24 120.330 120.330 118.744 1.586 17856 4488 1 14 . 1 1 24 24 ILE C C 24 176.309 176.309 177.947 -1.638 17856 4489 1 14 . 1 1 24 24 ILE CA C 24 61.540 61.540 65.233 -3.692 17856 4490 1 14 . 1 1 24 24 ILE H H 24 7.980 7.980 8.120 -0.140 17856 4491 1 14 . 1 1 25 25 LYS N N 25 124.310 124.310 118.906 5.404 17856 4492 1 14 . 1 1 25 25 LYS C C 25 176.365 176.365 177.842 -1.477 17856 4493 1 14 . 1 1 25 25 LYS CA C 25 56.334 56.334 58.597 -2.263 17856 4494 1 14 . 1 1 25 25 LYS H H 25 8.198 8.198 8.125 0.073 17856 4495 1 14 . 1 1 26 26 LYS N N 26 122.518 122.518 117.957 4.561 17856 4496 1 14 . 1 1 26 26 LYS C C 26 176.365 176.365 178.207 -1.842 17856 4497 1 14 . 1 1 26 26 LYS CA C 26 56.175 56.175 57.848 -1.673 17856 4498 1 14 . 1 1 26 26 LYS H H 26 8.125 8.125 7.442 0.683 17856 4499 1 14 . 1 1 27 27 ILE N N 27 122.670 122.670 121.006 1.664 17856 4500 1 14 . 1 1 27 27 ILE C C 27 176.261 176.261 177.848 -1.587 17856 4501 1 14 . 1 1 27 27 ILE CA C 27 61.294 61.294 65.262 -3.968 17856 4502 1 14 . 1 1 27 27 ILE H H 27 8.114 8.114 8.182 -0.068 17856 4503 1 14 . 1 1 28 28 ILE N N 28 125.178 125.178 119.403 5.775 17856 4504 1 14 . 1 1 28 28 ILE C C 28 175.803 175.803 176.432 -0.629 17856 4505 1 14 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.558 -2.478 17856 4506 1 14 . 1 1 28 28 ILE H H 28 8.220 8.220 8.032 0.188 17856 4507 1 14 . 1 1 29 29 ALA N N 29 127.850 127.850 121.100 6.750 17856 4508 1 14 . 1 1 29 29 ALA C C 29 177.627 177.627 179.664 -2.037 17856 4509 1 14 . 1 1 29 29 ALA CA C 29 53.684 53.684 54.738 -1.054 17856 4510 1 14 . 1 1 29 29 ALA H H 29 8.300 8.300 7.098 1.202 17856 4511 1 14 . 1 1 30 30 GLU N N 30 120.000 120.000 119.084 0.916 17856 4512 1 14 . 1 1 30 30 GLU C C 30 176.321 176.321 178.879 -2.558 17856 4513 1 14 . 1 1 30 30 GLU H H 30 8.258 8.258 7.702 0.556 17856 4514 1 14 . 1 1 31 31 PHE N N 31 119.128 119.128 117.813 1.315 17856 4515 1 14 . 1 1 31 31 PHE C C 31 175.180 175.180 178.225 -3.045 17856 4516 1 14 . 1 1 31 31 PHE CA C 31 57.540 57.540 59.954 -2.414 17856 4517 1 14 . 1 1 31 31 PHE H H 31 8.061 8.061 7.438 0.623 17856 4518 1 14 . 1 1 32 32 ASP N N 32 121.800 121.800 119.179 2.621 17856 4519 1 14 . 1 1 32 32 ASP C C 32 175.894 175.894 178.195 -2.301 17856 4520 1 14 . 1 1 32 32 ASP CA C 32 54.529 54.529 56.719 -2.190 17856 4521 1 14 . 1 1 32 32 ASP H H 32 8.275 8.275 7.717 0.558 17856 4522 1 14 . 1 1 33 33 VAL N N 33 119.648 119.648 120.312 -0.664 17856 4523 1 14 . 1 1 33 33 VAL C C 33 176.268 176.268 178.467 -2.199 17856 4524 1 14 . 1 1 33 33 VAL CA C 33 62.500 62.500 66.185 -3.685 17856 4525 1 14 . 1 1 33 33 VAL H H 33 8.059 8.059 7.561 0.498 17856 4526 1 14 . 1 1 34 34 VAL N N 34 123.882 123.882 117.747 6.135 17856 4527 1 14 . 1 1 34 34 VAL H H 34 7.774 7.774 8.327 -0.553 17856 4528 1 14 . 1 1 35 35 LYS N N 35 125.250 125.250 121.889 3.361 17856 4529 1 14 . 1 1 35 35 LYS C C 35 176.719 176.719 178.358 -1.639 17856 4530 1 14 . 1 1 35 35 LYS CA C 35 56.502 56.502 59.477 -2.975 17856 4531 1 14 . 1 1 35 35 LYS H H 35 8.357 8.357 7.484 0.873 17856 4532 1 14 . 1 1 36 36 GLU N N 36 121.850 121.850 116.438 5.412 17856 4533 1 14 . 1 1 36 36 GLU C C 36 176.426 176.426 176.989 -0.563 17856 4534 1 14 . 1 1 36 36 GLU H H 36 8.423 8.423 7.812 0.611 17856 4535 1 14 . 1 1 37 37 SER N N 37 117.100 117.100 114.115 2.985 17856 4536 1 14 . 1 1 37 37 SER C C 37 174.854 174.854 175.039 -0.185 17856 4537 1 14 . 1 1 37 37 SER CA C 37 58.850 58.850 59.673 -0.823 17856 4538 1 14 . 1 1 37 37 SER H H 37 8.362 8.362 7.753 0.609 17856 4539 1 14 . 1 1 38 38 VAL N N 38 121.625 121.625 124.699 -3.074 17856 4540 1 14 . 1 1 38 38 VAL C C 38 176.246 176.246 175.353 0.893 17856 4541 1 14 . 1 1 38 38 VAL CA C 38 63.043 63.043 62.366 0.677 17856 4542 1 14 . 1 1 38 38 VAL H H 38 8.225 8.225 7.589 0.636 17856 4543 1 14 . 1 1 39 39 ASN N N 39 121.150 121.150 125.871 -4.721 17856 4544 1 14 . 1 1 39 39 ASN C C 39 175.459 175.459 175.016 0.443 17856 4545 1 14 . 1 1 39 39 ASN CA C 39 53.568 53.568 53.520 0.048 17856 4546 1 14 . 1 1 39 39 ASN H H 39 8.366 8.366 8.492 -0.126 17856 4547 1 14 . 1 1 40 40 GLU N N 40 121.500 121.500 118.660 2.840 17856 4548 1 14 . 1 1 40 40 GLU C C 40 175.459 175.459 174.917 0.542 17856 4549 1 14 . 1 1 40 40 GLU CA C 40 56.860 56.860 55.805 1.055 17856 4550 1 14 . 1 1 40 40 GLU H H 40 8.370 8.370 8.249 0.121 17856 4551 1 14 . 1 1 41 41 LEU N N 41 121.950 121.950 121.175 0.775 17856 4552 1 14 . 1 1 41 41 LEU C C 41 177.939 177.939 176.755 1.184 17856 4553 1 14 . 1 1 41 41 LEU CA C 41 56.040 56.040 56.355 -0.315 17856 4554 1 14 . 1 1 41 41 LEU H H 41 8.152 8.152 8.351 -0.199 17856 4555 1 14 . 1 1 42 42 SER N N 42 113.326 113.326 115.778 -2.452 17856 4556 1 14 . 1 1 42 42 SER C C 42 174.660 174.660 176.207 -1.547 17856 4557 1 14 . 1 1 42 42 SER CA C 42 58.940 58.940 61.092 -2.152 17856 4558 1 14 . 1 1 42 42 SER H H 42 8.373 8.373 8.349 0.024 17856 4559 1 14 . 1 1 43 43 GLU N N 43 121.521 121.521 120.385 1.136 17856 4560 1 14 . 1 1 43 43 GLU C C 43 177.349 177.349 178.809 -1.460 17856 4561 1 14 . 1 1 43 43 GLU H H 43 7.329 7.329 8.753 -1.424 17856 4562 1 14 . 1 1 44 44 LYS N N 44 121.240 121.240 119.200 2.040 17856 4563 1 14 . 1 1 44 44 LYS C C 44 177.246 177.246 178.348 -1.102 17856 4564 1 14 . 1 1 44 44 LYS CA C 44 56.397 56.397 58.723 -2.326 17856 4565 1 14 . 1 1 44 44 LYS H H 44 8.103 8.103 7.425 0.678 17856 4566 1 14 . 1 1 45 45 ALA N N 45 119.568 119.568 121.109 -1.541 17856 4567 1 14 . 1 1 45 45 ALA C C 45 177.853 177.853 179.417 -1.564 17856 4568 1 14 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.627 -2.067 17856 4569 1 14 . 1 1 45 45 ALA H H 45 8.541 8.541 7.334 1.207 17856 4570 1 14 . 1 1 46 46 LYS N N 46 115.235 115.235 117.945 -2.710 17856 4571 1 14 . 1 1 46 46 LYS C C 46 177.110 177.110 178.589 -1.479 17856 4572 1 14 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.911 -2.115 17856 4573 1 14 . 1 1 46 46 LYS H H 46 7.257 7.257 7.642 -0.385 17856 4574 1 14 . 1 1 47 47 THR N N 47 103.239 103.239 109.219 -5.980 17856 4575 1 14 . 1 1 47 47 THR C C 47 173.973 173.973 174.820 -0.847 17856 4576 1 14 . 1 1 47 47 THR CA C 47 62.740 62.740 63.299 -0.559 17856 4577 1 14 . 1 1 47 47 THR H H 47 7.381 7.381 7.633 -0.252 17856 4578 1 14 . 1 1 48 48 ASP N N 48 122.976 122.976 121.325 1.651 17856 4579 1 14 . 1 1 48 48 ASP H H 48 8.031 8.031 7.662 0.369 17856 4580 1 14 . 1 1 49 49 PRO C C 49 178.106 178.106 178.383 -0.277 17856 4581 1 14 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.997 -0.778 17856 4582 1 14 . 1 1 50 50 GLN N N 50 118.351 118.351 118.626 -0.275 17856 4583 1 14 . 1 1 50 50 GLN C C 50 176.944 176.944 178.439 -1.495 17856 4584 1 14 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.549 -1.749 17856 4585 1 14 . 1 1 50 50 GLN H H 50 8.304 8.304 7.966 0.338 17856 4586 1 14 . 1 1 51 51 ALA N N 51 124.206 124.206 122.191 2.015 17856 4587 1 14 . 1 1 51 51 ALA C C 51 178.490 178.490 179.044 -0.554 17856 4588 1 14 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.871 -1.447 17856 4589 1 14 . 1 1 51 51 ALA H H 51 7.547 7.547 8.873 -1.326 17856 4590 1 14 . 1 1 52 52 ALA N N 52 118.686 118.686 120.004 -1.318 17856 4591 1 14 . 1 1 52 52 ALA C C 52 177.953 177.953 179.452 -1.499 17856 4592 1 14 . 1 1 52 52 ALA H H 52 7.931 7.931 7.822 0.109 17856 4593 1 14 . 1 1 53 53 GLU N N 53 120.075 120.075 117.912 2.163 17856 4594 1 14 . 1 1 53 53 GLU H H 53 7.729 7.729 7.721 0.008 17856 4595 1 14 . 1 1 55 55 LEU N N 55 123.640 123.640 120.880 2.760 17856 4596 1 14 . 1 1 55 55 LEU C C 55 177.587 177.587 177.916 -0.329 17856 4597 1 14 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.031 -1.244 17856 4598 1 14 . 1 1 55 55 LEU H H 55 8.215 8.215 8.177 0.038 17856 4599 1 14 . 1 1 56 56 ASN N N 56 118.520 118.520 117.955 0.565 17856 4600 1 14 . 1 1 56 56 ASN C C 56 175.700 175.700 176.938 -1.238 17856 4601 1 14 . 1 1 56 56 ASN CA C 56 54.132 54.132 57.019 -2.887 17856 4602 1 14 . 1 1 56 56 ASN H H 56 8.250 8.250 7.922 0.328 17856 4603 1 14 . 1 1 57 57 LYS N N 57 120.960 120.960 118.529 2.431 17856 4604 1 14 . 1 1 57 57 LYS C C 57 176.637 176.637 177.825 -1.188 17856 4605 1 14 . 1 1 57 57 LYS H H 57 8.065 8.065 7.631 0.434 17856 4606 1 14 . 1 1 58 58 LEU N N 58 122.610 122.610 120.028 2.582 17856 4607 1 14 . 1 1 58 58 LEU C C 58 177.433 177.433 179.433 -2.000 17856 4608 1 14 . 1 1 58 58 LEU CA C 58 55.120 55.120 57.012 -1.892 17856 4609 1 14 . 1 1 58 58 LEU H H 58 8.135 8.135 7.127 1.008 17856 4610 1 14 . 1 1 59 59 ILE N N 59 122.045 122.045 120.201 1.844 17856 4611 1 14 . 