data_18933 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18933 _Entry.PDB_ID 2M2T 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 18933 _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 LEU N N 2 122.812 122.812 121.761 1.051 18933 2 1 1 . 1 1 2 2 LEU C C 2 175.742 175.742 176.020 -0.278 18933 3 1 1 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.781 0.353 18933 4 1 1 . 1 1 2 2 LEU CB C 2 42.842 42.842 44.251 -1.409 18933 5 1 1 . 1 1 2 2 LEU H H 2 8.756 8.756 8.399 0.357 18933 6 1 1 . 1 1 3 3 THR N N 3 113.000 113.000 113.749 -0.749 18933 7 1 1 . 1 1 3 3 THR C C 3 175.938 175.938 175.825 0.113 18933 8 1 1 . 1 1 3 3 THR CA C 3 60.550 60.550 60.625 -0.075 18933 9 1 1 . 1 1 3 3 THR CB C 3 70.781 70.781 70.134 0.647 18933 10 1 1 . 1 1 3 3 THR H H 3 8.428 8.428 8.128 0.300 18933 11 1 1 . 1 1 4 4 LEU N N 4 122.531 122.531 123.586 -1.055 18933 12 1 1 . 1 1 4 4 LEU C C 4 178.463 178.463 178.554 -0.091 18933 13 1 1 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.576 -0.447 18933 14 1 1 . 1 1 4 4 LEU CB C 4 39.534 39.534 41.993 -2.459 18933 15 1 1 . 1 1 4 4 LEU H H 4 7.731 7.731 8.044 -0.313 18933 16 1 1 . 1 1 5 5 ILE N N 5 115.505 115.505 116.820 -1.315 18933 17 1 1 . 1 1 5 5 ILE C C 5 178.573 178.573 177.622 0.951 18933 18 1 1 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.883 -1.145 18933 19 1 1 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.429 -0.557 18933 20 1 1 . 1 1 5 5 ILE H H 5 7.645 7.645 8.169 -0.524 18933 21 1 1 . 1 1 6 6 GLN N N 6 121.626 121.626 119.285 2.341 18933 22 1 1 . 1 1 6 6 GLN C C 6 179.014 179.014 178.465 0.549 18933 23 1 1 . 1 1 6 6 GLN CA C 6 58.331 58.331 58.927 -0.596 18933 24 1 1 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.437 0.752 18933 25 1 1 . 1 1 6 6 GLN H H 6 7.645 7.645 8.050 -0.405 18933 26 1 1 . 1 1 7 7 GLY N N 7 107.684 107.684 106.979 0.705 18933 27 1 1 . 1 1 7 7 GLY C C 7 174.749 174.749 176.208 -1.459 18933 28 1 1 . 1 1 7 7 GLY CA C 7 46.790 46.790 47.047 -0.257 18933 29 1 1 . 1 1 7 7 GLY H H 7 8.660 8.660 8.140 0.520 18933 30 1 1 . 1 1 8 8 LYS N N 8 120.942 120.942 122.043 -1.101 18933 31 1 1 . 1 1 8 8 LYS C C 8 179.455 179.455 178.771 0.684 18933 32 1 1 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.268 0.637 18933 33 1 1 . 1 1 8 8 LYS CB C 8 31.422 31.422 31.849 -0.427 18933 34 1 1 . 1 1 8 8 LYS H H 8 8.518 8.518 7.671 0.847 18933 35 1 1 . 1 1 9 9 LYS N N 9 120.710 120.710 119.710 1.000 18933 36 1 1 . 1 1 9 9 LYS C C 9 179.823 179.823 179.142 0.681 18933 37 1 1 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.088 0.534 18933 38 1 1 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.108 -0.814 18933 39 1 1 . 1 1 9 9 LYS H H 9 7.731 7.731 8.123 -0.392 18933 40 1 1 . 1 1 10 10 ILE N N 10 121.345 121.345 120.408 0.937 18933 41 1 1 . 1 1 10 10 ILE C C 10 177.789 177.789 178.189 -0.400 18933 42 1 1 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.935 -1.470 18933 43 1 1 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.288 -1.923 18933 44 1 1 . 1 1 10 10 ILE H H 10 7.711 7.711 8.094 -0.383 18933 45 1 1 . 1 1 11 11 VAL N N 11 120.258 120.258 119.944 0.314 18933 46 1 1 . 1 1 11 11 VAL C C 11 177.372 177.372 177.714 -0.342 18933 47 1 1 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.445 0.005 18933 48 1 1 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.644 -1.110 18933 49 1 1 . 1 1 11 11 VAL H H 11 7.918 7.918 8.458 -0.540 18933 50 1 1 . 1 1 12 12 ASN N N 12 116.971 116.971 117.278 -0.307 18933 51 1 1 . 1 1 12 12 ASN C C 12 177.445 177.445 177.517 -0.072 18933 52 1 1 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.666 -0.555 18933 53 1 1 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.698 -1.065 18933 54 1 1 . 1 1 12 12 ASN H H 12 7.993 7.993 8.551 -0.558 18933 55 1 1 . 1 1 13 13 HIS N N 13 120.258 120.258 119.648 0.610 18933 56 1 1 . 1 1 13 13 HIS C C 13 177.862 177.862 177.755 0.107 18933 57 1 1 . 1 1 13 13 HIS CA C 13 59.098 59.098 58.462 0.636 18933 58 1 1 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.485 0.747 18933 59 1 1 . 1 1 13 13 HIS H H 13 7.741 7.741 8.369 -0.628 18933 60 1 1 . 1 1 14 14 LEU N N 14 116.641 116.641 120.060 -3.419 18933 61 1 1 . 1 1 14 14 LEU C C 14 179.186 179.186 178.261 0.925 18933 62 1 1 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.308 -1.551 18933 63 1 1 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.700 -0.581 18933 64 1 1 . 1 1 14 14 LEU H H 14 8.221 8.221 8.476 -0.255 18933 65 1 1 . 1 1 15 15 ARG N N 15 115.957 115.957 114.710 1.247 18933 66 1 1 . 1 1 15 15 ARG C C 15 176.330 176.330 178.051 -1.721 18933 67 1 1 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.402 1.301 18933 68 1 1 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.337 -1.260 18933 69 1 1 . 1 1 15 15 ARG H H 15 7.968 7.968 8.457 -0.489 18933 70 1 1 . 1 1 16 16 SER N N 16 109.395 109.395 115.603 -6.208 18933 71 1 1 . 1 1 16 16 SER C C 16 176.024 176.024 175.108 0.916 18933 72 1 1 . 1 1 16 16 SER CA C 16 57.282 57.282 59.798 -2.516 18933 73 1 1 . 1 1 16 16 SER CB C 16 63.683 63.683 63.723 -0.040 18933 74 1 1 . 1 1 16 16 SER H H 16 6.963 6.963 7.646 -0.683 18933 75 1 1 . 1 1 17 17 ARG N N 17 122.775 122.775 121.804 0.971 18933 76 1 1 . 1 1 17 17 ARG C C 17 174.590 174.590 173.971 0.619 18933 77 1 1 . 1 1 17 17 ARG CA C 17 56.273 56.273 55.061 1.212 18933 78 1 1 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.643 1.159 18933 79 1 1 . 1 1 17 17 ARG H H 17 7.781 7.781 8.221 -0.440 18933 80 1 1 . 1 1 18 18 LEU N N 18 122.421 122.421 125.800 -3.379 18933 81 1 1 . 1 1 18 18 LEU C C 18 176.281 176.281 174.130 2.151 18933 82 1 1 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.215 0.565 18933 83 1 1 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.424 -3.213 18933 84 1 1 . 1 1 18 18 LEU H H 18 8.650 8.650 7.837 0.813 18933 85 1 1 . 1 1 19 19 ALA N N 19 126.441 126.441 127.349 -0.908 18933 86 1 1 . 1 1 19 19 ALA C C 19 173.904 173.904 174.911 -1.007 18933 87 1 1 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.628 -0.762 18933 88 1 1 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.547 0.318 18933 89 1 1 . 1 1 19 19 ALA H H 19 8.609 8.609 9.031 -0.422 18933 90 1 1 . 1 1 20 20 PHE N N 20 114.600 114.600 118.995 -4.395 18933 91 1 1 . 1 1 20 20 PHE C C 20 172.592 172.592 173.800 -1.208 18933 92 1 1 . 1 1 20 20 PHE CA C 20 55.789 55.789 55.135 0.654 18933 93 1 1 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.795 -1.106 18933 94 1 1 . 1 1 20 20 PHE H H 20 8.801 8.801 9.074 -0.273 18933 95 1 1 . 1 1 21 21 GLU N N 21 122.873 122.873 122.675 0.198 18933 96 1 1 . 1 1 21 21 GLU C C 21 174.872 174.872 175.293 -0.421 18933 97 1 1 . 1 1 21 21 GLU CA C 21 55.062 55.062 54.964 0.098 18933 98 1 1 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.181 -0.456 18933 99 1 1 . 1 1 21 21 GLU H H 21 7.847 7.847 9.148 -1.301 18933 100 1 1 . 1 1 22 22 TYR N N 22 126.270 126.270 126.784 -0.514 18933 101 1 1 . 1 1 22 22 TYR C C 22 174.872 174.872 174.745 0.127 18933 102 1 1 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.660 -0.912 18933 103 1 1 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.010 -0.905 18933 104 1 1 . 1 1 22 22 TYR H H 22 8.806 8.806 9.146 -0.340 18933 105 1 1 . 1 1 23 23 ASN N N 23 128.420 128.420 126.288 2.132 18933 106 1 1 . 1 1 23 23 ASN C C 23 175.435 175.435 175.129 0.306 18933 107 1 1 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.573 -0.568 18933 108 1 1 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.643 -1.278 18933 109 1 1 . 1 1 23 23 ASN H H 23 8.943 8.943 9.169 -0.226 18933 110 1 1 . 1 1 24 24 GLY N N 24 104.067 104.067 101.956 2.111 18933 111 1 1 . 1 1 24 24 GLY C C 24 173.707 173.707 173.813 -0.106 18933 112 1 1 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.964 -0.030 18933 113 1 1 . 1 1 24 24 GLY H H 24 8.534 8.534 8.172 0.362 18933 114 1 1 . 1 1 25 25 GLN N N 25 120.038 120.038 119.646 0.392 18933 115 1 1 . 1 1 25 25 GLN C C 25 173.744 173.744 174.949 -1.205 18933 116 1 1 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.294 -0.967 18933 117 1 1 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.286 0.375 18933 118 1 1 . 1 1 25 25 GLN H H 25 7.595 7.595 7.888 -0.293 18933 119 1 1 . 1 1 26 26 LEU N N 26 124.681 124.681 125.109 -0.428 18933 120 1 1 . 1 1 26 26 LEU C C 26 175.987 175.987 176.215 -0.228 18933 121 1 1 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.477 -0.464 18933 122 1 1 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.347 -1.482 18933 123 1 1 . 1 1 26 26 LEU H H 26 8.382 8.382 8.620 -0.238 18933 124 1 1 . 1 1 27 27 ILE N N 27 130.779 130.779 127.409 3.370 18933 125 1 1 . 1 1 27 27 ILE C C 27 175.215 175.215 174.303 0.912 18933 126 1 1 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.595 -0.336 18933 127 1 1 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.058 -2.326 18933 128 1 1 . 1 1 27 27 ILE H H 27 8.882 8.882 8.920 -0.038 18933 129 1 1 . 1 1 28 28 LYS N N 28 126.160 126.160 127.585 -1.425 18933 130 1 1 . 1 1 28 28 LYS C C 28 176.771 176.771 175.667 1.104 18933 131 1 1 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.819 2.019 18933 132 1 1 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.186 -1.447 18933 133 1 1 . 1 1 28 28 LYS H H 28 8.165 8.165 8.329 -0.164 18933 134 1 1 . 1 1 29 29 ILE N N 29 126.380 126.380 122.139 4.241 18933 135 1 1 . 1 1 29 29 ILE C C 29 175.877 175.877 174.330 1.547 18933 136 1 1 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.566 -0.258 18933 137 1 1 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.477 -2.414 18933 138 1 1 . 1 1 29 29 ILE H H 29 8.019 8.019 8.765 -0.746 18933 139 1 1 . 1 1 30 30 LEU N N 30 129.215 129.215 122.335 6.880 18933 140 1 1 . 1 1 30 30 LEU C C 30 178.867 178.867 178.156 0.711 18933 141 1 1 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.349 1.270 18933 142 1 1 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.511 -4.646 18933 143 1 1 . 1 1 30 30 LEU H H 30 8.917 8.917 8.305 0.612 18933 144 1 1 . 1 1 31 31 SER N N 31 117.997 117.997 115.935 2.062 18933 145 1 1 . 1 1 31 31 SER C C 31 177.396 177.396 175.574 1.822 18933 146 1 1 . 1 1 31 31 SER CA C 31 61.236 61.236 60.808 0.428 18933 147 1 1 . 1 1 31 31 SER CB C 31 62.035 62.035 63.179 -1.144 18933 148 1 1 . 1 1 31 31 SER H H 31 8.594 8.594 8.801 -0.207 18933 149 1 1 . 1 1 32 32 LYS N N 32 116.189 116.189 118.666 -2.477 18933 150 1 1 . 1 1 32 32 LYS C C 32 176.244 176.244 177.034 -0.790 18933 151 1 1 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.101 -0.698 18933 152 1 1 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.300 -2.019 18933 153 1 1 . 1 1 32 32 LYS H H 32 8.029 8.029 8.220 -0.191 18933 154 1 1 . 1 1 33 33 ASN N N 33 119.061 119.061 115.208 3.853 18933 155 1 1 . 1 1 33 33 ASN C C 33 172.384 172.384 174.341 -1.957 18933 156 1 1 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.224 -1.067 18933 157 1 1 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.317 -3.050 18933 158 1 1 . 1 1 33 33 ASN H H 33 7.902 7.902 7.858 0.044 18933 159 1 1 . 1 1 34 34 ILE N N 34 120.038 120.038 120.017 0.021 18933 160 1 1 . 1 1 34 34 ILE C C 34 175.607 175.607 174.228 1.379 18933 161 1 1 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.500 0.050 18933 162 1 1 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.528 -2.564 18933 163 1 1 . 1 1 34 34 ILE H H 34 7.443 7.443 7.895 -0.452 18933 164 1 1 . 1 1 35 35 VAL N N 35 129.435 129.435 125.811 3.624 18933 165 1 1 . 1 1 35 35 VAL C C 35 175.386 175.386 174.381 1.005 18933 166 1 1 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.242 -0.216 18933 167 1 1 . 1 1 35 35 VAL CB C 35 34.781 34.781 36.127 -1.346 18933 168 1 1 . 1 1 35 35 VAL H H 35 9.533 9.533 8.727 0.806 18933 169 1 1 . 1 1 36 36 ALA N N 36 130.571 130.571 129.880 0.691 18933 170 1 1 . 1 1 36 36 ALA C C 36 177.347 177.347 176.375 0.972 18933 171 1 1 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.779 0.620 18933 172 1 1 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.704 -0.846 18933 173 1 1 . 1 1 36 36 ALA H H 36 8.665 8.665 8.495 0.170 18933 174 1 1 . 1 1 37 37 VAL N N 37 115.395 115.395 118.967 -3.572 18933 175 1 1 . 1 1 37 37 VAL C C 37 174.455 174.455 175.638 -1.183 18933 176 1 1 . 1 1 37 37 VAL CA C 37 59.380 59.380 58.766 0.614 18933 177 1 1 . 1 1 37 37 VAL CB C 37 32.943 32.943 34.063 -1.120 18933 178 1 1 . 1 1 37 37 VAL H H 37 8.079 8.079 8.289 -0.210 18933 179 1 1 . 1 1 38 38 GLY N N 38 107.672 107.672 108.035 -0.363 18933 180 1 1 . 1 1 38 38 GLY C C 38 173.364 173.364 175.591 -2.227 18933 181 1 1 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.276 -0.091 18933 182 1 1 . 1 1 38 38 GLY H H 38 7.579 7.579 8.294 -0.715 18933 183 1 1 . 1 1 39 39 SER N N 39 121.052 121.052 119.648 1.404 18933 184 1 1 . 1 1 39 39 SER C C 39 175.570 175.570 176.516 -0.946 18933 185 1 1 . 1 1 39 39 SER CA C 39 61.801 61.801 61.455 0.346 18933 186 1 1 . 1 1 39 39 SER CB C 39 62.478 62.478 63.340 -0.862 18933 187 1 1 . 1 1 39 39 SER H H 39 8.953 8.953 8.186 0.767 18933 188 1 1 . 1 1 40 40 LEU N N 40 121.553 121.553 121.767 -0.214 18933 189 1 1 . 1 1 40 40 LEU C C 40 180.203 180.203 178.069 2.134 18933 190 1 1 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.242 -0.113 18933 191 1 1 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.886 -0.133 18933 192 1 1 . 1 1 40 40 LEU H H 40 8.195 8.195 7.282 0.913 18933 193 1 1 . 1 1 41 41 ARG N N 41 121.956 121.956 117.258 4.698 18933 194 1 1 . 1 1 41 41 ARG C C 41 177.323 177.323 177.891 -0.568 18933 195 1 1 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.762 0.569 18933 196 1 1 . 1 1 41 41 ARG CB C 41 28.443 28.443 30.001 -1.558 18933 197 1 1 . 1 1 41 41 ARG H H 41 6.873 6.873 7.345 -0.472 18933 198 1 1 . 1 1 42 42 ARG N N 42 114.600 114.600 116.528 -1.928 18933 199 1 1 . 1 1 42 42 ARG C C 42 172.911 172.911 175.871 -2.960 18933 200 1 1 . 1 1 42 42 ARG CA C 42 57.242 57.242 56.968 0.274 18933 201 1 1 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.977 -1.837 18933 202 1 1 . 1 1 42 42 ARG H H 42 7.438 7.438 8.020 -0.582 18933 203 1 1 . 1 1 43 43 GLU N N 43 113.354 113.354 117.487 -4.133 18933 204 1 1 . 1 1 43 43 GLU C C 43 175.999 175.999 175.501 0.498 18933 205 1 1 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.387 -0.831 18933 206 1 1 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.415 -2.078 18933 207 1 1 . 1 1 43 43 GLU H H 43 7.564 7.564 7.958 -0.394 18933 208 1 1 . 1 1 44 44 GLU N N 44 119.696 119.696 121.640 -1.944 18933 209 1 1 . 1 1 44 44 GLU C C 44 175.423 175.423 176.613 -1.190 18933 210 1 1 . 1 1 44 44 GLU CA C 44 56.838 56.838 56.865 -0.028 18933 211 1 1 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.055 -1.359 18933 212 1 1 . 1 1 44 44 GLU H H 44 7.261 7.261 8.549 -1.288 18933 213 1 1 . 1 1 45 45 LYS N N 45 117.435 117.435 118.375 -0.940 18933 214 1 1 . 1 1 45 45 LYS C C 45 177.715 177.715 175.947 1.768 18933 215 1 1 . 1 1 45 45 LYS CA C 45 59.219 59.219 56.648 2.571 18933 216 1 1 . 1 1 45 45 LYS CB C 45 32.119 32.119 34.125 -2.006 18933 217 1 1 . 1 1 45 45 LYS H H 45 7.938 7.938 8.340 -0.402 18933 218 1 1 . 1 1 46 46 MET N N 46 115.847 115.847 118.286 -2.439 18933 219 1 1 . 1 1 46 46 MET CA C 46 52.520 52.520 53.598 -1.078 18933 220 1 1 . 1 1 46 46 MET CB C 46 33.450 33.450 35.175 -1.725 18933 221 1 1 . 1 1 46 46 MET H H 46 7.595 7.595 7.711 -0.116 18933 222 1 1 . 1 1 47 47 LEU N N 47 121.627 121.627 123.497 -1.870 18933 223 1 1 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.133 -1.007 18933 224 1 1 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.697 -0.627 18933 225 1 1 . 1 1 47 47 LEU H H 47 9.220 9.220 9.114 0.106 18933 226 1 1 . 1 1 49 49 ASP N N 49 117.093 117.093 118.435 -1.342 18933 227 1 1 . 1 1 49 49 ASP C C 49 173.340 173.340 174.294 -0.954 18933 228 1 1 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.448 -1.654 18933 229 1 1 . 1 1 49 49 ASP CB C 49 43.006 43.006 45.144 -2.138 18933 230 1 1 . 1 1 49 49 ASP H H 49 7.761 7.761 7.685 0.076 18933 231 1 1 . 1 1 50 50 VAL N N 50 119.012 119.012 118.445 0.567 18933 232 1 1 . 1 1 50 50 VAL C C 50 173.070 173.070 173.782 -0.712 18933 233 1 1 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.259 1.583 18933 234 1 1 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.532 -0.969 18933 235 1 1 . 1 1 50 50 VAL H H 50 8.089 8.089 8.457 -0.368 18933 236 1 1 . 1 1 51 51 ASP N N 51 127.064 127.064 125.689 1.375 18933 237 1 1 . 1 1 51 51 ASP C C 51 174.565 174.565 175.388 -0.823 18933 238 1 1 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.831 -0.674 18933 239 1 1 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.571 -0.930 18933 240 1 1 . 1 1 51 51 ASP H H 51 8.069 8.069 8.075 -0.006 18933 241 1 1 . 1 1 52 52 LEU N N 52 121.627 121.627 119.974 1.653 18933 242 1 1 . 1 1 52 52 LEU C C 52 174.063 174.063 174.544 -0.481 18933 243 1 1 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.439 -0.757 18933 244 1 1 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.265 -2.914 18933 245 1 1 . 1 1 52 52 LEU H H 52 8.852 8.852 8.824 0.028 18933 246 1 1 . 1 1 53 53 LEU N N 53 123.093 123.093 123.435 -0.342 18933 247 1 1 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.054 1.937 18933 248 1 1 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.557 -2.424 18933 249 1 1 . 1 1 53 53 LEU H H 53 9.362 9.362 9.072 0.290 18933 250 1 1 . 1 1 54 54 ILE N N 54 123.777 123.777 129.309 -5.532 18933 251 1 1 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.135 -4.073 18933 252 1 1 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.412 -7.342 18933 253 1 1 . 1 1 54 54 ILE H H 54 8.907 8.907 9.176 -0.269 18933 254 1 1 . 1 1 58 58 GLU N N 58 114.710 114.710 116.628 -1.918 18933 255 1 1 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.644 -1.267 18933 256 1 1 . 1 1 58 58 GLU CB C 58 31.422 31.422 33.217 -1.795 18933 257 1 1 . 1 1 58 58 GLU H H 58 6.716 6.716 7.667 -0.951 18933 258 1 1 . 1 1 61 61 LEU N N 61 115.957 115.957 119.802 -3.845 18933 259 1 1 . 1 1 61 61 LEU C C 61 178.512 178.512 178.525 -0.013 18933 260 1 1 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.342 -2.562 18933 261 1 1 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.903 -0.784 18933 262 1 1 . 1 1 61 61 LEU H H 61 7.307 7.307 7.796 -0.489 18933 263 1 1 . 1 1 62 62 LEU N N 62 120.038 120.038 119.562 0.476 18933 264 1 1 . 1 1 62 62 LEU C C 62 177.874 177.874 178.829 -0.955 18933 265 1 1 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.531 0.405 18933 266 1 1 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.981 -1.242 18933 267 1 1 . 1 1 62 62 LEU H H 62 7.327 7.327 8.082 -0.755 18933 268 1 1 . 1 1 63 63 LYS N N 63 114.600 114.600 115.461 -0.861 18933 269 1 1 . 1 1 63 63 LYS C C 63 175.460 175.460 177.760 -2.300 18933 270 1 1 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.688 -1.123 18933 271 1 1 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.664 -1.939 18933 272 1 1 . 1 1 63 63 LYS H H 63 7.973 7.973 7.778 0.195 18933 273 1 1 . 1 1 64 64 HIS N N 64 115.273 115.273 116.182 -0.909 18933 274 1 1 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.617 0.495 18933 275 1 1 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.472 1.964 18933 276 1 1 . 1 1 64 64 HIS H H 64 7.544 7.544 7.656 -0.112 18933 277 1 1 . 1 1 65 65 VAL N N 65 118.682 118.682 118.511 0.171 18933 278 1 1 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.834 3.204 18933 279 1 1 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.262 -2.235 18933 280 1 1 . 1 1 65 65 VAL H H 65 6.787 6.787 7.139 -0.352 18933 281 1 1 . 1 1 68 68 ASN N N 68 112.108 112.108 118.464 -6.356 18933 282 1 1 . 1 1 68 68 ASN C C 68 174.884 174.884 173.842 1.042 18933 283 1 1 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.360 -1.333 18933 284 1 1 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.145 1.087 18933 285 1 1 . 1 1 68 68 ASN H H 68 7.009 7.009 8.311 -1.302 18933 286 1 1 . 1 1 69 69 ILE N N 69 123.325 123.325 123.745 -0.420 18933 287 1 1 . 1 1 69 69 ILE C C 69 174.394 174.394 175.329 -0.935 18933 288 1 1 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.792 -1.685 18933 289 1 1 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.561 -0.294 18933 290 1 1 . 1 1 69 69 ILE H H 69 7.150 7.150 8.130 -0.980 18933 291 1 1 . 1 1 70 70 ARG N N 70 126.722 126.722 127.696 -0.974 18933 292 1 1 . 1 1 70 70 ARG C C 70 174.590 174.590 174.483 0.107 18933 293 1 1 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.407 -1.160 18933 294 1 1 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.766 -2.393 18933 295 1 1 . 1 1 70 70 ARG H H 70 8.902 8.902 9.194 -0.292 18933 296 1 1 . 1 1 71 71 ILE N N 71 119.978 119.978 120.469 -0.491 18933 297 1 1 . 1 1 71 71 ILE C C 71 175.583 175.583 175.782 -0.199 18933 298 1 1 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.827 -0.003 18933 299 1 1 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.342 -2.582 18933 300 1 1 . 1 1 71 71 ILE H H 71 7.491 7.491 8.842 -1.351 18933 301 1 1 . 1 1 72 72 LYS N N 72 128.530 128.530 125.939 2.591 18933 302 1 1 . 1 1 72 72 LYS C C 72 177.703 177.703 175.995 1.708 18933 303 1 1 . 1 1 72 72 LYS CA C 72 57.201 57.201 55.274 1.927 18933 304 1 1 . 1 1 72 72 LYS CB C 72 31.485 31.485 30.866 0.619 18933 305 1 1 . 1 1 72 72 LYS H H 72 8.523 8.523 8.529 -0.006 18933 306 1 1 . 1 1 73 73 GLY N N 73 113.806 113.806 109.991 3.815 18933 307 1 1 . 1 1 73 73 GLY C C 73 173.781 173.781 172.934 0.847 18933 308 1 1 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.177 0.645 18933 309 1 1 . 1 1 73 73 GLY H H 73 8.791 8.791 8.266 0.525 18933 310 1 1 . 1 1 74 74 LEU N N 74 120.490 120.490 118.445 2.045 18933 311 1 1 . 1 1 74 74 LEU C C 74 175.840 175.840 173.460 2.380 18933 312 1 1 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.452 -0.761 18933 313 1 1 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.067 -0.906 18933 314 1 1 . 1 1 74 74 LEU H H 74 7.393 7.393 7.263 0.130 18933 315 1 1 . 1 1 75 75 SER N N 75 120.038 120.038 115.486 4.552 18933 316 1 1 . 1 1 75 75 SER C C 75 173.205 173.205 173.140 0.065 18933 317 1 1 . 1 1 75 75 SER CA C 75 57.887 57.887 57.592 0.295 18933 318 1 1 . 1 1 75 75 SER CB C 75 63.049 63.049 64.922 -1.873 18933 319 1 1 . 1 1 75 75 SER H H 75 8.917 8.917 8.120 0.797 18933 320 1 1 . 1 1 76 76 PHE N N 76 119.586 119.586 118.001 1.585 18933 321 1 1 . 1 1 76 76 PHE C C 76 173.536 173.536 173.494 0.042 18933 322 1 1 . 1 1 76 76 PHE CA C 76 55.426 55.426 55.926 -0.500 18933 323 1 1 . 1 1 76 76 PHE CB C 76 42.006 42.006 41.867 0.139 18933 324 1 1 . 1 1 76 76 PHE H H 76 8.003 8.003 8.423 -0.420 18933 325 1 1 . 1 1 77 77 SER N N 77 114.943 114.943 115.937 -0.994 18933 326 1 1 . 1 1 77 77 SER C C 77 173.438 173.438 172.292 1.146 18933 327 1 1 . 1 1 77 77 SER CA C 77 56.152 56.152 57.201 -1.049 18933 328 1 1 . 1 1 77 77 SER CB C 77 65.204 65.204 65.938 -0.734 18933 329 1 1 . 1 1 77 77 SER H H 77 8.907 8.907 8.761 0.146 18933 330 1 1 . 1 1 78 78 VAL N N 78 124.791 124.791 124.757 0.034 18933 331 1 1 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.354 1.690 18933 332 1 1 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.141 -1.959 18933 333 1 1 . 1 1 78 78 VAL H H 78 8.892 8.892 8.268 0.624 18933 334 1 1 . 1 1 79 79 LYS N N 79 129.667 129.667 128.791 0.876 18933 335 1 1 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.180 2.012 18933 336 1 1 . 1 1 79 79 LYS CB C 79 32.372 32.372 34.802 -2.430 18933 337 1 1 . 1 1 79 79 LYS H H 79 9.049 9.049 8.652 0.397 18933 338 1 1 . 1 1 82 82 GLY N N 82 117.263 117.263 114.193 3.070 18933 339 1 1 . 1 1 82 82 GLY C C 82 171.710 171.710 174.547 -2.837 18933 340 1 1 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.623 -2.698 18933 341 1 1 . 1 1 82 82 GLY H H 82 8.044 8.044 8.476 -0.432 18933 342 1 1 . 1 1 83 83 GLU N N 83 117.203 117.203 120.305 -3.102 18933 343 1 1 . 1 1 83 83 GLU C C 83 178.695 178.695 177.863 0.832 18933 344 1 1 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.413 1.564 18933 345 1 1 . 1 1 83 83 GLU CB C 83 29.837 29.837 30.059 -0.222 18933 346 1 1 . 1 1 83 83 GLU H H 83 8.296 8.296 8.449 -0.153 18933 347 1 1 . 1 1 84 84 ARG N N 84 113.818 113.818 119.013 -5.195 18933 348 1 1 . 1 1 84 84 ARG C C 84 175.877 175.877 175.185 0.692 18933 349 1 1 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.486 -1.755 18933 350 1 1 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.590 1.705 18933 351 1 1 . 1 1 84 84 ARG H H 84 8.342 8.342 7.897 0.445 18933 352 1 1 . 1 1 85 85 LYS N N 85 119.354 119.354 121.769 -2.415 18933 353 1 1 . 1 1 85 85 LYS C C 85 174.516 174.516 174.266 0.250 18933 354 1 1 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.643 -0.903 18933 355 1 1 . 1 1 85 85 LYS CB C 85 34.844 34.844 34.777 0.067 18933 356 1 1 . 1 1 85 85 LYS H H 85 6.822 6.822 7.725 -0.903 18933 357 1 1 . 1 1 86 86 CYS N N 86 125.928 125.928 123.678 2.250 18933 358 1 1 . 1 1 86 86 CYS C C 86 171.600 171.600 173.454 -1.854 18933 359 1 1 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.894 -2.267 18933 360 1 1 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.460 -0.116 18933 361 1 1 . 1 1 86 86 CYS H H 86 9.084 9.084 9.492 -0.408 18933 362 1 1 . 1 1 87 87 VAL N N 87 126.612 126.612 125.604 1.008 18933 363 1 1 . 1 1 87 87 VAL C C 87 174.431 174.431 174.586 -0.155 18933 364 1 1 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.587 -0.270 18933 365 1 1 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.540 0.656 18933 366 1 1 . 1 1 87 87 VAL H H 87 8.705 8.705 8.799 -0.094 18933 367 1 1 . 1 1 88 88 LEU N N 88 127.748 127.748 123.179 4.569 18933 368 1 1 . 1 1 88 88 LEU C C 88 175.227 175.227 174.447 0.780 18933 369 1 1 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.691 -0.172 18933 370 1 1 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.084 -1.479 18933 371 1 1 . 1 1 88 88 LEU H H 88 9.417 9.417 8.751 0.666 18933 372 1 1 . 1 1 89 89 PHE N N 89 120.981 120.981 118.516 2.465 18933 373 1 1 . 1 1 89 89 PHE C C 89 176.906 176.906 176.070 0.836 18933 374 1 1 . 1 1 89 89 PHE CA C 89 55.587 55.587 56.182 -0.595 18933 375 1 1 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.822 -2.921 18933 376 1 1 . 1 1 89 89 PHE H H 89 8.937 8.937 8.529 0.408 18933 377 1 1 . 1 1 90 90 ILE N N 90 119.928 119.928 118.075 1.853 18933 378 1 1 . 1 1 90 90 ILE C C 90 173.781 173.781 174.974 -1.193 18933 379 1 1 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.807 -1.153 18933 380 1 1 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.874 0.738 18933 381 1 1 . 1 1 90 90 ILE H H 90 9.230 9.230 9.169 0.061 18933 382 1 1 . 1 1 91 91 GLU N N 91 124.339 124.339 124.572 -0.233 18933 383 1 1 . 1 1 91 91 GLU C C 91 175.607 175.607 175.333 0.274 18933 384 1 1 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.717 -0.097 18933 385 1 1 . 1 1 91 91 GLU CB C 91 29.837 29.837 33.316 -3.478 18933 386 1 1 . 1 1 91 91 GLU H H 91 8.175 8.175 9.043 -0.868 18933 387 1 1 . 1 1 92 92 TRP N N 92 127.516 127.516 124.938 2.578 18933 388 1 1 . 1 1 92 92 TRP C C 92 175.203 175.203 176.372 -1.169 18933 389 1 1 . 1 1 92 92 TRP CA C 92 56.233 56.233 55.019 1.214 18933 390 1 1 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.354 1.307 18933 391 1 1 . 1 1 92 92 TRP H H 92 9.306 9.306 8.576 0.730 18933 392 1 1 . 1 1 93 93 GLU N N 93 127.834 127.834 126.287 1.547 18933 393 1 1 . 1 1 93 93 GLU C C 93 175.668 175.668 176.139 -0.471 18933 394 1 1 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.685 -0.807 18933 395 1 1 . 1 1 93 93 GLU CB C 93 26.034 26.034 27.750 -1.716 18933 396 1 1 . 1 1 93 93 GLU H H 93 8.796 8.796 9.191 -0.395 18933 397 1 1 . 1 1 94 94 LYS N N 94 108.931 108.931 112.792 -3.861 18933 398 1 1 . 1 1 94 94 LYS C C 94 175.423 175.423 175.949 -0.526 18933 399 1 1 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.714 -0.271 18933 400 1 1 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.407 -2.774 18933 401 1 1 . 1 1 94 94 LYS H H 94 8.498 8.498 8.729 -0.232 18933 402 1 1 . 1 1 95 95 LYS N N 95 121.737 121.737 120.727 1.010 18933 403 1 1 . 1 1 95 95 LYS C C 95 174.443 174.443 175.157 -0.714 18933 404 1 1 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.604 -2.187 18933 405 1 1 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.250 0.214 18933 406 1 1 . 1 1 95 95 LYS H H 95 7.761 7.761 7.745 0.016 18933 407 1 1 . 1 1 96 96 THR N N 96 116.067 116.067 115.737 0.330 18933 408 1 1 . 1 1 96 96 THR C C 96 174.296 174.296 173.633 0.663 18933 409 1 1 . 1 1 96 96 THR CA C 96 61.115 61.115 61.425 -0.310 18933 410 1 1 . 1 1 96 96 THR CB C 96 69.450 69.450 71.598 -2.148 18933 411 1 1 . 1 1 96 96 THR H H 96 7.761 7.761 8.368 -0.607 18933 412 1 1 . 1 1 97 97 TYR N N 97 124.229 124.229 125.356 -1.127 18933 413 1 1 . 1 1 97 97 TYR C C 97 173.536 173.536 173.690 -0.154 18933 414 1 1 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.367 -0.417 18933 415 1 1 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.872 -1.690 18933 416 1 1 . 1 1 97 97 TYR H H 97 9.018 9.018 9.458 -0.440 18933 417 1 1 . 1 1 98 98 GLN N N 98 123.435 123.435 123.876 -0.441 18933 418 1 1 . 1 1 98 98 GLN C C 98 173.266 173.266 173.673 -0.407 18933 419 1 1 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.445 -0.302 18933 420 1 1 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.842 -0.829 18933 421 1 1 . 1 1 98 98 GLN H H 98 8.781 8.781 8.893 -0.112 18933 422 1 1 . 1 1 99 99 LEU N N 99 130.119 130.119 127.847 2.272 18933 423 1 1 . 1 1 99 99 LEU C C 99 173.867 173.867 173.981 -0.114 18933 424 1 1 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.228 -0.708 18933 425 1 1 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.403 -0.798 18933 426 1 1 . 1 1 99 99 LEU H H 99 9.104 9.104 8.724 0.380 18933 427 1 1 . 1 1 100 100 ASP N N 100 125.182 125.182 127.375 -2.193 18933 428 1 1 . 1 1 100 100 ASP C C 100 172.837 172.837 174.703 -1.866 18933 429 1 1 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.336 -1.582 18933 430 1 1 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.525 -4.181 18933 431 1 1 . 1 1 100 100 ASP H H 100 9.089 9.089 8.798 0.291 18933 432 1 1 . 1 1 101 101 LEU N N 101 121.174 121.174 122.020 -0.846 18933 433 1 1 . 1 1 101 101 LEU C C 101 174.529 174.529 174.885 -0.356 18933 434 1 1 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.115 -1.200 18933 435 1 1 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.710 -1.802 18933 436 1 1 . 1 1 101 101 LEU H H 101 8.458 8.458 9.127 -0.669 18933 437 1 1 . 1 1 102 102 PHE N N 102 119.464 119.464 120.254 -0.790 18933 438 1 1 . 1 1 102 102 PHE C C 102 176.293 176.293 175.283 1.010 18933 439 1 1 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.258 -1.204 18933 440 1 1 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.661 -0.781 18933 441 1 1 . 1 1 102 102 PHE H H 102 8.281 8.281 9.284 -1.003 18933 442 1 1 . 1 1 103 103 THR N N 103 108.576 108.576 117.098 -8.522 18933 443 1 1 . 1 1 103 103 THR C C 103 174.933 174.933 173.544 1.389 18933 444 1 1 . 1 1 103 103 THR CA C 103 57.726 57.726 60.282 -2.556 18933 445 1 1 . 1 1 103 103 THR CB C 103 71.288 71.288 69.321 1.967 18933 446 1 1 . 1 1 103 103 THR H H 103 7.872 7.872 8.378 -0.506 18933 447 1 1 . 1 1 104 104 ALA N N 104 122.885 122.885 128.616 -5.731 18933 448 1 1 . 1 1 104 104 ALA C C 104 175.754 175.754 175.206 0.548 18933 449 1 1 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.393 0.625 18933 450 1 1 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.066 0.419 18933 451 1 1 . 1 1 104 104 ALA H H 104 8.660 8.660 9.195 -0.535 18933 452 1 1 . 1 1 105 105 LEU N N 105 120.881 120.881 119.175 1.706 18933 453 1 1 . 1 1 105 105 LEU C C 105 179.504 179.504 178.638 0.866 18933 454 1 1 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.499 -1.252 18933 455 1 1 . 1 1 105 105 LEU CB C 105 41.753 41.753 43.603 -1.850 18933 456 1 1 . 1 1 105 105 LEU H H 105 8.226 8.226 8.340 -0.114 18933 457 1 1 . 1 1 106 106 ALA N N 106 124.901 124.901 123.962 0.939 18933 458 1 1 . 1 1 106 106 ALA C C 106 181.269 181.269 179.152 2.117 18933 459 1 1 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.645 1.668 18933 460 1 1 . 1 1 106 106 ALA CB C 106 17.224 17.224 19.033 -1.809 18933 461 1 1 . 1 1 106 106 ALA H H 106 8.392 8.392 8.568 -0.176 18933 462 1 1 . 1 1 107 107 GLU N N 107 116.409 116.409 116.675 -0.266 18933 463 1 1 . 1 1 107 107 GLU C C 107 177.764 177.764 176.946 0.818 18933 464 1 1 . 1 1 107 107 GLU CA C 107 58.533 58.533 57.994 0.539 18933 465 1 1 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.594 -1.658 18933 466 1 1 . 1 1 107 107 GLU H H 107 9.664 9.664 8.665 0.999 18933 467 1 1 . 1 1 108 108 GLU N N 108 116.189 116.189 117.152 -0.963 18933 468 1 1 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.240 -1.097 18933 469 1 1 . 1 1 108 108 GLU CB C 108 29.837 29.837 28.194 1.643 18933 470 1 1 . 1 1 108 108 GLU H H 108 7.589 7.589 7.750 -0.161 18933 471 1 1 . 1 1 109 109 LYS N N 109 119.928 119.928 121.565 -1.637 18933 472 1 1 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.010 1.841 18933 473 1 1 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.646 -0.175 18933 474 1 1 . 1 1 109 109 LYS H H 109 7.514 7.514 7.698 -0.184 18933 475 1 1 . 1 1 111 111 TYR N N 111 114.930 114.930 118.944 -4.014 18933 476 1 1 . 1 1 111 111 TYR C C 111 179.504 179.504 177.644 1.860 18933 477 1 1 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.924 -2.907 18933 478 1 1 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.760 -2.092 18933 479 1 1 . 1 1 111 111 TYR H H 111 6.393 6.393 8.527 -2.134 18933 480 1 1 . 1 1 112 112 ALA N N 112 124.901 124.901 121.952 2.949 18933 481 1 1 . 1 1 112 112 ALA C C 112 179.173 179.173 179.461 -0.288 18933 482 1 1 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.450 -0.549 18933 483 1 1 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.315 -0.203 18933 484 1 1 . 1 1 112 112 ALA H H 112 8.554 8.554 8.001 0.553 18933 485 1 1 . 1 1 113 113 ILE N N 113 119.464 119.464 120.114 -0.650 18933 486 1 1 . 1 1 113 113 ILE C C 113 178.499 178.499 177.648 0.851 18933 487 1 1 . 1 1 113 113 ILE CA C 113 66.281 66.281 63.926 2.355 18933 488 1 1 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.790 -0.474 18933 489 1 1 . 1 1 113 113 ILE H H 113 8.680 8.680 7.579 1.101 18933 490 1 1 . 1 1 114 114 PHE N N 114 122.922 122.922 121.970 0.952 18933 491 1 1 . 1 1 114 114 PHE C C 114 178.217 178.217 178.077 0.140 18933 492 1 1 . 1 1 114 114 PHE CA C 114 61.559 61.559 60.329 1.230 18933 493 1 1 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.490 0.981 18933 494 1 1 . 1 1 114 114 PHE H H 114 7.721 7.721 8.560 -0.839 18933 495 1 1 . 1 1 115 115 HIS N N 115 118.560 118.560 119.084 -0.524 18933 496 1 1 . 1 1 115 115 HIS C C 115 177.286 177.286 177.029 0.257 18933 497 1 1 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.728 -0.348 18933 498 1 1 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.263 1.602 18933 499 1 1 . 1 1 115 115 HIS H H 115 8.155 8.155 8.444 -0.289 18933 500 1 1 . 1 1 116 116 PHE N N 116 111.472 111.472 116.938 -5.466 18933 501 1 1 . 1 1 116 116 PHE C C 116 179.026 179.026 177.856 1.170 18933 502 1 1 . 1 1 116 116 PHE CA C 116 59.461 59.461 60.140 -0.679 18933 503 1 1 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.816 -1.627 18933 504 1 1 . 1 1 116 116 PHE H H 116 8.564 8.564 8.018 0.546 18933 505 1 1 . 1 1 117 117 THR N N 117 119.012 119.012 112.114 6.898 18933 506 1 1 . 1 1 117 117 THR C C 117 172.935 172.935 175.690 -2.755 18933 507 1 1 . 1 1 117 117 THR CA C 117 67.088 67.088 65.012 2.076 18933 508 1 1 . 1 1 117 117 THR CB C 117 37.126 37.126 68.963 -31.837 18933 509 1 1 . 1 1 117 117 THR H H 117 7.620 7.620 8.427 -0.807 18933 510 1 1 . 1 1 118 118 GLY N N 118 107.917 107.917 109.993 -2.076 18933 511 1 1 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.392 1.775 18933 512 1 1 . 1 1 118 118 GLY H H 118 6.666 6.666 7.703 -1.037 18933 513 1 1 . 1 1 121 121 SER N N 121 113.354 113.354 118.522 -5.168 18933 514 1 1 . 1 1 121 121 SER C C 121 176.061 176.061 176.053 0.008 18933 515 1 1 . 1 1 121 121 SER CA C 121 61.035 61.035 62.407 -1.372 18933 516 1 1 . 1 1 121 121 SER H H 121 8.322 8.322 8.202 0.120 18933 517 1 1 . 1 1 122 122 TYR N N 122 124.681 124.681 122.432 2.249 18933 518 1 1 . 1 1 122 122 TYR C C 122 176.293 176.293 177.151 -0.858 18933 519 1 1 . 1 1 122 122 TYR CA C 122 59.057 59.057 61.489 -2.432 18933 520 1 1 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.412 0.299 18933 521 1 1 . 1 1 122 122 TYR H H 122 6.514 6.514 8.446 -1.932 18933 522 1 1 . 1 1 123 123 LEU N N 123 117.997 117.997 119.653 -1.656 18933 523 1 1 . 1 1 123 123 LEU C C 123 179.774 179.774 178.992 0.782 18933 524 1 1 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.987 -0.109 18933 525 1 1 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.843 -0.865 18933 526 1 1 . 1 1 123 123 LEU H H 123 7.428 7.428 7.806 -0.378 18933 527 1 1 . 1 1 124 124 ILE N N 124 119.012 119.012 120.907 -1.895 18933 528 1 1 . 1 1 124 124 ILE C C 124 178.830 178.830 177.996 0.834 18933 529 1 1 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.305 -0.154 18933 530 1 1 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.236 -0.173 18933 531 1 1 . 1 1 124 124 ILE H H 124 8.453 8.453 8.409 0.044 18933 532 1 1 . 1 1 125 125 ARG N N 125 121.174 121.174 119.237 1.937 18933 533 1 1 . 1 1 125 125 ARG C C 125 179.762 179.762 178.988 0.774 18933 534 1 1 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.210 0.847 18933 535 1 1 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.315 -0.365 18933 536 1 1 . 1 1 125 125 ARG H H 125 7.004 7.004 8.020 -1.016 18933 537 1 1 . 1 1 126 126 ILE N N 126 122.299 122.299 120.129 2.170 18933 538 1 1 . 1 1 126 126 ILE C C 126 178.352 178.352 177.438 0.914 18933 539 1 1 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.565 -2.360 18933 540 1 1 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.086 -1.671 18933 541 1 1 . 1 1 126 126 ILE H H 126 7.579 7.579 7.954 -0.375 18933 542 1 1 . 1 1 127 127 ARG N N 127 119.354 119.354 120.763 -1.409 18933 543 1 1 . 1 1 127 127 ARG C C 127 179.786 179.786 178.608 1.178 18933 544 1 1 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.638 0.348 18933 545 1 1 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.113 -0.784 18933 546 1 1 . 1 1 127 127 ARG H H 127 8.715 8.715 7.980 0.735 18933 547 1 1 . 1 1 128 128 ALA N N 128 122.873 122.873 120.672 2.201 18933 548 1 1 . 1 1 128 128 ALA C C 128 180.325 180.325 179.386 0.939 18933 549 1 1 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.598 0.142 18933 550 1 1 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.237 -1.076 18933 551 1 1 . 1 1 128 128 ALA H H 128 7.978 7.978 8.225 -0.247 18933 552 1 1 . 1 1 129 129 ALA N N 129 121.846 121.846 121.683 0.163 18933 553 1 1 . 1 1 129 129 ALA C C 129 181.539 181.539 179.840 1.699 18933 554 1 1 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.767 -0.269 18933 555 1 1 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.587 -1.109 18933 556 1 1 . 1 1 129 129 ALA H H 129 7.519 7.519 7.988 -0.469 18933 557 1 1 . 1 1 130 130 LEU N N 130 119.134 119.134 118.200 0.934 18933 558 1 1 . 1 1 130 130 LEU C C 130 179.909 179.909 179.035 0.874 18933 559 1 1 . 1 1 130 130 LEU CA C 130 56.999 56.999 56.934 0.064 18933 560 1 1 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.792 -1.370 18933 561 1 1 . 1 1 130 130 LEU H H 130 8.296 8.296 8.495 -0.199 18933 562 1 1 . 1 1 131 131 LYS N N 131 122.299 122.299 120.383 1.916 18933 563 1 1 . 1 1 131 131 LYS C C 131 180.289 180.289 179.481 0.808 18933 564 1 1 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.699 -0.682 18933 565 1 1 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.145 -0.913 18933 566 1 1 . 1 1 131 131 LYS H H 131 8.281 8.281 7.787 0.494 18933 567 1 1 . 1 1 132 132 LYS N N 132 118.743 118.743 118.490 0.253 18933 568 1 1 . 1 1 132 132 LYS C C 132 177.482 177.482 177.748 -0.266 18933 569 1 1 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.403 0.089 18933 570 1 1 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.199 -0.967 18933 571 1 1 . 1 1 132 132 LYS H H 132 7.317 7.317 7.703 -0.386 18933 572 1 1 . 1 1 133 133 LYS N N 133 117.093 117.093 117.158 -0.065 18933 573 1 1 . 1 1 133 133 LYS C C 133 174.614 174.614 176.068 -1.454 18933 574 1 1 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.853 -1.073 18933 575 1 1 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.929 -0.747 18933 576 1 1 . 1 1 133 133 LYS H H 133 7.327 7.327 7.666 -0.339 18933 577 1 1 . 1 1 134 134 ASN N N 134 113.012 113.012 115.678 -2.666 18933 578 1 1 . 1 1 134 134 ASN C C 134 173.965 173.965 173.399 0.566 18933 579 1 1 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.567 -0.271 18933 580 1 1 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.381 -1.206 18933 581 1 1 . 1 1 134 134 ASN H H 134 7.938 7.938 7.958 -0.020 18933 582 1 1 . 1 1 135 135 TYR N N 135 115.725 115.725 119.654 -3.929 18933 583 1 1 . 1 1 135 135 TYR C C 135 176.342 176.342 174.856 1.486 18933 584 1 1 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.223 -1.555 18933 585 1 1 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.124 1.439 18933 586 1 1 . 1 1 135 135 TYR H H 135 7.741 7.741 8.307 -0.566 18933 587 1 1 . 1 1 136 136 LYS N N 136 122.641 122.641 125.132 -2.491 18933 588 1 1 . 1 1 136 136 LYS C C 136 173.475 173.475 174.513 -1.038 18933 589 1 1 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.609 0.292 18933 590 1 1 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.747 -2.029 18933 591 1 1 . 1 1 136 136 LYS H H 136 9.296 9.296 9.113 0.183 18933 592 1 1 . 1 1 137 137 LEU N N 137 127.284 127.284 123.174 4.110 18933 593 1 1 . 1 1 137 137 LEU C C 137 175.423 175.423 176.105 -0.682 18933 594 1 1 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.079 0.047 18933 595 1 1 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.530 3.216 18933 596 1 1 . 1 1 137 137 LEU H H 137 8.776 8.776 8.575 0.201 18933 597 1 1 . 1 1 138 138 ASN N N 138 125.818 125.818 119.578 6.240 18933 598 1 1 . 1 1 138 138 ASN C C 138 174.933 174.933 175.207 -0.274 18933 599 1 1 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.511 -0.394 18933 600 1 1 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.445 -4.939 18933 601 1 1 . 1 1 138 138 ASN H H 138 8.811 8.811 8.271 0.540 18933 602 1 1 . 1 1 139 139 GLN N N 139 116.861 116.861 118.824 -1.963 18933 603 1 1 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.195 -1.357 18933 604 1 1 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.397 -2.680 18933 605 1 1 . 1 1 139 139 GLN H H 139 9.220 9.220 8.875 0.345 18933 606 1 1 . 1 1 140 140 TYR N N 140 120.600 120.600 119.696 0.904 18933 607 1 1 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.792 -1.035 18933 608 1 1 . 1 1 140 140 TYR CB C 140 37.570 37.570 38.071 -0.501 18933 609 1 1 . 1 1 140 140 TYR H H 140 8.549 8.549 8.439 0.110 18933 610 1 1 . 1 1 141 141 GLY N N 141 105.986 105.986 107.882 -1.896 18933 611 1 1 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.376 -0.532 18933 612 1 1 . 1 1 141 141 GLY H H 141 7.186 7.186 7.803 -0.617 18933 613 1 1 . 1 1 142 142 LEU N N 142 120.038 120.038 116.430 3.608 18933 614 1 1 . 1 1 142 142 LEU C C 142 173.340 173.340 175.935 -2.595 18933 615 1 1 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.309 -0.788 18933 616 1 1 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.451 0.900 18933 617 1 1 . 1 1 142 142 LEU H H 142 7.539 7.539 8.263 -0.724 18933 618 1 1 . 1 1 143 143 PHE N N 143 124.229 124.229 119.223 5.006 18933 619 1 1 . 1 1 143 143 PHE C C 143 173.977 173.977 175.051 -1.074 18933 620 1 1 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.174 -2.533 18933 621 1 1 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.743 3.925 18933 622 1 1 . 1 1 143 143 PHE H H 143 9.084 9.084 9.057 0.027 18933 623 1 1 . 1 1 144 144 LYS N N 144 127.858 127.858 122.607 5.251 18933 624 1 1 . 1 1 144 144 LYS C C 144 175.092 175.092 176.727 -1.635 18933 625 1 1 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.411 4.445 18933 626 1 1 . 1 1 144 144 LYS CB C 144 38.584 38.584 35.101 3.483 18933 627 1 1 . 1 1 144 144 LYS H H 144 9.281 9.281 8.964 0.317 18933 628 1 1 . 1 1 145 145 ASN N N 145 128.188 128.188 125.875 2.313 18933 629 1 1 . 1 1 145 145 ASN C C 145 175.779 175.779 174.979 0.800 18933 630 1 1 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.387 3.339 18933 631 1 1 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.735 -3.081 18933 632 1 1 . 1 1 145 145 ASN H H 145 9.205 9.205 9.320 -0.115 18933 633 1 1 . 1 1 146 146 GLN N N 146 129.655 129.655 112.813 16.842 18933 634 1 1 . 1 1 146 146 GLN C C 146 175.399 175.399 174.144 1.255 18933 635 1 1 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.237 1.578 18933 636 1 1 . 1 1 146 146 GLN CB C 146 32.626 32.626 28.117 4.509 18933 637 1 1 . 1 1 146 146 GLN H H 146 8.983 8.983 8.632 0.351 18933 638 1 1 . 1 1 147 147 THR N N 147 117.936 117.936 115.037 2.899 18933 639 1 1 . 1 1 147 147 THR C C 147 173.254 173.254 173.299 -0.045 18933 640 1 1 . 1 1 147 147 THR CA C 147 61.721 61.721 61.207 0.514 18933 641 1 1 . 1 1 147 147 THR CB C 147 70.274 70.274 69.751 0.523 18933 642 1 1 . 1 1 147 147 THR H H 147 8.029 8.029 7.777 0.252 18933 643 1 1 . 1 1 148 148 LEU N N 148 130.681 130.681 130.914 -0.233 18933 644 1 1 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.445 0.021 18933 645 1 1 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.593 -0.904 18933 646 1 1 . 1 1 148 148 LEU H H 148 8.635 8.635 8.910 -0.275 18933 647 1 1 . 1 1 149 149 VAL N N 149 130.803 130.803 124.364 6.439 18933 648 1 1 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.099 1.079 18933 649 1 1 . 1 1 149 149 VAL CB C 149 31.675 31.675 33.767 -2.092 18933 650 1 1 . 1 1 149 149 VAL H H 149 8.968 8.968 9.179 -0.211 18933 651 1 1 . 1 1 151 151 LEU N N 151 124.290 124.290 117.539 6.751 18933 652 1 1 . 1 1 151 151 LEU CA C 151 54.013 54.013 53.772 0.241 18933 653 1 1 . 1 1 151 151 LEU CB C 151 44.098 44.098 39.381 4.717 18933 654 1 1 . 1 1 151 151 LEU H H 151 7.872 7.872 8.496 -0.624 18933 655 1 1 . 1 1 153 153 ILE N N 153 114.943 114.943 118.276 -3.333 18933 656 1 1 . 1 1 153 153 ILE C C 153 175.877 175.877 174.821 1.056 18933 657 1 1 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.858 -0.164 18933 658 1 1 . 1 1 153 153 ILE CB C 153 41.689 41.689 39.170 2.519 18933 659 1 1 . 1 1 153 153 ILE H H 153 7.125 7.125 7.586 -0.461 18933 660 1 1 . 1 1 154 154 THR N N 154 111.766 111.766 112.892 -1.126 18933 661 1 1 . 1 1 154 154 THR C C 154 174.945 174.945 173.995 0.950 18933 662 1 1 . 1 1 154 154 THR CA C 154 62.124 62.124 62.843 -0.719 18933 663 1 1 . 1 1 154 154 THR CB C 154 70.718 70.718 69.676 1.042 18933 664 1 1 . 1 1 154 154 THR H H 154 9.286 9.286 8.295 0.991 18933 665 1 1 . 1 1 155 155 THR N N 155 111.766 111.766 113.601 -1.835 18933 666 1 1 . 1 1 155 155 THR CA C 155 58.936 58.936 60.151 -1.215 18933 667 1 1 . 1 1 155 155 THR CB C 155 72.683 72.683 71.618 1.065 18933 668 1 1 . 1 1 155 155 THR H H 155 7.645 7.645 7.403 0.242 18933 669 1 1 . 1 1 157 157 LYS N N 157 119.464 119.464 117.869 1.595 18933 670 1 1 . 1 1 157 157 LYS C C 157 178.781 178.781 178.554 0.227 18933 671 1 1 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.715 0.311 18933 672 1 1 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.422 0.000 18933 673 1 1 . 1 1 157 157 LYS H H 157 8.175 8.175 8.304 -0.129 18933 674 1 1 . 1 1 158 158 GLU N N 158 118.340 118.340 118.397 -0.057 18933 675 1 1 . 1 1 158 158 GLU C C 158 178.867 178.867 178.881 -0.014 18933 676 1 1 . 1 1 158 158 GLU CA C 158 58.492 58.492 58.960 -0.468 18933 677 1 1 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.894 0.436 18933 678 1 1 . 1 1 158 158 GLU H H 158 7.519 7.519 8.214 -0.695 18933 679 1 1 . 1 1 159 159 LEU N N 159 120.710 120.710 121.290 -0.580 18933 680 1 1 . 1 1 159 159 LEU C C 159 176.526 176.526 178.556 -2.030 18933 681 1 1 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.235 -0.065 18933 682 1 1 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.574 -1.659 18933 683 1 1 . 1 1 159 159 LEU H H 159 7.524 7.524 8.004 -0.480 18933 684 1 1 . 1 1 160 160 ILE N N 160 118.217 118.217 118.775 -0.558 18933 685 1 1 . 1 1 160 160 ILE C C 160 177.213 177.213 178.015 -0.802 18933 686 1 1 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.489 -0.459 18933 687 1 1 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.239 0.267 18933 688 1 1 . 1 1 160 160 ILE H H 160 7.741 7.741 7.801 -0.060 18933 689 1 1 . 1 1 161 161 LYS N N 161 118.450 118.450 119.938 -1.488 18933 690 1 1 . 1 1 161 161 LYS C C 161 180.999 180.999 179.846 1.153 18933 691 1 1 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.454 -0.639 18933 692 1 1 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.194 -1.216 18933 693 1 1 . 1 1 161 161 LYS H H 161 7.382 7.382 7.970 -0.588 18933 694 1 1 . 1 1 162 162 GLU N N 162 121.846 121.846 121.160 0.686 18933 695 1 1 . 1 1 162 162 GLU C C 162 178.818 178.818 178.455 0.363 18933 696 1 1 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.873 -0.824 18933 697 1 1 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.334 -1.398 18933 698 1 1 . 1 1 162 162 GLU H H 162 8.210 8.210 7.903 0.307 18933 699 1 1 . 1 1 163 163 LEU N N 163 116.751 116.751 114.920 1.831 18933 700 1 1 . 1 1 163 163 LEU C C 163 176.784 176.784 177.164 -0.380 18933 701 1 1 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.272 -0.250 18933 702 1 1 . 1 1 163 163 LEU CB C 163 41.309 41.309 42.031 -0.722 18933 703 1 1 . 1 1 163 163 LEU H H 163 7.796 7.796 7.509 0.287 18933 704 1 1 . 1 1 164 164 GLY N N 164 104.849 104.849 105.323 -0.474 18933 705 1 1 . 1 1 164 164 GLY C C 164 174.492 174.492 174.227 0.265 18933 706 1 1 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.368 -0.636 18933 707 1 1 . 1 1 164 164 GLY H H 164 7.589 7.589 7.584 0.005 18933 708 1 1 . 1 1 165 165 PHE N N 165 118.902 118.902 119.894 -0.992 18933 709 1 1 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.164 -0.496 18933 710 1 1 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.486 -2.001 18933 711 1 1 . 1 1 165 165 PHE H H 165 7.251 7.251 7.742 -0.491 18933 712 1 1 . 1 1 166 166 THR N N 166 117.093 117.093 116.371 0.722 18933 713 1 1 . 1 1 166 166 THR CA C 166 62.245 62.245 61.147 1.099 18933 714 1 1 . 1 1 166 166 THR CB C 166 69.323 69.323 69.393 -0.070 18933 715 1 1 . 1 1 166 166 THR H H 166 8.407 8.407 8.199 0.208 18933 716 1 1 . 1 1 168 168 ARG N N 168 127.431 127.431 120.173 7.258 18933 717 1 1 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.350 -2.112 18933 718 1 1 . 1 1 168 168 ARG CB C 168 31.992 31.992 32.825 -0.833 18933 719 1 1 . 1 1 168 168 ARG H H 168 7.160 7.160 8.578 -1.418 18933 720 1 1 . 1 1 171 171 LYS N N 171 113.574 113.574 114.862 -1.288 18933 721 1 1 . 1 1 171 171 LYS C C 171 176.416 176.416 177.333 -0.917 18933 722 1 1 . 1 1 171 171 LYS CA C 171 57.605 57.605 57.297 0.308 18933 723 1 1 . 1 1 171 171 LYS CB C 171 31.929 31.929 30.928 1.001 18933 724 1 1 . 1 1 171 171 LYS H H 171 8.210 8.210 8.183 0.027 18933 725 1 1 . 1 1 172 172 LYS N N 172 117.313 117.313 117.893 -0.580 18933 726 1 1 . 1 1 172 172 LYS C C 172 175.717 175.717 176.735 -1.018 18933 727 1 1 . 1 1 172 172 LYS CA C 172 54.175 54.175 55.811 -1.636 18933 728 1 1 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.935 -1.323 18933 729 1 1 . 1 1 172 172 LYS H H 172 7.761 7.761 7.633 0.128 18933 730 1 1 . 1 1 173 173 ARG N N 173 122.056 122.056 120.013 2.043 18933 731 1 1 . 1 1 173 173 ARG C C 173 172.850 172.850 174.896 -2.046 18933 732 1 1 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.612 0.266 18933 733 1 1 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.809 -0.303 18933 734 1 1 . 1 1 173 173 ARG H H 173 6.885 6.885 7.633 -0.748 18933 735 1 2 . 1 1 2 2 LEU N N 2 122.812 122.812 122.596 0.216 18933 736 1 2 . 1 1 2 2 LEU C C 2 175.742 175.742 176.225 -0.483 18933 737 1 2 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.116 1.018 18933 738 1 2 . 1 1 2 2 LEU CB C 2 42.842 42.842 45.697 -2.855 18933 739 1 2 . 1 1 2 2 LEU H H 2 8.756 8.756 8.708 0.048 18933 740 1 2 . 1 1 3 3 THR N N 3 113.000 113.000 112.072 0.928 18933 741 1 2 . 1 1 3 3 THR C C 3 175.938 175.938 175.307 0.631 18933 742 1 2 . 1 1 3 3 THR CA C 3 60.550 60.550 60.084 0.466 18933 743 1 2 . 1 1 3 3 THR CB C 3 70.781 70.781 70.877 -0.096 18933 744 1 2 . 1 1 3 3 THR H H 3 8.428 8.428 8.007 0.421 18933 745 1 2 . 1 1 4 4 LEU N N 4 122.531 122.531 122.821 -0.290 18933 746 1 2 . 1 1 4 4 LEU C C 4 178.463 178.463 178.466 -0.003 18933 747 1 2 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.337 -0.208 18933 748 1 2 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.053 -2.519 18933 749 1 2 . 1 1 4 4 LEU H H 4 7.731 7.731 8.091 -0.360 18933 750 1 2 . 1 1 5 5 ILE N N 5 115.505 115.505 116.172 -0.667 18933 751 1 2 . 1 1 5 5 ILE C C 5 178.573 178.573 177.942 0.631 18933 752 1 2 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.463 -0.725 18933 753 1 2 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.321 -0.449 18933 754 1 2 . 1 1 5 5 ILE H H 5 7.645 7.645 7.930 -0.285 18933 755 1 2 . 1 1 6 6 GLN N N 6 121.626 121.626 119.568 2.058 18933 756 1 2 . 1 1 6 6 GLN C C 6 179.014 179.014 178.718 0.296 18933 757 1 2 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.267 -0.936 18933 758 1 2 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.881 0.308 18933 759 1 2 . 1 1 6 6 GLN H H 6 7.645 7.645 7.683 -0.038 18933 760 1 2 . 1 1 7 7 GLY N N 7 107.684 107.684 106.586 1.098 18933 761 1 2 . 1 1 7 7 GLY C C 7 174.749 174.749 176.282 -1.533 18933 762 1 2 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.930 -0.140 18933 763 1 2 . 1 1 7 7 GLY H H 7 8.660 8.660 8.002 0.658 18933 764 1 2 . 1 1 8 8 LYS N N 8 120.942 120.942 122.231 -1.289 18933 765 1 2 . 1 1 8 8 LYS C C 8 179.455 179.455 178.857 0.598 18933 766 1 2 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.278 0.627 18933 767 1 2 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.045 -0.623 18933 768 1 2 . 1 1 8 8 LYS H H 8 8.518 8.518 7.467 1.051 18933 769 1 2 . 1 1 9 9 LYS N N 9 120.710 120.710 119.712 0.998 18933 770 1 2 . 1 1 9 9 LYS C C 9 179.823 179.823 179.323 0.500 18933 771 1 2 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.899 -0.277 18933 772 1 2 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.505 -1.210 18933 773 1 2 . 1 1 9 9 LYS H H 9 7.731 7.731 8.244 -0.513 18933 774 1 2 . 1 1 10 10 ILE N N 10 121.345 121.345 120.794 0.551 18933 775 1 2 . 1 1 10 10 ILE C C 10 177.789 177.789 178.225 -0.436 18933 776 1 2 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.652 -1.187 18933 777 1 2 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.204 -1.839 18933 778 1 2 . 1 1 10 10 ILE H H 10 7.711 7.711 8.291 -0.580 18933 779 1 2 . 1 1 11 11 VAL N N 11 120.258 120.258 119.899 0.359 18933 780 1 2 . 1 1 11 11 VAL C C 11 177.372 177.372 177.693 -0.321 18933 781 1 2 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.067 0.384 18933 782 1 2 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.597 -1.063 18933 783 1 2 . 1 1 11 11 VAL H H 11 7.918 7.918 8.290 -0.372 18933 784 1 2 . 1 1 12 12 ASN N N 12 116.971 116.971 117.771 -0.800 18933 785 1 2 . 1 1 12 12 ASN C C 12 177.445 177.445 177.340 0.105 18933 786 1 2 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.432 -0.320 18933 787 1 2 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.544 -0.911 18933 788 1 2 . 1 1 12 12 ASN H H 12 7.993 7.993 8.563 -0.570 18933 789 1 2 . 1 1 13 13 HIS N N 13 120.258 120.258 119.531 0.727 18933 790 1 2 . 1 1 13 13 HIS C C 13 177.862 177.862 177.816 0.046 18933 791 1 2 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.534 -0.436 18933 792 1 2 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.358 0.874 18933 793 1 2 . 1 1 13 13 HIS H H 13 7.741 7.741 8.253 -0.512 18933 794 1 2 . 1 1 14 14 LEU N N 14 116.641 116.641 119.919 -3.278 18933 795 1 2 . 1 1 14 14 LEU C C 14 179.186 179.186 178.299 0.887 18933 796 1 2 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.357 -1.600 18933 797 1 2 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.477 -0.358 18933 798 1 2 . 1 1 14 14 LEU H H 14 8.221 8.221 8.502 -0.281 18933 799 1 2 . 1 1 15 15 ARG N N 15 115.957 115.957 114.584 1.373 18933 800 1 2 . 1 1 15 15 ARG C C 15 176.330 176.330 178.285 -1.955 18933 801 1 2 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.590 1.113 18933 802 1 2 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.403 -1.326 18933 803 1 2 . 1 1 15 15 ARG H H 15 7.968 7.968 8.336 -0.368 18933 804 1 2 . 1 1 16 16 SER N N 16 109.395 109.395 115.934 -6.539 18933 805 1 2 . 1 1 16 16 SER C C 16 176.024 176.024 175.039 0.985 18933 806 1 2 . 1 1 16 16 SER CA C 16 57.282 57.282 60.399 -3.117 18933 807 1 2 . 1 1 16 16 SER CB C 16 63.683 63.683 63.465 0.218 18933 808 1 2 . 1 1 16 16 SER H H 16 6.963 6.963 7.427 -0.464 18933 809 1 2 . 1 1 17 17 ARG N N 17 122.775 122.775 121.735 1.040 18933 810 1 2 . 1 1 17 17 ARG C C 17 174.590 174.590 173.985 0.605 18933 811 1 2 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.945 1.328 18933 812 1 2 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.444 1.358 18933 813 1 2 . 1 1 17 17 ARG H H 17 7.781 7.781 8.344 -0.563 18933 814 1 2 . 1 1 18 18 LEU N N 18 122.421 122.421 125.871 -3.450 18933 815 1 2 . 1 1 18 18 LEU C C 18 176.281 176.281 174.019 2.262 18933 816 1 2 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.437 0.343 18933 817 1 2 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.974 -3.763 18933 818 1 2 . 1 1 18 18 LEU H H 18 8.650 8.650 7.750 0.900 18933 819 1 2 . 1 1 19 19 ALA N N 19 126.441 126.441 126.618 -0.177 18933 820 1 2 . 1 1 19 19 ALA C C 19 173.904 173.904 174.873 -0.969 18933 821 1 2 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.592 -0.726 18933 822 1 2 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.284 0.581 18933 823 1 2 . 1 1 19 19 ALA H H 19 8.609 8.609 8.915 -0.306 18933 824 1 2 . 1 1 20 20 PHE N N 20 114.600 114.600 119.090 -4.490 18933 825 1 2 . 1 1 20 20 PHE C C 20 172.592 172.592 173.956 -1.364 18933 826 1 2 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.925 0.864 18933 827 1 2 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.552 -0.863 18933 828 1 2 . 1 1 20 20 PHE H H 20 8.801 8.801 9.062 -0.261 18933 829 1 2 . 1 1 21 21 GLU N N 21 122.873 122.873 123.608 -0.735 18933 830 1 2 . 1 1 21 21 GLU C C 21 174.872 174.872 175.230 -0.358 18933 831 1 2 . 1 1 21 21 GLU CA C 21 55.062 55.062 55.048 0.014 18933 832 1 2 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.082 -0.357 18933 833 1 2 . 1 1 21 21 GLU H H 21 7.847 7.847 9.173 -1.326 18933 834 1 2 . 1 1 22 22 TYR N N 22 126.270 126.270 125.798 0.472 18933 835 1 2 . 1 1 22 22 TYR C C 22 174.872 174.872 174.724 0.148 18933 836 1 2 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.197 -0.449 18933 837 1 2 . 1 1 22 22 TYR CB C 22 40.105 40.105 40.984 -0.879 18933 838 1 2 . 1 1 22 22 TYR H H 22 8.806 8.806 9.081 -0.275 18933 839 1 2 . 1 1 23 23 ASN N N 23 128.420 128.420 126.242 2.178 18933 840 1 2 . 1 1 23 23 ASN C C 23 175.435 175.435 175.073 0.362 18933 841 1 2 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.320 -0.315 18933 842 1 2 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.680 -1.315 18933 843 1 2 . 1 1 23 23 ASN H H 23 8.943 8.943 9.185 -0.242 18933 844 1 2 . 1 1 24 24 GLY N N 24 104.067 104.067 103.470 0.597 18933 845 1 2 . 1 1 24 24 GLY C C 24 173.707 173.707 173.789 -0.082 18933 846 1 2 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.915 0.019 18933 847 1 2 . 1 1 24 24 GLY H H 24 8.534 8.534 8.231 0.303 18933 848 1 2 . 1 1 25 25 GLN N N 25 120.038 120.038 119.726 0.312 18933 849 1 2 . 1 1 25 25 GLN C C 25 173.744 173.744 174.881 -1.137 18933 850 1 2 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.402 -1.075 18933 851 1 2 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.309 0.352 18933 852 1 2 . 1 1 25 25 GLN H H 25 7.595 7.595 7.818 -0.223 18933 853 1 2 . 1 1 26 26 LEU N N 26 124.681 124.681 124.957 -0.276 18933 854 1 2 . 1 1 26 26 LEU C C 26 175.987 175.987 176.253 -0.266 18933 855 1 2 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.470 -0.457 18933 856 1 2 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.419 -1.554 18933 857 1 2 . 1 1 26 26 LEU H H 26 8.382 8.382 8.605 -0.223 18933 858 1 2 . 1 1 27 27 ILE N N 27 130.779 130.779 127.359 3.420 18933 859 1 2 . 1 1 27 27 ILE C C 27 175.215 175.215 174.379 0.836 18933 860 1 2 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.706 -0.447 18933 861 1 2 . 1 1 27 27 ILE CB C 27 35.732 35.732 37.962 -2.230 18933 862 1 2 . 1 1 27 27 ILE H H 27 8.882 8.882 8.925 -0.043 18933 863 1 2 . 1 1 28 28 LYS N N 28 126.160 126.160 127.580 -1.420 18933 864 1 2 . 1 1 28 28 LYS C C 28 176.771 176.771 175.802 0.969 18933 865 1 2 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.911 1.927 18933 866 1 2 . 1 1 28 28 LYS CB C 28 31.739 31.739 32.996 -1.257 18933 867 1 2 . 1 1 28 28 LYS H H 28 8.165 8.165 8.351 -0.186 18933 868 1 2 . 1 1 29 29 ILE N N 29 126.380 126.380 121.953 4.427 18933 869 1 2 . 1 1 29 29 ILE C C 29 175.877 175.877 174.304 1.573 18933 870 1 2 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.470 -0.162 18933 871 1 2 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.655 -2.592 18933 872 1 2 . 1 1 29 29 ILE H H 29 8.019 8.019 8.721 -0.702 18933 873 1 2 . 1 1 30 30 LEU N N 30 129.215 129.215 122.273 6.942 18933 874 1 2 . 1 1 30 30 LEU C C 30 178.867 178.867 178.111 0.756 18933 875 1 2 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.364 1.255 18933 876 1 2 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.770 -4.905 18933 877 1 2 . 1 1 30 30 LEU H H 30 8.917 8.917 8.306 0.611 18933 878 1 2 . 1 1 31 31 SER N N 31 117.997 117.997 116.193 1.804 18933 879 1 2 . 1 1 31 31 SER C C 31 177.396 177.396 175.720 1.676 18933 880 1 2 . 1 1 31 31 SER CA C 31 61.236 61.236 60.953 0.283 18933 881 1 2 . 1 1 31 31 SER CB C 31 62.035 62.035 63.301 -1.266 18933 882 1 2 . 1 1 31 31 SER H H 31 8.594 8.594 8.899 -0.305 18933 883 1 2 . 1 1 32 32 LYS N N 32 116.189 116.189 118.981 -2.792 18933 884 1 2 . 1 1 32 32 LYS C C 32 176.244 176.244 177.337 -1.093 18933 885 1 2 . 1 1 32 32 LYS CA C 32 57.403 57.403 57.946 -0.543 18933 886 1 2 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.383 -2.102 18933 887 1 2 . 1 1 32 32 LYS H H 32 8.029 8.029 8.344 -0.315 18933 888 1 2 . 1 1 33 33 ASN N N 33 119.061 119.061 115.424 3.637 18933 889 1 2 . 1 1 33 33 ASN C C 33 172.384 172.384 174.308 -1.924 18933 890 1 2 . 1 1 33 33 ASN CA C 33 52.157 52.157 54.035 -1.879 18933 891 1 2 . 1 1 33 33 ASN CB C 33 38.267 38.267 40.991 -2.724 18933 892 1 2 . 1 1 33 33 ASN H H 33 7.902 7.902 7.838 0.064 18933 893 1 2 . 1 1 34 34 ILE N N 34 120.038 120.038 119.370 0.668 18933 894 1 2 . 1 1 34 34 ILE C C 34 175.607 175.607 174.250 1.357 18933 895 1 2 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.217 0.333 18933 896 1 2 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.761 -2.797 18933 897 1 2 . 1 1 34 34 ILE H H 34 7.443 7.443 7.887 -0.444 18933 898 1 2 . 1 1 35 35 VAL N N 35 129.435 129.435 126.441 2.994 18933 899 1 2 . 1 1 35 35 VAL C C 35 175.386 175.386 174.619 0.767 18933 900 1 2 . 1 1 35 35 VAL CA C 35 60.026 60.026 59.833 0.193 18933 901 1 2 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.400 -0.619 18933 902 1 2 . 1 1 35 35 VAL H H 35 9.533 9.533 9.083 0.450 18933 903 1 2 . 1 1 36 36 ALA N N 36 130.571 130.571 130.166 0.405 18933 904 1 2 . 1 1 36 36 ALA C C 36 177.347 177.347 176.250 1.097 18933 905 1 2 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.743 0.656 18933 906 1 2 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.908 -1.050 18933 907 1 2 . 1 1 36 36 ALA H H 36 8.665 8.665 8.513 0.152 18933 908 1 2 . 1 1 37 37 VAL N N 37 115.395 115.395 120.424 -5.029 18933 909 1 2 . 1 1 37 37 VAL C C 37 174.455 174.455 176.186 -1.731 18933 910 1 2 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.306 0.074 18933 911 1 2 . 1 1 37 37 VAL CB C 37 32.943 32.943 35.028 -2.085 18933 912 1 2 . 1 1 37 37 VAL H H 37 8.079 8.079 8.267 -0.188 18933 913 1 2 . 1 1 38 38 GLY N N 38 107.672 107.672 107.899 -0.227 18933 914 1 2 . 1 1 38 38 GLY C C 38 173.364 173.364 175.649 -2.285 18933 915 1 2 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.110 0.075 18933 916 1 2 . 1 1 38 38 GLY H H 38 7.579 7.579 8.225 -0.646 18933 917 1 2 . 1 1 39 39 SER N N 39 121.052 121.052 119.536 1.516 18933 918 1 2 . 1 1 39 39 SER C C 39 175.570 175.570 176.480 -0.910 18933 919 1 2 . 1 1 39 39 SER CA C 39 61.801 61.801 61.412 0.389 18933 920 1 2 . 1 1 39 39 SER CB C 39 62.478 62.478 63.381 -0.903 18933 921 1 2 . 1 1 39 39 SER H H 39 8.953 8.953 8.090 0.863 18933 922 1 2 . 1 1 40 40 LEU N N 40 121.553 121.553 121.951 -0.398 18933 923 1 2 . 1 1 40 40 LEU C C 40 180.203 180.203 177.767 2.436 18933 924 1 2 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.056 0.073 18933 925 1 2 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.917 -0.164 18933 926 1 2 . 1 1 40 40 LEU H H 40 8.195 8.195 7.359 0.836 18933 927 1 2 . 1 1 41 41 ARG N N 41 121.956 121.956 116.992 4.964 18933 928 1 2 . 1 1 41 41 ARG C C 41 177.323 177.323 178.158 -0.835 18933 929 1 2 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.752 0.579 18933 930 1 2 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.871 -1.428 18933 931 1 2 . 1 1 41 41 ARG H H 41 6.873 6.873 7.381 -0.508 18933 932 1 2 . 1 1 42 42 ARG N N 42 114.600 114.600 117.034 -2.434 18933 933 1 2 . 1 1 42 42 ARG C C 42 172.911 172.911 176.338 -3.427 18933 934 1 2 . 1 1 42 42 ARG CA C 42 57.242 57.242 56.995 0.247 18933 935 1 2 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.930 -1.790 18933 936 1 2 . 1 1 42 42 ARG H H 42 7.438 7.438 8.017 -0.579 18933 937 1 2 . 1 1 43 43 GLU N N 43 113.354 113.354 117.214 -3.860 18933 938 1 2 . 1 1 43 43 GLU C C 43 175.999 175.999 175.538 0.461 18933 939 1 2 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.225 -0.669 18933 940 1 2 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.276 -1.939 18933 941 1 2 . 1 1 43 43 GLU H H 43 7.564 7.564 7.966 -0.402 18933 942 1 2 . 1 1 44 44 GLU N N 44 119.696 119.696 121.200 -1.504 18933 943 1 2 . 1 1 44 44 GLU C C 44 175.423 175.423 176.441 -1.018 18933 944 1 2 . 1 1 44 44 GLU CA C 44 56.838 56.838 57.069 -0.231 18933 945 1 2 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.079 -1.383 18933 946 1 2 . 1 1 44 44 GLU H H 44 7.261 7.261 8.581 -1.320 18933 947 1 2 . 1 1 45 45 LYS N N 45 117.435 117.435 118.536 -1.101 18933 948 1 2 . 1 1 45 45 LYS C C 45 177.715 177.715 175.876 1.839 18933 949 1 2 . 1 1 45 45 LYS CA C 45 59.219 59.219 56.597 2.622 18933 950 1 2 . 1 1 45 45 LYS CB C 45 32.119 32.119 34.091 -1.972 18933 951 1 2 . 1 1 45 45 LYS H H 45 7.938 7.938 8.297 -0.359 18933 952 1 2 . 1 1 46 46 MET N N 46 115.847 115.847 118.095 -2.248 18933 953 1 2 . 1 1 46 46 MET CA C 46 52.520 52.520 53.750 -1.230 18933 954 1 2 . 1 1 46 46 MET CB C 46 33.450 33.450 35.325 -1.875 18933 955 1 2 . 1 1 46 46 MET H H 46 7.595 7.595 7.683 -0.088 18933 956 1 2 . 1 1 47 47 LEU N N 47 121.627 121.627 122.832 -1.205 18933 957 1 2 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.064 -0.938 18933 958 1 2 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.140 -0.070 18933 959 1 2 . 1 1 47 47 LEU H H 47 9.220 9.220 8.906 0.314 18933 960 1 2 . 1 1 49 49 ASP N N 49 117.093 117.093 117.265 -0.172 18933 961 1 2 . 1 1 49 49 ASP C C 49 173.340 173.340 174.387 -1.047 18933 962 1 2 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.429 -1.635 18933 963 1 2 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.879 -1.873 18933 964 1 2 . 1 1 49 49 ASP H H 49 7.761 7.761 7.559 0.202 18933 965 1 2 . 1 1 50 50 VAL N N 50 119.012 119.012 116.012 3.000 18933 966 1 2 . 1 1 50 50 VAL C C 50 173.070 173.070 173.811 -0.741 18933 967 1 2 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.220 1.622 18933 968 1 2 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.368 -0.805 18933 969 1 2 . 1 1 50 50 VAL H H 50 8.089 8.089 8.615 -0.526 18933 970 1 2 . 1 1 51 51 ASP N N 51 127.064 127.064 124.963 2.101 18933 971 1 2 . 1 1 51 51 ASP C C 51 174.565 174.565 175.374 -0.809 18933 972 1 2 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.732 -0.575 18933 973 1 2 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.553 -0.913 18933 974 1 2 . 1 1 51 51 ASP H H 51 8.069 8.069 8.121 -0.052 18933 975 1 2 . 1 1 52 52 LEU N N 52 121.627 121.627 119.955 1.672 18933 976 1 2 . 1 1 52 52 LEU C C 52 174.063 174.063 174.712 -0.649 18933 977 1 2 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.521 -0.839 18933 978 1 2 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.334 -2.983 18933 979 1 2 . 1 1 52 52 LEU H H 52 8.852 8.852 9.064 -0.212 18933 980 1 2 . 1 1 53 53 LEU N N 53 123.093 123.093 123.229 -0.136 18933 981 1 2 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.150 1.841 18933 982 1 2 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.697 -2.564 18933 983 1 2 . 1 1 53 53 LEU H H 53 9.362 9.362 9.144 0.218 18933 984 1 2 . 1 1 54 54 ILE N N 54 123.777 123.777 129.309 -5.532 18933 985 1 2 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.179 -4.117 18933 986 1 2 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.381 -7.311 18933 987 1 2 . 1 1 54 54 ILE H H 54 8.907 8.907 9.281 -0.374 18933 988 1 2 . 1 1 58 58 GLU N N 58 114.710 114.710 117.370 -2.660 18933 989 1 2 . 1 1 58 58 GLU CA C 58 54.377 54.377 54.920 -0.543 18933 990 1 2 . 1 1 58 58 GLU CB C 58 31.422 31.422 32.611 -1.189 18933 991 1 2 . 1 1 58 58 GLU H H 58 6.716 6.716 7.418 -0.702 18933 992 1 2 . 1 1 61 61 LEU N N 61 115.957 115.957 120.283 -4.326 18933 993 1 2 . 1 1 61 61 LEU C C 61 178.512 178.512 178.496 0.016 18933 994 1 2 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.395 -2.615 18933 995 1 2 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.822 -0.702 18933 996 1 2 . 1 1 61 61 LEU H H 61 7.307 7.307 7.671 -0.364 18933 997 1 2 . 1 1 62 62 LEU N N 62 120.038 120.038 119.256 0.782 18933 998 1 2 . 1 1 62 62 LEU C C 62 177.874 177.874 178.780 -0.906 18933 999 1 2 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.454 0.482 18933 1000 1 2 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.958 -1.219 18933 1001 1 2 . 1 1 62 62 LEU H H 62 7.327 7.327 8.185 -0.858 18933 1002 1 2 . 1 1 63 63 LYS N N 63 114.600 114.600 115.782 -1.182 18933 1003 1 2 . 1 1 63 63 LYS C C 63 175.460 175.460 177.693 -2.233 18933 1004 1 2 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.720 -1.156 18933 1005 1 2 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.481 -1.756 18933 1006 1 2 . 1 1 63 63 LYS H H 63 7.973 7.973 7.729 0.244 18933 1007 1 2 . 1 1 64 64 HIS N N 64 115.273 115.273 115.784 -0.511 18933 1008 1 2 . 1 1 64 64 HIS CA C 64 56.112 56.112 54.695 1.417 18933 1009 1 2 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.299 2.137 18933 1010 1 2 . 1 1 64 64 HIS H H 64 7.544 7.544 7.490 0.054 18933 1011 1 2 . 1 1 65 65 VAL N N 65 118.682 118.682 118.296 0.386 18933 1012 1 2 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.740 3.298 18933 1013 1 2 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.148 -2.121 18933 1014 1 2 . 1 1 65 65 VAL H H 65 6.787 6.787 7.055 -0.268 18933 1015 1 2 . 1 1 68 68 ASN N N 68 112.108 112.108 117.979 -5.871 18933 1016 1 2 . 1 1 68 68 ASN C C 68 174.884 174.884 173.936 0.948 18933 1017 1 2 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.381 -1.354 18933 1018 1 2 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.391 0.841 18933 1019 1 2 . 1 1 68 68 ASN H H 68 7.009 7.009 8.297 -1.288 18933 1020 1 2 . 1 1 69 69 ILE N N 69 123.325 123.325 123.324 0.001 18933 1021 1 2 . 1 1 69 69 ILE C C 69 174.394 174.394 175.439 -1.045 18933 1022 1 2 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.691 -1.584 18933 1023 1 2 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.445 -0.178 18933 1024 1 2 . 1 1 69 69 ILE H H 69 7.150 7.150 8.204 -1.054 18933 1025 1 2 . 1 1 70 70 ARG N N 70 126.722 126.722 128.112 -1.390 18933 1026 1 2 . 1 1 70 70 ARG C C 70 174.590 174.590 174.169 0.421 18933 1027 1 2 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.708 -1.461 18933 1028 1 2 . 1 1 70 70 ARG CB C 70 32.372 32.372 35.122 -2.750 18933 1029 1 2 . 1 1 70 70 ARG H H 70 8.902 8.902 9.182 -0.280 18933 1030 1 2 . 1 1 71 71 ILE N N 71 119.978 119.978 119.783 0.195 18933 1031 1 2 . 1 1 71 71 ILE C C 71 175.583 175.583 175.501 0.082 18933 1032 1 2 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.453 0.371 18933 1033 1 2 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.435 -2.675 18933 1034 1 2 . 1 1 71 71 ILE H H 71 7.491 7.491 8.754 -1.263 18933 1035 1 2 . 1 1 72 72 LYS N N 72 128.530 128.530 123.762 4.768 18933 1036 1 2 . 1 1 72 72 LYS C C 72 177.703 177.703 176.947 0.756 18933 1037 1 2 . 1 1 72 72 LYS CA C 72 57.201 57.201 55.641 1.560 18933 1038 1 2 . 1 1 72 72 LYS CB C 72 31.485 31.485 31.077 0.408 18933 1039 1 2 . 1 1 72 72 LYS H H 72 8.523 8.523 8.550 -0.027 18933 1040 1 2 . 1 1 73 73 GLY N N 73 113.806 113.806 112.110 1.696 18933 1041 1 2 . 1 1 73 73 GLY C C 73 173.781 173.781 173.243 0.538 18933 1042 1 2 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.558 0.264 18933 1043 1 2 . 1 1 73 73 GLY H H 73 8.791 8.791 8.745 0.046 18933 1044 1 2 . 1 1 74 74 LEU N N 74 120.490 120.490 118.223 2.267 18933 1045 1 2 . 1 1 74 74 LEU C C 74 175.840 175.840 173.961 1.879 18933 1046 1 2 . 1 1 74 74 LEU CA C 74 53.691 53.691 53.894 -0.203 18933 1047 1 2 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.043 -0.882 18933 1048 1 2 . 1 1 74 74 LEU H H 74 7.393 7.393 7.184 0.209 18933 1049 1 2 . 1 1 75 75 SER N N 75 120.038 120.038 115.956 4.082 18933 1050 1 2 . 1 1 75 75 SER C C 75 173.205 173.205 173.048 0.157 18933 1051 1 2 . 1 1 75 75 SER CA C 75 57.887 57.887 57.604 0.283 18933 1052 1 2 . 1 1 75 75 SER CB C 75 63.049 63.049 64.922 -1.873 18933 1053 1 2 . 1 1 75 75 SER H H 75 8.917 8.917 8.183 0.734 18933 1054 1 2 . 1 1 76 76 PHE N N 76 119.586 119.586 118.425 1.161 18933 1055 1 2 . 1 1 76 76 PHE C C 76 173.536 173.536 173.672 -0.136 18933 1056 1 2 . 1 1 76 76 PHE CA C 76 55.426 55.426 55.872 -0.446 18933 1057 1 2 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.316 -0.310 18933 1058 1 2 . 1 1 76 76 PHE H H 76 8.003 8.003 8.377 -0.374 18933 1059 1 2 . 1 1 77 77 SER N N 77 114.943 114.943 116.601 -1.658 18933 1060 1 2 . 1 1 77 77 SER C C 77 173.438 173.438 172.778 0.660 18933 1061 1 2 . 1 1 77 77 SER CA C 77 56.152 56.152 57.090 -0.938 18933 1062 1 2 . 1 1 77 77 SER CB C 77 65.204 65.204 65.395 -0.191 18933 1063 1 2 . 1 1 77 77 SER H H 77 8.907 8.907 8.779 0.128 18933 1064 1 2 . 1 1 78 78 VAL N N 78 124.791 124.791 123.736 1.055 18933 1065 1 2 . 1 1 78 78 VAL CA C 78 62.044 62.044 61.256 0.788 18933 1066 1 2 . 1 1 78 78 VAL CB C 78 32.182 32.182 33.918 -1.736 18933 1067 1 2 . 1 1 78 78 VAL H H 78 8.892 8.892 8.419 0.473 18933 1068 1 2 . 1 1 79 79 LYS N N 79 129.667 129.667 129.491 0.176 18933 1069 1 2 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.815 1.377 18933 1070 1 2 . 1 1 79 79 LYS CB C 79 32.372 32.372 35.260 -2.888 18933 1071 1 2 . 1 1 79 79 LYS H H 79 9.049 9.049 8.502 0.547 18933 1072 1 2 . 1 1 82 82 GLY N N 82 117.263 117.263 113.618 3.645 18933 1073 1 2 . 1 1 82 82 GLY C C 82 171.710 171.710 174.379 -2.669 18933 1074 1 2 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.858 -2.933 18933 1075 1 2 . 1 1 82 82 GLY H H 82 8.044 8.044 8.425 -0.381 18933 1076 1 2 . 1 1 83 83 GLU N N 83 117.203 117.203 121.210 -4.007 18933 1077 1 2 . 1 1 83 83 GLU C C 83 178.695 178.695 177.773 0.922 18933 1078 1 2 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.596 1.381 18933 1079 1 2 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.761 0.076 18933 1080 1 2 . 1 1 83 83 GLU H H 83 8.296 8.296 8.586 -0.290 18933 1081 1 2 . 1 1 84 84 ARG N N 84 113.818 113.818 120.448 -6.630 18933 1082 1 2 . 1 1 84 84 ARG C C 84 175.877 175.877 175.258 0.619 18933 1083 1 2 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.055 -1.324 18933 1084 1 2 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.128 2.167 18933 1085 1 2 . 1 1 84 84 ARG H H 84 8.342 8.342 7.932 0.410 18933 1086 1 2 . 1 1 85 85 LYS N N 85 119.354 119.354 120.390 -1.036 18933 1087 1 2 . 1 1 85 85 LYS C C 85 174.516 174.516 174.208 0.308 18933 1088 1 2 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.261 -0.521 18933 1089 1 2 . 1 1 85 85 LYS CB C 85 34.844 34.844 35.031 -0.187 18933 1090 1 2 . 1 1 85 85 LYS H H 85 6.822 6.822 7.661 -0.839 18933 1091 1 2 . 1 1 86 86 CYS N N 86 125.928 125.928 125.455 0.473 18933 1092 1 2 . 1 1 86 86 CYS C C 86 171.600 171.600 172.593 -0.993 18933 1093 1 2 . 1 1 86 86 CYS CA C 86 55.627 55.627 56.805 -1.178 18933 1094 1 2 . 1 1 86 86 CYS CB C 86 30.344 30.344 29.977 0.367 18933 1095 1 2 . 1 1 86 86 CYS H H 86 9.084 9.084 9.194 -0.110 18933 1096 1 2 . 1 1 87 87 VAL N N 87 126.612 126.612 128.670 -2.058 18933 1097 1 2 . 1 1 87 87 VAL C C 87 174.431 174.431 174.567 -0.136 18933 1098 1 2 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.145 0.172 18933 1099 1 2 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.081 1.115 18933 1100 1 2 . 1 1 87 87 VAL H H 87 8.705 8.705 8.922 -0.217 18933 1101 1 2 . 1 1 88 88 LEU N N 88 127.748 127.748 122.910 4.838 18933 1102 1 2 . 1 1 88 88 LEU C C 88 175.227 175.227 174.551 0.676 18933 1103 1 2 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.877 -0.357 18933 1104 1 2 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.203 -1.598 18933 1105 1 2 . 1 1 88 88 LEU H H 88 9.417 9.417 8.583 0.834 18933 1106 1 2 . 1 1 89 89 PHE N N 89 120.981 120.981 118.564 2.417 18933 1107 1 2 . 1 1 89 89 PHE C C 89 176.906 176.906 176.097 0.809 18933 1108 1 2 . 1 1 89 89 PHE CA C 89 55.587 55.587 56.085 -0.498 18933 1109 1 2 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.714 -2.813 18933 1110 1 2 . 1 1 89 89 PHE H H 89 8.937 8.937 8.461 0.476 18933 1111 1 2 . 1 1 90 90 ILE N N 90 119.928 119.928 118.257 1.671 18933 1112 1 2 . 1 1 90 90 ILE C C 90 173.781 173.781 174.880 -1.099 18933 1113 1 2 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.802 -1.148 18933 1114 1 2 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.767 0.845 18933 1115 1 2 . 1 1 90 90 ILE H H 90 9.230 9.230 9.096 0.134 18933 1116 1 2 . 1 1 91 91 GLU N N 91 124.339 124.339 124.715 -0.376 18933 1117 1 2 . 1 1 91 91 GLU C C 91 175.607 175.607 175.349 0.258 18933 1118 1 2 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.523 0.096 18933 1119 1 2 . 1 1 91 91 GLU CB C 91 29.837 29.837 33.175 -3.338 18933 1120 1 2 . 1 1 91 91 GLU H H 91 8.175 8.175 9.076 -0.901 18933 1121 1 2 . 1 1 92 92 TRP N N 92 127.516 127.516 125.304 2.212 18933 1122 1 2 . 1 1 92 92 TRP C C 92 175.203 175.203 175.527 -0.324 18933 1123 1 2 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.419 1.814 18933 1124 1 2 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.879 0.782 18933 1125 1 2 . 1 1 92 92 TRP H H 92 9.306 9.306 8.605 0.701 18933 1126 1 2 . 1 1 93 93 GLU N N 93 127.834 127.834 124.010 3.824 18933 1127 1 2 . 1 1 93 93 GLU C C 93 175.668 175.668 176.787 -1.119 18933 1128 1 2 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.305 -0.427 18933 1129 1 2 . 1 1 93 93 GLU CB C 93 26.034 26.034 29.471 -3.437 18933 1130 1 2 . 1 1 93 93 GLU H H 93 8.796 8.796 9.007 -0.211 18933 1131 1 2 . 1 1 94 94 LYS N N 94 108.931 108.931 113.043 -4.112 18933 1132 1 2 . 1 1 94 94 LYS C C 94 175.423 175.423 175.550 -0.127 18933 1133 1 2 . 1 1 94 94 LYS CA C 94 57.443 57.443 58.001 -0.558 18933 1134 1 2 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.656 -3.023 18933 1135 1 2 . 1 1 94 94 LYS H H 94 8.498 8.498 8.644 -0.146 18933 1136 1 2 . 1 1 95 95 LYS N N 95 121.737 121.737 120.238 1.499 18933 1137 1 2 . 1 1 95 95 LYS C C 95 174.443 174.443 174.890 -0.447 18933 1138 1 2 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.375 -1.958 18933 1139 1 2 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.003 0.461 18933 1140 1 2 . 1 1 95 95 LYS H H 95 7.761 7.761 7.497 0.264 18933 1141 1 2 . 1 1 96 96 THR N N 96 116.067 116.067 116.684 -0.617 18933 1142 1 2 . 1 1 96 96 THR C C 96 174.296 174.296 173.752 0.544 18933 1143 1 2 . 1 1 96 96 THR CA C 96 61.115 61.115 60.977 0.138 18933 1144 1 2 . 1 1 96 96 THR CB C 96 69.450 69.450 71.347 -1.897 18933 1145 1 2 . 1 1 96 96 THR H H 96 7.761 7.761 8.151 -0.390 18933 1146 1 2 . 1 1 97 97 TYR N N 97 124.229 124.229 124.412 -0.183 18933 1147 1 2 . 1 1 97 97 TYR C C 97 173.536 173.536 175.057 -1.521 18933 1148 1 2 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.303 -0.353 18933 1149 1 2 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.072 -0.890 18933 1150 1 2 . 1 1 97 97 TYR H H 97 9.018 9.018 9.150 -0.132 18933 1151 1 2 . 1 1 98 98 GLN N N 98 123.435 123.435 122.403 1.032 18933 1152 1 2 . 1 1 98 98 GLN C C 98 173.266 173.266 174.553 -1.287 18933 1153 1 2 . 1 1 98 98 GLN CA C 98 55.143 55.143 56.305 -1.162 18933 1154 1 2 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.157 -0.144 18933 1155 1 2 . 1 1 98 98 GLN H H 98 8.781 8.781 9.070 -0.289 18933 1156 1 2 . 1 1 99 99 LEU N N 99 130.119 130.119 127.608 2.511 18933 1157 1 2 . 1 1 99 99 LEU C C 99 173.867 173.867 174.299 -0.432 18933 1158 1 2 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.464 -0.944 18933 1159 1 2 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.626 -1.021 18933 1160 1 2 . 1 1 99 99 LEU H H 99 9.104 9.104 8.762 0.342 18933 1161 1 2 . 1 1 100 100 ASP N N 100 125.182 125.182 127.304 -2.122 18933 1162 1 2 . 1 1 100 100 ASP C C 100 172.837 172.837 174.480 -1.643 18933 1163 1 2 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.606 -1.853 18933 1164 1 2 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.107 -3.763 18933 1165 1 2 . 1 1 100 100 ASP H H 100 9.089 9.089 8.833 0.256 18933 1166 1 2 . 1 1 101 101 LEU N N 101 121.174 121.174 127.220 -6.046 18933 1167 1 2 . 1 1 101 101 LEU C C 101 174.529 174.529 174.810 -0.281 18933 1168 1 2 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.662 -1.747 18933 1169 1 2 . 1 1 101 101 LEU CB C 101 43.908 43.908 46.153 -2.244 18933 1170 1 2 . 1 1 101 101 LEU H H 101 8.458 8.458 9.167 -0.709 18933 1171 1 2 . 1 1 102 102 PHE N N 102 119.464 119.464 124.289 -4.825 18933 1172 1 2 . 1 1 102 102 PHE C C 102 176.293 176.293 174.447 1.846 18933 1173 1 2 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.757 -1.703 18933 1174 1 2 . 1 1 102 102 PHE CB C 102 41.880 41.880 43.051 -1.171 18933 1175 1 2 . 1 1 102 102 PHE H H 102 8.281 8.281 9.175 -0.894 18933 1176 1 2 . 1 1 103 103 THR N N 103 108.576 108.576 118.363 -9.787 18933 1177 1 2 . 1 1 103 103 THR C C 103 174.933 174.933 173.144 1.789 18933 1178 1 2 . 1 1 103 103 THR CA C 103 57.726 57.726 60.246 -2.520 18933 1179 1 2 . 1 1 103 103 THR CB C 103 71.288 71.288 69.263 2.025 18933 1180 1 2 . 1 1 103 103 THR H H 103 7.872 7.872 8.204 -0.332 18933 1181 1 2 . 1 1 104 104 ALA N N 104 122.885 122.885 129.137 -6.252 18933 1182 1 2 . 1 1 104 104 ALA C C 104 175.754 175.754 174.901 0.853 18933 1183 1 2 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.856 0.162 18933 1184 1 2 . 1 1 104 104 ALA CB C 104 22.485 22.485 23.081 -0.596 18933 1185 1 2 . 1 1 104 104 ALA H H 104 8.660 8.660 9.216 -0.556 18933 1186 1 2 . 1 1 105 105 LEU N N 105 120.881 120.881 119.898 0.983 18933 1187 1 2 . 1 1 105 105 LEU C C 105 179.504 179.504 177.611 1.893 18933 1188 1 2 . 1 1 105 105 LEU CA C 105 53.247 53.247 53.902 -0.655 18933 1189 1 2 . 1 1 105 105 LEU CB C 105 41.753 41.753 44.109 -2.356 18933 1190 1 2 . 1 1 105 105 LEU H H 105 8.226 8.226 9.020 -0.794 18933 1191 1 2 . 1 1 106 106 ALA N N 106 124.901 124.901 123.307 1.594 18933 1192 1 2 . 1 1 106 106 ALA C C 106 181.269 181.269 179.180 2.089 18933 1193 1 2 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.778 1.535 18933 1194 1 2 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.942 -1.718 18933 1195 1 2 . 1 1 106 106 ALA H H 106 8.392 8.392 8.366 0.026 18933 1196 1 2 . 1 1 107 107 GLU N N 107 116.409 116.409 118.886 -2.477 18933 1197 1 2 . 1 1 107 107 GLU C C 107 177.764 177.764 177.409 0.355 18933 1198 1 2 . 1 1 107 107 GLU CA C 107 58.533 58.533 58.529 0.004 18933 1199 1 2 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.675 -1.739 18933 1200 1 2 . 1 1 107 107 GLU H H 107 9.664 9.664 8.780 0.884 18933 1201 1 2 . 1 1 108 108 GLU N N 108 116.189 116.189 116.701 -0.512 18933 1202 1 2 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.998 -1.855 18933 1203 1 2 . 1 1 108 108 GLU CB C 108 29.837 29.837 28.620 1.217 18933 1204 1 2 . 1 1 108 108 GLU H H 108 7.589 7.589 8.547 -0.958 18933 1205 1 2 . 1 1 109 109 LYS N N 109 119.928 119.928 121.664 -1.736 18933 1206 1 2 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.289 1.562 18933 1207 1 2 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.437 0.034 18933 1208 1 2 . 1 1 109 109 LYS H H 109 7.514 7.514 7.569 -0.055 18933 1209 1 2 . 1 1 111 111 TYR N N 111 114.930 114.930 118.941 -4.011 18933 1210 1 2 . 1 1 111 111 TYR C C 111 179.504 179.504 177.804 1.700 18933 1211 1 2 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.233 -2.216 18933 1212 1 2 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.519 -1.851 18933 1213 1 2 . 1 1 111 111 TYR H H 111 6.393 6.393 8.475 -2.082 18933 1214 1 2 . 1 1 112 112 ALA N N 112 124.901 124.901 122.585 2.316 18933 1215 1 2 . 1 1 112 112 ALA C C 112 179.173 179.173 179.327 -0.154 18933 1216 1 2 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.545 -0.644 18933 1217 1 2 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.307 -0.195 18933 1218 1 2 . 1 1 112 112 ALA H H 112 8.554 8.554 8.464 0.090 18933 1219 1 2 . 1 1 113 113 ILE N N 113 119.464 119.464 119.667 -0.203 18933 1220 1 2 . 1 1 113 113 ILE C C 113 178.499 178.499 177.773 0.726 18933 1221 1 2 . 1 1 113 113 ILE CA C 113 66.281 66.281 64.029 2.252 18933 1222 1 2 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.885 -0.568 18933 1223 1 2 . 1 1 113 113 ILE H H 113 8.680 8.680 7.650 1.030 18933 1224 1 2 . 1 1 114 114 PHE N N 114 122.922 122.922 121.170 1.752 18933 1225 1 2 . 1 1 114 114 PHE C C 114 178.217 178.217 177.670 0.547 18933 1226 1 2 . 1 1 114 114 PHE CA C 114 61.559 61.559 61.797 -0.238 18933 1227 1 2 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.703 0.768 18933 1228 1 2 . 1 1 114 114 PHE H H 114 7.721 7.721 8.451 -0.730 18933 1229 1 2 . 1 1 115 115 HIS N N 115 118.560 118.560 118.023 0.537 18933 1230 1 2 . 1 1 115 115 HIS C C 115 177.286 177.286 176.402 0.884 18933 1231 1 2 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.317 0.063 18933 1232 1 2 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.239 1.626 18933 1233 1 2 . 1 1 115 115 HIS H H 115 8.155 8.155 8.283 -0.128 18933 1234 1 2 . 1 1 116 116 PHE N N 116 111.472 111.472 116.688 -5.216 18933 1235 1 2 . 1 1 116 116 PHE C C 116 179.026 179.026 177.002 2.024 18933 1236 1 2 . 1 1 116 116 PHE CA C 116 59.461 59.461 60.084 -0.623 18933 1237 1 2 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.940 -1.751 18933 1238 1 2 . 1 1 116 116 PHE H H 116 8.564 8.564 7.868 0.696 18933 1239 1 2 . 1 1 117 117 THR N N 117 119.012 119.012 112.306 6.706 18933 1240 1 2 . 1 1 117 117 THR C C 117 172.935 172.935 175.040 -2.105 18933 1241 1 2 . 1 1 117 117 THR CA C 117 67.088 67.088 64.894 2.193 18933 1242 1 2 . 1 1 117 117 THR CB C 117 37.126 37.126 68.923 -31.797 18933 1243 1 2 . 1 1 117 117 THR H H 117 7.620 7.620 8.051 -0.431 18933 1244 1 2 . 1 1 118 118 GLY N N 118 107.917 107.917 109.166 -1.249 18933 1245 1 2 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.180 1.987 18933 1246 1 2 . 1 1 118 118 GLY H H 118 6.666 6.666 7.399 -0.733 18933 1247 1 2 . 1 1 121 121 SER N N 121 113.354 113.354 118.355 -5.001 18933 1248 1 2 . 1 1 121 121 SER C C 121 176.061 176.061 175.980 0.081 18933 1249 1 2 . 1 1 121 121 SER CA C 121 61.035 61.035 62.375 -1.340 18933 1250 1 2 . 1 1 121 121 SER H H 121 8.322 8.322 8.246 0.076 18933 1251 1 2 . 1 1 122 122 TYR N N 122 124.681 124.681 121.514 3.167 18933 1252 1 2 . 1 1 122 122 TYR C C 122 176.293 176.293 177.094 -0.801 18933 1253 1 2 . 1 1 122 122 TYR CA C 122 59.057 59.057 61.157 -2.099 18933 1254 1 2 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.381 0.330 18933 1255 1 2 . 1 1 122 122 TYR H H 122 6.514 6.514 8.387 -1.873 18933 1256 1 2 . 1 1 123 123 LEU N N 123 117.997 117.997 120.030 -2.033 18933 1257 1 2 . 1 1 123 123 LEU C C 123 179.774 179.774 178.892 0.882 18933 1258 1 2 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.909 -0.031 18933 1259 1 2 . 1 1 123 123 LEU CB C 123 39.978 39.978 41.092 -1.114 18933 1260 1 2 . 1 1 123 123 LEU H H 123 7.428 7.428 7.364 0.064 18933 1261 1 2 . 1 1 124 124 ILE N N 124 119.012 119.012 120.810 -1.798 18933 1262 1 2 . 1 1 124 124 ILE C C 124 178.830 178.830 178.136 0.694 18933 1263 1 2 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.282 -0.132 18933 1264 1 2 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.215 -0.152 18933 1265 1 2 . 1 1 124 124 ILE H H 124 8.453 8.453 8.477 -0.024 18933 1266 1 2 . 1 1 125 125 ARG N N 125 121.174 121.174 119.178 1.996 18933 1267 1 2 . 1 1 125 125 ARG C C 125 179.762 179.762 178.920 0.842 18933 1268 1 2 . 1 1 125 125 ARG CA C 125 59.057 59.057 57.934 1.123 18933 1269 1 2 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.271 -0.321 18933 1270 1 2 . 1 1 125 125 ARG H H 125 7.004 7.004 8.054 -1.050 18933 1271 1 2 . 1 1 126 126 ILE N N 126 122.299 122.299 120.498 1.801 18933 1272 1 2 . 1 1 126 126 ILE C C 126 178.352 178.352 177.683 0.669 18933 1273 1 2 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.791 -2.586 18933 1274 1 2 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.135 -1.720 18933 1275 1 2 . 1 1 126 126 ILE H H 126 7.579 7.579 7.983 -0.404 18933 1276 1 2 . 1 1 127 127 ARG N N 127 119.354 119.354 120.181 -0.827 18933 1277 1 2 . 1 1 127 127 ARG C C 127 179.786 179.786 178.687 1.099 18933 1278 1 2 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.612 0.374 18933 1279 1 2 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.097 -0.767 18933 1280 1 2 . 1 1 127 127 ARG H H 127 8.715 8.715 8.148 0.567 18933 1281 1 2 . 1 1 128 128 ALA N N 128 122.873 122.873 120.743 2.130 18933 1282 1 2 . 1 1 128 128 ALA C C 128 180.325 180.325 179.369 0.956 18933 1283 1 2 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.606 0.134 18933 1284 1 2 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.294 -1.133 18933 1285 1 2 . 1 1 128 128 ALA H H 128 7.978 7.978 8.127 -0.149 18933 1286 1 2 . 1 1 129 129 ALA N N 129 121.846 121.846 121.697 0.149 18933 1287 1 2 . 1 1 129 129 ALA C C 129 181.539 181.539 179.855 1.684 18933 1288 1 2 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.737 -0.239 18933 1289 1 2 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.677 -1.199 18933 1290 1 2 . 1 1 129 129 ALA H H 129 7.519 7.519 8.160 -0.641 18933 1291 1 2 . 1 1 130 130 LEU N N 130 119.134 119.134 118.278 0.856 18933 1292 1 2 . 1 1 130 130 LEU C C 130 179.909 179.909 178.936 0.973 18933 1293 1 2 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.030 -0.031 18933 1294 1 2 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.675 -1.253 18933 1295 1 2 . 1 1 130 130 LEU H H 130 8.296 8.296 8.649 -0.353 18933 1296 1 2 . 1 1 131 131 LYS N N 131 122.299 122.299 120.585 1.714 18933 1297 1 2 . 1 1 131 131 LYS C C 131 180.289 180.289 179.496 0.793 18933 1298 1 2 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.932 -0.916 18933 1299 1 2 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.125 -0.893 18933 1300 1 2 . 1 1 131 131 LYS H H 131 8.281 8.281 7.760 0.521 18933 1301 1 2 . 1 1 132 132 LYS N N 132 118.743 118.743 118.338 0.405 18933 1302 1 2 . 1 1 132 132 LYS C C 132 177.482 177.482 177.731 -0.249 18933 1303 1 2 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.393 0.099 18933 1304 1 2 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.128 -0.896 18933 1305 1 2 . 1 1 132 132 LYS H H 132 7.317 7.317 7.780 -0.463 18933 1306 1 2 . 1 1 133 133 LYS N N 133 117.093 117.093 117.287 -0.194 18933 1307 1 2 . 1 1 133 133 LYS C C 133 174.614 174.614 176.067 -1.453 18933 1308 1 2 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.931 -1.151 18933 1309 1 2 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.732 -0.550 18933 1310 1 2 . 1 1 133 133 LYS H H 133 7.327 7.327 7.575 -0.248 18933 1311 1 2 . 1 1 134 134 ASN N N 134 113.012 113.012 115.110 -2.098 18933 1312 1 2 . 1 1 134 134 ASN C C 134 173.965 173.965 173.319 0.646 18933 1313 1 2 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.038 0.258 18933 1314 1 2 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.748 -1.573 18933 1315 1 2 . 1 1 134 134 ASN H H 134 7.938 7.938 7.886 0.052 18933 1316 1 2 . 1 1 135 135 TYR N N 135 115.725 115.725 118.716 -2.991 18933 1317 1 2 . 1 1 135 135 TYR C C 135 176.342 176.342 174.935 1.407 18933 1318 1 2 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.364 -1.696 18933 1319 1 2 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.467 1.096 18933 1320 1 2 . 1 1 135 135 TYR H H 135 7.741 7.741 8.455 -0.714 18933 1321 1 2 . 1 1 136 136 LYS N N 136 122.641 122.641 124.817 -2.176 18933 1322 1 2 . 1 1 136 136 LYS C C 136 173.475 173.475 174.504 -1.029 18933 1323 1 2 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.642 0.259 18933 1324 1 2 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.375 -1.657 18933 1325 1 2 . 1 1 136 136 LYS H H 136 9.296 9.296 8.700 0.596 18933 1326 1 2 . 1 1 137 137 LEU N N 137 127.284 127.284 122.847 4.437 18933 1327 1 2 . 1 1 137 137 LEU C C 137 175.423 175.423 175.351 0.072 18933 1328 1 2 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.242 -0.116 18933 1329 1 2 . 1 1 137 137 LEU CB C 137 45.746 45.746 43.020 2.726 18933 1330 1 2 . 1 1 137 137 LEU H H 137 8.776 8.776 8.528 0.248 18933 1331 1 2 . 1 1 138 138 ASN N N 138 125.818 125.818 118.902 6.916 18933 1332 1 2 . 1 1 138 138 ASN C C 138 174.933 174.933 175.563 -0.630 18933 1333 1 2 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.240 -0.123 18933 1334 1 2 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.245 -4.739 18933 1335 1 2 . 1 1 138 138 ASN H H 138 8.811 8.811 8.076 0.735 18933 1336 1 2 . 1 1 139 139 GLN N N 139 116.861 116.861 119.671 -2.810 18933 1337 1 2 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.593 -1.755 18933 1338 1 2 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.664 -2.947 18933 1339 1 2 . 1 1 139 139 GLN H H 139 9.220 9.220 8.894 0.326 18933 1340 1 2 . 1 1 140 140 TYR N N 140 120.600 120.600 119.626 0.974 18933 1341 1 2 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.375 -0.618 18933 1342 1 2 . 1 1 140 140 TYR CB C 140 37.570 37.570 37.880 -0.311 18933 1343 1 2 . 1 1 140 140 TYR H H 140 8.549 8.549 7.750 0.799 18933 1344 1 2 . 1 1 141 141 GLY N N 141 105.986 105.986 108.283 -2.297 18933 1345 1 2 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.398 -0.554 18933 1346 1 2 . 1 1 141 141 GLY H H 141 7.186 7.186 7.846 -0.660 18933 1347 1 2 . 1 1 142 142 LEU N N 142 120.038 120.038 116.632 3.406 18933 1348 1 2 . 1 1 142 142 LEU C C 142 173.340 173.340 175.756 -2.416 18933 1349 1 2 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.091 -0.571 18933 1350 1 2 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.535 0.816 18933 1351 1 2 . 1 1 142 142 LEU H H 142 7.539 7.539 8.486 -0.947 18933 1352 1 2 . 1 1 143 143 PHE N N 143 124.229 124.229 118.723 5.506 18933 1353 1 2 . 1 1 143 143 PHE C C 143 173.977 173.977 175.026 -1.049 18933 1354 1 2 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.289 -2.648 18933 1355 1 2 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.559 4.109 18933 1356 1 2 . 1 1 143 143 PHE H H 143 9.084 9.084 8.991 0.093 18933 1357 1 2 . 1 1 144 144 LYS N N 144 127.858 127.858 123.142 4.716 18933 1358 1 2 . 1 1 144 144 LYS C C 144 175.092 175.092 176.894 -1.802 18933 1359 1 2 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.228 4.628 18933 1360 1 2 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.713 3.871 18933 1361 1 2 . 1 1 144 144 LYS H H 144 9.281 9.281 8.869 0.412 18933 1362 1 2 . 1 1 145 145 ASN N N 145 128.188 128.188 126.477 1.711 18933 1363 1 2 . 1 1 145 145 ASN C C 145 175.779 175.779 174.821 0.958 18933 1364 1 2 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.475 3.251 18933 1365 1 2 . 1 1 145 145 ASN CB C 145 34.654 34.654 38.194 -3.540 18933 1366 1 2 . 1 1 145 145 ASN H H 145 9.205 9.205 8.988 0.217 18933 1367 1 2 . 1 1 146 146 GLN N N 146 129.655 129.655 110.048 19.607 18933 1368 1 2 . 1 1 146 146 GLN C C 146 175.399 175.399 174.895 0.504 18933 1369 1 2 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.407 1.408 18933 1370 1 2 . 1 1 146 146 GLN CB C 146 32.626 32.626 27.018 5.608 18933 1371 1 2 . 1 1 146 146 GLN H H 146 8.983 8.983 8.869 0.114 18933 1372 1 2 . 1 1 147 147 THR N N 147 117.936 117.936 115.580 2.356 18933 1373 1 2 . 1 1 147 147 THR C C 147 173.254 173.254 173.459 -0.205 18933 1374 1 2 . 1 1 147 147 THR CA C 147 61.721 61.721 61.739 -0.018 18933 1375 1 2 . 1 1 147 147 THR CB C 147 70.274 70.274 69.544 0.730 18933 1376 1 2 . 1 1 147 147 THR H H 147 8.029 8.029 7.931 0.098 18933 1377 1 2 . 1 1 148 148 LEU N N 148 130.681 130.681 130.935 -0.254 18933 1378 1 2 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.288 0.179 18933 1379 1 2 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.806 -1.117 18933 1380 1 2 . 1 1 148 148 LEU H H 148 8.635 8.635 8.866 -0.231 18933 1381 1 2 . 1 1 149 149 VAL N N 149 130.803 130.803 128.587 2.216 18933 1382 1 2 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.094 1.084 18933 1383 1 2 . 1 1 149 149 VAL CB C 149 31.675 31.675 35.527 -3.852 18933 1384 1 2 . 1 1 149 149 VAL H H 149 8.968 8.968 9.299 -0.331 18933 1385 1 2 . 1 1 151 151 LEU N N 151 124.290 124.290 120.265 4.025 18933 1386 1 2 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.505 -2.492 18933 1387 1 2 . 1 1 151 151 LEU CB C 151 44.098 44.098 40.909 3.189 18933 1388 1 2 . 1 1 151 151 LEU H H 151 7.872 7.872 8.196 -0.324 18933 1389 1 2 . 1 1 153 153 ILE N N 153 114.943 114.943 113.816 1.127 18933 1390 1 2 . 1 1 153 153 ILE C C 153 175.877 175.877 175.276 0.601 18933 1391 1 2 . 1 1 153 153 ILE CA C 153 58.694 58.694 59.111 -0.417 18933 1392 1 2 . 1 1 153 153 ILE CB C 153 41.689 41.689 39.875 1.814 18933 1393 1 2 . 1 1 153 153 ILE H H 153 7.125 7.125 7.614 -0.489 18933 1394 1 2 . 1 1 154 154 THR N N 154 111.766 111.766 109.186 2.580 18933 1395 1 2 . 1 1 154 154 THR C C 154 174.945 174.945 174.157 0.788 18933 1396 1 2 . 1 1 154 154 THR CA C 154 62.124 62.124 62.435 -0.311 18933 1397 1 2 . 1 1 154 154 THR CB C 154 70.718 70.718 69.913 0.805 18933 1398 1 2 . 1 1 154 154 THR H H 154 9.286 9.286 8.356 0.930 18933 1399 1 2 . 1 1 155 155 THR N N 155 111.766 111.766 112.218 -0.452 18933 1400 1 2 . 1 1 155 155 THR CA C 155 58.936 58.936 59.692 -0.756 18933 1401 1 2 . 1 1 155 155 THR CB C 155 72.683 72.683 71.713 0.970 18933 1402 1 2 . 1 1 155 155 THR H H 155 7.645 7.645 7.424 0.221 18933 1403 1 2 . 1 1 157 157 LYS N N 157 119.464 119.464 118.806 0.658 18933 1404 1 2 . 1 1 157 157 LYS C C 157 178.781 178.781 178.237 0.544 18933 1405 1 2 . 1 1 157 157 LYS CA C 157 60.026 60.026 60.150 -0.124 18933 1406 1 2 . 1 1 157 157 LYS CB C 157 31.422 31.422 32.009 -0.587 18933 1407 1 2 . 1 1 157 157 LYS H H 157 8.175 8.175 8.495 -0.320 18933 1408 1 2 . 1 1 158 158 GLU N N 158 118.340 118.340 118.203 0.137 18933 1409 1 2 . 1 1 158 158 GLU C C 158 178.867 178.867 179.190 -0.323 18933 1410 1 2 . 1 1 158 158 GLU CA C 158 58.492 58.492 58.964 -0.472 18933 1411 1 2 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.983 0.347 18933 1412 1 2 . 1 1 158 158 GLU H H 158 7.519 7.519 8.129 -0.610 18933 1413 1 2 . 1 1 159 159 LEU N N 159 120.710 120.710 120.353 0.357 18933 1414 1 2 . 1 1 159 159 LEU C C 159 176.526 176.526 178.639 -2.113 18933 1415 1 2 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.392 -0.222 18933 1416 1 2 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.349 -1.434 18933 1417 1 2 . 1 1 159 159 LEU H H 159 7.524 7.524 7.971 -0.447 18933 1418 1 2 . 1 1 160 160 ILE N N 160 118.217 118.217 118.959 -0.742 18933 1419 1 2 . 1 1 160 160 ILE C C 160 177.213 177.213 178.007 -0.794 18933 1420 1 2 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.416 -0.386 18933 1421 1 2 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.104 0.402 18933 1422 1 2 . 1 1 160 160 ILE H H 160 7.741 7.741 8.389 -0.647 18933 1423 1 2 . 1 1 161 161 LYS N N 161 118.450 118.450 121.116 -2.666 18933 1424 1 2 . 1 1 161 161 LYS C C 161 180.999 180.999 179.578 1.421 18933 1425 1 2 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.645 -0.830 18933 1426 1 2 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.181 -1.203 18933 1427 1 2 . 1 1 161 161 LYS H H 161 7.382 7.382 8.252 -0.870 18933 1428 1 2 . 1 1 162 162 GLU N N 162 121.846 121.846 119.847 1.999 18933 1429 1 2 . 1 1 162 162 GLU C C 162 178.818 178.818 178.134 0.684 18933 1430 1 2 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.263 -0.214 18933 1431 1 2 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.361 -1.425 18933 1432 1 2 . 1 1 162 162 GLU H H 162 8.210 8.210 7.881 0.329 18933 1433 1 2 . 1 1 163 163 LEU N N 163 116.751 116.751 115.502 1.249 18933 1434 1 2 . 1 1 163 163 LEU C C 163 176.784 176.784 177.391 -0.607 18933 1435 1 2 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.030 -0.008 18933 1436 1 2 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.961 -0.652 18933 1437 1 2 . 1 1 163 163 LEU H H 163 7.796 7.796 7.476 0.320 18933 1438 1 2 . 1 1 164 164 GLY N N 164 104.849 104.849 105.740 -0.891 18933 1439 1 2 . 1 1 164 164 GLY C C 164 174.492 174.492 173.895 0.597 18933 1440 1 2 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.476 -0.744 18933 1441 1 2 . 1 1 164 164 GLY H H 164 7.589 7.589 7.454 0.135 18933 1442 1 2 . 1 1 165 165 PHE N N 165 118.902 118.902 118.778 0.124 18933 1443 1 2 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.489 -0.821 18933 1444 1 2 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.676 -2.191 18933 1445 1 2 . 1 1 165 165 PHE H H 165 7.251 7.251 7.927 -0.676 18933 1446 1 2 . 1 1 166 166 THR N N 166 117.093 117.093 116.981 0.112 18933 1447 1 2 . 1 1 166 166 THR CA C 166 62.245 62.245 60.883 1.361 18933 1448 1 2 . 1 1 166 166 THR CB C 166 69.323 69.323 69.322 0.001 18933 1449 1 2 . 1 1 166 166 THR H H 166 8.407 8.407 8.136 0.271 18933 1450 1 2 . 1 1 168 168 ARG N N 168 127.431 127.431 122.427 5.004 18933 1451 1 2 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.344 -2.106 18933 1452 1 2 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.538 -1.546 18933 1453 1 2 . 1 1 168 168 ARG H H 168 7.160 7.160 8.314 -1.154 18933 1454 1 2 . 1 1 171 171 LYS N N 171 113.574 113.574 117.293 -3.719 18933 1455 1 2 . 1 1 171 171 LYS C C 171 176.416 176.416 177.684 -1.268 18933 1456 1 2 . 1 1 171 171 LYS CA C 171 57.605 57.605 58.329 -0.724 18933 1457 1 2 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.266 0.663 18933 1458 1 2 . 1 1 171 171 LYS H H 171 8.210 8.210 8.256 -0.046 18933 1459 1 2 . 1 1 172 172 LYS N N 172 117.313 117.313 118.949 -1.636 18933 1460 1 2 . 1 1 172 172 LYS C C 172 175.717 175.717 175.636 0.081 18933 1461 1 2 . 1 1 172 172 LYS CA C 172 54.175 54.175 55.879 -1.704 18933 1462 1 2 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.701 -1.089 18933 1463 1 2 . 1 1 172 172 LYS H H 172 7.761 7.761 7.412 0.349 18933 1464 1 2 . 1 1 173 173 ARG N N 173 122.056 122.056 116.835 5.221 18933 1465 1 2 . 1 1 173 173 ARG C C 173 172.850 172.850 175.537 -2.687 18933 1466 1 2 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.249 0.628 18933 1467 1 2 . 1 1 173 173 ARG CB C 173 28.506 28.506 27.707 0.799 18933 1468 1 2 . 1 1 173 173 ARG H H 173 6.885 6.885 7.424 -0.539 18933 1469 1 3 . 1 1 2 2 LEU N N 2 122.812 122.812 120.640 2.172 18933 1470 1 3 . 1 1 2 2 LEU C C 2 175.742 175.742 175.677 0.065 18933 1471 1 3 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.949 0.185 18933 1472 1 3 . 1 1 2 2 LEU CB C 2 42.842 42.842 44.430 -1.588 18933 1473 1 3 . 1 1 2 2 LEU H H 2 8.756 8.756 7.905 0.851 18933 1474 1 3 . 1 1 3 3 THR N N 3 113.000 113.000 115.479 -2.479 18933 1475 1 3 . 1 1 3 3 THR C C 3 175.938 175.938 175.275 0.663 18933 1476 1 3 . 1 1 3 3 THR CA C 3 60.550 60.550 60.880 -0.330 18933 1477 1 3 . 1 1 3 3 THR CB C 3 70.781 70.781 70.287 0.494 18933 1478 1 3 . 1 1 3 3 THR H H 3 8.428 8.428 8.239 0.189 18933 1479 1 3 . 1 1 4 4 LEU N N 4 122.531 122.531 123.622 -1.091 18933 1480 1 3 . 1 1 4 4 LEU C C 4 178.463 178.463 178.532 -0.069 18933 1481 1 3 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.651 -0.522 18933 1482 1 3 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.043 -2.509 18933 1483 1 3 . 1 1 4 4 LEU H H 4 7.731 7.731 7.900 -0.169 18933 1484 1 3 . 1 1 5 5 ILE N N 5 115.505 115.505 117.066 -1.561 18933 1485 1 3 . 1 1 5 5 ILE C C 5 178.573 178.573 177.696 0.877 18933 1486 1 3 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.985 -1.247 18933 1487 1 3 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.386 -0.514 18933 1488 1 3 . 1 1 5 5 ILE H H 5 7.645 7.645 8.194 -0.549 18933 1489 1 3 . 1 1 6 6 GLN N N 6 121.626 121.626 119.281 2.345 18933 1490 1 3 . 1 1 6 6 GLN C C 6 179.014 179.014 178.760 0.254 18933 1491 1 3 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.012 -0.681 18933 1492 1 3 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.517 0.672 18933 1493 1 3 . 1 1 6 6 GLN H H 6 7.645 7.645 8.019 -0.374 18933 1494 1 3 . 1 1 7 7 GLY N N 7 107.684 107.684 106.980 0.704 18933 1495 1 3 . 1 1 7 7 GLY C C 7 174.749 174.749 176.157 -1.408 18933 1496 1 3 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.753 0.037 18933 1497 1 3 . 1 1 7 7 GLY H H 7 8.660 8.660 8.102 0.558 18933 1498 1 3 . 1 1 8 8 LYS N N 8 120.942 120.942 122.693 -1.751 18933 1499 1 3 . 1 1 8 8 LYS C C 8 179.455 179.455 178.618 0.837 18933 1500 1 3 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.243 0.662 18933 1501 1 3 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.224 -0.802 18933 1502 1 3 . 1 1 8 8 LYS H H 8 8.518 8.518 7.725 0.793 18933 1503 1 3 . 1 1 9 9 LYS N N 9 120.710 120.710 119.202 1.508 18933 1504 1 3 . 1 1 9 9 LYS C C 9 179.823 179.823 178.990 0.833 18933 1505 1 3 . 1 1 9 9 LYS CA C 9 59.622 59.622 58.905 0.717 18933 1506 1 3 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.041 -0.746 18933 1507 1 3 . 1 1 9 9 LYS H H 9 7.731 7.731 8.090 -0.359 18933 1508 1 3 . 1 1 10 10 ILE N N 10 121.345 121.345 121.007 0.338 18933 1509 1 3 . 1 1 10 10 ILE C C 10 177.789 177.789 178.056 -0.267 18933 1510 1 3 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.941 -1.476 18933 1511 1 3 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.143 -1.778 18933 1512 1 3 . 1 1 10 10 ILE H H 10 7.711 7.711 8.403 -0.692 18933 1513 1 3 . 1 1 11 11 VAL N N 11 120.258 120.258 120.292 -0.034 18933 1514 1 3 . 1 1 11 11 VAL C C 11 177.372 177.372 178.097 -0.725 18933 1515 1 3 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.017 0.434 18933 1516 1 3 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.102 -0.568 18933 1517 1 3 . 1 1 11 11 VAL H H 11 7.918 7.918 8.548 -0.630 18933 1518 1 3 . 1 1 12 12 ASN N N 12 116.971 116.971 118.267 -1.296 18933 1519 1 3 . 1 1 12 12 ASN C C 12 177.445 177.445 178.180 -0.735 18933 1520 1 3 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.303 -0.191 18933 1521 1 3 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.516 -0.883 18933 1522 1 3 . 1 1 12 12 ASN H H 12 7.993 7.993 8.753 -0.760 18933 1523 1 3 . 1 1 13 13 HIS N N 13 120.258 120.258 119.747 0.511 18933 1524 1 3 . 1 1 13 13 HIS C C 13 177.862 177.862 177.803 0.059 18933 1525 1 3 . 1 1 13 13 HIS CA C 13 59.098 59.098 58.703 0.395 18933 1526 1 3 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.633 0.599 18933 1527 1 3 . 1 1 13 13 HIS H H 13 7.741 7.741 8.455 -0.714 18933 1528 1 3 . 1 1 14 14 LEU N N 14 116.641 116.641 119.500 -2.859 18933 1529 1 3 . 1 1 14 14 LEU C C 14 179.186 179.186 178.309 0.877 18933 1530 1 3 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.341 -1.584 18933 1531 1 3 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.614 -0.495 18933 1532 1 3 . 1 1 14 14 LEU H H 14 8.221 8.221 8.567 -0.346 18933 1533 1 3 . 1 1 15 15 ARG N N 15 115.957 115.957 114.253 1.704 18933 1534 1 3 . 1 1 15 15 ARG C C 15 176.330 176.330 178.147 -1.817 18933 1535 1 3 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.332 1.371 18933 1536 1 3 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.471 -1.394 18933 1537 1 3 . 1 1 15 15 ARG H H 15 7.968 7.968 8.404 -0.436 18933 1538 1 3 . 1 1 16 16 SER N N 16 109.395 109.395 116.071 -6.676 18933 1539 1 3 . 1 1 16 16 SER C C 16 176.024 176.024 175.063 0.961 18933 1540 1 3 . 1 1 16 16 SER CA C 16 57.282 57.282 60.392 -3.110 18933 1541 1 3 . 1 1 16 16 SER CB C 16 63.683 63.683 63.923 -0.240 18933 1542 1 3 . 1 1 16 16 SER H H 16 6.963 6.963 7.539 -0.576 18933 1543 1 3 . 1 1 17 17 ARG N N 17 122.775 122.775 121.838 0.937 18933 1544 1 3 . 1 1 17 17 ARG C C 17 174.590 174.590 173.990 0.600 18933 1545 1 3 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.965 1.308 18933 1546 1 3 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.426 1.376 18933 1547 1 3 . 1 1 17 17 ARG H H 17 7.781 7.781 8.270 -0.489 18933 1548 1 3 . 1 1 18 18 LEU N N 18 122.421 122.421 125.955 -3.534 18933 1549 1 3 . 1 1 18 18 LEU C C 18 176.281 176.281 174.051 2.230 18933 1550 1 3 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.451 0.329 18933 1551 1 3 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.953 -3.741 18933 1552 1 3 . 1 1 18 18 LEU H H 18 8.650 8.650 7.735 0.915 18933 1553 1 3 . 1 1 19 19 ALA N N 19 126.441 126.441 126.821 -0.380 18933 1554 1 3 . 1 1 19 19 ALA C C 19 173.904 173.904 174.862 -0.958 18933 1555 1 3 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.570 -0.704 18933 1556 1 3 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.301 0.564 18933 1557 1 3 . 1 1 19 19 ALA H H 19 8.609 8.609 8.854 -0.245 18933 1558 1 3 . 1 1 20 20 PHE N N 20 114.600 114.600 119.463 -4.863 18933 1559 1 3 . 1 1 20 20 PHE C C 20 172.592 172.592 173.900 -1.308 18933 1560 1 3 . 1 1 20 20 PHE CA C 20 55.789 55.789 55.041 0.749 18933 1561 1 3 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.582 -0.893 18933 1562 1 3 . 1 1 20 20 PHE H H 20 8.801 8.801 9.201 -0.400 18933 1563 1 3 . 1 1 21 21 GLU N N 21 122.873 122.873 124.142 -1.269 18933 1564 1 3 . 1 1 21 21 GLU C C 21 174.872 174.872 175.237 -0.365 18933 1565 1 3 . 1 1 21 21 GLU CA C 21 55.062 55.062 54.969 0.093 18933 1566 1 3 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.180 -0.455 18933 1567 1 3 . 1 1 21 21 GLU H H 21 7.847 7.847 9.117 -1.270 18933 1568 1 3 . 1 1 22 22 TYR N N 22 126.270 126.270 126.703 -0.433 18933 1569 1 3 . 1 1 22 22 TYR C C 22 174.872 174.872 174.728 0.144 18933 1570 1 3 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.779 -1.031 18933 1571 1 3 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.105 -1.000 18933 1572 1 3 . 1 1 22 22 TYR H H 22 8.806 8.806 9.174 -0.368 18933 1573 1 3 . 1 1 23 23 ASN N N 23 128.420 128.420 126.491 1.929 18933 1574 1 3 . 1 1 23 23 ASN C C 23 175.435 175.435 175.140 0.295 18933 1575 1 3 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.651 -0.646 18933 1576 1 3 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.513 -1.148 18933 1577 1 3 . 1 1 23 23 ASN H H 23 8.943 8.943 9.215 -0.272 18933 1578 1 3 . 1 1 24 24 GLY N N 24 104.067 104.067 102.818 1.249 18933 1579 1 3 . 1 1 24 24 GLY C C 24 173.707 173.707 173.631 0.076 18933 1580 1 3 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.945 -0.011 18933 1581 1 3 . 1 1 24 24 GLY H H 24 8.534 8.534 8.244 0.290 18933 1582 1 3 . 1 1 25 25 GLN N N 25 120.038 120.038 119.530 0.508 18933 1583 1 3 . 1 1 25 25 GLN C C 25 173.744 173.744 174.831 -1.087 18933 1584 1 3 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.092 -0.765 18933 1585 1 3 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.416 0.245 18933 1586 1 3 . 1 1 25 25 GLN H H 25 7.595 7.595 7.793 -0.198 18933 1587 1 3 . 1 1 26 26 LEU N N 26 124.681 124.681 125.362 -0.681 18933 1588 1 3 . 1 1 26 26 LEU C C 26 175.987 175.987 175.836 0.151 18933 1589 1 3 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.369 -0.356 18933 1590 1 3 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.454 -1.589 18933 1591 1 3 . 1 1 26 26 LEU H H 26 8.382 8.382 8.739 -0.357 18933 1592 1 3 . 1 1 27 27 ILE N N 27 130.779 130.779 127.137 3.642 18933 1593 1 3 . 1 1 27 27 ILE C C 27 175.215 175.215 174.408 0.807 18933 1594 1 3 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.969 -0.710 18933 1595 1 3 . 1 1 27 27 ILE CB C 27 35.732 35.732 37.749 -2.017 18933 1596 1 3 . 1 1 27 27 ILE H H 27 8.882 8.882 8.921 -0.039 18933 1597 1 3 . 1 1 28 28 LYS N N 28 126.160 126.160 127.830 -1.670 18933 1598 1 3 . 1 1 28 28 LYS C C 28 176.771 176.771 175.649 1.122 18933 1599 1 3 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.677 2.161 18933 1600 1 3 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.118 -1.379 18933 1601 1 3 . 1 1 28 28 LYS H H 28 8.165 8.165 8.356 -0.191 18933 1602 1 3 . 1 1 29 29 ILE N N 29 126.380 126.380 122.586 3.794 18933 1603 1 3 . 1 1 29 29 ILE C C 29 175.877 175.877 174.317 1.560 18933 1604 1 3 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.502 -0.194 18933 1605 1 3 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.603 -2.540 18933 1606 1 3 . 1 1 29 29 ILE H H 29 8.019 8.019 8.725 -0.706 18933 1607 1 3 . 1 1 30 30 LEU N N 30 129.215 129.215 122.270 6.945 18933 1608 1 3 . 1 1 30 30 LEU C C 30 178.867 178.867 178.110 0.757 18933 1609 1 3 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.323 1.296 18933 1610 1 3 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.762 -4.897 18933 1611 1 3 . 1 1 30 30 LEU H H 30 8.917 8.917 8.303 0.614 18933 1612 1 3 . 1 1 31 31 SER N N 31 117.997 117.997 116.179 1.818 18933 1613 1 3 . 1 1 31 31 SER C C 31 177.396 177.396 175.718 1.678 18933 1614 1 3 . 1 1 31 31 SER CA C 31 61.236 61.236 60.927 0.309 18933 1615 1 3 . 1 1 31 31 SER CB C 31 62.035 62.035 63.206 -1.171 18933 1616 1 3 . 1 1 31 31 SER H H 31 8.594 8.594 8.879 -0.285 18933 1617 1 3 . 1 1 32 32 LYS N N 32 116.189 116.189 119.067 -2.878 18933 1618 1 3 . 1 1 32 32 LYS C C 32 176.244 176.244 176.994 -0.750 18933 1619 1 3 . 1 1 32 32 LYS CA C 32 57.403 57.403 57.972 -0.569 18933 1620 1 3 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.410 -2.130 18933 1621 1 3 . 1 1 32 32 LYS H H 32 8.029 8.029 8.019 0.010 18933 1622 1 3 . 1 1 33 33 ASN N N 33 119.061 119.061 116.225 2.836 18933 1623 1 3 . 1 1 33 33 ASN C C 33 172.384 172.384 173.924 -1.540 18933 1624 1 3 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.648 -1.491 18933 1625 1 3 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.224 -2.958 18933 1626 1 3 . 1 1 33 33 ASN H H 33 7.902 7.902 7.842 0.060 18933 1627 1 3 . 1 1 34 34 ILE N N 34 120.038 120.038 119.852 0.186 18933 1628 1 3 . 1 1 34 34 ILE C C 34 175.607 175.607 174.215 1.392 18933 1629 1 3 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.366 0.184 18933 1630 1 3 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.839 -2.875 18933 1631 1 3 . 1 1 34 34 ILE H H 34 7.443 7.443 7.775 -0.332 18933 1632 1 3 . 1 1 35 35 VAL N N 35 129.435 129.435 125.584 3.851 18933 1633 1 3 . 1 1 35 35 VAL C C 35 175.386 175.386 174.566 0.820 18933 1634 1 3 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.164 -0.138 18933 1635 1 3 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.601 -0.820 18933 1636 1 3 . 1 1 35 35 VAL H H 35 9.533 9.533 8.923 0.610 18933 1637 1 3 . 1 1 36 36 ALA N N 36 130.571 130.571 129.109 1.462 18933 1638 1 3 . 1 1 36 36 ALA C C 36 177.347 177.347 176.166 1.181 18933 1639 1 3 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.752 0.647 18933 1640 1 3 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.750 -0.892 18933 1641 1 3 . 1 1 36 36 ALA H H 36 8.665 8.665 8.491 0.174 18933 1642 1 3 . 1 1 37 37 VAL N N 37 115.395 115.395 119.930 -4.535 18933 1643 1 3 . 1 1 37 37 VAL C C 37 174.455 174.455 175.843 -1.388 18933 1644 1 3 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.326 0.054 18933 1645 1 3 . 1 1 37 37 VAL CB C 37 32.943 32.943 33.879 -0.936 18933 1646 1 3 . 1 1 37 37 VAL H H 37 8.079 8.079 8.282 -0.203 18933 1647 1 3 . 1 1 38 38 GLY N N 38 107.672 107.672 108.332 -0.660 18933 1648 1 3 . 1 1 38 38 GLY C C 38 173.364 173.364 175.992 -2.628 18933 1649 1 3 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.335 -0.150 18933 1650 1 3 . 1 1 38 38 GLY H H 38 7.579 7.579 8.178 -0.599 18933 1651 1 3 . 1 1 39 39 SER N N 39 121.052 121.052 119.962 1.090 18933 1652 1 3 . 1 1 39 39 SER C C 39 175.570 175.570 176.403 -0.833 18933 1653 1 3 . 1 1 39 39 SER CA C 39 61.801 61.801 61.849 -0.049 18933 1654 1 3 . 1 1 39 39 SER CB C 39 62.478 62.478 63.134 -0.656 18933 1655 1 3 . 1 1 39 39 SER H H 39 8.953 8.953 8.096 0.857 18933 1656 1 3 . 1 1 40 40 LEU N N 40 121.553 121.553 121.357 0.196 18933 1657 1 3 . 1 1 40 40 LEU C C 40 180.203 180.203 178.378 1.825 18933 1658 1 3 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.069 0.060 18933 1659 1 3 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.688 0.065 18933 1660 1 3 . 1 1 40 40 LEU H H 40 8.195 8.195 7.247 0.948 18933 1661 1 3 . 1 1 41 41 ARG N N 41 121.956 121.956 116.953 5.003 18933 1662 1 3 . 1 1 41 41 ARG C C 41 177.323 177.323 177.529 -0.206 18933 1663 1 3 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.968 0.363 18933 1664 1 3 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.963 -1.520 18933 1665 1 3 . 1 1 41 41 ARG H H 41 6.873 6.873 7.974 -1.101 18933 1666 1 3 . 1 1 42 42 ARG N N 42 114.600 114.600 116.661 -2.061 18933 1667 1 3 . 1 1 42 42 ARG C C 42 172.911 172.911 175.909 -2.998 18933 1668 1 3 . 1 1 42 42 ARG CA C 42 57.242 57.242 57.041 0.201 18933 1669 1 3 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.991 -1.851 18933 1670 1 3 . 1 1 42 42 ARG H H 42 7.438 7.438 8.023 -0.585 18933 1671 1 3 . 1 1 43 43 GLU N N 43 113.354 113.354 117.380 -4.026 18933 1672 1 3 . 1 1 43 43 GLU C C 43 175.999 175.999 175.186 0.813 18933 1673 1 3 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.387 -0.831 18933 1674 1 3 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.522 -2.185 18933 1675 1 3 . 