1 1 59 59 ILE CA C 59 61.535 61.535 63.860 -2.325 17856 4612 1 14 . 1 1 59 59 ILE H H 59 8.220 8.220 8.470 -0.250 17856 4613 1 14 . 1 1 60 60 GLU N N 60 124.000 124.000 119.531 4.469 17856 4614 1 14 . 1 1 60 60 GLU C C 60 177.007 177.007 177.383 -0.376 17856 4615 1 14 . 1 1 60 60 GLU CA C 60 56.722 56.722 56.919 -0.197 17856 4616 1 14 . 1 1 60 60 GLU H H 60 8.340 8.340 7.914 0.426 17856 4617 1 14 . 1 1 61 61 GLY N N 61 110.520 110.520 106.025 4.495 17856 4618 1 14 . 1 1 61 61 GLY C C 61 174.002 174.002 175.030 -1.028 17856 4619 1 14 . 1 1 61 61 GLY CA C 61 45.405 45.405 45.006 0.399 17856 4620 1 14 . 1 1 61 61 GLY H H 61 8.557 8.557 7.520 1.037 17856 4621 1 14 . 1 1 62 62 TYR N N 62 119.600 119.600 122.577 -2.977 17856 4622 1 14 . 1 1 62 62 TYR C C 62 175.940 175.940 175.441 0.499 17856 4623 1 14 . 1 1 62 62 TYR CA C 62 58.108 58.108 57.140 0.968 17856 4624 1 14 . 1 1 62 62 TYR H H 62 7.980 7.980 7.520 0.460 17856 4625 1 14 . 1 1 63 63 THR N N 63 116.304 116.304 116.041 0.263 17856 4626 1 14 . 1 1 63 63 THR C C 63 173.796 173.796 173.989 -0.193 17856 4627 1 14 . 1 1 63 63 THR H H 63 8.049 8.049 7.762 0.287 17856 4628 1 14 . 1 1 64 64 TYR N N 64 122.050 122.050 122.820 -0.770 17856 4629 1 14 . 1 1 64 64 TYR C C 64 176.290 176.290 175.610 0.680 17856 4630 1 14 . 1 1 64 64 TYR CA C 64 58.533 58.533 58.299 0.234 17856 4631 1 14 . 1 1 64 64 TYR H H 64 8.133 8.133 8.081 0.052 17856 4632 1 14 . 1 1 65 65 GLY N N 65 110.456 110.456 111.433 -0.977 17856 4633 1 14 . 1 1 65 65 GLY C C 65 174.340 174.340 173.211 1.129 17856 4634 1 14 . 1 1 65 65 GLY CA C 65 45.328 45.328 44.290 1.038 17856 4635 1 14 . 1 1 65 65 GLY H H 65 7.747 7.747 7.802 -0.055 17856 4636 1 14 . 1 1 66 66 GLU N N 66 120.783 120.783 120.094 0.689 17856 4637 1 14 . 1 1 66 66 GLU C C 66 176.895 176.895 175.496 1.399 17856 4638 1 14 . 1 1 66 66 GLU CA C 66 56.804 56.804 56.283 0.521 17856 4639 1 14 . 1 1 66 66 GLU H H 66 8.243 8.243 8.420 -0.177 17856 4640 1 14 . 1 1 67 67 GLU N N 67 121.587 121.587 125.679 -4.092 17856 4641 1 14 . 1 1 67 67 GLU C C 67 176.340 176.340 177.115 -0.775 17856 4642 1 14 . 1 1 67 67 GLU H H 67 8.611 8.611 8.647 -0.036 17856 4643 1 14 . 1 1 68 68 ARG N N 68 121.790 121.790 121.871 -0.081 17856 4644 1 14 . 1 1 68 68 ARG C C 68 176.350 176.350 177.901 -1.551 17856 4645 1 14 . 1 1 68 68 ARG H H 68 8.267 8.267 9.003 -0.736 17856 4646 1 14 . 1 1 69 69 LYS N N 69 118.431 118.431 121.564 -3.133 17856 4647 1 14 . 1 1 69 69 LYS H H 69 7.567 7.567 7.983 -0.416 17856 4648 1 14 . 1 1 70 70 LEU C C 70 177.338 177.338 178.635 -1.297 17856 4649 1 14 . 1 1 70 70 LEU CA C 70 55.533 55.533 57.342 -1.809 17856 4650 1 14 . 1 1 71 71 TYR N N 71 119.504 119.504 116.309 3.195 17856 4651 1 14 . 1 1 71 71 TYR H H 71 7.997 7.997 7.486 0.511 17856 4652 1 14 . 1 1 72 72 ASP C C 72 176.528 176.528 178.520 -1.992 17856 4653 1 14 . 1 1 72 72 ASP CA C 72 54.693 54.693 57.293 -2.600 17856 4654 1 14 . 1 1 73 73 SER N N 73 117.000 117.000 115.541 1.459 17856 4655 1 14 . 1 1 73 73 SER C C 73 174.950 174.950 176.423 -1.473 17856 4656 1 14 . 1 1 73 73 SER CA C 73 58.997 58.997 61.247 -2.250 17856 4657 1 14 . 1 1 73 73 SER H H 73 8.282 8.282 7.821 0.461 17856 4658 1 14 . 1 1 74 74 ALA N N 74 125.422 125.422 124.699 0.723 17856 4659 1 14 . 1 1 74 74 ALA C C 74 178.389 178.389 179.498 -1.109 17856 4660 1 14 . 1 1 74 74 ALA CA C 74 53.433 53.433 55.171 -1.738 17856 4661 1 14 . 1 1 74 74 ALA H H 74 8.339 8.339 7.545 0.794 17856 4662 1 14 . 1 1 75 75 LEU N N 75 120.019 120.019 118.495 1.524 17856 4663 1 14 . 1 1 75 75 LEU C C 75 177.954 177.954 179.106 -1.152 17856 4664 1 14 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.337 -1.557 17856 4665 1 14 . 1 1 75 75 LEU H H 75 7.948 7.948 7.656 0.292 17856 4666 1 14 . 1 1 76 76 SER N N 76 113.321 113.321 115.194 -1.873 17856 4667 1 14 . 1 1 76 76 SER C C 76 174.784 174.784 176.757 -1.973 17856 4668 1 14 . 1 1 76 76 SER CA C 76 59.173 59.173 61.981 -2.808 17856 4669 1 14 . 1 1 76 76 SER H H 76 7.951 7.951 7.714 0.237 17856 4670 1 14 . 1 1 77 77 LYS N N 77 122.710 122.710 121.066 1.644 17856 4671 1 14 . 1 1 77 77 LYS C C 77 176.734 176.734 178.748 -2.014 17856 4672 1 14 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.458 -1.068 17856 4673 1 14 . 1 1 77 77 LYS H H 77 8.170 8.170 7.504 0.666 17856 4674 1 14 . 1 1 78 78 ILE N N 78 121.521 121.521 118.293 3.228 17856 4675 1 14 . 1 1 78 78 ILE C C 78 176.512 176.512 178.332 -1.820 17856 4676 1 14 . 1 1 78 78 ILE H H 78 8.160 8.160 7.193 0.967 17856 4677 1 14 . 1 1 79 79 GLU N N 79 123.840 123.840 121.019 2.821 17856 4678 1 14 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.749 -4.271 17856 4679 1 14 . 1 1 79 79 GLU H H 79 8.360 8.360 7.946 0.414 17856 4680 1 14 . 1 1 80 80 LYS N N 80 122.143 122.143 119.601 2.542 17856 4681 1 14 . 1 1 80 80 LYS C C 80 176.937 176.937 179.025 -2.088 17856 4682 1 14 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.332 -2.832 17856 4683 1 14 . 1 1 80 80 LYS H H 80 8.231 8.231 7.634 0.597 17856 4684 1 14 . 1 1 81 81 LEU N N 81 122.095 122.095 121.560 0.535 17856 4685 1 14 . 1 1 81 81 LEU C C 81 177.531 177.531 178.718 -1.187 17856 4686 1 14 . 1 1 81 81 LEU H H 81 8.050 8.050 7.453 0.597 17856 4687 1 14 . 1 1 82 82 ILE N N 82 120.609 120.609 118.486 2.123 17856 4688 1 14 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.469 -4.109 17856 4689 1 14 . 1 1 82 82 ILE H H 82 8.000 8.000 7.509 0.491 17856 4690 1 14 . 1 1 83 83 GLU N N 83 124.611 124.611 120.327 4.284 17856 4691 1 14 . 1 1 83 83 GLU C C 83 177.298 177.298 179.561 -2.263 17856 4692 1 14 . 1 1 83 83 GLU H H 83 8.380 8.380 8.043 0.337 17856 4693 1 14 . 1 1 84 84 THR N N 84 115.107 115.107 115.411 -0.304 17856 4694 1 14 . 1 1 84 84 THR C C 84 174.400 174.400 175.572 -1.172 17856 4695 1 14 . 1 1 84 84 THR CA C 84 62.659 62.659 65.641 -2.982 17856 4696 1 14 . 1 1 84 84 THR H H 84 8.064 8.064 8.012 0.052 17856 4697 1 14 . 1 1 85 85 LEU N N 85 124.150 124.150 120.158 3.992 17856 4698 1 14 . 1 1 85 85 LEU C C 85 177.120 177.120 176.627 0.493 17856 4699 1 14 . 1 1 85 85 LEU CA C 85 55.020 55.020 54.609 0.411 17856 4700 1 14 . 1 1 85 85 LEU H H 85 8.238 8.238 7.357 0.881 17856 4701 1 14 . 1 1 86 86 SER N N 86 114.913 114.913 116.267 -1.354 17856 4702 1 14 . 1 1 86 86 SER H H 86 7.678 7.678 7.480 0.198 17856 4703 1 14 . 1 1 87 87 PRO CA C 87 63.550 63.550 64.429 -0.879 17856 4704 1 14 . 1 1 88 88 ALA N N 88 123.767 123.767 119.791 3.976 17856 4705 1 14 . 1 1 88 88 ALA C C 88 178.131 178.131 177.586 0.545 17856 4706 1 14 . 1 1 88 88 ALA CA C 88 52.878 52.878 53.502 -0.624 17856 4707 1 14 . 1 1 88 88 ALA H H 88 8.342 8.342 8.124 0.218 17856 4708 1 14 . 1 1 89 89 ARG N N 89 119.159 119.159 122.220 -3.061 17856 4709 1 14 . 1 1 89 89 ARG C C 89 176.620 176.620 174.608 2.012 17856 4710 1 14 . 1 1 89 89 ARG H H 89 8.133 8.133 8.240 -0.107 17856 4711 1 14 . 1 1 90 90 SER N N 90 116.910 116.910 119.328 -2.418 17856 4712 1 14 . 1 1 90 90 SER C C 90 174.887 174.887 174.165 0.722 17856 4713 1 14 . 1 1 90 90 SER H H 90 8.322 8.322 8.229 0.093 17856 4714 1 14 . 1 1 91 91 LYS N N 91 123.457 123.457 121.775 1.682 17856 4715 1 14 . 1 1 91 91 LYS C C 91 176.970 176.970 175.994 0.976 17856 4716 1 14 . 1 1 91 91 LYS H H 91 8.396 8.396 8.285 0.111 17856 4717 1 14 . 1 1 92 92 SER N N 92 116.692 116.692 117.622 -0.930 17856 4718 1 14 . 1 1 92 92 SER C C 92 174.573 174.573 174.396 0.177 17856 4719 1 14 . 1 1 92 92 SER CA C 92 58.600 58.600 58.231 0.369 17856 4720 1 14 . 1 1 92 92 SER H H 92 8.297 8.297 8.506 -0.209 17856 4721 1 14 . 1 1 93 93 GLN N N 93 121.916 121.916 122.883 -0.967 17856 4722 1 14 . 1 1 93 93 GLN C C 93 175.971 175.971 174.520 1.451 17856 4723 1 14 . 1 1 93 93 GLN H H 93 8.325 8.325 8.381 -0.056 17856 4724 1 14 . 1 1 94 94 SER N N 94 117.385 117.385 116.996 0.389 17856 4725 1 14 . 1 1 94 94 SER C C 94 173.940 173.940 173.239 0.701 17856 4726 1 14 . 1 1 94 94 SER CA C 94 58.520 58.520 59.009 -0.489 17856 4727 1 14 . 1 1 94 94 SER H H 94 8.352 8.352 8.555 -0.203 17856 4728 1 14 . 1 1 95 95 THR N N 95 120.756 120.756 117.646 3.110 17856 4729 1 14 . 1 1 95 95 THR H H 95 7.805 7.805 8.456 -0.651 17856 4730 1 14 . 1 1 99 99 ARG C C 99 176.250 176.250 174.699 1.551 17856 4731 1 14 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.529 -0.372 17856 4732 1 14 . 1 1 100 100 ASN N N 100 118.482 118.482 118.065 0.417 17856 4733 1 14 . 1 1 100 100 ASN H H 100 8.272 8.272 8.113 0.159 17856 4734 1 14 . 1 1 101 101 ARG C C 101 176.280 176.280 175.094 1.186 17856 4735 1 14 . 1 1 102 102 ASN N N 102 118.688 118.688 119.453 -0.765 17856 4736 1 14 . 1 1 102 102 ASN C C 102 174.996 174.996 175.023 -0.027 17856 4737 1 14 . 1 1 102 102 ASN CA C 102 53.609 53.609 52.968 0.642 17856 4738 1 14 . 1 1 102 102 ASN H H 102 8.424 8.424 8.478 -0.054 17856 4739 1 14 . 1 1 103 103 ASN N N 103 118.865 118.865 118.558 0.307 17856 4740 1 14 . 1 1 103 103 ASN C C 103 175.040 175.040 174.650 0.390 17856 4741 1 14 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.758 0.054 17856 4742 1 14 . 1 1 103 103 ASN H H 103 8.282 8.282 8.329 -0.047 17856 4743 1 14 . 1 1 104 104 ARG N N 104 120.875 120.875 116.264 4.611 17856 4744 1 14 . 1 1 104 104 ARG H H 104 8.140 8.140 8.339 -0.199 17856 4745 1 14 . 1 1 106 106 ILE C C 106 175.408 175.408 175.772 -0.364 17856 4746 1 14 . 1 1 106 106 ILE CA C 106 61.395 61.395 62.672 -1.277 17856 4747 1 15 . 1 1 2 2 SER N N 2 116.304 116.304 119.700 -3.396 17856 4748 1 15 . 1 1 2 2 SER C C 2 174.710 174.710 176.614 -1.904 17856 4749 1 15 . 1 1 2 2 SER CA C 2 58.908 58.908 60.709 -1.801 17856 4750 1 15 . 1 1 2 2 SER H H 2 8.003 8.003 8.778 -0.775 17856 4751 1 15 . 1 1 3 3 ILE N N 3 122.062 122.062 121.033 1.029 17856 4752 1 15 . 1 1 3 3 ILE C C 3 176.750 176.750 176.176 0.574 17856 4753 1 15 . 1 1 3 3 ILE CA C 3 61.786 61.786 63.591 -1.805 17856 4754 1 15 . 1 1 3 3 ILE H H 3 7.957 7.957 8.007 -0.050 17856 4755 1 15 . 1 1 4 4 VAL N N 4 122.674 122.674 116.553 6.121 17856 4756 1 15 . 1 1 4 4 VAL C C 4 176.221 176.221 175.914 0.307 17856 4757 1 15 . 1 1 4 4 VAL CA C 4 62.970 62.970 62.160 0.810 17856 4758 1 15 . 1 1 4 4 VAL H H 4 7.970 7.970 7.428 0.542 17856 4759 1 15 . 1 1 5 5 SER N N 5 117.750 117.750 113.924 3.826 17856 4760 1 15 . 1 1 5 5 SER C C 5 174.858 174.858 175.321 -0.463 17856 4761 1 15 . 1 1 5 5 SER CA C 5 58.630 58.630 59.102 -0.472 17856 4762 1 15 . 1 1 5 5 SER H H 5 8.093 8.093 7.312 0.781 17856 4763 1 15 . 1 1 6 6 GLN N N 6 121.961 121.961 122.714 -0.753 17856 4764 1 15 . 1 1 6 6 GLN C C 6 176.467 176.467 175.601 0.866 17856 4765 1 15 . 1 1 6 6 GLN CA C 6 56.226 56.226 54.944 1.282 17856 4766 1 15 . 1 1 6 6 GLN H H 6 8.371 8.371 8.011 0.360 17856 4767 1 15 . 1 1 7 7 THR N N 7 115.325 115.325 112.549 2.776 17856 4768 1 15 . 1 1 7 7 THR C C 7 174.752 174.752 175.908 -1.156 17856 4769 1 15 . 1 1 7 7 THR H H 7 8.152 8.152 7.631 0.521 17856 4770 1 15 . 1 1 8 8 ARG N N 8 122.530 122.530 120.254 2.276 17856 4771 1 15 . 1 1 8 8 ARG C C 8 176.200 176.200 177.572 -1.372 17856 4772 1 15 . 1 1 8 8 ARG CA C 8 56.570 56.570 57.128 -0.558 17856 4773 1 15 . 1 1 8 8 ARG H H 8 8.211 8.211 8.535 -0.324 17856 4774 1 15 . 1 1 9 9 ASN N N 9 119.600 119.600 118.653 0.947 17856 4775 1 15 . 1 1 9 9 ASN C C 9 177.164 177.164 176.417 0.747 17856 4776 1 15 . 1 1 9 9 ASN H H 9 8.398 8.398 8.493 -0.095 17856 4777 1 15 . 1 1 10 10 LYS N N 10 121.600 121.600 120.160 1.440 17856 4778 1 15 . 1 1 10 10 LYS C C 10 176.845 176.845 178.582 -1.737 17856 4779 1 15 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.703 -2.593 17856 4780 1 15 . 1 1 10 10 LYS H H 10 8.190 8.190 8.211 -0.021 17856 4781 1 15 . 1 1 11 11 GLU N N 11 120.700 120.700 119.086 1.614 17856 4782 1 15 . 1 1 11 11 GLU C C 11 176.825 176.825 178.676 -1.851 17856 4783 1 15 . 1 1 11 11 GLU CA C 11 56.690 56.690 58.928 -2.238 17856 4784 1 15 . 1 1 11 11 GLU H H 11 8.323 8.323 7.629 0.694 17856 4785 1 15 . 1 1 12 12 LEU N N 12 122.390 122.390 121.843 0.547 17856 4786 1 15 . 1 1 12 12 LEU C C 12 177.670 177.670 178.834 -1.164 17856 4787 1 15 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.297 -2.827 17856 4788 1 15 . 1 1 12 12 LEU H H 12 8.155 8.155 8.099 0.056 17856 4789 1 15 . 1 1 13 13 LEU N N 13 122.570 122.570 116.188 6.382 17856 4790 1 15 . 1 1 13 13 LEU C C 13 177.510 177.510 178.570 -1.060 17856 4791 1 15 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.522 -2.941 17856 4792 1 15 . 1 1 13 13 LEU H H 13 8.220 8.220 8.314 -0.094 17856 4793 1 15 . 1 1 14 14 ASP N N 14 120.780 120.780 120.842 -0.062 17856 4794 1 15 . 1 1 14 14 ASP C C 14 176.480 176.480 178.646 -2.166 17856 4795 1 15 . 1 1 14 14 ASP CA C 14 54.650 54.650 58.012 -3.362 17856 4796 1 15 . 1 1 14 14 ASP H H 14 8.243 8.243 7.924 0.319 17856 4797 1 15 . 1 1 15 15 LYS N N 15 120.900 120.900 119.521 1.379 17856 4798 1 15 . 1 1 15 15 LYS C C 15 175.580 175.580 179.056 -3.476 17856 4799 1 15 . 1 1 15 15 LYS H H 15 8.052 8.052 8.098 -0.046 17856 4800 1 15 . 1 1 16 16 LYS N N 16 121.980 121.980 120.081 1.899 17856 4801 1 15 . 1 1 16 16 LYS C C 16 176.887 176.887 179.007 -2.120 17856 4802 1 15 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.729 -2.395 17856 4803 1 15 . 1 1 16 16 LYS H H 16 8.243 8.243 7.640 0.603 17856 4804 1 15 . 1 1 17 17 ILE N N 17 121.940 121.940 119.119 2.821 17856 4805 1 15 . 1 1 17 17 ILE H H 17 8.110 8.110 8.374 -0.264 17856 4806 1 15 . 1 1 18 18 ARG C C 18 176.520 176.520 178.100 -1.580 17856 4807 1 15 . 1 1 19 19 SER N N 19 117.150 117.150 115.250 1.900 17856 4808 1 15 . 1 1 19 19 SER C C 19 175.167 175.167 176.194 -1.027 17856 4809 1 15 . 1 1 19 19 SER CA C 19 58.840 58.840 61.801 -2.961 17856 4810 1 15 . 1 1 19 19 SER H H 19 8.396 8.396 7.856 0.540 17856 4811 1 15 . 1 1 20 20 GLU N N 20 123.176 123.176 122.229 0.947 17856 4812 1 15 . 1 1 20 20 GLU C C 20 176.921 176.921 178.891 -1.970 17856 4813 1 15 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.324 -2.464 17856 4814 1 15 . 1 1 20 20 GLU H H 20 8.478 8.478 7.724 0.754 17856 4815 1 15 . 1 1 21 21 ILE N N 21 120.550 120.550 115.328 5.222 17856 4816 1 15 . 1 1 21 21 ILE C C 21 176.550 176.550 178.025 -1.475 17856 4817 1 15 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.576 -2.946 17856 4818 1 15 . 1 1 21 21 ILE H H 21 8.080 8.080 7.444 0.636 17856 4819 1 15 . 1 1 22 22 GLU N N 22 123.685 123.685 120.975 2.710 17856 4820 1 15 . 1 1 22 22 GLU C C 22 176.109 176.109 178.576 -2.467 17856 4821 1 15 . 1 1 22 22 GLU H H 22 8.309 8.309 7.775 0.534 17856 4822 1 15 . 1 1 23 23 ALA N N 23 124.280 124.280 122.805 1.475 17856 4823 1 15 . 1 1 23 23 ALA C C 23 178.474 178.474 179.774 -1.300 17856 4824 1 15 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.157 -1.751 17856 4825 1 15 . 1 1 23 23 ALA H H 23 8.088 8.088 8.105 -0.017 17856 4826 1 15 . 1 1 24 24 ILE N N 24 120.330 120.330 118.485 1.845 17856 4827 1 15 . 1 1 24 24 ILE C C 24 176.309 176.309 177.767 -1.458 17856 4828 1 15 . 1 1 24 24 ILE CA C 24 61.540 61.540 65.051 -3.511 17856 4829 1 15 . 1 1 24 24 ILE H H 24 7.980 7.980 8.265 -0.285 17856 4830 1 15 . 1 1 25 25 LYS N N 25 124.310 124.310 119.723 4.587 17856 4831 1 15 . 1 1 25 25 LYS C C 25 176.365 176.365 178.650 -2.285 17856 4832 1 15 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.171 -2.837 17856 4833 1 15 . 1 1 25 25 LYS H H 25 8.198 8.198 7.816 0.382 17856 4834 1 15 . 1 1 26 26 LYS N N 26 122.518 122.518 118.324 4.194 17856 4835 1 15 . 1 1 26 26 LYS C C 26 176.365 176.365 178.572 -2.207 17856 4836 1 15 . 1 1 26 26 LYS CA C 26 56.175 56.175 59.056 -2.881 17856 4837 1 15 . 1 1 26 26 LYS H H 26 8.125 8.125 7.259 0.866 17856 4838 1 15 . 1 1 27 27 ILE N N 27 122.670 122.670 120.453 2.217 17856 4839 1 15 . 1 1 27 27 ILE C C 27 176.261 176.261 178.256 -1.995 17856 4840 1 15 . 1 1 27 27 ILE CA C 27 61.294 61.294 64.182 -2.888 17856 4841 1 15 . 1 1 27 27 ILE H H 27 8.114 8.114 7.804 0.310 17856 4842 1 15 . 1 1 28 28 ILE N N 28 125.178 125.178 119.920 5.258 17856 4843 1 15 . 1 1 28 28 ILE C C 28 175.803 175.803 176.993 -1.190 17856 4844 1 15 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.841 -2.761 17856 4845 1 15 . 1 1 28 28 ILE H H 28 8.220 8.220 8.030 0.190 17856 4846 1 15 . 1 1 29 29 ALA N N 29 127.850 127.850 120.954 6.896 17856 4847 1 15 . 1 1 29 29 ALA C C 29 177.627 177.627 179.658 -2.031 17856 4848 1 15 . 1 1 29 29 ALA CA C 29 53.684 53.684 54.861 -1.177 17856 4849 1 15 . 1 1 29 29 ALA H H 29 8.300 8.300 7.173 1.127 17856 4850 1 15 . 1 1 30 30 GLU N N 30 120.000 120.000 119.271 0.729 17856 4851 1 15 . 1 1 30 30 GLU C C 30 176.321 176.321 178.915 -2.594 17856 4852 1 15 . 1 1 30 30 GLU H H 30 8.258 8.258 7.704 0.554 17856 4853 1 15 . 1 1 31 31 PHE N N 31 119.128 119.128 117.460 1.668 17856 4854 1 15 . 1 1 31 31 PHE C C 31 175.180 175.180 178.264 -3.084 17856 4855 1 15 . 1 1 31 31 PHE CA C 31 57.540 57.540 60.380 -2.840 17856 4856 1 15 . 1 1 31 31 PHE H H 31 8.061 8.061 7.527 0.534 17856 4857 1 15 . 1 1 32 32 ASP N N 32 121.800 121.800 119.584 2.216 17856 4858 1 15 . 1 1 32 32 ASP C C 32 175.894 175.894 178.256 -2.362 17856 4859 1 15 . 