1 1 43 43 GLU H H 43 7.564 7.564 8.456 -0.892 18933 1676 1 3 . 1 1 44 44 GLU N N 44 119.696 119.696 123.647 -3.951 18933 1677 1 3 . 1 1 44 44 GLU C C 44 175.423 175.423 176.951 -1.528 18933 1678 1 3 . 1 1 44 44 GLU CA C 44 56.838 56.838 57.313 -0.475 18933 1679 1 3 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.724 -2.028 18933 1680 1 3 . 1 1 44 44 GLU H H 44 7.261 7.261 8.641 -1.380 18933 1681 1 3 . 1 1 45 45 LYS N N 45 117.435 117.435 117.657 -0.222 18933 1682 1 3 . 1 1 45 45 LYS C C 45 177.715 177.715 174.900 2.815 18933 1683 1 3 . 1 1 45 45 LYS CA C 45 59.219 59.219 57.192 2.027 18933 1684 1 3 . 1 1 45 45 LYS CB C 45 32.119 32.119 33.690 -1.571 18933 1685 1 3 . 1 1 45 45 LYS H H 45 7.938 7.938 8.321 -0.383 18933 1686 1 3 . 1 1 46 46 MET N N 46 115.847 115.847 118.381 -2.534 18933 1687 1 3 . 1 1 46 46 MET CA C 46 52.520 52.520 54.027 -1.507 18933 1688 1 3 . 1 1 46 46 MET CB C 46 33.450 33.450 35.274 -1.824 18933 1689 1 3 . 1 1 46 46 MET H H 46 7.595 7.595 7.781 -0.186 18933 1690 1 3 . 1 1 47 47 LEU N N 47 121.627 121.627 122.755 -1.128 18933 1691 1 3 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.179 -1.054 18933 1692 1 3 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.115 -0.046 18933 1693 1 3 . 1 1 47 47 LEU H H 47 9.220 9.220 8.982 0.239 18933 1694 1 3 . 1 1 49 49 ASP N N 49 117.093 117.093 116.437 0.656 18933 1695 1 3 . 1 1 49 49 ASP C C 49 173.340 173.340 174.839 -1.499 18933 1696 1 3 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.135 -1.341 18933 1697 1 3 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.501 -1.495 18933 1698 1 3 . 1 1 49 49 ASP H H 49 7.761 7.761 7.726 0.035 18933 1699 1 3 . 1 1 50 50 VAL N N 50 119.012 119.012 116.164 2.848 18933 1700 1 3 . 1 1 50 50 VAL C C 50 173.070 173.070 174.345 -1.275 18933 1701 1 3 . 1 1 50 50 VAL CA C 50 61.842 61.842 59.373 2.469 18933 1702 1 3 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.881 -1.318 18933 1703 1 3 . 1 1 50 50 VAL H H 50 8.089 8.089 8.387 -0.298 18933 1704 1 3 . 1 1 51 51 ASP N N 51 127.064 127.064 124.286 2.778 18933 1705 1 3 . 1 1 51 51 ASP C C 51 174.565 174.565 174.987 -0.422 18933 1706 1 3 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.784 -0.627 18933 1707 1 3 . 1 1 51 51 ASP CB C 51 42.640 42.640 44.359 -1.719 18933 1708 1 3 . 1 1 51 51 ASP H H 51 8.069 8.069 8.072 -0.003 18933 1709 1 3 . 1 1 52 52 LEU N N 52 121.627 121.627 119.899 1.728 18933 1710 1 3 . 1 1 52 52 LEU C C 52 174.063 174.063 174.612 -0.549 18933 1711 1 3 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.392 -0.710 18933 1712 1 3 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.188 -2.837 18933 1713 1 3 . 1 1 52 52 LEU H H 52 8.852 8.852 8.963 -0.111 18933 1714 1 3 . 1 1 53 53 LEU N N 53 123.093 123.093 123.364 -0.271 18933 1715 1 3 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.143 1.848 18933 1716 1 3 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.657 -2.524 18933 1717 1 3 . 1 1 53 53 LEU H H 53 9.362 9.362 9.097 0.265 18933 1718 1 3 . 1 1 54 54 ILE N N 54 123.777 123.777 129.323 -5.546 18933 1719 1 3 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.226 -4.164 18933 1720 1 3 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.350 -7.280 18933 1721 1 3 . 1 1 54 54 ILE H H 54 8.907 8.907 9.314 -0.407 18933 1722 1 3 . 1 1 58 58 GLU N N 58 114.710 114.710 116.798 -2.088 18933 1723 1 3 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.127 -0.750 18933 1724 1 3 . 1 1 58 58 GLU CB C 58 31.422 31.422 32.591 -1.169 18933 1725 1 3 . 1 1 58 58 GLU H H 58 6.716 6.716 7.380 -0.664 18933 1726 1 3 . 1 1 61 61 LEU N N 61 115.957 115.957 119.719 -3.762 18933 1727 1 3 . 1 1 61 61 LEU C C 61 178.512 178.512 178.399 0.113 18933 1728 1 3 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.221 -2.441 18933 1729 1 3 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.701 -0.582 18933 1730 1 3 . 1 1 61 61 LEU H H 61 7.307 7.307 7.792 -0.485 18933 1731 1 3 . 1 1 62 62 LEU N N 62 120.038 120.038 119.309 0.729 18933 1732 1 3 . 1 1 62 62 LEU C C 62 177.874 177.874 178.754 -0.880 18933 1733 1 3 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.555 0.381 18933 1734 1 3 . 1 1 62 62 LEU CB C 62 40.739 40.739 42.036 -1.297 18933 1735 1 3 . 1 1 62 62 LEU H H 62 7.327 7.327 8.032 -0.705 18933 1736 1 3 . 1 1 63 63 LYS N N 63 114.600 114.600 115.621 -1.021 18933 1737 1 3 . 1 1 63 63 LYS C C 63 175.460 175.460 177.539 -2.079 18933 1738 1 3 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.672 -1.108 18933 1739 1 3 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.571 -1.846 18933 1740 1 3 . 1 1 63 63 LYS H H 63 7.973 7.973 7.802 0.171 18933 1741 1 3 . 1 1 64 64 HIS N N 64 115.273 115.273 115.936 -0.663 18933 1742 1 3 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.544 0.569 18933 1743 1 3 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.064 2.372 18933 1744 1 3 . 1 1 64 64 HIS H H 64 7.544 7.544 7.643 -0.099 18933 1745 1 3 . 1 1 65 65 VAL N N 65 118.682 118.682 118.142 0.540 18933 1746 1 3 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.608 3.430 18933 1747 1 3 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.277 -2.250 18933 1748 1 3 . 1 1 65 65 VAL H H 65 6.787 6.787 7.103 -0.316 18933 1749 1 3 . 1 1 68 68 ASN N N 68 112.108 112.108 117.283 -5.175 18933 1750 1 3 . 1 1 68 68 ASN C C 68 174.884 174.884 173.674 1.210 18933 1751 1 3 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.326 -1.299 18933 1752 1 3 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.482 0.750 18933 1753 1 3 . 1 1 68 68 ASN H H 68 7.009 7.009 8.330 -1.321 18933 1754 1 3 . 1 1 69 69 ILE N N 69 123.325 123.325 123.721 -0.396 18933 1755 1 3 . 1 1 69 69 ILE C C 69 174.394 174.394 175.374 -0.980 18933 1756 1 3 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.657 -1.550 18933 1757 1 3 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.413 -0.146 18933 1758 1 3 . 1 1 69 69 ILE H H 69 7.150 7.150 8.347 -1.197 18933 1759 1 3 . 1 1 70 70 ARG N N 70 126.722 126.722 128.004 -1.282 18933 1760 1 3 . 1 1 70 70 ARG C C 70 174.590 174.590 174.429 0.161 18933 1761 1 3 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.763 -1.516 18933 1762 1 3 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.994 -2.622 18933 1763 1 3 . 1 1 70 70 ARG H H 70 8.902 8.902 9.294 -0.392 18933 1764 1 3 . 1 1 71 71 ILE N N 71 119.978 119.978 120.307 -0.329 18933 1765 1 3 . 1 1 71 71 ILE C C 71 175.583 175.583 175.683 -0.100 18933 1766 1 3 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.805 0.019 18933 1767 1 3 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.245 -2.485 18933 1768 1 3 . 1 1 71 71 ILE H H 71 7.491 7.491 8.871 -1.380 18933 1769 1 3 . 1 1 72 72 LYS N N 72 128.530 128.530 125.941 2.589 18933 1770 1 3 . 1 1 72 72 LYS C C 72 177.703 177.703 176.263 1.440 18933 1771 1 3 . 1 1 72 72 LYS CA C 72 57.201 57.201 55.660 1.541 18933 1772 1 3 . 1 1 72 72 LYS CB C 72 31.485 31.485 30.733 0.752 18933 1773 1 3 . 1 1 72 72 LYS H H 72 8.523 8.523 8.608 -0.085 18933 1774 1 3 . 1 1 73 73 GLY N N 73 113.806 113.806 110.386 3.420 18933 1775 1 3 . 1 1 73 73 GLY C C 73 173.781 173.781 173.114 0.667 18933 1776 1 3 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.207 0.615 18933 1777 1 3 . 1 1 73 73 GLY H H 73 8.791 8.791 8.315 0.476 18933 1778 1 3 . 1 1 74 74 LEU N N 74 120.490 120.490 118.812 1.678 18933 1779 1 3 . 1 1 74 74 LEU C C 74 175.840 175.840 173.613 2.227 18933 1780 1 3 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.274 -0.583 18933 1781 1 3 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.188 -1.027 18933 1782 1 3 . 1 1 74 74 LEU H H 74 7.393 7.393 7.253 0.140 18933 1783 1 3 . 1 1 75 75 SER N N 75 120.038 120.038 115.512 4.526 18933 1784 1 3 . 1 1 75 75 SER C C 75 173.205 173.205 173.067 0.138 18933 1785 1 3 . 1 1 75 75 SER CA C 75 57.887 57.887 57.479 0.408 18933 1786 1 3 . 1 1 75 75 SER CB C 75 63.049 63.049 64.970 -1.921 18933 1787 1 3 . 1 1 75 75 SER H H 75 8.917 8.917 8.142 0.775 18933 1788 1 3 . 1 1 76 76 PHE N N 76 119.586 119.586 117.676 1.910 18933 1789 1 3 . 1 1 76 76 PHE C C 76 173.536 173.536 173.746 -0.210 18933 1790 1 3 . 1 1 76 76 PHE CA C 76 55.426 55.426 55.748 -0.322 18933 1791 1 3 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.280 -0.274 18933 1792 1 3 . 1 1 76 76 PHE H H 76 8.003 8.003 8.496 -0.493 18933 1793 1 3 . 1 1 77 77 SER N N 77 114.943 114.943 115.880 -0.937 18933 1794 1 3 . 1 1 77 77 SER C C 77 173.438 173.438 172.517 0.921 18933 1795 1 3 . 1 1 77 77 SER CA C 77 56.152 56.152 57.243 -1.091 18933 1796 1 3 . 1 1 77 77 SER CB C 77 65.204 65.204 66.232 -1.028 18933 1797 1 3 . 1 1 77 77 SER H H 77 8.907 8.907 8.701 0.206 18933 1798 1 3 . 1 1 78 78 VAL N N 78 124.791 124.791 124.075 0.716 18933 1799 1 3 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.144 1.900 18933 1800 1 3 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.182 -2.000 18933 1801 1 3 . 1 1 78 78 VAL H H 78 8.892 8.892 8.339 0.553 18933 1802 1 3 . 1 1 79 79 LYS N N 79 129.667 129.667 129.136 0.531 18933 1803 1 3 . 1 1 79 79 LYS CA C 79 56.192 56.192 53.529 2.663 18933 1804 1 3 . 1 1 79 79 LYS CB C 79 32.372 32.372 33.492 -1.120 18933 1805 1 3 . 1 1 79 79 LYS H H 79 9.049 9.049 8.845 0.204 18933 1806 1 3 . 1 1 82 82 GLY N N 82 117.263 117.263 113.450 3.813 18933 1807 1 3 . 1 1 82 82 GLY C C 82 171.710 171.710 174.871 -3.161 18933 1808 1 3 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.445 -2.520 18933 1809 1 3 . 1 1 82 82 GLY H H 82 8.044 8.044 8.431 -0.387 18933 1810 1 3 . 1 1 83 83 GLU N N 83 117.203 117.203 121.146 -3.943 18933 1811 1 3 . 1 1 83 83 GLU C C 83 178.695 178.695 178.083 0.612 18933 1812 1 3 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.728 1.249 18933 1813 1 3 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.881 -0.044 18933 1814 1 3 . 1 1 83 83 GLU H H 83 8.296 8.296 8.431 -0.135 18933 1815 1 3 . 1 1 84 84 ARG N N 84 113.818 113.818 119.843 -6.025 18933 1816 1 3 . 1 1 84 84 ARG C C 84 175.877 175.877 175.659 0.218 18933 1817 1 3 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.380 -1.649 18933 1818 1 3 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.570 1.725 18933 1819 1 3 . 1 1 84 84 ARG H H 84 8.342 8.342 8.026 0.316 18933 1820 1 3 . 1 1 85 85 LYS N N 85 119.354 119.354 121.073 -1.719 18933 1821 1 3 . 1 1 85 85 LYS C C 85 174.516 174.516 174.042 0.474 18933 1822 1 3 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.582 -0.842 18933 1823 1 3 . 1 1 85 85 LYS CB C 85 34.844 34.844 35.304 -0.460 18933 1824 1 3 . 1 1 85 85 LYS H H 85 6.822 6.822 7.600 -0.778 18933 1825 1 3 . 1 1 86 86 CYS N N 86 125.928 125.928 124.380 1.548 18933 1826 1 3 . 1 1 86 86 CYS C C 86 171.600 171.600 173.308 -1.708 18933 1827 1 3 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.968 -2.341 18933 1828 1 3 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.286 0.058 18933 1829 1 3 . 1 1 86 86 CYS H H 86 9.084 9.084 9.350 -0.266 18933 1830 1 3 . 1 1 87 87 VAL N N 87 126.612 126.612 126.217 0.395 18933 1831 1 3 . 1 1 87 87 VAL C C 87 174.431 174.431 174.558 -0.127 18933 1832 1 3 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.745 -0.428 18933 1833 1 3 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.274 0.922 18933 1834 1 3 . 1 1 87 87 VAL H H 87 8.705 8.705 9.038 -0.333 18933 1835 1 3 . 1 1 88 88 LEU N N 88 127.748 127.748 123.247 4.501 18933 1836 1 3 . 1 1 88 88 LEU C C 88 175.227 175.227 174.667 0.560 18933 1837 1 3 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.522 -0.002 18933 1838 1 3 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.007 -1.401 18933 1839 1 3 . 1 1 88 88 LEU H H 88 9.417 9.417 8.662 0.755 18933 1840 1 3 . 1 1 89 89 PHE N N 89 120.981 120.981 118.903 2.078 18933 1841 1 3 . 1 1 89 89 PHE C C 89 176.906 176.906 176.045 0.861 18933 1842 1 3 . 1 1 89 89 PHE CA C 89 55.587 55.587 56.050 -0.463 18933 1843 1 3 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.523 -2.622 18933 1844 1 3 . 1 1 89 89 PHE H H 89 8.937 8.937 8.628 0.309 18933 1845 1 3 . 1 1 90 90 ILE N N 90 119.928 119.928 118.222 1.706 18933 1846 1 3 . 1 1 90 90 ILE C C 90 173.781 173.781 174.972 -1.191 18933 1847 1 3 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.786 -1.132 18933 1848 1 3 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.768 0.844 18933 1849 1 3 . 1 1 90 90 ILE H H 90 9.230 9.230 9.075 0.155 18933 1850 1 3 . 1 1 91 91 GLU N N 91 124.339 124.339 124.774 -0.435 18933 1851 1 3 . 1 1 91 91 GLU C C 91 175.607 175.607 175.350 0.257 18933 1852 1 3 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.762 -0.143 18933 1853 1 3 . 1 1 91 91 GLU CB C 91 29.837 29.837 33.107 -3.270 18933 1854 1 3 . 1 1 91 91 GLU H H 91 8.175 8.175 9.054 -0.879 18933 1855 1 3 . 1 1 92 92 TRP N N 92 127.516 127.516 124.917 2.599 18933 1856 1 3 . 1 1 92 92 TRP C C 92 175.203 175.203 176.346 -1.143 18933 1857 1 3 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.698 1.535 18933 1858 1 3 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.749 0.912 18933 1859 1 3 . 1 1 92 92 TRP H H 92 9.306 9.306 8.638 0.668 18933 1860 1 3 . 1 1 93 93 GLU N N 93 127.834 127.834 126.232 1.602 18933 1861 1 3 . 1 1 93 93 GLU C C 93 175.668 175.668 176.205 -0.537 18933 1862 1 3 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.782 -0.904 18933 1863 1 3 . 1 1 93 93 GLU CB C 93 26.034 26.034 28.170 -2.136 18933 1864 1 3 . 1 1 93 93 GLU H H 93 8.796 8.796 9.214 -0.418 18933 1865 1 3 . 1 1 94 94 LYS N N 94 108.931 108.931 113.126 -4.195 18933 1866 1 3 . 1 1 94 94 LYS C C 94 175.423 175.423 176.029 -0.606 18933 1867 1 3 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.487 -0.044 18933 1868 1 3 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.100 -2.467 18933 1869 1 3 . 1 1 94 94 LYS H H 94 8.498 8.498 8.625 -0.127 18933 1870 1 3 . 1 1 95 95 LYS N N 95 121.737 121.737 120.760 0.977 18933 1871 1 3 . 1 1 95 95 LYS C C 95 174.443 174.443 175.228 -0.785 18933 1872 1 3 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.255 -1.838 18933 1873 1 3 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.540 -0.076 18933 1874 1 3 . 1 1 95 95 LYS H H 95 7.761 7.761 7.787 -0.026 18933 1875 1 3 . 1 1 96 96 THR N N 96 116.067 116.067 115.742 0.325 18933 1876 1 3 . 1 1 96 96 THR C C 96 174.296 174.296 173.572 0.724 18933 1877 1 3 . 1 1 96 96 THR CA C 96 61.115 61.115 60.981 0.134 18933 1878 1 3 . 1 1 96 96 THR CB C 96 69.450 69.450 71.957 -2.507 18933 1879 1 3 . 1 1 96 96 THR H H 96 7.761 7.761 8.343 -0.582 18933 1880 1 3 . 1 1 97 97 TYR N N 97 124.229 124.229 124.369 -0.140 18933 1881 1 3 . 1 1 97 97 TYR C C 97 173.536 173.536 173.455 0.081 18933 1882 1 3 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.600 -0.650 18933 1883 1 3 . 1 1 97 97 TYR CB C 97 41.182 41.182 43.244 -2.062 18933 1884 1 3 . 1 1 97 97 TYR H H 97 9.018 9.018 9.382 -0.364 18933 1885 1 3 . 1 1 98 98 GLN N N 98 123.435 123.435 126.133 -2.698 18933 1886 1 3 . 1 1 98 98 GLN C C 98 173.266 173.266 173.549 -0.283 18933 1887 1 3 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.314 -0.171 18933 1888 1 3 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.304 -0.291 18933 1889 1 3 . 1 1 98 98 GLN H H 98 8.781 8.781 8.842 -0.061 18933 1890 1 3 . 1 1 99 99 LEU N N 99 130.119 130.119 129.084 1.035 18933 1891 1 3 . 1 1 99 99 LEU C C 99 173.867 173.867 174.008 -0.141 18933 1892 1 3 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.392 -0.872 18933 1893 1 3 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.784 -1.179 18933 1894 1 3 . 1 1 99 99 LEU H H 99 9.104 9.104 8.836 0.268 18933 1895 1 3 . 1 1 100 100 ASP N N 100 125.182 125.182 127.585 -2.403 18933 1896 1 3 . 1 1 100 100 ASP C C 100 172.837 172.837 174.247 -1.410 18933 1897 1 3 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.984 -2.230 18933 1898 1 3 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.620 -4.276 18933 1899 1 3 . 1 1 100 100 ASP H H 100 9.089 9.089 8.804 0.285 18933 1900 1 3 . 1 1 101 101 LEU N N 101 121.174 121.174 128.004 -6.830 18933 1901 1 3 . 1 1 101 101 LEU C C 101 174.529 174.529 174.548 -0.019 18933 1902 1 3 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.659 -1.744 18933 1903 1 3 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.330 -1.422 18933 1904 1 3 . 1 1 101 101 LEU H H 101 8.458 8.458 9.191 -0.733 18933 1905 1 3 . 1 1 102 102 PHE N N 102 119.464 119.464 126.403 -6.939 18933 1906 1 3 . 1 1 102 102 PHE C C 102 176.293 176.293 174.874 1.419 18933 1907 1 3 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.307 -1.253 18933 1908 1 3 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.412 -0.532 18933 1909 1 3 . 1 1 102 102 PHE H H 102 8.281 8.281 9.442 -1.161 18933 1910 1 3 . 1 1 103 103 THR N N 103 108.576 108.576 118.004 -9.428 18933 1911 1 3 . 1 1 103 103 THR C C 103 174.933 174.933 173.243 1.690 18933 1912 1 3 . 1 1 103 103 THR CA C 103 57.726 57.726 60.240 -2.514 18933 1913 1 3 . 1 1 103 103 THR CB C 103 71.288 71.288 69.233 2.055 18933 1914 1 3 . 1 1 103 103 THR H H 103 7.872 7.872 8.365 -0.493 18933 1915 1 3 . 1 1 104 104 ALA N N 104 122.885 122.885 129.390 -6.505 18933 1916 1 3 . 1 1 104 104 ALA C C 104 175.754 175.754 174.807 0.947 18933 1917 1 3 . 1 1 104 104 ALA CA C 104 50.018 50.018 50.026 -0.008 18933 1918 1 3 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.727 -0.242 18933 1919 1 3 . 1 1 104 104 ALA H H 104 8.660 8.660 9.250 -0.590 18933 1920 1 3 . 1 1 105 105 LEU N N 105 120.881 120.881 119.929 0.952 18933 1921 1 3 . 1 1 105 105 LEU C C 105 179.504 179.504 178.781 0.723 18933 1922 1 3 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.122 -0.875 18933 1923 1 3 . 1 1 105 105 LEU CB C 105 41.753 41.753 42.970 -1.217 18933 1924 1 3 . 1 1 105 105 LEU H H 105 8.226 8.226 8.178 0.048 18933 1925 1 3 . 1 1 106 106 ALA N N 106 124.901 124.901 123.772 1.129 18933 1926 1 3 . 1 1 106 106 ALA C C 106 181.269 181.269 179.130 2.139 18933 1927 1 3 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.667 1.646 18933 1928 1 3 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.954 -1.730 18933 1929 1 3 . 1 1 106 106 ALA H H 106 8.392 8.392 8.631 -0.239 18933 1930 1 3 . 1 1 107 107 GLU N N 107 116.409 116.409 116.749 -0.340 18933 1931 1 3 . 1 1 107 107 GLU C C 107 177.764 177.764 177.166 0.598 18933 1932 1 3 . 1 1 107 107 GLU CA C 107 58.533 58.533 58.396 0.137 18933 1933 1 3 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.637 -1.701 18933 1934 1 3 . 1 1 107 107 GLU H H 107 9.664 9.664 8.690 0.974 18933 1935 1 3 . 1 1 108 108 GLU N N 108 116.189 116.189 117.946 -1.757 18933 1936 1 3 . 1 1 108 108 GLU CA C 108 55.143 55.143 57.043 -1.900 18933 1937 1 3 . 1 1 108 108 GLU CB C 108 29.837 29.837 28.404 1.433 18933 1938 1 3 . 1 1 108 108 GLU H H 108 7.589 7.589 7.499 0.090 18933 1939 1 3 . 1 1 109 109 LYS N N 109 119.928 119.928 121.038 -1.110 18933 1940 1 3 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.553 1.298 18933 1941 1 3 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.767 -0.296 18933 1942 1 3 . 1 1 109 109 LYS H H 109 7.514 7.514 7.607 -0.093 18933 1943 1 3 . 1 1 111 111 TYR N N 111 114.930 114.930 118.838 -3.908 18933 1944 1 3 . 1 1 111 111 TYR C C 111 179.504 179.504 177.780 1.724 18933 1945 1 3 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.639 -2.622 18933 1946 1 3 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.618 -1.950 18933 1947 1 3 . 1 1 111 111 TYR H H 111 6.393 6.393 8.455 -2.062 18933 1948 1 3 . 1 1 112 112 ALA N N 112 124.901 124.901 122.919 1.982 18933 1949 1 3 . 1 1 112 112 ALA C C 112 179.173 179.173 179.407 -0.234 18933 1950 1 3 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.500 -0.599 18933 1951 1 3 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.382 -0.270 18933 1952 1 3 . 1 1 112 112 ALA H H 112 8.554 8.554 8.178 0.376 18933 1953 1 3 . 1 1 113 113 ILE N N 113 119.464 119.464 119.382 0.082 18933 1954 1 3 . 1 1 113 113 ILE C C 113 178.499 178.499 177.639 0.860 18933 1955 1 3 . 1 1 113 113 ILE CA C 113 66.281 66.281 64.388 1.893 18933 1956 1 3 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.773 -0.457 18933 1957 1 3 . 1 1 113 113 ILE H H 113 8.680 8.680 7.611 1.069 18933 1958 1 3 . 1 1 114 114 PHE N N 114 122.922 122.922 121.951 0.971 18933 1959 1 3 . 1 1 114 114 PHE C C 114 178.217 178.217 177.731 0.486 18933 1960 1 3 . 1 1 114 114 PHE CA C 114 61.559 61.559 61.557 0.002 18933 1961 1 3 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.632 0.839 18933 1962 1 3 . 1 1 114 114 PHE H H 114 7.721 7.721 8.727 -1.006 18933 1963 1 3 . 1 1 115 115 HIS N N 115 118.560 118.560 118.210 0.350 18933 1964 1 3 . 1 1 115 115 HIS C C 115 177.286 177.286 176.606 0.680 18933 1965 1 3 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.500 -0.120 18933 1966 1 3 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.210 1.655 18933 1967 1 3 . 1 1 115 115 HIS H H 115 8.155 8.155 8.277 -0.122 18933 1968 1 3 . 1 1 116 116 PHE N N 116 111.472 111.472 116.608 -5.136 18933 1969 1 3 . 1 1 116 116 PHE C C 116 179.026 179.026 177.279 1.747 18933 1970 1 3 . 1 1 116 116 PHE CA C 116 59.461 59.461 60.230 -0.769 18933 1971 1 3 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.916 -1.727 18933 1972 1 3 . 1 1 116 116 PHE H H 116 8.564 8.564 7.915 0.649 18933 1973 1 3 . 1 1 117 117 THR N N 117 119.012 119.012 111.064 7.948 18933 1974 1 3 . 1 1 117 117 THR C C 117 172.935 172.935 175.537 -2.602 18933 1975 1 3 . 1 1 117 117 THR CA C 117 67.088 67.088 64.684 2.404 18933 1976 1 3 . 1 1 117 117 THR CB C 117 37.126 37.126 69.046 -31.921 18933 1977 1 3 . 1 1 117 117 THR H H 117 7.620 7.620 8.286 -0.666 18933 1978 1 3 . 1 1 118 118 GLY N N 118 107.917 107.917 110.149 -2.232 18933 1979 1 3 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.270 1.897 18933 1980 1 3 . 1 1 118 118 GLY H H 118 6.666 6.666 7.491 -0.825 18933 1981 1 3 . 1 1 121 121 SER N N 121 113.354 113.354 118.359 -5.005 18933 1982 1 3 . 1 1 121 121 SER C C 121 176.061 176.061 175.826 0.235 18933 1983 1 3 . 1 1 121 121 SER CA C 121 61.035 61.035 62.493 -1.458 18933 1984 1 3 . 1 1 121 121 SER H H 121 8.322 8.322 8.288 0.034 18933 1985 1 3 . 1 1 122 122 TYR N N 122 124.681 124.681 121.071 3.610 18933 1986 1 3 . 1 1 122 122 TYR C C 122 176.293 176.293 176.865 -0.572 18933 1987 1 3 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.806 -1.748 18933 1988 1 3 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.028 0.683 18933 1989 1 3 . 1 1 122 122 TYR H H 122 6.514 6.514 8.159 -1.645 18933 1990 1 3 . 1 1 123 123 LEU N N 123 117.997 117.997 119.762 -1.765 18933 1991 1 3 . 1 1 123 123 LEU C C 123 179.774 179.774 179.004 0.770 18933 1992 1 3 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.711 0.167 18933 1993 1 3 . 1 1 123 123 LEU CB C 123 39.978 39.978 41.016 -1.038 18933 1994 1 3 . 1 1 123 123 LEU H H 123 7.428 7.428 7.250 0.178 18933 1995 1 3 . 1 1 124 124 ILE N N 124 119.012 119.012 120.266 -1.254 18933 1996 1 3 . 1 1 124 124 ILE C C 124 178.830 178.830 177.867 0.963 18933 1997 1 3 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.399 -0.248 18933 1998 1 3 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.372 -0.309 18933 1999 1 3 . 1 1 124 124 ILE H H 124 8.453 8.453 8.427 0.026 18933 2000 1 3 . 1 1 125 125 ARG N N 125 121.174 121.174 119.808 1.366 18933 2001 1 3 . 1 1 125 125 ARG C C 125 179.762 179.762 178.702 1.060 18933 2002 1 3 . 1 1 125 125 ARG CA C 125 59.057 59.057 59.000 0.057 18933 2003 1 3 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.458 -0.508 18933 2004 1 3 . 1 1 125 125 ARG H H 125 7.004 7.004 8.172 -1.168 18933 2005 1 3 . 1 1 126 126 ILE N N 126 122.299 122.299 120.991 1.308 18933 2006 1 3 . 1 1 126 126 ILE C C 126 178.352 178.352 177.624 0.728 18933 2007 1 3 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.670 -2.465 18933 2008 1 3 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.172 -1.757 18933 2009 1 3 . 1 1 126 126 ILE H H 126 7.579 7.579 7.906 -0.327 18933 2010 1 3 . 1 1 127 127 ARG N N 127 119.354 119.354 120.630 -1.276 18933 2011 1 3 . 1 1 127 127 ARG C C 127 179.786 179.786 178.744 1.042 18933 2012 1 3 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.718 0.268 18933 2013 1 3 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.174 -0.844 18933 2014 1 3 . 1 1 127 127 ARG H H 127 8.715 8.715 8.150 0.565 18933 2015 1 3 . 1 1 128 128 ALA N N 128 122.873 122.873 120.437 2.436 18933 2016 1 3 . 1 1 128 128 ALA C C 128 180.325 180.325 179.318 1.007 18933 2017 1 3 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.620 0.120 18933 2018 1 3 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.251 -1.090 18933 2019 1 3 . 1 1 128 128 ALA H H 128 7.978 7.978 8.155 -0.177 18933 2020 1 3 . 1 1 129 129 ALA N N 129 121.846 121.846 121.855 -0.009 18933 2021 1 3 . 1 1 129 129 ALA C C 129 181.539 181.539 179.897 1.642 18933 2022 1 3 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.777 -0.279 18933 2023 1 3 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.601 -1.123 18933 2024 1 3 . 1 1 129 129 ALA H H 129 7.519 7.519 7.856 -0.337 18933 2025 1 3 . 1 1 130 130 LEU N N 130 119.134 119.134 118.251 0.883 18933 2026 1 3 . 1 1 130 130 LEU C C 130 179.909 179.909 178.984 0.925 18933 2027 1 3 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.075 -0.076 18933 2028 1 3 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.690 -1.268 18933 2029 1 3 . 1 1 130 130 LEU H H 130 8.296 8.296 8.705 -0.409 18933 2030 1 3 . 1 1 131 131 LYS N N 131 122.299 122.299 120.316 1.983 18933 2031 1 3 . 1 1 131 131 LYS C C 131 180.289 180.289 179.522 0.767 18933 2032 1 3 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.883 -0.866 18933 2033 1 3 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.121 -0.889 18933 2034 1 3 . 1 1 131 131 LYS H H 131 8.281 8.281 7.897 0.384 18933 2035 1 3 . 1 1 132 132 LYS N N 132 118.743 118.743 118.378 0.365 18933 2036 1 3 . 1 1 132 132 LYS C C 132 177.482 177.482 177.736 -0.254 18933 2037 1 3 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.404 0.088 18933 2038 1 3 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.217 -0.985 18933 2039 1 3 . 1 1 132 132 LYS H H 132 7.317 7.317 7.683 -0.366 18933 2040 1 3 . 1 1 133 133 LYS N N 133 117.093 117.093 117.688 -0.595 18933 2041 1 3 . 1 1 133 133 LYS C C 133 174.614 174.614 175.807 -1.193 18933 2042 1 3 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.848 -1.068 18933 2043 1 3 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.961 -0.779 18933 2044 1 3 . 1 1 133 133 LYS H H 133 7.327 7.327 7.708 -0.381 18933 2045 1 3 . 1 1 134 134 ASN N N 134 113.012 113.012 115.042 -2.030 18933 2046 1 3 . 1 1 134 134 ASN C C 134 173.965 173.965 173.434 0.531 18933 2047 1 3 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.195 0.101 18933 2048 1 3 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.358 -1.183 18933 2049 1 3 . 1 1 134 134 ASN H H 134 7.938 7.938 7.814 0.124 18933 2050 1 3 . 1 1 135 135 TYR N N 135 115.725 115.725 119.366 -3.641 18933 2051 1 3 . 1 1 135 135 TYR C C 135 176.342 176.342 175.276 1.066 18933 2052 1 3 . 1 1 135 135 TYR CA C 135 55.668 55.668 56.766 -1.098 18933 2053 1 3 . 1 1 135 135 TYR CB C 135 41.563 41.563 39.876 1.688 18933 2054 1 3 . 1 1 135 135 TYR H H 135 7.741 7.741 8.349 -0.608 18933 2055 1 3 . 1 1 136 136 LYS N N 136 122.641 122.641 125.660 -3.019 18933 2056 1 3 . 1 1 136 136 LYS C C 136 173.475 173.475 174.710 -1.235 18933 2057 1 3 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.653 0.248 18933 2058 1 3 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.381 -1.663 18933 2059 1 3 . 1 1 136 136 LYS H H 136 9.296 9.296 8.892 0.404 18933 2060 1 3 . 1 1 137 137 LEU N N 137 127.284 127.284 123.551 3.733 18933 2061 1 3 . 1 1 137 137 LEU C C 137 175.423 175.423 176.264 -0.841 18933 2062 1 3 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.077 0.049 18933 2063 1 3 . 1 1 137 137 LEU CB C 137 45.746 45.746 41.916 3.830 18933 2064 1 3 . 1 1 137 137 LEU H H 137 8.776 8.776 8.482 0.294 18933 2065 1 3 . 1 1 138 138 ASN N N 138 125.818 125.818 120.052 5.766 18933 2066 1 3 . 1 1 138 138 ASN C C 138 174.933 174.933 175.252 -0.319 18933 2067 1 3 . 1 1 138 138 ASN CA C 138 52.117 52.117 51.972 0.145 18933 2068 1 3 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.286 -4.780 18933 2069 1 3 . 1 1 138 138 ASN H H 138 8.811 8.811 8.205 0.606 18933 2070 1 3 . 1 1 139 139 GLN N N 139 116.861 116.861 119.111 -2.250 18933 2071 1 3 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.429 -1.591 18933 2072 1 3 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.667 -2.950 18933 2073 1 3 . 1 1 139 139 GLN H H 139 9.220 9.220 8.956 0.264 18933 2074 1 3 . 1 1 140 140 TYR N N 140 120.600 120.600 120.372 0.228 18933 2075 1 3 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.663 -0.906 18933 2076 1 3 . 1 1 140 140 TYR CB C 140 37.570 37.570 38.276 -0.706 18933 2077 1 3 . 1 1 140 140 TYR H H 140 8.549 8.549 8.333 0.216 18933 2078 1 3 . 1 1 141 141 GLY N N 141 105.986 105.986 108.430 -2.444 18933 2079 1 3 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.406 -0.562 18933 2080 1 3 . 1 1 141 141 GLY H H 141 7.186 7.186 7.738 -0.552 18933 2081 1 3 . 1 1 142 142 LEU N N 142 120.038 120.038 116.899 3.139 18933 2082 1 3 . 1 1 142 142 LEU C C 142 173.340 173.340 175.748 -2.408 18933 2083 1 3 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.121 -0.601 18933 2084 1 3 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.460 0.891 18933 2085 1 3 . 1 1 142 142 LEU H H 142 7.539 7.539 8.397 -0.858 18933 2086 1 3 . 1 1 143 143 PHE N N 143 124.229 124.229 119.141 5.088 18933 2087 1 3 . 1 1 143 143 PHE C C 143 173.977 173.977 175.153 -1.176 18933 2088 1 3 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.284 -2.643 18933 2089 1 3 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.418 4.250 18933 2090 1 3 . 1 1 143 143 PHE H H 143 9.084 9.084 9.014 0.070 18933 2091 1 3 . 1 1 144 144 LYS N N 144 127.858 127.858 123.063 4.795 18933 2092 1 3 . 1 1 144 144 LYS C C 144 175.092 175.092 176.713 -1.621 18933 2093 1 3 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.536 4.320 18933 2094 1 3 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.879 3.705 18933 2095 1 3 . 1 1 144 144 LYS H H 144 9.281 9.281 8.892 0.389 18933 2096 1 3 . 1 1 145 145 ASN N N 145 128.188 128.188 126.136 2.052 18933 2097 1 3 . 1 1 145 145 ASN C C 145 175.779 175.779 174.776 1.003 18933 2098 1 3 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.516 3.210 18933 2099 1 3 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.497 -2.843 18933 2100 1 3 . 1 1 145 145 ASN H H 145 9.205 9.205 9.214 -0.009 18933 2101 1 3 . 1 1 146 146 GLN N N 146 129.655 129.655 112.317 17.338 18933 2102 1 3 . 1 1 146 146 GLN C C 146 175.399 175.399 173.942 1.457 18933 2103 1 3 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.260 1.555 18933 2104 1 3 . 1 1 146 146 GLN CB C 146 32.626 32.626 28.283 4.343 18933 2105 1 3 . 1 1 146 146 GLN H H 146 8.983 8.983 8.751 0.232 18933 2106 1 3 . 1 1 147 147 THR N N 147 117.936 117.936 114.879 3.057 18933 2107 1 3 . 1 1 147 147 THR C C 147 173.254 173.254 173.434 -0.180 18933 2108 1 3 . 1 1 147 147 THR CA C 147 61.721 61.721 61.123 0.598 18933 2109 1 3 . 1 1 147 147 THR CB C 147 70.274 70.274 69.576 0.698 18933 2110 1 3 . 1 1 147 147 THR H H 147 8.029 8.029 7.799 0.230 18933 2111 1 3 . 1 1 148 148 LEU N N 148 130.681 130.681 130.806 -0.125 18933 2112 1 3 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.486 -0.020 18933 2113 1 3 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.760 -1.071 18933 2114 1 3 . 1 1 148 148 LEU H H 148 8.635 8.635 8.925 -0.290 18933 2115 1 3 . 1 1 149 149 VAL N N 149 130.803 130.803 128.748 2.055 18933 2116 1 3 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.017 1.161 18933 2117 1 3 . 1 1 149 149 VAL CB C 149 31.675 31.675 35.425 -3.751 18933 2118 1 3 . 1 1 149 149 VAL H H 149 8.968 8.968 9.190 -0.222 18933 2119 1 3 . 1 1 151 151 LEU N N 151 124.290 124.290 121.688 2.602 18933 2120 1 3 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.407 -2.394 18933 2121 1 3 . 1 1 151 151 LEU CB C 151 44.098 44.098 40.963 3.135 18933 2122 1 3 . 1 1 151 151 LEU H H 151 7.872 7.872 8.165 -0.293 18933 2123 1 3 . 1 1 153 153 ILE N N 153 114.943 114.943 113.831 1.112 18933 2124 1 3 . 1 1 153 153 ILE C C 153 175.877 175.877 175.290 0.587 18933 2125 1 3 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.697 -0.003 18933 2126 1 3 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.408 1.281 18933 2127 1 3 . 1 1 153 153 ILE H H 153 7.125 7.125 7.768 -0.643 18933 2128 1 3 . 1 1 154 154 THR N N 154 111.766 111.766 110.487 1.279 18933 2129 1 3 . 1 1 154 154 THR C C 154 174.945 174.945 174.368 0.577 18933 2130 1 3 . 1 1 154 154 THR CA C 154 62.124 62.124 62.908 -0.784 18933 2131 1 3 . 1 1 154 154 THR CB C 154 70.718 70.718 69.664 1.054 18933 2132 1 3 . 1 1 154 154 THR H H 154 9.286 9.286 8.212 1.074 18933 2133 1 3 . 1 1 155 155 THR N N 155 111.766 111.766 113.360 -1.594 18933 2134 1 3 . 1 1 155 155 THR CA C 155 58.936 58.936 59.671 -0.735 18933 2135 1 3 . 1 1 155 155 THR CB C 155 72.683 72.683 72.398 0.285 18933 2136 1 3 . 1 1 155 155 THR H H 155 7.645 7.645 7.359 0.286 18933 2137 1 3 . 1 1 157 157 LYS N N 157 119.464 119.464 119.479 -0.015 18933 2138 1 3 . 1 1 157 157 LYS C C 157 178.781 178.781 178.566 0.215 18933 2139 1 3 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.916 0.110 18933 2140 1 3 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.735 -0.313 18933 2141 1 3 . 1 1 157 157 LYS H H 157 8.175 8.175 8.233 -0.058 18933 2142 1 3 . 1 1 158 158 GLU N N 158 118.340 118.340 117.691 0.649 18933 2143 1 3 . 1 1 158 158 GLU C C 158 178.867 178.867 178.811 0.056 18933 2144 1 3 . 1 1 158 158 GLU CA C 158 58.492 58.492 59.599 -1.107 18933 2145 1 3 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.947 0.383 18933 2146 1 3 . 1 1 158 158 GLU H H 158 7.519 7.519 8.432 -0.913 18933 2147 1 3 . 1 1 159 159 LEU N N 159 120.710 120.710 121.168 -0.458 18933 2148 1 3 . 1 1 159 159 LEU C C 159 176.526 176.526 178.244 -1.718 18933 2149 1 3 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.352 -0.182 18933 2150 1 3 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.574 -1.659 18933 2151 1 3 . 1 1 159 159 LEU H H 159 7.524 7.524 7.816 -0.292 18933 2152 1 3 . 1 1 160 160 ILE N N 160 118.217 118.217 119.293 -1.076 18933 2153 1 3 . 1 1 160 160 ILE C C 160 177.213 177.213 177.946 -0.733 18933 2154 1 3 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.633 -0.603 18933 2155 1 3 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.440 0.066 18933 2156 1 3 . 1 1 160 160 ILE H H 160 7.741 7.741 8.387 -0.646 18933 2157 1 3 . 1 1 161 161 LYS N N 161 118.450 118.450 119.765 -1.315 18933 2158 1 3 . 1 1 161 161 LYS C C 161 180.999 180.999 179.052 1.947 18933 2159 1 3 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.432 -0.617 18933 2160 1 3 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.309 -1.331 18933 2161 1 3 . 1 1 161 161 LYS H H 161 7.382 7.382 8.067 -0.685 18933 2162 1 3 . 1 1 162 162 GLU N N 162 121.846 121.846 119.794 2.052 18933 2163 1 3 . 1 1 162 162 GLU C C 162 178.818 178.818 178.763 0.055 18933 2164 1 3 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.578 -0.529 18933 2165 1 3 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.233 -1.298 18933 2166 1 3 . 1 1 162 162 GLU H H 162 8.210 8.210 7.724 0.486 18933 2167 1 3 . 1 1 163 163 LEU N N 163 116.751 116.751 115.108 1.643 18933 2168 1 3 . 1 1 163 163 LEU C C 163 176.784 176.784 177.287 -0.503 18933 2169 1 3 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.276 -0.254 18933 2170 1 3 . 1 1 163 163 LEU CB C 163 41.309 41.309 42.017 -0.708 18933 2171 1 3 . 1 1 163 163 LEU H H 163 7.796 7.796 7.477 0.319 18933 2172 1 3 . 1 1 164 164 GLY N N 164 104.849 104.849 105.502 -0.653 18933 2173 1 3 . 1 1 164 164 GLY C C 164 174.492 174.492 174.032 0.460 18933 2174 1 3 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.465 -0.733 18933 2175 1 3 . 1 1 164 164 GLY H H 164 7.589 7.589 7.478 0.111 18933 2176 1 3 . 1 1 165 165 PHE N N 165 118.902 118.902 118.733 0.169 18933 2177 1 3 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.581 -0.913 18933 2178 1 3 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.159 -1.674 18933 2179 1 3 . 1 1 165 165 PHE H H 165 7.251 7.251 7.937 -0.686 18933 2180 1 3 . 1 1 166 166 THR N N 166 117.093 117.093 115.670 1.423 18933 2181 1 3 . 1 1 166 166 THR CA C 166 62.245 62.245 60.775 1.470 18933 2182 1 3 . 1 1 166 166 THR CB C 166 69.323 69.323 69.649 -0.326 18933 2183 1 3 . 1 1 166 166 THR H H 166 8.407 8.407 8.351 0.056 18933 2184 1 3 . 1 1 168 168 ARG N N 168 127.431 127.431 121.926 5.505 18933 2185 1 3 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.620 -2.382 18933 2186 1 3 . 1 1 168 168 ARG CB C 168 31.992 31.992 32.252 -0.260 18933 2187 1 3 . 1 1 168 168 ARG H H 168 7.160 7.160 8.327 -1.167 18933 2188 1 3 . 1 1 171 171 LYS N N 171 113.574 113.574 115.978 -2.404 18933 2189 1 3 . 1 1 171 171 LYS C C 171 176.416 176.416 177.185 -0.769 18933 2190 1 3 . 1 1 171 171 LYS CA C 171 57.605 57.605 57.738 -0.133 18933 2191 1 3 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.430 0.499 18933 2192 1 3 . 1 1 171 171 LYS H H 171 8.210 8.210 8.301 -0.091 18933 2193 1 3 . 1 1 172 172 LYS N N 172 117.313 117.313 117.148 0.165 18933 2194 1 3 . 1 1 172 172 LYS C C 172 175.717 175.717 176.285 -0.568 18933 2195 1 3 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.532 -2.357 18933 2196 1 3 . 1 1 172 172 LYS CB C 172 31.612 31.612 33.056 -1.444 18933 2197 1 3 . 1 1 172 172 LYS H H 172 7.761 7.761 7.475 0.286 18933 2198 1 3 . 1 1 173 173 ARG N N 173 122.056 122.056 117.444 4.612 18933 2199 1 3 . 1 1 173 173 ARG C C 173 172.850 172.850 175.603 -2.753 18933 2200 1 3 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.220 0.658 18933 2201 1 3 . 1 1 173 173 ARG CB C 173 28.506 28.506 27.371 1.135 18933 2202 1 3 . 1 1 173 173 ARG H H 173 6.885 6.885 7.540 -0.655 18933 2203 1 4 . 1 1 2 2 LEU N N 2 122.812 122.812 120.653 2.159 18933 2204 1 4 . 1 1 2 2 LEU C C 2 175.742 175.742 175.885 -0.143 18933 2205 1 4 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.429 0.705 18933 2206 1 4 . 1 1 2 2 LEU CB C 2 42.842 42.842 44.804 -1.962 18933 2207 1 4 . 1 1 2 2 LEU H H 2 8.756 8.756 8.345 0.411 18933 2208 1 4 . 1 1 3 3 THR N N 3 113.000 113.000 114.783 -1.783 18933 2209 1 4 . 1 1 3 3 THR C C 3 175.938 175.938 175.531 0.407 18933 2210 1 4 . 1 1 3 3 THR CA C 3 60.550 60.550 60.162 0.388 18933 2211 1 4 . 1 1 3 3 THR CB C 3 70.781 70.781 70.710 0.071 18933 2212 1 4 . 1 1 3 3 THR H H 3 8.428 8.428 8.027 0.401 18933 2213 1 4 . 1 1 4 4 LEU N N 4 122.531 122.531 123.733 -1.202 18933 2214 1 4 . 1 1 4 4 LEU C C 4 178.463 178.463 178.520 -0.057 18933 2215 1 4 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.810 -0.681 18933 2216 1 4 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.025 -2.490 18933 2217 1 4 . 1 1 4 4 LEU H H 4 7.731 7.731 8.374 -0.643 18933 2218 1 4 . 1 1 5 5 ILE N N 5 115.505 115.505 117.765 -2.260 18933 2219 1 4 . 1 1 5 5 ILE C C 5 178.573 178.573 178.047 0.526 18933 2220 1 4 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.479 -0.741 18933 2221 1 4 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.313 -0.441 18933 2222 1 4 . 1 1 5 5 ILE H H 5 7.645 7.645 7.927 -0.282 18933 2223 1 4 . 1 1 6 6 GLN N N 6 121.626 121.626 119.346 2.280 18933 2224 1 4 . 1 1 6 6 GLN C C 6 179.014 179.014 178.803 0.211 18933 2225 1 4 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.091 -0.760 18933 2226 1 4 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.633 0.556 18933 2227 1 4 . 1 1 6 6 GLN H H 6 7.645 7.645 8.078 -0.433 18933 2228 1 4 . 1 1 7 7 GLY N N 7 107.684 107.684 106.963 0.721 18933 2229 1 4 . 1 1 7 7 GLY C C 7 174.749 174.749 176.247 -1.498 18933 2230 1 4 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.734 0.056 18933 2231 1 4 . 1 1 7 7 GLY H H 7 8.660 8.660 8.155 0.505 18933 2232 1 4 . 1 1 8 8 LYS N N 8 120.942 120.942 122.622 -1.680 18933 2233 1 4 . 1 1 8 8 LYS C C 8 179.455 179.455 178.750 0.705 18933 2234 1 4 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.300 0.605 18933 2235 1 4 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.300 -0.878 18933 2236 1 4 . 1 1 8 8 LYS H H 8 8.518 8.518 7.950 0.568 18933 2237 1 4 . 1 1 9 9 LYS N N 9 120.710 120.710 119.611 1.099 18933 2238 1 4 . 1 1 9 9 LYS C C 9 179.823 179.823 179.299 0.524 18933 2239 1 4 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.121 0.501 18933 2240 1 4 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.419 -1.124 18933 2241 1 4 . 1 1 9 9 LYS H H 9 7.731 7.731 8.097 -0.366 18933 2242 1 4 . 1 1 10 10 ILE N N 10 121.345 121.345 121.064 0.281 18933 2243 1 4 . 1 1 10 10 ILE C C 10 177.789 177.789 178.283 -0.494 18933 2244 1 4 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.668 -1.203 18933 2245 1 4 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.264 -1.899 18933 2246 1 4 . 1 1 10 10 ILE H H 10 7.711 7.711 8.281 -0.570 18933 2247 1 4 . 1 1 11 11 VAL N N 11 120.258 120.258 120.123 0.135 18933 2248 1 4 . 1 1 11 11 VAL C C 11 177.372 177.372 177.728 -0.356 18933 2249 1 4 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.316 0.135 18933 2250 1 4 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.613 -1.079 18933 2251 1 4 . 1 1 11 11 VAL H H 11 7.918 7.918 8.551 -0.633 18933 2252 1 4 . 1 1 12 12 ASN N N 12 116.971 116.971 117.951 -0.980 18933 2253 1 4 . 1 1 12 12 ASN C C 12 177.445 177.445 177.428 0.017 18933 2254 1 4 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.323 -0.211 18933 2255 1 4 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.492 -0.859 18933 2256 1 4 . 1 1 12 12 ASN H H 12 7.993 7.993 8.453 -0.460 18933 2257 1 4 . 1 1 13 13 HIS N N 13 120.258 120.258 119.610 0.648 18933 2258 1 4 . 1 1 13 13 HIS C C 13 177.862 177.862 178.294 -0.432 18933 2259 1 4 . 1 1 13 13 HIS CA C 13 59.098 59.098 58.725 0.373 18933 2260 1 4 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.168 1.064 18933 2261 1 4 . 1 1 13 13 HIS H H 13 7.741 7.741 8.333 -0.592 18933 2262 1 4 . 1 1 14 14 LEU N N 14 116.641 116.641 120.363 -3.722 18933 2263 1 4 . 1 1 14 14 LEU C C 14 179.186 179.186 178.175 1.011 18933 2264 1 4 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.236 -1.479 18933 2265 1 4 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.558 -0.439 18933 2266 1 4 . 1 1 14 14 LEU H H 14 8.221 8.221 8.537 -0.316 18933 2267 1 4 . 1 1 15 15 ARG N N 15 115.957 115.957 116.031 -0.074 18933 2268 1 4 . 1 1 15 15 ARG C C 15 176.330 176.330 178.091 -1.761 18933 2269 1 4 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.699 1.004 18933 2270 1 4 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.381 -1.304 18933 2271 1 4 . 1 1 15 15 ARG H H 15 7.968 7.968 8.389 -0.421 18933 2272 1 4 . 1 1 16 16 SER N N 16 109.395 109.395 115.545 -6.150 18933 2273 1 4 . 1 1 16 16 SER C C 16 176.024 176.024 174.833 1.191 18933 2274 1 4 . 1 1 16 16 SER CA C 16 57.282 57.282 59.589 -2.307 18933 2275 1 4 . 1 1 16 16 SER CB C 16 63.683 63.683 63.338 0.345 18933 2276 1 4 . 1 1 16 16 SER H H 16 6.963 6.963 8.085 -1.122 18933 2277 1 4 . 1 1 17 17 ARG N N 17 122.775 122.775 121.644 1.131 18933 2278 1 4 . 1 1 17 17 ARG C C 17 174.590 174.590 173.964 0.626 18933 2279 1 4 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.904 1.369 18933 2280 1 4 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.319 1.483 18933 2281 1 4 . 1 1 17 17 ARG H H 17 7.781 7.781 8.201 -0.420 18933 2282 1 4 . 1 1 18 18 LEU N N 18 122.421 122.421 125.923 -3.502 18933 2283 1 4 . 1 1 18 18 LEU C C 18 176.281 176.281 173.984 2.297 18933 2284 1 4 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.453 0.327 18933 2285 1 4 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.839 -3.628 18933 2286 1 4 . 1 1 18 18 LEU H H 18 8.650 8.650 7.752 0.898 18933 2287 1 4 . 1 1 19 19 ALA N N 19 126.441 126.441 127.084 -0.643 18933 2288 1 4 . 1 1 19 19 ALA C C 19 173.904 173.904 174.856 -0.952 18933 2289 1 4 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.496 -0.630 18933 2290 1 4 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.291 0.574 18933 2291 1 4 . 1 1 19 19 ALA H H 19 8.609 8.609 8.904 -0.295 18933 2292 1 4 . 1 1 20 20 PHE N N 20 114.600 114.600 119.055 -4.455 18933 2293 1 4 . 1 1 20 20 PHE C C 20 172.592 172.592 173.960 -1.368 18933 2294 1 4 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.858 0.931 18933 2295 1 4 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.542 -0.853 18933 2296 1 4 . 1 1 20 20 PHE H H 20 8.801 8.801 9.080 -0.279 18933 2297 1 4 . 1 1 21 21 GLU N N 21 122.873 122.873 123.528 -0.655 18933 2298 1 4 . 1 1 21 21 GLU C C 21 174.872 174.872 175.250 -0.378 18933 2299 1 4 . 1 1 21 21 GLU CA C 21 55.062 55.062 54.965 0.097 18933 2300 1 4 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.209 -0.484 18933 2301 1 4 . 1 1 21 21 GLU H H 21 7.847 7.847 9.158 -1.311 18933 2302 1 4 . 1 1 22 22 TYR N N 22 126.270 126.270 126.477 -0.207 18933 2303 1 4 . 1 1 22 22 TYR C C 22 174.872 174.872 174.760 0.112 18933 2304 1 4 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.560 -0.812 18933 2305 1 4 . 1 1 22 22 TYR CB C 22 40.105 40.105 40.978 -0.873 18933 2306 1 4 . 1 1 22 22 TYR H H 22 8.806 8.806 9.134 -0.328 18933 2307 1 4 . 1 1 23 23 ASN N N 23 128.420 128.420 125.704 2.716 18933 2308 1 4 . 1 1 23 23 ASN C C 23 175.435 175.435 175.045 0.390 18933 2309 1 4 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.592 -0.587 18933 2310 1 4 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.759 -1.394 18933 2311 1 4 . 1 1 23 23 ASN H H 23 8.943 8.943 9.086 -0.143 18933 2312 1 4 . 1 1 24 24 GLY N N 24 104.067 104.067 102.007 2.060 18933 2313 1 4 . 1 1 24 24 GLY C C 24 173.707 173.707 173.833 -0.126 18933 2314 1 4 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.928 0.005 18933 2315 1 4 . 1 1 24 24 GLY H H 24 8.534 8.534 8.134 0.400 18933 2316 1 4 . 1 1 25 25 GLN N N 25 120.038 120.038 119.790 0.248 18933 2317 1 4 . 1 1 25 25 GLN C C 25 173.744 173.744 174.919 -1.175 18933 2318 1 4 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.386 -1.058 18933 2319 1 4 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.267 0.394 18933 2320 1 4 . 1 1 25 25 GLN H H 25 7.595 7.595 7.811 -0.216 18933 2321 1 4 . 1 1 26 26 LEU N N 26 124.681 124.681 124.954 -0.273 18933 2322 1 4 . 1 1 26 26 LEU C C 26 175.987 175.987 176.165 -0.178 18933 2323 1 4 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.511 -0.498 18933 2324 1 4 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.324 -1.459 18933 2325 1 4 . 1 1 26 26 LEU H H 26 8.382 8.382 8.588 -0.206 18933 2326 1 4 . 1 1 27 27 ILE N N 27 130.779 130.779 127.301 3.478 18933 2327 1 4 . 1 1 27 27 ILE C C 27 175.215 175.215 174.268 0.947 18933 2328 1 4 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.717 -0.458 18933 2329 1 4 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.109 -2.377 18933 2330 1 4 . 1 1 27 27 ILE H H 27 8.882 8.882 8.915 -0.033 18933 2331 1 4 . 1 1 28 28 LYS N N 28 126.160 126.160 127.355 -1.195 18933 2332 1 4 . 1 1 28 28 LYS C C 28 176.771 176.771 175.679 1.092 18933 2333 1 4 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.746 2.092 18933 2334 1 4 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.352 -1.613 18933 2335 1 4 . 1 1 28 28 LYS H H 28 8.165 8.165 8.316 -0.151 18933 2336 1 4 . 1 1 29 29 ILE N N 29 126.380 126.380 121.175 5.205 18933 2337 1 4 . 1 1 29 29 ILE C C 29 175.877 175.877 173.938 1.939 18933 2338 1 4 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.393 -0.085 18933 2339 1 4 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.603 -2.540 18933 2340 1 4 . 1 1 29 29 ILE H H 29 8.019 8.019 8.729 -0.710 18933 2341 1 4 . 1 1 30 30 LEU N N 30 129.215 129.215 122.283 6.932 18933 2342 1 4 . 1 1 30 30 LEU C C 30 178.867 178.867 178.155 0.712 18933 2343 1 4 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.341 1.278 18933 2344 1 4 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.585 -4.720 18933 2345 1 4 . 1 1 30 30 LEU H H 30 8.917 8.917 8.289 0.628 18933 2346 1 4 . 1 1 31 31 SER N N 31 117.997 117.997 116.264 1.733 18933 2347 1 4 . 1 1 31 31 SER C C 31 177.396 177.396 175.668 1.728 18933 2348 1 4 . 1 1 31 31 SER CA C 31 61.236 61.236 61.005 0.231 18933 2349 1 4 . 1 1 31 31 SER CB C 31 62.035 62.035 63.262 -1.227 18933 2350 1 4 . 1 1 31 31 SER H H 31 8.594 8.594 8.865 -0.271 18933 2351 1 4 . 1 1 32 32 LYS N N 32 116.189 116.189 119.362 -3.173 18933 2352 1 4 . 1 1 32 32 LYS C C 32 176.244 176.244 176.896 -0.652 18933 2353 1 4 . 1 1 32 32 LYS CA C 32 57.403 57.403 57.891 -0.488 18933 2354 1 4 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.469 -2.188 18933 2355 1 4 . 1 1 32 32 LYS H H 32 8.029 8.029 8.159 -0.130 18933 2356 1 4 . 1 1 33 33 ASN N N 33 119.061 119.061 116.364 2.697 18933 2357 1 4 . 1 1 33 33 ASN C C 33 172.384 172.384 173.681 -1.297 18933 2358 1 4 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.865 -1.708 18933 2359 1 4 . 1 1 33 33 ASN CB C 33 38.267 38.267 40.927 -2.660 18933 2360 1 4 . 1 1 33 33 ASN H H 33 7.902 7.902 7.770 0.132 18933 2361 1 4 . 1 1 34 34 ILE N N 34 120.038 120.038 119.466 0.572 18933 2362 1 4 . 1 1 34 34 ILE C C 34 175.607 175.607 174.339 1.268 18933 2363 1 4 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.242 0.308 18933 2364 1 4 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.873 -2.909 18933 2365 1 4 . 1 1 34 34 ILE H H 34 7.443 7.443 7.769 -0.326 18933 2366 1 4 . 1 1 35 35 VAL N N 35 129.435 129.435 126.191 3.244 18933 2367 1 4 . 1 1 35 35 VAL C C 35 175.386 175.386 174.524 0.862 18933 2368 1 4 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.183 -0.157 18933 2369 1 4 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.577 -0.796 18933 2370 1 4 . 1 1 35 35 VAL H H 35 9.533 9.533 8.893 0.640 18933 2371 1 4 . 1 1 36 36 ALA N N 36 130.571 130.571 129.930 0.641 18933 2372 1 4 . 1 1 36 36 ALA C C 36 177.347 177.347 176.281 1.066 18933 2373 1 4 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.996 0.403 18933 2374 1 4 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.756 -0.898 18933 2375 1 4 . 1 1 36 36 ALA H H 36 8.665 8.665 8.403 0.262 18933 2376 1 4 . 1 1 37 37 VAL N N 37 115.395 115.395 120.975 -5.580 18933 2377 1 4 . 1 1 37 37 VAL C C 37 174.455 174.455 176.182 -1.727 18933 2378 1 4 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.568 -0.188 18933 2379 1 4 . 1 1 37 37 VAL CB C 37 32.943 32.943 34.661 -1.718 18933 2380 1 4 . 1 1 37 37 VAL H H 37 8.079 8.079 8.234 -0.155 18933 2381 1 4 . 1 1 38 38 GLY N N 38 107.672 107.672 108.205 -0.533 18933 2382 1 4 . 1 1 38 38 GLY C C 38 173.364 173.364 175.594 -2.230 18933 2383 1 4 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.127 0.058 18933 2384 1 4 . 1 1 38 38 GLY H H 38 7.579 7.579 8.332 -0.753 18933 2385 1 4 . 1 1 39 39 SER N N 39 121.052 121.052 120.130 0.922 18933 2386 1 4 . 1 1 39 39 SER C C 39 175.570 175.570 176.194 -0.624 18933 2387 1 4 . 1 1 39 39 SER CA C 39 61.801 61.801 61.914 -0.113 18933 2388 1 4 . 1 1 39 39 SER CB C 39 62.478 62.478 63.273 -0.795 18933 2389 1 4 . 1 1 39 39 SER H H 39 8.953 8.953 8.154 0.799 18933 2390 1 4 . 1 1 40 40 LEU N N 40 121.553 121.553 122.135 -0.582 18933 2391 1 4 . 1 1 40 40 LEU C C 40 180.203 180.203 178.285 1.918 18933 2392 1 4 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.728 -0.599 18933 2393 1 4 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.764 -0.011 18933 2394 1 4 . 1 1 40 40 LEU H H 40 8.195 8.195 7.231 0.964 18933 2395 1 4 . 1 1 41 41 ARG N N 41 121.956 121.956 117.930 4.026 18933 2396 1 4 . 1 1 41 41 ARG C C 41 177.323 177.323 178.099 -0.776 18933 2397 1 4 . 1 1 41 41 ARG CA C 41 58.331 58.331 58.083 0.248 18933 2398 1 4 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.797 -1.354 18933 2399 1 4 . 1 1 41 41 ARG H H 41 6.873 6.873 8.113 -1.240 18933 2400 1 4 . 1 1 42 42 ARG N N 42 114.600 114.600 116.660 -2.060 18933 2401 1 4 . 1 1 42 42 ARG C C 42 172.911 172.911 175.658 -2.747 18933 2402 1 4 . 1 1 42 42 ARG CA C 42 57.242 57.242 57.056 0.186 18933 2403 1 4 . 1 1 42 42 ARG CB C 42 29.140 29.140 31.038 -1.899 18933 2404 1 4 . 1 1 42 42 ARG H H 42 7.438 7.438 8.095 -0.657 18933 2405 1 4 . 1 1 43 43 GLU N N 43 113.354 113.354 113.739 -0.385 18933 2406 1 4 . 1 1 43 43 GLU C C 43 175.999 175.999 174.971 1.028 18933 2407 1 4 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.004 -0.448 18933 2408 1 4 . 1 1 43 43 GLU CB C 43 25.337 25.337 26.826 -1.489 18933 2409 1 4 . 1 1 43 43 GLU H H 43 7.564 7.564 7.940 -0.376 18933 2410 1 4 . 1 1 44 44 GLU N N 44 119.696 119.696 120.289 -0.593 18933 2411 1 4 . 1 1 44 44 GLU C C 44 175.423 175.423 175.953 -0.530 18933 2412 1 4 . 1 1 44 44 GLU CA C 44 56.838 56.838 53.957 2.881 18933 2413 1 4 . 1 1 44 44 GLU CB C 44 28.696 28.696 28.614 0.082 18933 2414 1 4 . 1 1 44 44 GLU H H 44 7.261 7.261 7.588 -0.327 18933 2415 1 4 . 1 1 45 45 LYS N N 45 117.435 117.435 121.751 -4.316 18933 2416 1 4 . 1 1 45 45 LYS C C 45 177.715 177.715 176.973 0.742 18933 2417 1 4 . 1 1 45 45 LYS CA C 45 59.219 59.219 58.821 0.398 18933 2418 1 4 . 1 1 45 45 LYS CB C 45 32.119 32.119 32.685 -0.566 18933 2419 1 4 . 1 1 45 45 LYS H H 45 7.938 7.938 7.731 0.207 18933 2420 1 4 . 1 1 46 46 MET N N 46 115.847 115.847 117.485 -1.638 18933 2421 1 4 . 1 1 46 46 MET CA C 46 52.520 52.520 53.830 -1.310 18933 2422 1 4 . 1 1 46 46 MET CB C 46 33.450 33.450 31.581 1.869 18933 2423 1 4 . 1 1 46 46 MET H H 46 7.595 7.595 7.752 -0.157 18933 2424 1 4 . 1 1 47 47 LEU N N 47 121.627 121.627 125.480 -3.853 18933 2425 1 4 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.981 -1.855 18933 2426 1 4 . 1 1 47 47 LEU CB C 47 43.070 43.070 42.916 0.154 18933 2427 1 4 . 1 1 47 47 LEU H H 47 9.220 9.220 8.881 0.339 18933 2428 1 4 . 1 1 49 49 ASP N N 49 117.093 117.093 118.469 -1.376 18933 2429 1 4 . 1 1 49 49 ASP C C 49 173.340 173.340 174.341 -1.001 18933 2430 1 4 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.274 -1.480 18933 2431 1 4 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.779 -1.773 18933 2432 1 4 . 1 1 49 49 ASP H H 49 7.761 7.761 7.612 0.149 18933 2433 1 4 . 1 1 50 50 VAL N N 50 119.012 119.012 117.492 1.520 18933 2434 1 4 . 1 1 50 50 VAL C C 50 173.070 173.070 173.595 -0.525 18933 2435 1 4 . 1 1 50 50 VAL CA C 50 61.842 61.842 59.673 2.169 18933 2436 1 4 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.314 -0.751 18933 2437 1 4 . 1 1 50 50 VAL H H 50 8.089 8.089 8.379 -0.290 18933 2438 1 4 . 1 1 51 51 ASP N N 51 127.064 127.064 126.019 1.045 18933 2439 1 4 . 1 1 51 51 ASP C C 51 174.565 174.565 175.290 -0.725 18933 2440 1 4 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.365 -0.208 18933 2441 1 4 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.734 -1.094 18933 2442 1 4 . 1 1 51 51 ASP H H 51 8.069 8.069 8.134 -0.065 18933 2443 1 4 . 1 1 52 52 LEU N N 52 121.627 121.627 119.631 1.996 18933 2444 1 4 . 1 1 52 52 LEU C C 52 174.063 174.063 174.664 -0.601 18933 2445 1 4 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.474 -0.791 18933 2446 1 4 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.168 -2.817 18933 2447 1 4 . 1 1 52 52 LEU H H 52 8.852 8.852 8.813 0.039 18933 2448 1 4 . 1 1 53 53 LEU N N 53 123.093 123.093 123.173 -0.080 18933 2449 1 4 . 1 1 53 53 LEU CA C 53 55.991 55.991 53.922 2.069 18933 2450 1 4 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.745 -2.612 18933 2451 1 4 . 1 1 53 53 LEU H H 53 9.362 9.362 9.025 0.337 18933 2452 1 4 . 1 1 54 54 ILE N N 54 123.777 123.777 127.769 -3.992 18933 2453 1 4 . 1 1 54 54 ILE CA C 54 55.062 55.062 60.082 -5.020 18933 2454 1 4 . 1 1 54 54 ILE CB C 54 33.070 33.070 38.337 -5.266 18933 2455 1 4 . 1 1 54 54 ILE H H 54 8.907 8.907 9.421 -0.514 18933 2456 1 4 . 1 1 58 58 GLU N N 58 114.710 114.710 117.324 -2.614 18933 2457 1 4 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.114 -0.737 18933 2458 1 4 . 1 1 58 58 GLU CB C 58 31.422 31.422 32.483 -1.061 18933 2459 1 4 . 1 1 58 58 GLU H H 58 6.716 6.716 7.341 -0.625 18933 2460 1 4 . 1 1 61 61 LEU N N 61 115.957 115.957 120.578 -4.621 18933 2461 1 4 . 1 1 61 61 LEU C C 61 178.512 178.512 178.253 0.259 18933 2462 1 4 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.160 -2.380 18933 2463 1 4 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.602 -0.483 18933 2464 1 4 . 1 1 61 61 LEU H H 61 7.307 7.307 7.911 -0.604 18933 2465 1 4 . 1 1 62 62 LEU N N 62 120.038 120.038 119.439 0.599 18933 2466 1 4 . 1 1 62 62 LEU C C 62 177.874 177.874 178.708 -0.834 18933 2467 1 4 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.464 0.472 18933 2468 1 4 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.946 -1.207 18933 2469 1 4 . 1 1 62 62 LEU H H 62 7.327 7.327 8.147 -0.820 18933 2470 1 4 . 1 1 63 63 LYS N N 63 114.600 114.600 115.782 -1.182 18933 2471 1 4 . 1 1 63 63 LYS C C 63 175.460 175.460 177.796 -2.336 18933 2472 1 4 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.661 -1.097 18933 2473 1 4 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.442 -1.717 18933 2474 1 4 . 1 1 63 63 LYS H H 63 7.973 7.973 7.670 0.303 18933 2475 1 4 . 1 1 64 64 HIS N N 64 115.273 115.273 115.909 -0.636 18933 2476 1 4 . 1 1 64 64 HIS CA C 64 56.112 56.112 54.887 1.225 18933 2477 1 4 . 1 1 64 64 HIS CB C 64 32.436 32.436 29.853 2.583 18933 2478 1 4 . 1 1 64 64 HIS H H 64 7.544 7.544 7.451 0.093 18933 2479 1 4 . 1 1 65 65 VAL N N 65 118.682 118.682 118.885 -0.203 18933 2480 1 4 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.605 3.433 18933 2481 1 4 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.432 -2.405 18933 2482 1 4 . 1 1 65 65 VAL H H 65 6.787 6.787 7.106 -0.319 18933 2483 1 4 . 1 1 68 68 ASN N N 68 112.108 112.108 118.010 -5.902 18933 2484 1 4 . 1 1 68 68 ASN C C 68 174.884 174.884 173.972 0.912 18933 2485 1 4 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.380 -1.353 18933 2486 1 4 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.420 0.812 18933 2487 1 4 . 1 1 68 68 ASN H H 68 7.009 7.009 8.304 -1.295 18933 2488 1 4 . 1 1 69 69 ILE N N 69 123.325 123.325 123.259 0.066 18933 2489 1 4 . 1 1 69 69 ILE C C 69 174.394 174.394 175.524 -1.130 18933 2490 1 4 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.622 -1.515 18933 2491 1 4 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.636 -0.369 18933 2492 1 4 . 1 1 69 69 ILE H H 69 7.150 7.150 8.270 -1.120 18933 2493 1 4 . 1 1 70 70 ARG N N 70 126.722 126.722 128.274 -1.552 18933 2494 1 4 . 1 1 70 70 ARG C C 70 174.590 174.590 174.092 0.498 18933 2495 1 4 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.712 -1.465 18933 2496 1 4 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.968 -2.595 18933 2497 1 4 . 1 1 70 70 ARG H H 70 8.902 8.902 9.158 -0.256 18933 2498 1 4 . 1 1 71 71 ILE N N 71 119.978 119.978 120.898 -0.920 18933 2499 1 4 . 1 1 71 71 ILE C C 71 175.583 175.583 175.759 -0.176 18933 2500 1 4 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.751 0.073 18933 2501 1 4 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.246 -2.486 18933 2502 1 4 . 1 1 71 71 ILE H H 71 7.491 7.491 8.827 -1.336 18933 2503 1 4 . 1 1 72 72 LYS N N 72 128.530 128.530 124.660 3.870 18933 2504 1 4 . 1 1 72 72 LYS C C 72 177.703 177.703 176.314 1.389 18933 2505 1 4 . 