1 1 32 32 ASP CA C 32 54.529 54.529 56.907 -2.378 17856 4860 1 15 . 1 1 32 32 ASP H H 32 8.275 8.275 7.692 0.583 17856 4861 1 15 . 1 1 33 33 VAL N N 33 119.648 119.648 120.708 -1.060 17856 4862 1 15 . 1 1 33 33 VAL C C 33 176.268 176.268 178.386 -2.118 17856 4863 1 15 . 1 1 33 33 VAL CA C 33 62.500 62.500 66.247 -3.747 17856 4864 1 15 . 1 1 33 33 VAL H H 33 8.059 8.059 7.588 0.471 17856 4865 1 15 . 1 1 34 34 VAL N N 34 123.882 123.882 118.719 5.163 17856 4866 1 15 . 1 1 34 34 VAL H H 34 7.774 7.774 8.469 -0.695 17856 4867 1 15 . 1 1 35 35 LYS N N 35 125.250 125.250 120.323 4.927 17856 4868 1 15 . 1 1 35 35 LYS C C 35 176.719 176.719 178.264 -1.545 17856 4869 1 15 . 1 1 35 35 LYS CA C 35 56.502 56.502 59.279 -2.777 17856 4870 1 15 . 1 1 35 35 LYS H H 35 8.357 8.357 7.574 0.783 17856 4871 1 15 . 1 1 36 36 GLU N N 36 121.850 121.850 117.123 4.727 17856 4872 1 15 . 1 1 36 36 GLU C C 36 176.426 176.426 179.344 -2.918 17856 4873 1 15 . 1 1 36 36 GLU H H 36 8.423 8.423 7.814 0.609 17856 4874 1 15 . 1 1 37 37 SER N N 37 117.100 117.100 114.493 2.607 17856 4875 1 15 . 1 1 37 37 SER C C 37 174.854 174.854 176.125 -1.271 17856 4876 1 15 . 1 1 37 37 SER CA C 37 58.850 58.850 61.170 -2.320 17856 4877 1 15 . 1 1 37 37 SER H H 37 8.362 8.362 7.740 0.622 17856 4878 1 15 . 1 1 38 38 VAL N N 38 121.625 121.625 114.261 7.364 17856 4879 1 15 . 1 1 38 38 VAL C C 38 176.246 176.246 174.993 1.253 17856 4880 1 15 . 1 1 38 38 VAL CA C 38 63.043 63.043 60.579 2.464 17856 4881 1 15 . 1 1 38 38 VAL H H 38 8.225 8.225 7.399 0.826 17856 4882 1 15 . 1 1 39 39 ASN N N 39 121.150 121.150 119.216 1.934 17856 4883 1 15 . 1 1 39 39 ASN C C 39 175.459 175.459 175.975 -0.516 17856 4884 1 15 . 1 1 39 39 ASN CA C 39 53.568 53.568 55.428 -1.860 17856 4885 1 15 . 1 1 39 39 ASN H H 39 8.366 8.366 7.742 0.624 17856 4886 1 15 . 1 1 40 40 GLU N N 40 121.500 121.500 120.044 1.456 17856 4887 1 15 . 1 1 40 40 GLU C C 40 175.459 175.459 175.668 -0.209 17856 4888 1 15 . 1 1 40 40 GLU CA C 40 56.860 56.860 55.691 1.169 17856 4889 1 15 . 1 1 40 40 GLU H H 40 8.370 8.370 8.090 0.280 17856 4890 1 15 . 1 1 41 41 LEU N N 41 121.950 121.950 124.964 -3.014 17856 4891 1 15 . 1 1 41 41 LEU C C 41 177.939 177.939 177.549 0.390 17856 4892 1 15 . 1 1 41 41 LEU CA C 41 56.040 56.040 56.527 -0.487 17856 4893 1 15 . 1 1 41 41 LEU H H 41 8.152 8.152 7.798 0.354 17856 4894 1 15 . 1 1 42 42 SER N N 42 113.326 113.326 116.400 -3.074 17856 4895 1 15 . 1 1 42 42 SER C C 42 174.660 174.660 176.515 -1.855 17856 4896 1 15 . 1 1 42 42 SER CA C 42 58.940 58.940 61.477 -2.537 17856 4897 1 15 . 1 1 42 42 SER H H 42 8.373 8.373 8.477 -0.104 17856 4898 1 15 . 1 1 43 43 GLU N N 43 121.521 121.521 121.119 0.402 17856 4899 1 15 . 1 1 43 43 GLU C C 43 177.349 177.349 178.263 -0.914 17856 4900 1 15 . 1 1 43 43 GLU H H 43 7.329 7.329 8.587 -1.258 17856 4901 1 15 . 1 1 44 44 LYS N N 44 121.240 121.240 119.842 1.398 17856 4902 1 15 . 1 1 44 44 LYS C C 44 177.246 177.246 178.665 -1.419 17856 4903 1 15 . 1 1 44 44 LYS CA C 44 56.397 56.397 58.176 -1.779 17856 4904 1 15 . 1 1 44 44 LYS H H 44 8.103 8.103 7.515 0.588 17856 4905 1 15 . 1 1 45 45 ALA N N 45 119.568 119.568 122.048 -2.480 17856 4906 1 15 . 1 1 45 45 ALA C C 45 177.853 177.853 179.499 -1.646 17856 4907 1 15 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.836 -2.276 17856 4908 1 15 . 1 1 45 45 ALA H H 45 8.541 8.541 7.392 1.149 17856 4909 1 15 . 1 1 46 46 LYS N N 46 115.235 115.235 117.012 -1.777 17856 4910 1 15 . 1 1 46 46 LYS C C 46 177.110 177.110 178.405 -1.295 17856 4911 1 15 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.667 -1.871 17856 4912 1 15 . 1 1 46 46 LYS H H 46 7.257 7.257 7.695 -0.438 17856 4913 1 15 . 1 1 47 47 THR N N 47 103.239 103.239 110.996 -7.757 17856 4914 1 15 . 1 1 47 47 THR C C 47 173.973 173.973 175.167 -1.194 17856 4915 1 15 . 1 1 47 47 THR CA C 47 62.740 62.740 63.499 -0.759 17856 4916 1 15 . 1 1 47 47 THR H H 47 7.381 7.381 7.446 -0.065 17856 4917 1 15 . 1 1 48 48 ASP N N 48 122.976 122.976 123.295 -0.319 17856 4918 1 15 . 1 1 48 48 ASP H H 48 8.031 8.031 8.181 -0.150 17856 4919 1 15 . 1 1 49 49 PRO C C 49 178.106 178.106 178.296 -0.190 17856 4920 1 15 . 1 1 49 49 PRO CA C 49 64.219 64.219 65.131 -0.912 17856 4921 1 15 . 1 1 50 50 GLN N N 50 118.351 118.351 117.735 0.616 17856 4922 1 15 . 1 1 50 50 GLN C C 50 176.944 176.944 178.030 -1.086 17856 4923 1 15 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.931 -2.131 17856 4924 1 15 . 1 1 50 50 GLN H H 50 8.304 8.304 8.747 -0.443 17856 4925 1 15 . 1 1 51 51 ALA N N 51 124.206 124.206 122.008 2.198 17856 4926 1 15 . 1 1 51 51 ALA C C 51 178.490 178.490 179.102 -0.612 17856 4927 1 15 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.388 -0.964 17856 4928 1 15 . 1 1 51 51 ALA H H 51 7.547 7.547 7.498 0.049 17856 4929 1 15 . 1 1 52 52 ALA N N 52 118.686 118.686 121.865 -3.179 17856 4930 1 15 . 1 1 52 52 ALA C C 52 177.953 177.953 179.794 -1.841 17856 4931 1 15 . 1 1 52 52 ALA H H 52 7.931 7.931 7.705 0.226 17856 4932 1 15 . 1 1 53 53 GLU N N 53 120.075 120.075 117.646 2.429 17856 4933 1 15 . 1 1 53 53 GLU H H 53 7.729 7.729 7.884 -0.155 17856 4934 1 15 . 1 1 55 55 LEU N N 55 123.640 123.640 119.772 3.868 17856 4935 1 15 . 1 1 55 55 LEU C C 55 177.587 177.587 178.971 -1.384 17856 4936 1 15 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.551 -1.764 17856 4937 1 15 . 1 1 55 55 LEU H H 55 8.215 8.215 8.510 -0.295 17856 4938 1 15 . 1 1 56 56 ASN N N 56 118.520 118.520 118.884 -0.364 17856 4939 1 15 . 1 1 56 56 ASN C C 56 175.700 175.700 177.762 -2.062 17856 4940 1 15 . 1 1 56 56 ASN CA C 56 54.132 54.132 56.381 -2.249 17856 4941 1 15 . 1 1 56 56 ASN H H 56 8.250 8.250 8.258 -0.008 17856 4942 1 15 . 1 1 57 57 LYS N N 57 120.960 120.960 119.839 1.121 17856 4943 1 15 . 1 1 57 57 LYS C C 57 176.637 176.637 178.896 -2.259 17856 4944 1 15 . 1 1 57 57 LYS H H 57 8.065 8.065 8.061 0.004 17856 4945 1 15 . 1 1 58 58 LEU N N 58 122.610 122.610 119.546 3.064 17856 4946 1 15 . 1 1 58 58 LEU C C 58 177.433 177.433 179.029 -1.596 17856 4947 1 15 . 1 1 58 58 LEU CA C 58 55.120 55.120 57.679 -2.559 17856 4948 1 15 . 1 1 58 58 LEU H H 58 8.135 8.135 7.804 0.331 17856 4949 1 15 . 1 1 59 59 ILE N N 59 122.045 122.045 118.995 3.050 17856 4950 1 15 . 1 1 59 59 ILE CA C 59 61.535 61.535 62.508 -0.973 17856 4951 1 15 . 1 1 59 59 ILE H H 59 8.220 8.220 7.730 0.490 17856 4952 1 15 . 1 1 60 60 GLU N N 60 124.000 124.000 120.169 3.831 17856 4953 1 15 . 1 1 60 60 GLU C C 60 177.007 177.007 177.087 -0.080 17856 4954 1 15 . 1 1 60 60 GLU CA C 60 56.722 56.722 57.693 -0.971 17856 4955 1 15 . 1 1 60 60 GLU H H 60 8.340 8.340 7.871 0.469 17856 4956 1 15 . 1 1 61 61 GLY N N 61 110.520 110.520 107.249 3.271 17856 4957 1 15 . 1 1 61 61 GLY C C 61 174.002 174.002 173.263 0.739 17856 4958 1 15 . 1 1 61 61 GLY CA C 61 45.405 45.405 45.331 0.074 17856 4959 1 15 . 1 1 61 61 GLY H H 61 8.557 8.557 7.640 0.917 17856 4960 1 15 . 1 1 62 62 TYR N N 62 119.600 119.600 122.665 -3.065 17856 4961 1 15 . 1 1 62 62 TYR C C 62 175.940 175.940 175.227 0.713 17856 4962 1 15 . 1 1 62 62 TYR CA C 62 58.108 58.108 57.895 0.213 17856 4963 1 15 . 1 1 62 62 TYR H H 62 7.980 7.980 7.951 0.029 17856 4964 1 15 . 1 1 63 63 THR N N 63 116.304 116.304 120.485 -4.181 17856 4965 1 15 . 1 1 63 63 THR C C 63 173.796 173.796 172.965 0.831 17856 4966 1 15 . 1 1 63 63 THR H H 63 8.049 8.049 8.478 -0.429 17856 4967 1 15 . 1 1 64 64 TYR N N 64 122.050 122.050 120.626 1.424 17856 4968 1 15 . 1 1 64 64 TYR C C 64 176.290 176.290 173.840 2.450 17856 4969 1 15 . 1 1 64 64 TYR CA C 64 58.533 58.533 57.688 0.845 17856 4970 1 15 . 1 1 64 64 TYR H H 64 8.133 8.133 7.297 0.836 17856 4971 1 15 . 1 1 65 65 GLY N N 65 110.456 110.456 112.494 -2.038 17856 4972 1 15 . 1 1 65 65 GLY C C 65 174.340 174.340 173.785 0.555 17856 4973 1 15 . 1 1 65 65 GLY CA C 65 45.328 45.328 45.577 -0.249 17856 4974 1 15 . 1 1 65 65 GLY H H 65 7.747 7.747 8.062 -0.315 17856 4975 1 15 . 1 1 66 66 GLU N N 66 120.783 120.783 119.036 1.747 17856 4976 1 15 . 1 1 66 66 GLU C C 66 176.895 176.895 177.095 -0.200 17856 4977 1 15 . 1 1 66 66 GLU CA C 66 56.804 56.804 56.754 0.050 17856 4978 1 15 . 1 1 66 66 GLU H H 66 8.243 8.243 8.644 -0.401 17856 4979 1 15 . 1 1 67 67 GLU N N 67 121.587 121.587 118.682 2.905 17856 4980 1 15 . 1 1 67 67 GLU C C 67 176.340 176.340 177.695 -1.355 17856 4981 1 15 . 1 1 67 67 GLU H H 67 8.611 8.611 8.833 -0.222 17856 4982 1 15 . 1 1 68 68 ARG N N 68 121.790 121.790 120.886 0.904 17856 4983 1 15 . 1 1 68 68 ARG C C 68 176.350 176.350 177.936 -1.586 17856 4984 1 15 . 1 1 68 68 ARG H H 68 8.267 8.267 7.730 0.537 17856 4985 1 15 . 1 1 69 69 LYS N N 69 118.431 118.431 120.079 -1.648 17856 4986 1 15 . 1 1 69 69 LYS H H 69 7.567 7.567 7.601 -0.035 17856 4987 1 15 . 1 1 70 70 LEU C C 70 177.338 177.338 178.745 -1.407 17856 4988 1 15 . 1 1 70 70 LEU CA C 70 55.533 55.533 57.013 -1.480 17856 4989 1 15 . 1 1 71 71 TYR N N 71 119.504 119.504 117.998 1.506 17856 4990 1 15 . 1 1 71 71 TYR H H 71 7.997 7.997 7.280 0.717 17856 4991 1 15 . 1 1 72 72 ASP C C 72 176.528 176.528 177.956 -1.428 17856 4992 1 15 . 1 1 72 72 ASP CA C 72 54.693 54.693 56.915 -2.222 17856 4993 1 15 . 1 1 73 73 SER N N 73 117.000 117.000 114.373 2.627 17856 4994 1 15 . 1 1 73 73 SER C C 73 174.950 174.950 175.960 -1.010 17856 4995 1 15 . 1 1 73 73 SER CA C 73 58.997 58.997 60.248 -1.251 17856 4996 1 15 . 1 1 73 73 SER H H 73 8.282 8.282 7.576 0.706 17856 4997 1 15 . 1 1 74 74 ALA N N 74 125.422 125.422 125.450 -0.028 17856 4998 1 15 . 1 1 74 74 ALA C C 74 178.389 178.389 179.404 -1.015 17856 4999 1 15 . 1 1 74 74 ALA CA C 74 53.433 53.433 54.987 -1.554 17856 5000 1 15 . 1 1 74 74 ALA H H 74 8.339 8.339 7.562 0.777 17856 5001 1 15 . 1 1 75 75 LEU N N 75 120.019 120.019 118.168 1.851 17856 5002 1 15 . 1 1 75 75 LEU C C 75 177.954 177.954 178.840 -0.886 17856 5003 1 15 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.200 -1.421 17856 5004 1 15 . 1 1 75 75 LEU H H 75 7.948 7.948 7.787 0.161 17856 5005 1 15 . 1 1 76 76 SER N N 76 113.321 113.321 113.977 -0.656 17856 5006 1 15 . 1 1 76 76 SER C C 76 174.784 174.784 176.447 -1.663 17856 5007 1 15 . 1 1 76 76 SER CA C 76 59.173 59.173 61.525 -2.352 17856 5008 1 15 . 1 1 76 76 SER H H 76 7.951 7.951 7.935 0.016 17856 5009 1 15 . 1 1 77 77 LYS N N 77 122.710 122.710 121.835 0.875 17856 5010 1 15 . 1 1 77 77 LYS C C 77 176.734 176.734 178.919 -2.185 17856 5011 1 15 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.152 -0.762 17856 5012 1 15 . 1 1 77 77 LYS H H 77 8.170 8.170 7.307 0.863 17856 5013 1 15 . 1 1 78 78 ILE N N 78 121.521 121.521 119.337 2.184 17856 5014 1 15 . 1 1 78 78 ILE C C 78 176.512 176.512 178.111 -1.599 17856 5015 1 15 . 1 1 78 78 ILE H H 78 8.160 8.160 7.467 0.693 17856 5016 1 15 . 1 1 79 79 GLU N N 79 123.840 123.840 121.033 2.807 17856 5017 1 15 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.877 -4.399 17856 5018 1 15 . 1 1 79 79 GLU H H 79 8.360 8.360 8.229 0.131 17856 5019 1 15 . 1 1 80 80 LYS N N 80 122.143 122.143 119.564 2.579 17856 5020 1 15 . 1 1 80 80 LYS C C 80 176.937 176.937 179.095 -2.158 17856 5021 1 15 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.208 -2.708 17856 5022 1 15 . 1 1 80 80 LYS H H 80 8.231 8.231 7.598 0.633 17856 5023 1 15 . 1 1 81 81 LEU N N 81 122.095 122.095 122.130 -0.035 17856 5024 1 15 . 1 1 81 81 LEU C C 81 177.531 177.531 178.774 -1.243 17856 5025 1 15 . 1 1 81 81 LEU H H 81 8.050 8.050 7.696 0.354 17856 5026 1 15 . 1 1 82 82 ILE N N 82 120.609 120.609 118.082 2.527 17856 5027 1 15 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.309 -3.949 17856 5028 1 15 . 1 1 82 82 ILE H H 82 8.000 8.000 8.295 -0.295 17856 5029 1 15 . 1 1 83 83 GLU N N 83 124.611 124.611 120.817 3.794 17856 5030 1 15 . 1 1 83 83 GLU C C 83 177.298 177.298 179.442 -2.144 17856 5031 1 15 . 1 1 83 83 GLU H H 83 8.380 8.380 7.999 0.381 17856 5032 1 15 . 1 1 84 84 THR N N 84 115.107 115.107 116.245 -1.138 17856 5033 1 15 . 1 1 84 84 THR C C 84 174.400 174.400 175.535 -1.135 17856 5034 1 15 . 1 1 84 84 THR CA C 84 62.659 62.659 66.082 -3.423 17856 5035 1 15 . 1 1 84 84 THR H H 84 8.064 8.064 8.047 0.017 17856 5036 1 15 . 1 1 85 85 LEU N N 85 124.150 124.150 119.654 4.496 17856 5037 1 15 . 1 1 85 85 LEU C C 85 177.120 177.120 176.726 0.394 17856 5038 1 15 . 1 1 85 85 LEU CA C 85 55.020 55.020 54.771 0.249 17856 5039 1 15 . 1 1 85 85 LEU H H 85 8.238 8.238 7.355 0.883 17856 5040 1 15 . 1 1 86 86 SER N N 86 114.913 114.913 115.730 -0.817 17856 5041 1 15 . 1 1 86 86 SER H H 86 7.678 7.678 7.535 0.143 17856 5042 1 15 . 1 1 87 87 PRO CA C 87 63.550 63.550 64.518 -0.968 17856 5043 1 15 . 1 1 88 88 ALA N N 88 123.767 123.767 117.591 6.176 17856 5044 1 15 . 1 1 88 88 ALA C C 88 178.131 178.131 178.016 0.115 17856 5045 1 15 . 1 1 88 88 ALA CA C 88 52.878 52.878 54.249 -1.371 17856 5046 1 15 . 1 1 88 88 ALA H H 88 8.342 8.342 8.645 -0.303 17856 5047 1 15 . 1 1 89 89 ARG N N 89 119.159 119.159 119.832 -0.673 17856 5048 1 15 . 1 1 89 89 ARG C C 89 176.620 176.620 175.887 0.733 17856 5049 1 15 . 1 1 89 89 ARG H H 89 8.133 8.133 8.620 -0.487 17856 5050 1 15 . 1 1 90 90 SER N N 90 116.910 116.910 113.361 3.549 17856 5051 1 15 . 1 1 90 90 SER C C 90 174.887 174.887 172.405 2.482 17856 5052 1 15 . 1 1 90 90 SER H H 90 8.322 8.322 8.230 0.092 17856 5053 1 15 . 1 1 91 91 LYS N N 91 123.457 123.457 121.170 2.287 17856 5054 1 15 . 1 1 91 91 LYS C C 91 176.970 176.970 176.483 0.487 17856 5055 1 15 . 1 1 91 91 LYS H H 91 8.396 8.396 8.449 -0.053 17856 5056 1 15 . 1 1 92 92 SER N N 92 116.692 116.692 115.998 0.694 17856 5057 1 15 . 1 1 92 92 SER C C 92 174.573 174.573 174.216 0.357 17856 5058 1 15 . 1 1 92 92 SER CA C 92 58.600 58.600 58.305 0.295 17856 5059 1 15 . 1 1 92 92 SER H H 92 8.297 8.297 8.379 -0.082 17856 5060 1 15 . 1 1 93 93 GLN N N 93 121.916 121.916 121.038 0.878 17856 5061 1 15 . 1 1 93 93 GLN C C 93 175.971 175.971 176.136 -0.165 17856 5062 1 15 . 1 1 93 93 GLN H H 93 8.325 8.325 7.951 0.374 17856 5063 1 15 . 1 1 94 94 SER N N 94 117.385 117.385 115.196 2.189 17856 5064 1 15 . 1 1 94 94 SER C C 94 173.940 173.940 173.281 0.659 17856 5065 1 15 . 1 1 94 94 SER CA C 94 58.520 58.520 58.672 -0.152 17856 5066 1 15 . 1 1 94 94 SER H H 94 8.352 8.352 8.605 -0.253 17856 5067 1 15 . 1 1 95 95 THR N N 95 120.756 120.756 114.726 6.030 17856 5068 1 15 . 1 1 95 95 THR H H 95 7.805 7.805 7.717 0.088 17856 5069 1 15 . 1 1 99 99 ARG C C 99 176.250 176.250 175.470 0.780 17856 5070 1 15 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.563 -0.406 17856 5071 1 15 . 1 1 100 100 ASN N N 100 118.482 118.482 116.213 2.269 17856 5072 1 15 . 1 1 100 100 ASN H H 100 8.272 8.272 8.487 -0.215 17856 5073 1 15 . 1 1 101 101 ARG C C 101 176.280 176.280 175.362 0.918 17856 5074 1 15 . 1 1 102 102 ASN N N 102 118.688 118.688 124.661 -5.973 17856 5075 1 15 . 1 1 102 102 ASN C C 102 174.996 174.996 175.671 -0.675 17856 5076 1 15 . 1 1 102 102 ASN CA C 102 53.609 53.609 53.211 0.398 17856 5077 1 15 . 1 1 102 102 ASN H H 102 8.424 8.424 8.727 -0.303 17856 5078 1 15 . 1 1 103 103 ASN N N 103 118.865 118.865 118.118 0.747 17856 5079 1 15 . 1 1 103 103 ASN C C 103 175.040 175.040 174.519 0.521 17856 5080 1 15 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.714 0.098 17856 5081 1 15 . 1 1 103 103 ASN H H 103 8.282 8.282 8.275 0.007 17856 5082 1 15 . 1 1 104 104 ARG N N 104 120.875 120.875 116.175 4.700 17856 5083 1 15 . 1 1 104 104 ARG H H 104 8.140 8.140 8.661 -0.521 17856 5084 1 15 . 1 1 106 106 ILE C C 106 175.408 175.408 175.858 -0.450 17856 5085 1 15 . 1 1 106 106 ILE CA C 106 61.395 61.395 62.300 -0.904 17856 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 92 3.145 -1.336 2.862 17856 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 17856 3 1 1 "Average Difference" C 86 1.478 0.737 1.288 17856 4 1 1 "Average Difference" CA 69 2.114 1.468 1.533 17856 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 17856 6 1 1 "Average Difference" HN 92 0.443 -0.136 0.424 17856 7 1 2 "Average Difference" N 92 2.729 -1.287 2.420 17856 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 17856 9 1 2 "Average Difference" C 86 1.494 0.886 1.210 17856 10 1 2 "Average Difference" CA 69 2.043 1.411 1.489 17856 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 17856 12 1 2 "Average Difference" HN 92 0.510 -0.163 0.486 17856 13 1 3 "Average Difference" N 92 2.938 -1.497 2.542 17856 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 17856 15 1 3 "Average Difference" C 86 1.520 0.994 1.157 17856 16 1 3 "Average Difference" CA 69 2.054 1.507 1.406 17856 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 17856 18 1 3 "Average Difference" HN 92 0.497 -0.226 0.445 17856 19 1 4 "Average Difference" N 92 3.119 -1.569 2.710 17856 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 17856 21 1 4 "Average Difference" C 86 1.493 1.053 1.065 17856 22 1 4 "Average Difference" CA 69 2.213 1.780 1.325 17856 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 17856 24 1 4 "Average Difference" HN 92 0.501 -0.180 0.470 17856 25 1 5 "Average