1 1 72 72 LYS CA C 72 57.201 57.201 54.749 2.451 18933 2506 1 4 . 1 1 72 72 LYS CB C 72 31.485 31.485 31.018 0.467 18933 2507 1 4 . 1 1 72 72 LYS H H 72 8.523 8.523 8.569 -0.046 18933 2508 1 4 . 1 1 73 73 GLY N N 73 113.806 113.806 110.249 3.557 18933 2509 1 4 . 1 1 73 73 GLY C C 73 173.781 173.781 172.976 0.805 18933 2510 1 4 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.220 0.602 18933 2511 1 4 . 1 1 73 73 GLY H H 73 8.791 8.791 8.374 0.417 18933 2512 1 4 . 1 1 74 74 LEU N N 74 120.490 120.490 118.385 2.105 18933 2513 1 4 . 1 1 74 74 LEU C C 74 175.840 175.840 173.550 2.290 18933 2514 1 4 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.408 -0.717 18933 2515 1 4 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.177 -1.016 18933 2516 1 4 . 1 1 74 74 LEU H H 74 7.393 7.393 7.318 0.075 18933 2517 1 4 . 1 1 75 75 SER N N 75 120.038 120.038 115.816 4.222 18933 2518 1 4 . 1 1 75 75 SER C C 75 173.205 173.205 173.156 0.049 18933 2519 1 4 . 1 1 75 75 SER CA C 75 57.887 57.887 57.828 0.059 18933 2520 1 4 . 1 1 75 75 SER CB C 75 63.049 63.049 64.809 -1.760 18933 2521 1 4 . 1 1 75 75 SER H H 75 8.917 8.917 8.128 0.789 18933 2522 1 4 . 1 1 76 76 PHE N N 76 119.586 119.586 118.344 1.242 18933 2523 1 4 . 1 1 76 76 PHE C C 76 173.536 173.536 173.752 -0.216 18933 2524 1 4 . 1 1 76 76 PHE CA C 76 55.426 55.426 56.025 -0.599 18933 2525 1 4 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.617 -0.611 18933 2526 1 4 . 1 1 76 76 PHE H H 76 8.003 8.003 8.307 -0.304 18933 2527 1 4 . 1 1 77 77 SER N N 77 114.943 114.943 116.262 -1.319 18933 2528 1 4 . 1 1 77 77 SER C C 77 173.438 173.438 172.723 0.715 18933 2529 1 4 . 1 1 77 77 SER CA C 77 56.152 56.152 57.048 -0.896 18933 2530 1 4 . 1 1 77 77 SER CB C 77 65.204 65.204 65.418 -0.214 18933 2531 1 4 . 1 1 77 77 SER H H 77 8.907 8.907 8.856 0.051 18933 2532 1 4 . 1 1 78 78 VAL N N 78 124.791 124.791 123.758 1.033 18933 2533 1 4 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.138 1.906 18933 2534 1 4 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.282 -2.100 18933 2535 1 4 . 1 1 78 78 VAL H H 78 8.892 8.892 8.450 0.442 18933 2536 1 4 . 1 1 79 79 LYS N N 79 129.667 129.667 128.907 0.760 18933 2537 1 4 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.538 1.654 18933 2538 1 4 . 1 1 79 79 LYS CB C 79 32.372 32.372 34.642 -2.270 18933 2539 1 4 . 1 1 79 79 LYS H H 79 9.049 9.049 9.051 -0.002 18933 2540 1 4 . 1 1 82 82 GLY N N 82 117.263 117.263 112.817 4.446 18933 2541 1 4 . 1 1 82 82 GLY C C 82 171.710 171.710 174.962 -3.252 18933 2542 1 4 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.466 -2.541 18933 2543 1 4 . 1 1 82 82 GLY H H 82 8.044 8.044 8.403 -0.359 18933 2544 1 4 . 1 1 83 83 GLU N N 83 117.203 117.203 122.164 -4.961 18933 2545 1 4 . 1 1 83 83 GLU C C 83 178.695 178.695 177.978 0.717 18933 2546 1 4 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.839 1.138 18933 2547 1 4 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.780 0.057 18933 2548 1 4 . 1 1 83 83 GLU H H 83 8.296 8.296 8.552 -0.256 18933 2549 1 4 . 1 1 84 84 ARG N N 84 113.818 113.818 119.114 -5.296 18933 2550 1 4 . 1 1 84 84 ARG C C 84 175.877 175.877 175.209 0.668 18933 2551 1 4 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.105 -1.374 18933 2552 1 4 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.087 2.208 18933 2553 1 4 . 1 1 84 84 ARG H H 84 8.342 8.342 8.009 0.333 18933 2554 1 4 . 1 1 85 85 LYS N N 85 119.354 119.354 121.396 -2.042 18933 2555 1 4 . 1 1 85 85 LYS C C 85 174.516 174.516 174.235 0.281 18933 2556 1 4 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.458 -0.718 18933 2557 1 4 . 1 1 85 85 LYS CB C 85 34.844 34.844 35.283 -0.439 18933 2558 1 4 . 1 1 85 85 LYS H H 85 6.822 6.822 7.603 -0.781 18933 2559 1 4 . 1 1 86 86 CYS N N 86 125.928 125.928 124.684 1.244 18933 2560 1 4 . 1 1 86 86 CYS C C 86 171.600 171.600 173.098 -1.498 18933 2561 1 4 . 1 1 86 86 CYS CA C 86 55.627 55.627 58.099 -2.471 18933 2562 1 4 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.236 0.108 18933 2563 1 4 . 1 1 86 86 CYS H H 86 9.084 9.084 9.128 -0.044 18933 2564 1 4 . 1 1 87 87 VAL N N 87 126.612 126.612 126.333 0.279 18933 2565 1 4 . 1 1 87 87 VAL C C 87 174.431 174.431 174.574 -0.143 18933 2566 1 4 . 1 1 87 87 VAL CA C 87 61.317 61.317 62.004 -0.687 18933 2567 1 4 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.635 0.561 18933 2568 1 4 . 1 1 87 87 VAL H H 87 8.705 8.705 9.011 -0.306 18933 2569 1 4 . 1 1 88 88 LEU N N 88 127.748 127.748 123.341 4.407 18933 2570 1 4 . 1 1 88 88 LEU C C 88 175.227 175.227 174.354 0.873 18933 2571 1 4 . 1 1 88 88 LEU CA C 88 52.520 52.520 53.087 -0.567 18933 2572 1 4 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.630 -2.025 18933 2573 1 4 . 1 1 88 88 LEU H H 88 9.417 9.417 8.582 0.835 18933 2574 1 4 . 1 1 89 89 PHE N N 89 120.981 120.981 118.413 2.568 18933 2575 1 4 . 1 1 89 89 PHE C C 89 176.906 176.906 176.081 0.825 18933 2576 1 4 . 1 1 89 89 PHE CA C 89 55.587 55.587 56.115 -0.528 18933 2577 1 4 . 1 1 89 89 PHE CB C 89 38.901 38.901 42.020 -3.119 18933 2578 1 4 . 1 1 89 89 PHE H H 89 8.937 8.937 8.564 0.373 18933 2579 1 4 . 1 1 90 90 ILE N N 90 119.928 119.928 118.423 1.505 18933 2580 1 4 . 1 1 90 90 ILE C C 90 173.781 173.781 175.089 -1.308 18933 2581 1 4 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.896 -1.242 18933 2582 1 4 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.471 1.141 18933 2583 1 4 . 1 1 90 90 ILE H H 90 9.230 9.230 9.060 0.170 18933 2584 1 4 . 1 1 91 91 GLU N N 91 124.339 124.339 124.875 -0.536 18933 2585 1 4 . 1 1 91 91 GLU C C 91 175.607 175.607 175.181 0.426 18933 2586 1 4 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.891 -0.272 18933 2587 1 4 . 1 1 91 91 GLU CB C 91 29.837 29.837 32.800 -2.963 18933 2588 1 4 . 1 1 91 91 GLU H H 91 8.175 8.175 8.974 -0.799 18933 2589 1 4 . 1 1 92 92 TRP N N 92 127.516 127.516 124.869 2.647 18933 2590 1 4 . 1 1 92 92 TRP C C 92 175.203 175.203 176.154 -0.951 18933 2591 1 4 . 1 1 92 92 TRP CA C 92 56.233 56.233 55.122 1.111 18933 2592 1 4 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.206 1.455 18933 2593 1 4 . 1 1 92 92 TRP H H 92 9.306 9.306 8.025 1.281 18933 2594 1 4 . 1 1 93 93 GLU N N 93 127.834 127.834 123.313 4.521 18933 2595 1 4 . 1 1 93 93 GLU C C 93 175.668 175.668 176.404 -0.736 18933 2596 1 4 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.489 -0.611 18933 2597 1 4 . 1 1 93 93 GLU CB C 93 26.034 26.034 29.397 -3.363 18933 2598 1 4 . 1 1 93 93 GLU H H 93 8.796 8.796 8.794 0.002 18933 2599 1 4 . 1 1 94 94 LYS N N 94 108.931 108.931 114.839 -5.908 18933 2600 1 4 . 1 1 94 94 LYS C C 94 175.423 175.423 175.820 -0.397 18933 2601 1 4 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.681 -0.237 18933 2602 1 4 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.762 -3.129 18933 2603 1 4 . 1 1 94 94 LYS H H 94 8.498 8.498 8.543 -0.045 18933 2604 1 4 . 1 1 95 95 LYS N N 95 121.737 121.737 119.239 2.498 18933 2605 1 4 . 1 1 95 95 LYS C C 95 174.443 174.443 175.340 -0.897 18933 2606 1 4 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.010 -1.593 18933 2607 1 4 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.505 -0.041 18933 2608 1 4 . 1 1 95 95 LYS H H 95 7.761 7.761 7.462 0.299 18933 2609 1 4 . 1 1 96 96 THR N N 96 116.067 116.067 115.934 0.133 18933 2610 1 4 . 1 1 96 96 THR C C 96 174.296 174.296 173.407 0.889 18933 2611 1 4 . 1 1 96 96 THR CA C 96 61.115 61.115 61.048 0.067 18933 2612 1 4 . 1 1 96 96 THR CB C 96 69.450 69.450 71.150 -1.700 18933 2613 1 4 . 1 1 96 96 THR H H 96 7.761 7.761 8.329 -0.568 18933 2614 1 4 . 1 1 97 97 TYR N N 97 124.229 124.229 125.155 -0.926 18933 2615 1 4 . 1 1 97 97 TYR C C 97 173.536 173.536 173.714 -0.178 18933 2616 1 4 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.535 -0.584 18933 2617 1 4 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.746 -1.564 18933 2618 1 4 . 1 1 97 97 TYR H H 97 9.018 9.018 9.292 -0.274 18933 2619 1 4 . 1 1 98 98 GLN N N 98 123.435 123.435 124.185 -0.750 18933 2620 1 4 . 1 1 98 98 GLN C C 98 173.266 173.266 173.633 -0.367 18933 2621 1 4 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.639 -0.496 18933 2622 1 4 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.322 -0.309 18933 2623 1 4 . 1 1 98 98 GLN H H 98 8.781 8.781 8.943 -0.162 18933 2624 1 4 . 1 1 99 99 LEU N N 99 130.119 130.119 128.566 1.553 18933 2625 1 4 . 1 1 99 99 LEU C C 99 173.867 173.867 174.152 -0.285 18933 2626 1 4 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.309 -0.790 18933 2627 1 4 . 1 1 99 99 LEU CB C 99 44.605 44.605 44.965 -0.360 18933 2628 1 4 . 1 1 99 99 LEU H H 99 9.104 9.104 8.421 0.683 18933 2629 1 4 . 1 1 100 100 ASP N N 100 125.182 125.182 127.848 -2.666 18933 2630 1 4 . 1 1 100 100 ASP C C 100 172.837 172.837 175.080 -2.243 18933 2631 1 4 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.022 -1.268 18933 2632 1 4 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.330 -3.986 18933 2633 1 4 . 1 1 100 100 ASP H H 100 9.089 9.089 8.623 0.466 18933 2634 1 4 . 1 1 101 101 LEU N N 101 121.174 121.174 123.472 -2.298 18933 2635 1 4 . 1 1 101 101 LEU C C 101 174.529 174.529 176.104 -1.575 18933 2636 1 4 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.343 -1.428 18933 2637 1 4 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.080 -1.172 18933 2638 1 4 . 1 1 101 101 LEU H H 101 8.458 8.458 9.195 -0.737 18933 2639 1 4 . 1 1 102 102 PHE N N 102 119.464 119.464 120.167 -0.703 18933 2640 1 4 . 1 1 102 102 PHE C C 102 176.293 176.293 174.708 1.585 18933 2641 1 4 . 1 1 102 102 PHE CA C 102 54.054 54.054 56.227 -2.173 18933 2642 1 4 . 1 1 102 102 PHE CB C 102 41.880 41.880 43.107 -1.227 18933 2643 1 4 . 1 1 102 102 PHE H H 102 8.281 8.281 9.183 -0.902 18933 2644 1 4 . 1 1 103 103 THR N N 103 108.576 108.576 117.630 -9.054 18933 2645 1 4 . 1 1 103 103 THR C C 103 174.933 174.933 173.341 1.592 18933 2646 1 4 . 1 1 103 103 THR CA C 103 57.726 57.726 60.221 -2.495 18933 2647 1 4 . 1 1 103 103 THR CB C 103 71.288 71.288 69.886 1.402 18933 2648 1 4 . 1 1 103 103 THR H H 103 7.872 7.872 8.246 -0.374 18933 2649 1 4 . 1 1 104 104 ALA N N 104 122.885 122.885 128.923 -6.038 18933 2650 1 4 . 1 1 104 104 ALA C C 104 175.754 175.754 174.816 0.938 18933 2651 1 4 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.849 0.169 18933 2652 1 4 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.692 -0.207 18933 2653 1 4 . 1 1 104 104 ALA H H 104 8.660 8.660 9.353 -0.693 18933 2654 1 4 . 1 1 105 105 LEU N N 105 120.881 120.881 119.632 1.249 18933 2655 1 4 . 1 1 105 105 LEU C C 105 179.504 179.504 179.237 0.267 18933 2656 1 4 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.096 -0.849 18933 2657 1 4 . 1 1 105 105 LEU CB C 105 41.753 41.753 42.989 -1.236 18933 2658 1 4 . 1 1 105 105 LEU H H 105 8.226 8.226 8.332 -0.106 18933 2659 1 4 . 1 1 106 106 ALA N N 106 124.901 124.901 124.499 0.402 18933 2660 1 4 . 1 1 106 106 ALA C C 106 181.269 181.269 179.071 2.198 18933 2661 1 4 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.859 1.454 18933 2662 1 4 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.861 -1.637 18933 2663 1 4 . 1 1 106 106 ALA H H 106 8.392 8.392 8.613 -0.221 18933 2664 1 4 . 1 1 107 107 GLU N N 107 116.409 116.409 115.676 0.733 18933 2665 1 4 . 1 1 107 107 GLU C C 107 177.764 177.764 177.283 0.481 18933 2666 1 4 . 1 1 107 107 GLU CA C 107 58.533 58.533 57.997 0.536 18933 2667 1 4 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.357 -1.421 18933 2668 1 4 . 1 1 107 107 GLU H H 107 9.664 9.664 8.691 0.973 18933 2669 1 4 . 1 1 108 108 GLU N N 108 116.189 116.189 118.868 -2.679 18933 2670 1 4 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.664 -1.521 18933 2671 1 4 . 1 1 108 108 GLU CB C 108 29.837 29.837 29.094 0.743 18933 2672 1 4 . 1 1 108 108 GLU H H 108 7.589 7.589 7.808 -0.219 18933 2673 1 4 . 1 1 109 109 LYS N N 109 119.928 119.928 121.154 -1.226 18933 2674 1 4 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.425 1.427 18933 2675 1 4 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.810 -0.339 18933 2676 1 4 . 1 1 109 109 LYS H H 109 7.514 7.514 7.575 -0.061 18933 2677 1 4 . 1 1 111 111 TYR N N 111 114.930 114.930 118.876 -3.946 18933 2678 1 4 . 1 1 111 111 TYR C C 111 179.504 179.504 177.845 1.659 18933 2679 1 4 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.093 -2.075 18933 2680 1 4 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.484 -1.816 18933 2681 1 4 . 1 1 111 111 TYR H H 111 6.393 6.393 8.416 -2.023 18933 2682 1 4 . 1 1 112 112 ALA N N 112 124.901 124.901 122.211 2.690 18933 2683 1 4 . 1 1 112 112 ALA C C 112 179.173 179.173 179.232 -0.059 18933 2684 1 4 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.538 -0.637 18933 2685 1 4 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.333 -0.221 18933 2686 1 4 . 1 1 112 112 ALA H H 112 8.554 8.554 8.487 0.067 18933 2687 1 4 . 1 1 113 113 ILE N N 113 119.464 119.464 119.309 0.155 18933 2688 1 4 . 1 1 113 113 ILE C C 113 178.499 178.499 177.965 0.534 18933 2689 1 4 . 1 1 113 113 ILE CA C 113 66.281 66.281 64.153 2.128 18933 2690 1 4 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.903 -0.587 18933 2691 1 4 . 1 1 113 113 ILE H H 113 8.680 8.680 7.624 1.056 18933 2692 1 4 . 1 1 114 114 PHE N N 114 122.922 122.922 121.449 1.473 18933 2693 1 4 . 1 1 114 114 PHE C C 114 178.217 178.217 177.722 0.495 18933 2694 1 4 . 1 1 114 114 PHE CA C 114 61.559 61.559 61.941 -0.382 18933 2695 1 4 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.743 0.728 18933 2696 1 4 . 1 1 114 114 PHE H H 114 7.721 7.721 8.521 -0.800 18933 2697 1 4 . 1 1 115 115 HIS N N 115 118.560 118.560 118.347 0.213 18933 2698 1 4 . 1 1 115 115 HIS C C 115 177.286 177.286 176.624 0.662 18933 2699 1 4 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.355 0.025 18933 2700 1 4 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.307 1.558 18933 2701 1 4 . 1 1 115 115 HIS H H 115 8.155 8.155 8.377 -0.222 18933 2702 1 4 . 1 1 116 116 PHE N N 116 111.472 111.472 116.818 -5.346 18933 2703 1 4 . 1 1 116 116 PHE C C 116 179.026 179.026 177.168 1.858 18933 2704 1 4 . 1 1 116 116 PHE CA C 116 59.461 59.461 60.188 -0.727 18933 2705 1 4 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.972 -1.783 18933 2706 1 4 . 1 1 116 116 PHE H H 116 8.564 8.564 7.872 0.692 18933 2707 1 4 . 1 1 117 117 THR N N 117 119.012 119.012 111.066 7.946 18933 2708 1 4 . 1 1 117 117 THR C C 117 172.935 172.935 174.895 -1.960 18933 2709 1 4 . 1 1 117 117 THR CA C 117 67.088 67.088 64.936 2.152 18933 2710 1 4 . 1 1 117 117 THR CB C 117 37.126 37.126 69.382 -32.256 18933 2711 1 4 . 1 1 117 117 THR H H 117 7.620 7.620 8.085 -0.465 18933 2712 1 4 . 1 1 118 118 GLY N N 118 107.917 107.917 109.593 -1.676 18933 2713 1 4 . 1 1 118 118 GLY CA C 118 44.167 44.167 41.974 2.193 18933 2714 1 4 . 1 1 118 118 GLY H H 118 6.666 6.666 7.479 -0.813 18933 2715 1 4 . 1 1 121 121 SER N N 121 113.354 113.354 118.191 -4.837 18933 2716 1 4 . 1 1 121 121 SER C C 121 176.061 176.061 175.971 0.090 18933 2717 1 4 . 1 1 121 121 SER CA C 121 61.035 61.035 62.507 -1.472 18933 2718 1 4 . 1 1 121 121 SER H H 121 8.322 8.322 8.358 -0.036 18933 2719 1 4 . 1 1 122 122 TYR N N 122 124.681 124.681 121.445 3.236 18933 2720 1 4 . 1 1 122 122 TYR C C 122 176.293 176.293 177.246 -0.953 18933 2721 1 4 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.669 -1.612 18933 2722 1 4 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.223 0.488 18933 2723 1 4 . 1 1 122 122 TYR H H 122 6.514 6.514 8.118 -1.604 18933 2724 1 4 . 1 1 123 123 LEU N N 123 117.997 117.997 119.710 -1.713 18933 2725 1 4 . 1 1 123 123 LEU C C 123 179.774 179.774 179.040 0.734 18933 2726 1 4 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.822 0.056 18933 2727 1 4 . 1 1 123 123 LEU CB C 123 39.978 39.978 41.033 -1.056 18933 2728 1 4 . 1 1 123 123 LEU H H 123 7.428 7.428 7.175 0.253 18933 2729 1 4 . 1 1 124 124 ILE N N 124 119.012 119.012 120.251 -1.239 18933 2730 1 4 . 1 1 124 124 ILE C C 124 178.830 178.830 177.821 1.009 18933 2731 1 4 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.338 -0.187 18933 2732 1 4 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.350 -0.287 18933 2733 1 4 . 1 1 124 124 ILE H H 124 8.453 8.453 8.442 0.011 18933 2734 1 4 . 1 1 125 125 ARG N N 125 121.174 121.174 120.009 1.165 18933 2735 1 4 . 1 1 125 125 ARG C C 125 179.762 179.762 178.698 1.064 18933 2736 1 4 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.972 0.085 18933 2737 1 4 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.418 -0.467 18933 2738 1 4 . 1 1 125 125 ARG H H 125 7.004 7.004 8.108 -1.105 18933 2739 1 4 . 1 1 126 126 ILE N N 126 122.299 122.299 120.779 1.520 18933 2740 1 4 . 1 1 126 126 ILE C C 126 178.352 178.352 177.193 1.159 18933 2741 1 4 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.752 -2.547 18933 2742 1 4 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.348 -1.933 18933 2743 1 4 . 1 1 126 126 ILE H H 126 7.579 7.579 7.853 -0.274 18933 2744 1 4 . 1 1 127 127 ARG N N 127 119.354 119.354 121.039 -1.685 18933 2745 1 4 . 1 1 127 127 ARG C C 127 179.786 179.786 178.622 1.164 18933 2746 1 4 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.475 0.511 18933 2747 1 4 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.099 -0.769 18933 2748 1 4 . 1 1 127 127 ARG H H 127 8.715 8.715 8.029 0.686 18933 2749 1 4 . 1 1 128 128 ALA N N 128 122.873 122.873 120.260 2.613 18933 2750 1 4 . 1 1 128 128 ALA C C 128 180.325 180.325 179.394 0.931 18933 2751 1 4 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.587 0.153 18933 2752 1 4 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.298 -1.137 18933 2753 1 4 . 1 1 128 128 ALA H H 128 7.978 7.978 8.300 -0.322 18933 2754 1 4 . 1 1 129 129 ALA N N 129 121.846 121.846 121.755 0.091 18933 2755 1 4 . 1 1 129 129 ALA C C 129 181.539 181.539 179.852 1.687 18933 2756 1 4 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.693 -0.195 18933 2757 1 4 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.766 -1.288 18933 2758 1 4 . 1 1 129 129 ALA H H 129 7.519 7.519 7.791 -0.272 18933 2759 1 4 . 1 1 130 130 LEU N N 130 119.134 119.134 118.620 0.514 18933 2760 1 4 . 1 1 130 130 LEU C C 130 179.909 179.909 178.928 0.981 18933 2761 1 4 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.126 -0.127 18933 2762 1 4 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.705 -1.283 18933 2763 1 4 . 1 1 130 130 LEU H H 130 8.296 8.296 8.657 -0.361 18933 2764 1 4 . 1 1 131 131 LYS N N 131 122.299 122.299 120.519 1.780 18933 2765 1 4 . 1 1 131 131 LYS C C 131 180.289 180.289 179.427 0.862 18933 2766 1 4 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.832 -0.815 18933 2767 1 4 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.121 -0.889 18933 2768 1 4 . 1 1 131 131 LYS H H 131 8.281 8.281 7.998 0.283 18933 2769 1 4 . 1 1 132 132 LYS N N 132 118.743 118.743 118.463 0.280 18933 2770 1 4 . 1 1 132 132 LYS C C 132 177.482 177.482 177.867 -0.385 18933 2771 1 4 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.438 0.054 18933 2772 1 4 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.102 -0.870 18933 2773 1 4 . 1 1 132 132 LYS H H 132 7.317 7.317 7.718 -0.401 18933 2774 1 4 . 1 1 133 133 LYS N N 133 117.093 117.093 117.778 -0.685 18933 2775 1 4 . 1 1 133 133 LYS C C 133 174.614 174.614 175.811 -1.197 18933 2776 1 4 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.537 -0.757 18933 2777 1 4 . 1 1 133 133 LYS CB C 133 32.182 32.182 33.002 -0.820 18933 2778 1 4 . 1 1 133 133 LYS H H 133 7.327 7.327 7.743 -0.416 18933 2779 1 4 . 1 1 134 134 ASN N N 134 113.012 113.012 115.983 -2.971 18933 2780 1 4 . 1 1 134 134 ASN C C 134 173.965 173.965 173.331 0.634 18933 2781 1 4 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.505 -0.209 18933 2782 1 4 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.597 -1.423 18933 2783 1 4 . 1 1 134 134 ASN H H 134 7.938 7.938 8.117 -0.179 18933 2784 1 4 . 1 1 135 135 TYR N N 135 115.725 115.725 119.528 -3.803 18933 2785 1 4 . 1 1 135 135 TYR C C 135 176.342 176.342 175.243 1.099 18933 2786 1 4 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.204 -1.536 18933 2787 1 4 . 1 1 135 135 TYR CB C 135 41.563 41.563 39.588 1.975 18933 2788 1 4 . 1 1 135 135 TYR H H 135 7.741 7.741 8.349 -0.608 18933 2789 1 4 . 1 1 136 136 LYS N N 136 122.641 122.641 125.723 -3.082 18933 2790 1 4 . 1 1 136 136 LYS C C 136 173.475 173.475 174.658 -1.183 18933 2791 1 4 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.619 0.282 18933 2792 1 4 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.363 -1.645 18933 2793 1 4 . 1 1 136 136 LYS H H 136 9.296 9.296 8.820 0.476 18933 2794 1 4 . 1 1 137 137 LEU N N 137 127.284 127.284 123.866 3.418 18933 2795 1 4 . 1 1 137 137 LEU C C 137 175.423 175.423 176.444 -1.021 18933 2796 1 4 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.247 -0.121 18933 2797 1 4 . 1 1 137 137 LEU CB C 137 45.746 45.746 41.777 3.969 18933 2798 1 4 . 1 1 137 137 LEU H H 137 8.776 8.776 8.512 0.264 18933 2799 1 4 . 1 1 138 138 ASN N N 138 125.818 125.818 119.498 6.320 18933 2800 1 4 . 1 1 138 138 ASN C C 138 174.933 174.933 175.119 -0.186 18933 2801 1 4 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.281 -0.164 18933 2802 1 4 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.335 -4.829 18933 2803 1 4 . 1 1 138 138 ASN H H 138 8.811 8.811 8.271 0.540 18933 2804 1 4 . 1 1 139 139 GLN N N 139 116.861 116.861 118.622 -1.761 18933 2805 1 4 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.433 -1.595 18933 2806 1 4 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.615 -2.898 18933 2807 1 4 . 1 1 139 139 GLN H H 139 9.220 9.220 8.937 0.283 18933 2808 1 4 . 1 1 140 140 TYR N N 140 120.600 120.600 120.741 -0.141 18933 2809 1 4 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.943 -1.185 18933 2810 1 4 . 1 1 140 140 TYR CB C 140 37.570 37.570 38.101 -0.531 18933 2811 1 4 . 1 1 140 140 TYR H H 140 8.549 8.549 7.778 0.771 18933 2812 1 4 . 1 1 141 141 GLY N N 141 105.986 105.986 108.534 -2.548 18933 2813 1 4 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.400 -0.556 18933 2814 1 4 . 1 1 141 141 GLY H H 141 7.186 7.186 7.799 -0.613 18933 2815 1 4 . 1 1 142 142 LEU N N 142 120.038 120.038 116.677 3.361 18933 2816 1 4 . 1 1 142 142 LEU C C 142 173.340 173.340 176.033 -2.693 18933 2817 1 4 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.342 -0.822 18933 2818 1 4 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.237 1.114 18933 2819 1 4 . 1 1 142 142 LEU H H 142 7.539 7.539 8.270 -0.731 18933 2820 1 4 . 1 1 143 143 PHE N N 143 124.229 124.229 120.058 4.171 18933 2821 1 4 . 1 1 143 143 PHE C C 143 173.977 173.977 175.377 -1.400 18933 2822 1 4 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.217 -2.576 18933 2823 1 4 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.443 4.225 18933 2824 1 4 . 1 1 143 143 PHE H H 143 9.084 9.084 9.025 0.059 18933 2825 1 4 . 1 1 144 144 LYS N N 144 127.858 127.858 123.235 4.623 18933 2826 1 4 . 1 1 144 144 LYS C C 144 175.092 175.092 176.963 -1.871 18933 2827 1 4 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.311 4.545 18933 2828 1 4 . 1 1 144 144 LYS CB C 144 38.584 38.584 35.061 3.523 18933 2829 1 4 . 1 1 144 144 LYS H H 144 9.281 9.281 8.914 0.367 18933 2830 1 4 . 1 1 145 145 ASN N N 145 128.188 128.188 125.910 2.278 18933 2831 1 4 . 1 1 145 145 ASN C C 145 175.779 175.779 175.305 0.474 18933 2832 1 4 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.576 3.150 18933 2833 1 4 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.612 -2.958 18933 2834 1 4 . 1 1 145 145 ASN H H 145 9.205 9.205 9.514 -0.308 18933 2835 1 4 . 1 1 146 146 GLN N N 146 129.655 129.655 112.406 17.249 18933 2836 1 4 . 1 1 146 146 GLN C C 146 175.399 175.399 174.457 0.942 18933 2837 1 4 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.316 1.499 18933 2838 1 4 . 1 1 146 146 GLN CB C 146 32.626 32.626 28.127 4.499 18933 2839 1 4 . 1 1 146 146 GLN H H 146 8.983 8.983 8.730 0.253 18933 2840 1 4 . 1 1 147 147 THR N N 147 117.936 117.936 115.850 2.086 18933 2841 1 4 . 1 1 147 147 THR C C 147 173.254 173.254 173.337 -0.083 18933 2842 1 4 . 1 1 147 147 THR CA C 147 61.721 61.721 62.271 -0.550 18933 2843 1 4 . 1 1 147 147 THR CB C 147 70.274 70.274 69.627 0.647 18933 2844 1 4 . 1 1 147 147 THR H H 147 8.029 8.029 7.834 0.195 18933 2845 1 4 . 1 1 148 148 LEU N N 148 130.681 130.681 131.031 -0.350 18933 2846 1 4 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.309 0.157 18933 2847 1 4 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.891 -1.202 18933 2848 1 4 . 1 1 148 148 LEU H H 148 8.635 8.635 8.898 -0.263 18933 2849 1 4 . 1 1 149 149 VAL N N 149 130.803 130.803 128.904 1.899 18933 2850 1 4 . 1 1 149 149 VAL CA C 149 59.178 59.178 57.971 1.208 18933 2851 1 4 . 1 1 149 149 VAL CB C 149 31.675 31.675 35.300 -3.625 18933 2852 1 4 . 1 1 149 149 VAL H H 149 8.968 8.968 9.198 -0.230 18933 2853 1 4 . 1 1 151 151 LEU N N 151 124.290 124.290 120.666 3.624 18933 2854 1 4 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.264 -2.251 18933 2855 1 4 . 1 1 151 151 LEU CB C 151 44.098 44.098 41.004 3.094 18933 2856 1 4 . 1 1 151 151 LEU H H 151 7.872 7.872 8.099 -0.227 18933 2857 1 4 . 1 1 153 153 ILE N N 153 114.943 114.943 114.008 0.935 18933 2858 1 4 . 1 1 153 153 ILE C C 153 175.877 175.877 174.582 1.295 18933 2859 1 4 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.521 0.173 18933 2860 1 4 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.275 1.414 18933 2861 1 4 . 1 1 153 153 ILE H H 153 7.125 7.125 7.675 -0.550 18933 2862 1 4 . 1 1 154 154 THR N N 154 111.766 111.766 113.491 -1.725 18933 2863 1 4 . 1 1 154 154 THR C C 154 174.945 174.945 174.149 0.796 18933 2864 1 4 . 1 1 154 154 THR CA C 154 62.124 62.124 62.959 -0.835 18933 2865 1 4 . 1 1 154 154 THR CB C 154 70.718 70.718 69.666 1.052 18933 2866 1 4 . 1 1 154 154 THR H H 154 9.286 9.286 8.376 0.910 18933 2867 1 4 . 1 1 155 155 THR N N 155 111.766 111.766 111.875 -0.109 18933 2868 1 4 . 1 1 155 155 THR CA C 155 58.936 58.936 60.155 -1.219 18933 2869 1 4 . 1 1 155 155 THR CB C 155 72.683 72.683 71.283 1.400 18933 2870 1 4 . 1 1 155 155 THR H H 155 7.645 7.645 7.255 0.390 18933 2871 1 4 . 1 1 157 157 LYS N N 157 119.464 119.464 119.701 -0.237 18933 2872 1 4 . 1 1 157 157 LYS C C 157 178.781 178.781 178.107 0.674 18933 2873 1 4 . 1 1 157 157 LYS CA C 157 60.026 60.026 60.282 -0.256 18933 2874 1 4 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.765 -0.343 18933 2875 1 4 . 1 1 157 157 LYS H H 157 8.175 8.175 8.504 -0.329 18933 2876 1 4 . 1 1 158 158 GLU N N 158 118.340 118.340 117.275 1.065 18933 2877 1 4 . 1 1 158 158 GLU C C 158 178.867 178.867 178.941 -0.074 18933 2878 1 4 . 1 1 158 158 GLU CA C 158 58.492 58.492 59.011 -0.519 18933 2879 1 4 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.928 0.402 18933 2880 1 4 . 1 1 158 158 GLU H H 158 7.519 7.519 8.428 -0.909 18933 2881 1 4 . 1 1 159 159 LEU N N 159 120.710 120.710 120.713 -0.003 18933 2882 1 4 . 1 1 159 159 LEU C C 159 176.526 176.526 178.537 -2.011 18933 2883 1 4 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.315 -0.145 18933 2884 1 4 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.406 -1.491 18933 2885 1 4 . 1 1 159 159 LEU H H 159 7.524 7.524 7.968 -0.444 18933 2886 1 4 . 1 1 160 160 ILE N N 160 118.217 118.217 119.050 -0.833 18933 2887 1 4 . 1 1 160 160 ILE C C 160 177.213 177.213 178.113 -0.900 18933 2888 1 4 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.322 -0.292 18933 2889 1 4 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.177 0.329 18933 2890 1 4 . 1 1 160 160 ILE H H 160 7.741 7.741 8.267 -0.526 18933 2891 1 4 . 1 1 161 161 LYS N N 161 118.450 118.450 120.281 -1.831 18933 2892 1 4 . 1 1 161 161 LYS C C 161 180.999 180.999 179.829 1.170 18933 2893 1 4 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.631 -0.816 18933 2894 1 4 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.146 -1.168 18933 2895 1 4 . 1 1 161 161 LYS H H 161 7.382 7.382 8.018 -0.636 18933 2896 1 4 . 1 1 162 162 GLU N N 162 121.846 121.846 121.137 0.709 18933 2897 1 4 . 1 1 162 162 GLU C C 162 178.818 178.818 178.460 0.358 18933 2898 1 4 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.730 -0.681 18933 2899 1 4 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.182 -1.246 18933 2900 1 4 . 1 1 162 162 GLU H H 162 8.210 8.210 7.909 0.301 18933 2901 1 4 . 1 1 163 163 LEU N N 163 116.751 116.751 114.891 1.860 18933 2902 1 4 . 1 1 163 163 LEU C C 163 176.784 176.784 177.203 -0.419 18933 2903 1 4 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.087 -0.065 18933 2904 1 4 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.874 -0.565 18933 2905 1 4 . 1 1 163 163 LEU H H 163 7.796 7.796 7.368 0.428 18933 2906 1 4 . 1 1 164 164 GLY N N 164 104.849 104.849 105.851 -1.002 18933 2907 1 4 . 1 1 164 164 GLY C C 164 174.492 174.492 174.249 0.243 18933 2908 1 4 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.647 -0.915 18933 2909 1 4 . 1 1 164 164 GLY H H 164 7.589 7.589 7.661 -0.072 18933 2910 1 4 . 1 1 165 165 PHE N N 165 118.902 118.902 120.049 -1.147 18933 2911 1 4 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.579 -0.911 18933 2912 1 4 . 1 1 165 165 PHE CB C 165 40.485 40.485 41.796 -1.311 18933 2913 1 4 . 1 1 165 165 PHE H H 165 7.251 7.251 7.827 -0.576 18933 2914 1 4 . 1 1 166 166 THR N N 166 117.093 117.093 117.364 -0.271 18933 2915 1 4 . 1 1 166 166 THR CA C 166 62.245 62.245 61.962 0.283 18933 2916 1 4 . 1 1 166 166 THR CB C 166 69.323 69.323 68.654 0.669 18933 2917 1 4 . 1 1 166 166 THR H H 166 8.407 8.407 8.488 -0.081 18933 2918 1 4 . 1 1 168 168 ARG N N 168 127.431 127.431 121.252 6.179 18933 2919 1 4 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.698 -2.460 18933 2920 1 4 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.089 -1.097 18933 2921 1 4 . 1 1 168 168 ARG H H 168 7.160 7.160 8.596 -1.436 18933 2922 1 4 . 1 1 171 171 LYS N N 171 113.574 113.574 120.054 -6.480 18933 2923 1 4 . 1 1 171 171 LYS C C 171 176.416 176.416 178.389 -1.973 18933 2924 1 4 . 1 1 171 171 LYS CA C 171 57.605 57.605 58.737 -1.132 18933 2925 1 4 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.520 0.409 18933 2926 1 4 . 1 1 171 171 LYS H H 171 8.210 8.210 8.548 -0.338 18933 2927 1 4 . 1 1 172 172 LYS N N 172 117.313 117.313 117.858 -0.545 18933 2928 1 4 . 1 1 172 172 LYS C C 172 175.717 175.717 176.492 -0.775 18933 2929 1 4 . 1 1 172 172 LYS CA C 172 54.175 54.175 57.861 -3.687 18933 2930 1 4 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.519 -0.907 18933 2931 1 4 . 1 1 172 172 LYS H H 172 7.761 7.761 7.393 0.368 18933 2932 1 4 . 1 1 173 173 ARG N N 173 122.056 122.056 118.898 3.158 18933 2933 1 4 . 1 1 173 173 ARG C C 173 172.850 172.850 174.788 -1.938 18933 2934 1 4 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.697 0.180 18933 2935 1 4 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.713 -0.207 18933 2936 1 4 . 1 1 173 173 ARG H H 173 6.885 6.885 7.622 -0.737 18933 2937 1 5 . 1 1 2 2 LEU N N 2 122.812 122.812 123.201 -0.389 18933 2938 1 5 . 1 1 2 2 LEU C C 2 175.742 175.742 177.037 -1.295 18933 2939 1 5 . 1 1 2 2 LEU CA C 2 54.134 54.134 54.045 0.089 18933 2940 1 5 . 1 1 2 2 LEU CB C 2 42.842 42.842 43.591 -0.749 18933 2941 1 5 . 1 1 2 2 LEU H H 2 8.756 8.756 7.970 0.786 18933 2942 1 5 . 1 1 3 3 THR N N 3 113.000 113.000 112.564 0.436 18933 2943 1 5 . 1 1 3 3 THR C C 3 175.938 175.938 175.388 0.550 18933 2944 1 5 . 1 1 3 3 THR CA C 3 60.550 60.550 60.441 0.110 18933 2945 1 5 . 1 1 3 3 THR CB C 3 70.781 70.781 70.589 0.192 18933 2946 1 5 . 1 1 3 3 THR H H 3 8.428 8.428 7.893 0.535 18933 2947 1 5 . 1 1 4 4 LEU N N 4 122.531 122.531 123.141 -0.610 18933 2948 1 5 . 1 1 4 4 LEU C C 4 178.463 178.463 178.284 0.179 18933 2949 1 5 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.688 -0.559 18933 2950 1 5 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.050 -2.516 18933 2951 1 5 . 1 1 4 4 LEU H H 4 7.731 7.731 7.898 -0.167 18933 2952 1 5 . 1 1 5 5 ILE N N 5 115.505 115.505 116.747 -1.242 18933 2953 1 5 . 1 1 5 5 ILE C C 5 178.573 178.573 177.941 0.632 18933 2954 1 5 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.664 -0.926 18933 2955 1 5 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.309 -0.437 18933 2956 1 5 . 1 1 5 5 ILE H H 5 7.645 7.645 7.970 -0.325 18933 2957 1 5 . 1 1 6 6 GLN N N 6 121.626 121.626 119.449 2.177 18933 2958 1 5 . 1 1 6 6 GLN C C 6 179.014 179.014 178.713 0.301 18933 2959 1 5 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.112 -0.781 18933 2960 1 5 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.672 0.517 18933 2961 1 5 . 1 1 6 6 GLN H H 6 7.645 7.645 7.828 -0.183 18933 2962 1 5 . 1 1 7 7 GLY N N 7 107.684 107.684 107.026 0.658 18933 2963 1 5 . 1 1 7 7 GLY C C 7 174.749 174.749 176.228 -1.479 18933 2964 1 5 . 1 1 7 7 GLY CA C 7 46.790 46.790 47.007 -0.217 18933 2965 1 5 . 1 1 7 7 GLY H H 7 8.660 8.660 8.055 0.605 18933 2966 1 5 . 1 1 8 8 LYS N N 8 120.942 120.942 122.255 -1.313 18933 2967 1 5 . 1 1 8 8 LYS C C 8 179.455 179.455 178.891 0.564 18933 2968 1 5 . 1 1 8 8 LYS CA C 8 59.905 59.905 58.922 0.983 18933 2969 1 5 . 1 1 8 8 LYS CB C 8 31.422 31.422 31.925 -0.503 18933 2970 1 5 . 1 1 8 8 LYS H H 8 8.518 8.518 7.542 0.976 18933 2971 1 5 . 1 1 9 9 LYS N N 9 120.710 120.710 119.962 0.748 18933 2972 1 5 . 1 1 9 9 LYS C C 9 179.823 179.823 179.263 0.560 18933 2973 1 5 . 1 1 9 9 LYS CA C 9 59.622 59.622 60.020 -0.398 18933 2974 1 5 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.441 -1.146 18933 2975 1 5 . 1 1 9 9 LYS H H 9 7.731 7.731 8.291 -0.560 18933 2976 1 5 . 1 1 10 10 ILE N N 10 121.345 121.345 120.951 0.394 18933 2977 1 5 . 1 1 10 10 ILE C C 10 177.789 177.789 178.138 -0.349 18933 2978 1 5 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.645 -1.180 18933 2979 1 5 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.115 -1.750 18933 2980 1 5 . 1 1 10 10 ILE H H 10 7.711 7.711 8.380 -0.669 18933 2981 1 5 . 1 1 11 11 VAL N N 11 120.258 120.258 120.219 0.039 18933 2982 1 5 . 1 1 11 11 VAL C C 11 177.372 177.372 178.065 -0.693 18933 2983 1 5 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.002 0.449 18933 2984 1 5 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.075 -0.541 18933 2985 1 5 . 1 1 11 11 VAL H H 11 7.918 7.918 8.429 -0.511 18933 2986 1 5 . 1 1 12 12 ASN N N 12 116.971 116.971 118.392 -1.421 18933 2987 1 5 . 1 1 12 12 ASN C C 12 177.445 177.445 177.962 -0.517 18933 2988 1 5 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.276 -0.164 18933 2989 1 5 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.389 -0.756 18933 2990 1 5 . 1 1 12 12 ASN H H 12 7.993 7.993 8.676 -0.683 18933 2991 1 5 . 1 1 13 13 HIS N N 13 120.258 120.258 119.809 0.449 18933 2992 1 5 . 1 1 13 13 HIS C C 13 177.862 177.862 177.899 -0.037 18933 2993 1 5 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.786 -0.688 18933 2994 1 5 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.360 0.872 18933 2995 1 5 . 1 1 13 13 HIS H H 13 7.741 7.741 8.295 -0.554 18933 2996 1 5 . 1 1 14 14 LEU N N 14 116.641 116.641 119.568 -2.927 18933 2997 1 5 . 1 1 14 14 LEU C C 14 179.186 179.186 178.402 0.784 18933 2998 1 5 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.305 -1.548 18933 2999 1 5 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.458 -0.339 18933 3000 1 5 . 1 1 14 14 LEU H H 14 8.221 8.221 8.579 -0.358 18933 3001 1 5 . 1 1 15 15 ARG N N 15 115.957 115.957 114.519 1.438 18933 3002 1 5 . 1 1 15 15 ARG C C 15 176.330 176.330 178.144 -1.814 18933 3003 1 5 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.473 1.230 18933 3004 1 5 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.441 -1.364 18933 3005 1 5 . 1 1 15 15 ARG H H 15 7.968 7.968 8.376 -0.408 18933 3006 1 5 . 1 1 16 16 SER N N 16 109.395 109.395 115.853 -6.458 18933 3007 1 5 . 1 1 16 16 SER C C 16 176.024 176.024 175.095 0.929 18933 3008 1 5 . 1 1 16 16 SER CA C 16 57.282 57.282 60.280 -2.998 18933 3009 1 5 . 1 1 16 16 SER CB C 16 63.683 63.683 63.796 -0.113 18933 3010 1 5 . 1 1 16 16 SER H H 16 6.963 6.963 7.459 -0.496 18933 3011 1 5 . 1 1 17 17 ARG N N 17 122.775 122.775 121.850 0.925 18933 3012 1 5 . 1 1 17 17 ARG C C 17 174.590 174.590 174.028 0.562 18933 3013 1 5 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.961 1.312 18933 3014 1 5 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.557 1.245 18933 3015 1 5 . 1 1 17 17 ARG H H 17 7.781 7.781 8.322 -0.541 18933 3016 1 5 . 1 1 18 18 LEU N N 18 122.421 122.421 125.894 -3.473 18933 3017 1 5 . 1 1 18 18 LEU C C 18 176.281 176.281 174.045 2.236 18933 3018 1 5 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.474 0.306 18933 3019 1 5 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.918 -3.707 18933 3020 1 5 . 1 1 18 18 LEU H H 18 8.650 8.650 7.813 0.837 18933 3021 1 5 . 1 1 19 19 ALA N N 19 126.441 126.441 126.917 -0.476 18933 3022 1 5 . 1 1 19 19 ALA C C 19 173.904 173.904 174.884 -0.980 18933 3023 1 5 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.541 -0.674 18933 3024 1 5 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.268 0.597 18933 3025 1 5 . 1 1 19 19 ALA H H 19 8.609 8.609 8.917 -0.308 18933 3026 1 5 . 1 1 20 20 PHE N N 20 114.600 114.600 119.041 -4.441 18933 3027 1 5 . 1 1 20 20 PHE C C 20 172.592 172.592 173.844 -1.252 18933 3028 1 5 . 1 1 20 20 PHE CA C 20 55.789 55.789 55.068 0.721 18933 3029 1 5 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.699 -1.010 18933 3030 1 5 . 1 1 20 20 PHE H H 20 8.801 8.801 9.116 -0.315 18933 3031 1 5 . 1 1 21 21 GLU N N 21 122.873 122.873 122.902 -0.029 18933 3032 1 5 . 1 1 21 21 GLU C C 21 174.872 174.872 175.182 -0.310 18933 3033 1 5 . 1 1 21 21 GLU CA C 21 55.062 55.062 54.983 0.079 18933 3034 1 5 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.344 -0.619 18933 3035 1 5 . 1 1 21 21 GLU H H 21 7.847 7.847 9.263 -1.416 18933 3036 1 5 . 1 1 22 22 TYR N N 22 126.270 126.270 126.386 -0.116 18933 3037 1 5 . 1 1 22 22 TYR C C 22 174.872 174.872 174.703 0.169 18933 3038 1 5 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.617 -0.869 18933 3039 1 5 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.176 -1.071 18933 3040 1 5 . 1 1 22 22 TYR H H 22 8.806 8.806 9.167 -0.361 18933 3041 1 5 . 1 1 23 23 ASN N N 23 128.420 128.420 125.578 2.842 18933 3042 1 5 . 1 1 23 23 ASN C C 23 175.435 175.435 175.070 0.365 18933 3043 1 5 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.491 -0.486 18933 3044 1 5 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.775 -1.410 18933 3045 1 5 . 1 1 23 23 ASN H H 23 8.943 8.943 9.057 -0.114 18933 3046 1 5 . 1 1 24 24 GLY N N 24 104.067 104.067 102.053 2.014 18933 3047 1 5 . 1 1 24 24 GLY C C 24 173.707 173.707 173.863 -0.156 18933 3048 1 5 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.997 -0.063 18933 3049 1 5 . 1 1 24 24 GLY H H 24 8.534 8.534 8.151 0.383 18933 3050 1 5 . 1 1 25 25 GLN N N 25 120.038 120.038 119.595 0.443 18933 3051 1 5 . 1 1 25 25 GLN C C 25 173.744 173.744 174.995 -1.251 18933 3052 1 5 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.338 -1.011 18933 3053 1 5 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.213 0.448 18933 3054 1 5 . 1 1 25 25 GLN H H 25 7.595 7.595 7.776 -0.181 18933 3055 1 5 . 1 1 26 26 LEU N N 26 124.681 124.681 124.558 0.123 18933 3056 1 5 . 1 1 26 26 LEU C C 26 175.987 175.987 176.294 -0.307 18933 3057 1 5 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.562 -0.549 18933 3058 1 5 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.501 -1.636 18933 3059 1 5 . 1 1 26 26 LEU H H 26 8.382 8.382 8.556 -0.174 18933 3060 1 5 . 1 1 27 27 ILE N N 27 130.779 130.779 127.257 3.522 18933 3061 1 5 . 1 1 27 27 ILE C C 27 175.215 175.215 174.295 0.920 18933 3062 1 5 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.663 -0.404 18933 3063 1 5 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.437 -2.705 18933 3064 1 5 . 1 1 27 27 ILE H H 27 8.882 8.882 8.954 -0.072 18933 3065 1 5 . 1 1 28 28 LYS N N 28 126.160 126.160 127.510 -1.350 18933 3066 1 5 . 1 1 28 28 LYS C C 28 176.771 176.771 175.716 1.055 18933 3067 1 5 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.980 1.858 18933 3068 1 5 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.074 -1.335 18933 3069 1 5 . 1 1 28 28 LYS H H 28 8.165 8.165 8.388 -0.223 18933 3070 1 5 . 1 1 29 29 ILE N N 29 126.380 126.380 122.135 4.245 18933 3071 1 5 . 1 1 29 29 ILE C C 29 175.877 175.877 174.342 1.535 18933 3072 1 5 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.561 -0.253 18933 3073 1 5 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.532 -2.469 18933 3074 1 5 . 1 1 29 29 ILE H H 29 8.019 8.019 8.726 -0.707 18933 3075 1 5 . 1 1 30 30 LEU N N 30 129.215 129.215 122.203 7.012 18933 3076 1 5 . 1 1 30 30 LEU C C 30 178.867 178.867 178.179 0.688 18933 3077 1 5 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.326 1.293 18933 3078 1 5 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.463 -4.598 18933 3079 1 5 . 1 1 30 30 LEU H H 30 8.917 8.917 8.316 0.601 18933 3080 1 5 . 1 1 31 31 SER N N 31 117.997 117.997 116.393 1.604 18933 3081 1 5 . 1 1 31 31 SER C C 31 177.396 177.396 175.699 1.697 18933 3082 1 5 . 1 1 31 31 SER CA C 31 61.236 61.236 60.810 0.426 18933 3083 1 5 . 1 1 31 31 SER CB C 31 62.035 62.035 63.185 -1.150 18933 3084 1 5 . 1 1 31 31 SER H H 31 8.594 8.594 8.851 -0.257 18933 3085 1 5 . 1 1 32 32 LYS N N 32 116.189 116.189 119.521 -3.332 18933 3086 1 5 . 1 1 32 32 LYS C C 32 176.244 176.244 176.966 -0.722 18933 3087 1 5 . 1 1 32 32 LYS CA C 32 57.403 57.403 57.859 -0.456 18933 3088 1 5 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.528 -2.247 18933 3089 1 5 . 1 1 32 32 LYS H H 32 8.029 8.029 8.137 -0.108 18933 3090 1 5 . 1 1 33 33 ASN N N 33 119.061 119.061 116.334 2.727 18933 3091 1 5 . 1 1 33 33 ASN C C 33 172.384 172.384 173.716 -1.332 18933 3092 1 5 . 1 1 33 33 ASN CA C 33 52.157 52.157 54.007 -1.850 18933 3093 1 5 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.108 -2.841 18933 3094 1 5 . 1 1 33 33 ASN H H 33 7.902 7.902 7.832 0.070 18933 3095 1 5 . 1 1 34 34 ILE N N 34 120.038 120.038 119.766 0.272 18933 3096 1 5 . 1 1 34 34 ILE C C 34 175.607 175.607 174.239 1.368 18933 3097 1 5 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.136 0.414 18933 3098 1 5 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.629 -2.665 18933 3099 1 5 . 1 1 34 34 ILE H H 34 7.443 7.443 7.873 -0.430 18933 3100 1 5 . 1 1 35 35 VAL N N 35 129.435 129.435 126.108 3.327 18933 3101 1 5 . 1 1 35 35 VAL C C 35 175.386 175.386 174.689 0.697 18933 3102 1 5 . 1 1 35 35 VAL CA C 35 60.026 60.026 59.706 0.320 18933 3103 1 5 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.122 -0.341 18933 3104 1 5 . 1 1 35 35 VAL H H 35 9.533 9.533 8.889 0.644 18933 3105 1 5 . 1 1 36 36 ALA N N 36 130.571 130.571 129.873 0.698 18933 3106 1 5 . 1 1 36 36 ALA C C 36 177.347 177.347 176.417 0.930 18933 3107 1 5 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.671 0.728 18933 3108 1 5 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.766 -0.908 18933 3109 1 5 . 1 1 36 36 ALA H H 36 8.665 8.665 8.519 0.146 18933 3110 1 5 . 1 1 37 37 VAL N N 37 115.395 115.395 121.342 -5.947 18933 3111 1 5 . 1 1 37 37 VAL C C 37 174.455 174.455 176.362 -1.907 18933 3112 1 5 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.492 -0.112 18933 3113 1 5 . 1 1 37 37 VAL CB C 37 32.943 32.943 34.903 -1.960 18933 3114 1 5 . 1 1 37 37 VAL H H 37 8.079 8.079 8.285 -0.206 18933 3115 1 5 . 1 1 38 38 GLY N N 38 107.672 107.672 108.151 -0.479 18933 3116 1 5 . 1 1 38 38 GLY C C 38 173.364 173.364 175.679 -2.315 18933 3117 1 5 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.197 -0.012 18933 3118 1 5 . 1 1 38 38 GLY H H 38 7.579 7.579 8.286 -0.707 18933 3119 1 5 . 1 1 39 39 SER N N 39 121.052 121.052 119.825 1.227 18933 3120 1 5 . 1 1 39 39 SER C C 39 175.570 175.570 176.422 -0.852 18933 3121 1 5 . 1 1 39 39 SER CA C 39 61.801 61.801 62.054 -0.253 18933 3122 1 5 . 1 1 39 39 SER CB C 39 62.478 62.478 63.310 -0.832 18933 3123 1 5 . 1 1 39 39 SER H H 39 8.953 8.953 8.057 0.896 18933 3124 1 5 . 1 1 40 40 LEU N N 40 121.553 121.553 119.632 1.921 18933 3125 1 5 . 1 1 40 40 LEU C C 40 180.203 180.203 177.697 2.506 18933 3126 1 5 . 1 1 40 40 LEU CA C 40 58.129 58.129 57.725 0.404 18933 3127 1 5 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.989 -0.235 18933 3128 1 5 . 1 1 40 40 LEU H H 40 8.195 8.195 7.304 0.891 18933 3129 1 5 . 1 1 41 41 ARG N N 41 121.956 121.956 116.546 5.410 18933 3130 1 5 . 1 1 41 41 ARG C C 41 177.323 177.323 177.753 -0.430 18933 3131 1 5 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.865 0.466 18933 3132 1 5 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.912 -1.469 18933 3133 1 5 . 1 1 41 41 ARG H H 41 6.873 6.873 7.914 -1.041 18933 3134 1 5 . 1 1 42 42 ARG N N 42 114.600 114.600 116.869 -2.269 18933 3135 1 5 . 1 1 42 42 ARG C C 42 172.911 172.911 175.786 -2.875 18933 3136 1 5 . 1 1 42 42 ARG CA C 42 57.242 57.242 56.796 0.446 18933 3137 1 5 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.794 -1.654 18933 3138 1 5 . 1 1 42 42 ARG H H 42 7.438 7.438 7.973 -0.535 18933 3139 1 5 . 1 1 43 43 GLU N N 43 113.354 113.354 116.755 -3.401 18933 3140 1 5 . 1 1 43 43 GLU C C 43 175.999 175.999 175.622 0.377 18933 3141 1 5 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.094 -0.538 18933 3142 1 5 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.345 -2.007 18933 3143 1 5 . 1 1 43 43 GLU H H 43 7.564 7.564 7.966 -0.402 18933 3144 1 5 . 1 1 44 44 GLU N N 44 119.696 119.696 123.528 -3.832 18933 3145 1 5 . 1 1 44 44 GLU C C 44 175.423 175.423 176.969 -1.546 18933 3146 1 5 . 1 1 44 44 GLU CA C 44 56.838 56.838 58.120 -1.282 18933 3147 1 5 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.436 -1.740 18933 3148 1 5 . 1 1 44 44 GLU H H 44 7.261 7.261 8.778 -1.517 18933 3149 1 5 . 1 1 45 45 LYS N N 45 117.435 117.435 116.864 0.571 18933 3150 1 5 . 1 1 45 45 LYS C C 45 177.715 177.715 175.915 1.800 18933 3151 1 5 . 1 1 45 45 LYS CA C 45 59.219 59.219 56.977 2.242 18933 3152 1 5 . 1 1 45 45 LYS CB C 45 32.119 32.119 34.482 -2.363 18933 3153 1 5 . 1 1 45 45 LYS H H 45 7.938 7.938 8.190 -0.252 18933 3154 1 5 . 1 1 46 46 MET N N 46 115.847 115.847 118.287 -2.440 18933 3155 1 5 . 1 1 46 46 MET CA C 46 52.520 52.520 53.927 -1.407 18933 3156 1 5 . 1 1 46 46 MET CB C 46 33.450 33.450 35.307 -1.857 18933 3157 1 5 . 1 1 46 46 MET H H 46 7.595 7.595 8.111 -0.516 18933 3158 1 5 . 1 1 47 47 LEU N N 47 121.627 121.627 121.823 -0.196 18933 3159 1 5 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.051 -0.925 18933 3160 1 5 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.530 -0.460 18933 3161 1 5 . 1 1 47 47 LEU H H 47 9.220 9.220 8.839 0.381 18933 3162 1 5 . 1 1 49 49 ASP N N 49 117.093 117.093 118.102 -1.009 18933 3163 1 5 . 1 1 49 49 ASP C C 49 173.340 173.340 174.361 -1.021 18933 3164 1 5 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.598 -1.804 18933 3165 1 5 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.514 -1.508 18933 3166 1 5 . 1 1 49 49 ASP H H 49 7.761 7.761 7.501 0.260 18933 3167 1 5 . 1 1 50 50 VAL N N 50 119.012 119.012 118.454 0.558 18933 3168 1 5 . 1 1 50 50 VAL C C 50 173.070 173.070 174.052 -0.982 18933 3169 1 5 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.473 1.369 18933 3170 1 5 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.231 -0.668 18933 3171 1 5 . 1 1 50 50 VAL H H 50 8.089 8.089 8.647 -0.558 18933 3172 1 5 . 1 1 51 51 ASP N N 51 127.064 127.064 125.813 1.251 18933 3173 1 5 . 1 1 51 51 ASP C C 51 174.565 174.565 175.367 -0.802 18933 3174 1 5 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.960 -0.803 18933 3175 1 5 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.574 -0.934 18933 3176 1 5 . 1 1 51 51 ASP H H 51 8.069 8.069 8.118 -0.049 18933 3177 1 5 . 1 1 52 52 LEU N N 52 121.627 121.627 120.153 1.474 18933 3178 1 5 . 1 1 52 52 LEU C C 52 174.063 174.063 174.799 -0.736 18933 3179 1 5 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.496 -0.814 18933 3180 1 5 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.302 -2.951 18933 3181 1 5 . 1 1 52 52 LEU H H 52 8.852 8.852 9.117 -0.265 18933 3182 1 5 . 1 1 53 53 LEU N N 53 123.093 123.093 122.613 0.480 18933 3183 1 5 . 1 1 53 53 LEU CA C 53 55.991 55.991 53.924 2.067 18933 3184 1 5 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.586 -2.453 18933 3185 1 5 . 1 1 53 53 LEU H H 53 9.362 9.362 9.032 0.330 18933 3186 1 5 . 1 1 54 54 ILE N N 54 123.777 123.777 128.795 -5.018 18933 3187 1 5 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.104 -4.042 18933 3188 1 5 . 1 1 54 54 ILE CB C 54 33.070 33.070 39.877 -6.807 18933 3189 1 5 . 1 1 54 54 ILE H H 54 8.907 8.907 9.231 -0.324 18933 3190 1 5 . 1 1 58 58 GLU N N 58 114.710 114.710 116.748 -2.038 18933 3191 1 5 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.272 -0.895 18933 3192 1 5 . 1 1 58 58 GLU CB C 58 31.422 31.422 32.580 -1.157 18933 3193 1 5 . 1 1 58 58 GLU H H 58 6.716 6.716 7.384 -0.668 18933 3194 1 5 . 1 1 61 61 LEU N N 61 115.957 115.957 120.323 -4.366 18933 3195 1 5 . 1 1 61 61 LEU C C 61 178.512 178.512 178.220 0.292 18933 3196 1 5 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.207 -2.427 18933 3197 1 5 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.598 -0.479 18933 3198 1 5 . 1 1 61 61 LEU H H 61 7.307 7.307 7.886 -0.579 18933 3199 1 5 . 1 1 62 62 LEU N N 62 120.038 120.038 119.510 0.528 18933 3200 1 5 . 1 1 62 62 LEU C C 62 177.874 177.874 178.753 -0.879 18933 3201 1 5 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.548 0.388 18933 3202 1 5 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.909 -1.170 18933 3203 1 5 . 1 1 62 62 LEU H H 62 7.327 7.327 8.172 -0.845 18933 3204 1 5 . 1 1 63 63 LYS N N 63 114.600 114.600 115.991 -1.391 18933 3205 1 5 . 1 1 63 63 LYS C C 63 175.460 175.460 177.810 -2.350 18933 3206 1 5 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.772 -1.208 18933 3207 1 5 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.502 -1.777 18933 3208 1 5 . 1 1 63 63 LYS H H 63 7.973 7.973 7.684 0.289 18933 3209 1 5 . 1 1 64 64 HIS N N 64 115.273 115.273 115.656 -0.383 18933 3210 1 5 . 1 1 64 64 HIS CA C 64 56.112 56.112 54.927 1.185 18933 3211 1 5 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.092 2.344 18933 3212 1 5 . 1 1 64 64 HIS H H 64 7.544 7.544 7.466 0.078 18933 3213 1 5 . 1 1 65 65 VAL N N 65 118.682 118.682 119.094 -0.412 18933 3214 1 5 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.843 3.195 18933 3215 1 5 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.517 -2.490 18933 3216 1 5 . 1 1 65 65 VAL H H 65 6.787 6.787 7.165 -0.378 18933 3217 1 5 . 1 1 68 68 ASN N N 68 112.108 112.108 118.049 -5.941 18933 3218 1 5 . 1 1 68 68 ASN C C 68 174.884 174.884 173.873 1.011 18933 3219 1 5 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.398 -1.371 18933 3220 1 5 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.561 0.671 18933 3221 1 5 . 1 1 68 68 ASN H H 68 7.009 7.009 8.307 -1.298 18933 3222 1 5 . 1 1 69 69 ILE N N 69 123.325 123.325 123.319 0.006 18933 3223 1 5 . 1 1 69 69 ILE C C 69 174.394 174.394 175.488 -1.094 18933 3224 1 5 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.658 -1.551 18933 3225 1 5 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.565 -0.298 18933 3226 1 5 . 1 1 69 69 ILE H H 69 7.150 7.150 8.246 -1.096 18933 3227 1 5 . 1 1 70 70 ARG N N 70 126.722 126.722 127.848 -1.126 18933 3228 1 5 . 1 1 70 70 ARG C C 70 174.590 174.590 174.317 0.273 18933 3229 1 5 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.629 -1.382 18933 3230 1 5 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.689 -2.317 18933 3231 1 5 . 1 1 70 70 ARG H H 70 8.902 8.902 9.221 -0.319 18933 3232 1 5 . 1 1 71 71 ILE N N 71 119.978 119.978 120.146 -0.168 18933 3233 1 5 . 1 1 71 71 ILE C C 71 175.583 175.583 175.701 -0.118 18933 3234 1 5 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.965 -0.141 18933 3235 1 5 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.255 -2.495 18933 3236 1 5 . 1 1 71 71 ILE H H 71 7.491 7.491 8.818 -1.327 18933 3237 1 5 . 1 1 72 72 LYS N N 72 128.530 128.530 125.469 3.061 18933 3238 1 5 . 1 1 72 72 LYS C C 72 177.703 177.703 176.217 1.486 18933 3239 1 5 . 1 1 72 72 LYS CA C 72 57.201 57.201 55.003 2.198 18933 3240 1 5 . 1 1 72 72 LYS CB C 72 31.485 31.485 31.248 0.237 18933 3241 1 5 . 1 1 72 72 LYS H H 72 8.523 8.523 8.644 -0.121 18933 3242 1 5 . 1 1 73 73 GLY N N 73 113.806 113.806 110.161 3.645 18933 3243 1 5 . 1 1 73 73 GLY C C 73 173.781 173.781 172.703 1.078 18933 3244 1 5 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.171 0.651 18933 3245 1 5 . 1 1 73 73 GLY H H 73 8.791 8.791 8.352 0.439 18933 3246 1 5 . 1 1 74 74 LEU N N 74 120.490 120.490 118.037 2.453 18933 3247 1 5 . 1 1 74 74 LEU C C 74 175.840 175.840 173.579 2.261 18933 3248 1 5 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.410 -0.719 18933 3249 1 5 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.230 -1.069 18933 3250 1 5 . 1 1 74 74 LEU H H 74 7.393 7.393 7.253 0.140 18933 3251 1 5 . 1 1 75 75 SER N N 75 120.038 120.038 115.658 4.380 18933 3252 1 5 . 1 1 75 75 SER C C 75 173.205 173.205 173.373 -0.168 18933 3253 1 5 . 1 1 75 75 SER CA C 75 57.887 57.887 57.044 0.843 18933 3254 1 5 . 1 1 75 75 SER CB C 75 63.049 63.049 65.016 -1.967 18933 3255 1 5 . 1 1 75 75 SER H H 75 8.917 8.917 8.139 0.778 18933 3256 1 5 . 1 1 76 76 PHE N N 76 119.586 119.586 117.443 2.143 18933 3257 1 5 . 1 1 76 76 PHE C C 76 173.536 173.536 174.105 -0.569 18933 3258 1 5 . 1 1 76 76 PHE CA C 76 55.426 55.426 56.456 -1.030 18933 3259 1 5 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.571 -0.565 18933 3260 1 5 . 1 1 76 76 PHE H H 76 8.003 8.003 8.318 -0.315 18933 3261 1 5 . 1 1 77 77 SER N N 77 114.943 114.943 116.558 -1.615 18933 3262 1 5 . 1 1 77 77 SER C C 77 173.438 173.438 172.709 0.729 18933 3263 1 5 . 1 1 77 77 SER CA C 77 56.152 56.152 57.396 -1.244 18933 3264 1 5 . 1 1 77 77 SER CB C 77 65.204 65.204 65.569 -0.365 18933 3265 1 5 . 1 1 77 77 SER H H 77 8.907 8.907 8.725 0.182 18933 3266 1 5 . 1 1 78 78 VAL N N 78 124.791 124.791 123.695 1.096 18933 3267 1 5 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.495 1.549 18933 3268 1 5 . 1 1 78 78 VAL CB C 78 32.182 32.182 33.422 -1.240 18933 3269 1 5 . 1 1 78 78 VAL H H 78 8.892 8.892 8.476 0.416 18933 3270 1 5 . 1 1 79 79 LYS N N 79 129.667 129.667 129.195 0.472 18933 3271 1 5 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.453 1.740 18933 3272 1 5 . 1 1 79 79 LYS CB C 79 32.372 32.372 34.354 -1.982 18933 3273 1 5 . 1 1 79 79 LYS H H 79 9.049 9.049 8.944 0.105 18933 3274 1 5 . 1 1 82 82 GLY N N 82 117.263 117.263 113.629 3.634 18933 3275 1 5 . 1 1 82 82 GLY C C 82 171.710 171.710 174.312 -2.602 18933 3276 1 5 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.141 -2.216 18933 3277 1 5 . 1 1 82 82 GLY H H 82 8.044 8.044 8.466 -0.422 18933 3278 1 5 . 1 1 83 83 GLU N N 83 117.203 117.203 120.210 -3.007 18933 3279 1 5 . 1 1 83 83 GLU C C 83 178.695 178.695 178.173 0.522 18933 3280 1 5 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.371 1.606 18933 3281 1 5 . 1 1 83 83 GLU CB C 83 29.837 29.837 30.096 -0.259 18933 3282 1 5 . 1 1 83 83 GLU H H 83 8.296 8.296 8.373 -0.077 18933 3283 1 5 . 1 1 84 84 ARG N N 84 113.818 113.818 120.079 -6.261 18933 3284 1 5 . 1 1 84 84 ARG C C 84 175.877 175.877 175.400 0.477 18933 3285 1 5 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.105 -1.374 18933 3286 1 5 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.315 1.980 18933 3287 1 5 . 1 1 84 84 ARG H H 84 8.342 8.342 8.014 0.328 18933 3288 1 5 . 1 1 85 85 LYS N N 85 119.354 119.354 120.096 -0.742 18933 3289 1 5 . 1 1 85 85 LYS C C 85 174.516 174.516 174.366 0.150 18933 3290 1 5 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.557 -0.817 18933 3291 1 5 . 1 1 85 85 LYS CB C 85 34.844 34.844 35.520 -0.676 18933 3292 1 5 . 1 1 85 85 LYS H H 85 6.822 6.822 7.696 -0.874 18933 3293 1 5 . 1 1 86 86 CYS N N 86 125.928 125.928 124.121 1.807 18933 3294 1 5 . 1 1 86 86 CYS C C 86 171.600 171.600 173.007 -1.407 18933 3295 1 5 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.967 -2.340 18933 3296 1 5 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.167 0.177 18933 3297 1 5 . 1 1 86 86 CYS H H 86 9.084 9.084 9.439 -0.355 18933 3298 1 5 . 1 1 87 87 VAL N N 87 126.612 126.612 126.462 0.150 18933 3299 1 5 . 1 1 87 87 VAL C C 87 174.431 174.431 173.631 0.800 18933 3300 1 5 . 1 1 87 87 VAL CA C 87 61.317 61.317 60.482 0.835 18933 3301 1 5 . 1 1 87 87 VAL CB C 87 33.196 33.196 34.253 -1.057 18933 3302 1 5 . 1 1 87 87 VAL H H 87 8.705 8.705 9.053 -0.348 18933 3303 1 5 . 1 1 88 88 LEU N N 88 127.748 127.748 124.049 3.699 18933 3304 1 5 . 1 1 88 88 LEU C C 88 175.227 175.227 174.449 0.778 18933 3305 1 5 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.671 -0.151 18933 3306 1 5 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.032 -1.427 18933 3307 1 5 . 1 1 88 88 LEU H H 88 9.417 9.417 8.775 0.642 18933 3308 1 5 . 1 1 89 89 PHE N N 89 120.981 120.981 119.312 1.669 18933 3309 1 5 . 1 1 89 89 PHE C C 89 176.906 176.906 176.019 0.887 18933 3310 1 5 . 1 1 89 89 PHE CA C 89 55.587 55.587 55.869 -0.282 18933 3311 1 5 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.392 -2.491 18933 3312 1 5 . 1 1 89 89 PHE H H 89 8.937 8.937 8.548 0.389 18933 3313 1 5 . 1 1 90 90 ILE N N 90 119.928 119.928 118.587 1.341 18933 3314 1 5 . 1 1 90 90 ILE C C 90 173.781 173.781 175.088 -1.307 18933 3315 1 5 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.666 -1.012 18933 3316 1 5 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.032 1.580 18933 3317 1 5 . 1 1 90 90 ILE H H 90 9.230 9.230 9.109 0.121 18933 3318 1 5 . 1 1 91 91 GLU N N 91 124.339 124.339 125.614 -1.275 18933 3319 1 5 . 1 1 91 91 GLU C C 91 175.607 175.607 175.416 0.191 18933 3320 1 5 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.721 -0.102 18933 3321 1 5 . 1 1 91 91 GLU CB C 91 29.837 29.837 32.825 -2.988 18933 3322 1 5 . 1 1 91 91 GLU H H 91 8.175 8.175 8.946 -0.771 18933 3323 1 5 . 1 1 92 92 TRP N N 92 127.516 127.516 124.516 3.000 18933 3324 1 5 . 1 1 92 92 TRP C C 92 175.203 175.203 176.123 -0.920 18933 3325 1 5 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.098 2.135 18933 3326 1 5 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.677 0.984 18933 3327 1 5 . 1 1 92 92 TRP H H 92 9.306 9.306 8.844 0.462 18933 3328 1 5 . 1 1 93 93 GLU N N 93 127.834 127.834 126.364 1.470 18933 3329 1 5 . 1 1 93 93 GLU C C 93 175.668 175.668 175.974 -0.306 18933 3330 1 5 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.426 -0.548 18933 3331 1 5 . 1 1 93 93 GLU CB C 93 26.034 26.034 28.595 -2.561 18933 3332 1 5 . 1 1 93 93 GLU H H 93 8.796 8.796 9.064 -0.268 18933 3333 1 5 . 1 1 94 94 LYS N N 94 108.931 108.931 113.227 -4.296 18933 3334 1 5 . 1 1 94 94 LYS C C 94 175.423 175.423 175.374 0.049 18933 3335 1 5 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.761 -0.318 18933 3336 1 5 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.313 -2.680 18933 3337 1 5 . 