Difference" N 92 2.922 -1.300 2.631 17856 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 17856 27 1 5 "Average Difference" C 86 1.465 0.936 1.134 17856 28 1 5 "Average Difference" CA 69 2.077 1.568 1.373 17856 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 17856 30 1 5 "Average Difference" HN 92 0.489 -0.195 0.451 17856 31 1 6 "Average Difference" N 92 3.002 -1.193 2.770 17856 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 17856 33 1 6 "Average Difference" C 86 1.454 0.946 1.111 17856 34 1 6 "Average Difference" CA 69 2.066 1.584 1.336 17856 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 17856 36 1 6 "Average Difference" HN 92 0.489 -0.200 0.449 17856 37 1 7 "Average Difference" N 92 3.117 -1.286 2.855 17856 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 17856 39 1 7 "Average Difference" C 86 1.542 0.963 1.212 17856 40 1 7 "Average Difference" CA 69 2.056 1.574 1.333 17856 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 17856 42 1 7 "Average Difference" HN 92 0.496 -0.182 0.464 17856 43 1 8 "Average Difference" N 92 2.975 -1.241 2.719 17856 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 17856 45 1 8 "Average Difference" C 86 1.344 0.751 1.121 17856 46 1 8 "Average Difference" CA 69 1.975 1.436 1.366 17856 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 17856 48 1 8 "Average Difference" HN 92 0.519 -0.163 0.495 17856 49 1 9 "Average Difference" N 92 2.959 -1.539 2.541 17856 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 17856 51 1 9 "Average Difference" C 86 1.402 0.882 1.097 17856 52 1 9 "Average Difference" CA 69 2.076 1.421 1.525 17856 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 17856 54 1 9 "Average Difference" HN 92 0.496 -0.229 0.442 17856 55 1 10 "Average Difference" N 92 3.114 -1.498 2.745 17856 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 17856 57 1 10 "Average Difference" C 86 1.468 0.789 1.245 17856 58 1 10 "Average Difference" CA 69 2.090 1.581 1.376 17856 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 17856 60 1 10 "Average Difference" HN 92 0.489 -0.251 0.421 17856 61 1 11 "Average Difference" N 92 3.134 -1.450 2.794 17856 62 1 11 "Average Difference" HA 0 0.000 0.000 0.000 17856 63 1 11 "Average Difference" C 86 1.447 0.941 1.106 17856 64 1 11 "Average Difference" CA 69 2.171 1.604 1.473 17856 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 17856 66 1 11 "Average Difference" HN 92 0.481 -0.144 0.461 17856 67 1 12 "Average Difference" N 92 3.229 -1.360 2.944 17856 68 1 12 "Average Difference" HA 0 0.000 0.000 0.000 17856 69 1 12 "Average Difference" C 86 1.429 0.828 1.171 17856 70 1 12 "Average Difference" CA 69 1.965 1.435 1.352 17856 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 17856 72 1 12 "Average Difference" HN 92 0.506 -0.229 0.454 17856 73 1 13 "Average Difference" N 92 3.089 -1.336 2.800 17856 74 1 13 "Average Difference" HA 0 0.000 0.000 0.000 17856 75 1 13 "Average Difference" C 86 1.383 0.661 1.222 17856 76 1 13 "Average Difference" CA 69 2.074 1.369 1.568 17856 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 17856 78 1 13 "Average Difference" HN 92 0.475 -0.123 0.461 17856 79 1 14 "Average Difference" N 92 2.834 -1.302 2.531 17856 80 1 14 "Average Difference" HA 0 0.000 0.000 0.000 17856 81 1 14 "Average Difference" C 86 1.458 0.869 1.177 17856 82 1 14 "Average Difference" CA 69 2.098 1.592 1.377 17856 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 17856 84 1 14 "Average Difference" HN 92 0.525 -0.220 0.480 17856 85 1 15 "Average Difference" N 92 3.144 -1.550 2.750 17856 86 1 15 "Average Difference" HA 0 0.000 0.000 0.000 17856 87 1 15 "Average Difference" C 86 1.530 0.941 1.214 17856 88 1 15 "Average Difference" CA 69 2.083 1.550 1.401 17856 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 17856 90 1 15 "Average Difference" HN 92 0.504 -0.202 0.465 17856 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 17856 _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 SER N N 2 116.304 116.304 118.848 -2.544 17856 2 1 . 1 1 2 2 SER C C 2 174.710 174.710 174.984 -0.274 17856 3 1 . 1 1 2 2 SER CA C 2 58.908 58.908 59.351 -0.443 17856 4 1 . 1 1 2 2 SER H H 2 8.003 8.003 8.612 -0.609 17856 5 1 . 1 1 3 3 ILE N N 3 122.062 122.062 123.154 -1.092 17856 6 1 . 1 1 3 3 ILE C C 3 176.750 176.750 176.356 0.394 17856 7 1 . 1 1 3 3 ILE CA C 3 61.786 61.786 62.830 -1.044 17856 8 1 . 1 1 3 3 ILE H H 3 7.957 7.957 8.165 -0.208 17856 9 1 . 1 1 4 4 VAL N N 4 122.674 122.674 119.032 3.642 17856 10 1 . 1 1 4 4 VAL C C 4 176.221 176.221 176.338 -0.117 17856 11 1 . 1 1 4 4 VAL CA C 4 62.970 62.970 63.759 -0.789 17856 12 1 . 1 1 4 4 VAL H H 4 7.970 7.970 7.879 0.091 17856 13 1 . 1 1 5 5 SER N N 5 117.750 117.750 114.964 2.786 17856 14 1 . 1 1 5 5 SER C C 5 174.858 174.858 175.533 -0.675 17856 15 1 . 1 1 5 5 SER CA C 5 58.630 58.630 60.248 -1.618 17856 16 1 . 1 1 5 5 SER H H 5 8.093 8.093 7.940 0.153 17856 17 1 . 1 1 6 6 GLN N N 6 121.961 121.961 120.745 1.216 17856 18 1 . 1 1 6 6 GLN C C 6 176.467 176.467 176.602 -0.135 17856 19 1 . 1 1 6 6 GLN CA C 6 56.226 56.226 56.918 -0.691 17856 20 1 . 1 1 6 6 GLN H H 6 8.371 8.371 8.068 0.303 17856 21 1 . 1 1 7 7 THR N N 7 115.325 115.325 113.647 1.678 17856 22 1 . 1 1 7 7 THR C C 7 174.752 174.752 175.686 -0.934 17856 23 1 . 1 1 7 7 THR H H 7 8.152 8.152 7.922 0.230 17856 24 1 . 1 1 8 8 ARG N N 8 122.530 122.530 121.440 1.090 17856 25 1 . 1 1 8 8 ARG C C 8 176.200 176.200 177.488 -1.288 17856 26 1 . 1 1 8 8 ARG CA C 8 56.570 56.570 57.620 -1.050 17856 27 1 . 1 1 8 8 ARG H H 8 8.211 8.211 8.195 0.016 17856 28 1 . 1 1 9 9 ASN N N 9 119.600 119.600 118.793 0.807 17856 29 1 . 1 1 9 9 ASN C C 9 177.164 177.164 176.773 0.391 17856 30 1 . 1 1 9 9 ASN H H 9 8.398 8.398 8.148 0.250 17856 31 1 . 1 1 10 10 LYS N N 10 121.600 121.600 120.273 1.327 17856 32 1 . 1 1 10 10 LYS C C 10 176.845 176.845 178.704 -1.859 17856 33 1 . 1 1 10 10 LYS CA C 10 57.110 57.110 59.187 -2.077 17856 34 1 . 1 1 10 10 LYS H H 10 8.190 8.190 8.042 0.148 17856 35 1 . 1 1 11 11 GLU N N 11 120.700 120.700 119.307 1.393 17856 36 1 . 1 1 11 11 GLU C C 11 176.825 176.825 178.709 -1.884 17856 37 1 . 1 1 11 11 GLU CA C 11 56.690 56.690 59.149 -2.459 17856 38 1 . 1 1 11 11 GLU H H 11 8.323 8.323 7.748 0.575 17856 39 1 . 1 1 12 12 LEU N N 12 122.390 122.390 121.577 0.813 17856 40 1 . 1 1 12 12 LEU C C 12 177.670 177.670 178.880 -1.210 17856 41 1 . 1 1 12 12 LEU CA C 12 55.470 55.470 58.267 -2.797 17856 42 1 . 1 1 12 12 LEU H H 12 8.155 8.155 7.987 0.168 17856 43 1 . 1 1 13 13 LEU N N 13 122.570 122.570 116.380 6.190 17856 44 1 . 1 1 13 13 LEU C C 13 177.510 177.510 178.593 -1.083 17856 45 1 . 1 1 13 13 LEU CA C 13 55.581 55.581 58.488 -2.907 17856 46 1 . 1 1 13 13 LEU H H 13 8.220 8.220 8.084 0.136 17856 47 1 . 1 1 14 14 ASP N N 14 120.780 120.780 120.691 0.089 17856 48 1 . 1 1 14 14 ASP C C 14 176.480 176.480 178.626 -2.146 17856 49 1 . 1 1 14 14 ASP CA C 14 54.650 54.650 58.021 -3.371 17856 50 1 . 1 1 14 14 ASP H H 14 8.243 8.243 8.034 0.209 17856 51 1 . 1 1 15 15 LYS N N 15 120.900 120.900 119.394 1.506 17856 52 1 . 1 1 15 15 LYS C C 15 175.580 175.580 179.009 -3.429 17856 53 1 . 1 1 15 15 LYS H H 15 8.052 8.052 8.081 -0.029 17856 54 1 . 1 1 16 16 LYS N N 16 121.980 121.980 120.064 1.916 17856 55 1 . 1 1 16 16 LYS C C 16 176.887 176.887 179.007 -2.120 17856 56 1 . 1 1 16 16 LYS CA C 16 56.334 56.334 58.674 -2.340 17856 57 1 . 1 1 16 16 LYS H H 16 8.243 8.243 7.706 0.537 17856 58 1 . 1 1 17 17 ILE N N 17 121.940 121.940 119.354 2.586 17856 59 1 . 1 1 17 17 ILE H H 17 8.110 8.110 8.280 -0.170 17856 60 1 . 1 1 18 18 ARG C C 18 176.520 176.520 178.263 -1.743 17856 61 1 . 1 1 19 19 SER N N 19 117.150 117.150 114.688 2.462 17856 62 1 . 1 1 19 19 SER C C 19 175.167 175.167 176.172 -1.005 17856 63 1 . 1 1 19 19 SER CA C 19 58.840 58.840 61.526 -2.686 17856 64 1 . 1 1 19 19 SER H H 19 8.396 8.396 7.799 0.597 17856 65 1 . 1 1 20 20 GLU N N 20 123.176 123.176 122.089 1.087 17856 66 1 . 1 1 20 20 GLU C C 20 176.921 176.921 178.927 -2.006 17856 67 1 . 1 1 20 20 GLU CA C 20 56.860 56.860 59.254 -2.394 17856 68 1 . 1 1 20 20 GLU H H 20 8.478 8.478 7.740 0.738 17856 69 1 . 1 1 21 21 ILE N N 21 120.550 120.550 115.169 5.381 17856 70 1 . 1 1 21 21 ILE C C 21 176.550 176.550 178.023 -1.473 17856 71 1 . 1 1 21 21 ILE CA C 21 61.630 61.630 64.608 -2.978 17856 72 1 . 1 1 21 21 ILE H H 21 8.080 8.080 7.474 0.606 17856 73 1 . 1 1 22 22 GLU N N 22 123.685 123.685 120.699 2.986 17856 74 1 . 