1 1 94 94 LYS H H 94 8.498 8.498 8.579 -0.081 18933 3338 1 5 . 1 1 95 95 LYS N N 95 121.737 121.737 120.258 1.479 18933 3339 1 5 . 1 1 95 95 LYS C C 95 174.443 174.443 175.051 -0.608 18933 3340 1 5 . 1 1 95 95 LYS CA C 95 54.417 54.417 55.829 -1.412 18933 3341 1 5 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.457 0.007 18933 3342 1 5 . 1 1 95 95 LYS H H 95 7.761 7.761 7.323 0.438 18933 3343 1 5 . 1 1 96 96 THR N N 96 116.067 116.067 116.973 -0.906 18933 3344 1 5 . 1 1 96 96 THR C C 96 174.296 174.296 173.610 0.686 18933 3345 1 5 . 1 1 96 96 THR CA C 96 61.115 61.115 60.983 0.132 18933 3346 1 5 . 1 1 96 96 THR CB C 96 69.450 69.450 71.236 -1.786 18933 3347 1 5 . 1 1 96 96 THR H H 96 7.761 7.761 8.139 -0.378 18933 3348 1 5 . 1 1 97 97 TYR N N 97 124.229 124.229 124.137 0.092 18933 3349 1 5 . 1 1 97 97 TYR C C 97 173.536 173.536 174.847 -1.311 18933 3350 1 5 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.623 -0.673 18933 3351 1 5 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.918 -1.736 18933 3352 1 5 . 1 1 97 97 TYR H H 97 9.018 9.018 9.097 -0.079 18933 3353 1 5 . 1 1 98 98 GLN N N 98 123.435 123.435 124.021 -0.586 18933 3354 1 5 . 1 1 98 98 GLN C C 98 173.266 173.266 174.095 -0.829 18933 3355 1 5 . 1 1 98 98 GLN CA C 98 55.143 55.143 56.118 -0.975 18933 3356 1 5 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.994 -0.981 18933 3357 1 5 . 1 1 98 98 GLN H H 98 8.781 8.781 9.049 -0.268 18933 3358 1 5 . 1 1 99 99 LEU N N 99 130.119 130.119 129.814 0.305 18933 3359 1 5 . 1 1 99 99 LEU C C 99 173.867 173.867 174.065 -0.198 18933 3360 1 5 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.515 -0.995 18933 3361 1 5 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.718 -1.113 18933 3362 1 5 . 1 1 99 99 LEU H H 99 9.104 9.104 8.933 0.171 18933 3363 1 5 . 1 1 100 100 ASP N N 100 125.182 125.182 128.018 -2.836 18933 3364 1 5 . 1 1 100 100 ASP C C 100 172.837 172.837 174.212 -1.375 18933 3365 1 5 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.560 -1.806 18933 3366 1 5 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.440 -4.096 18933 3367 1 5 . 1 1 100 100 ASP H H 100 9.089 9.089 8.945 0.144 18933 3368 1 5 . 1 1 101 101 LEU N N 101 121.174 121.174 127.525 -6.351 18933 3369 1 5 . 1 1 101 101 LEU C C 101 174.529 174.529 174.651 -0.122 18933 3370 1 5 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.724 -1.809 18933 3371 1 5 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.858 -1.950 18933 3372 1 5 . 1 1 101 101 LEU H H 101 8.458 8.458 9.099 -0.641 18933 3373 1 5 . 1 1 102 102 PHE N N 102 119.464 119.464 125.002 -5.538 18933 3374 1 5 . 1 1 102 102 PHE C C 102 176.293 176.293 174.905 1.388 18933 3375 1 5 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.329 -1.275 18933 3376 1 5 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.251 -0.371 18933 3377 1 5 . 1 1 102 102 PHE H H 102 8.281 8.281 9.151 -0.870 18933 3378 1 5 . 1 1 103 103 THR N N 103 108.576 108.576 116.685 -8.109 18933 3379 1 5 . 1 1 103 103 THR C C 103 174.933 174.933 173.415 1.518 18933 3380 1 5 . 1 1 103 103 THR CA C 103 57.726 57.726 60.221 -2.495 18933 3381 1 5 . 1 1 103 103 THR CB C 103 71.288 71.288 69.647 1.641 18933 3382 1 5 . 1 1 103 103 THR H H 103 7.872 7.872 8.341 -0.469 18933 3383 1 5 . 1 1 104 104 ALA N N 104 122.885 122.885 128.990 -6.105 18933 3384 1 5 . 1 1 104 104 ALA C C 104 175.754 175.754 175.015 0.739 18933 3385 1 5 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.623 0.395 18933 3386 1 5 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.804 -0.319 18933 3387 1 5 . 1 1 104 104 ALA H H 104 8.660 8.660 9.175 -0.515 18933 3388 1 5 . 1 1 105 105 LEU N N 105 120.881 120.881 119.531 1.350 18933 3389 1 5 . 1 1 105 105 LEU C C 105 179.504 179.504 178.540 0.964 18933 3390 1 5 . 1 1 105 105 LEU CA C 105 53.247 53.247 53.826 -0.579 18933 3391 1 5 . 1 1 105 105 LEU CB C 105 41.753 41.753 43.068 -1.315 18933 3392 1 5 . 1 1 105 105 LEU H H 105 8.226 8.226 8.412 -0.186 18933 3393 1 5 . 1 1 106 106 ALA N N 106 124.901 124.901 124.189 0.712 18933 3394 1 5 . 1 1 106 106 ALA C C 106 181.269 181.269 179.104 2.165 18933 3395 1 5 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.621 1.692 18933 3396 1 5 . 1 1 106 106 ALA CB C 106 17.224 17.224 19.033 -1.809 18933 3397 1 5 . 1 1 106 106 ALA H H 106 8.392 8.392 8.645 -0.253 18933 3398 1 5 . 1 1 107 107 GLU N N 107 116.409 116.409 116.990 -0.581 18933 3399 1 5 . 1 1 107 107 GLU C C 107 177.764 177.764 176.740 1.024 18933 3400 1 5 . 1 1 107 107 GLU CA C 107 58.533 58.533 58.231 0.302 18933 3401 1 5 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.804 -1.868 18933 3402 1 5 . 1 1 107 107 GLU H H 107 9.664 9.664 8.683 0.981 18933 3403 1 5 . 1 1 108 108 GLU N N 108 116.189 116.189 117.122 -0.933 18933 3404 1 5 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.693 -1.550 18933 3405 1 5 . 1 1 108 108 GLU CB C 108 29.837 29.837 28.785 1.052 18933 3406 1 5 . 1 1 108 108 GLU H H 108 7.589 7.589 7.610 -0.021 18933 3407 1 5 . 1 1 109 109 LYS N N 109 119.928 119.928 121.608 -1.680 18933 3408 1 5 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.056 1.795 18933 3409 1 5 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.374 0.097 18933 3410 1 5 . 1 1 109 109 LYS H H 109 7.514 7.514 7.562 -0.048 18933 3411 1 5 . 1 1 111 111 TYR N N 111 114.930 114.930 119.216 -4.286 18933 3412 1 5 . 1 1 111 111 TYR C C 111 179.504 179.504 177.725 1.779 18933 3413 1 5 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.212 -2.195 18933 3414 1 5 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.581 -1.913 18933 3415 1 5 . 1 1 111 111 TYR H H 111 6.393 6.393 8.432 -2.039 18933 3416 1 5 . 1 1 112 112 ALA N N 112 124.901 124.901 122.039 2.862 18933 3417 1 5 . 1 1 112 112 ALA C C 112 179.173 179.173 179.809 -0.636 18933 3418 1 5 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.539 -0.638 18933 3419 1 5 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.059 0.053 18933 3420 1 5 . 1 1 112 112 ALA H H 112 8.554 8.554 8.224 0.330 18933 3421 1 5 . 1 1 113 113 ILE N N 113 119.464 119.464 119.202 0.262 18933 3422 1 5 . 1 1 113 113 ILE C C 113 178.499 178.499 177.963 0.536 18933 3423 1 5 . 1 1 113 113 ILE CA C 113 66.281 66.281 63.907 2.374 18933 3424 1 5 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.879 -0.563 18933 3425 1 5 . 1 1 113 113 ILE H H 113 8.680 8.680 7.711 0.969 18933 3426 1 5 . 1 1 114 114 PHE N N 114 122.922 122.922 122.252 0.670 18933 3427 1 5 . 1 1 114 114 PHE C C 114 178.217 178.217 176.783 1.434 18933 3428 1 5 . 1 1 114 114 PHE CA C 114 61.559 61.559 61.690 -0.131 18933 3429 1 5 . 1 1 114 114 PHE CB C 114 39.471 39.471 39.022 0.449 18933 3430 1 5 . 1 1 114 114 PHE H H 114 7.721 7.721 8.595 -0.874 18933 3431 1 5 . 1 1 115 115 HIS N N 115 118.560 118.560 117.759 0.801 18933 3432 1 5 . 1 1 115 115 HIS C C 115 177.286 177.286 176.618 0.668 18933 3433 1 5 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.006 0.374 18933 3434 1 5 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.388 1.477 18933 3435 1 5 . 1 1 115 115 HIS H H 115 8.155 8.155 8.465 -0.310 18933 3436 1 5 . 1 1 116 116 PHE N N 116 111.472 111.472 116.961 -5.489 18933 3437 1 5 . 1 1 116 116 PHE C C 116 179.026 179.026 177.206 1.820 18933 3438 1 5 . 1 1 116 116 PHE CA C 116 59.461 59.461 59.964 -0.503 18933 3439 1 5 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.929 -1.740 18933 3440 1 5 . 1 1 116 116 PHE H H 116 8.564 8.564 8.034 0.530 18933 3441 1 5 . 1 1 117 117 THR N N 117 119.012 119.012 111.916 7.096 18933 3442 1 5 . 1 1 117 117 THR C C 117 172.935 172.935 175.132 -2.197 18933 3443 1 5 . 1 1 117 117 THR CA C 117 67.088 67.088 64.013 3.075 18933 3444 1 5 . 1 1 117 117 THR CB C 117 37.126 37.126 68.917 -31.791 18933 3445 1 5 . 1 1 117 117 THR H H 117 7.620 7.620 8.172 -0.552 18933 3446 1 5 . 1 1 118 118 GLY N N 118 107.917 107.917 109.967 -2.050 18933 3447 1 5 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.322 1.845 18933 3448 1 5 . 1 1 118 118 GLY H H 118 6.666 6.666 7.387 -0.721 18933 3449 1 5 . 1 1 121 121 SER N N 121 113.354 113.354 118.126 -4.772 18933 3450 1 5 . 1 1 121 121 SER C C 121 176.061 176.061 175.885 0.176 18933 3451 1 5 . 1 1 121 121 SER CA C 121 61.035 61.035 61.515 -0.480 18933 3452 1 5 . 1 1 121 121 SER H H 121 8.322 8.322 8.239 0.083 18933 3453 1 5 . 1 1 122 122 TYR N N 122 124.681 124.681 121.004 3.677 18933 3454 1 5 . 1 1 122 122 TYR C C 122 176.293 176.293 177.370 -1.077 18933 3455 1 5 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.668 -1.611 18933 3456 1 5 . 1 1 122 122 TYR CB C 122 38.711 38.711 37.889 0.822 18933 3457 1 5 . 1 1 122 122 TYR H H 122 6.514 6.514 8.232 -1.718 18933 3458 1 5 . 1 1 123 123 LEU N N 123 117.997 117.997 119.840 -1.843 18933 3459 1 5 . 1 1 123 123 LEU C C 123 179.774 179.774 179.070 0.704 18933 3460 1 5 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.770 0.108 18933 3461 1 5 . 1 1 123 123 LEU CB C 123 39.978 39.978 41.003 -1.025 18933 3462 1 5 . 1 1 123 123 LEU H H 123 7.428 7.428 7.298 0.130 18933 3463 1 5 . 1 1 124 124 ILE N N 124 119.012 119.012 120.116 -1.104 18933 3464 1 5 . 1 1 124 124 ILE C C 124 178.830 178.830 177.856 0.974 18933 3465 1 5 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.405 -0.254 18933 3466 1 5 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.371 -0.308 18933 3467 1 5 . 1 1 124 124 ILE H H 124 8.453 8.453 8.444 0.009 18933 3468 1 5 . 1 1 125 125 ARG N N 125 121.174 121.174 120.026 1.148 18933 3469 1 5 . 1 1 125 125 ARG C C 125 179.762 179.762 178.685 1.077 18933 3470 1 5 . 1 1 125 125 ARG CA C 125 59.057 59.057 59.044 0.013 18933 3471 1 5 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.557 -0.607 18933 3472 1 5 . 1 1 125 125 ARG H H 125 7.004 7.004 8.189 -1.185 18933 3473 1 5 . 1 1 126 126 ILE N N 126 122.299 122.299 120.739 1.560 18933 3474 1 5 . 1 1 126 126 ILE C C 126 178.352 178.352 177.266 1.086 18933 3475 1 5 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.674 -2.469 18933 3476 1 5 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.394 -1.979 18933 3477 1 5 . 1 1 126 126 ILE H H 126 7.579 7.579 7.909 -0.330 18933 3478 1 5 . 1 1 127 127 ARG N N 127 119.354 119.354 120.416 -1.062 18933 3479 1 5 . 1 1 127 127 ARG C C 127 179.786 179.786 178.811 0.975 18933 3480 1 5 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.804 0.182 18933 3481 1 5 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.212 -0.882 18933 3482 1 5 . 1 1 127 127 ARG H H 127 8.715 8.715 8.090 0.625 18933 3483 1 5 . 1 1 128 128 ALA N N 128 122.873 122.873 120.266 2.607 18933 3484 1 5 . 1 1 128 128 ALA C C 128 180.325 180.325 179.300 1.025 18933 3485 1 5 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.631 0.109 18933 3486 1 5 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.236 -1.075 18933 3487 1 5 . 1 1 128 128 ALA H H 128 7.978 7.978 8.166 -0.188 18933 3488 1 5 . 1 1 129 129 ALA N N 129 121.846 121.846 121.821 0.025 18933 3489 1 5 . 1 1 129 129 ALA C C 129 181.539 181.539 179.853 1.686 18933 3490 1 5 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.695 -0.197 18933 3491 1 5 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.656 -1.178 18933 3492 1 5 . 1 1 129 129 ALA H H 129 7.519 7.519 7.706 -0.187 18933 3493 1 5 . 1 1 130 130 LEU N N 130 119.134 119.134 118.449 0.685 18933 3494 1 5 . 1 1 130 130 LEU C C 130 179.909 179.909 178.916 0.993 18933 3495 1 5 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.040 -0.041 18933 3496 1 5 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.657 -1.235 18933 3497 1 5 . 1 1 130 130 LEU H H 130 8.296 8.296 8.619 -0.323 18933 3498 1 5 . 1 1 131 131 LYS N N 131 122.299 122.299 120.585 1.714 18933 3499 1 5 . 1 1 131 131 LYS C C 131 180.289 180.289 179.444 0.845 18933 3500 1 5 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.764 -0.747 18933 3501 1 5 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.099 -0.867 18933 3502 1 5 . 1 1 131 131 LYS H H 131 8.281 8.281 7.953 0.328 18933 3503 1 5 . 1 1 132 132 LYS N N 132 118.743 118.743 118.348 0.395 18933 3504 1 5 . 1 1 132 132 LYS C C 132 177.482 177.482 177.840 -0.358 18933 3505 1 5 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.600 -0.108 18933 3506 1 5 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.222 -0.990 18933 3507 1 5 . 1 1 132 132 LYS H H 132 7.317 7.317 7.715 -0.398 18933 3508 1 5 . 1 1 133 133 LYS N N 133 117.093 117.093 117.145 -0.052 18933 3509 1 5 . 1 1 133 133 LYS C C 133 174.614 174.614 176.238 -1.624 18933 3510 1 5 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.984 -1.204 18933 3511 1 5 . 1 1 133 133 LYS CB C 133 32.182 32.182 33.071 -0.889 18933 3512 1 5 . 1 1 133 133 LYS H H 133 7.327 7.327 7.659 -0.332 18933 3513 1 5 . 1 1 134 134 ASN N N 134 113.012 113.012 115.449 -2.437 18933 3514 1 5 . 1 1 134 134 ASN C C 134 173.965 173.965 173.550 0.415 18933 3515 1 5 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.430 -0.134 18933 3516 1 5 . 1 1 134 134 ASN CB C 134 36.175 36.175 36.862 -0.687 18933 3517 1 5 . 1 1 134 134 ASN H H 134 7.938 7.938 8.075 -0.137 18933 3518 1 5 . 1 1 135 135 TYR N N 135 115.725 115.725 119.594 -3.869 18933 3519 1 5 . 1 1 135 135 TYR C C 135 176.342 176.342 175.091 1.251 18933 3520 1 5 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.615 -1.947 18933 3521 1 5 . 1 1 135 135 TYR CB C 135 41.563 41.563 39.839 1.724 18933 3522 1 5 . 1 1 135 135 TYR H H 135 7.741 7.741 8.426 -0.685 18933 3523 1 5 . 1 1 136 136 LYS N N 136 122.641 122.641 124.830 -2.189 18933 3524 1 5 . 1 1 136 136 LYS C C 136 173.475 173.475 174.528 -1.053 18933 3525 1 5 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.597 0.304 18933 3526 1 5 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.374 -1.656 18933 3527 1 5 . 1 1 136 136 LYS H H 136 9.296 9.296 8.806 0.490 18933 3528 1 5 . 1 1 137 137 LEU N N 137 127.284 127.284 124.032 3.252 18933 3529 1 5 . 1 1 137 137 LEU C C 137 175.423 175.423 176.075 -0.652 18933 3530 1 5 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.309 -0.183 18933 3531 1 5 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.039 3.707 18933 3532 1 5 . 1 1 137 137 LEU H H 137 8.776 8.776 8.605 0.171 18933 3533 1 5 . 1 1 138 138 ASN N N 138 125.818 125.818 119.686 6.132 18933 3534 1 5 . 1 1 138 138 ASN C C 138 174.933 174.933 175.226 -0.293 18933 3535 1 5 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.720 -0.603 18933 3536 1 5 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.386 -4.880 18933 3537 1 5 . 1 1 138 138 ASN H H 138 8.811 8.811 8.244 0.567 18933 3538 1 5 . 1 1 139 139 GLN N N 139 116.861 116.861 118.656 -1.795 18933 3539 1 5 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.210 -1.372 18933 3540 1 5 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.389 -2.672 18933 3541 1 5 . 1 1 139 139 GLN H H 139 9.220 9.220 8.909 0.311 18933 3542 1 5 . 1 1 140 140 TYR N N 140 120.600 120.600 119.721 0.879 18933 3543 1 5 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.947 -1.190 18933 3544 1 5 . 1 1 140 140 TYR CB C 140 37.570 37.570 38.259 -0.689 18933 3545 1 5 . 1 1 140 140 TYR H H 140 8.549 8.549 8.474 0.075 18933 3546 1 5 . 1 1 141 141 GLY N N 141 105.986 105.986 108.031 -2.045 18933 3547 1 5 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.425 -0.581 18933 3548 1 5 . 1 1 141 141 GLY H H 141 7.186 7.186 8.004 -0.818 18933 3549 1 5 . 1 1 142 142 LEU N N 142 120.038 120.038 116.964 3.074 18933 3550 1 5 . 1 1 142 142 LEU C C 142 173.340 173.340 176.105 -2.765 18933 3551 1 5 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.252 -0.732 18933 3552 1 5 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.327 1.024 18933 3553 1 5 . 1 1 142 142 LEU H H 142 7.539 7.539 8.207 -0.668 18933 3554 1 5 . 1 1 143 143 PHE N N 143 124.229 124.229 119.421 4.808 18933 3555 1 5 . 1 1 143 143 PHE C C 143 173.977 173.977 175.161 -1.184 18933 3556 1 5 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.094 -2.453 18933 3557 1 5 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.527 4.141 18933 3558 1 5 . 1 1 143 143 PHE H H 143 9.084 9.084 8.980 0.104 18933 3559 1 5 . 1 1 144 144 LYS N N 144 127.858 127.858 123.227 4.631 18933 3560 1 5 . 1 1 144 144 LYS C C 144 175.092 175.092 176.964 -1.872 18933 3561 1 5 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.240 4.616 18933 3562 1 5 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.365 4.219 18933 3563 1 5 . 1 1 144 144 LYS H H 144 9.281 9.281 8.848 0.433 18933 3564 1 5 . 1 1 145 145 ASN N N 145 128.188 128.188 126.513 1.675 18933 3565 1 5 . 1 1 145 145 ASN C C 145 175.779 175.779 174.940 0.839 18933 3566 1 5 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.419 3.308 18933 3567 1 5 . 1 1 145 145 ASN CB C 145 34.654 34.654 38.050 -3.396 18933 3568 1 5 . 1 1 145 145 ASN H H 145 9.205 9.205 9.124 0.081 18933 3569 1 5 . 1 1 146 146 GLN N N 146 129.655 129.655 111.504 18.151 18933 3570 1 5 . 1 1 146 146 GLN C C 146 175.399 175.399 174.371 1.028 18933 3571 1 5 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.174 1.641 18933 3572 1 5 . 1 1 146 146 GLN CB C 146 32.626 32.626 27.789 4.837 18933 3573 1 5 . 1 1 146 146 GLN H H 146 8.983 8.983 8.731 0.252 18933 3574 1 5 . 1 1 147 147 THR N N 147 117.936 117.936 116.119 1.817 18933 3575 1 5 . 1 1 147 147 THR C C 147 173.254 173.254 173.511 -0.257 18933 3576 1 5 . 1 1 147 147 THR CA C 147 61.721 61.721 61.633 0.088 18933 3577 1 5 . 1 1 147 147 THR CB C 147 70.274 70.274 69.550 0.724 18933 3578 1 5 . 1 1 147 147 THR H H 147 8.029 8.029 7.893 0.136 18933 3579 1 5 . 1 1 148 148 LEU N N 148 130.681 130.681 131.584 -0.903 18933 3580 1 5 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.381 0.085 18933 3581 1 5 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.511 -0.822 18933 3582 1 5 . 1 1 148 148 LEU H H 148 8.635 8.635 8.893 -0.258 18933 3583 1 5 . 1 1 149 149 VAL N N 149 130.803 130.803 123.799 7.004 18933 3584 1 5 . 1 1 149 149 VAL CA C 149 59.178 59.178 57.962 1.216 18933 3585 1 5 . 1 1 149 149 VAL CB C 149 31.675 31.675 33.278 -1.603 18933 3586 1 5 . 1 1 149 149 VAL H H 149 8.968 8.968 9.328 -0.360 18933 3587 1 5 . 1 1 151 151 LEU N N 151 124.290 124.290 118.656 5.634 18933 3588 1 5 . 1 1 151 151 LEU CA C 151 54.013 54.013 54.095 -0.082 18933 3589 1 5 . 1 1 151 151 LEU CB C 151 44.098 44.098 39.073 5.025 18933 3590 1 5 . 1 1 151 151 LEU H H 151 7.872 7.872 8.325 -0.453 18933 3591 1 5 . 1 1 153 153 ILE N N 153 114.943 114.943 120.012 -5.069 18933 3592 1 5 . 1 1 153 153 ILE C C 153 175.877 175.877 175.404 0.473 18933 3593 1 5 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.694 0.000 18933 3594 1 5 . 1 1 153 153 ILE CB C 153 41.689 41.689 39.771 1.918 18933 3595 1 5 . 1 1 153 153 ILE H H 153 7.125 7.125 7.539 -0.414 18933 3596 1 5 . 1 1 154 154 THR N N 154 111.766 111.766 111.427 0.339 18933 3597 1 5 . 1 1 154 154 THR C C 154 174.945 174.945 174.920 0.025 18933 3598 1 5 . 1 1 154 154 THR CA C 154 62.124 62.124 63.591 -1.467 18933 3599 1 5 . 1 1 154 154 THR CB C 154 70.718 70.718 69.536 1.182 18933 3600 1 5 . 1 1 154 154 THR H H 154 9.286 9.286 8.180 1.106 18933 3601 1 5 . 1 1 155 155 THR N N 155 111.766 111.766 113.654 -1.888 18933 3602 1 5 . 1 1 155 155 THR CA C 155 58.936 58.936 59.614 -0.678 18933 3603 1 5 . 1 1 155 155 THR CB C 155 72.683 72.683 70.852 1.831 18933 3604 1 5 . 1 1 155 155 THR H H 155 7.645 7.645 7.510 0.136 18933 3605 1 5 . 1 1 157 157 LYS N N 157 119.464 119.464 118.934 0.530 18933 3606 1 5 . 1 1 157 157 LYS C C 157 178.781 178.781 178.553 0.228 18933 3607 1 5 . 1 1 157 157 LYS CA C 157 60.026 60.026 60.410 -0.383 18933 3608 1 5 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.902 -0.480 18933 3609 1 5 . 1 1 157 157 LYS H H 157 8.175 8.175 8.448 -0.273 18933 3610 1 5 . 1 1 158 158 GLU N N 158 118.340 118.340 118.210 0.130 18933 3611 1 5 . 1 1 158 158 GLU C C 158 178.867 178.867 179.146 -0.279 18933 3612 1 5 . 1 1 158 158 GLU CA C 158 58.492 58.492 59.054 -0.562 18933 3613 1 5 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.723 0.607 18933 3614 1 5 . 1 1 158 158 GLU H H 158 7.519 7.519 8.127 -0.608 18933 3615 1 5 . 1 1 159 159 LEU N N 159 120.710 120.710 121.776 -1.066 18933 3616 1 5 . 1 1 159 159 LEU C C 159 176.526 176.526 178.319 -1.793 18933 3617 1 5 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.323 -0.153 18933 3618 1 5 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.758 -1.843 18933 3619 1 5 . 1 1 159 159 LEU H H 159 7.524 7.524 8.090 -0.566 18933 3620 1 5 . 1 1 160 160 ILE N N 160 118.217 118.217 118.519 -0.302 18933 3621 1 5 . 1 1 160 160 ILE C C 160 177.213 177.213 178.023 -0.810 18933 3622 1 5 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.611 -0.581 18933 3623 1 5 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.353 0.153 18933 3624 1 5 . 1 1 160 160 ILE H H 160 7.741 7.741 8.335 -0.594 18933 3625 1 5 . 1 1 161 161 LYS N N 161 118.450 118.450 119.696 -1.246 18933 3626 1 5 . 1 1 161 161 LYS C C 161 180.999 180.999 179.003 1.996 18933 3627 1 5 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.432 -0.617 18933 3628 1 5 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.255 -1.277 18933 3629 1 5 . 1 1 161 161 LYS H H 161 7.382 7.382 7.909 -0.527 18933 3630 1 5 . 1 1 162 162 GLU N N 162 121.846 121.846 119.809 2.037 18933 3631 1 5 . 1 1 162 162 GLU C C 162 178.818 178.818 178.731 0.087 18933 3632 1 5 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.437 -0.388 18933 3633 1 5 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.250 -1.314 18933 3634 1 5 . 1 1 162 162 GLU H H 162 8.210 8.210 7.687 0.523 18933 3635 1 5 . 1 1 163 163 LEU N N 163 116.751 116.751 115.112 1.639 18933 3636 1 5 . 1 1 163 163 LEU C C 163 176.784 176.784 177.129 -0.345 18933 3637 1 5 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.577 -0.555 18933 3638 1 5 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.900 -0.591 18933 3639 1 5 . 1 1 163 163 LEU H H 163 7.796 7.796 7.595 0.201 18933 3640 1 5 . 1 1 164 164 GLY N N 164 104.849 104.849 105.574 -0.725 18933 3641 1 5 . 1 1 164 164 GLY C C 164 174.492 174.492 174.086 0.406 18933 3642 1 5 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.233 -0.501 18933 3643 1 5 . 1 1 164 164 GLY H H 164 7.589 7.589 7.420 0.169 18933 3644 1 5 . 1 1 165 165 PHE N N 165 118.902 118.902 119.475 -0.573 18933 3645 1 5 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.223 -0.555 18933 3646 1 5 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.261 -1.776 18933 3647 1 5 . 1 1 165 165 PHE H H 165 7.251 7.251 8.061 -0.810 18933 3648 1 5 . 1 1 166 166 THR N N 166 117.093 117.093 116.603 0.490 18933 3649 1 5 . 1 1 166 166 THR CA C 166 62.245 62.245 61.889 0.356 18933 3650 1 5 . 1 1 166 166 THR CB C 166 69.323 69.323 68.926 0.397 18933 3651 1 5 . 1 1 166 166 THR H H 166 8.407 8.407 8.155 0.252 18933 3652 1 5 . 1 1 168 168 ARG N N 168 127.431 127.431 122.436 4.995 18933 3653 1 5 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.577 -2.338 18933 3654 1 5 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.229 -1.237 18933 3655 1 5 . 1 1 168 168 ARG H H 168 7.160 7.160 8.798 -1.638 18933 3656 1 5 . 1 1 171 171 LYS N N 171 113.574 113.574 119.407 -5.833 18933 3657 1 5 . 1 1 171 171 LYS C C 171 176.416 176.416 177.803 -1.387 18933 3658 1 5 . 1 1 171 171 LYS CA C 171 57.605 57.605 59.073 -1.468 18933 3659 1 5 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.702 0.227 18933 3660 1 5 . 1 1 171 171 LYS H H 171 8.210 8.210 8.358 -0.148 18933 3661 1 5 . 1 1 172 172 LYS N N 172 117.313 117.313 119.257 -1.944 18933 3662 1 5 . 1 1 172 172 LYS C C 172 175.717 175.717 176.099 -0.382 18933 3663 1 5 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.258 -2.083 18933 3664 1 5 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.548 -0.936 18933 3665 1 5 . 1 1 172 172 LYS H H 172 7.761 7.761 7.438 0.323 18933 3666 1 5 . 1 1 173 173 ARG N N 173 122.056 122.056 116.581 5.475 18933 3667 1 5 . 1 1 173 173 ARG C C 173 172.850 172.850 174.869 -2.019 18933 3668 1 5 . 1 1 173 173 ARG CA C 173 56.878 56.878 57.095 -0.217 18933 3669 1 5 . 1 1 173 173 ARG CB C 173 28.506 28.506 27.821 0.685 18933 3670 1 5 . 1 1 173 173 ARG H H 173 6.885 6.885 7.630 -0.745 18933 3671 1 6 . 1 1 2 2 LEU N N 2 122.812 122.812 125.693 -2.881 18933 3672 1 6 . 1 1 2 2 LEU C C 2 175.742 175.742 176.422 -0.680 18933 3673 1 6 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.725 0.409 18933 3674 1 6 . 1 1 2 2 LEU CB C 2 42.842 42.842 44.998 -2.156 18933 3675 1 6 . 1 1 2 2 LEU H H 2 8.756 8.756 8.608 0.148 18933 3676 1 6 . 1 1 3 3 THR N N 3 113.000 113.000 114.233 -1.233 18933 3677 1 6 . 1 1 3 3 THR C C 3 175.938 175.938 175.237 0.701 18933 3678 1 6 . 1 1 3 3 THR CA C 3 60.550 60.550 60.692 -0.142 18933 3679 1 6 . 1 1 3 3 THR CB C 3 70.781 70.781 70.462 0.319 18933 3680 1 6 . 1 1 3 3 THR H H 3 8.428 8.428 8.170 0.258 18933 3681 1 6 . 1 1 4 4 LEU N N 4 122.531 122.531 123.416 -0.885 18933 3682 1 6 . 1 1 4 4 LEU C C 4 178.463 178.463 178.579 -0.116 18933 3683 1 6 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.590 -0.461 18933 3684 1 6 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.027 -2.493 18933 3685 1 6 . 1 1 4 4 LEU H H 4 7.731 7.731 7.942 -0.211 18933 3686 1 6 . 1 1 5 5 ILE N N 5 115.505 115.505 117.597 -2.092 18933 3687 1 6 . 1 1 5 5 ILE C C 5 178.573 178.573 177.844 0.729 18933 3688 1 6 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.370 -0.632 18933 3689 1 6 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.343 -0.471 18933 3690 1 6 . 1 1 5 5 ILE H H 5 7.645 7.645 8.000 -0.355 18933 3691 1 6 . 1 1 6 6 GLN N N 6 121.626 121.626 119.410 2.216 18933 3692 1 6 . 1 1 6 6 GLN C C 6 179.014 179.014 178.575 0.439 18933 3693 1 6 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.035 -0.704 18933 3694 1 6 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.534 0.655 18933 3695 1 6 . 1 1 6 6 GLN H H 6 7.645 7.645 8.063 -0.418 18933 3696 1 6 . 1 1 7 7 GLY N N 7 107.684 107.684 106.798 0.886 18933 3697 1 6 . 1 1 7 7 GLY C C 7 174.749 174.749 176.218 -1.469 18933 3698 1 6 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.843 -0.053 18933 3699 1 6 . 1 1 7 7 GLY H H 7 8.660 8.660 8.147 0.513 18933 3700 1 6 . 1 1 8 8 LYS N N 8 120.942 120.942 122.488 -1.546 18933 3701 1 6 . 1 1 8 8 LYS C C 8 179.455 179.455 178.638 0.817 18933 3702 1 6 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.953 -0.049 18933 3703 1 6 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.404 -0.982 18933 3704 1 6 . 1 1 8 8 LYS H H 8 8.518 8.518 7.568 0.950 18933 3705 1 6 . 1 1 9 9 LYS N N 9 120.710 120.710 119.705 1.005 18933 3706 1 6 . 1 1 9 9 LYS C C 9 179.823 179.823 179.334 0.489 18933 3707 1 6 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.495 0.127 18933 3708 1 6 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.447 -1.151 18933 3709 1 6 . 1 1 9 9 LYS H H 9 7.731 7.731 8.104 -0.373 18933 3710 1 6 . 1 1 10 10 ILE N N 10 121.345 121.345 120.515 0.830 18933 3711 1 6 . 1 1 10 10 ILE C C 10 177.789 177.789 178.300 -0.511 18933 3712 1 6 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.896 -1.431 18933 3713 1 6 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.281 -1.916 18933 3714 1 6 . 1 1 10 10 ILE H H 10 7.711 7.711 8.285 -0.574 18933 3715 1 6 . 1 1 11 11 VAL N N 11 120.258 120.258 120.237 0.021 18933 3716 1 6 . 1 1 11 11 VAL C C 11 177.372 177.372 177.836 -0.464 18933 3717 1 6 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.228 0.223 18933 3718 1 6 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.558 -1.024 18933 3719 1 6 . 1 1 11 11 VAL H H 11 7.918 7.918 8.421 -0.503 18933 3720 1 6 . 1 1 12 12 ASN N N 12 116.971 116.971 117.780 -0.809 18933 3721 1 6 . 1 1 12 12 ASN C C 12 177.445 177.445 177.770 -0.325 18933 3722 1 6 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.184 -0.072 18933 3723 1 6 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.512 -0.879 18933 3724 1 6 . 1 1 12 12 ASN H H 12 7.993 7.993 8.630 -0.637 18933 3725 1 6 . 1 1 13 13 HIS N N 13 120.258 120.258 119.506 0.752 18933 3726 1 6 . 1 1 13 13 HIS C C 13 177.862 177.862 178.160 -0.298 18933 3727 1 6 . 1 1 13 13 HIS CA C 13 59.098 59.098 58.065 1.033 18933 3728 1 6 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.571 0.661 18933 3729 1 6 . 1 1 13 13 HIS H H 13 7.741 7.741 8.180 -0.439 18933 3730 1 6 . 1 1 14 14 LEU N N 14 116.641 116.641 120.125 -3.484 18933 3731 1 6 . 1 1 14 14 LEU C C 14 179.186 179.186 178.194 0.992 18933 3732 1 6 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.176 -1.419 18933 3733 1 6 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.661 -0.542 18933 3734 1 6 . 1 1 14 14 LEU H H 14 8.221 8.221 8.512 -0.291 18933 3735 1 6 . 1 1 15 15 ARG N N 15 115.957 115.957 114.895 1.062 18933 3736 1 6 . 1 1 15 15 ARG C C 15 176.330 176.330 178.214 -1.884 18933 3737 1 6 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.685 1.018 18933 3738 1 6 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.330 -1.253 18933 3739 1 6 . 1 1 15 15 ARG H H 15 7.968 7.968 8.389 -0.421 18933 3740 1 6 . 1 1 16 16 SER N N 16 109.395 109.395 115.605 -6.210 18933 3741 1 6 . 1 1 16 16 SER C C 16 176.024 176.024 175.047 0.977 18933 3742 1 6 . 1 1 16 16 SER CA C 16 57.282 57.282 60.370 -3.088 18933 3743 1 6 . 1 1 16 16 SER CB C 16 63.683 63.683 63.724 -0.041 18933 3744 1 6 . 1 1 16 16 SER H H 16 6.963 6.963 7.466 -0.503 18933 3745 1 6 . 1 1 17 17 ARG N N 17 122.775 122.775 121.760 1.015 18933 3746 1 6 . 1 1 17 17 ARG C C 17 174.590 174.590 174.011 0.579 18933 3747 1 6 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.982 1.291 18933 3748 1 6 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.311 1.491 18933 3749 1 6 . 1 1 17 17 ARG H H 17 7.781 7.781 8.306 -0.525 18933 3750 1 6 . 1 1 18 18 LEU N N 18 122.421 122.421 125.838 -3.417 18933 3751 1 6 . 1 1 18 18 LEU C C 18 176.281 176.281 174.047 2.234 18933 3752 1 6 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.429 0.351 18933 3753 1 6 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.869 -3.658 18933 3754 1 6 . 1 1 18 18 LEU H H 18 8.650 8.650 7.780 0.870 18933 3755 1 6 . 1 1 19 19 ALA N N 19 126.441 126.441 126.965 -0.524 18933 3756 1 6 . 1 1 19 19 ALA C C 19 173.904 173.904 174.850 -0.946 18933 3757 1 6 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.615 -0.749 18933 3758 1 6 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.287 0.578 18933 3759 1 6 . 1 1 19 19 ALA H H 19 8.609 8.609 8.859 -0.250 18933 3760 1 6 . 1 1 20 20 PHE N N 20 114.600 114.600 118.970 -4.370 18933 3761 1 6 . 1 1 20 20 PHE C C 20 172.592 172.592 173.888 -1.296 18933 3762 1 6 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.966 0.823 18933 3763 1 6 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.664 -0.975 18933 3764 1 6 . 1 1 20 20 PHE H H 20 8.801 8.801 9.147 -0.346 18933 3765 1 6 . 1 1 21 21 GLU N N 21 122.873 122.873 123.075 -0.202 18933 3766 1 6 . 1 1 21 21 GLU C C 21 174.872 174.872 175.264 -0.392 18933 3767 1 6 . 1 1 21 21 GLU CA C 21 55.062 55.062 54.921 0.141 18933 3768 1 6 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.194 -0.469 18933 3769 1 6 . 1 1 21 21 GLU H H 21 7.847 7.847 9.198 -1.351 18933 3770 1 6 . 1 1 22 22 TYR N N 22 126.270 126.270 126.572 -0.302 18933 3771 1 6 . 1 1 22 22 TYR C C 22 174.872 174.872 174.731 0.141 18933 3772 1 6 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.488 -0.740 18933 3773 1 6 . 1 1 22 22 TYR CB C 22 40.105 40.105 40.800 -0.695 18933 3774 1 6 . 1 1 22 22 TYR H H 22 8.806 8.806 9.174 -0.368 18933 3775 1 6 . 1 1 23 23 ASN N N 23 128.420 128.420 125.636 2.784 18933 3776 1 6 . 1 1 23 23 ASN C C 23 175.435 175.435 175.065 0.370 18933 3777 1 6 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.680 -0.675 18933 3778 1 6 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.880 -1.515 18933 3779 1 6 . 1 1 23 23 ASN H H 23 8.943 8.943 9.197 -0.254 18933 3780 1 6 . 1 1 24 24 GLY N N 24 104.067 104.067 102.221 1.846 18933 3781 1 6 . 1 1 24 24 GLY C C 24 173.707 173.707 173.859 -0.152 18933 3782 1 6 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.907 0.027 18933 3783 1 6 . 1 1 24 24 GLY H H 24 8.534 8.534 8.121 0.413 18933 3784 1 6 . 1 1 25 25 GLN N N 25 120.038 120.038 120.050 -0.012 18933 3785 1 6 . 1 1 25 25 GLN C C 25 173.744 173.744 174.945 -1.201 18933 3786 1 6 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.612 -1.285 18933 3787 1 6 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.072 0.589 18933 3788 1 6 . 1 1 25 25 GLN H H 25 7.595 7.595 7.798 -0.203 18933 3789 1 6 . 1 1 26 26 LEU N N 26 124.681 124.681 124.986 -0.305 18933 3790 1 6 . 1 1 26 26 LEU C C 26 175.987 175.987 176.258 -0.271 18933 3791 1 6 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.402 -0.389 18933 3792 1 6 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.595 -1.730 18933 3793 1 6 . 1 1 26 26 LEU H H 26 8.382 8.382 8.552 -0.170 18933 3794 1 6 . 1 1 27 27 ILE N N 27 130.779 130.779 127.165 3.614 18933 3795 1 6 . 1 1 27 27 ILE C C 27 175.215 175.215 174.281 0.934 18933 3796 1 6 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.686 -0.427 18933 3797 1 6 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.360 -2.628 18933 3798 1 6 . 1 1 27 27 ILE H H 27 8.882 8.882 8.922 -0.040 18933 3799 1 6 . 1 1 28 28 LYS N N 28 126.160 126.160 127.488 -1.328 18933 3800 1 6 . 1 1 28 28 LYS C C 28 176.771 176.771 175.681 1.090 18933 3801 1 6 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.847 1.991 18933 3802 1 6 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.313 -1.575 18933 3803 1 6 . 1 1 28 28 LYS H H 28 8.165 8.165 8.380 -0.215 18933 3804 1 6 . 1 1 29 29 ILE N N 29 126.380 126.380 121.464 4.916 18933 3805 1 6 . 1 1 29 29 ILE C C 29 175.877 175.877 173.922 1.955 18933 3806 1 6 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.447 -0.139 18933 3807 1 6 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.512 -2.449 18933 3808 1 6 . 1 1 29 29 ILE H H 29 8.019 8.019 8.751 -0.732 18933 3809 1 6 . 1 1 30 30 LEU N N 30 129.215 129.215 122.463 6.752 18933 3810 1 6 . 1 1 30 30 LEU C C 30 178.867 178.867 178.083 0.784 18933 3811 1 6 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.361 1.258 18933 3812 1 6 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.729 -4.864 18933 3813 1 6 . 1 1 30 30 LEU H H 30 8.917 8.917 8.316 0.601 18933 3814 1 6 . 1 1 31 31 SER N N 31 117.997 117.997 116.209 1.788 18933 3815 1 6 . 1 1 31 31 SER C C 31 177.396 177.396 175.648 1.748 18933 3816 1 6 . 1 1 31 31 SER CA C 31 61.236 61.236 60.865 0.371 18933 3817 1 6 . 1 1 31 31 SER CB C 31 62.035 62.035 63.217 -1.182 18933 3818 1 6 . 1 1 31 31 SER H H 31 8.594 8.594 8.884 -0.290 18933 3819 1 6 . 1 1 32 32 LYS N N 32 116.189 116.189 119.452 -3.263 18933 3820 1 6 . 1 1 32 32 LYS C C 32 176.244 176.244 176.971 -0.727 18933 3821 1 6 . 1 1 32 32 LYS CA C 32 57.403 57.403 57.988 -0.585 18933 3822 1 6 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.484 -2.203 18933 3823 1 6 . 1 1 32 32 LYS H H 32 8.029 8.029 8.166 -0.137 18933 3824 1 6 . 1 1 33 33 ASN N N 33 119.061 119.061 116.396 2.665 18933 3825 1 6 . 1 1 33 33 ASN C C 33 172.384 172.384 173.697 -1.313 18933 3826 1 6 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.853 -1.696 18933 3827 1 6 . 1 1 33 33 ASN CB C 33 38.267 38.267 40.891 -2.623 18933 3828 1 6 . 1 1 33 33 ASN H H 33 7.902 7.902 7.797 0.105 18933 3829 1 6 . 1 1 34 34 ILE N N 34 120.038 120.038 119.926 0.112 18933 3830 1 6 . 1 1 34 34 ILE C C 34 175.607 175.607 174.515 1.092 18933 3831 1 6 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.080 0.471 18933 3832 1 6 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.439 -2.475 18933 3833 1 6 . 1 1 34 34 ILE H H 34 7.443 7.443 7.795 -0.352 18933 3834 1 6 . 1 1 35 35 VAL N N 35 129.435 129.435 125.873 3.562 18933 3835 1 6 . 1 1 35 35 VAL C C 35 175.386 175.386 174.483 0.903 18933 3836 1 6 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.261 -0.235 18933 3837 1 6 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.860 -1.079 18933 3838 1 6 . 1 1 35 35 VAL H H 35 9.533 9.533 8.825 0.708 18933 3839 1 6 . 1 1 36 36 ALA N N 36 130.571 130.571 129.571 1.000 18933 3840 1 6 . 1 1 36 36 ALA C C 36 177.347 177.347 176.582 0.765 18933 3841 1 6 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.407 0.991 18933 3842 1 6 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.970 -1.112 18933 3843 1 6 . 1 1 36 36 ALA H H 36 8.665 8.665 8.573 0.092 18933 3844 1 6 . 1 1 37 37 VAL N N 37 115.395 115.395 121.867 -6.472 18933 3845 1 6 . 1 1 37 37 VAL C C 37 174.455 174.455 176.380 -1.925 18933 3846 1 6 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.318 0.062 18933 3847 1 6 . 1 1 37 37 VAL CB C 37 32.943 32.943 35.042 -2.099 18933 3848 1 6 . 1 1 37 37 VAL H H 37 8.079 8.079 8.278 -0.199 18933 3849 1 6 . 1 1 38 38 GLY N N 38 107.672 107.672 108.245 -0.573 18933 3850 1 6 . 1 1 38 38 GLY C C 38 173.364 173.364 175.731 -2.367 18933 3851 1 6 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.235 -0.050 18933 3852 1 6 . 1 1 38 38 GLY H H 38 7.579 7.579 8.276 -0.697 18933 3853 1 6 . 1 1 39 39 SER N N 39 121.052 121.052 119.821 1.231 18933 3854 1 6 . 1 1 39 39 SER C C 39 175.570 175.570 176.579 -1.009 18933 3855 1 6 . 1 1 39 39 SER CA C 39 61.801 61.801 61.959 -0.158 18933 3856 1 6 . 1 1 39 39 SER CB C 39 62.478 62.478 63.398 -0.920 18933 3857 1 6 . 1 1 39 39 SER H H 39 8.953 8.953 8.092 0.861 18933 3858 1 6 . 1 1 40 40 LEU N N 40 121.553 121.553 121.082 0.471 18933 3859 1 6 . 1 1 40 40 LEU C C 40 180.203 180.203 177.705 2.498 18933 3860 1 6 . 1 1 40 40 LEU CA C 40 58.129 58.129 57.859 0.270 18933 3861 1 6 . 1 1 40 40 LEU CB C 40 41.753 41.753 42.099 -0.346 18933 3862 1 6 . 1 1 40 40 LEU H H 40 8.195 8.195 7.298 0.897 18933 3863 1 6 . 1 1 41 41 ARG N N 41 121.956 121.956 116.605 5.351 18933 3864 1 6 . 1 1 41 41 ARG C C 41 177.323 177.323 177.961 -0.638 18933 3865 1 6 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.934 0.397 18933 3866 1 6 . 1 1 41 41 ARG CB C 41 28.443 28.443 30.036 -1.593 18933 3867 1 6 . 1 1 41 41 ARG H H 41 6.873 6.873 7.363 -0.490 18933 3868 1 6 . 1 1 42 42 ARG N N 42 114.600 114.600 116.536 -1.936 18933 3869 1 6 . 1 1 42 42 ARG C C 42 172.911 172.911 175.812 -2.901 18933 3870 1 6 . 1 1 42 42 ARG CA C 42 57.242 57.242 56.941 0.301 18933 3871 1 6 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.965 -1.825 18933 3872 1 6 . 1 1 42 42 ARG H H 42 7.438 7.438 8.174 -0.736 18933 3873 1 6 . 1 1 43 43 GLU N N 43 113.354 113.354 116.158 -2.804 18933 3874 1 6 . 1 1 43 43 GLU C C 43 175.999 175.999 175.856 0.143 18933 3875 1 6 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.057 -0.501 18933 3876 1 6 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.589 -2.252 18933 3877 1 6 . 1 1 43 43 GLU H H 43 7.564 7.564 8.164 -0.600 18933 3878 1 6 . 1 1 44 44 GLU N N 44 119.696 119.696 122.607 -2.911 18933 3879 1 6 . 1 1 44 44 GLU C C 44 175.423 175.423 177.621 -2.198 18933 3880 1 6 . 1 1 44 44 GLU CA C 44 56.838 56.838 58.075 -1.237 18933 3881 1 6 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.326 -1.630 18933 3882 1 6 . 1 1 44 44 GLU H H 44 7.261 7.261 8.660 -1.399 18933 3883 1 6 . 1 1 45 45 LYS N N 45 117.435 117.435 116.488 0.947 18933 3884 1 6 . 1 1 45 45 LYS C C 45 177.715 177.715 175.647 2.068 18933 3885 1 6 . 1 1 45 45 LYS CA C 45 59.219 59.219 57.418 1.801 18933 3886 1 6 . 1 1 45 45 LYS CB C 45 32.119 32.119 33.776 -1.657 18933 3887 1 6 . 1 1 45 45 LYS H H 45 7.938 7.938 8.225 -0.287 18933 3888 1 6 . 1 1 46 46 MET N N 46 115.847 115.847 117.832 -1.985 18933 3889 1 6 . 1 1 46 46 MET CA C 46 52.520 52.520 53.782 -1.262 18933 3890 1 6 . 1 1 46 46 MET CB C 46 33.450 33.450 34.926 -1.476 18933 3891 1 6 . 1 1 46 46 MET H H 46 7.595 7.595 7.674 -0.079 18933 3892 1 6 . 1 1 47 47 LEU N N 47 121.627 121.627 121.767 -0.140 18933 3893 1 6 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.313 -1.187 18933 3894 1 6 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.281 -0.211 18933 3895 1 6 . 1 1 47 47 LEU H H 47 9.220 9.220 8.921 0.299 18933 3896 1 6 . 1 1 49 49 ASP N N 49 117.093 117.093 118.203 -1.110 18933 3897 1 6 . 1 1 49 49 ASP C C 49 173.340 173.340 174.245 -0.905 18933 3898 1 6 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.632 -1.838 18933 3899 1 6 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.450 -1.444 18933 3900 1 6 . 1 1 49 49 ASP H H 49 7.761 7.761 7.533 0.228 18933 3901 1 6 . 1 1 50 50 VAL N N 50 119.012 119.012 119.300 -0.288 18933 3902 1 6 . 1 1 50 50 VAL C C 50 173.070 173.070 174.024 -0.954 18933 3903 1 6 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.442 1.400 18933 3904 1 6 . 1 1 50 50 VAL CB C 50 32.563 32.563 32.860 -0.297 18933 3905 1 6 . 1 1 50 50 VAL H H 50 8.089 8.089 8.352 -0.263 18933 3906 1 6 . 1 1 51 51 ASP N N 51 127.064 127.064 125.966 1.098 18933 3907 1 6 . 1 1 51 51 ASP C C 51 174.565 174.565 175.428 -0.863 18933 3908 1 6 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.840 -0.683 18933 3909 1 6 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.353 -0.713 18933 3910 1 6 . 1 1 51 51 ASP H H 51 8.069 8.069 8.056 0.013 18933 3911 1 6 . 1 1 52 52 LEU N N 52 121.627 121.627 120.032 1.595 18933 3912 1 6 . 1 1 52 52 LEU C C 52 174.063 174.063 174.733 -0.670 18933 3913 1 6 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.501 -0.819 18933 3914 1 6 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.327 -2.976 18933 3915 1 6 . 1 1 52 52 LEU H H 52 8.852 8.852 9.040 -0.188 18933 3916 1 6 . 1 1 53 53 LEU N N 53 123.093 123.093 122.508 0.585 18933 3917 1 6 . 1 1 53 53 LEU CA C 53 55.991 55.991 53.765 2.226 18933 3918 1 6 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.514 -2.381 18933 3919 1 6 . 1 1 53 53 LEU H H 53 9.362 9.362 9.087 0.275 18933 3920 1 6 . 1 1 54 54 ILE N N 54 123.777 123.777 126.560 -2.783 18933 3921 1 6 . 1 1 54 54 ILE CA C 54 55.062 55.062 60.233 -5.171 18933 3922 1 6 . 1 1 54 54 ILE CB C 54 33.070 33.070 37.851 -4.781 18933 3923 1 6 . 1 1 54 54 ILE H H 54 8.907 8.907 9.450 -0.543 18933 3924 1 6 . 1 1 58 58 GLU N N 58 114.710 114.710 117.575 -2.865 18933 3925 1 6 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.538 -1.161 18933 3926 1 6 . 1 1 58 58 GLU CB C 58 31.422 31.422 33.125 -1.703 18933 3927 1 6 . 1 1 58 58 GLU H H 58 6.716 6.716 7.421 -0.705 18933 3928 1 6 . 1 1 61 61 LEU N N 61 115.957 115.957 120.360 -4.403 18933 3929 1 6 . 1 1 61 61 LEU C C 61 178.512 178.512 178.091 0.421 18933 3930 1 6 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.144 -2.364 18933 3931 1 6 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.506 -0.387 18933 3932 1 6 . 1 1 61 61 LEU H H 61 7.307 7.307 7.925 -0.618 18933 3933 1 6 . 1 1 62 62 LEU N N 62 120.038 120.038 119.315 0.723 18933 3934 1 6 . 1 1 62 62 LEU C C 62 177.874 177.874 178.785 -0.911 18933 3935 1 6 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.480 0.456 18933 3936 1 6 . 1 1 62 62 LEU CB C 62 40.739 40.739 42.004 -1.265 18933 3937 1 6 . 1 1 62 62 LEU H H 62 7.327 7.327 8.059 -0.732 18933 3938 1 6 . 1 1 63 63 LYS N N 63 114.600 114.600 115.461 -0.861 18933 3939 1 6 . 1 1 63 63 LYS C C 63 175.460 175.460 177.488 -2.028 18933 3940 1 6 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.608 -1.044 18933 3941 1 6 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.595 -1.870 18933 3942 1 6 . 1 1 63 63 LYS H H 63 7.973 7.973 7.801 0.172 18933 3943 1 6 . 1 1 64 64 HIS N N 64 115.273 115.273 116.092 -0.819 18933 3944 1 6 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.518 0.594 18933 3945 1 6 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.279 2.157 18933 3946 1 6 . 1 1 64 64 HIS H H 64 7.544 7.544 7.578 -0.034 18933 3947 1 6 . 1 1 65 65 VAL N N 65 118.682 118.682 118.285 0.397 18933 3948 1 6 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.591 3.447 18933 3949 1 6 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.249 -2.222 18933 3950 1 6 . 1 1 65 65 VAL H H 65 6.787 6.787 7.104 -0.317 18933 3951 1 6 . 1 1 68 68 ASN N N 68 112.108 112.108 118.185 -6.077 18933 3952 1 6 . 1 1 68 68 ASN C C 68 174.884 174.884 173.937 0.947 18933 3953 1 6 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.394 -1.367 18933 3954 1 6 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.351 0.881 18933 3955 1 6 . 1 1 68 68 ASN H H 68 7.009 7.009 8.322 -1.313 18933 3956 1 6 . 1 1 69 69 ILE N N 69 123.325 123.325 123.515 -0.190 18933 3957 1 6 . 1 1 69 69 ILE C C 69 174.394 174.394 175.523 -1.129 18933 3958 1 6 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.613 -1.506 18933 3959 1 6 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.589 -0.322 18933 3960 1 6 . 1 1 69 69 ILE H H 69 7.150 7.150 8.238 -1.088 18933 3961 1 6 . 1 1 70 70 ARG N N 70 126.722 126.722 127.710 -0.988 18933 3962 1 6 . 1 1 70 70 ARG C C 70 174.590 174.590 174.428 0.162 18933 3963 1 6 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.629 -1.382 18933 3964 1 6 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.951 -2.579 18933 3965 1 6 . 1 1 70 70 ARG H H 70 8.902 8.902 9.236 -0.334 18933 3966 1 6 . 1 1 71 71 ILE N N 71 119.978 119.978 120.357 -0.379 18933 3967 1 6 . 1 1 71 71 ILE C C 71 175.583 175.583 175.850 -0.267 18933 3968 1 6 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.793 0.031 18933 3969 1 6 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.048 -2.288 18933 3970 1 6 . 1 1 71 71 ILE H H 71 7.491 7.491 8.757 -1.266 18933 3971 1 6 . 1 1 72 72 LYS N N 72 128.530 128.530 125.139 3.391 18933 3972 1 6 . 1 1 72 72 LYS C C 72 177.703 177.703 176.166 1.537 18933 3973 1 6 . 1 1 72 72 LYS CA C 72 57.201 57.201 54.572 2.628 18933 3974 1 6 . 1 1 72 72 LYS CB C 72 31.485 31.485 30.929 0.556 18933 3975 1 6 . 1 1 72 72 LYS H H 72 8.523 8.523 8.508 0.015 18933 3976 1 6 . 1 1 73 73 GLY N N 73 113.806 113.806 110.007 3.799 18933 3977 1 6 . 1 1 73 73 GLY C C 73 173.781 173.781 172.883 0.898 18933 3978 1 6 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.176 0.646 18933 3979 1 6 . 1 1 73 73 GLY H H 73 8.791 8.791 8.286 0.505 18933 3980 1 6 . 1 1 74 74 LEU N N 74 120.490 120.490 118.194 2.296 18933 3981 1 6 . 1 1 74 74 LEU C C 74 175.840 175.840 173.533 2.307 18933 3982 1 6 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.438 -0.747 18933 3983 1 6 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.264 -1.103 18933 3984 1 6 . 1 1 74 74 LEU H H 74 7.393 7.393 7.234 0.159 18933 3985 1 6 . 1 1 75 75 SER N N 75 120.038 120.038 115.750 4.288 18933 3986 1 6 . 1 1 75 75 SER C C 75 173.205 173.205 173.355 -0.150 18933 3987 1 6 . 1 1 75 75 SER CA C 75 57.887 57.887 57.650 0.237 18933 3988 1 6 . 1 1 75 75 SER CB C 75 63.049 63.049 64.817 -1.768 18933 3989 1 6 . 1 1 75 75 SER H H 75 8.917 8.917 8.106 0.811 18933 3990 1 6 . 1 1 76 76 PHE N N 76 119.586 119.586 117.533 2.053 18933 3991 1 6 . 1 1 76 76 PHE C C 76 173.536 173.536 173.788 -0.252 18933 3992 1 6 . 1 1 76 76 PHE CA C 76 55.426 55.426 56.335 -0.909 18933 3993 1 6 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.292 -0.286 18933 3994 1 6 . 1 1 76 76 PHE H H 76 8.003 8.003 8.461 -0.458 18933 3995 1 6 . 1 1 77 77 SER N N 77 114.943 114.943 115.787 -0.844 18933 3996 1 6 . 1 1 77 77 SER C C 77 173.438 173.438 172.308 1.130 18933 3997 1 6 . 1 1 77 77 SER CA C 77 56.152 56.152 56.942 -0.790 18933 3998 1 6 . 1 1 77 77 SER CB C 77 65.204 65.204 65.822 -0.618 18933 3999 1 6 . 1 1 77 77 SER H H 77 8.907 8.907 8.724 0.183 18933 4000 1 6 . 1 1 78 78 VAL N N 78 124.791 124.791 124.615 0.176 18933 4001 1 6 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.346 1.698 18933 4002 1 6 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.557 -2.375 18933 4003 1 6 . 1 1 78 78 VAL H H 78 8.892 8.892 8.253 0.639 18933 4004 1 6 . 1 1 79 79 LYS N N 79 129.667 129.667 128.917 0.750 18933 4005 1 6 . 1 1 79 79 LYS CA C 79 56.192 56.192 53.914 2.278 18933 4006 1 6 . 1 1 79 79 LYS CB C 79 32.372 32.372 35.056 -2.684 18933 4007 1 6 . 1 1 79 79 LYS H H 79 9.049 9.049 8.848 0.201 18933 4008 1 6 . 1 1 82 82 GLY N N 82 117.263 117.263 112.866 4.397 18933 4009 1 6 . 1 1 82 82 GLY C C 82 171.710 171.710 174.289 -2.579 18933 4010 1 6 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.032 -2.107 18933 4011 1 6 . 1 1 82 82 GLY H H 82 8.044 8.044 8.483 -0.439 18933 4012 1 6 . 1 1 83 83 GLU N N 83 117.203 117.203 121.714 -4.511 18933 4013 1 6 . 1 1 83 83 GLU C C 83 178.695 178.695 177.880 0.815 18933 4014 1 6 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.565 1.412 18933 4015 1 6 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.836 0.001 18933 4016 1 6 . 1 1 83 83 GLU H H 83 8.296 8.296 8.422 -0.126 18933 4017 1 6 . 1 1 84 84 ARG N N 84 113.818 113.818 119.038 -5.220 18933 4018 1 6 . 1 1 84 84 ARG C C 84 175.877 175.877 175.146 0.731 18933 4019 1 6 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.035 -1.304 18933 4020 1 6 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.178 2.117 18933 4021 1 6 . 1 1 84 84 ARG H H 84 8.342 8.342 7.890 0.452 18933 4022 1 6 . 1 1 85 85 LYS N N 85 119.354 119.354 121.456 -2.102 18933 4023 1 6 . 1 1 85 85 LYS C C 85 174.516 174.516 174.129 0.387 18933 4024 1 6 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.685 -0.945 18933 4025 1 6 . 1 1 85 85 LYS CB C 85 34.844 34.844 34.981 -0.137 18933 4026 1 6 . 1 1 85 85 LYS H H 85 6.822 6.822 7.607 -0.785 18933 4027 1 6 . 1 1 86 86 CYS N N 86 125.928 125.928 124.117 1.811 18933 4028 1 6 . 1 1 86 86 CYS C C 86 171.600 171.600 173.117 -1.517 18933 4029 1 6 . 1 1 86 86 CYS CA C 86 55.627 55.627 58.026 -2.399 18933 4030 1 6 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.730 -0.386 18933 4031 1 6 . 1 1 86 86 CYS H H 86 9.084 9.084 9.337 -0.253 18933 4032 1 6 . 1 1 87 87 VAL N N 87 126.612 126.612 126.473 0.139 18933 4033 1 6 . 1 1 87 87 VAL C C 87 174.431 174.431 173.660 0.771 18933 4034 1 6 . 1 1 87 87 VAL CA C 87 61.317 61.317 59.992 1.325 18933 4035 1 6 . 1 1 87 87 VAL CB C 87 33.196 33.196 33.519 -0.323 18933 4036 1 6 . 1 1 87 87 VAL H H 87 8.705 8.705 9.026 -0.321 18933 4037 1 6 . 1 1 88 88 LEU N N 88 127.748 127.748 124.180 3.568 18933 4038 1 6 . 1 1 88 88 LEU C C 88 175.227 175.227 174.879 0.348 18933 4039 1 6 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.557 -0.037 18933 4040 1 6 . 1 1 88 88 LEU CB C 88 44.605 44.605 45.611 -1.006 18933 4041 1 6 . 1 1 88 88 LEU H H 88 9.417 9.417 8.777 0.640 18933 4042 1 6 . 1 1 89 89 PHE N N 89 120.981 120.981 119.224 1.757 18933 4043 1 6 . 1 1 89 89 PHE C C 89 176.906 176.906 176.091 0.815 18933 4044 1 6 . 1 1 89 89 PHE CA C 89 55.587 55.587 56.279 -0.692 18933 4045 1 6 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.644 -2.743 18933 4046 1 6 . 1 1 89 89 PHE H H 89 8.937 8.937 8.767 0.170 18933 4047 1 6 . 1 1 90 90 ILE N N 90 119.928 119.928 118.375 1.553 18933 4048 1 6 . 1 1 90 90 ILE C C 90 173.781 173.781 174.864 -1.083 18933 4049 1 6 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.883 -1.230 18933 4050 1 6 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.908 0.704 18933 4051 1 6 . 1 1 90 90 ILE H H 90 9.230 9.230 9.019 0.211 18933 4052 1 6 . 1 1 91 91 GLU N N 91 124.339 124.339 124.689 -0.350 18933 4053 1 6 . 1 1 91 91 GLU C C 91 175.607 175.607 175.385 0.222 18933 4054 1 6 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.605 0.014 18933 4055 1 6 . 1 1 91 91 GLU CB C 91 29.837 29.837 33.577 -3.740 18933 4056 1 6 . 1 1 91 91 GLU H H 91 8.175 8.175 9.000 -0.825 18933 4057 1 6 . 1 1 92 92 TRP N N 92 127.516 127.516 124.846 2.670 18933 4058 1 6 . 1 1 92 92 TRP C C 92 175.203 175.203 176.354 -1.151 18933 4059 1 6 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.769 1.464 18933 4060 1 6 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.370 1.291 18933 4061 1 6 . 1 1 92 92 TRP H H 92 9.306 9.306 8.695 0.611 18933 4062 1 6 . 1 1 93 93 GLU N N 93 127.834 127.834 126.881 0.953 18933 4063 1 6 . 1 1 93 93 GLU C C 93 175.668 175.668 176.376 -0.708 18933 4064 1 6 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.573 -0.695 18933 4065 1 6 . 1 1 93 93 GLU CB C 93 26.034 26.034 28.370 -2.336 18933 4066 1 6 . 1 1 93 93 GLU H H 93 8.796 8.796 9.287 -0.491 18933 4067 1 6 . 1 1 94 94 LYS N N 94 108.931 108.931 112.309 -3.378 18933 4068 1 6 . 1 1 94 94 LYS C C 94 175.423 175.423 175.757 -0.334 18933 4069 1 6 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.953 -0.510 18933 4070 1 6 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.159 -2.526 18933 4071 1 6 . 1 1 94 94 LYS H H 94 8.498 8.498 8.628 -0.130 18933 4072 1 6 . 1 1 95 95 LYS N N 95 121.737 121.737 120.658 1.079 18933 4073 1 6 . 1 1 95 95 LYS C C 95 174.443 174.443 175.276 -0.833 18933 4074 1 6 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.582 -2.165 18933 4075 1 6 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.263 0.201 18933 4076 1 6 . 1 1 95 95 LYS H H 95 7.761 7.761 7.781 -0.020 18933 4077 1 6 . 1 1 96 96 THR N N 96 116.067 116.067 116.156 -0.089 18933 4078 1 6 . 1 1 96 96 THR C C 96 174.296 174.296 173.750 0.546 18933 4079 1 6 . 1 1 96 96 THR CA C 96 61.115 61.115 61.228 -0.113 18933 4080 1 6 . 1 1 96 96 THR CB C 96 69.450 69.450 71.896 -2.446 18933 4081 1 6 . 1 1 96 96 THR H H 96 7.761 7.761 8.393 -0.632 18933 4082 1 6 . 1 1 97 97 TYR N N 97 124.229 124.229 124.342 -0.113 18933 4083 1 6 . 1 1 97 97 TYR C C 97 173.536 173.536 173.710 -0.174 18933 4084 1 6 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.268 -0.318 18933 4085 1 6 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.888 -1.706 18933 4086 1 6 . 1 1 97 97 TYR H H 97 9.018 9.018 9.324 -0.306 18933 4087 1 6 . 1 1 98 98 GLN N N 98 123.435 123.435 124.440 -1.005 18933 4088 1 6 . 1 1 98 98 GLN C C 98 173.266 173.266 174.220 -0.954 18933 4089 1 6 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.946 -0.803 18933 4090 1 6 . 1 1 98 98 GLN CB C 98 29.013 29.013 28.756 0.257 18933 4091 1 6 . 1 1 98 98 GLN H H 98 8.781 8.781 9.215 -0.434 18933 4092 1 6 . 1 1 99 99 LEU N N 99 130.119 130.119 127.269 2.850 18933 4093 1 6 . 1 1 99 99 LEU C C 99 173.867 173.867 174.588 -0.721 18933 4094 1 6 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.384 -0.864 18933 4095 1 6 . 1 1 99 99 LEU CB C 99 44.605 44.605 44.523 0.082 18933 4096 1 6 . 1 1 99 99 LEU H H 99 9.104 9.104 8.718 0.386 18933 4097 1 6 . 1 1 100 100 ASP N N 100 125.182 125.182 126.504 -1.322 18933 4098 1 6 . 1 1 100 100 ASP C C 100 172.837 172.837 174.425 -1.588 18933 4099 1 6 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.817 -2.063 18933 4100 1 6 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.074 -3.730 18933 4101 1 6 . 1 1 100 100 ASP H H 100 9.089 9.089 8.849 0.240 18933 4102 1 6 . 1 1 101 101 LEU N N 101 121.174 121.174 126.926 -5.752 18933 4103 1 6 . 1 1 101 101 LEU C C 101 174.529 174.529 175.544 -1.015 18933 4104 1 6 . 1 1 101 101 LEU CA C 101 51.915 51.915 54.091 -2.176 18933 4105 1 6 . 1 1 101 101 LEU CB C 101 43.908 43.908 44.984 -1.076 18933 4106 1 6 . 1 1 101 101 LEU H H 101 8.458 8.458 9.313 -0.855 18933 4107 1 6 . 1 1 102 102 PHE N N 102 119.464 119.464 124.285 -4.821 18933 4108 1 6 . 1 1 102 102 PHE C C 102 176.293 176.293 174.996 1.297 18933 4109 1 6 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.273 -1.218 18933 4110 1 6 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.127 -0.247 18933 4111 1 6 . 1 1 102 102 PHE H H 102 8.281 8.281 9.479 -1.198 18933 4112 1 6 . 1 1 103 103 THR N N 103 108.576 108.576 118.066 -9.490 18933 4113 1 6 . 1 1 103 103 THR C C 103 174.933 174.933 173.207 1.726 18933 4114 1 6 . 1 1 103 103 THR CA C 103 57.726 57.726 60.035 -2.309 18933 4115 1 6 . 1 1 103 103 THR CB C 103 71.288 71.288 69.159 2.130 18933 4116 1 6 . 1 1 103 103 THR H H 103 7.872 7.872 8.349 -0.477 18933 4117 1 6 . 1 1 104 104 ALA N N 104 122.885 122.885 128.839 -5.954 18933 4118 1 6 . 1 1 104 104 ALA C C 104 175.754 175.754 174.814 0.940 18933 4119 1 6 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.849 0.169 18933 4120 1 6 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.521 -0.036 18933 4121 1 6 . 1 1 104 104 ALA H H 104 8.660 8.660 9.226 -0.566 18933 4122 1 6 . 1 1 105 105 LEU N N 105 120.881 120.881 120.108 0.773 18933 4123 1 6 . 1 1 105 105 LEU C C 105 179.504 179.504 178.103 1.401 18933 4124 1 6 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.521 -1.274 18933 4125 1 6 . 1 1 105 105 LEU CB C 105 41.753 41.753 43.188 -1.435 18933 4126 1 6 . 1 1 105 105 LEU H H 105 8.226 8.226 8.451 -0.225 18933 4127 1 6 . 1 1 106 106 ALA N N 106 124.901 124.901 122.677 2.224 18933 4128 1 6 . 1 1 106 106 ALA C C 106 181.269 181.269 179.577 1.692 18933 4129 1 6 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.748 1.565 18933 4130 1 6 . 1 1 106 106 ALA CB C 106 17.224 17.224 19.129 -1.905 18933 4131 1 6 . 1 1 106 106 ALA H H 106 8.392 8.392 8.454 -0.062 18933 4132 1 6 . 1 1 107 107 GLU N N 107 116.409 116.409 117.673 -1.264 18933 4133 1 6 . 1 1 107 107 GLU C C 107 177.764 177.764 177.505 0.259 18933 4134 1 6 . 1 1 107 107 GLU CA C 107 58.533 58.533 58.947 -0.414 18933 4135 1 6 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.648 -1.712 18933 4136 1 6 . 1 1 107 107 GLU H H 107 9.664 9.664 8.649 1.015 18933 4137 1 6 . 1 1 108 108 GLU N N 108 116.189 116.189 116.248 -0.059 18933 4138 1 6 . 1 1 108 108 GLU CA C 108 55.143 55.143 57.516 -2.373 18933 4139 1 6 . 1 1 108 108 GLU CB C 108 29.837 29.837 29.120 0.716 18933 4140 1 6 . 1 1 108 108 GLU H H 108 7.589 7.589 8.420 -0.831 18933 4141 1 6 . 1 1 109 109 LYS N N 109 119.928 119.928 120.846 -0.918 18933 4142 1 6 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.383 1.468 18933 4143 1 6 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.837 -0.365 18933 4144 1 6 . 1 1 109 109 LYS H H 109 7.514 7.514 7.554 -0.040 18933 4145 1 6 . 1 1 111 111 TYR N N 111 114.930 114.930 119.092 -4.162 18933 4146 1 6 . 1 1 111 111 TYR C C 111 179.504 179.504 177.823 1.681 18933 4147 1 6 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.050 -2.034 18933 4148 1 6 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.516 -1.848 18933 4149 1 6 . 1 1 111 111 TYR H H 111 6.393 6.393 8.499 -2.106 18933 4150 1 6 . 1 1 112 112 ALA N N 112 124.901 124.901 121.890 3.011 18933 4151 1 6 . 1 1 112 112 ALA C C 112 179.173 179.173 179.494 -0.321 18933 4152 1 6 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.550 -0.649 18933 4153 1 6 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.327 -0.215 18933 4154 1 6 . 1 1 112 112 ALA H H 112 8.554 8.554 8.202 0.352 18933 4155 1 6 . 1 1 113 113 ILE N N 113 119.464 119.464 119.927 -0.463 18933 4156 1 6 . 1 1 113 113 ILE C C 113 178.499 178.499 177.681 0.818 18933 4157 1 6 . 1 1 113 113 ILE CA C 113 66.281 66.281 64.079 2.203 18933 4158 1 6 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.893 -0.577 18933 4159 1 6 . 1 1 113 113 ILE H H 113 8.680 8.680 7.617 1.063 18933 4160 1 6 . 1 1 114 114 PHE N N 114 122.922 122.922 121.987 0.935 18933 4161 1 6 . 1 1 114 114 PHE C C 114 178.217 178.217 178.187 0.030 18933 4162 1 6 . 1 1 114 114 PHE CA C 114 61.559 61.559 59.619 1.940 18933 4163 1 6 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.552 0.919 18933 4164 1 6 . 1 1 114 114 PHE H H 114 7.721 7.721 8.663 -0.942 18933 4165 1 6 . 1 1 115 115 HIS N N 115 118.560 118.560 118.596 -0.036 18933 4166 1 6 . 1 1 115 115 HIS C C 115 177.286 177.286 176.675 0.611 18933 4167 1 6 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.548 -0.168 18933 4168 1 6 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.309 1.556 18933 4169 1 6 . 1 1 115 115 HIS H H 115 8.155 8.155 8.394 -0.239 18933 4170 1 6 . 1 1 116 116 PHE N N 116 111.472 111.472 116.636 -5.164 18933 4171 1 6 . 1 1 116 116 PHE C C 116 179.026 179.026 177.203 1.823 18933 4172 1 6 . 1 1 116 116 PHE CA C 116 59.461 59.461 59.836 -0.375 18933 4173 1 6 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.909 -1.720 18933 4174 1 6 . 1 1 116 116 PHE H H 116 8.564 8.564 7.954 0.610 18933 4175 1 6 . 1 1 117 117 THR N N 117 119.012 119.012 111.546 7.466 18933 4176 1 6 . 1 1 117 117 THR C C 117 172.935 172.935 175.426 -2.491 18933 4177 1 6 . 1 1 117 117 THR CA C 117 67.088 67.088 64.472 2.616 18933 4178 1 6 . 1 1 117 117 THR CB C 117 37.126 37.126 69.119 -31.993 18933 4179 1 6 . 1 1 117 117 THR H H 117 7.620 7.620 8.349 -0.729 18933 4180 1 6 . 1 1 118 118 GLY N N 118 107.917 107.917 110.136 -2.219 18933 4181 1 6 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.407 1.760 18933 4182 1 6 . 1 1 118 118 GLY H H 118 6.666 6.666 7.552 -0.886 18933 4183 1 6 . 1 1 121 121 SER N N 121 113.354 113.354 117.977 -4.623 18933 4184 1 6 . 1 1 121 121 SER C C 121 176.061 176.061 175.926 0.135 18933 4185 1 6 . 1 1 121 121 SER CA C 121 61.035 61.035 61.403 -0.368 18933 4186 1 6 . 1 1 121 121 SER H H 121 8.322 8.322 8.363 -0.041 18933 4187 1 6 . 1 1 122 122 TYR N N 122 124.681 124.681 121.844 2.837 18933 4188 1 6 . 1 1 122 122 TYR C C 122 176.293 176.293 177.217 -0.924 18933 4189 1 6 . 1 1 122 122 TYR CA C 122 59.057 59.057 59.894 -0.837 18933 4190 1 6 . 1 1 122 122 TYR CB C 122 38.711 38.711 37.834 0.877 18933 4191 1 6 . 1 1 122 122 TYR H H 122 6.514 6.514 8.375 -1.861 18933 4192 1 6 . 1 1 123 123 LEU N N 123 117.997 117.997 120.161 -2.164 18933 4193 1 6 . 1 1 123 123 LEU C C 123 179.774 179.774 178.998 0.776 18933 4194 1 6 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.547 0.331 18933 4195 1 6 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.886 -0.908 18933 4196 1 6 . 1 1 123 123 LEU H H 123 7.428 7.428 7.357 0.071 18933 4197 1 6 . 1 1 124 124 ILE N N 124 119.012 119.012 120.741 -1.729 18933 4198 1 6 . 1 1 124 124 ILE C C 124 178.830 178.830 178.110 0.720 18933 4199 1 6 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.305 -0.154 18933 4200 1 6 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.222 -0.159 18933 4201 1 6 . 1 1 124 124 ILE H H 124 8.453 8.453 8.453 -0.000 18933 4202 1 6 . 1 1 125 125 ARG N N 125 121.174 121.174 119.261 1.913 18933 4203 1 6 . 1 1 125 125 ARG C C 125 179.762 179.762 179.029 0.733 18933 4204 1 6 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.057 1.000 18933 4205 1 6 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.429 -0.479 18933 4206 1 6 . 1 1 125 125 ARG H H 125 7.004 7.004 8.117 -1.113 18933 4207 1 6 . 1 1 126 126 ILE N N 126 122.299 122.299 120.717 1.582 18933 4208 1 6 . 1 1 126 126 ILE C C 126 178.352 178.352 177.751 0.601 18933 4209 1 6 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.708 -2.503 18933 4210 1 6 . 1 1 126 126 ILE CB C 126 35.415 35.415 36.987 -1.572 18933 4211 1 6 . 1 1 126 126 ILE H H 126 7.579 7.579 8.055 -0.476 18933 4212 1 6 . 1 1 127 127 ARG N N 127 119.354 119.354 119.916 -0.562 18933 4213 1 6 . 1 1 127 127 ARG C C 127 179.786 179.786 178.905 0.881 18933 4214 1 6 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.900 0.086 18933 4215 1 6 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.108 -0.778 18933 4216 1 6 . 1 1 127 127 ARG H H 127 8.715 8.715 8.055 0.660 18933 4217 1 6 . 1 1 128 128 ALA N N 128 122.873 122.873 120.720 2.153 18933 4218 1 6 . 1 1 128 128 ALA C C 128 180.325 180.325 179.386 0.939 18933 4219 1 6 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.616 0.124 18933 4220 1 6 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.262 -1.101 18933 4221 1 6 . 1 1 128 128 ALA H H 128 7.978 7.978 8.090 -0.112 18933 4222 1 6 . 1 1 129 129 ALA N N 129 121.846 121.846 121.933 -0.087 18933 4223 1 6 . 1 1 129 129 ALA C C 129 181.539 181.539 179.885 1.654 18933 4224 1 6 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.824 -0.326 18933 4225 1 6 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.664 -1.186 18933 4226 1 6 . 1 1 129 129 ALA H H 129 7.519 7.519 8.111 -0.592 18933 4227 1 6 . 1 1 130 130 LEU N N 130 119.134 119.134 118.358 0.776 18933 4228 1 6 . 1 1 130 130 LEU C C 130 179.909 179.909 178.948 0.961 18933 4229 1 6 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.147 -0.147 18933 4230 1 6 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.685 -1.263 18933 4231 1 6 . 1 1 130 130 LEU H H 130 8.296 8.296 8.697 -0.401 18933 4232 1 6 . 1 1 131 131 LYS N N 131 122.299 122.299 120.231 2.068 18933 4233 1 6 . 1 1 131 131 LYS C C 131 180.289 180.289 179.518 0.771 18933 4234 1 6 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.604 -0.587 18933 4235 1 6 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.089 -0.857 18933 4236 1 6 . 1 1 131 131 LYS H H 131 8.281 8.281 7.911 0.370 18933 4237 1 6 . 1 1 132 132 LYS N N 132 118.743 118.743 118.555 0.188 18933 4238 1 6 . 1 1 132 132 LYS C C 132 177.482 177.482 177.852 -0.370 18933 4239 1 6 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.568 -0.076 18933 4240 1 6 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.375 -1.143 18933 4241 1 6 . 1 1 132 132 LYS H H 132 7.317 7.317 7.622 -0.305 18933 4242 1 6 . 1 1 133 133 LYS N N 133 117.093 117.093 117.007 0.086 18933 4243 1 6 . 1 1 133 133 LYS C C 133 174.614 174.614 176.111 -1.497 18933 4244 1 6 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.930 -1.150 18933 4245 1 6 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.840 -0.658 18933 4246 1 6 . 1 1 133 133 LYS H H 133 7.327 7.327 7.626 -0.299 18933 4247 1 6 . 1 1 134 134 ASN N N 134 113.012 113.012 115.254 -2.242 18933 4248 1 6 . 1 1 134 134 ASN C C 134 173.965 173.965 173.348 0.617 18933 4249 1 6 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.002 0.294 18933 4250 1 6 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.777 -1.602 18933 4251 1 6 . 1 1 134 134 ASN H H 134 7.938 7.938 7.905 0.033 18933 4252 1 6 . 1 1 135 135 TYR N N 135 115.725 115.725 118.977 -3.252 18933 4253 1 6 . 1 1 135 135 TYR C C 135 176.342 176.342 174.788 1.554 18933 4254 1 6 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.267 -1.599 18933 4255 1 6 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.901 0.662 18933 4256 1 6 . 1 1 135 135 TYR H H 135 7.741 7.741 8.379 -0.638 18933 4257 1 6 . 1 1 136 136 LYS N N 136 122.641 122.641 124.106 -1.465 18933 4258 1 6 . 1 1 136 136 LYS C C 136 173.475 173.475 174.439 -0.964 18933 4259 1 6 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.465 0.437 18933 4260 1 6 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.887 -2.169 18933 4261 1 6 . 1 1 136 136 LYS H H 136 9.296 9.296 8.827 0.469 18933 4262 1 6 . 1 1 137 137 LEU N N 137 127.284 127.284 122.933 4.351 18933 4263 1 6 . 1 1 137 137 LEU C C 137 175.423 175.423 176.499 -1.076 18933 4264 1 6 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.183 -0.057 18933 4265 1 6 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.114 3.632 18933 4266 1 6 . 1 1 137 137 LEU H H 137 8.776 8.776 8.544 0.232 18933 4267 1 6 . 1 1 138 138 ASN N N 138 125.818 125.818 119.759 6.059 18933 4268 1 6 . 1 1 138 138 ASN C C 138 174.933 174.933 175.697 -0.764 18933 4269 1 6 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.508 -0.391 18933 4270 1 6 . 1 1 138 138 ASN CB C 138 37.506 37.506 41.759 -4.253 18933 4271 1 6 . 1 1 138 138 ASN H H 138 8.811 8.811 8.158 0.653 18933 4272 1 6 . 1 1 139 139 GLN N N 139 116.861 116.861 119.743 -2.882 18933 4273 1 6 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.594 -1.756 18933 4274 1 6 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.727 -3.010 18933 4275 1 6 . 1 1 139 139 GLN H H 139 9.220 9.220 8.811 0.409 18933 4276 1 6 . 1 1 140 140 TYR N N 140 120.600 120.600 117.857 2.743 18933 4277 1 6 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.135 -0.377 18933 4278 1 6 . 1 1 140 140 TYR CB C 140 37.570 37.570 38.015 -0.445 18933 4279 1 6 . 1 1 140 140 TYR H H 140 8.549 8.549 7.636 0.913 18933 4280 1 6 . 1 1 141 141 GLY N N 141 105.986 105.986 108.408 -2.422 18933 4281 1 6 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.469 -0.625 18933 4282 1 6 . 1 1 141 141 GLY H H 141 7.186 7.186 8.044 -0.858 18933 4283 1 6 . 1 1 142 142 LEU N N 142 120.038 120.038 116.869 3.169 18933 4284 1 6 . 1 1 142 142 LEU C C 142 173.340 173.340 176.199 -2.859 18933 4285 1 6 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.479 -0.959 18933 4286 1 6 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.201 1.150 18933 4287 1 6 . 1 1 142 142 LEU H H 142 7.539 7.539 8.291 -0.752 18933 4288 1 6 . 1 1 143 143 PHE N N 143 124.229 124.229 120.379 3.850 18933 4289 1 6 . 1 1 143 143 PHE C C 143 173.977 173.977 175.155 -1.178 18933 4290 1 6 . 1 1 143 143 PHE CA C 143 52.641 52.641 54.876 -2.235 18933 4291 1 6 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.286 4.382 18933 4292 1 6 . 1 1 143 143 PHE H H 143 9.084 9.084 9.051 0.033 18933 4293 1 6 . 1 1 144 144 LYS N N 144 127.858 127.858 122.696 5.162 18933 4294 1 6 . 1 1 144 144 LYS C C 144 175.092 175.092 176.676 -1.584 18933 4295 1 6 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.367 4.489 18933 4296 1 6 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.484 4.100 18933 4297 1 6 . 1 1 144 144 LYS H H 144 9.281 9.281 8.801 0.480 18933 4298 1 6 . 1 1 145 145 ASN N N 145 128.188 128.188 126.343 1.845 18933 4299 1 6 . 1 1 145 145 ASN C C 145 175.779 175.779 174.667 1.112 18933 4300 1 6 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.454 3.272 18933 4301 1 6 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.792 -3.138 18933 4302 1 6 . 1 1 145 145 ASN H H 145 9.205 9.205 9.032 0.173 18933 4303 1 6 . 1 1 146 146 GLN N N 146 129.655 129.655 112.306 17.349 18933 4304 1 6 . 1 1 146 146 GLN C C 146 175.399 175.399 174.461 0.938 18933 4305 1 6 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.263 1.552 18933 4306 1 6 . 1 1 146 146 GLN CB C 146 32.626 32.626 27.888 4.738 18933 4307 1 6 . 1 1 146 146 GLN H H 146 8.983 8.983 8.781 0.202 18933 4308 1 6 . 1 1 147 147 THR N N 147 117.936 117.936 115.328 2.608 18933 4309 1 6 . 1 1 147 147 THR C C 147 173.254 173.254 173.354 -0.100 18933 4310 1 6 . 1 1 147 147 THR CA C 147 61.721 61.721 61.373 0.348 18933 4311 1 6 . 1 1 147 147 THR CB C 147 70.274 70.274 69.717 0.557 18933 4312 1 6 . 1 1 147 147 THR H H 147 8.029 8.029 7.901 0.128 18933 4313 1 6 . 1 1 148 148 LEU N N 148 130.681 130.681 131.421 -0.740 18933 4314 1 6 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.298 0.168 18933 4315 1 6 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.704 -1.015 18933 4316 1 6 . 1 1 148 148 LEU H H 148 8.635 8.635 8.835 -0.200 18933 4317 1 6 . 1 1 149 149 VAL N N 149 130.803 130.803 128.679 2.124 18933 4318 1 6 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.136 1.042 18933 4319 1 6 . 1 1 149 149 VAL CB C 149 31.675 31.675 35.318 -3.643 18933 4320 1 6 . 1 1 149 149 VAL H H 149 8.968 8.968 9.337 -0.369 18933 4321 1 6 . 1 1 151 151 LEU N N 151 124.290 124.290 118.018 6.272 18933 4322 1 6 . 1 1 151 151 LEU CA C 151 54.013 54.013 53.958 0.055 18933 4323 1 6 . 1 1 151 151 LEU CB C 151 44.098 44.098 39.135 4.963 18933 4324 1 6 . 1 1 151 151 LEU H H 151 7.872 7.872 8.354 -0.482 18933 4325 1 6 . 1 1 153 153 ILE N N 153 114.943 114.943 119.056 -4.113 18933 4326 1 6 . 1 1 153 153 ILE C C 153 175.877 175.877 174.940 0.937 18933 4327 1 6 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.757 -0.063 18933 4328 1 6 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.245 1.444 18933 4329 1 6 . 1 1 153 153 ILE H H 153 7.125 7.125 7.490 -0.365 18933 4330 1 6 . 1 1 154 154 THR N N 154 111.766 111.766 109.141 2.625 18933 4331 1 6 . 1 1 154 154 THR C C 154 174.945 174.945 174.415 0.530 18933 4332 1 6 . 1 1 154 154 THR CA C 154 62.124 62.124 63.151 -1.027 18933 4333 1 6 . 1 1 154 154 THR CB C 154 70.718 70.718 69.613 1.105 18933 4334 1 6 . 1 1 154 154 THR H H 154 9.286 9.286 8.202 1.084 18933 4335 1 6 . 1 1 155 155 THR N N 155 111.766 111.766 114.235 -2.469 18933 4336 1 6 . 1 1 155 155 THR CA C 155 58.936 58.936 59.860 -0.924 18933 4337 1 6 . 1 1 155 155 THR CB C 155 72.683 72.683 72.349 0.334 18933 4338 1 6 . 1 1 155 155 THR H H 155 7.645 7.645 7.610 0.035 18933 4339 1 6 . 1 1 157 157 LYS N N 157 119.464 119.464 118.878 0.586 18933 4340 1 6 . 1 1 157 157 LYS C C 157 178.781 178.781 178.768 0.013 18933 4341 1 6 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.951 0.075 18933 4342 1 6 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.935 -0.513 18933 4343 1 6 . 1 1 157 157 LYS H H 157 8.175 8.175 8.219 -0.044 18933 4344 1 6 . 1 1 158 158 GLU N N 158 118.340 118.340 118.828 -0.488 18933 4345 1 6 . 1 1 158 158 GLU C C 158 178.867 178.867 179.102 -0.235 18933 4346 1 6 . 1 1 158 158 GLU CA C 158 58.492 58.492 59.285 -0.793 18933 4347 1 6 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.680 0.650 18933 4348 1 6 . 1 1 158 158 GLU H H 158 7.519 7.519 8.115 -0.596 18933 4349 1 6 . 1 1 159 159 LEU N N 159 120.710 120.710 121.475 -0.765 18933 4350 1 6 . 1 1 159 159 LEU C C 159 176.526 176.526 178.259 -1.733 18933 4351 1 6 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.325 -0.155 18933 4352 1 6 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.748 -1.833 18933 4353 1 6 . 1 1 159 159 LEU H H 159 7.524 7.524 7.907 -0.383 18933 4354 1 6 . 1 1 160 160 ILE N N 160 118.217 118.217 118.351 -0.134 18933 4355 1 6 . 1 1 160 160 ILE C C 160 177.213 177.213 178.121 -0.908 18933 4356 1 6 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.519 -0.489 18933 4357 1 6 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.222 0.284 18933 4358 1 6 . 1 1 160 160 ILE H H 160 7.741 7.741 7.976 -0.235 18933 4359 1 6 . 1 1 161 161 LYS N N 161 118.450 118.450 119.775 -1.325 18933 4360 1 6 . 1 1 161 161 LYS C C 161 180.999 180.999 179.893 1.106 18933 4361 1 6 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.270 -0.455 18933 4362 1 6 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.210 -1.232 18933 4363 1 6 . 1 1 161 161 LYS H H 161 7.382 7.382 7.952 -0.570 18933 4364 1 6 . 1 1 162 162 GLU N N 162 121.846 121.846 121.655 0.191 18933 4365 1 6 . 1 1 162 162 GLU C C 162 178.818 178.818 178.363 0.455 18933 4366 1 6 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.993 -0.944 18933 4367 1 6 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.515 -1.579 18933 4368 1 6 . 1 1 162 162 GLU H H 162 8.210 8.210 7.996 0.214 18933 4369 1 6 . 1 1 163 163 LEU N N 163 116.751 116.751 113.117 3.634 18933 4370 1 6 . 1 1 163 163 LEU C C 163 176.784 176.784 176.993 -0.209 18933 4371 1 6 . 1 1 163 163 LEU CA C 163 55.022 55.022 54.722 0.300 18933 4372 1 6 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.277 0.032 18933 4373 1 6 . 1 1 163 163 LEU H H 163 7.796 7.796 7.593 0.203 18933 4374 1 6 . 1 1 164 164 GLY N N 164 104.849 104.849 106.462 -1.613 18933 4375 1 6 . 1 1 164 164 GLY C C 164 174.492 174.492 173.906 0.586 18933 4376 1 6 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.171 -0.439 18933 4377 1 6 . 1 1 164 164 GLY H H 164 7.589 7.589 7.505 0.084 18933 4378 1 6 . 1 1 165 165 PHE N N 165 118.902 118.902 118.677 0.225 18933 4379 1 6 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.117 -0.449 18933 4380 1 6 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.703 -2.218 18933 4381 1 6 . 1 1 165 165 PHE H H 165 7.251 7.251 8.041 -0.790 18933 4382 1 6 . 1 1 166 166 THR N N 166 117.093 117.093 116.250 0.843 18933 4383 1 6 . 1 1 166 166 THR CA C 166 62.245 62.245 60.148 2.097 18933 4384 1 6 . 1 1 166 166 THR CB C 166 69.323 69.323 69.845 -0.522 18933 4385 1 6 . 1 1 166 166 THR H H 166 8.407 8.407 8.371 0.036 18933 4386 1 6 . 1 1 168 168 ARG N N 168 127.431 127.431 120.391 7.040 18933 4387 1 6 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.010 -1.772 18933 4388 1 6 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.775 -1.783 18933 4389 1 6 . 1 1 168 168 ARG H H 168 7.160 7.160 8.327 -1.167 18933 4390 1 6 . 1 1 171 171 LYS N N 171 113.574 113.574 118.144 -4.570 18933 4391 1 6 . 1 1 171 171 LYS C C 171 176.416 176.416 177.907 -1.491 18933 4392 1 6 . 1 1 171 171 LYS CA C 171 57.605 57.605 59.051 -1.446 18933 4393 1 6 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.946 -0.017 18933 4394 1 6 . 1 1 171 171 LYS H H 171 8.210 8.210 8.469 -0.259 18933 4395 1 6 . 1 1 172 172 LYS N N 172 117.313 117.313 117.795 -0.482 18933 4396 1 6 . 1 1 172 172 LYS C C 172 175.717 175.717 176.366 -0.649 18933 4397 1 6 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.631 -2.456 18933 4398 1 6 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.579 -0.967 18933 4399 1 6 . 1 1 172 172 LYS H H 172 7.761 7.761 7.570 0.191 18933 4400 1 6 . 1 1 173 173 ARG N N 173 122.056 122.056 115.220 6.836 18933 4401 1 6 . 1 1 173 173 ARG C C 173 172.850 172.850 175.415 -2.565 18933 4402 1 6 . 1 1 173 173 ARG CA C 173 56.878 56.878 57.300 -0.422 18933 4403 1 6 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.609 -0.103 18933 4404 1 6 . 1 1 173 173 ARG H H 173 6.885 6.885 7.241 -0.356 18933 4405 1 7 . 1 1 2 2 LEU N N 2 122.812 122.812 121.300 1.512 18933 4406 1 7 . 1 1 2 2 LEU C C 2 175.742 175.742 175.786 -0.044 18933 4407 1 7 . 1 1 2 2 LEU CA C 2 54.134 54.134 54.243 -0.109 18933 4408 1 7 . 1 1 2 2 LEU CB C 2 42.842 42.842 44.656 -1.814 18933 4409 1 7 . 1 1 2 2 LEU H H 2 8.756 8.756 8.442 0.314 18933 4410 1 7 . 1 1 3 3 THR N N 3 113.000 113.000 112.202 0.798 18933 4411 1 7 . 1 1 3 3 THR C C 3 175.938 175.938 175.662 0.276 18933 4412 1 7 . 1 1 3 3 THR CA C 3 60.550 60.550 60.496 0.054 18933 4413 1 7 . 1 1 3 3 THR CB C 3 70.781 70.781 69.944 0.838 18933 4414 1 7 . 1 1 3 3 THR H H 3 8.428 8.428 8.115 0.313 18933 4415 1 7 . 1 1 4 4 LEU N N 4 122.531 122.531 122.968 -0.437 18933 4416 1 7 . 1 1 4 4 LEU C C 4 178.463 178.463 178.437 0.026 18933 4417 1 7 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.855 -0.725 18933 4418 1 7 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.001 -2.467 18933 4419 1 7 . 1 1 4 4 LEU H H 4 7.731 7.731 8.066 -0.335 18933 4420 1 7 . 1 1 5 5 ILE N N 5 115.505 115.505 116.785 -1.280 18933 4421 1 7 . 1 1 5 5 ILE C C 5 178.573 178.573 177.896 0.677 18933 4422 1 7 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.675 -0.937 18933 4423 1 7 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.331 -0.459 18933 4424 1 7 . 1 1 5 5 ILE H H 5 7.645 7.645 7.978 -0.333 18933 4425 1 7 . 1 1 6 6 GLN N N 6 121.626 121.626 119.455 2.171 18933 4426 1 7 . 1 1 6 6 GLN C C 6 179.014 179.014 178.799 0.215 18933 4427 1 7 . 1 1 6 6 GLN CA C 6 58.331 58.331 58.977 -0.645 18933 4428 1 7 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.720 0.469 18933 4429 1 7 . 1 1 6 6 GLN H H 6 7.645 7.645 7.736 -0.091 18933 4430 1 7 . 1 1 7 7 GLY N N 7 107.684 107.684 106.804 0.880 18933 4431 1 7 . 1 1 7 7 GLY C C 7 174.749 174.749 176.294 -1.545 18933 4432 1 7 . 1 1 7 7 GLY CA C 7 46.790 46.790 47.006 -0.216 18933 4433 1 7 . 1 1 7 7 GLY H H 7 8.660 8.660 8.062 0.598 18933 4434 1 7 . 1 1 8 8 LYS N N 8 120.942 120.942 122.456 -1.514 18933 4435 1 7 . 1 1 8 8 LYS C C 8 179.455 179.455 178.863 0.592 18933 4436 1 7 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.378 0.527 18933 4437 1 7 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.059 -0.637 18933 4438 1 7 . 1 1 8 8 LYS H H 8 8.518 8.518 7.601 0.917 18933 4439 1 7 . 1 1 9 9 LYS N N 9 120.710 120.710 119.315 1.395 18933 4440 1 7 . 1 1 9 9 LYS C C 9 179.823 179.823 179.169 0.654 18933 4441 1 7 . 1 1 9 9 LYS CA C 9 59.622 59.622 58.796 0.826 18933 4442 1 7 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.219 -0.924 18933 4443 1 7 . 1 1 9 9 LYS H H 9 7.731 7.731 8.226 -0.495 18933 4444 1 7 . 1 1 10 10 ILE N N 10 121.345 121.345 120.783 0.562 18933 4445 1 7 . 1 1 10 10 ILE C C 10 177.789 177.789 178.129 -0.340 18933 4446 1 7 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.965 -1.500 18933 4447 1 7 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.158 -1.793 18933 4448 1 7 . 1 1 10 10 ILE H H 10 7.711 7.711 8.325 -0.614 18933 4449 1 7 . 1 1 11 11 VAL N N 11 120.258 120.258 120.319 -0.061 18933 4450 1 7 . 1 1 11 11 VAL C C 11 177.372 177.372 177.815 -0.443 18933 4451 1 7 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.283 0.168 18933 4452 1 7 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.550 -1.016 18933 4453 1 7 . 1 1 11 11 VAL H H 11 7.918 7.918 8.473 -0.555 18933 4454 1 7 . 1 1 12 12 ASN N N 12 116.971 116.971 117.836 -0.865 18933 4455 1 7 . 1 1 12 12 ASN C C 12 177.445 177.445 178.030 -0.585 18933 4456 1 7 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.260 -0.148 18933 4457 1 7 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.493 -0.860 18933 4458 1 7 . 1 1 12 12 ASN H H 12 7.993 7.993 8.615 -0.622 18933 4459 1 7 . 1 1 13 13 HIS N N 13 120.258 120.258 119.448 0.810 18933 4460 1 7 . 1 1 13 13 HIS C C 13 177.862 177.862 178.231 -0.369 18933 4461 1 7 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.170 -0.072 18933 4462 1 7 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.710 0.522 18933 4463 1 7 . 1 1 13 13 HIS H H 13 7.741 7.741 8.439 -0.698 18933 4464 1 7 . 1 1 14 14 LEU N N 14 116.641 116.641 120.297 -3.656 18933 4465 1 7 . 1 1 14 14 LEU C C 14 179.186 179.186 178.259 0.927 18933 4466 1 7 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.248 -1.491 18933 4467 1 7 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.484 -0.365 18933 4468 1 7 . 1 1 14 14 LEU H H 14 8.221 8.221 8.525 -0.304 18933 4469 1 7 . 1 1 15 15 ARG N N 15 115.957 115.957 114.561 1.396 18933 4470 1 7 . 1 1 15 15 ARG C C 15 176.330 176.330 178.125 -1.795 18933 4471 1 7 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.496 1.207 18933 4472 1 7 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.360 -1.283 18933 4473 1 7 . 1 1 15 15 ARG H H 15 7.968 7.968 8.456 -0.488 18933 4474 1 7 . 1 1 16 16 SER N N 16 109.395 109.395 115.935 -6.540 18933 4475 1 7 . 1 1 16 16 SER C C 16 176.024 176.024 175.060 0.964 18933 4476 1 7 . 1 1 16 16 SER CA C 16 57.282 57.282 60.279 -2.997 18933 4477 1 7 . 1 1 16 16 SER CB C 16 63.683 63.683 63.817 -0.134 18933 4478 1 7 . 1 1 16 16 SER H H 16 6.963 6.963 7.468 -0.505 18933 4479 1 7 . 1 1 17 17 ARG N N 17 122.775 122.775 121.713 1.062 18933 4480 1 7 . 1 1 17 17 ARG C C 17 174.590 174.590 173.965 0.625 18933 4481 1 7 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.907 1.366 18933 4482 1 7 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.415 1.387 18933 4483 1 7 . 1 1 17 17 ARG H H 17 7.781 7.781 8.314 -0.533 18933 4484 1 7 . 1 1 18 18 LEU N N 18 122.421 122.421 125.806 -3.385 18933 4485 1 7 . 1 1 18 18 LEU C C 18 176.281 176.281 174.040 2.241 18933 4486 1 7 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.422 0.357 18933 4487 1 7 . 1 1 18 18 LEU CB C 18 43.211 43.211 47.006 -3.795 18933 4488 1 7 . 1 1 18 18 LEU H H 18 8.650 8.650 7.734 0.916 18933 4489 1 7 . 1 1 19 19 ALA N N 19 126.441 126.441 126.507 -0.066 18933 4490 1 7 . 1 1 19 19 ALA C C 19 173.904 173.904 174.826 -0.922 18933 4491 1 7 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.610 -0.744 18933 4492 1 7 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.259 0.606 18933 4493 1 7 . 1 1 19 19 ALA H H 19 8.609 8.609 8.906 -0.297 18933 4494 1 7 . 1 1 20 20 PHE N N 20 114.600 114.600 119.617 -5.017 18933 4495 1 7 . 1 1 20 20 PHE C C 20 172.592 172.592 173.932 -1.340 18933 4496 1 7 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.976 0.813 18933 4497 1 7 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.510 -0.821 18933 4498 1 7 . 1 1 20 20 PHE H H 20 8.801 8.801 9.097 -0.296 18933 4499 1 7 . 1 1 21 21 GLU N N 21 122.873 122.873 124.354 -1.481 18933 4500 1 7 . 1 1 21 21 GLU C C 21 174.872 174.872 175.198 -0.326 18933 4501 1 7 . 1 1 21 21 GLU CA C 21 55.062 55.062 54.968 0.094 18933 4502 1 7 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.226 -0.501 18933 4503 1 7 . 1 1 21 21 GLU H H 21 7.847 7.847 9.208 -1.361 18933 4504 1 7 . 1 1 22 22 TYR N N 22 126.270 126.270 126.884 -0.614 18933 4505 1 7 . 1 1 22 22 TYR C C 22 174.872 174.872 174.978 -0.106 18933 4506 1 7 . 1 1 22 22 TYR CA C 22 55.748 55.748 57.029 -1.281 18933 4507 1 7 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.740 -1.635 18933 4508 1 7 . 1 1 22 22 TYR H H 22 8.806 8.806 9.070 -0.264 18933 4509 1 7 . 1 1 23 23 ASN N N 23 128.420 128.420 126.104 2.316 18933 4510 1 7 . 1 1 23 23 ASN C C 23 175.435 175.435 175.060 0.375 18933 4511 1 7 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.451 -0.446 18933 4512 1 7 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.615 -1.250 18933 4513 1 7 . 1 1 23 23 ASN H H 23 8.943 8.943 9.102 -0.159 18933 4514 1 7 . 1 1 24 24 GLY N N 24 104.067 104.067 101.959 2.108 18933 4515 1 7 . 1 1 24 24 GLY C C 24 173.707 173.707 173.704 0.003 18933 4516 1 7 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.947 -0.013 18933 4517 1 7 . 1 1 24 24 GLY H H 24 8.534 8.534 8.181 0.353 18933 4518 1 7 . 1 1 25 25 GLN N N 25 120.038 120.038 119.520 0.518 18933 4519 1 7 . 1 1 25 25 GLN C C 25 173.744 173.744 174.771 -1.027 18933 4520 1 7 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.087 -0.761 18933 4521 1 7 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.480 0.181 18933 4522 1 7 . 1 1 25 25 GLN H H 25 7.595 7.595 7.771 -0.176 18933 4523 1 7 . 1 1 26 26 LEU N N 26 124.681 124.681 125.173 -0.492 18933 4524 1 7 . 1 1 26 26 LEU C C 26 175.987 175.987 176.137 -0.150 18933 4525 1 7 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.514 -0.501 18933 4526 1 7 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.394 -1.529 18933 4527 1 7 . 1 1 26 26 LEU H H 26 8.382 8.382 8.634 -0.252 18933 4528 1 7 . 1 1 27 27 ILE N N 27 130.779 130.779 127.379 3.400 18933 4529 1 7 . 1 1 27 27 ILE C C 27 175.215 175.215 174.505 0.710 18933 4530 1 7 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.735 -0.476 18933 4531 1 7 . 1 1 27 27 ILE CB C 27 35.732 35.732 37.679 -1.947 18933 4532 1 7 . 1 1 27 27 ILE H H 27 8.882 8.882 8.882 0.000 18933 4533 1 7 . 1 1 28 28 LYS N N 28 126.160 126.160 127.643 -1.483 18933 4534 1 7 . 1 1 28 28 LYS C C 28 176.771 176.771 175.723 1.048 18933 4535 1 7 . 1 1 28 28 LYS CA C 28 56.838 56.838 55.021 1.817 18933 4536 1 7 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.013 -1.274 18933 4537 1 7 . 1 1 28 28 LYS H H 28 8.165 8.165 8.304 -0.139 18933 4538 1 7 . 1 1 29 29 ILE N N 29 126.380 126.380 122.208 4.172 18933 4539 1 7 . 1 1 29 29 ILE C C 29 175.877 175.877 174.318 1.559 18933 4540 1 7 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.518 -0.210 18933 4541 1 7 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.565 -2.502 18933 4542 1 7 . 1 1 29 29 ILE H H 29 8.019 8.019 8.689 -0.670 18933 4543 1 7 . 1 1 30 30 LEU N N 30 129.215 129.215 122.432 6.783 18933 4544 1 7 . 1 1 30 30 LEU C C 30 178.867 178.867 178.223 0.644 18933 4545 1 7 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.248 1.371 18933 4546 1 7 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.542 -4.677 18933 4547 1 7 . 1 1 30 30 LEU H H 30 8.917 8.917 8.367 0.550 18933 4548 1 7 . 1 1 31 31 SER N N 31 117.997 117.997 116.538 1.459 18933 4549 1 7 . 1 1 31 31 SER C C 31 177.396 177.396 175.554 1.842 18933 4550 1 7 . 1 1 31 31 SER CA C 31 61.236 61.236 60.787 0.449 18933 4551 1 7 . 1 1 31 31 SER CB C 31 62.035 62.035 63.163 -1.127 18933 4552 1 7 . 1 1 31 31 SER H H 31 8.594 8.594 8.871 -0.277 18933 4553 1 7 . 1 1 32 32 LYS N N 32 116.189 116.189 119.199 -3.010 18933 4554 1 7 . 1 1 32 32 LYS C C 32 176.244 176.244 177.078 -0.834 18933 4555 1 7 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.100 -0.697 18933 4556 1 7 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.423 -2.142 18933 4557 1 7 . 1 1 32 32 LYS H H 32 8.029 8.029 8.257 -0.228 18933 4558 1 7 . 1 1 33 33 ASN N N 33 119.061 119.061 115.541 3.520 18933 4559 1 7 . 1 1 33 33 ASN C C 33 172.384 172.384 174.324 -1.940 18933 4560 1 7 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.299 -1.142 18933 4561 1 7 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.186 -2.919 18933 4562 1 7 . 1 1 33 33 ASN H H 33 7.902 7.902 7.815 0.087 18933 4563 1 7 . 1 1 34 34 ILE N N 34 120.038 120.038 119.586 0.452 18933 4564 1 7 . 1 1 34 34 ILE C C 34 175.607 175.607 174.302 1.305 18933 4565 1 7 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.356 0.194 18933 4566 1 7 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.846 -2.882 18933 4567 1 7 . 1 1 34 34 ILE H H 34 7.443 7.443 7.855 -0.412 18933 4568 1 7 . 1 1 35 35 VAL N N 35 129.435 129.435 125.191 4.244 18933 4569 1 7 . 1 1 35 35 VAL C C 35 175.386 175.386 174.323 1.063 18933 4570 1 7 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.234 -0.208 18933 4571 1 7 . 1 1 35 35 VAL CB C 35 34.781 34.781 36.507 -1.726 18933 4572 1 7 . 1 1 35 35 VAL H H 35 9.533 9.533 8.784 0.749 18933 4573 1 7 . 1 1 36 36 ALA N N 36 130.571 130.571 129.560 1.011 18933 4574 1 7 . 1 1 36 36 ALA C C 36 177.347 177.347 176.327 1.020 18933 4575 1 7 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.739 0.660 18933 4576 1 7 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.819 -0.961 18933 4577 1 7 . 1 1 36 36 ALA H H 36 8.665 8.665 8.551 0.114 18933 4578 1 7 . 1 1 37 37 VAL N N 37 115.395 115.395 120.135 -4.740 18933 4579 1 7 . 1 1 37 37 VAL C C 37 174.455 174.455 175.849 -1.394 18933 4580 1 7 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.343 0.038 18933 4581 1 7 . 1 1 37 37 VAL CB C 37 32.943 32.943 33.865 -0.923 18933 4582 1 7 . 1 1 37 37 VAL H H 37 8.079 8.079 8.309 -0.230 18933 4583 1 7 . 1 1 38 38 GLY N N 38 107.672 107.672 107.888 -0.216 18933 4584 1 7 . 1 1 38 38 GLY C C 38 173.364 173.364 175.799 -2.435 18933 4585 1 7 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.497 -0.312 18933 4586 1 7 . 1 1 38 38 GLY H H 38 7.579 7.579 8.171 -0.593 18933 4587 1 7 . 1 1 39 39 SER N N 39 121.052 121.052 119.765 1.287 18933 4588 1 7 . 1 1 39 39 SER C C 39 175.570 175.570 176.550 -0.980 18933 4589 1 7 . 1 1 39 39 SER CA C 39 61.801 61.801 61.993 -0.192 18933 4590 1 7 . 1 1 39 39 SER CB C 39 62.478 62.478 63.365 -0.887 18933 4591 1 7 . 1 1 39 39 SER H H 39 8.953 8.953 8.064 0.889 18933 4592 1 7 . 1 1 40 40 LEU N N 40 121.553 121.553 121.205 0.348 18933 4593 1 7 . 1 1 40 40 LEU C C 40 180.203 180.203 178.418 1.785 18933 4594 1 7 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.206 -0.077 18933 4595 1 7 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.961 -0.208 18933 4596 1 7 . 1 1 40 40 LEU H H 40 8.195 8.195 7.355 0.840 18933 4597 1 7 . 1 1 41 41 ARG N N 41 121.956 121.956 118.045 3.911 18933 4598 1 7 . 1 1 41 41 ARG C C 41 177.323 177.323 177.878 -0.555 18933 4599 1 7 . 1 1 41 41 ARG CA C 41 58.331 58.331 58.384 -0.053 18933 4600 1 7 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.989 -1.546 18933 4601 1 7 . 1 1 41 41 ARG H H 41 6.873 6.873 7.336 -0.463 18933 4602 1 7 . 1 1 42 42 ARG N N 42 114.600 114.600 116.347 -1.747 18933 4603 1 7 . 1 1 42 42 ARG C C 42 172.911 172.911 176.332 -3.421 18933 4604 1 7 . 1 1 42 42 ARG CA C 42 57.242 57.242 57.361 -0.119 18933 4605 1 7 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.792 -1.652 18933 4606 1 7 . 1 1 42 42 ARG H H 42 7.438 7.438 8.125 -0.687 18933 4607 1 7 . 1 1 43 43 GLU N N 43 113.354 113.354 117.277 -3.923 18933 4608 1 7 . 1 1 43 43 GLU C C 43 175.999 175.999 175.460 0.539 18933 4609 1 7 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.365 -0.809 18933 4610 1 7 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.342 -2.005 18933 4611 1 7 . 1 1 43 43 GLU H H 43 7.564 7.564 8.050 -0.486 18933 4612 1 7 . 1 1 44 44 GLU N N 44 119.696 119.696 122.655 -2.959 18933 4613 1 7 . 1 1 44 44 GLU C C 44 175.423 175.423 176.429 -1.006 18933 4614 1 7 . 1 1 44 44 GLU CA C 44 56.838 56.838 56.925 -0.087 18933 4615 1 7 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.181 -1.485 18933 4616 1 7 . 1 1 44 44 GLU H H 44 7.261 7.261 8.649 -1.388 18933 4617 1 7 . 1 1 45 45 LYS N N 45 117.435 117.435 118.081 -0.646 18933 4618 1 7 . 1 1 45 45 LYS C C 45 177.715 177.715 175.456 2.259 18933 4619 1 7 . 1 1 45 45 LYS CA C 45 59.219 59.219 56.611 2.608 18933 4620 1 7 . 1 1 45 45 LYS CB C 45 32.119 32.119 33.968 -1.849 18933 4621 1 7 . 1 1 45 45 LYS H H 45 7.938 7.938 8.199 -0.261 18933 4622 1 7 . 1 1 46 46 MET N N 46 115.847 115.847 117.605 -1.758 18933 4623 1 7 . 1 1 46 46 MET CA C 46 52.520 52.520 53.307 -0.787 18933 4624 1 7 . 1 1 46 46 MET CB C 46 33.450 33.450 35.453 -2.003 18933 4625 1 7 . 1 1 46 46 MET H H 46 7.595 7.595 7.673 -0.078 18933 4626 1 7 . 1 1 47 47 LEU N N 47 121.627 121.627 122.008 -0.381 18933 4627 1 7 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.140 -1.014 18933 4628 1 7 . 1 1 47 47 LEU CB C 47 43.070 43.070 44.168 -1.098 18933 4629 1 7 . 1 1 47 47 LEU H H 47 9.220 9.220 9.038 0.182 18933 4630 1 7 . 1 1 49 49 ASP N N 49 117.093 117.093 117.356 -0.263 18933 4631 1 7 . 1 1 49 49 ASP C C 49 173.340 173.340 174.178 -0.838 18933 4632 1 7 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.035 -1.240 18933 4633 1 7 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.751 -1.744 18933 4634 1 7 . 1 1 49 49 ASP H H 49 7.761 7.761 7.600 0.161 18933 4635 1 7 . 1 1 50 50 VAL N N 50 119.012 119.012 116.343 2.669 18933 4636 1 7 . 1 1 50 50 VAL C C 50 173.070 173.070 173.751 -0.681 18933 4637 1 7 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.261 1.581 18933 4638 1 7 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.775 -1.212 18933 4639 1 7 . 1 1 50 50 VAL H H 50 8.089 8.089 8.343 -0.254 18933 4640 1 7 . 1 1 51 51 ASP N N 51 127.064 127.064 124.925 2.139 18933 4641 1 7 . 1 1 51 51 ASP C C 51 174.565 174.565 175.221 -0.656 18933 4642 1 7 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.969 -0.812 18933 4643 1 7 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.630 -0.990 18933 4644 1 7 . 1 1 51 51 ASP H H 51 8.069 8.069 8.046 0.023 18933 4645 1 7 . 1 1 52 52 LEU N N 52 121.627 121.627 120.036 1.591 18933 4646 1 7 . 1 1 52 52 LEU C C 52 174.063 174.063 174.676 -0.613 18933 4647 1 7 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.447 -0.765 18933 4648 1 7 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.332 -2.981 18933 4649 1 7 . 1 1 52 52 LEU H H 52 8.852 8.852 8.960 -0.108 18933 4650 1 7 . 1 1 53 53 LEU N N 53 123.093 123.093 123.186 -0.093 18933 4651 1 7 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.225 1.766 18933 4652 1 7 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.759 -2.626 18933 4653 1 7 . 1 1 53 53 LEU H H 53 9.362 9.362 9.061 0.301 18933 4654 1 7 . 1 1 54 54 ILE N N 54 123.777 123.777 129.147 -5.370 18933 4655 1 7 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.186 -4.124 18933 4656 1 7 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.399 -7.329 18933 4657 1 7 . 1 1 54 54 ILE H H 54 8.907 8.907 9.287 -0.380 18933 4658 1 7 . 1 1 58 58 GLU N N 58 114.710 114.710 116.453 -1.743 18933 4659 1 7 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.625 -1.248 18933 4660 1 7 . 1 1 58 58 GLU CB C 58 31.422 31.422 32.888 -1.466 18933 4661 1 7 . 1 1 58 58 GLU H H 58 6.716 6.716 7.433 -0.717 18933 4662 1 7 . 1 1 61 61 LEU N N 61 115.957 115.957 119.805 -3.848 18933 4663 1 7 . 1 1 61 61 LEU C C 61 178.512 178.512 178.361 0.151 18933 4664 1 7 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.380 -2.600 18933 4665 1 7 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.703 -0.584 18933 4666 1 7 . 1 1 61 61 LEU H H 61 7.307 7.307 7.723 -0.416 18933 4667 1 7 . 1 1 62 62 LEU N N 62 120.038 120.038 119.355 0.683 18933 4668 1 7 . 1 1 62 62 LEU C C 62 177.874 177.874 178.775 -0.901 18933 4669 1 7 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.498 0.438 18933 4670 1 7 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.985 -1.246 18933 4671 1 7 . 1 1 62 62 LEU H H 62 7.327 7.327 7.998 -0.671 18933 4672 1 7 . 1 1 63 63 LYS N N 63 114.600 114.600 116.180 -1.580 18933 4673 1 7 . 1 1 63 63 LYS C C 63 175.460 175.460 177.686 -2.226 18933 4674 1 7 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.856 -1.292 18933 4675 1 7 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.505 -1.780 18933 4676 1 7 . 1 1 63 63 LYS H H 63 7.973 7.973 7.813 0.160 18933 4677 1 7 . 1 1 64 64 HIS N N 64 115.273 115.273 115.615 -0.342 18933 4678 1 7 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.365 0.747 18933 4679 1 7 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.268 2.168 18933 4680 1 7 . 1 1 64 64 HIS H H 64 7.544 7.544 7.549 -0.005 18933 4681 1 7 . 1 1 65 65 VAL N N 65 118.682 118.682 119.444 -0.762 18933 4682 1 7 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.771 3.267 18933 4683 1 7 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.204 -2.177 18933 4684 1 7 . 1 1 65 65 VAL H H 65 6.787 6.787 7.277 -0.490 18933 4685 1 7 . 1 1 68 68 ASN N N 68 112.108 112.108 117.862 -5.754 18933 4686 1 7 . 1 1 68 68 ASN C C 68 174.884 174.884 173.947 0.937 18933 4687 1 7 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.417 -1.390 18933 4688 1 7 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.540 0.692 18933 4689 1 7 . 1 1 68 68 ASN H H 68 7.009 7.009 8.356 -1.347 18933 4690 1 7 . 1 1 69 69 ILE N N 69 123.325 123.325 123.431 -0.106 18933 4691 1 7 . 1 1 69 69 ILE C C 69 174.394 174.394 175.516 -1.122 18933 4692 1 7 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.590 -1.482 18933 4693 1 7 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.469 -0.202 18933 4694 1 7 . 1 1 69 69 ILE H H 69 7.150 7.150 8.245 -1.095 18933 4695 1 7 . 1 1 70 70 ARG N N 70 126.722 126.722 128.023 -1.301 18933 4696 1 7 . 1 1 70 70 ARG C C 70 174.590 174.590 174.386 0.204 18933 4697 1 7 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.619 -1.372 18933 4698 1 7 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.744 -2.372 18933 4699 1 7 . 1 1 70 70 ARG H H 70 8.902 8.902 9.254 -0.352 18933 4700 1 7 . 1 1 71 71 ILE N N 71 119.978 119.978 120.191 -0.213 18933 4701 1 7 . 1 1 71 71 ILE C C 71 175.583 175.583 175.989 -0.406 18933 4702 1 7 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.903 -0.079 18933 4703 1 7 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.239 -2.479 18933 4704 1 7 . 1 1 71 71 ILE H H 71 7.491 7.491 8.847 -1.356 18933 4705 1 7 . 1 1 72 72 LYS N N 72 128.530 128.530 124.866 3.664 18933 4706 1 7 . 1 1 72 72 LYS C C 72 177.703 177.703 176.374 1.329 18933 4707 1 7 . 1 1 72 72 LYS CA C 72 57.201 57.201 55.575 1.627 18933 4708 1 7 . 1 1 72 72 LYS CB C 72 31.485 31.485 31.559 -0.074 18933 4709 1 7 . 1 1 72 72 LYS H H 72 8.523 8.523 8.494 0.029 18933 4710 1 7 . 1 1 73 73 GLY N N 73 113.806 113.806 110.105 3.701 18933 4711 1 7 . 1 1 73 73 GLY C C 73 173.781 173.781 173.067 0.714 18933 4712 1 7 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.149 0.673 18933 4713 1 7 . 1 1 73 73 GLY H H 73 8.791 8.791 8.363 0.428 18933 4714 1 7 . 1 1 74 74 LEU N N 74 120.490 120.490 118.361 2.129 18933 4715 1 7 . 1 1 74 74 LEU C C 74 175.840 175.840 173.523 2.317 18933 4716 1 7 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.316 -0.625 18933 4717 1 7 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.212 -1.051 18933 4718 1 7 . 1 1 74 74 LEU H H 74 7.393 7.393 7.299 0.094 18933 4719 1 7 . 1 1 75 75 SER N N 75 120.038 120.038 115.581 4.457 18933 4720 1 7 . 1 1 75 75 SER C C 75 173.205 173.205 173.091 0.114 18933 4721 1 7 . 1 1 75 75 SER CA C 75 57.887 57.887 57.547 0.340 18933 4722 1 7 . 1 1 75 75 SER CB C 75 63.049 63.049 64.841 -1.792 18933 4723 1 7 . 1 1 75 75 SER H H 75 8.917 8.917 8.123 0.794 18933 4724 1 7 . 1 1 76 76 PHE N N 76 119.586 119.586 118.153 1.433 18933 4725 1 7 . 1 1 76 76 PHE C C 76 173.536 173.536 173.591 -0.055 18933 4726 1 7 . 1 1 76 76 PHE CA C 76 55.426 55.426 55.974 -0.548 18933 4727 1 7 . 1 1 76 76 PHE CB C 76 42.006 42.006 41.699 0.307 18933 4728 1 7 . 1 1 76 76 PHE H H 76 8.003 8.003 8.429 -0.426 18933 4729 1 7 . 1 1 77 77 SER N N 77 114.943 114.943 115.941 -0.998 18933 4730 1 7 . 1 1 77 77 SER C C 77 173.438 173.438 172.359 1.079 18933 4731 1 7 . 1 1 77 77 SER CA C 77 56.152 56.152 57.240 -1.088 18933 4732 1 7 . 1 1 77 77 SER CB C 77 65.204 65.204 65.372 -0.168 18933 4733 1 7 . 1 1 77 77 SER H H 77 8.907 8.907 8.664 0.243 18933 4734 1 7 . 1 1 78 78 VAL N N 78 124.791 124.791 124.435 0.356 18933 4735 1 7 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.190 1.854 18933 4736 1 7 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.631 -2.449 18933 4737 1 7 . 1 1 78 78 VAL H H 78 8.892 8.892 8.190 0.702 18933 4738 1 7 . 1 1 79 79 LYS N N 79 129.667 129.667 128.898 0.769 18933 4739 1 7 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.754 1.438 18933 4740 1 7 . 1 1 79 79 LYS CB C 79 32.372 32.372 35.175 -2.803 18933 4741 1 7 . 1 1 79 79 LYS H H 79 9.049 9.049 8.715 0.334 18933 4742 1 7 . 1 1 82 82 GLY N N 82 117.263 117.263 114.801 2.462 18933 4743 1 7 . 1 1 82 82 GLY C C 82 171.710 171.710 174.471 -2.761 18933 4744 1 7 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.717 -2.792 18933 4745 1 7 . 1 1 82 82 GLY H H 82 8.044 8.044 8.496 -0.452 18933 4746 1 7 . 1 1 83 83 GLU N N 83 117.203 117.203 120.441 -3.238 18933 4747 1 7 . 1 1 83 83 GLU C C 83 178.695 178.695 178.104 0.591 18933 4748 1 7 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.466 1.511 18933 4749 1 7 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.612 0.225 18933 4750 1 7 . 1 1 83 83 GLU H H 83 8.296 8.296 8.518 -0.222 18933 4751 1 7 . 1 1 84 84 ARG N N 84 113.818 113.818 120.569 -6.751 18933 4752 1 7 . 1 1 84 84 ARG C C 84 175.877 175.877 174.903 0.974 18933 4753 1 7 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.405 -1.674 18933 4754 1 7 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.251 2.044 18933 4755 1 7 . 1 1 84 84 ARG H H 84 8.342 8.342 7.968 0.374 18933 4756 1 7 . 1 1 85 85 LYS N N 85 119.354 119.354 120.941 -1.587 18933 4757 1 7 . 1 1 85 85 LYS C C 85 174.516 174.516 174.365 0.151 18933 4758 1 7 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.581 -0.841 18933 4759 1 7 . 1 1 85 85 LYS CB C 85 34.844 34.844 35.161 -0.317 18933 4760 1 7 . 1 1 85 85 LYS H H 85 6.822 6.822 7.563 -0.741 18933 4761 1 7 . 1 1 86 86 CYS N N 86 125.928 125.928 124.773 1.155 18933 4762 1 7 . 1 1 86 86 CYS C C 86 171.600 171.600 173.126 -1.526 18933 4763 1 7 . 1 1 86 86 CYS CA C 86 55.627 55.627 58.043 -2.416 18933 4764 1 7 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.671 -0.327 18933 4765 1 7 . 1 1 86 86 CYS H H 86 9.084 9.084 9.410 -0.326 18933 4766 1 7 . 1 1 87 87 VAL N N 87 126.612 126.612 126.024 0.588 18933 4767 1 7 . 1 1 87 87 VAL C C 87 174.431 174.431 175.009 -0.578 18933 4768 1 7 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.804 -0.487 18933 4769 1 7 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.172 1.024 18933 4770 1 7 . 1 1 87 87 VAL H H 87 8.705 8.705 9.181 -0.476 18933 4771 1 7 . 1 1 88 88 LEU N N 88 127.748 127.748 123.719 4.029 18933 4772 1 7 . 1 1 88 88 LEU C C 88 175.227 175.227 174.867 0.360 18933 4773 1 7 . 1 1 88 88 LEU CA C 88 52.520 52.520 53.044 -0.524 18933 4774 1 7 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.353 -1.748 18933 4775 1 7 . 1 1 88 88 LEU H H 88 9.417 9.417 8.736 0.681 18933 4776 1 7 . 1 1 89 89 PHE N N 89 120.981 120.981 119.772 1.209 18933 4777 1 7 . 1 1 89 89 PHE C C 89 176.906 176.906 176.031 0.875 18933 4778 1 7 . 1 1 89 89 PHE CA C 89 55.587 55.587 56.286 -0.699 18933 4779 1 7 . 1 1 89 89 PHE CB C 89 38.901 38.901 42.098 -3.197 18933 4780 1 7 . 1 1 89 89 PHE H H 89 8.937 8.937 8.792 0.145 18933 4781 1 7 . 1 1 90 90 ILE N N 90 119.928 119.928 118.505 1.423 18933 4782 1 7 . 1 1 90 90 ILE C C 90 173.781 173.781 174.860 -1.079 18933 4783 1 7 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.871 -1.218 18933 4784 1 7 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.886 0.726 18933 4785 1 7 . 1 1 90 90 ILE H H 90 9.230 9.230 9.074 0.156 18933 4786 1 7 . 1 1 91 91 GLU N N 91 124.339 124.339 124.868 -0.529 18933 4787 1 7 . 1 1 91 91 GLU C C 91 175.607 175.607 175.453 0.154 18933 4788 1 7 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.542 0.077 18933 4789 1 7 . 1 1 91 91 GLU CB C 91 29.837 29.837 33.337 -3.500 18933 4790 1 7 . 1 1 91 91 GLU H H 91 8.175 8.175 9.038 -0.863 18933 4791 1 7 . 1 1 92 92 TRP N N 92 127.516 127.516 125.141 2.375 18933 4792 1 7 . 1 1 92 92 TRP C C 92 175.203 175.203 176.348 -1.145 18933 4793 1 7 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.735 1.498 18933 4794 1 7 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.316 1.345 18933 4795 1 7 . 1 1 92 92 TRP H H 92 9.306 9.306 8.752 0.554 18933 4796 1 7 . 1 1 93 93 GLU N N 93 127.834 127.834 125.907 1.927 18933 4797 1 7 . 1 1 93 93 GLU C C 93 175.668 175.668 176.221 -0.553 18933 4798 1 7 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.646 -0.768 18933 4799 1 7 . 1 1 93 93 GLU CB C 93 26.034 26.034 28.480 -2.446 18933 4800 1 7 . 1 1 93 93 GLU H H 93 8.796 8.796 9.312 -0.516 18933 4801 1 7 . 1 1 94 94 LYS N N 94 108.931 108.931 113.253 -4.322 18933 4802 1 7 . 1 1 94 94 LYS C C 94 175.423 175.423 176.278 -0.855 18933 4803 1 7 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.948 -0.505 18933 4804 1 7 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.446 -2.813 18933 4805 1 7 . 1 1 94 94 LYS H H 94 8.498 8.498 8.251 0.247 18933 4806 1 7 . 1 1 95 95 LYS N N 95 121.737 121.737 120.773 0.964 18933 4807 1 7 . 1 1 95 95 LYS C C 95 174.443 174.443 175.619 -1.176 18933 4808 1 7 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.647 -2.230 18933 4809 1 7 . 1 1 95 95 LYS CB C 95 34.464 34.464 33.800 0.664 18933 4810 1 7 . 1 1 95 95 LYS H H 95 7.761 7.761 7.740 0.021 18933 4811 1 7 . 1 1 96 96 THR N N 96 116.067 116.067 117.505 -1.438 18933 4812 1 7 . 1 1 96 96 THR C C 96 174.296 174.296 173.756 0.540 18933 4813 1 7 . 1 1 96 96 THR CA C 96 61.115 61.115 60.921 0.194 18933 4814 1 7 . 1 1 96 96 THR CB C 96 69.450 69.450 71.508 -2.058 18933 4815 1 7 . 1 1 96 96 THR H H 96 7.761 7.761 8.433 -0.672 18933 4816 1 7 . 1 1 97 97 TYR N N 97 124.229 124.229 125.494 -1.265 18933 4817 1 7 . 1 1 97 97 TYR C C 97 173.536 173.536 173.273 0.263 18933 4818 1 7 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.513 -0.562 18933 4819 1 7 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.965 -1.783 18933 4820 1 7 . 1 1 97 97 TYR H H 97 9.018 9.018 9.260 -0.242 18933 4821 1 7 . 1 1 98 98 GLN N N 98 123.435 123.435 125.906 -2.471 18933 4822 1 7 . 1 1 98 98 GLN C C 98 173.266 173.266 173.140 0.126 18933 4823 1 7 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.191 -0.049 18933 4824 1 7 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.505 -0.492 18933 4825 1 7 . 1 1 98 98 GLN H H 98 8.781 8.781 8.751 0.030 18933 4826 1 7 . 1 1 99 99 LEU N N 99 130.119 130.119 129.806 0.313 18933 4827 1 7 . 1 1 99 99 LEU C C 99 173.867 173.867 174.077 -0.210 18933 4828 1 7 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.135 -0.615 18933 4829 1 7 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.161 -0.556 18933 4830 1 7 . 1 1 99 99 LEU H H 99 9.104 9.104 8.559 0.545 18933 4831 1 7 . 1 1 100 100 ASP N N 100 125.182 125.182 128.171 -2.989 18933 4832 1 7 . 1 1 100 100 ASP C C 100 172.837 172.837 174.398 -1.561 18933 4833 1 7 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.951 -2.197 18933 4834 1 7 . 1 1 100 100 ASP CB C 100 39.344 39.344 42.879 -3.535 18933 4835 1 7 . 1 1 100 100 ASP H H 100 9.089 9.089 8.788 0.301 18933 4836 1 7 . 1 1 101 101 LEU N N 101 121.174 121.174 127.448 -6.274 18933 4837 1 7 . 1 1 101 101 LEU C C 101 174.529 174.529 174.703 -0.174 18933 4838 1 7 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.846 -1.931 18933 4839 1 7 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.631 -1.723 18933 4840 1 7 . 1 1 101 101 LEU H H 101 8.458 8.458 9.146 -0.688 18933 4841 1 7 . 1 1 102 102 PHE N N 102 119.464 119.464 125.547 -6.083 18933 4842 1 7 . 1 1 102 102 PHE C C 102 176.293 176.293 174.892 1.401 18933 4843 1 7 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.065 -1.011 18933 4844 1 7 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.757 -0.877 18933 4845 1 7 . 1 1 102 102 PHE H H 102 8.281 8.281 9.217 -0.936 18933 4846 1 7 . 1 1 103 103 THR N N 103 108.576 108.576 117.662 -9.086 18933 4847 1 7 . 1 1 103 103 THR C C 103 174.933 174.933 173.289 1.644 18933 4848 1 7 . 1 1 103 103 THR CA C 103 57.726 57.726 60.294 -2.568 18933 4849 1 7 . 1 1 103 103 THR CB C 103 71.288 71.288 69.328 1.960 18933 4850 1 7 . 1 1 103 103 THR H H 103 7.872 7.872 8.318 -0.446 18933 4851 1 7 . 1 1 104 104 ALA N N 104 122.885 122.885 128.767 -5.882 18933 4852 1 7 . 1 1 104 104 ALA C C 104 175.754 175.754 175.039 0.715 18933 4853 1 7 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.997 0.021 18933 4854 1 7 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.486 -0.001 18933 4855 1 7 . 1 1 104 104 ALA H H 104 8.660 8.660 9.270 -0.610 18933 4856 1 7 . 1 1 105 105 LEU N N 105 120.881 120.881 119.135 1.746 18933 4857 1 7 . 1 1 105 105 LEU C C 105 179.504 179.504 179.023 0.481 18933 4858 1 7 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.145 -0.897 18933 4859 1 7 . 1 1 105 105 LEU CB C 105 41.753 41.753 43.637 -1.884 18933 4860 1 7 . 1 1 105 105 LEU H H 105 8.226 8.226 8.361 -0.135 18933 4861 1 7 . 1 1 106 106 ALA N N 106 124.901 124.901 124.419 0.482 18933 4862 1 7 . 1 1 106 106 ALA C C 106 181.269 181.269 179.352 1.917 18933 4863 1 7 . 1 1 106 106 ALA CA C 106 56.313 56.313 55.159 1.154 18933 4864 1 7 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.651 -1.427 18933 4865 1 7 . 1 1 106 106 ALA H H 106 8.392 8.392 8.682 -0.290 18933 4866 1 7 . 1 1 107 107 GLU N N 107 116.409 116.409 116.332 0.077 18933 4867 1 7 . 1 1 107 107 GLU C C 107 177.764 177.764 176.744 1.020 18933 4868 1 7 . 1 1 107 107 GLU CA C 107 58.533 58.533 57.739 0.794 18933 4869 1 7 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.694 -1.758 18933 4870 1 7 . 1 1 107 107 GLU H H 107 9.664 9.664 8.555 1.109 18933 4871 1 7 . 1 1 108 108 GLU N N 108 116.189 116.189 118.149 -1.960 18933 4872 1 7 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.356 -1.213 18933 4873 1 7 . 1 1 108 108 GLU CB C 108 29.837 29.837 29.781 0.056 18933 4874 1 7 . 1 1 108 108 GLU H H 108 7.589 7.589 7.709 -0.120 18933 4875 1 7 . 1 1 109 109 LYS N N 109 119.928 119.928 121.332 -1.404 18933 4876 1 7 . 1 1 109 109 LYS CA C 109 62.851 62.851 60.504 2.347 18933 4877 1 7 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.531 -0.060 18933 4878 1 7 . 1 1 109 109 LYS H H 109 7.514 7.514 7.535 -0.021 18933 4879 1 7 . 1 1 111 111 TYR N N 111 114.930 114.930 119.248 -4.318 18933 4880 1 7 . 1 1 111 111 TYR C C 111 179.504 179.504 177.827 1.677 18933 4881 1 7 . 1 1 111 111 TYR CA C 111 59.017 59.017 60.693 -1.676 18933 4882 1 7 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.508 -1.840 18933 4883 1 7 . 1 1 111 111 TYR H H 111 6.393 6.393 8.449 -2.056 18933 4884 1 7 . 1 1 112 112 ALA N N 112 124.901 124.901 122.092 2.809 18933 4885 1 7 . 1 1 112 112 ALA C C 112 179.173 179.173 179.732 -0.559 18933 4886 1 7 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.447 -0.546 18933 4887 1 7 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.274 -0.162 18933 4888 1 7 . 1 1 112 112 ALA H H 112 8.554 8.554 8.216 0.338 18933 4889 1 7 . 1 1 113 113 ILE N N 113 119.464 119.464 119.962 -0.498 18933 4890 1 7 . 1 1 113 113 ILE C C 113 178.499 178.499 177.708 0.791 18933 4891 1 7 . 1 1 113 113 ILE CA C 113 66.281 66.281 63.915 2.366 18933 4892 1 7 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.868 -0.552 18933 4893 1 7 . 1 1 113 113 ILE H H 113 8.680 8.680 7.521 1.159 18933 4894 1 7 . 1 1 114 114 PHE N N 114 122.922 122.922 122.242 0.680 18933 4895 1 7 . 1 1 114 114 PHE C C 114 178.217 178.217 177.980 0.237 18933 4896 1 7 . 1 1 114 114 PHE CA C 114 61.559 61.559 60.340 1.219 18933 4897 1 7 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.755 0.716 18933 4898 1 7 . 1 1 114 114 PHE H H 114 7.721 7.721 8.827 -1.106 18933 4899 1 7 . 1 1 115 115 HIS N N 115 118.560 118.560 119.268 -0.708 18933 4900 1 7 . 1 1 115 115 HIS C C 115 177.286 177.286 176.943 0.343 18933 4901 1 7 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.534 -0.154 18933 4902 1 7 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.282 1.583 18933 4903 1 7 . 1 1 115 115 HIS H H 115 8.155 8.155 8.444 -0.289 18933 4904 1 7 . 1 1 116 116 PHE N N 116 111.472 111.472 117.680 -6.208 18933 4905 1 7 . 1 1 116 116 PHE C C 116 179.026 179.026 177.233 1.793 18933 4906 1 7 . 1 1 116 116 PHE CA C 116 59.461 59.461 59.708 -0.247 18933 4907 1 7 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.873 -1.684 18933 4908 1 7 . 1 1 116 116 PHE H H 116 8.564 8.564 8.113 0.451 18933 4909 1 7 . 1 1 117 117 THR N N 117 119.012 119.012 112.071 6.941 18933 4910 1 7 . 1 1 117 117 THR C C 117 172.935 172.935 176.029 -3.094 18933 4911 1 7 . 1 1 117 117 THR CA C 117 67.088 67.088 65.250 1.838 18933 4912 1 7 . 1 1 117 117 THR CB C 117 37.126 37.126 68.994 -31.868 18933 4913 1 7 . 1 1 117 117 THR H H 117 7.620 7.620 8.403 -0.783 18933 4914 1 7 . 1 1 118 118 GLY N N 118 107.917 107.917 109.720 -1.803 18933 4915 1 7 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.357 1.810 18933 4916 1 7 . 1 1 118 118 GLY H H 118 6.666 6.666 7.581 -0.915 18933 4917 1 7 . 1 1 121 121 SER N N 121 113.354 113.354 118.151 -4.797 18933 4918 1 7 . 1 1 121 121 SER C C 121 176.061 176.061 175.940 0.121 18933 4919 1 7 . 1 1 121 121 SER CA C 121 61.035 61.035 62.699 -1.663 18933 4920 1 7 . 1 1 121 121 SER H H 121 8.322 8.322 8.281 0.041 18933 4921 1 7 . 1 1 122 122 TYR N N 122 124.681 124.681 121.094 3.587 18933 4922 1 7 . 1 1 122 122 TYR C C 122 176.293 176.293 176.744 -0.451 18933 4923 1 7 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.826 -1.769 18933 4924 1 7 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.062 0.649 18933 4925 1 7 . 1 1 122 122 TYR H H 122 6.514 6.514 8.159 -1.645 18933 4926 1 7 . 1 1 123 123 LEU N N 123 117.997 117.997 119.676 -1.679 18933 4927 1 7 . 1 1 123 123 LEU C C 123 179.774 179.774 178.974 0.800 18933 4928 1 7 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.627 0.251 18933 4929 1 7 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.856 -0.878 18933 4930 1 7 . 1 1 123 123 LEU H H 123 7.428 7.428 7.187 0.241 18933 4931 1 7 . 1 1 124 124 ILE N N 124 119.012 119.012 120.819 -1.807 18933 4932 1 7 . 1 1 124 124 ILE C C 124 178.830 178.830 178.049 0.781 18933 4933 1 7 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.242 -0.091 18933 4934 1 7 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.194 -0.131 18933 4935 1 7 . 1 1 124 124 ILE H H 124 8.453 8.453 8.405 0.048 18933 4936 1 7 . 1 1 125 125 ARG N N 125 121.174 121.174 119.302 1.872 18933 4937 1 7 . 1 1 125 125 ARG C C 125 179.762 179.762 178.946 0.816 18933 4938 1 7 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.117 0.940 18933 4939 1 7 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.309 -0.359 18933 4940 1 7 . 1 1 125 125 ARG H H 125 7.004 7.004 8.082 -1.078 18933 4941 1 7 . 1 1 126 126 ILE N N 126 122.299 122.299 120.399 1.900 18933 4942 1 7 . 1 1 126 126 ILE C C 126 178.352 178.352 177.533 0.819 18933 4943 1 7 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.671 -2.466 18933 4944 1 7 . 1 1 126 126 ILE CB C 126 35.415 35.415 36.969 -1.554 18933 4945 1 7 . 1 1 126 126 ILE H H 126 7.579 7.579 7.909 -0.330 18933 4946 1 7 . 1 1 127 127 ARG N N 127 119.354 119.354 120.519 -1.165 18933 4947 1 7 . 1 1 127 127 ARG C C 127 179.786 179.786 178.700 1.086 18933 4948 1 7 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.635 0.351 18933 4949 1 7 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.132 -0.802 18933 4950 1 7 . 1 1 127 127 ARG H H 127 8.715 8.715 8.084 0.631 18933 4951 1 7 . 1 1 128 128 ALA N N 128 122.873 122.873 120.573 2.300 18933 4952 1 7 . 1 1 128 128 ALA C C 128 180.325 180.325 179.361 0.964 18933 4953 1 7 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.587 0.153 18933 4954 1 7 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.274 -1.113 18933 4955 1 7 . 1 1 128 128 ALA H H 128 7.978 7.978 8.147 -0.169 18933 4956 1 7 . 1 1 129 129 ALA N N 129 121.846 121.846 121.879 -0.033 18933 4957 1 7 . 1 1 129 129 ALA C C 129 181.539 181.539 179.884 1.655 18933 4958 1 7 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.829 -0.331 18933 4959 1 7 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.630 -1.152 18933 4960 1 7 . 1 1 129 129 ALA H H 129 7.519 7.519 8.063 -0.544 18933 4961 1 7 . 1 1 130 130 LEU N N 130 119.134 119.134 118.363 0.771 18933 4962 1 7 . 1 1 130 130 LEU C C 130 179.909 179.909 178.910 0.999 18933 4963 1 7 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.182 -0.183 18933 4964 1 7 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.674 -1.252 18933 4965 1 7 . 1 1 130 130 LEU H H 130 8.296 8.296 8.667 -0.371 18933 4966 1 7 . 1 1 131 131 LYS N N 131 122.299 122.299 120.393 1.906 18933 4967 1 7 . 1 1 131 131 LYS C C 131 180.289 180.289 179.471 0.818 18933 4968 1 7 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.795 -0.778 18933 4969 1 7 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.132 -0.900 18933 4970 1 7 . 1 1 131 131 LYS H H 131 8.281 8.281 7.801 0.480 18933 4971 1 7 . 1 1 132 132 LYS N N 132 118.743 118.743 118.557 0.186 18933 4972 1 7 . 1 1 132 132 LYS C C 132 177.482 177.482 177.860 -0.378 18933 4973 1 7 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.500 -0.008 18933 4974 1 7 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.122 -0.890 18933 4975 1 7 . 1 1 132 132 LYS H H 132 7.317 7.317 7.695 -0.378 18933 4976 1 7 . 1 1 133 133 LYS N N 133 117.093 117.093 117.053 0.040 18933 4977 1 7 . 1 1 133 133 LYS C C 133 174.614 174.614 176.121 -1.507 18933 4978 1 7 . 1 1 133 133 LYS CA C 133 54.780 54.780 56.010 -1.230 18933 4979 1 7 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.749 -0.567 18933 4980 1 7 . 1 1 133 133 LYS H H 133 7.327 7.327 7.510 -0.183 18933 4981 1 7 . 1 1 134 134 ASN N N 134 113.012 113.012 115.651 -2.639 18933 4982 1 7 . 1 1 134 134 ASN C C 134 173.965 173.965 173.402 0.563 18933 4983 1 7 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.405 -0.109 18933 4984 1 7 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.016 -0.841 18933 4985 1 7 . 1 1 134 134 ASN H H 134 7.938 7.938 7.928 0.010 18933 4986 1 7 . 1 1 135 135 TYR N N 135 115.725 115.725 119.225 -3.500 18933 4987 1 7 . 1 1 135 135 TYR C C 135 176.342 176.342 174.851 1.491 18933 4988 1 7 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.013 -1.345 18933 4989 1 7 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.588 0.975 18933 4990 1 7 . 1 1 135 135 TYR H H 135 7.741 7.741 8.439 -0.698 18933 4991 1 7 . 1 1 136 136 LYS N N 136 122.641 122.641 124.583 -1.942 18933 4992 1 7 . 