1 1 22 22 GLU C C 22 176.109 176.109 178.691 -2.582 17856 75 1 . 1 1 22 22 GLU H H 22 8.309 8.309 7.677 0.632 17856 76 1 . 1 1 23 23 ALA N N 23 124.280 124.280 122.744 1.536 17856 77 1 . 1 1 23 23 ALA C C 23 178.474 178.474 179.683 -1.209 17856 78 1 . 1 1 23 23 ALA CA C 23 53.406 53.406 55.061 -1.655 17856 79 1 . 1 1 23 23 ALA H H 23 8.088 8.088 8.103 -0.015 17856 80 1 . 1 1 24 24 ILE N N 24 120.330 120.330 118.660 1.670 17856 81 1 . 1 1 24 24 ILE C C 24 176.309 176.309 177.748 -1.439 17856 82 1 . 1 1 24 24 ILE CA C 24 61.540 61.540 64.929 -3.389 17856 83 1 . 1 1 24 24 ILE H H 24 7.980 7.980 8.191 -0.211 17856 84 1 . 1 1 25 25 LYS N N 25 124.310 124.310 119.832 4.478 17856 85 1 . 1 1 25 25 LYS C C 25 176.365 176.365 178.525 -2.160 17856 86 1 . 1 1 25 25 LYS CA C 25 56.334 56.334 59.042 -2.708 17856 87 1 . 1 1 25 25 LYS H H 25 8.198 8.198 7.925 0.273 17856 88 1 . 1 1 26 26 LYS N N 26 122.518 122.518 118.657 3.861 17856 89 1 . 1 1 26 26 LYS C C 26 176.365 176.365 178.491 -2.126 17856 90 1 . 1 1 26 26 LYS CA C 26 56.175 56.175 58.398 -2.223 17856 91 1 . 1 1 26 26 LYS H H 26 8.125 8.125 7.384 0.741 17856 92 1 . 1 1 27 27 ILE N N 27 122.670 122.670 120.510 2.160 17856 93 1 . 1 1 27 27 ILE C C 27 176.261 176.261 178.155 -1.894 17856 94 1 . 1 1 27 27 ILE CA C 27 61.294 61.294 64.651 -3.357 17856 95 1 . 1 1 27 27 ILE H H 27 8.114 8.114 7.819 0.295 17856 96 1 . 1 1 28 28 ILE N N 28 125.178 125.178 119.377 5.801 17856 97 1 . 1 1 28 28 ILE C C 28 175.803 175.803 176.792 -0.989 17856 98 1 . 1 1 28 28 ILE CA C 28 61.080 61.080 63.704 -2.624 17856 99 1 . 1 1 28 28 ILE H H 28 8.220 8.220 7.977 0.243 17856 100 1 . 1 1 29 29 ALA N N 29 127.850 127.850 121.323 6.527 17856 101 1 . 1 1 29 29 ALA C C 29 177.627 177.627 179.480 -1.853 17856 102 1 . 1 1 29 29 ALA CA C 29 53.684 53.684 54.633 -0.949 17856 103 1 . 1 1 29 29 ALA H H 29 8.300 8.300 7.278 1.023 17856 104 1 . 1 1 30 30 GLU N N 30 120.000 120.000 119.110 0.890 17856 105 1 . 1 1 30 30 GLU C C 30 176.321 176.321 178.764 -2.443 17856 106 1 . 1 1 30 30 GLU H H 30 8.258 8.258 7.825 0.433 17856 107 1 . 1 1 31 31 PHE N N 31 119.128 119.128 118.002 1.126 17856 108 1 . 1 1 31 31 PHE C C 31 175.180 175.180 178.081 -2.901 17856 109 1 . 1 1 31 31 PHE CA C 31 57.540 57.540 60.932 -3.392 17856 110 1 . 1 1 31 31 PHE H H 31 8.061 8.061 7.483 0.578 17856 111 1 . 1 1 32 32 ASP N N 32 121.800 121.800 119.124 2.676 17856 112 1 . 1 1 32 32 ASP C C 32 175.894 175.894 178.239 -2.345 17856 113 1 . 1 1 32 32 ASP CA C 32 54.529 54.529 56.985 -2.456 17856 114 1 . 1 1 32 32 ASP H H 32 8.275 8.275 7.802 0.473 17856 115 1 . 1 1 33 33 VAL N N 33 119.648 119.648 119.609 0.039 17856 116 1 . 1 1 33 33 VAL C C 33 176.268 176.268 178.141 -1.873 17856 117 1 . 1 1 33 33 VAL CA C 33 62.500 62.500 65.893 -3.393 17856 118 1 . 1 1 33 33 VAL H H 33 8.059 8.059 7.539 0.520 17856 119 1 . 1 1 34 34 VAL N N 34 123.882 123.882 118.622 5.260 17856 120 1 . 1 1 34 34 VAL H H 34 7.774 7.774 8.183 -0.409 17856 121 1 . 1 1 35 35 LYS N N 35 125.250 125.250 119.710 5.540 17856 122 1 . 1 1 35 35 LYS C C 35 176.719 176.719 177.377 -0.658 17856 123 1 . 1 1 35 35 LYS CA C 35 56.502 56.502 58.532 -2.030 17856 124 1 . 1 1 35 35 LYS H H 35 8.357 8.357 7.734 0.623 17856 125 1 . 1 1 36 36 GLU N N 36 121.850 121.850 118.229 3.621 17856 126 1 . 1 1 36 36 GLU C C 36 176.426 176.426 177.562 -1.136 17856 127 1 . 1 1 36 36 GLU H H 36 8.423 8.423 7.933 0.490 17856 128 1 . 1 1 37 37 SER N N 37 117.100 117.100 115.401 1.699 17856 129 1 . 1 1 37 37 SER C C 37 174.854 174.854 175.518 -0.664 17856 130 1 . 1 1 37 37 SER CA C 37 58.850 58.850 60.224 -1.374 17856 131 1 . 1 1 37 37 SER H H 37 8.362 8.362 8.003 0.359 17856 132 1 . 1 1 38 38 VAL N N 38 121.625 121.625 120.220 1.405 17856 133 1 . 1 1 38 38 VAL C C 38 176.246 176.246 175.295 0.951 17856 134 1 . 1 1 38 38 VAL CA C 38 63.043 63.043 62.336 0.707 17856 135 1 . 1 1 38 38 VAL H H 38 8.225 8.225 7.741 0.484 17856 136 1 . 1 1 39 39 ASN N N 39 121.150 121.150 121.279 -0.129 17856 137 1 . 1 1 39 39 ASN C C 39 175.459 175.459 175.848 -0.389 17856 138 1 . 1 1 39 39 ASN CA C 39 53.568 53.568 54.214 -0.646 17856 139 1 . 1 1 39 39 ASN H H 39 8.366 8.366 8.138 0.228 17856 140 1 . 1 1 40 40 GLU N N 40 121.500 121.500 120.088 1.412 17856 141 1 . 1 1 40 40 GLU C C 40 175.459 175.459 176.376 -0.917 17856 142 1 . 1 1 40 40 GLU CA C 40 56.860 56.860 56.838 0.022 17856 143 1 . 1 1 40 40 GLU H H 40 8.370 8.370 8.289 0.081 17856 144 1 . 1 1 41 41 LEU N N 41 121.950 121.950 120.816 1.134 17856 145 1 . 1 1 41 41 LEU C C 41 177.939 177.939 177.539 0.400 17856 146 1 . 1 1 41 41 LEU CA C 41 56.040 56.040 56.077 -0.037 17856 147 1 . 1 1 41 41 LEU H H 41 8.152 8.152 7.996 0.156 17856 148 1 . 1 1 42 42 SER N N 42 113.326 113.326 115.878 -2.552 17856 149 1 . 1 1 42 42 SER C C 42 174.660 174.660 176.377 -1.717 17856 150 1 . 1 1 42 42 SER CA C 42 58.940 58.940 61.005 -2.064 17856 151 1 . 1 1 42 42 SER H H 42 8.373 8.373 8.055 0.318 17856 152 1 . 1 1 43 43 GLU N N 43 121.521 121.521 121.196 0.325 17856 153 1 . 1 1 43 43 GLU C C 43 177.349 177.349 178.501 -1.152 17856 154 1 . 1 1 43 43 GLU H H 43 7.329 7.329 8.290 -0.961 17856 155 1 . 1 1 44 44 LYS N N 44 121.240 121.240 119.550 1.690 17856 156 1 . 1 1 44 44 LYS C C 44 177.246 177.246 178.296 -1.050 17856 157 1 . 1 1 44 44 LYS CA C 44 56.397 56.397 58.634 -2.237 17856 158 1 . 1 1 44 44 LYS H H 44 8.103 8.103 7.764 0.339 17856 159 1 . 1 1 45 45 ALA N N 45 119.568 119.568 121.527 -1.959 17856 160 1 . 1 1 45 45 ALA C C 45 177.853 177.853 179.017 -1.164 17856 161 1 . 1 1 45 45 ALA CA C 45 52.560 52.560 54.745 -2.185 17856 162 1 . 1 1 45 45 ALA H H 45 8.541 8.541 7.493 1.048 17856 163 1 . 1 1 46 46 LYS N N 46 115.235 115.235 117.169 -1.934 17856 164 1 . 1 1 46 46 LYS C C 46 177.110 177.110 178.391 -1.281 17856 165 1 . 1 1 46 46 LYS CA C 46 56.796 56.796 58.693 -1.897 17856 166 1 . 1 1 46 46 LYS H H 46 7.257 7.257 7.731 -0.474 17856 167 1 . 1 1 47 47 THR N N 47 103.239 103.239 110.675 -7.436 17856 168 1 . 1 1 47 47 THR C C 47 173.973 173.973 174.898 -0.925 17856 169 1 . 1 1 47 47 THR CA C 47 62.740 62.740 63.278 -0.537 17856 170 1 . 1 1 47 47 THR H H 47 7.381 7.381 7.582 -0.201 17856 171 1 . 1 1 48 48 ASP N N 48 122.976 122.976 122.315 0.661 17856 172 1 . 1 1 48 48 ASP H H 48 8.031 8.031 7.937 0.094 17856 173 1 . 1 1 49 49 PRO C C 49 178.106 178.106 178.421 -0.315 17856 174 1 . 1 1 49 49 PRO CA C 49 64.219 64.219 64.887 -0.668 17856 175 1 . 1 1 50 50 GLN N N 50 118.351 118.351 118.534 -0.183 17856 176 1 . 1 1 50 50 GLN C C 50 176.944 176.944 178.242 -1.298 17856 177 1 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.479 -1.679 17856 178 1 . 1 1 50 50 GLN H H 50 8.304 8.304 8.285 0.019 17856 179 1 . 1 1 51 51 ALA N N 51 124.206 124.206 122.190 2.016 17856 180 1 . 1 1 51 51 ALA C C 51 178.490 178.490 179.150 -0.660 17856 181 1 . 1 1 51 51 ALA CA C 51 53.424 53.424 54.794 -1.370 17856 182 1 . 1 1 51 51 ALA H H 51 7.547 7.547 8.293 -0.746 17856 183 1 . 1 1 52 52 ALA N N 52 118.686 118.686 120.488 -1.802 17856 184 1 . 1 1 52 52 ALA C C 52 177.953 177.953 179.398 -1.445 17856 185 1 . 1 1 52 52 ALA H H 52 7.931 7.931 7.719 0.212 17856 186 1 . 1 1 53 53 GLU N N 53 120.075 120.075 118.140 1.935 17856 187 1 . 1 1 53 53 GLU H H 53 7.729 7.729 7.772 -0.043 17856 188 1 . 1 1 55 55 LEU N N 55 123.640 123.640 119.772 3.868 17856 189 1 . 1 1 55 55 LEU C C 55 177.587 177.587 178.568 -0.981 17856 190 1 . 1 1 55 55 LEU CA C 55 55.787 55.787 57.271 -1.484 17856 191 1 . 1 1 55 55 LEU H H 55 8.215 8.215 8.188 0.027 17856 192 1 . 1 1 56 56 ASN N N 56 118.520 118.520 117.393 1.127 17856 193 1 . 1 1 56 56 ASN C C 56 175.700 175.700 176.758 -1.058 17856 194 1 . 1 1 56 56 ASN CA C 56 54.132 54.132 55.644 -1.512 17856 195 1 . 1 1 56 56 ASN H H 56 8.250 8.250 7.979 0.271 17856 196 1 . 1 1 57 57 LYS N N 57 120.960 120.960 117.900 3.060 17856 197 1 . 1 1 57 57 LYS C C 57 176.637 176.637 177.208 -0.571 17856 198 1 . 1 1 57 57 LYS H H 57 8.065 8.065 7.721 0.344 17856 199 1 . 1 1 58 58 LEU N N 58 122.610 122.610 121.014 1.596 17856 200 1 . 1 1 58 58 LEU C C 58 177.433 177.433 177.315 0.118 17856 201 1 . 1 1 58 58 LEU CA C 58 55.120 55.120 55.638 -0.518 17856 202 1 . 1 1 58 58 LEU H H 58 8.135 8.135 7.731 0.404 17856 203 1 . 1 1 59 59 ILE N N 59 122.045 122.045 120.029 2.016 17856 204 1 . 1 1 59 59 ILE CA C 59 61.535 61.535 62.359 -0.824 17856 205 1 . 1 1 59 59 ILE H H 59 8.220 8.220 7.840 0.380 17856 206 1 . 1 1 60 60 GLU N N 60 124.000 124.000 120.294 3.706 17856 207 1 . 