1 1 136 136 LYS C C 136 173.475 173.475 174.533 -1.058 18933 4993 1 7 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.538 0.362 18933 4994 1 7 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.720 -2.002 18933 4995 1 7 . 1 1 136 136 LYS H H 136 9.296 9.296 8.802 0.494 18933 4996 1 7 . 1 1 137 137 LEU N N 137 127.284 127.284 123.416 3.868 18933 4997 1 7 . 1 1 137 137 LEU C C 137 175.423 175.423 176.003 -0.580 18933 4998 1 7 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.255 -0.129 18933 4999 1 7 . 1 1 137 137 LEU CB C 137 45.746 45.746 41.942 3.804 18933 5000 1 7 . 1 1 137 137 LEU H H 137 8.776 8.776 8.488 0.288 18933 5001 1 7 . 1 1 138 138 ASN N N 138 125.818 125.818 118.756 7.062 18933 5002 1 7 . 1 1 138 138 ASN C C 138 174.933 174.933 175.526 -0.593 18933 5003 1 7 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.917 -0.800 18933 5004 1 7 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.144 -4.638 18933 5005 1 7 . 1 1 138 138 ASN H H 138 8.811 8.811 8.219 0.592 18933 5006 1 7 . 1 1 139 139 GLN N N 139 116.861 116.861 118.855 -1.994 18933 5007 1 7 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.211 -1.373 18933 5008 1 7 . 1 1 139 139 GLN CB C 139 25.717 25.717 29.035 -3.318 18933 5009 1 7 . 1 1 139 139 GLN H H 139 9.220 9.220 8.967 0.253 18933 5010 1 7 . 1 1 140 140 TYR N N 140 120.600 120.600 120.162 0.438 18933 5011 1 7 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.843 -1.086 18933 5012 1 7 . 1 1 140 140 TYR CB C 140 37.570 37.570 37.782 -0.212 18933 5013 1 7 . 1 1 140 140 TYR H H 140 8.549 8.549 8.099 0.450 18933 5014 1 7 . 1 1 141 141 GLY N N 141 105.986 105.986 107.933 -1.947 18933 5015 1 7 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.624 -0.780 18933 5016 1 7 . 1 1 141 141 GLY H H 141 7.186 7.186 7.878 -0.692 18933 5017 1 7 . 1 1 142 142 LEU N N 142 120.038 120.038 117.314 2.724 18933 5018 1 7 . 1 1 142 142 LEU C C 142 173.340 173.340 176.336 -2.996 18933 5019 1 7 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.560 -1.040 18933 5020 1 7 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.084 1.267 18933 5021 1 7 . 1 1 142 142 LEU H H 142 7.539 7.539 8.347 -0.808 18933 5022 1 7 . 1 1 143 143 PHE N N 143 124.229 124.229 120.407 3.822 18933 5023 1 7 . 1 1 143 143 PHE C C 143 173.977 173.977 175.309 -1.332 18933 5024 1 7 . 1 1 143 143 PHE CA C 143 52.641 52.641 54.867 -2.226 18933 5025 1 7 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.144 4.524 18933 5026 1 7 . 1 1 143 143 PHE H H 143 9.084 9.084 9.056 0.028 18933 5027 1 7 . 1 1 144 144 LYS N N 144 127.858 127.858 123.470 4.388 18933 5028 1 7 . 1 1 144 144 LYS C C 144 175.092 175.092 176.264 -1.172 18933 5029 1 7 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.269 4.587 18933 5030 1 7 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.530 4.054 18933 5031 1 7 . 1 1 144 144 LYS H H 144 9.281 9.281 8.897 0.384 18933 5032 1 7 . 1 1 145 145 ASN N N 145 128.188 128.188 126.672 1.516 18933 5033 1 7 . 1 1 145 145 ASN C C 145 175.779 175.779 174.614 1.165 18933 5034 1 7 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.455 3.271 18933 5035 1 7 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.788 -3.134 18933 5036 1 7 . 1 1 145 145 ASN H H 145 9.205 9.205 9.169 0.036 18933 5037 1 7 . 1 1 146 146 GLN N N 146 129.655 129.655 111.889 17.766 18933 5038 1 7 . 1 1 146 146 GLN C C 146 175.399 175.399 174.491 0.908 18933 5039 1 7 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.318 1.497 18933 5040 1 7 . 1 1 146 146 GLN CB C 146 32.626 32.626 28.202 4.424 18933 5041 1 7 . 1 1 146 146 GLN H H 146 8.983 8.983 8.714 0.269 18933 5042 1 7 . 1 1 147 147 THR N N 147 117.936 117.936 115.292 2.644 18933 5043 1 7 . 1 1 147 147 THR C C 147 173.254 173.254 173.416 -0.162 18933 5044 1 7 . 1 1 147 147 THR CA C 147 61.721 61.721 61.348 0.373 18933 5045 1 7 . 1 1 147 147 THR CB C 147 70.274 70.274 69.719 0.555 18933 5046 1 7 . 1 1 147 147 THR H H 147 8.029 8.029 7.794 0.235 18933 5047 1 7 . 1 1 148 148 LEU N N 148 130.681 130.681 131.378 -0.697 18933 5048 1 7 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.421 0.045 18933 5049 1 7 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.672 -0.983 18933 5050 1 7 . 1 1 148 148 LEU H H 148 8.635 8.635 8.921 -0.286 18933 5051 1 7 . 1 1 149 149 VAL N N 149 130.803 130.803 124.676 6.127 18933 5052 1 7 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.205 0.974 18933 5053 1 7 . 1 1 149 149 VAL CB C 149 31.675 31.675 33.564 -1.889 18933 5054 1 7 . 1 1 149 149 VAL H H 149 8.968 8.968 9.234 -0.266 18933 5055 1 7 . 1 1 151 151 LEU N N 151 124.290 124.290 121.321 2.969 18933 5056 1 7 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.519 -2.506 18933 5057 1 7 . 1 1 151 151 LEU CB C 151 44.098 44.098 41.163 2.935 18933 5058 1 7 . 1 1 151 151 LEU H H 151 7.872 7.872 8.294 -0.422 18933 5059 1 7 . 1 1 153 153 ILE N N 153 114.943 114.943 112.266 2.677 18933 5060 1 7 . 1 1 153 153 ILE C C 153 175.877 175.877 173.901 1.976 18933 5061 1 7 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.932 -0.238 18933 5062 1 7 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.280 1.409 18933 5063 1 7 . 1 1 153 153 ILE H H 153 7.125 7.125 7.323 -0.198 18933 5064 1 7 . 1 1 154 154 THR N N 154 111.766 111.766 114.207 -2.441 18933 5065 1 7 . 1 1 154 154 THR C C 154 174.945 174.945 174.144 0.801 18933 5066 1 7 . 1 1 154 154 THR CA C 154 62.124 62.124 61.560 0.564 18933 5067 1 7 . 1 1 154 154 THR CB C 154 70.718 70.718 70.843 -0.125 18933 5068 1 7 . 1 1 154 154 THR H H 154 9.286 9.286 9.218 0.068 18933 5069 1 7 . 1 1 155 155 THR N N 155 111.766 111.766 114.436 -2.670 18933 5070 1 7 . 1 1 155 155 THR CA C 155 58.936 58.936 59.720 -0.784 18933 5071 1 7 . 1 1 155 155 THR CB C 155 72.683 72.683 72.229 0.454 18933 5072 1 7 . 1 1 155 155 THR H H 155 7.645 7.645 7.809 -0.164 18933 5073 1 7 . 1 1 157 157 LYS N N 157 119.464 119.464 118.217 1.247 18933 5074 1 7 . 1 1 157 157 LYS C C 157 178.781 178.781 178.714 0.067 18933 5075 1 7 . 1 1 157 157 LYS CA C 157 60.026 60.026 60.277 -0.251 18933 5076 1 7 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.597 -0.175 18933 5077 1 7 . 1 1 157 157 LYS H H 157 8.175 8.175 8.361 -0.186 18933 5078 1 7 . 1 1 158 158 GLU N N 158 118.340 118.340 118.501 -0.161 18933 5079 1 7 . 1 1 158 158 GLU C C 158 178.867 178.867 178.862 0.005 18933 5080 1 7 . 1 1 158 158 GLU CA C 158 58.492 58.492 59.212 -0.721 18933 5081 1 7 . 1 1 158 158 GLU CB C 158 29.330 29.330 29.193 0.137 18933 5082 1 7 . 1 1 158 158 GLU H H 158 7.519 7.519 8.243 -0.724 18933 5083 1 7 . 1 1 159 159 LEU N N 159 120.710 120.710 121.483 -0.773 18933 5084 1 7 . 1 1 159 159 LEU C C 159 176.526 176.526 178.183 -1.657 18933 5085 1 7 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.198 -0.028 18933 5086 1 7 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.864 -1.949 18933 5087 1 7 . 1 1 159 159 LEU H H 159 7.524 7.524 7.942 -0.418 18933 5088 1 7 . 1 1 160 160 ILE N N 160 118.217 118.217 118.350 -0.133 18933 5089 1 7 . 1 1 160 160 ILE C C 160 177.213 177.213 178.017 -0.804 18933 5090 1 7 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.549 -0.519 18933 5091 1 7 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.312 0.194 18933 5092 1 7 . 1 1 160 160 ILE H H 160 7.741 7.741 7.822 -0.081 18933 5093 1 7 . 1 1 161 161 LYS N N 161 118.450 118.450 119.905 -1.455 18933 5094 1 7 . 1 1 161 161 LYS C C 161 180.999 180.999 179.920 1.079 18933 5095 1 7 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.387 -0.572 18933 5096 1 7 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.164 -1.186 18933 5097 1 7 . 1 1 161 161 LYS H H 161 7.382 7.382 8.091 -0.709 18933 5098 1 7 . 1 1 162 162 GLU N N 162 121.846 121.846 120.909 0.937 18933 5099 1 7 . 1 1 162 162 GLU C C 162 178.818 178.818 178.261 0.557 18933 5100 1 7 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.413 -0.365 18933 5101 1 7 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.315 -1.379 18933 5102 1 7 . 1 1 162 162 GLU H H 162 8.210 8.210 7.840 0.370 18933 5103 1 7 . 1 1 163 163 LEU N N 163 116.751 116.751 114.975 1.776 18933 5104 1 7 . 1 1 163 163 LEU C C 163 176.784 176.784 177.086 -0.302 18933 5105 1 7 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.361 -0.339 18933 5106 1 7 . 1 1 163 163 LEU CB C 163 41.309 41.309 42.008 -0.699 18933 5107 1 7 . 1 1 163 163 LEU H H 163 7.796 7.796 7.635 0.161 18933 5108 1 7 . 1 1 164 164 GLY N N 164 104.849 104.849 105.663 -0.814 18933 5109 1 7 . 1 1 164 164 GLY C C 164 174.492 174.492 173.995 0.497 18933 5110 1 7 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.410 -0.678 18933 5111 1 7 . 1 1 164 164 GLY H H 164 7.589 7.589 7.463 0.126 18933 5112 1 7 . 1 1 165 165 PHE N N 165 118.902 118.902 118.826 0.076 18933 5113 1 7 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.600 -0.932 18933 5114 1 7 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.335 -1.850 18933 5115 1 7 . 1 1 165 165 PHE H H 165 7.251 7.251 7.810 -0.559 18933 5116 1 7 . 1 1 166 166 THR N N 166 117.093 117.093 116.258 0.835 18933 5117 1 7 . 1 1 166 166 THR CA C 166 62.245 62.245 60.472 1.773 18933 5118 1 7 . 1 1 166 166 THR CB C 166 69.323 69.323 69.358 -0.035 18933 5119 1 7 . 1 1 166 166 THR H H 166 8.407 8.407 8.273 0.134 18933 5120 1 7 . 1 1 168 168 ARG N N 168 127.431 127.431 121.343 6.088 18933 5121 1 7 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.265 -2.027 18933 5122 1 7 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.457 -1.465 18933 5123 1 7 . 1 1 168 168 ARG H H 168 7.160 7.160 8.347 -1.187 18933 5124 1 7 . 1 1 171 171 LYS N N 171 113.574 113.574 115.368 -1.794 18933 5125 1 7 . 1 1 171 171 LYS C C 171 176.416 176.416 177.384 -0.968 18933 5126 1 7 . 1 1 171 171 LYS CA C 171 57.605 57.605 57.235 0.370 18933 5127 1 7 . 1 1 171 171 LYS CB C 171 31.929 31.929 30.991 0.938 18933 5128 1 7 . 1 1 171 171 LYS H H 171 8.210 8.210 8.179 0.031 18933 5129 1 7 . 1 1 172 172 LYS N N 172 117.313 117.313 118.979 -1.666 18933 5130 1 7 . 1 1 172 172 LYS C C 172 175.717 175.717 176.763 -1.046 18933 5131 1 7 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.636 -2.462 18933 5132 1 7 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.617 -1.005 18933 5133 1 7 . 1 1 172 172 LYS H H 172 7.761 7.761 7.881 -0.120 18933 5134 1 7 . 1 1 173 173 ARG N N 173 122.056 122.056 118.525 3.531 18933 5135 1 7 . 1 1 173 173 ARG C C 173 172.850 172.850 175.190 -2.340 18933 5136 1 7 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.578 0.300 18933 5137 1 7 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.028 0.478 18933 5138 1 7 . 1 1 173 173 ARG H H 173 6.885 6.885 7.679 -0.794 18933 5139 1 8 . 1 1 2 2 LEU N N 2 122.812 122.812 120.095 2.717 18933 5140 1 8 . 1 1 2 2 LEU C C 2 175.742 175.742 175.844 -0.102 18933 5141 1 8 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.775 0.359 18933 5142 1 8 . 1 1 2 2 LEU CB C 2 42.842 42.842 44.152 -1.310 18933 5143 1 8 . 1 1 2 2 LEU H H 2 8.756 8.756 7.967 0.789 18933 5144 1 8 . 1 1 3 3 THR N N 3 113.000 113.000 112.673 0.327 18933 5145 1 8 . 1 1 3 3 THR C C 3 175.938 175.938 175.462 0.476 18933 5146 1 8 . 1 1 3 3 THR CA C 3 60.550 60.550 60.104 0.446 18933 5147 1 8 . 1 1 3 3 THR CB C 3 70.781 70.781 70.732 0.049 18933 5148 1 8 . 1 1 3 3 THR H H 3 8.428 8.428 8.017 0.411 18933 5149 1 8 . 1 1 4 4 LEU N N 4 122.531 122.531 122.838 -0.307 18933 5150 1 8 . 1 1 4 4 LEU C C 4 178.463 178.463 178.344 0.119 18933 5151 1 8 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.437 -0.307 18933 5152 1 8 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.052 -2.518 18933 5153 1 8 . 1 1 4 4 LEU H H 4 7.731 7.731 8.012 -0.281 18933 5154 1 8 . 1 1 5 5 ILE N N 5 115.505 115.505 116.730 -1.225 18933 5155 1 8 . 1 1 5 5 ILE C C 5 178.573 178.573 177.887 0.686 18933 5156 1 8 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.595 -0.857 18933 5157 1 8 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.319 -0.447 18933 5158 1 8 . 1 1 5 5 ILE H H 5 7.645 7.645 7.949 -0.304 18933 5159 1 8 . 1 1 6 6 GLN N N 6 121.626 121.626 119.406 2.220 18933 5160 1 8 . 1 1 6 6 GLN C C 6 179.014 179.014 178.651 0.363 18933 5161 1 8 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.151 -0.820 18933 5162 1 8 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.757 0.432 18933 5163 1 8 . 1 1 6 6 GLN H H 6 7.645 7.645 7.702 -0.057 18933 5164 1 8 . 1 1 7 7 GLY N N 7 107.684 107.684 106.946 0.738 18933 5165 1 8 . 1 1 7 7 GLY C C 7 174.749 174.749 176.236 -1.487 18933 5166 1 8 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.797 -0.007 18933 5167 1 8 . 1 1 7 7 GLY H H 7 8.660 8.660 7.988 0.672 18933 5168 1 8 . 1 1 8 8 LYS N N 8 120.942 120.942 122.418 -1.476 18933 5169 1 8 . 1 1 8 8 LYS C C 8 179.455 179.455 178.682 0.773 18933 5170 1 8 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.507 0.398 18933 5171 1 8 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.247 -0.825 18933 5172 1 8 . 1 1 8 8 LYS H H 8 8.518 8.518 7.557 0.961 18933 5173 1 8 . 1 1 9 9 LYS N N 9 120.710 120.710 119.534 1.176 18933 5174 1 8 . 1 1 9 9 LYS C C 9 179.823 179.823 178.932 0.891 18933 5175 1 8 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.280 0.342 18933 5176 1 8 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.179 -0.884 18933 5177 1 8 . 1 1 9 9 LYS H H 9 7.731 7.731 8.133 -0.402 18933 5178 1 8 . 1 1 10 10 ILE N N 10 121.345 121.345 120.482 0.863 18933 5179 1 8 . 1 1 10 10 ILE C C 10 177.789 177.789 178.023 -0.234 18933 5180 1 8 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.841 -1.376 18933 5181 1 8 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.074 -1.709 18933 5182 1 8 . 1 1 10 10 ILE H H 10 7.711 7.711 8.408 -0.697 18933 5183 1 8 . 1 1 11 11 VAL N N 11 120.258 120.258 120.285 -0.027 18933 5184 1 8 . 1 1 11 11 VAL C C 11 177.372 177.372 178.099 -0.727 18933 5185 1 8 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.117 0.334 18933 5186 1 8 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.099 -0.565 18933 5187 1 8 . 1 1 11 11 VAL H H 11 7.918 7.918 8.448 -0.530 18933 5188 1 8 . 1 1 12 12 ASN N N 12 116.971 116.971 118.181 -1.210 18933 5189 1 8 . 1 1 12 12 ASN C C 12 177.445 177.445 178.272 -0.827 18933 5190 1 8 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.287 -0.175 18933 5191 1 8 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.454 -0.821 18933 5192 1 8 . 1 1 12 12 ASN H H 12 7.993 7.993 8.722 -0.729 18933 5193 1 8 . 1 1 13 13 HIS N N 13 120.258 120.258 120.325 -0.067 18933 5194 1 8 . 1 1 13 13 HIS C C 13 177.862 177.862 177.768 0.094 18933 5195 1 8 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.010 0.088 18933 5196 1 8 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.690 0.542 18933 5197 1 8 . 1 1 13 13 HIS H H 13 7.741 7.741 8.369 -0.628 18933 5198 1 8 . 1 1 14 14 LEU N N 14 116.641 116.641 119.619 -2.978 18933 5199 1 8 . 1 1 14 14 LEU C C 14 179.186 179.186 178.315 0.871 18933 5200 1 8 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.234 -1.477 18933 5201 1 8 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.600 -0.481 18933 5202 1 8 . 1 1 14 14 LEU H H 14 8.221 8.221 8.509 -0.288 18933 5203 1 8 . 1 1 15 15 ARG N N 15 115.957 115.957 114.688 1.269 18933 5204 1 8 . 1 1 15 15 ARG C C 15 176.330 176.330 178.155 -1.825 18933 5205 1 8 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.561 1.142 18933 5206 1 8 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.528 -1.451 18933 5207 1 8 . 1 1 15 15 ARG H H 15 7.968 7.968 8.331 -0.363 18933 5208 1 8 . 1 1 16 16 SER N N 16 109.395 109.395 115.227 -5.832 18933 5209 1 8 . 1 1 16 16 SER C C 16 176.024 176.024 174.995 1.029 18933 5210 1 8 . 1 1 16 16 SER CA C 16 57.282 57.282 60.114 -2.832 18933 5211 1 8 . 1 1 16 16 SER CB C 16 63.683 63.683 63.647 0.036 18933 5212 1 8 . 1 1 16 16 SER H H 16 6.963 6.963 7.452 -0.488 18933 5213 1 8 . 1 1 17 17 ARG N N 17 122.775 122.775 121.724 1.051 18933 5214 1 8 . 1 1 17 17 ARG C C 17 174.590 174.590 173.899 0.691 18933 5215 1 8 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.953 1.320 18933 5216 1 8 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.587 1.215 18933 5217 1 8 . 1 1 17 17 ARG H H 17 7.781 7.781 8.208 -0.427 18933 5218 1 8 . 1 1 18 18 LEU N N 18 122.421 122.421 125.920 -3.499 18933 5219 1 8 . 1 1 18 18 LEU C C 18 176.281 176.281 174.042 2.239 18933 5220 1 8 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.497 0.283 18933 5221 1 8 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.932 -3.721 18933 5222 1 8 . 1 1 18 18 LEU H H 18 8.650 8.650 7.733 0.917 18933 5223 1 8 . 1 1 19 19 ALA N N 19 126.441 126.441 126.533 -0.092 18933 5224 1 8 . 1 1 19 19 ALA C C 19 173.904 173.904 174.867 -0.963 18933 5225 1 8 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.682 -0.816 18933 5226 1 8 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.226 0.639 18933 5227 1 8 . 1 1 19 19 ALA H H 19 8.609 8.609 8.887 -0.278 18933 5228 1 8 . 1 1 20 20 PHE N N 20 114.600 114.600 118.902 -4.302 18933 5229 1 8 . 1 1 20 20 PHE C C 20 172.592 172.592 173.944 -1.352 18933 5230 1 8 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.948 0.841 18933 5231 1 8 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.648 -0.959 18933 5232 1 8 . 1 1 20 20 PHE H H 20 8.801 8.801 9.046 -0.245 18933 5233 1 8 . 1 1 21 21 GLU N N 21 122.873 122.873 122.881 -0.008 18933 5234 1 8 . 1 1 21 21 GLU C C 21 174.872 174.872 175.268 -0.396 18933 5235 1 8 . 1 1 21 21 GLU CA C 21 55.062 55.062 54.952 0.110 18933 5236 1 8 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.146 -0.421 18933 5237 1 8 . 1 1 21 21 GLU H H 21 7.847 7.847 9.150 -1.303 18933 5238 1 8 . 1 1 22 22 TYR N N 22 126.270 126.270 126.783 -0.513 18933 5239 1 8 . 1 1 22 22 TYR C C 22 174.872 174.872 174.697 0.175 18933 5240 1 8 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.733 -0.985 18933 5241 1 8 . 1 1 22 22 TYR CB C 22 40.105 40.105 40.979 -0.874 18933 5242 1 8 . 1 1 22 22 TYR H H 22 8.806 8.806 9.190 -0.384 18933 5243 1 8 . 1 1 23 23 ASN N N 23 128.420 128.420 126.169 2.251 18933 5244 1 8 . 1 1 23 23 ASN C C 23 175.435 175.435 175.147 0.288 18933 5245 1 8 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.556 -0.551 18933 5246 1 8 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.636 -1.271 18933 5247 1 8 . 1 1 23 23 ASN H H 23 8.943 8.943 9.094 -0.151 18933 5248 1 8 . 1 1 24 24 GLY N N 24 104.067 104.067 102.065 2.002 18933 5249 1 8 . 1 1 24 24 GLY C C 24 173.707 173.707 173.804 -0.097 18933 5250 1 8 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.972 -0.038 18933 5251 1 8 . 1 1 24 24 GLY H H 24 8.534 8.534 8.200 0.334 18933 5252 1 8 . 1 1 25 25 GLN N N 25 120.038 120.038 119.921 0.117 18933 5253 1 8 . 1 1 25 25 GLN C C 25 173.744 173.744 174.783 -1.039 18933 5254 1 8 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.618 -1.291 18933 5255 1 8 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.224 0.437 18933 5256 1 8 . 1 1 25 25 GLN H H 25 7.595 7.595 7.852 -0.257 18933 5257 1 8 . 1 1 26 26 LEU N N 26 124.681 124.681 124.711 -0.030 18933 5258 1 8 . 1 1 26 26 LEU C C 26 175.987 175.987 176.248 -0.261 18933 5259 1 8 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.390 -0.377 18933 5260 1 8 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.577 -1.712 18933 5261 1 8 . 1 1 26 26 LEU H H 26 8.382 8.382 8.568 -0.186 18933 5262 1 8 . 1 1 27 27 ILE N N 27 130.779 130.779 127.243 3.536 18933 5263 1 8 . 1 1 27 27 ILE C C 27 175.215 175.215 174.347 0.868 18933 5264 1 8 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.636 -0.377 18933 5265 1 8 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.119 -2.387 18933 5266 1 8 . 1 1 27 27 ILE H H 27 8.882 8.882 8.950 -0.068 18933 5267 1 8 . 1 1 28 28 LYS N N 28 126.160 126.160 127.427 -1.267 18933 5268 1 8 . 1 1 28 28 LYS C C 28 176.771 176.771 175.727 1.044 18933 5269 1 8 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.996 1.842 18933 5270 1 8 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.101 -1.362 18933 5271 1 8 . 1 1 28 28 LYS H H 28 8.165 8.165 8.352 -0.187 18933 5272 1 8 . 1 1 29 29 ILE N N 29 126.380 126.380 121.239 5.141 18933 5273 1 8 . 1 1 29 29 ILE C C 29 175.877 175.877 174.077 1.800 18933 5274 1 8 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.435 -0.127 18933 5275 1 8 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.687 -2.624 18933 5276 1 8 . 1 1 29 29 ILE H H 29 8.019 8.019 8.707 -0.688 18933 5277 1 8 . 1 1 30 30 LEU N N 30 129.215 129.215 122.322 6.893 18933 5278 1 8 . 1 1 30 30 LEU C C 30 178.867 178.867 178.118 0.749 18933 5279 1 8 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.350 1.269 18933 5280 1 8 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.535 -4.670 18933 5281 1 8 . 1 1 30 30 LEU H H 30 8.917 8.917 8.332 0.585 18933 5282 1 8 . 1 1 31 31 SER N N 31 117.997 117.997 116.287 1.710 18933 5283 1 8 . 1 1 31 31 SER C C 31 177.396 177.396 175.646 1.750 18933 5284 1 8 . 1 1 31 31 SER CA C 31 61.236 61.236 60.713 0.523 18933 5285 1 8 . 1 1 31 31 SER CB C 31 62.035 62.035 63.186 -1.151 18933 5286 1 8 . 1 1 31 31 SER H H 31 8.594 8.594 8.843 -0.249 18933 5287 1 8 . 1 1 32 32 LYS N N 32 116.189 116.189 119.252 -3.063 18933 5288 1 8 . 1 1 32 32 LYS C C 32 176.244 176.244 177.227 -0.983 18933 5289 1 8 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.038 -0.635 18933 5290 1 8 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.456 -2.175 18933 5291 1 8 . 1 1 32 32 LYS H H 32 8.029 8.029 8.376 -0.347 18933 5292 1 8 . 1 1 33 33 ASN N N 33 119.061 119.061 115.084 3.977 18933 5293 1 8 . 1 1 33 33 ASN C C 33 172.384 172.384 174.352 -1.968 18933 5294 1 8 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.888 -1.731 18933 5295 1 8 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.116 -2.849 18933 5296 1 8 . 1 1 33 33 ASN H H 33 7.902 7.902 7.860 0.042 18933 5297 1 8 . 1 1 34 34 ILE N N 34 120.038 120.038 119.273 0.765 18933 5298 1 8 . 1 1 34 34 ILE C C 34 175.607 175.607 174.207 1.400 18933 5299 1 8 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.399 0.151 18933 5300 1 8 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.770 -2.806 18933 5301 1 8 . 1 1 34 34 ILE H H 34 7.443 7.443 7.717 -0.274 18933 5302 1 8 . 1 1 35 35 VAL N N 35 129.435 129.435 125.359 4.076 18933 5303 1 8 . 1 1 35 35 VAL C C 35 175.386 175.386 174.535 0.851 18933 5304 1 8 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.124 -0.098 18933 5305 1 8 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.715 -0.934 18933 5306 1 8 . 1 1 35 35 VAL H H 35 9.533 9.533 8.843 0.690 18933 5307 1 8 . 1 1 36 36 ALA N N 36 130.571 130.571 128.339 2.232 18933 5308 1 8 . 1 1 36 36 ALA C C 36 177.347 177.347 176.397 0.950 18933 5309 1 8 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.622 0.777 18933 5310 1 8 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.751 -0.893 18933 5311 1 8 . 1 1 36 36 ALA H H 36 8.665 8.665 8.337 0.328 18933 5312 1 8 . 1 1 37 37 VAL N N 37 115.395 115.395 119.305 -3.910 18933 5313 1 8 . 1 1 37 37 VAL C C 37 174.455 174.455 175.556 -1.101 18933 5314 1 8 . 1 1 37 37 VAL CA C 37 59.380 59.380 58.825 0.555 18933 5315 1 8 . 1 1 37 37 VAL CB C 37 32.943 32.943 34.105 -1.162 18933 5316 1 8 . 1 1 37 37 VAL H H 37 8.079 8.079 8.282 -0.203 18933 5317 1 8 . 1 1 38 38 GLY N N 38 107.672 107.672 108.020 -0.348 18933 5318 1 8 . 1 1 38 38 GLY C C 38 173.364 173.364 175.485 -2.121 18933 5319 1 8 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.269 -0.084 18933 5320 1 8 . 1 1 38 38 GLY H H 38 7.579 7.579 8.488 -0.909 18933 5321 1 8 . 1 1 39 39 SER N N 39 121.052 121.052 120.349 0.703 18933 5322 1 8 . 1 1 39 39 SER C C 39 175.570 175.570 176.133 -0.563 18933 5323 1 8 . 1 1 39 39 SER CA C 39 61.801 61.801 61.591 0.210 18933 5324 1 8 . 1 1 39 39 SER CB C 39 62.478 62.478 62.976 -0.498 18933 5325 1 8 . 1 1 39 39 SER H H 39 8.953 8.953 8.431 0.522 18933 5326 1 8 . 1 1 40 40 LEU N N 40 121.553 121.553 121.467 0.086 18933 5327 1 8 . 1 1 40 40 LEU C C 40 180.203 180.203 178.475 1.728 18933 5328 1 8 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.198 -0.069 18933 5329 1 8 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.835 -0.082 18933 5330 1 8 . 1 1 40 40 LEU H H 40 8.195 8.195 7.270 0.925 18933 5331 1 8 . 1 1 41 41 ARG N N 41 121.956 121.956 118.028 3.928 18933 5332 1 8 . 1 1 41 41 ARG C C 41 177.323 177.323 177.961 -0.638 18933 5333 1 8 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.858 0.473 18933 5334 1 8 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.930 -1.487 18933 5335 1 8 . 1 1 41 41 ARG H H 41 6.873 6.873 7.383 -0.510 18933 5336 1 8 . 1 1 42 42 ARG N N 42 114.600 114.600 116.355 -1.755 18933 5337 1 8 . 1 1 42 42 ARG C C 42 172.911 172.911 175.814 -2.903 18933 5338 1 8 . 1 1 42 42 ARG CA C 42 57.242 57.242 57.001 0.241 18933 5339 1 8 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.837 -1.697 18933 5340 1 8 . 1 1 42 42 ARG H H 42 7.438 7.438 8.075 -0.637 18933 5341 1 8 . 1 1 43 43 GLU N N 43 113.354 113.354 114.783 -1.429 18933 5342 1 8 . 1 1 43 43 GLU C C 43 175.999 175.999 175.482 0.517 18933 5343 1 8 . 1 1 43 43 GLU CA C 43 56.556 56.556 56.977 -0.421 18933 5344 1 8 . 1 1 43 43 GLU CB C 43 25.337 25.337 26.809 -1.472 18933 5345 1 8 . 1 1 43 43 GLU H H 43 7.564 7.564 7.742 -0.178 18933 5346 1 8 . 1 1 44 44 GLU N N 44 119.696 119.696 120.889 -1.193 18933 5347 1 8 . 1 1 44 44 GLU C C 44 175.423 175.423 176.073 -0.650 18933 5348 1 8 . 1 1 44 44 GLU CA C 44 56.838 56.838 54.402 2.436 18933 5349 1 8 . 1 1 44 44 GLU CB C 44 28.696 28.696 28.410 0.286 18933 5350 1 8 . 1 1 44 44 GLU H H 44 7.261 7.261 7.671 -0.410 18933 5351 1 8 . 1 1 45 45 LYS N N 45 117.435 117.435 121.690 -4.255 18933 5352 1 8 . 1 1 45 45 LYS C C 45 177.715 177.715 176.791 0.924 18933 5353 1 8 . 1 1 45 45 LYS CA C 45 59.219 59.219 58.742 0.477 18933 5354 1 8 . 1 1 45 45 LYS CB C 45 32.119 32.119 32.682 -0.563 18933 5355 1 8 . 1 1 45 45 LYS H H 45 7.938 7.938 7.711 0.227 18933 5356 1 8 . 1 1 46 46 MET N N 46 115.847 115.847 116.953 -1.106 18933 5357 1 8 . 1 1 46 46 MET CA C 46 52.520 52.520 53.429 -0.909 18933 5358 1 8 . 1 1 46 46 MET CB C 46 33.450 33.450 31.983 1.467 18933 5359 1 8 . 1 1 46 46 MET H H 46 7.595 7.595 7.703 -0.108 18933 5360 1 8 . 1 1 47 47 LEU N N 47 121.627 121.627 124.667 -3.040 18933 5361 1 8 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.897 -1.771 18933 5362 1 8 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.018 0.052 18933 5363 1 8 . 1 1 47 47 LEU H H 47 9.220 9.220 8.639 0.581 18933 5364 1 8 . 1 1 49 49 ASP N N 49 117.093 117.093 118.097 -1.004 18933 5365 1 8 . 1 1 49 49 ASP C C 49 173.340 173.340 174.348 -1.008 18933 5366 1 8 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.241 -1.447 18933 5367 1 8 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.778 -1.772 18933 5368 1 8 . 1 1 49 49 ASP H H 49 7.761 7.761 7.710 0.051 18933 5369 1 8 . 1 1 50 50 VAL N N 50 119.012 119.012 116.406 2.606 18933 5370 1 8 . 1 1 50 50 VAL C C 50 173.070 173.070 173.675 -0.605 18933 5371 1 8 . 1 1 50 50 VAL CA C 50 61.842 61.842 59.757 2.086 18933 5372 1 8 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.712 -1.149 18933 5373 1 8 . 1 1 50 50 VAL H H 50 8.089 8.089 8.611 -0.522 18933 5374 1 8 . 1 1 51 51 ASP N N 51 127.064 127.064 125.000 2.064 18933 5375 1 8 . 1 1 51 51 ASP C C 51 174.565 174.565 175.080 -0.515 18933 5376 1 8 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.561 -0.404 18933 5377 1 8 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.817 -1.177 18933 5378 1 8 . 1 1 51 51 ASP H H 51 8.069 8.069 8.065 0.004 18933 5379 1 8 . 1 1 52 52 LEU N N 52 121.627 121.627 119.520 2.107 18933 5380 1 8 . 1 1 52 52 LEU C C 52 174.063 174.063 174.713 -0.650 18933 5381 1 8 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.347 -0.665 18933 5382 1 8 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.157 -2.806 18933 5383 1 8 . 1 1 52 52 LEU H H 52 8.852 8.852 8.895 -0.043 18933 5384 1 8 . 1 1 53 53 LEU N N 53 123.093 123.093 123.161 -0.068 18933 5385 1 8 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.249 1.742 18933 5386 1 8 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.699 -2.566 18933 5387 1 8 . 1 1 53 53 LEU H H 53 9.362 9.362 9.055 0.307 18933 5388 1 8 . 1 1 54 54 ILE N N 54 123.777 123.777 129.261 -5.484 18933 5389 1 8 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.120 -4.058 18933 5390 1 8 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.418 -7.348 18933 5391 1 8 . 1 1 54 54 ILE H H 54 8.907 8.907 9.318 -0.411 18933 5392 1 8 . 1 1 58 58 GLU N N 58 114.710 114.710 117.102 -2.392 18933 5393 1 8 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.602 -1.224 18933 5394 1 8 . 1 1 58 58 GLU CB C 58 31.422 31.422 33.017 -1.595 18933 5395 1 8 . 1 1 58 58 GLU H H 58 6.716 6.716 7.410 -0.694 18933 5396 1 8 . 1 1 61 61 LEU N N 61 115.957 115.957 119.759 -3.802 18933 5397 1 8 . 1 1 61 61 LEU C C 61 178.512 178.512 178.670 -0.158 18933 5398 1 8 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.341 -2.561 18933 5399 1 8 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.874 -0.755 18933 5400 1 8 . 1 1 61 61 LEU H H 61 7.307 7.307 7.770 -0.463 18933 5401 1 8 . 1 1 62 62 LEU N N 62 120.038 120.038 119.540 0.498 18933 5402 1 8 . 1 1 62 62 LEU C C 62 177.874 177.874 178.696 -0.822 18933 5403 1 8 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.602 0.334 18933 5404 1 8 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.992 -1.253 18933 5405 1 8 . 1 1 62 62 LEU H H 62 7.327 7.327 8.108 -0.781 18933 5406 1 8 . 1 1 63 63 LYS N N 63 114.600 114.600 115.843 -1.243 18933 5407 1 8 . 1 1 63 63 LYS C C 63 175.460 175.460 177.946 -2.486 18933 5408 1 8 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.863 -1.299 18933 5409 1 8 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.566 -1.841 18933 5410 1 8 . 1 1 63 63 LYS H H 63 7.973 7.973 7.696 0.277 18933 5411 1 8 . 1 1 64 64 HIS N N 64 115.273 115.273 115.383 -0.110 18933 5412 1 8 . 1 1 64 64 HIS CA C 64 56.112 56.112 54.680 1.432 18933 5413 1 8 . 1 1 64 64 HIS CB C 64 32.436 32.436 29.998 2.438 18933 5414 1 8 . 1 1 64 64 HIS H H 64 7.544 7.544 7.484 0.060 18933 5415 1 8 . 1 1 65 65 VAL N N 65 118.682 118.682 118.990 -0.308 18933 5416 1 8 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.700 3.338 18933 5417 1 8 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.248 -2.221 18933 5418 1 8 . 1 1 65 65 VAL H H 65 6.787 6.787 7.159 -0.372 18933 5419 1 8 . 1 1 68 68 ASN N N 68 112.108 112.108 117.821 -5.713 18933 5420 1 8 . 1 1 68 68 ASN C C 68 174.884 174.884 173.953 0.931 18933 5421 1 8 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.424 -1.397 18933 5422 1 8 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.547 0.685 18933 5423 1 8 . 1 1 68 68 ASN H H 68 7.009 7.009 8.306 -1.297 18933 5424 1 8 . 1 1 69 69 ILE N N 69 123.325 123.325 123.492 -0.167 18933 5425 1 8 . 1 1 69 69 ILE C C 69 174.394 174.394 175.449 -1.055 18933 5426 1 8 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.609 -1.502 18933 5427 1 8 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.469 -0.202 18933 5428 1 8 . 1 1 69 69 ILE H H 69 7.150 7.150 8.229 -1.079 18933 5429 1 8 . 1 1 70 70 ARG N N 70 126.722 126.722 127.941 -1.219 18933 5430 1 8 . 1 1 70 70 ARG C C 70 174.590 174.590 174.354 0.236 18933 5431 1 8 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.057 -0.810 18933 5432 1 8 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.760 -2.388 18933 5433 1 8 . 1 1 70 70 ARG H H 70 8.902 8.902 9.226 -0.324 18933 5434 1 8 . 1 1 71 71 ILE N N 71 119.978 119.978 119.860 0.118 18933 5435 1 8 . 1 1 71 71 ILE C C 71 175.583 175.583 175.854 -0.271 18933 5436 1 8 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.715 0.109 18933 5437 1 8 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.179 -2.419 18933 5438 1 8 . 1 1 71 71 ILE H H 71 7.491 7.491 8.742 -1.252 18933 5439 1 8 . 1 1 72 72 LYS N N 72 128.530 128.530 124.494 4.036 18933 5440 1 8 . 1 1 72 72 LYS C C 72 177.703 177.703 176.325 1.378 18933 5441 1 8 . 1 1 72 72 LYS CA C 72 57.201 57.201 54.815 2.386 18933 5442 1 8 . 1 1 72 72 LYS CB C 72 31.485 31.485 31.105 0.380 18933 5443 1 8 . 1 1 72 72 LYS H H 72 8.523 8.523 8.597 -0.074 18933 5444 1 8 . 1 1 73 73 GLY N N 73 113.806 113.806 110.376 3.430 18933 5445 1 8 . 1 1 73 73 GLY C C 73 173.781 173.781 172.775 1.006 18933 5446 1 8 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.219 0.603 18933 5447 1 8 . 1 1 73 73 GLY H H 73 8.791 8.791 8.378 0.413 18933 5448 1 8 . 1 1 74 74 LEU N N 74 120.490 120.490 117.946 2.544 18933 5449 1 8 . 1 1 74 74 LEU C C 74 175.840 175.840 173.462 2.378 18933 5450 1 8 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.517 -0.826 18933 5451 1 8 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.163 -1.002 18933 5452 1 8 . 1 1 74 74 LEU H H 74 7.393 7.393 7.290 0.103 18933 5453 1 8 . 1 1 75 75 SER N N 75 120.038 120.038 115.611 4.427 18933 5454 1 8 . 1 1 75 75 SER C C 75 173.205 173.205 173.193 0.012 18933 5455 1 8 . 1 1 75 75 SER CA C 75 57.887 57.887 57.985 -0.098 18933 5456 1 8 . 1 1 75 75 SER CB C 75 63.049 63.049 64.820 -1.772 18933 5457 1 8 . 1 1 75 75 SER H H 75 8.917 8.917 8.090 0.827 18933 5458 1 8 . 1 1 76 76 PHE N N 76 119.586 119.586 117.703 1.883 18933 5459 1 8 . 1 1 76 76 PHE C C 76 173.536 173.536 173.747 -0.211 18933 5460 1 8 . 1 1 76 76 PHE CA C 76 55.426 55.426 56.443 -1.016 18933 5461 1 8 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.173 -0.167 18933 5462 1 8 . 1 1 76 76 PHE H H 76 8.003 8.003 8.526 -0.523 18933 5463 1 8 . 1 1 77 77 SER N N 77 114.943 114.943 116.028 -1.085 18933 5464 1 8 . 1 1 77 77 SER C C 77 173.438 173.438 172.176 1.262 18933 5465 1 8 . 1 1 77 77 SER CA C 77 56.152 56.152 57.250 -1.098 18933 5466 1 8 . 1 1 77 77 SER CB C 77 65.204 65.204 65.928 -0.724 18933 5467 1 8 . 1 1 77 77 SER H H 77 8.907 8.907 8.793 0.114 18933 5468 1 8 . 1 1 78 78 VAL N N 78 124.791 124.791 124.769 0.022 18933 5469 1 8 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.046 1.998 18933 5470 1 8 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.986 -2.804 18933 5471 1 8 . 1 1 78 78 VAL H H 78 8.892 8.892 8.233 0.659 18933 5472 1 8 . 1 1 79 79 LYS N N 79 129.667 129.667 129.164 0.503 18933 5473 1 8 . 1 1 79 79 LYS CA C 79 56.192 56.192 53.492 2.700 18933 5474 1 8 . 1 1 79 79 LYS CB C 79 32.372 32.372 33.423 -1.051 18933 5475 1 8 . 1 1 79 79 LYS H H 79 9.049 9.049 8.864 0.185 18933 5476 1 8 . 1 1 82 82 GLY N N 82 117.263 117.263 113.465 3.798 18933 5477 1 8 . 1 1 82 82 GLY C C 82 171.710 171.710 174.545 -2.835 18933 5478 1 8 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.583 -2.658 18933 5479 1 8 . 1 1 82 82 GLY H H 82 8.044 8.044 8.471 -0.427 18933 5480 1 8 . 1 1 83 83 GLU N N 83 117.203 117.203 122.392 -5.189 18933 5481 1 8 . 1 1 83 83 GLU C C 83 178.695 178.695 178.143 0.552 18933 5482 1 8 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.850 1.127 18933 5483 1 8 . 1 1 83 83 GLU CB C 83 29.837 29.837 30.207 -0.370 18933 5484 1 8 . 1 1 83 83 GLU H H 83 8.296 8.296 8.621 -0.325 18933 5485 1 8 . 1 1 84 84 ARG N N 84 113.818 113.818 119.373 -5.555 18933 5486 1 8 . 1 1 84 84 ARG C C 84 175.877 175.877 175.266 0.611 18933 5487 1 8 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.190 -1.459 18933 5488 1 8 . 1 1 84 84 ARG CB C 84 31.295 31.295 28.988 2.307 18933 5489 1 8 . 1 1 84 84 ARG H H 84 8.342 8.342 8.018 0.324 18933 5490 1 8 . 1 1 85 85 LYS N N 85 119.354 119.354 121.357 -2.003 18933 5491 1 8 . 1 1 85 85 LYS C C 85 174.516 174.516 174.347 0.169 18933 5492 1 8 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.666 -0.926 18933 5493 1 8 . 1 1 85 85 LYS CB C 85 34.844 34.844 34.915 -0.071 18933 5494 1 8 . 1 1 85 85 LYS H H 85 6.822 6.822 7.726 -0.904 18933 5495 1 8 . 1 1 86 86 CYS N N 86 125.928 125.928 124.218 1.710 18933 5496 1 8 . 1 1 86 86 CYS C C 86 171.600 171.600 173.425 -1.825 18933 5497 1 8 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.922 -2.295 18933 5498 1 8 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.508 -0.164 18933 5499 1 8 . 1 1 86 86 CYS H H 86 9.084 9.084 9.519 -0.435 18933 5500 1 8 . 1 1 87 87 VAL N N 87 126.612 126.612 126.066 0.546 18933 5501 1 8 . 1 1 87 87 VAL C C 87 174.431 174.431 174.544 -0.113 18933 5502 1 8 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.869 -0.552 18933 5503 1 8 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.251 0.945 18933 5504 1 8 . 1 1 87 87 VAL H H 87 8.705 8.705 8.775 -0.070 18933 5505 1 8 . 1 1 88 88 LEU N N 88 127.748 127.748 123.307 4.441 18933 5506 1 8 . 1 1 88 88 LEU C C 88 175.227 175.227 174.493 0.734 18933 5507 1 8 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.583 -0.063 18933 5508 1 8 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.170 -1.565 18933 5509 1 8 . 1 1 88 88 LEU H H 88 9.417 9.417 8.688 0.729 18933 5510 1 8 . 1 1 89 89 PHE N N 89 120.981 120.981 118.622 2.359 18933 5511 1 8 . 1 1 89 89 PHE C C 89 176.906 176.906 175.983 0.923 18933 5512 1 8 . 1 1 89 89 PHE CA C 89 55.587 55.587 55.738 -0.151 18933 5513 1 8 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.686 -2.785 18933 5514 1 8 . 1 1 89 89 PHE H H 89 8.937 8.937 8.530 0.407 18933 5515 1 8 . 1 1 90 90 ILE N N 90 119.928 119.928 118.478 1.450 18933 5516 1 8 . 1 1 90 90 ILE C C 90 173.781 173.781 175.172 -1.391 18933 5517 1 8 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.635 -0.981 18933 5518 1 8 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.019 1.593 18933 5519 1 8 . 1 1 90 90 ILE H H 90 9.230 9.230 9.122 0.108 18933 5520 1 8 . 1 1 91 91 GLU N N 91 124.339 124.339 125.419 -1.080 18933 5521 1 8 . 1 1 91 91 GLU C C 91 175.607 175.607 175.383 0.224 18933 5522 1 8 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.708 -0.089 18933 5523 1 8 . 1 1 91 91 GLU CB C 91 29.837 29.837 32.514 -2.677 18933 5524 1 8 . 1 1 91 91 GLU H H 91 8.175 8.175 8.940 -0.765 18933 5525 1 8 . 1 1 92 92 TRP N N 92 127.516 127.516 124.976 2.540 18933 5526 1 8 . 1 1 92 92 TRP C C 92 175.203 175.203 176.255 -1.052 18933 5527 1 8 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.538 1.695 18933 5528 1 8 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.434 1.227 18933 5529 1 8 . 1 1 92 92 TRP H H 92 9.306 9.306 8.610 0.696 18933 5530 1 8 . 1 1 93 93 GLU N N 93 127.834 127.834 125.402 2.432 18933 5531 1 8 . 1 1 93 93 GLU C C 93 175.668 175.668 176.043 -0.375 18933 5532 1 8 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.798 -0.920 18933 5533 1 8 . 1 1 93 93 GLU CB C 93 26.034 26.034 27.951 -1.917 18933 5534 1 8 . 1 1 93 93 GLU H H 93 8.796 8.796 9.210 -0.414 18933 5535 1 8 . 1 1 94 94 LYS N N 94 108.931 108.931 112.594 -3.663 18933 5536 1 8 . 1 1 94 94 LYS C C 94 175.423 175.423 175.707 -0.284 18933 5537 1 8 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.520 -0.077 18933 5538 1 8 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.045 -2.412 18933 5539 1 8 . 1 1 94 94 LYS H H 94 8.498 8.498 8.481 0.017 18933 5540 1 8 . 1 1 95 95 LYS N N 95 121.737 121.737 120.575 1.162 18933 5541 1 8 . 1 1 95 95 LYS C C 95 174.443 174.443 174.771 -0.328 18933 5542 1 8 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.185 -1.768 18933 5543 1 8 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.278 0.186 18933 5544 1 8 . 1 1 95 95 LYS H H 95 7.761 7.761 7.623 0.138 18933 5545 1 8 . 1 1 96 96 THR N N 96 116.067 116.067 116.101 -0.034 18933 5546 1 8 . 1 1 96 96 THR C C 96 174.296 174.296 173.600 0.696 18933 5547 1 8 . 1 1 96 96 THR CA C 96 61.115 61.115 61.061 0.054 18933 5548 1 8 . 1 1 96 96 THR CB C 96 69.450 69.450 71.340 -1.890 18933 5549 1 8 . 1 1 96 96 THR H H 96 7.761 7.761 8.084 -0.323 18933 5550 1 8 . 1 1 97 97 TYR N N 97 124.229 124.229 124.255 -0.026 18933 5551 1 8 . 1 1 97 97 TYR C C 97 173.536 173.536 174.140 -0.604 18933 5552 1 8 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.318 -0.368 18933 5553 1 8 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.382 -1.200 18933 5554 1 8 . 1 1 97 97 TYR H H 97 9.018 9.018 9.150 -0.132 18933 5555 1 8 . 1 1 98 98 GLN N N 98 123.435 123.435 122.768 0.667 18933 5556 1 8 . 1 1 98 98 GLN C C 98 173.266 173.266 173.955 -0.689 18933 5557 1 8 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.572 -0.429 18933 5558 1 8 . 1 1 98 98 GLN CB C 98 29.013 29.013 30.591 -1.578 18933 5559 1 8 . 1 1 98 98 GLN H H 98 8.781 8.781 9.192 -0.411 18933 5560 1 8 . 1 1 99 99 LEU N N 99 130.119 130.119 129.180 0.939 18933 5561 1 8 . 1 1 99 99 LEU C C 99 173.867 173.867 174.047 -0.180 18933 5562 1 8 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.313 -0.793 18933 5563 1 8 . 1 1 99 99 LEU CB C 99 44.605 44.605 46.245 -1.640 18933 5564 1 8 . 1 1 99 99 LEU H H 99 9.104 9.104 9.145 -0.041 18933 5565 1 8 . 1 1 100 100 ASP N N 100 125.182 125.182 127.465 -2.283 18933 5566 1 8 . 1 1 100 100 ASP C C 100 172.837 172.837 174.256 -1.419 18933 5567 1 8 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.775 -2.021 18933 5568 1 8 . 1 1 100 100 ASP CB C 100 39.344 39.344 42.996 -3.652 18933 5569 1 8 . 1 1 100 100 ASP H H 100 9.089 9.089 8.660 0.429 18933 5570 1 8 . 1 1 101 101 LEU N N 101 121.174 121.174 127.917 -6.743 18933 5571 1 8 . 1 1 101 101 LEU C C 101 174.529 174.529 174.606 -0.077 18933 5572 1 8 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.701 -1.786 18933 5573 1 8 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.294 -1.386 18933 5574 1 8 . 1 1 101 101 LEU H H 101 8.458 8.458 9.163 -0.705 18933 5575 1 8 . 1 1 102 102 PHE N N 102 119.464 119.464 126.440 -6.976 18933 5576 1 8 . 1 1 102 102 PHE C C 102 176.293 176.293 174.971 1.322 18933 5577 1 8 . 1 1 102 102 PHE CA C 102 54.054 54.054 54.838 -0.784 18933 5578 1 8 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.271 -0.391 18933 5579 1 8 . 1 1 102 102 PHE H H 102 8.281 8.281 9.336 -1.055 18933 5580 1 8 . 1 1 103 103 THR N N 103 108.576 108.576 117.535 -8.959 18933 5581 1 8 . 1 1 103 103 THR C C 103 174.933 174.933 173.289 1.644 18933 5582 1 8 . 1 1 103 103 THR CA C 103 57.726 57.726 60.373 -2.647 18933 5583 1 8 . 1 1 103 103 THR CB C 103 71.288 71.288 69.124 2.164 18933 5584 1 8 . 1 1 103 103 THR H H 103 7.872 7.872 8.440 -0.568 18933 5585 1 8 . 1 1 104 104 ALA N N 104 122.885 122.885 129.306 -6.421 18933 5586 1 8 . 1 1 104 104 ALA C C 104 175.754 175.754 174.835 0.919 18933 5587 1 8 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.785 0.233 18933 5588 1 8 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.611 -0.126 18933 5589 1 8 . 1 1 104 104 ALA H H 104 8.660 8.660 9.350 -0.690 18933 5590 1 8 . 1 1 105 105 LEU N N 105 120.881 120.881 120.148 0.733 18933 5591 1 8 . 1 1 105 105 LEU C C 105 179.504 179.504 178.556 0.948 18933 5592 1 8 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.112 -0.865 18933 5593 1 8 . 1 1 105 105 LEU CB C 105 41.753 41.753 42.905 -1.152 18933 5594 1 8 . 1 1 105 105 LEU H H 105 8.226 8.226 8.085 0.141 18933 5595 1 8 . 1 1 106 106 ALA N N 106 124.901 124.901 124.055 0.846 18933 5596 1 8 . 1 1 106 106 ALA C C 106 181.269 181.269 179.109 2.160 18933 5597 1 8 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.630 1.683 18933 5598 1 8 . 1 1 106 106 ALA CB C 106 17.224 17.224 19.081 -1.857 18933 5599 1 8 . 1 1 106 106 ALA H H 106 8.392 8.392 8.590 -0.198 18933 5600 1 8 . 1 1 107 107 GLU N N 107 116.409 116.409 116.927 -0.518 18933 5601 1 8 . 1 1 107 107 GLU C C 107 177.764 177.764 177.164 0.600 18933 5602 1 8 . 1 1 107 107 GLU CA C 107 58.533 58.533 58.154 0.380 18933 5603 1 8 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.567 -1.631 18933 5604 1 8 . 1 1 107 107 GLU H H 107 9.664 9.664 8.718 0.946 18933 5605 1 8 . 1 1 108 108 GLU N N 108 116.189 116.189 117.314 -1.125 18933 5606 1 8 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.533 -1.390 18933 5607 1 8 . 1 1 108 108 GLU CB C 108 29.837 29.837 28.676 1.161 18933 5608 1 8 . 1 1 108 108 GLU H H 108 7.589 7.589 7.522 0.067 18933 5609 1 8 . 1 1 109 109 LYS N N 109 119.928 119.928 121.527 -1.599 18933 5610 1 8 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.210 1.641 18933 5611 1 8 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.564 -0.093 18933 5612 1 8 . 1 1 109 109 LYS H H 109 7.514 7.514 7.603 -0.089 18933 5613 1 8 . 1 1 111 111 TYR N N 111 114.930 114.930 119.048 -4.118 18933 5614 1 8 . 1 1 111 111 TYR C C 111 179.504 179.504 177.695 1.809 18933 5615 1 8 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.709 -2.692 18933 5616 1 8 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.680 -2.012 18933 5617 1 8 . 1 1 111 111 TYR H H 111 6.393 6.393 8.528 -2.135 18933 5618 1 8 . 1 1 112 112 ALA N N 112 124.901 124.901 122.066 2.835 18933 5619 1 8 . 1 1 112 112 ALA C C 112 179.173 179.173 179.463 -0.290 18933 5620 1 8 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.448 -0.547 18933 5621 1 8 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.304 -0.192 18933 5622 1 8 . 1 1 112 112 ALA H H 112 8.554 8.554 8.063 0.491 18933 5623 1 8 . 1 1 113 113 ILE N N 113 119.464 119.464 119.936 -0.472 18933 5624 1 8 . 1 1 113 113 ILE C C 113 178.499 178.499 177.664 0.835 18933 5625 1 8 . 1 1 113 113 ILE CA C 113 66.281 66.281 64.077 2.204 18933 5626 1 8 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.831 -0.515 18933 5627 1 8 . 1 1 113 113 ILE H H 113 8.680 8.680 7.697 0.983 18933 5628 1 8 . 1 1 114 114 PHE N N 114 122.922 122.922 122.152 0.770 18933 5629 1 8 . 1 1 114 114 PHE C C 114 178.217 178.217 178.005 0.212 18933 5630 1 8 . 1 1 114 114 PHE CA C 114 61.559 61.559 60.168 1.391 18933 5631 1 8 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.536 0.935 18933 5632 1 8 . 1 1 114 114 PHE H H 114 7.721 7.721 8.459 -0.738 18933 5633 1 8 . 1 1 115 115 HIS N N 115 118.560 118.560 119.009 -0.449 18933 5634 1 8 . 1 1 115 115 HIS C C 115 177.286 177.286 176.848 0.438 18933 5635 1 8 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.698 -0.318 18933 5636 1 8 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.242 1.623 18933 5637 1 8 . 1 1 115 115 HIS H H 115 8.155 8.155 8.419 -0.264 18933 5638 1 8 . 1 1 116 116 PHE N N 116 111.472 111.472 116.663 -5.191 18933 5639 1 8 . 1 1 116 116 PHE C C 116 179.026 179.026 177.920 1.106 18933 5640 1 8 . 1 1 116 116 PHE CA C 116 59.461 59.461 59.761 -0.300 18933 5641 1 8 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.951 -1.762 18933 5642 1 8 . 1 1 116 116 PHE H H 116 8.564 8.564 8.025 0.539 18933 5643 1 8 . 1 1 117 117 THR N N 117 119.012 119.012 112.409 6.603 18933 5644 1 8 . 1 1 117 117 THR C C 117 172.935 172.935 175.746 -2.811 18933 5645 1 8 . 1 1 117 117 THR CA C 117 67.088 67.088 65.253 1.835 18933 5646 1 8 . 1 1 117 117 THR CB C 117 37.126 37.126 69.073 -31.947 18933 5647 1 8 . 1 1 117 117 THR H H 117 7.620 7.620 8.379 -0.759 18933 5648 1 8 . 1 1 118 118 GLY N N 118 107.917 107.917 110.230 -2.313 18933 5649 1 8 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.415 1.752 18933 5650 1 8 . 1 1 118 118 GLY H H 118 6.666 6.666 7.711 -1.045 18933 5651 1 8 . 1 1 121 121 SER N N 121 113.354 113.354 118.356 -5.002 18933 5652 1 8 . 1 1 121 121 SER C C 121 176.061 176.061 175.920 0.141 18933 5653 1 8 . 1 1 121 121 SER CA C 121 61.035 61.035 62.491 -1.456 18933 5654 1 8 . 1 1 121 121 SER H H 121 8.322 8.322 8.432 -0.110 18933 5655 1 8 . 1 1 122 122 TYR N N 122 124.681 124.681 121.192 3.489 18933 5656 1 8 . 1 1 122 122 TYR C C 122 176.293 176.293 176.932 -0.639 18933 5657 1 8 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.817 -1.760 18933 5658 1 8 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.052 0.659 18933 5659 1 8 . 1 1 122 122 TYR H H 122 6.514 6.514 8.171 -1.657 18933 5660 1 8 . 1 1 123 123 LEU N N 123 117.997 117.997 119.588 -1.591 18933 5661 1 8 . 1 1 123 123 LEU C C 123 179.774 179.774 179.047 0.727 18933 5662 1 8 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.632 0.246 18933 5663 1 8 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.896 -0.918 18933 5664 1 8 . 1 1 123 123 LEU H H 123 7.428 7.428 7.198 0.230 18933 5665 1 8 . 1 1 124 124 ILE N N 124 119.012 119.012 120.957 -1.945 18933 5666 1 8 . 1 1 124 124 ILE C C 124 178.830 178.830 178.078 0.752 18933 5667 1 8 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.299 -0.148 18933 5668 1 8 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.272 -0.209 18933 5669 1 8 . 1 1 124 124 ILE H H 124 8.453 8.453 8.413 0.040 18933 5670 1 8 . 1 1 125 125 ARG N N 125 121.174 121.174 119.135 2.039 18933 5671 1 8 . 1 1 125 125 ARG C C 125 179.762 179.762 178.964 0.798 18933 5672 1 8 . 1 1 125 125 ARG CA C 125 59.057 59.057 57.775 1.282 18933 5673 1 8 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.223 -0.273 18933 5674 1 8 . 1 1 125 125 ARG H H 125 7.004 7.004 8.114 -1.110 18933 5675 1 8 . 1 1 126 126 ILE N N 126 122.299 122.299 120.552 1.747 18933 5676 1 8 . 1 1 126 126 ILE C C 126 178.352 178.352 177.596 0.756 18933 5677 1 8 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.813 -2.608 18933 5678 1 8 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.071 -1.656 18933 5679 1 8 . 1 1 126 126 ILE H H 126 7.579 7.579 8.055 -0.476 18933 5680 1 8 . 1 1 127 127 ARG N N 127 119.354 119.354 120.404 -1.050 18933 5681 1 8 . 1 1 127 127 ARG C C 127 179.786 179.786 178.617 1.169 18933 5682 1 8 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.615 0.371 18933 5683 1 8 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.000 -0.670 18933 5684 1 8 . 1 1 127 127 ARG H H 127 8.715 8.715 8.060 0.655 18933 5685 1 8 . 1 1 128 128 ALA N N 128 122.873 122.873 120.608 2.265 18933 5686 1 8 . 1 1 128 128 ALA C C 128 180.325 180.325 179.431 0.894 18933 5687 1 8 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.611 0.129 18933 5688 1 8 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.269 -1.108 18933 5689 1 8 . 1 1 128 128 ALA H H 128 7.978 7.978 8.055 -0.077 18933 5690 1 8 . 1 1 129 129 ALA N N 129 121.846 121.846 121.866 -0.020 18933 5691 1 8 . 1 1 129 129 ALA C C 129 181.539 181.539 179.913 1.626 18933 5692 1 8 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.800 -0.302 18933 5693 1 8 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.655 -1.177 18933 5694 1 8 . 1 1 129 129 ALA H H 129 7.519 7.519 8.138 -0.619 18933 5695 1 8 . 1 1 130 130 LEU N N 130 119.134 119.134 118.405 0.729 18933 5696 1 8 . 1 1 130 130 LEU C C 130 179.909 179.909 178.877 1.032 18933 5697 1 8 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.124 -0.126 18933 5698 1 8 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.738 -1.316 18933 5699 1 8 . 1 1 130 130 LEU H H 130 8.296 8.296 8.707 -0.411 18933 5700 1 8 . 1 1 131 131 LYS N N 131 122.299 122.299 120.251 2.048 18933 5701 1 8 . 1 1 131 131 LYS C C 131 180.289 180.289 179.455 0.834 18933 5702 1 8 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.669 -0.652 18933 5703 1 8 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.086 -0.854 18933 5704 1 8 . 1 1 131 131 LYS H H 131 8.281 8.281 7.851 0.430 18933 5705 1 8 . 1 1 132 132 LYS N N 132 118.743 118.743 118.617 0.126 18933 5706 1 8 . 1 1 132 132 LYS C C 132 177.482 177.482 177.796 -0.314 18933 5707 1 8 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.480 0.013 18933 5708 1 8 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.263 -1.031 18933 5709 1 8 . 1 1 132 132 LYS H H 132 7.317 7.317 7.622 -0.305 18933 5710 1 8 . 1 1 133 133 LYS N N 133 117.093 117.093 117.081 0.012 18933 5711 1 8 . 1 1 133 133 LYS C C 133 174.614 174.614 175.996 -1.382 18933 5712 1 8 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.788 -1.008 18933 5713 1 8 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.850 -0.668 18933 5714 1 8 . 1 1 133 133 LYS H H 133 7.327 7.327 7.660 -0.333 18933 5715 1 8 . 1 1 134 134 ASN N N 134 113.012 113.012 115.933 -2.921 18933 5716 1 8 . 1 1 134 134 ASN C C 134 173.965 173.965 173.345 0.620 18933 5717 1 8 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.149 0.147 18933 5718 1 8 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.740 -1.565 18933 5719 1 8 . 1 1 134 134 ASN H H 134 7.938 7.938 8.023 -0.085 18933 5720 1 8 . 1 1 135 135 TYR N N 135 115.725 115.725 119.222 -3.497 18933 5721 1 8 . 1 1 135 135 TYR C C 135 176.342 176.342 174.921 1.421 18933 5722 1 8 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.655 -1.987 18933 5723 1 8 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.020 1.543 18933 5724 1 8 . 1 1 135 135 TYR H H 135 7.741 7.741 8.363 -0.622 18933 5725 1 8 . 1 1 136 136 LYS N N 136 122.641 122.641 124.901 -2.260 18933 5726 1 8 . 1 1 136 136 LYS C C 136 173.475 173.475 174.594 -1.119 18933 5727 1 8 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.608 0.293 18933 5728 1 8 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.500 -1.782 18933 5729 1 8 . 1 1 136 136 LYS H H 136 9.296 9.296 8.847 0.449 18933 5730 1 8 . 1 1 137 137 LEU N N 137 127.284 127.284 123.233 4.051 18933 5731 1 8 . 1 1 137 137 LEU C C 137 175.423 175.423 176.111 -0.688 18933 5732 1 8 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.153 -0.027 18933 5733 1 8 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.488 3.258 18933 5734 1 8 . 1 1 137 137 LEU H H 137 8.776 8.776 8.583 0.193 18933 5735 1 8 . 1 1 138 138 ASN N N 138 125.818 125.818 119.265 6.553 18933 5736 1 8 . 1 1 138 138 ASN C C 138 174.933 174.933 175.409 -0.476 18933 5737 1 8 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.442 -0.325 18933 5738 1 8 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.367 -4.861 18933 5739 1 8 . 1 1 138 138 ASN H H 138 8.811 8.811 8.146 0.665 18933 5740 1 8 . 1 1 139 139 GLN N N 139 116.861 116.861 119.592 -2.731 18933 5741 1 8 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.429 -1.591 18933 5742 1 8 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.524 -2.807 18933 5743 1 8 . 1 1 139 139 GLN H H 139 9.220 9.220 8.937 0.283 18933 5744 1 8 . 1 1 140 140 TYR N N 140 120.600 120.600 120.466 0.134 18933 5745 1 8 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.679 -0.923 18933 5746 1 8 . 1 1 140 140 TYR CB C 140 37.570 37.570 37.962 -0.391 18933 5747 1 8 . 1 1 140 140 TYR H H 140 8.549 8.549 8.546 0.003 18933 5748 1 8 . 1 1 141 141 GLY N N 141 105.986 105.986 108.175 -2.189 18933 5749 1 8 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.475 -0.631 18933 5750 1 8 . 1 1 141 141 GLY H H 141 7.186 7.186 7.794 -0.608 18933 5751 1 8 . 1 1 142 142 LEU N N 142 120.038 120.038 117.173 2.865 18933 5752 1 8 . 1 1 142 142 LEU C C 142 173.340 173.340 175.840 -2.500 18933 5753 1 8 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.230 -0.710 18933 5754 1 8 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.429 0.922 18933 5755 1 8 . 1 1 142 142 LEU H H 142 7.539 7.539 8.475 -0.936 18933 5756 1 8 . 1 1 143 143 PHE N N 143 124.229 124.229 120.030 4.199 18933 5757 1 8 . 1 1 143 143 PHE C C 143 173.977 173.977 175.127 -1.150 18933 5758 1 8 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.177 -2.536 18933 5759 1 8 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.305 4.363 18933 5760 1 8 . 1 1 143 143 PHE H H 143 9.084 9.084 8.953 0.131 18933 5761 1 8 . 1 1 144 144 LYS N N 144 127.858 127.858 122.915 4.943 18933 5762 1 8 . 1 1 144 144 LYS C C 144 175.092 175.092 176.680 -1.588 18933 5763 1 8 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.469 4.387 18933 5764 1 8 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.664 3.920 18933 5765 1 8 . 1 1 144 144 LYS H H 144 9.281 9.281 8.817 0.464 18933 5766 1 8 . 1 1 145 145 ASN N N 145 128.188 128.188 125.808 2.380 18933 5767 1 8 . 1 1 145 145 ASN C C 145 175.779 175.779 174.935 0.844 18933 5768 1 8 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.425 3.301 18933 5769 1 8 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.385 -2.731 18933 5770 1 8 . 1 1 145 145 ASN H H 145 9.205 9.205 9.072 0.133 18933 5771 1 8 . 1 1 146 146 GLN N N 146 129.655 129.655 111.766 17.889 18933 5772 1 8 . 1 1 146 146 GLN C C 146 175.399 175.399 174.463 0.936 18933 5773 1 8 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.289 1.526 18933 5774 1 8 . 1 1 146 146 GLN CB C 146 32.626 32.626 28.290 4.336 18933 5775 1 8 . 1 1 146 146 GLN H H 146 8.983 8.983 8.795 0.188 18933 5776 1 8 . 1 1 147 147 THR N N 147 117.936 117.936 115.603 2.333 18933 5777 1 8 . 1 1 147 147 THR C C 147 173.254 173.254 173.536 -0.282 18933 5778 1 8 . 1 1 147 147 THR CA C 147 61.721 61.721 61.472 0.249 18933 5779 1 8 . 1 1 147 147 THR CB C 147 70.274 70.274 69.295 0.979 18933 5780 1 8 . 1 1 147 147 THR H H 147 8.029 8.029 7.809 0.220 18933 5781 1 8 . 1 1 148 148 LEU N N 148 130.681 130.681 131.113 -0.432 18933 5782 1 8 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.490 -0.024 18933 5783 1 8 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.638 -0.949 18933 5784 1 8 . 1 1 148 148 LEU H H 148 8.635 8.635 8.877 -0.242 18933 5785 1 8 . 1 1 149 149 VAL N N 149 130.803 130.803 128.696 2.107 18933 5786 1 8 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.075 1.103 18933 5787 1 8 . 1 1 149 149 VAL CB C 149 31.675 31.675 35.506 -3.831 18933 5788 1 8 . 1 1 149 149 VAL H H 149 8.968 8.968 9.329 -0.361 18933 5789 1 8 . 1 1 151 151 LEU N N 151 124.290 124.290 118.339 5.951 18933 5790 1 8 . 1 1 151 151 LEU CA C 151 54.013 54.013 54.167 -0.154 18933 5791 1 8 . 1 1 151 151 LEU CB C 151 44.098 44.098 39.608 4.490 18933 5792 1 8 . 1 1 151 151 LEU H H 151 7.872 7.872 8.359 -0.487 18933 5793 1 8 . 1 1 153 153 ILE N N 153 114.943 114.943 119.784 -4.841 18933 5794 1 8 . 1 1 153 153 ILE C C 153 175.877 175.877 174.981 0.896 18933 5795 1 8 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.635 0.059 18933 5796 1 8 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.052 1.637 18933 5797 1 8 . 1 1 153 153 ILE H H 153 7.125 7.125 7.662 -0.537 18933 5798 1 8 . 1 1 154 154 THR N N 154 111.766 111.766 109.498 2.268 18933 5799 1 8 . 1 1 154 154 THR C C 154 174.945 174.945 173.959 0.986 18933 5800 1 8 . 1 1 154 154 THR CA C 154 62.124 62.124 63.243 -1.119 18933 5801 1 8 . 1 1 154 154 THR CB C 154 70.718 70.718 69.737 0.981 18933 5802 1 8 . 1 1 154 154 THR H H 154 9.286 9.286 8.377 0.909 18933 5803 1 8 . 1 1 155 155 THR N N 155 111.766 111.766 112.314 -0.548 18933 5804 1 8 . 1 1 155 155 THR CA C 155 58.936 58.936 59.940 -1.004 18933 5805 1 8 . 1 1 155 155 THR CB C 155 72.683 72.683 71.466 1.216 18933 5806 1 8 . 1 1 155 155 THR H H 155 7.645 7.645 7.391 0.254 18933 5807 1 8 . 1 1 157 157 LYS N N 157 119.464 119.464 119.050 0.414 18933 5808 1 8 . 1 1 157 157 LYS C C 157 178.781 178.781 178.545 0.236 18933 5809 1 8 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.507 0.519 18933 5810 1 8 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.753 -0.331 18933 5811 1 8 . 1 1 157 157 LYS H H 157 8.175 8.175 8.166 0.009 18933 5812 1 8 . 1 1 158 158 GLU N N 158 118.340 118.340 118.531 -0.191 18933 5813 1 8 . 1 1 158 158 GLU C C 158 178.867 178.867 179.181 -0.314 18933 5814 1 8 . 1 1 158 158 GLU CA C 158 58.492 58.492 58.973 -0.481 18933 5815 1 8 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.676 0.654 18933 5816 1 8 . 1 1 158 158 GLU H H 158 7.519 7.519 8.145 -0.626 18933 5817 1 8 . 1 1 159 159 LEU N N 159 120.710 120.710 121.572 -0.862 18933 5818 1 8 . 1 1 159 159 LEU C C 159 176.526 176.526 178.486 -1.960 18933 5819 1 8 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.120 0.050 18933 5820 1 8 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.620 -1.704 18933 5821 1 8 . 