1 1 60 60 GLU C C 60 177.007 177.007 177.103 -0.096 17856 208 1 . 1 1 60 60 GLU CA C 60 56.722 56.722 57.389 -0.667 17856 209 1 . 1 1 60 60 GLU H H 60 8.340 8.340 7.992 0.348 17856 210 1 . 1 1 61 61 GLY N N 61 110.520 110.520 108.670 1.850 17856 211 1 . 1 1 61 61 GLY C C 61 174.002 174.002 174.148 -0.146 17856 212 1 . 1 1 61 61 GLY CA C 61 45.405 45.405 45.039 0.366 17856 213 1 . 1 1 61 61 GLY H H 61 8.557 8.557 8.121 0.436 17856 214 1 . 1 1 62 62 TYR N N 62 119.600 119.600 120.692 -1.092 17856 215 1 . 1 1 62 62 TYR C C 62 175.940 175.940 176.118 -0.178 17856 216 1 . 1 1 62 62 TYR CA C 62 58.108 58.108 58.055 0.053 17856 217 1 . 1 1 62 62 TYR H H 62 7.980 7.980 7.885 0.095 17856 218 1 . 1 1 63 63 THR N N 63 116.304 116.304 116.270 0.034 17856 219 1 . 1 1 63 63 THR C C 63 173.796 173.796 174.012 -0.216 17856 220 1 . 1 1 63 63 THR H H 63 8.049 8.049 7.975 0.074 17856 221 1 . 1 1 64 64 TYR N N 64 122.050 122.050 122.900 -0.850 17856 222 1 . 1 1 64 64 TYR C C 64 176.290 176.290 175.493 0.797 17856 223 1 . 1 1 64 64 TYR CA C 64 58.533 58.533 57.903 0.630 17856 224 1 . 1 1 64 64 TYR H H 64 8.133 8.133 8.003 0.130 17856 225 1 . 1 1 65 65 GLY N N 65 110.456 110.456 110.055 0.401 17856 226 1 . 1 1 65 65 GLY C C 65 174.340 174.340 174.647 -0.307 17856 227 1 . 1 1 65 65 GLY CA C 65 45.328 45.328 45.499 -0.171 17856 228 1 . 1 1 65 65 GLY H H 65 7.747 7.747 8.245 -0.498 17856 229 1 . 1 1 66 66 GLU N N 66 120.783 120.783 120.844 -0.061 17856 230 1 . 1 1 66 66 GLU C C 66 176.895 176.895 177.250 -0.355 17856 231 1 . 1 1 66 66 GLU CA C 66 56.804 56.804 57.489 -0.685 17856 232 1 . 1 1 66 66 GLU H H 66 8.243 8.243 8.568 -0.325 17856 233 1 . 1 1 67 67 GLU N N 67 121.587 121.587 119.795 1.792 17856 234 1 . 1 1 67 67 GLU C C 67 176.340 176.340 177.390 -1.050 17856 235 1 . 1 1 67 67 GLU H H 67 8.611 8.611 8.429 0.182 17856 236 1 . 1 1 68 68 ARG N N 68 121.790 121.790 120.164 1.626 17856 237 1 . 1 1 68 68 ARG C C 68 176.350 176.350 177.329 -0.979 17856 238 1 . 1 1 68 68 ARG H H 68 8.267 8.267 8.135 0.132 17856 239 1 . 1 1 69 69 LYS N N 69 118.431 118.431 119.841 -1.410 17856 240 1 . 1 1 69 69 LYS H H 69 7.567 7.567 7.890 -0.323 17856 241 1 . 1 1 70 70 LEU C C 70 177.338 177.338 178.389 -1.051 17856 242 1 . 1 1 70 70 LEU CA C 70 55.533 55.533 56.785 -1.252 17856 243 1 . 1 1 71 71 TYR N N 71 119.504 119.504 116.720 2.784 17856 244 1 . 1 1 71 71 TYR H H 71 7.997 7.997 7.635 0.362 17856 245 1 . 1 1 72 72 ASP C C 72 176.528 176.528 178.276 -1.748 17856 246 1 . 1 1 72 72 ASP CA C 72 54.693 54.693 57.213 -2.520 17856 247 1 . 1 1 73 73 SER N N 73 117.000 117.000 115.138 1.862 17856 248 1 . 1 1 73 73 SER C C 73 174.950 174.950 175.960 -1.010 17856 249 1 . 1 1 73 73 SER CA C 73 58.997 58.997 60.963 -1.966 17856 250 1 . 1 1 73 73 SER H H 73 8.282 8.282 7.844 0.438 17856 251 1 . 1 1 74 74 ALA N N 74 125.422 125.422 124.827 0.595 17856 252 1 . 1 1 74 74 ALA C C 74 178.389 178.389 179.403 -1.014 17856 253 1 . 1 1 74 74 ALA CA C 74 53.433 53.433 54.916 -1.483 17856 254 1 . 1 1 74 74 ALA H H 74 8.339 8.339 7.533 0.806 17856 255 1 . 1 1 75 75 LEU N N 75 120.019 120.019 118.647 1.372 17856 256 1 . 1 1 75 75 LEU C C 75 177.954 177.954 178.949 -0.995 17856 257 1 . 1 1 75 75 LEU CA C 75 55.780 55.780 57.315 -1.535 17856 258 1 . 1 1 75 75 LEU H H 75 7.948 7.948 7.666 0.282 17856 259 1 . 1 1 76 76 SER N N 76 113.321 113.321 114.884 -1.563 17856 260 1 . 1 1 76 76 SER C C 76 174.784 174.784 176.746 -1.962 17856 261 1 . 1 1 76 76 SER CA C 76 59.173 59.173 61.749 -2.576 17856 262 1 . 1 1 76 76 SER H H 76 7.951 7.951 7.809 0.142 17856 263 1 . 1 1 77 77 LYS N N 77 122.710 122.710 121.588 1.122 17856 264 1 . 1 1 77 77 LYS C C 77 176.734 176.734 178.908 -2.174 17856 265 1 . 1 1 77 77 LYS CA C 77 58.390 58.390 59.242 -0.852 17856 266 1 . 1 1 77 77 LYS H H 77 8.170 8.170 7.448 0.722 17856 267 1 . 1 1 78 78 ILE N N 78 121.521 121.521 119.164 2.357 17856 268 1 . 1 1 78 78 ILE C C 78 176.512 176.512 178.063 -1.551 17856 269 1 . 1 1 78 78 ILE H H 78 8.160 8.160 7.506 0.654 17856 270 1 . 1 1 79 79 GLU N N 79 123.840 123.840 120.793 3.047 17856 271 1 . 1 1 79 79 GLU CA C 79 55.478 55.478 59.776 -4.298 17856 272 1 . 1 1 79 79 GLU H H 79 8.360 8.360 8.014 0.346 17856 273 1 . 1 1 80 80 LYS N N 80 122.143 122.143 119.485 2.658 17856 274 1 . 1 1 80 80 LYS C C 80 176.937 176.937 178.987 -2.050 17856 275 1 . 1 1 80 80 LYS CA C 80 56.500 56.500 59.303 -2.803 17856 276 1 . 1 1 80 80 LYS H H 80 8.231 8.231 7.578 0.653 17856 277 1 . 1 1 81 81 LEU N N 81 122.095 122.095 121.681 0.414 17856 278 1 . 1 1 81 81 LEU C C 81 177.531 177.531 178.718 -1.187 17856 279 1 . 1 1 81 81 LEU H H 81 8.050 8.050 7.518 0.532 17856 280 1 . 1 1 82 82 ILE N N 82 120.609 120.609 118.359 2.250 17856 281 1 . 1 1 82 82 ILE CA C 82 61.360 61.360 65.294 -3.934 17856 282 1 . 1 1 82 82 ILE H H 82 8.000 8.000 7.713 0.287 17856 283 1 . 1 1 83 83 GLU N N 83 124.611 124.611 120.115 4.496 17856 284 1 . 1 1 83 83 GLU C C 83 177.298 177.298 179.120 -1.822 17856 285 1 . 1 1 83 83 GLU H H 83 8.380 8.380 8.011 0.369 17856 286 1 . 1 1 84 84 THR N N 84 115.107 115.107 115.147 -0.040 17856 287 1 . 1 1 84 84 THR C C 84 174.400 174.400 175.421 -1.021 17856 288 1 . 1 1 84 84 THR CA C 84 62.659 62.659 65.579 -2.920 17856 289 1 . 1 1 84 84 THR H H 84 8.064 8.064 7.956 0.108 17856 290 1 . 1 1 85 85 LEU N N 85 124.150 124.150 119.839 4.311 17856 291 1 . 1 1 85 85 LEU C C 85 177.120 177.120 176.744 0.376 17856 292 1 . 1 1 85 85 LEU CA C 85 55.020 55.020 55.146 -0.126 17856 293 1 . 1 1 85 85 LEU H H 85 8.238 8.238 7.303 0.935 17856 294 1 . 1 1 86 86 SER N N 86 114.913 114.913 115.330 -0.417 17856 295 1 . 1 1 86 86 SER H H 86 7.678 7.678 7.509 0.169 17856 296 1 . 1 1 87 87 PRO CA C 87 63.550 63.550 64.070 -0.520 17856 297 1 . 1 1 88 88 ALA N N 88 123.767 123.767 119.717 4.050 17856 298 1 . 1 1 88 88 ALA C C 88 178.131 178.131 177.204 0.927 17856 299 1 . 1 1 88 88 ALA CA C 88 52.878 52.878 53.345 -0.467 17856 300 1 . 1 1 88 88 ALA H H 88 8.342 8.342 8.145 0.197 17856 301 1 . 1 1 89 89 ARG N N 89 119.159 119.159 120.853 -1.694 17856 302 1 . 1 1 89 89 ARG C C 89 176.620 176.620 175.522 1.098 17856 303 1 . 1 1 89 89 ARG H H 89 8.133 8.133 8.448 -0.315 17856 304 1 . 1 1 90 90 SER N N 90 116.910 116.910 117.909 -0.999 17856 305 1 . 1 1 90 90 SER C C 90 174.887 174.887 173.826 1.061 17856 306 1 . 1 1 90 90 SER H H 90 8.322 8.322 8.377 -0.055 17856 307 1 . 1 1 91 91 LYS N N 91 123.457 123.457 124.461 -1.004 17856 308 1 . 1 1 91 91 LYS C C 91 176.970 176.970 175.908 1.062 17856 309 1 . 1 1 91 91 LYS H H 91 8.396 8.396 8.408 -0.012 17856 310 1 . 1 1 92 92 SER N N 92 116.692 116.692 118.666 -1.974 17856 311 1 . 1 1 92 92 SER C C 92 174.573 174.573 174.498 0.075 17856 312 1 . 1 1 92 92 SER CA C 92 58.600 58.600 58.403 0.197 17856 313 1 . 1 1 92 92 SER H H 92 8.297 8.297 8.493 -0.196 17856 314 1 . 1 1 93 93 GLN N N 93 121.916 121.916 122.808 -0.892 17856 315 1 . 1 1 93 93 GLN C C 93 175.971 175.971 175.344 0.627 17856 316 1 . 1 1 93 93 GLN H H 93 8.325 8.325 8.224 0.101 17856 317 1 . 1 1 94 94 SER N N 94 117.385 117.385 115.627 1.758 17856 318 1 . 1 1 94 94 SER C C 94 173.940 173.940 173.617 0.323 17856 319 1 . 1 1 94 94 SER CA C 94 58.520 58.520 58.960 -0.440 17856 320 1 . 1 1 94 94 SER H H 94 8.352 8.352 8.486 -0.134 17856 321 1 . 1 1 95 95 THR N N 95 120.756 120.756 115.378 5.378 17856 322 1 . 1 1 95 95 THR H H 95 7.805 7.805 8.006 -0.201 17856 323 1 . 1 1 99 99 ARG C C 99 176.250 176.250 175.627 0.623 17856 324 1 . 1 1 99 99 ARG CA C 99 56.157 56.157 56.819 -0.662 17856 325 1 . 1 1 100 100 ASN N N 100 118.482 118.482 118.192 0.290 17856 326 1 . 1 1 100 100 ASN H H 100 8.272 8.272 8.487 -0.215 17856 327 1 . 1 1 101 101 ARG C C 101 176.280 176.280 175.545 0.735 17856 328 1 . 1 1 102 102 ASN N N 102 118.688 118.688 121.850 -3.162 17856 329 1 . 1 1 102 102 ASN C C 102 174.996 174.996 175.134 -0.138 17856 330 1 . 1 1 102 102 ASN CA C 102 53.609 53.609 53.682 -0.073 17856 331 1 . 1 1 102 102 ASN H H 102 8.424 8.424 8.619 -0.195 17856 332 1 . 1 1 103 103 ASN N N 103 118.865 118.865 117.944 0.921 17856 333 1 . 1 1 103 103 ASN C C 103 175.040 175.040 174.489 0.551 17856 334 1 . 1 1 103 103 ASN CA C 103 53.812 53.812 53.666 0.146 17856 335 1 . 1 1 103 103 ASN H H 103 8.282 8.282 8.419 -0.137 17856 336 1 . 1 1 104 104 ARG N N 104 120.875 120.875 116.015 4.860 17856 337 1 . 1 1 104 104 ARG H H 104 8.140 8.140 8.364 -0.224 17856 338 1 . 1 1 106 106 ILE C C 106 175.408 175.408 175.829 -0.421 17856 339 1 . 1 1 106 106 ILE CA C 106 61.395 61.395 61.957 -0.562 17856 stop_ save_