1 1 159 159 LEU H H 159 7.524 7.524 7.889 -0.365 18933 5822 1 8 . 1 1 160 160 ILE N N 160 118.217 118.217 118.926 -0.709 18933 5823 1 8 . 1 1 160 160 ILE C C 160 177.213 177.213 177.930 -0.717 18933 5824 1 8 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.584 -0.554 18933 5825 1 8 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.241 0.265 18933 5826 1 8 . 1 1 160 160 ILE H H 160 7.741 7.741 7.894 -0.153 18933 5827 1 8 . 1 1 161 161 LYS N N 161 118.450 118.450 119.763 -1.313 18933 5828 1 8 . 1 1 161 161 LYS C C 161 180.999 180.999 179.810 1.189 18933 5829 1 8 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.472 -0.657 18933 5830 1 8 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.224 -1.246 18933 5831 1 8 . 1 1 161 161 LYS H H 161 7.382 7.382 7.960 -0.578 18933 5832 1 8 . 1 1 162 162 GLU N N 162 121.846 121.846 121.065 0.781 18933 5833 1 8 . 1 1 162 162 GLU C C 162 178.818 178.818 178.250 0.568 18933 5834 1 8 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.757 -0.708 18933 5835 1 8 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.336 -1.400 18933 5836 1 8 . 1 1 162 162 GLU H H 162 8.210 8.210 7.848 0.362 18933 5837 1 8 . 1 1 163 163 LEU N N 163 116.751 116.751 115.178 1.573 18933 5838 1 8 . 1 1 163 163 LEU C C 163 176.784 176.784 177.315 -0.531 18933 5839 1 8 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.142 -0.120 18933 5840 1 8 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.918 -0.609 18933 5841 1 8 . 1 1 163 163 LEU H H 163 7.796 7.796 7.477 0.319 18933 5842 1 8 . 1 1 164 164 GLY N N 164 104.849 104.849 105.764 -0.915 18933 5843 1 8 . 1 1 164 164 GLY C C 164 174.492 174.492 174.206 0.286 18933 5844 1 8 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.415 -0.683 18933 5845 1 8 . 1 1 164 164 GLY H H 164 7.589 7.589 7.581 0.008 18933 5846 1 8 . 1 1 165 165 PHE N N 165 118.902 118.902 118.886 0.016 18933 5847 1 8 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.429 -0.761 18933 5848 1 8 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.365 -1.880 18933 5849 1 8 . 1 1 165 165 PHE H H 165 7.251 7.251 7.731 -0.480 18933 5850 1 8 . 1 1 166 166 THR N N 166 117.093 117.093 115.287 1.806 18933 5851 1 8 . 1 1 166 166 THR CA C 166 62.245 62.245 60.555 1.690 18933 5852 1 8 . 1 1 166 166 THR CB C 166 69.323 69.323 69.681 -0.358 18933 5853 1 8 . 1 1 166 166 THR H H 166 8.407 8.407 8.276 0.131 18933 5854 1 8 . 1 1 168 168 ARG N N 168 127.431 127.431 120.983 6.448 18933 5855 1 8 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.357 -2.119 18933 5856 1 8 . 1 1 168 168 ARG CB C 168 31.992 31.992 32.872 -0.880 18933 5857 1 8 . 1 1 168 168 ARG H H 168 7.160 7.160 8.434 -1.274 18933 5858 1 8 . 1 1 171 171 LYS N N 171 113.574 113.574 116.232 -2.658 18933 5859 1 8 . 1 1 171 171 LYS C C 171 176.416 176.416 177.657 -1.241 18933 5860 1 8 . 1 1 171 171 LYS CA C 171 57.605 57.605 58.199 -0.594 18933 5861 1 8 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.096 0.833 18933 5862 1 8 . 1 1 171 171 LYS H H 171 8.210 8.210 8.253 -0.043 18933 5863 1 8 . 1 1 172 172 LYS N N 172 117.313 117.313 118.857 -1.544 18933 5864 1 8 . 1 1 172 172 LYS C C 172 175.717 175.717 176.101 -0.384 18933 5865 1 8 . 1 1 172 172 LYS CA C 172 54.175 54.175 55.952 -1.777 18933 5866 1 8 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.886 -1.274 18933 5867 1 8 . 1 1 172 172 LYS H H 172 7.761 7.761 7.727 0.034 18933 5868 1 8 . 1 1 173 173 ARG N N 173 122.056 122.056 119.052 3.004 18933 5869 1 8 . 1 1 173 173 ARG C C 173 172.850 172.850 174.781 -1.931 18933 5870 1 8 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.214 0.664 18933 5871 1 8 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.067 0.439 18933 5872 1 8 . 1 1 173 173 ARG H H 173 6.885 6.885 7.464 -0.579 18933 5873 1 9 . 1 1 2 2 LEU N N 2 122.812 122.812 120.709 2.103 18933 5874 1 9 . 1 1 2 2 LEU C C 2 175.742 175.742 176.002 -0.260 18933 5875 1 9 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.565 0.569 18933 5876 1 9 . 1 1 2 2 LEU CB C 2 42.842 42.842 44.437 -1.595 18933 5877 1 9 . 1 1 2 2 LEU H H 2 8.756 8.756 8.058 0.698 18933 5878 1 9 . 1 1 3 3 THR N N 3 113.000 113.000 113.484 -0.484 18933 5879 1 9 . 1 1 3 3 THR C C 3 175.938 175.938 175.463 0.475 18933 5880 1 9 . 1 1 3 3 THR CA C 3 60.550 60.550 60.277 0.273 18933 5881 1 9 . 1 1 3 3 THR CB C 3 70.781 70.781 70.581 0.201 18933 5882 1 9 . 1 1 3 3 THR H H 3 8.428 8.428 8.047 0.381 18933 5883 1 9 . 1 1 4 4 LEU N N 4 122.531 122.531 123.229 -0.698 18933 5884 1 9 . 1 1 4 4 LEU C C 4 178.463 178.463 178.313 0.150 18933 5885 1 9 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.685 -0.556 18933 5886 1 9 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.052 -2.518 18933 5887 1 9 . 1 1 4 4 LEU H H 4 7.731 7.731 8.154 -0.423 18933 5888 1 9 . 1 1 5 5 ILE N N 5 115.505 115.505 117.797 -2.292 18933 5889 1 9 . 1 1 5 5 ILE C C 5 178.573 178.573 177.891 0.682 18933 5890 1 9 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.443 -0.705 18933 5891 1 9 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.339 -0.467 18933 5892 1 9 . 1 1 5 5 ILE H H 5 7.645 7.645 7.956 -0.311 18933 5893 1 9 . 1 1 6 6 GLN N N 6 121.626 121.626 119.381 2.245 18933 5894 1 9 . 1 1 6 6 GLN C C 6 179.014 179.014 178.733 0.281 18933 5895 1 9 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.042 -0.711 18933 5896 1 9 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.562 0.626 18933 5897 1 9 . 1 1 6 6 GLN H H 6 7.645 7.645 8.050 -0.405 18933 5898 1 9 . 1 1 7 7 GLY N N 7 107.684 107.684 106.941 0.743 18933 5899 1 9 . 1 1 7 7 GLY C C 7 174.749 174.749 176.133 -1.384 18933 5900 1 9 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.703 0.087 18933 5901 1 9 . 1 1 7 7 GLY H H 7 8.660 8.660 8.139 0.521 18933 5902 1 9 . 1 1 8 8 LYS N N 8 120.942 120.942 122.515 -1.573 18933 5903 1 9 . 1 1 8 8 LYS C C 8 179.455 179.455 178.621 0.834 18933 5904 1 9 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.172 0.733 18933 5905 1 9 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.221 -0.799 18933 5906 1 9 . 1 1 8 8 LYS H H 8 8.518 8.518 7.664 0.854 18933 5907 1 9 . 1 1 9 9 LYS N N 9 120.710 120.710 119.651 1.059 18933 5908 1 9 . 1 1 9 9 LYS C C 9 179.823 179.823 179.345 0.478 18933 5909 1 9 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.373 0.249 18933 5910 1 9 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.462 -1.167 18933 5911 1 9 . 1 1 9 9 LYS H H 9 7.731 7.731 8.138 -0.407 18933 5912 1 9 . 1 1 10 10 ILE N N 10 121.345 121.345 120.861 0.484 18933 5913 1 9 . 1 1 10 10 ILE C C 10 177.789 177.789 178.121 -0.332 18933 5914 1 9 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.853 -1.387 18933 5915 1 9 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.156 -1.791 18933 5916 1 9 . 1 1 10 10 ILE H H 10 7.711 7.711 8.392 -0.681 18933 5917 1 9 . 1 1 11 11 VAL N N 11 120.258 120.258 120.140 0.118 18933 5918 1 9 . 1 1 11 11 VAL C C 11 177.372 177.372 178.061 -0.689 18933 5919 1 9 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.060 0.391 18933 5920 1 9 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.133 -0.599 18933 5921 1 9 . 1 1 11 11 VAL H H 11 7.918 7.918 8.424 -0.506 18933 5922 1 9 . 1 1 12 12 ASN N N 12 116.971 116.971 118.296 -1.325 18933 5923 1 9 . 1 1 12 12 ASN C C 12 177.445 177.445 177.597 -0.152 18933 5924 1 9 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.272 -0.160 18933 5925 1 9 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.465 -0.832 18933 5926 1 9 . 1 1 12 12 ASN H H 12 7.993 7.993 8.660 -0.667 18933 5927 1 9 . 1 1 13 13 HIS N N 13 120.258 120.258 120.063 0.195 18933 5928 1 9 . 1 1 13 13 HIS C C 13 177.862 177.862 177.913 -0.051 18933 5929 1 9 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.474 -0.376 18933 5930 1 9 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.304 0.928 18933 5931 1 9 . 1 1 13 13 HIS H H 13 7.741 7.741 8.278 -0.537 18933 5932 1 9 . 1 1 14 14 LEU N N 14 116.641 116.641 119.733 -3.092 18933 5933 1 9 . 1 1 14 14 LEU C C 14 179.186 179.186 178.169 1.017 18933 5934 1 9 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.239 -1.482 18933 5935 1 9 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.718 -0.599 18933 5936 1 9 . 1 1 14 14 LEU H H 14 8.221 8.221 8.429 -0.208 18933 5937 1 9 . 1 1 15 15 ARG N N 15 115.957 115.957 114.445 1.512 18933 5938 1 9 . 1 1 15 15 ARG C C 15 176.330 176.330 178.060 -1.730 18933 5939 1 9 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.238 1.465 18933 5940 1 9 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.364 -1.287 18933 5941 1 9 . 1 1 15 15 ARG H H 15 7.968 7.968 8.427 -0.459 18933 5942 1 9 . 1 1 16 16 SER N N 16 109.395 109.395 115.729 -6.334 18933 5943 1 9 . 1 1 16 16 SER C C 16 176.024 176.024 175.102 0.922 18933 5944 1 9 . 1 1 16 16 SER CA C 16 57.282 57.282 59.668 -2.386 18933 5945 1 9 . 1 1 16 16 SER CB C 16 63.683 63.683 63.680 0.003 18933 5946 1 9 . 1 1 16 16 SER H H 16 6.963 6.963 7.662 -0.699 18933 5947 1 9 . 1 1 17 17 ARG N N 17 122.775 122.775 121.755 1.020 18933 5948 1 9 . 1 1 17 17 ARG C C 17 174.590 174.590 173.957 0.633 18933 5949 1 9 . 1 1 17 17 ARG CA C 17 56.273 56.273 55.039 1.234 18933 5950 1 9 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.721 1.081 18933 5951 1 9 . 1 1 17 17 ARG H H 17 7.781 7.781 8.249 -0.468 18933 5952 1 9 . 1 1 18 18 LEU N N 18 122.421 122.421 125.830 -3.409 18933 5953 1 9 . 1 1 18 18 LEU C C 18 176.281 176.281 174.087 2.194 18933 5954 1 9 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.458 0.322 18933 5955 1 9 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.968 -3.757 18933 5956 1 9 . 1 1 18 18 LEU H H 18 8.650 8.650 7.814 0.837 18933 5957 1 9 . 1 1 19 19 ALA N N 19 126.441 126.441 126.666 -0.225 18933 5958 1 9 . 1 1 19 19 ALA C C 19 173.904 173.904 174.875 -0.971 18933 5959 1 9 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.600 -0.734 18933 5960 1 9 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.250 0.615 18933 5961 1 9 . 1 1 19 19 ALA H H 19 8.609 8.609 8.935 -0.326 18933 5962 1 9 . 1 1 20 20 PHE N N 20 114.600 114.600 119.284 -4.684 18933 5963 1 9 . 1 1 20 20 PHE C C 20 172.592 172.592 173.889 -1.297 18933 5964 1 9 . 1 1 20 20 PHE CA C 20 55.789 55.789 55.021 0.768 18933 5965 1 9 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.679 -0.990 18933 5966 1 9 . 1 1 20 20 PHE H H 20 8.801 8.801 9.178 -0.377 18933 5967 1 9 . 1 1 21 21 GLU N N 21 122.873 122.873 123.419 -0.546 18933 5968 1 9 . 1 1 21 21 GLU C C 21 174.872 174.872 175.201 -0.329 18933 5969 1 9 . 1 1 21 21 GLU CA C 21 55.062 55.062 55.102 -0.040 18933 5970 1 9 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.266 -0.541 18933 5971 1 9 . 1 1 21 21 GLU H H 21 7.847 7.847 9.191 -1.344 18933 5972 1 9 . 1 1 22 22 TYR N N 22 126.270 126.270 126.417 -0.147 18933 5973 1 9 . 1 1 22 22 TYR C C 22 174.872 174.872 174.792 0.080 18933 5974 1 9 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.686 -0.938 18933 5975 1 9 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.351 -1.246 18933 5976 1 9 . 1 1 22 22 TYR H H 22 8.806 8.806 9.151 -0.345 18933 5977 1 9 . 1 1 23 23 ASN N N 23 128.420 128.420 125.489 2.931 18933 5978 1 9 . 1 1 23 23 ASN C C 23 175.435 175.435 175.079 0.356 18933 5979 1 9 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.604 -0.599 18933 5980 1 9 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.855 -1.490 18933 5981 1 9 . 1 1 23 23 ASN H H 23 8.943 8.943 9.158 -0.215 18933 5982 1 9 . 1 1 24 24 GLY N N 24 104.067 104.067 102.031 2.036 18933 5983 1 9 . 1 1 24 24 GLY C C 24 173.707 173.707 173.767 -0.060 18933 5984 1 9 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.971 -0.037 18933 5985 1 9 . 1 1 24 24 GLY H H 24 8.534 8.534 8.168 0.366 18933 5986 1 9 . 1 1 25 25 GLN N N 25 120.038 120.038 119.741 0.297 18933 5987 1 9 . 1 1 25 25 GLN C C 25 173.744 173.744 174.772 -1.028 18933 5988 1 9 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.307 -0.980 18933 5989 1 9 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.523 0.137 18933 5990 1 9 . 1 1 25 25 GLN H H 25 7.595 7.595 7.946 -0.351 18933 5991 1 9 . 1 1 26 26 LEU N N 26 124.681 124.681 124.612 0.069 18933 5992 1 9 . 1 1 26 26 LEU C C 26 175.987 175.987 176.208 -0.221 18933 5993 1 9 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.585 -0.572 18933 5994 1 9 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.380 -1.515 18933 5995 1 9 . 1 1 26 26 LEU H H 26 8.382 8.382 8.581 -0.199 18933 5996 1 9 . 1 1 27 27 ILE N N 27 130.779 130.779 127.241 3.538 18933 5997 1 9 . 1 1 27 27 ILE C C 27 175.215 175.215 174.295 0.920 18933 5998 1 9 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.729 -0.470 18933 5999 1 9 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.481 -2.749 18933 6000 1 9 . 1 1 27 27 ILE H H 27 8.882 8.882 8.932 -0.050 18933 6001 1 9 . 1 1 28 28 LYS N N 28 126.160 126.160 127.438 -1.278 18933 6002 1 9 . 1 1 28 28 LYS C C 28 176.771 176.771 175.686 1.085 18933 6003 1 9 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.750 2.088 18933 6004 1 9 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.176 -1.437 18933 6005 1 9 . 1 1 28 28 LYS H H 28 8.165 8.165 8.389 -0.224 18933 6006 1 9 . 1 1 29 29 ILE N N 29 126.380 126.380 122.000 4.380 18933 6007 1 9 . 1 1 29 29 ILE C C 29 175.877 175.877 174.346 1.531 18933 6008 1 9 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.529 -0.221 18933 6009 1 9 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.668 -2.605 18933 6010 1 9 . 1 1 29 29 ILE H H 29 8.019 8.019 8.635 -0.616 18933 6011 1 9 . 1 1 30 30 LEU N N 30 129.215 129.215 121.998 7.217 18933 6012 1 9 . 1 1 30 30 LEU C C 30 178.867 178.867 178.155 0.712 18933 6013 1 9 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.361 1.258 18933 6014 1 9 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.594 -4.729 18933 6015 1 9 . 1 1 30 30 LEU H H 30 8.917 8.917 8.296 0.621 18933 6016 1 9 . 1 1 31 31 SER N N 31 117.997 117.997 116.316 1.681 18933 6017 1 9 . 1 1 31 31 SER C C 31 177.396 177.396 175.707 1.689 18933 6018 1 9 . 1 1 31 31 SER CA C 31 61.236 61.236 60.913 0.323 18933 6019 1 9 . 1 1 31 31 SER CB C 31 62.035 62.035 63.254 -1.218 18933 6020 1 9 . 1 1 31 31 SER H H 31 8.594 8.594 8.854 -0.260 18933 6021 1 9 . 1 1 32 32 LYS N N 32 116.189 116.189 119.124 -2.935 18933 6022 1 9 . 1 1 32 32 LYS C C 32 176.244 176.244 177.251 -1.007 18933 6023 1 9 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.090 -0.687 18933 6024 1 9 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.383 -2.102 18933 6025 1 9 . 1 1 32 32 LYS H H 32 8.029 8.029 8.372 -0.343 18933 6026 1 9 . 1 1 33 33 ASN N N 33 119.061 119.061 114.969 4.092 18933 6027 1 9 . 1 1 33 33 ASN C C 33 172.384 172.384 174.241 -1.857 18933 6028 1 9 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.802 -1.645 18933 6029 1 9 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.065 -2.798 18933 6030 1 9 . 1 1 33 33 ASN H H 33 7.902 7.902 7.809 0.092 18933 6031 1 9 . 1 1 34 34 ILE N N 34 120.038 120.038 119.297 0.741 18933 6032 1 9 . 1 1 34 34 ILE C C 34 175.607 175.607 174.288 1.319 18933 6033 1 9 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.388 0.162 18933 6034 1 9 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.835 -2.871 18933 6035 1 9 . 1 1 34 34 ILE H H 34 7.443 7.443 7.713 -0.270 18933 6036 1 9 . 1 1 35 35 VAL N N 35 129.435 129.435 126.209 3.226 18933 6037 1 9 . 1 1 35 35 VAL C C 35 175.386 175.386 174.545 0.841 18933 6038 1 9 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.241 -0.215 18933 6039 1 9 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.557 -0.777 18933 6040 1 9 . 1 1 35 35 VAL H H 35 9.533 9.533 8.903 0.630 18933 6041 1 9 . 1 1 36 36 ALA N N 36 130.571 130.571 129.468 1.103 18933 6042 1 9 . 1 1 36 36 ALA C C 36 177.347 177.347 176.426 0.921 18933 6043 1 9 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.979 0.420 18933 6044 1 9 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.624 -0.766 18933 6045 1 9 . 1 1 36 36 ALA H H 36 8.665 8.665 8.405 0.260 18933 6046 1 9 . 1 1 37 37 VAL N N 37 115.395 115.395 121.217 -5.822 18933 6047 1 9 . 1 1 37 37 VAL C C 37 174.455 174.455 175.571 -1.116 18933 6048 1 9 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.436 -0.056 18933 6049 1 9 . 1 1 37 37 VAL CB C 37 32.943 32.943 34.705 -1.762 18933 6050 1 9 . 1 1 37 37 VAL H H 37 8.079 8.079 8.245 -0.166 18933 6051 1 9 . 1 1 38 38 GLY N N 38 107.672 107.672 107.789 -0.117 18933 6052 1 9 . 1 1 38 38 GLY C C 38 173.364 173.364 175.480 -2.116 18933 6053 1 9 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.217 -0.032 18933 6054 1 9 . 1 1 38 38 GLY H H 38 7.579 7.579 8.226 -0.647 18933 6055 1 9 . 1 1 39 39 SER N N 39 121.052 121.052 119.855 1.197 18933 6056 1 9 . 1 1 39 39 SER C C 39 175.570 175.570 176.211 -0.641 18933 6057 1 9 . 1 1 39 39 SER CA C 39 61.801 61.801 61.673 0.128 18933 6058 1 9 . 1 1 39 39 SER CB C 39 62.478 62.478 63.235 -0.757 18933 6059 1 9 . 1 1 39 39 SER H H 39 8.953 8.953 8.148 0.805 18933 6060 1 9 . 1 1 40 40 LEU N N 40 121.553 121.553 121.490 0.063 18933 6061 1 9 . 1 1 40 40 LEU C C 40 180.203 180.203 178.257 1.946 18933 6062 1 9 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.079 0.050 18933 6063 1 9 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.975 -0.222 18933 6064 1 9 . 1 1 40 40 LEU H H 40 8.195 8.195 7.174 1.021 18933 6065 1 9 . 1 1 41 41 ARG N N 41 121.956 121.956 116.977 4.979 18933 6066 1 9 . 1 1 41 41 ARG C C 41 177.323 177.323 178.055 -0.732 18933 6067 1 9 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.767 0.565 18933 6068 1 9 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.990 -1.547 18933 6069 1 9 . 1 1 41 41 ARG H H 41 6.873 6.873 7.383 -0.510 18933 6070 1 9 . 1 1 42 42 ARG N N 42 114.600 114.600 116.765 -2.165 18933 6071 1 9 . 1 1 42 42 ARG C C 42 172.911 172.911 175.926 -3.015 18933 6072 1 9 . 1 1 42 42 ARG CA C 42 57.242 57.242 57.209 0.033 18933 6073 1 9 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.890 -1.750 18933 6074 1 9 . 1 1 42 42 ARG H H 42 7.438 7.438 8.197 -0.759 18933 6075 1 9 . 1 1 43 43 GLU N N 43 113.354 113.354 113.875 -0.521 18933 6076 1 9 . 1 1 43 43 GLU C C 43 175.999 175.999 175.583 0.416 18933 6077 1 9 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.043 -0.487 18933 6078 1 9 . 1 1 43 43 GLU CB C 43 25.337 25.337 26.546 -1.209 18933 6079 1 9 . 1 1 43 43 GLU H H 43 7.564 7.564 7.972 -0.408 18933 6080 1 9 . 1 1 44 44 GLU N N 44 119.696 119.696 120.348 -0.652 18933 6081 1 9 . 1 1 44 44 GLU C C 44 175.423 175.423 176.096 -0.673 18933 6082 1 9 . 1 1 44 44 GLU CA C 44 56.838 56.838 54.832 2.006 18933 6083 1 9 . 1 1 44 44 GLU CB C 44 28.696 28.696 28.012 0.684 18933 6084 1 9 . 1 1 44 44 GLU H H 44 7.261 7.261 7.830 -0.569 18933 6085 1 9 . 1 1 45 45 LYS N N 45 117.435 117.435 121.182 -3.747 18933 6086 1 9 . 1 1 45 45 LYS C C 45 177.715 177.715 176.216 1.499 18933 6087 1 9 . 1 1 45 45 LYS CA C 45 59.219 59.219 59.060 0.159 18933 6088 1 9 . 1 1 45 45 LYS CB C 45 32.119 32.119 32.643 -0.524 18933 6089 1 9 . 1 1 45 45 LYS H H 45 7.938 7.938 7.834 0.104 18933 6090 1 9 . 1 1 46 46 MET N N 46 115.847 115.847 116.669 -0.822 18933 6091 1 9 . 1 1 46 46 MET CA C 46 52.520 52.520 53.849 -1.329 18933 6092 1 9 . 1 1 46 46 MET CB C 46 33.450 33.450 31.252 2.198 18933 6093 1 9 . 1 1 46 46 MET H H 46 7.595 7.595 7.795 -0.200 18933 6094 1 9 . 1 1 47 47 LEU N N 47 121.627 121.627 124.473 -2.846 18933 6095 1 9 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.799 -1.673 18933 6096 1 9 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.143 -0.073 18933 6097 1 9 . 1 1 47 47 LEU H H 47 9.220 9.220 8.574 0.646 18933 6098 1 9 . 1 1 49 49 ASP N N 49 117.093 117.093 117.985 -0.892 18933 6099 1 9 . 1 1 49 49 ASP C C 49 173.340 173.340 174.258 -0.918 18933 6100 1 9 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.442 -1.648 18933 6101 1 9 . 1 1 49 49 ASP CB C 49 43.006 43.006 45.152 -2.146 18933 6102 1 9 . 1 1 49 49 ASP H H 49 7.761 7.761 7.730 0.031 18933 6103 1 9 . 1 1 50 50 VAL N N 50 119.012 119.012 117.706 1.306 18933 6104 1 9 . 1 1 50 50 VAL C C 50 173.070 173.070 173.822 -0.752 18933 6105 1 9 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.334 1.508 18933 6106 1 9 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.755 -1.192 18933 6107 1 9 . 1 1 50 50 VAL H H 50 8.089 8.089 8.579 -0.490 18933 6108 1 9 . 1 1 51 51 ASP N N 51 127.064 127.064 124.990 2.074 18933 6109 1 9 . 1 1 51 51 ASP C C 51 174.565 174.565 175.244 -0.679 18933 6110 1 9 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.964 -0.807 18933 6111 1 9 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.508 -0.868 18933 6112 1 9 . 1 1 51 51 ASP H H 51 8.069 8.069 8.108 -0.039 18933 6113 1 9 . 1 1 52 52 LEU N N 52 121.627 121.627 119.943 1.684 18933 6114 1 9 . 1 1 52 52 LEU C C 52 174.063 174.063 174.686 -0.623 18933 6115 1 9 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.526 -0.844 18933 6116 1 9 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.370 -3.019 18933 6117 1 9 . 1 1 52 52 LEU H H 52 8.852 8.852 9.068 -0.216 18933 6118 1 9 . 1 1 53 53 LEU N N 53 123.093 123.093 123.517 -0.424 18933 6119 1 9 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.149 1.842 18933 6120 1 9 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.611 -2.478 18933 6121 1 9 . 1 1 53 53 LEU H H 53 9.362 9.362 9.105 0.257 18933 6122 1 9 . 1 1 54 54 ILE N N 54 123.777 123.777 129.219 -5.442 18933 6123 1 9 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.079 -4.017 18933 6124 1 9 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.633 -7.563 18933 6125 1 9 . 1 1 54 54 ILE H H 54 8.907 8.907 9.315 -0.408 18933 6126 1 9 . 1 1 58 58 GLU N N 58 114.710 114.710 117.199 -2.489 18933 6127 1 9 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.000 -0.623 18933 6128 1 9 . 1 1 58 58 GLU CB C 58 31.422 31.422 32.594 -1.172 18933 6129 1 9 . 1 1 58 58 GLU H H 58 6.716 6.716 7.375 -0.659 18933 6130 1 9 . 1 1 61 61 LEU N N 61 115.957 115.957 120.281 -4.324 18933 6131 1 9 . 1 1 61 61 LEU C C 61 178.512 178.512 178.383 0.129 18933 6132 1 9 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.077 -2.297 18933 6133 1 9 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.549 -0.430 18933 6134 1 9 . 1 1 61 61 LEU H H 61 7.307 7.307 7.984 -0.677 18933 6135 1 9 . 1 1 62 62 LEU N N 62 120.038 120.038 119.509 0.529 18933 6136 1 9 . 1 1 62 62 LEU C C 62 177.874 177.874 178.800 -0.926 18933 6137 1 9 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.542 0.394 18933 6138 1 9 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.912 -1.173 18933 6139 1 9 . 1 1 62 62 LEU H H 62 7.327 7.327 8.270 -0.943 18933 6140 1 9 . 1 1 63 63 LYS N N 63 114.600 114.600 115.755 -1.155 18933 6141 1 9 . 1 1 63 63 LYS C C 63 175.460 175.460 177.763 -2.303 18933 6142 1 9 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.888 -1.324 18933 6143 1 9 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.662 -1.937 18933 6144 1 9 . 1 1 63 63 LYS H H 63 7.973 7.973 7.775 0.198 18933 6145 1 9 . 1 1 64 64 HIS N N 64 115.273 115.273 115.886 -0.613 18933 6146 1 9 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.355 0.757 18933 6147 1 9 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.529 1.907 18933 6148 1 9 . 1 1 64 64 HIS H H 64 7.544 7.544 7.586 -0.042 18933 6149 1 9 . 1 1 65 65 VAL N N 65 118.682 118.682 118.376 0.306 18933 6150 1 9 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.721 3.317 18933 6151 1 9 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.360 -2.333 18933 6152 1 9 . 1 1 65 65 VAL H H 65 6.787 6.787 7.193 -0.406 18933 6153 1 9 . 1 1 68 68 ASN N N 68 112.108 112.108 118.011 -5.903 18933 6154 1 9 . 1 1 68 68 ASN C C 68 174.884 174.884 173.886 0.998 18933 6155 1 9 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.348 -1.321 18933 6156 1 9 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.322 0.909 18933 6157 1 9 . 1 1 68 68 ASN H H 68 7.009 7.009 8.305 -1.296 18933 6158 1 9 . 1 1 69 69 ILE N N 69 123.325 123.325 123.927 -0.602 18933 6159 1 9 . 1 1 69 69 ILE C C 69 174.394 174.394 175.351 -0.957 18933 6160 1 9 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.492 -1.385 18933 6161 1 9 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.472 -0.205 18933 6162 1 9 . 1 1 69 69 ILE H H 69 7.150 7.150 8.231 -1.081 18933 6163 1 9 . 1 1 70 70 ARG N N 70 126.722 126.722 127.513 -0.791 18933 6164 1 9 . 1 1 70 70 ARG C C 70 174.590 174.590 174.466 0.124 18933 6165 1 9 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.146 -0.899 18933 6166 1 9 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.216 -1.844 18933 6167 1 9 . 1 1 70 70 ARG H H 70 8.902 8.902 9.221 -0.319 18933 6168 1 9 . 1 1 71 71 ILE N N 71 119.978 119.978 120.328 -0.350 18933 6169 1 9 . 1 1 71 71 ILE C C 71 175.583 175.583 175.912 -0.329 18933 6170 1 9 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.791 0.033 18933 6171 1 9 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.224 -2.464 18933 6172 1 9 . 1 1 71 71 ILE H H 71 7.491 7.491 8.851 -1.360 18933 6173 1 9 . 1 1 72 72 LYS N N 72 128.530 128.530 124.884 3.646 18933 6174 1 9 . 1 1 72 72 LYS C C 72 177.703 177.703 176.385 1.318 18933 6175 1 9 . 1 1 72 72 LYS CA C 72 57.201 57.201 54.490 2.711 18933 6176 1 9 . 1 1 72 72 LYS CB C 72 31.485 31.485 30.712 0.773 18933 6177 1 9 . 1 1 72 72 LYS H H 72 8.523 8.523 8.515 0.008 18933 6178 1 9 . 1 1 73 73 GLY N N 73 113.806 113.806 110.280 3.526 18933 6179 1 9 . 1 1 73 73 GLY C C 73 173.781 173.781 172.838 0.943 18933 6180 1 9 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.273 0.549 18933 6181 1 9 . 1 1 73 73 GLY H H 73 8.791 8.791 8.281 0.510 18933 6182 1 9 . 1 1 74 74 LEU N N 74 120.490 120.490 118.049 2.441 18933 6183 1 9 . 1 1 74 74 LEU C C 74 175.840 175.840 173.598 2.242 18933 6184 1 9 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.315 -0.624 18933 6185 1 9 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.283 -1.122 18933 6186 1 9 . 1 1 74 74 LEU H H 74 7.393 7.393 7.249 0.144 18933 6187 1 9 . 1 1 75 75 SER N N 75 120.038 120.038 115.602 4.436 18933 6188 1 9 . 1 1 75 75 SER C C 75 173.205 173.205 173.377 -0.172 18933 6189 1 9 . 1 1 75 75 SER CA C 75 57.887 57.887 57.713 0.174 18933 6190 1 9 . 1 1 75 75 SER CB C 75 63.049 63.049 65.004 -1.955 18933 6191 1 9 . 1 1 75 75 SER H H 75 8.917 8.917 8.120 0.797 18933 6192 1 9 . 1 1 76 76 PHE N N 76 119.586 119.586 118.190 1.396 18933 6193 1 9 . 1 1 76 76 PHE C C 76 173.536 173.536 173.824 -0.288 18933 6194 1 9 . 1 1 76 76 PHE CA C 76 55.426 55.426 55.971 -0.545 18933 6195 1 9 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.699 -0.693 18933 6196 1 9 . 1 1 76 76 PHE H H 76 8.003 8.003 8.219 -0.216 18933 6197 1 9 . 1 1 77 77 SER N N 77 114.943 114.943 116.502 -1.559 18933 6198 1 9 . 1 1 77 77 SER C C 77 173.438 173.438 172.715 0.723 18933 6199 1 9 . 1 1 77 77 SER CA C 77 56.152 56.152 57.169 -1.017 18933 6200 1 9 . 1 1 77 77 SER CB C 77 65.204 65.204 66.012 -0.808 18933 6201 1 9 . 1 1 77 77 SER H H 77 8.907 8.907 8.752 0.155 18933 6202 1 9 . 1 1 78 78 VAL N N 78 124.791 124.791 124.086 0.705 18933 6203 1 9 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.109 1.935 18933 6204 1 9 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.742 -2.560 18933 6205 1 9 . 1 1 78 78 VAL H H 78 8.892 8.892 8.413 0.479 18933 6206 1 9 . 1 1 79 79 LYS N N 79 129.667 129.667 129.569 0.098 18933 6207 1 9 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.645 1.547 18933 6208 1 9 . 1 1 79 79 LYS CB C 79 32.372 32.372 34.814 -2.442 18933 6209 1 9 . 1 1 79 79 LYS H H 79 9.049 9.049 9.015 0.034 18933 6210 1 9 . 1 1 82 82 GLY N N 82 117.263 117.263 113.313 3.950 18933 6211 1 9 . 1 1 82 82 GLY C C 82 171.710 171.710 174.906 -3.196 18933 6212 1 9 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.401 -2.476 18933 6213 1 9 . 1 1 82 82 GLY H H 82 8.044 8.044 8.485 -0.441 18933 6214 1 9 . 1 1 83 83 GLU N N 83 117.203 117.203 123.013 -5.810 18933 6215 1 9 . 1 1 83 83 GLU C C 83 178.695 178.695 178.146 0.549 18933 6216 1 9 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.946 1.031 18933 6217 1 9 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.984 -0.147 18933 6218 1 9 . 1 1 83 83 GLU H H 83 8.296 8.296 8.490 -0.194 18933 6219 1 9 . 1 1 84 84 ARG N N 84 113.818 113.818 117.669 -3.851 18933 6220 1 9 . 1 1 84 84 ARG C C 84 175.877 175.877 175.290 0.587 18933 6221 1 9 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.356 -1.625 18933 6222 1 9 . 1 1 84 84 ARG CB C 84 31.295 31.295 28.938 2.357 18933 6223 1 9 . 1 1 84 84 ARG H H 84 8.342 8.342 7.997 0.345 18933 6224 1 9 . 1 1 85 85 LYS N N 85 119.354 119.354 121.490 -2.136 18933 6225 1 9 . 1 1 85 85 LYS C C 85 174.516 174.516 174.161 0.355 18933 6226 1 9 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.644 -0.904 18933 6227 1 9 . 1 1 85 85 LYS CB C 85 34.844 34.844 35.419 -0.575 18933 6228 1 9 . 1 1 85 85 LYS H H 85 6.822 6.822 7.630 -0.808 18933 6229 1 9 . 1 1 86 86 CYS N N 86 125.928 125.928 124.667 1.261 18933 6230 1 9 . 1 1 86 86 CYS C C 86 171.600 171.600 173.115 -1.515 18933 6231 1 9 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.963 -2.336 18933 6232 1 9 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.710 -0.367 18933 6233 1 9 . 1 1 86 86 CYS H H 86 9.084 9.084 9.393 -0.309 18933 6234 1 9 . 1 1 87 87 VAL N N 87 126.612 126.612 125.801 0.811 18933 6235 1 9 . 1 1 87 87 VAL C C 87 174.431 174.431 174.710 -0.279 18933 6236 1 9 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.822 -0.504 18933 6237 1 9 . 1 1 87 87 VAL CB C 87 33.196 33.196 31.996 1.200 18933 6238 1 9 . 1 1 87 87 VAL H H 87 8.705 8.705 9.114 -0.409 18933 6239 1 9 . 1 1 88 88 LEU N N 88 127.748 127.748 124.001 3.747 18933 6240 1 9 . 1 1 88 88 LEU C C 88 175.227 175.227 174.542 0.685 18933 6241 1 9 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.806 -0.286 18933 6242 1 9 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.398 -1.793 18933 6243 1 9 . 1 1 88 88 LEU H H 88 9.417 9.417 8.616 0.801 18933 6244 1 9 . 1 1 89 89 PHE N N 89 120.981 120.981 119.171 1.810 18933 6245 1 9 . 1 1 89 89 PHE C C 89 176.906 176.906 176.170 0.736 18933 6246 1 9 . 1 1 89 89 PHE CA C 89 55.587 55.587 56.011 -0.424 18933 6247 1 9 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.818 -2.917 18933 6248 1 9 . 1 1 89 89 PHE H H 89 8.937 8.937 8.735 0.203 18933 6249 1 9 . 1 1 90 90 ILE N N 90 119.928 119.928 118.573 1.355 18933 6250 1 9 . 1 1 90 90 ILE C C 90 173.781 173.781 174.994 -1.213 18933 6251 1 9 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.939 -1.285 18933 6252 1 9 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.373 1.239 18933 6253 1 9 . 1 1 90 90 ILE H H 90 9.230 9.230 9.070 0.160 18933 6254 1 9 . 1 1 91 91 GLU N N 91 124.339 124.339 125.276 -0.937 18933 6255 1 9 . 1 1 91 91 GLU C C 91 175.607 175.607 175.413 0.194 18933 6256 1 9 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.629 -0.010 18933 6257 1 9 . 1 1 91 91 GLU CB C 91 29.837 29.837 32.899 -3.062 18933 6258 1 9 . 1 1 91 91 GLU H H 91 8.175 8.175 9.004 -0.829 18933 6259 1 9 . 1 1 92 92 TRP N N 92 127.516 127.516 124.534 2.982 18933 6260 1 9 . 1 1 92 92 TRP C C 92 175.203 175.203 176.290 -1.087 18933 6261 1 9 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.469 1.764 18933 6262 1 9 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.495 1.166 18933 6263 1 9 . 1 1 92 92 TRP H H 92 9.306 9.306 8.500 0.806 18933 6264 1 9 . 1 1 93 93 GLU N N 93 127.834 127.834 125.768 2.066 18933 6265 1 9 . 1 1 93 93 GLU C C 93 175.668 175.668 176.050 -0.382 18933 6266 1 9 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.398 -0.520 18933 6267 1 9 . 1 1 93 93 GLU CB C 93 26.034 26.034 28.952 -2.918 18933 6268 1 9 . 1 1 93 93 GLU H H 93 8.796 8.796 8.934 -0.138 18933 6269 1 9 . 1 1 94 94 LYS N N 94 108.931 108.931 113.906 -4.975 18933 6270 1 9 . 1 1 94 94 LYS C C 94 175.423 175.423 175.797 -0.374 18933 6271 1 9 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.578 -0.135 18933 6272 1 9 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.577 -2.944 18933 6273 1 9 . 1 1 94 94 LYS H H 94 8.498 8.498 8.624 -0.126 18933 6274 1 9 . 1 1 95 95 LYS N N 95 121.737 121.737 120.229 1.508 18933 6275 1 9 . 1 1 95 95 LYS C C 95 174.443 174.443 174.944 -0.501 18933 6276 1 9 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.152 -1.735 18933 6277 1 9 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.259 0.205 18933 6278 1 9 . 1 1 95 95 LYS H H 95 7.761 7.761 7.621 0.140 18933 6279 1 9 . 1 1 96 96 THR N N 96 116.067 116.067 116.105 -0.038 18933 6280 1 9 . 1 1 96 96 THR C C 96 174.296 174.296 173.550 0.746 18933 6281 1 9 . 1 1 96 96 THR CA C 96 61.115 61.115 61.001 0.115 18933 6282 1 9 . 1 1 96 96 THR CB C 96 69.450 69.450 71.454 -2.005 18933 6283 1 9 . 1 1 96 96 THR H H 96 7.761 7.761 8.100 -0.339 18933 6284 1 9 . 1 1 97 97 TYR N N 97 124.229 124.229 123.337 0.892 18933 6285 1 9 . 1 1 97 97 TYR C C 97 173.536 173.536 174.825 -1.289 18933 6286 1 9 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.802 -0.852 18933 6287 1 9 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.467 -1.284 18933 6288 1 9 . 1 1 97 97 TYR H H 97 9.018 9.018 9.202 -0.184 18933 6289 1 9 . 1 1 98 98 GLN N N 98 123.435 123.435 122.180 1.255 18933 6290 1 9 . 1 1 98 98 GLN C C 98 173.266 173.266 174.431 -1.165 18933 6291 1 9 . 1 1 98 98 GLN CA C 98 55.143 55.143 56.301 -1.158 18933 6292 1 9 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.043 -0.030 18933 6293 1 9 . 1 1 98 98 GLN H H 98 8.781 8.781 9.076 -0.295 18933 6294 1 9 . 1 1 99 99 LEU N N 99 130.119 130.119 127.483 2.636 18933 6295 1 9 . 1 1 99 99 LEU C C 99 173.867 173.867 174.249 -0.382 18933 6296 1 9 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.625 -1.105 18933 6297 1 9 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.592 -0.987 18933 6298 1 9 . 1 1 99 99 LEU H H 99 9.104 9.104 8.679 0.425 18933 6299 1 9 . 1 1 100 100 ASP N N 100 125.182 125.182 128.228 -3.046 18933 6300 1 9 . 1 1 100 100 ASP C C 100 172.837 172.837 174.274 -1.437 18933 6301 1 9 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.851 -2.097 18933 6302 1 9 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.232 -3.888 18933 6303 1 9 . 1 1 100 100 ASP H H 100 9.089 9.089 8.849 0.240 18933 6304 1 9 . 1 1 101 101 LEU N N 101 121.174 121.174 127.792 -6.618 18933 6305 1 9 . 1 1 101 101 LEU C C 101 174.529 174.529 174.594 -0.065 18933 6306 1 9 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.759 -1.844 18933 6307 1 9 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.535 -1.627 18933 6308 1 9 . 1 1 101 101 LEU H H 101 8.458 8.458 9.223 -0.765 18933 6309 1 9 . 1 1 102 102 PHE N N 102 119.464 119.464 125.557 -6.093 18933 6310 1 9 . 1 1 102 102 PHE C C 102 176.293 176.293 174.980 1.313 18933 6311 1 9 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.377 -1.323 18933 6312 1 9 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.253 -0.373 18933 6313 1 9 . 1 1 102 102 PHE H H 102 8.281 8.281 9.319 -1.038 18933 6314 1 9 . 1 1 103 103 THR N N 103 108.576 108.576 116.915 -8.339 18933 6315 1 9 . 1 1 103 103 THR C C 103 174.933 174.933 173.317 1.616 18933 6316 1 9 . 1 1 103 103 THR CA C 103 57.726 57.726 60.272 -2.546 18933 6317 1 9 . 1 1 103 103 THR CB C 103 71.288 71.288 69.773 1.515 18933 6318 1 9 . 1 1 103 103 THR H H 103 7.872 7.872 8.315 -0.443 18933 6319 1 9 . 1 1 104 104 ALA N N 104 122.885 122.885 127.681 -4.796 18933 6320 1 9 . 1 1 104 104 ALA C C 104 175.754 175.754 174.685 1.069 18933 6321 1 9 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.782 0.236 18933 6322 1 9 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.012 0.473 18933 6323 1 9 . 1 1 104 104 ALA H H 104 8.660 8.660 9.082 -0.422 18933 6324 1 9 . 1 1 105 105 LEU N N 105 120.881 120.881 118.983 1.898 18933 6325 1 9 . 1 1 105 105 LEU C C 105 179.504 179.504 178.784 0.720 18933 6326 1 9 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.340 -1.093 18933 6327 1 9 . 1 1 105 105 LEU CB C 105 41.753 41.753 44.181 -2.428 18933 6328 1 9 . 1 1 105 105 LEU H H 105 8.226 8.226 8.217 0.009 18933 6329 1 9 . 1 1 106 106 ALA N N 106 124.901 124.901 124.238 0.663 18933 6330 1 9 . 1 1 106 106 ALA C C 106 181.269 181.269 179.116 2.153 18933 6331 1 9 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.752 1.561 18933 6332 1 9 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.896 -1.672 18933 6333 1 9 . 1 1 106 106 ALA H H 106 8.392 8.392 8.617 -0.225 18933 6334 1 9 . 1 1 107 107 GLU N N 107 116.409 116.409 115.382 1.027 18933 6335 1 9 . 1 1 107 107 GLU C C 107 177.764 177.764 176.654 1.110 18933 6336 1 9 . 1 1 107 107 GLU CA C 107 58.533 58.533 58.227 0.306 18933 6337 1 9 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.690 -1.754 18933 6338 1 9 . 1 1 107 107 GLU H H 107 9.664 9.664 8.576 1.088 18933 6339 1 9 . 1 1 108 108 GLU N N 108 116.189 116.189 118.068 -1.879 18933 6340 1 9 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.462 -1.319 18933 6341 1 9 . 1 1 108 108 GLU CB C 108 29.837 29.837 29.303 0.534 18933 6342 1 9 . 1 1 108 108 GLU H H 108 7.589 7.589 7.476 0.113 18933 6343 1 9 . 1 1 109 109 LYS N N 109 119.928 119.928 121.395 -1.467 18933 6344 1 9 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.424 1.427 18933 6345 1 9 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.772 -0.301 18933 6346 1 9 . 1 1 109 109 LYS H H 109 7.514 7.514 7.604 -0.090 18933 6347 1 9 . 1 1 111 111 TYR N N 111 114.930 114.930 119.228 -4.298 18933 6348 1 9 . 1 1 111 111 TYR C C 111 179.504 179.504 177.847 1.657 18933 6349 1 9 . 1 1 111 111 TYR CA C 111 59.017 59.017 60.455 -1.438 18933 6350 1 9 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.466 -1.798 18933 6351 1 9 . 1 1 111 111 TYR H H 111 6.393 6.393 8.430 -2.037 18933 6352 1 9 . 1 1 112 112 ALA N N 112 124.901 124.901 121.739 3.162 18933 6353 1 9 . 1 1 112 112 ALA C C 112 179.173 179.173 179.602 -0.429 18933 6354 1 9 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.525 -0.624 18933 6355 1 9 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.306 -0.194 18933 6356 1 9 . 1 1 112 112 ALA H H 112 8.554 8.554 8.150 0.404 18933 6357 1 9 . 1 1 113 113 ILE N N 113 119.464 119.464 119.313 0.151 18933 6358 1 9 . 1 1 113 113 ILE C C 113 178.499 178.499 177.644 0.855 18933 6359 1 9 . 1 1 113 113 ILE CA C 113 66.281 66.281 64.607 1.674 18933 6360 1 9 . 1 1 113 113 ILE CB C 113 37.316 37.316 38.139 -0.823 18933 6361 1 9 . 1 1 113 113 ILE H H 113 8.680 8.680 7.629 1.051 18933 6362 1 9 . 1 1 114 114 PHE N N 114 122.922 122.922 122.656 0.266 18933 6363 1 9 . 1 1 114 114 PHE C C 114 178.217 178.217 177.114 1.103 18933 6364 1 9 . 1 1 114 114 PHE CA C 114 61.559 61.559 59.647 1.912 18933 6365 1 9 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.864 0.607 18933 6366 1 9 . 1 1 114 114 PHE H H 114 7.721 7.721 8.661 -0.940 18933 6367 1 9 . 1 1 115 115 HIS N N 115 118.560 118.560 118.000 0.560 18933 6368 1 9 . 1 1 115 115 HIS C C 115 177.286 177.286 176.788 0.498 18933 6369 1 9 . 1 1 115 115 HIS CA C 115 59.380 59.380 58.987 0.393 18933 6370 1 9 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.460 1.405 18933 6371 1 9 . 1 1 115 115 HIS H H 115 8.155 8.155 8.208 -0.053 18933 6372 1 9 . 1 1 116 116 PHE N N 116 111.472 111.472 116.831 -5.359 18933 6373 1 9 . 1 1 116 116 PHE C C 116 179.026 179.026 177.137 1.889 18933 6374 1 9 . 1 1 116 116 PHE CA C 116 59.461 59.461 60.022 -0.561 18933 6375 1 9 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.969 -1.780 18933 6376 1 9 . 1 1 116 116 PHE H H 116 8.564 8.564 7.918 0.646 18933 6377 1 9 . 1 1 117 117 THR N N 117 119.012 119.012 111.196 7.816 18933 6378 1 9 . 1 1 117 117 THR C C 117 172.935 172.935 175.151 -2.216 18933 6379 1 9 . 1 1 117 117 THR CA C 117 67.088 67.088 64.852 2.236 18933 6380 1 9 . 1 1 117 117 THR CB C 117 37.126 37.126 69.286 -32.160 18933 6381 1 9 . 1 1 117 117 THR H H 117 7.620 7.620 8.200 -0.580 18933 6382 1 9 . 1 1 118 118 GLY N N 118 107.917 107.917 110.090 -2.173 18933 6383 1 9 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.160 2.007 18933 6384 1 9 . 1 1 118 118 GLY H H 118 6.666 6.666 7.453 -0.787 18933 6385 1 9 . 1 1 121 121 SER N N 121 113.354 113.354 117.437 -4.083 18933 6386 1 9 . 1 1 121 121 SER C C 121 176.061 176.061 175.871 0.190 18933 6387 1 9 . 1 1 121 121 SER CA C 121 61.035 61.035 61.430 -0.395 18933 6388 1 9 . 1 1 121 121 SER H H 121 8.322 8.322 8.223 0.099 18933 6389 1 9 . 1 1 122 122 TYR N N 122 124.681 124.681 121.244 3.437 18933 6390 1 9 . 1 1 122 122 TYR C C 122 176.293 176.293 177.392 -1.099 18933 6391 1 9 . 1 1 122 122 TYR CA C 122 59.057 59.057 61.321 -2.264 18933 6392 1 9 . 1 1 122 122 TYR CB C 122 38.711 38.711 37.950 0.761 18933 6393 1 9 . 1 1 122 122 TYR H H 122 6.514 6.514 8.245 -1.731 18933 6394 1 9 . 1 1 123 123 LEU N N 123 117.997 117.997 119.929 -1.932 18933 6395 1 9 . 1 1 123 123 LEU C C 123 179.774 179.774 178.930 0.844 18933 6396 1 9 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.666 0.212 18933 6397 1 9 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.928 -0.950 18933 6398 1 9 . 1 1 123 123 LEU H H 123 7.428 7.428 7.262 0.166 18933 6399 1 9 . 1 1 124 124 ILE N N 124 119.012 119.012 120.166 -1.154 18933 6400 1 9 . 1 1 124 124 ILE C C 124 178.830 178.830 177.888 0.942 18933 6401 1 9 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.309 -0.158 18933 6402 1 9 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.363 -0.300 18933 6403 1 9 . 1 1 124 124 ILE H H 124 8.453 8.453 8.443 0.010 18933 6404 1 9 . 1 1 125 125 ARG N N 125 121.174 121.174 120.192 0.982 18933 6405 1 9 . 1 1 125 125 ARG C C 125 179.762 179.762 178.547 1.215 18933 6406 1 9 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.885 0.172 18933 6407 1 9 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.328 -0.377 18933 6408 1 9 . 1 1 125 125 ARG H H 125 7.004 7.004 8.146 -1.142 18933 6409 1 9 . 1 1 126 126 ILE N N 126 122.299 122.299 120.961 1.338 18933 6410 1 9 . 1 1 126 126 ILE C C 126 178.352 178.352 177.734 0.618 18933 6411 1 9 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.669 -2.464 18933 6412 1 9 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.171 -1.756 18933 6413 1 9 . 1 1 126 126 ILE H H 126 7.579 7.579 7.933 -0.354 18933 6414 1 9 . 1 1 127 127 ARG N N 127 119.354 119.354 120.625 -1.271 18933 6415 1 9 . 1 1 127 127 ARG C C 127 179.786 179.786 178.659 1.127 18933 6416 1 9 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.646 0.340 18933 6417 1 9 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.024 -0.694 18933 6418 1 9 . 1 1 127 127 ARG H H 127 8.715 8.715 8.191 0.524 18933 6419 1 9 . 1 1 128 128 ALA N N 128 122.873 122.873 120.557 2.316 18933 6420 1 9 . 1 1 128 128 ALA C C 128 180.325 180.325 179.365 0.960 18933 6421 1 9 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.625 0.115 18933 6422 1 9 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.256 -1.095 18933 6423 1 9 . 1 1 128 128 ALA H H 128 7.978 7.978 8.098 -0.120 18933 6424 1 9 . 1 1 129 129 ALA N N 129 121.846 121.846 121.927 -0.081 18933 6425 1 9 . 1 1 129 129 ALA C C 129 181.539 181.539 179.927 1.612 18933 6426 1 9 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.834 -0.336 18933 6427 1 9 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.648 -1.170 18933 6428 1 9 . 1 1 129 129 ALA H H 129 7.519 7.519 7.891 -0.372 18933 6429 1 9 . 1 1 130 130 LEU N N 130 119.134 119.134 118.215 0.919 18933 6430 1 9 . 1 1 130 130 LEU C C 130 179.909 179.909 179.036 0.873 18933 6431 1 9 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.175 -0.176 18933 6432 1 9 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.686 -1.264 18933 6433 1 9 . 1 1 130 130 LEU H H 130 8.296 8.296 8.817 -0.521 18933 6434 1 9 . 1 1 131 131 LYS N N 131 122.299 122.299 120.082 2.217 18933 6435 1 9 . 1 1 131 131 LYS C C 131 180.289 180.289 178.793 1.496 18933 6436 1 9 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.656 -0.639 18933 6437 1 9 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.144 -0.912 18933 6438 1 9 . 1 1 131 131 LYS H H 131 8.281 8.281 7.859 0.422 18933 6439 1 9 . 1 1 132 132 LYS N N 132 118.743 118.743 117.793 0.950 18933 6440 1 9 . 1 1 132 132 LYS C C 132 177.482 177.482 178.209 -0.727 18933 6441 1 9 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.415 0.077 18933 6442 1 9 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.234 -1.002 18933 6443 1 9 . 1 1 132 132 LYS H H 132 7.317 7.317 7.564 -0.247 18933 6444 1 9 . 1 1 133 133 LYS N N 133 117.093 117.093 117.143 -0.050 18933 6445 1 9 . 1 1 133 133 LYS C C 133 174.614 174.614 176.108 -1.494 18933 6446 1 9 . 1 1 133 133 LYS CA C 133 54.780 54.780 56.023 -1.243 18933 6447 1 9 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.758 -0.576 18933 6448 1 9 . 1 1 133 133 LYS H H 133 7.327 7.327 7.506 -0.179 18933 6449 1 9 . 1 1 134 134 ASN N N 134 113.012 113.012 115.546 -2.534 18933 6450 1 9 . 1 1 134 134 ASN C C 134 173.965 173.965 173.453 0.512 18933 6451 1 9 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.580 -0.284 18933 6452 1 9 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.382 -1.207 18933 6453 1 9 . 1 1 134 134 ASN H H 134 7.938 7.938 7.888 0.050 18933 6454 1 9 . 1 1 135 135 TYR N N 135 115.725 115.725 119.301 -3.576 18933 6455 1 9 . 1 1 135 135 TYR C C 135 176.342 176.342 174.981 1.361 18933 6456 1 9 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.519 -1.851 18933 6457 1 9 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.337 1.226 18933 6458 1 9 . 1 1 135 135 TYR H H 135 7.741 7.741 8.538 -0.797 18933 6459 1 9 . 1 1 136 136 LYS N N 136 122.641 122.641 124.521 -1.880 18933 6460 1 9 . 1 1 136 136 LYS C C 136 173.475 173.475 174.560 -1.085 18933 6461 1 9 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.615 0.286 18933 6462 1 9 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.531 -1.813 18933 6463 1 9 . 1 1 136 136 LYS H H 136 9.296 9.296 8.855 0.441 18933 6464 1 9 . 1 1 137 137 LEU N N 137 127.284 127.284 123.906 3.378 18933 6465 1 9 . 1 1 137 137 LEU C C 137 175.423 175.423 176.187 -0.764 18933 6466 1 9 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.399 -0.273 18933 6467 1 9 . 1 1 137 137 LEU CB C 137 45.746 45.746 41.854 3.892 18933 6468 1 9 . 1 1 137 137 LEU H H 137 8.776 8.776 8.600 0.176 18933 6469 1 9 . 1 1 138 138 ASN N N 138 125.818 125.818 119.987 5.831 18933 6470 1 9 . 1 1 138 138 ASN C C 138 174.933 174.933 175.281 -0.348 18933 6471 1 9 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.791 -0.674 18933 6472 1 9 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.599 -5.093 18933 6473 1 9 . 1 1 138 138 ASN H H 138 8.811 8.811 8.341 0.470 18933 6474 1 9 . 1 1 139 139 GLN N N 139 116.861 116.861 119.276 -2.415 18933 6475 1 9 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.347 -1.509 18933 6476 1 9 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.568 -2.851 18933 6477 1 9 . 1 1 139 139 GLN H H 139 9.220 9.220 8.902 0.318 18933 6478 1 9 . 1 1 140 140 TYR N N 140 120.600 120.600 122.233 -1.633 18933 6479 1 9 . 1 1 140 140 TYR CA C 140 56.757 56.757 58.088 -1.331 18933 6480 1 9 . 1 1 140 140 TYR CB C 140 37.570 37.570 37.896 -0.326 18933 6481 1 9 . 1 1 140 140 TYR H H 140 8.549 8.549 8.434 0.115 18933 6482 1 9 . 1 1 141 141 GLY N N 141 105.986 105.986 108.688 -2.702 18933 6483 1 9 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.598 -0.754 18933 6484 1 9 . 1 1 141 141 GLY H H 141 7.186 7.186 7.967 -0.781 18933 6485 1 9 . 1 1 142 142 LEU N N 142 120.038 120.038 117.079 2.959 18933 6486 1 9 . 1 1 142 142 LEU C C 142 173.340 173.340 176.238 -2.898 18933 6487 1 9 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.422 -0.902 18933 6488 1 9 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.291 1.060 18933 6489 1 9 . 1 1 142 142 LEU H H 142 7.539 7.539 8.316 -0.777 18933 6490 1 9 . 1 1 143 143 PHE N N 143 124.229 124.229 119.732 4.497 18933 6491 1 9 . 1 1 143 143 PHE C C 143 173.977 173.977 175.187 -1.210 18933 6492 1 9 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.231 -2.590 18933 6493 1 9 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.264 4.404 18933 6494 1 9 . 1 1 143 143 PHE H H 143 9.084 9.084 9.035 0.049 18933 6495 1 9 . 1 1 144 144 LYS N N 144 127.858 127.858 123.805 4.053 18933 6496 1 9 . 1 1 144 144 LYS C C 144 175.092 175.092 176.417 -1.325 18933 6497 1 9 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.102 4.754 18933 6498 1 9 . 1 1 144 144 LYS CB C 144 38.584 38.584 33.940 4.644 18933 6499 1 9 . 1 1 144 144 LYS H H 144 9.281 9.281 8.804 0.477 18933 6500 1 9 . 1 1 145 145 ASN N N 145 128.188 128.188 127.054 1.134 18933 6501 1 9 . 1 1 145 145 ASN C C 145 175.779 175.779 174.646 1.133 18933 6502 1 9 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.659 3.067 18933 6503 1 9 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.363 -2.709 18933 6504 1 9 . 1 1 145 145 ASN H H 145 9.205 9.205 9.058 0.147 18933 6505 1 9 . 1 1 146 146 GLN N N 146 129.655 129.655 109.905 19.750 18933 6506 1 9 . 1 1 146 146 GLN C C 146 175.399 175.399 174.697 0.702 18933 6507 1 9 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.473 1.342 18933 6508 1 9 . 1 1 146 146 GLN CB C 146 32.626 32.626 27.792 4.834 18933 6509 1 9 . 1 1 146 146 GLN H H 146 8.983 8.983 8.739 0.244 18933 6510 1 9 . 1 1 147 147 THR N N 147 117.936 117.936 116.418 1.518 18933 6511 1 9 . 1 1 147 147 THR C C 147 173.254 173.254 173.635 -0.381 18933 6512 1 9 . 1 1 147 147 THR CA C 147 61.721 61.721 62.285 -0.564 18933 6513 1 9 . 1 1 147 147 THR CB C 147 70.274 70.274 69.247 1.027 18933 6514 1 9 . 1 1 147 147 THR H H 147 8.029 8.029 7.869 0.160 18933 6515 1 9 . 1 1 148 148 LEU N N 148 130.681 130.681 131.309 -0.628 18933 6516 1 9 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.654 -0.188 18933 6517 1 9 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.871 -1.182 18933 6518 1 9 . 1 1 148 148 LEU H H 148 8.635 8.635 8.905 -0.270 18933 6519 1 9 . 1 1 149 149 VAL N N 149 130.803 130.803 127.688 3.115 18933 6520 1 9 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.479 0.699 18933 6521 1 9 . 1 1 149 149 VAL CB C 149 31.675 31.675 35.349 -3.674 18933 6522 1 9 . 1 1 149 149 VAL H H 149 8.968 8.968 9.333 -0.365 18933 6523 1 9 . 1 1 151 151 LEU N N 151 124.290 124.290 121.003 3.287 18933 6524 1 9 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.703 -2.690 18933 6525 1 9 . 1 1 151 151 LEU CB C 151 44.098 44.098 40.763 3.336 18933 6526 1 9 . 1 1 151 151 LEU H H 151 7.872 7.872 8.193 -0.321 18933 6527 1 9 . 1 1 153 153 ILE N N 153 114.943 114.943 113.288 1.655 18933 6528 1 9 . 1 1 153 153 ILE C C 153 175.877 175.877 175.163 0.714 18933 6529 1 9 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.870 -0.176 18933 6530 1 9 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.612 1.077 18933 6531 1 9 . 1 1 153 153 ILE H H 153 7.125 7.125 7.715 -0.590 18933 6532 1 9 . 1 1 154 154 THR N N 154 111.766 111.766 109.556 2.210 18933 6533 1 9 . 1 1 154 154 THR C C 154 174.945 174.945 174.367 0.578 18933 6534 1 9 . 1 1 154 154 THR CA C 154 62.124 62.124 62.195 -0.071 18933 6535 1 9 . 1 1 154 154 THR CB C 154 70.718 70.718 69.733 0.985 18933 6536 1 9 . 1 1 154 154 THR H H 154 9.286 9.286 8.184 1.102 18933 6537 1 9 . 1 1 155 155 THR N N 155 111.766 111.766 112.832 -1.066 18933 6538 1 9 . 1 1 155 155 THR CA C 155 58.936 58.936 59.595 -0.659 18933 6539 1 9 . 1 1 155 155 THR CB C 155 72.683 72.683 72.383 0.299 18933 6540 1 9 . 1 1 155 155 THR H H 155 7.645 7.645 7.400 0.245 18933 6541 1 9 . 1 1 157 157 LYS N N 157 119.464 119.464 118.804 0.660 18933 6542 1 9 . 1 1 157 157 LYS C C 157 178.781 178.781 178.589 0.192 18933 6543 1 9 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.815 0.211 18933 6544 1 9 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.953 -0.530 18933 6545 1 9 . 1 1 157 157 LYS H H 157 8.175 8.175 8.261 -0.086 18933 6546 1 9 . 1 1 158 158 GLU N N 158 118.340 118.340 118.374 -0.034 18933 6547 1 9 . 1 1 158 158 GLU C C 158 178.867 178.867 179.196 -0.329 18933 6548 1 9 . 1 1 158 158 GLU CA C 158 58.492 58.492 58.777 -0.285 18933 6549 1 9 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.535 0.795 18933 6550 1 9 . 1 1 158 158 GLU H H 158 7.519 7.519 8.139 -0.620 18933 6551 1 9 . 1 1 159 159 LEU N N 159 120.710 120.710 122.071 -1.361 18933 6552 1 9 . 1 1 159 159 LEU C C 159 176.526 176.526 178.244 -1.718 18933 6553 1 9 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.173 -0.004 18933 6554 1 9 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.706 -1.791 18933 6555 1 9 . 1 1 159 159 LEU H H 159 7.524 7.524 7.981 -0.457 18933 6556 1 9 . 1 1 160 160 ILE N N 160 118.217 118.217 118.210 0.007 18933 6557 1 9 . 1 1 160 160 ILE C C 160 177.213 177.213 178.132 -0.919 18933 6558 1 9 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.463 -0.433 18933 6559 1 9 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.369 0.137 18933 6560 1 9 . 1 1 160 160 ILE H H 160 7.741 7.741 7.982 -0.241 18933 6561 1 9 . 1 1 161 161 LYS N N 161 118.450 118.450 119.949 -1.499 18933 6562 1 9 . 1 1 161 161 LYS C C 161 180.999 180.999 179.793 1.206 18933 6563 1 9 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.379 -0.564 18933 6564 1 9 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.167 -1.189 18933 6565 1 9 . 1 1 161 161 LYS H H 161 7.382 7.382 8.006 -0.624 18933 6566 1 9 . 1 1 162 162 GLU N N 162 121.846 121.846 120.767 1.079 18933 6567 1 9 . 1 1 162 162 GLU C C 162 178.818 178.818 178.456 0.362 18933 6568 1 9 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.802 -0.753 18933 6569 1 9 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.508 -1.571 18933 6570 1 9 . 1 1 162 162 GLU H H 162 8.210 8.210 7.901 0.309 18933 6571 1 9 . 1 1 163 163 LEU N N 163 116.751 116.751 112.915 3.836 18933 6572 1 9 . 1 1 163 163 LEU C C 163 176.784 176.784 177.317 -0.533 18933 6573 1 9 . 1 1 163 163 LEU CA C 163 55.022 55.022 54.476 0.546 18933 6574 1 9 . 1 1 163 163 LEU CB C 163 41.309 41.309 40.931 0.378 18933 6575 1 9 . 1 1 163 163 LEU H H 163 7.796 7.796 7.320 0.476 18933 6576 1 9 . 1 1 164 164 GLY N N 164 104.849 104.849 106.384 -1.535 18933 6577 1 9 . 1 1 164 164 GLY C C 164 174.492 174.492 173.672 0.820 18933 6578 1 9 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.646 -0.914 18933 6579 1 9 . 1 1 164 164 GLY H H 164 7.589 7.589 7.634 -0.045 18933 6580 1 9 . 1 1 165 165 PHE N N 165 118.902 118.902 118.647 0.255 18933 6581 1 9 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.531 -0.863 18933 6582 1 9 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.702 -2.217 18933 6583 1 9 . 1 1 165 165 PHE H H 165 7.251 7.251 7.823 -0.572 18933 6584 1 9 . 1 1 166 166 THR N N 166 117.093 117.093 116.582 0.511 18933 6585 1 9 . 1 1 166 166 THR CA C 166 62.245 62.245 60.531 1.714 18933 6586 1 9 . 1 1 166 166 THR CB C 166 69.323 69.323 69.528 -0.205 18933 6587 1 9 . 1 1 166 166 THR H H 166 8.407 8.407 8.378 0.029 18933 6588 1 9 . 1 1 168 168 ARG N N 168 127.431 127.431 121.719 5.712 18933 6589 1 9 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.023 -1.785 18933 6590 1 9 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.414 -1.422 18933 6591 1 9 . 1 1 168 168 ARG H H 168 7.160 7.160 8.197 -1.037 18933 6592 1 9 . 1 1 171 171 LYS N N 171 113.574 113.574 117.726 -4.152 18933 6593 1 9 . 1 1 171 171 LYS C C 171 176.416 176.416 177.684 -1.268 18933 6594 1 9 . 1 1 171 171 LYS CA C 171 57.605 57.605 58.273 -0.668 18933 6595 1 9 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.359 0.570 18933 6596 1 9 . 1 1 171 171 LYS H H 171 8.210 8.210 8.330 -0.120 18933 6597 1 9 . 1 1 172 172 LYS N N 172 117.313 117.313 116.922 0.391 18933 6598 1 9 . 1 1 172 172 LYS C C 172 175.717 175.717 176.297 -0.580 18933 6599 1 9 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.933 -2.758 18933 6600 1 9 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.801 -1.189 18933 6601 1 9 . 1 1 172 172 LYS H H 172 7.761 7.761 7.561 0.200 18933 6602 1 9 . 1 1 173 173 ARG N N 173 122.056 122.056 117.037 5.019 18933 6603 1 9 . 1 1 173 173 ARG C C 173 172.850 172.850 174.416 -1.566 18933 6604 1 9 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.805 0.073 18933 6605 1 9 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.223 0.283 18933 6606 1 9 . 1 1 173 173 ARG H H 173 6.885 6.885 7.585 -0.700 18933 6607 1 10 . 1 1 2 2 LEU N N 2 122.812 122.812 122.838 -0.026 18933 6608 1 10 . 1 1 2 2 LEU C C 2 175.742 175.742 176.642 -0.900 18933 6609 1 10 . 1 1 2 2 LEU CA C 2 54.134 54.134 52.935 1.199 18933 6610 1 10 . 1 1 2 2 LEU CB C 2 42.842 42.842 44.820 -1.978 18933 6611 1 10 . 1 1 2 2 LEU H H 2 8.756 8.756 8.996 -0.240 18933 6612 1 10 . 1 1 3 3 THR N N 3 113.000 113.000 115.051 -2.051 18933 6613 1 10 . 1 1 3 3 THR C C 3 175.938 175.938 175.281 0.657 18933 6614 1 10 . 1 1 3 3 THR CA C 3 60.550 60.550 60.831 -0.281 18933 6615 1 10 . 1 1 3 3 THR CB C 3 70.781 70.781 70.313 0.468 18933 6616 1 10 . 1 1 3 3 THR H H 3 8.428 8.428 8.151 0.277 18933 6617 1 10 . 1 1 4 4 LEU N N 4 122.531 122.531 124.050 -1.519 18933 6618 1 10 . 1 1 4 4 LEU C C 4 178.463 178.463 178.503 -0.040 18933 6619 1 10 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.695 -0.566 18933 6620 1 10 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.030 -2.496 18933 6621 1 10 . 1 1 4 4 LEU H H 4 7.731 7.731 7.907 -0.176 18933 6622 1 10 . 1 1 5 5 ILE N N 5 115.505 115.505 117.607 -2.102 18933 6623 1 10 . 1 1 5 5 ILE C C 5 178.573 178.573 177.864 0.709 18933 6624 1 10 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.322 -0.584 18933 6625 1 10 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.344 -0.472 18933 6626 1 10 . 1 1 5 5 ILE H H 5 7.645 7.645 7.977 -0.332 18933 6627 1 10 . 1 1 6 6 GLN N N 6 121.626 121.626 119.474 2.152 18933 6628 1 10 . 1 1 6 6 GLN C C 6 179.014 179.014 178.753 0.261 18933 6629 1 10 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.048 -0.717 18933 6630 1 10 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.545 0.644 18933 6631 1 10 . 1 1 6 6 GLN H H 6 7.645 7.645 8.023 -0.378 18933 6632 1 10 . 1 1 7 7 GLY N N 7 107.684 107.684 106.761 0.923 18933 6633 1 10 . 1 1 7 7 GLY C C 7 174.749 174.749 176.130 -1.381 18933 6634 1 10 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.684 0.106 18933 6635 1 10 . 1 1 7 7 GLY H H 7 8.660 8.660 8.114 0.546 18933 6636 1 10 . 1 1 8 8 LYS N N 8 120.942 120.942 122.473 -1.531 18933 6637 1 10 . 1 1 8 8 LYS C C 8 179.455 179.455 178.668 0.787 18933 6638 1 10 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.211 0.694 18933 6639 1 10 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.244 -0.822 18933 6640 1 10 . 1 1 8 8 LYS H H 8 8.518 8.518 7.529 0.989 18933 6641 1 10 . 1 1 9 9 LYS N N 9 120.710 120.710 119.769 0.941 18933 6642 1 10 . 1 1 9 9 LYS C C 9 179.823 179.823 179.355 0.468 18933 6643 1 10 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.514 0.108 18933 6644 1 10 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.525 -1.230 18933 6645 1 10 . 1 1 9 9 LYS H H 9 7.731 7.731 8.182 -0.451 18933 6646 1 10 . 1 1 10 10 ILE N N 10 121.345 121.345 121.208 0.137 18933 6647 1 10 . 1 1 10 10 ILE C C 10 177.789 177.789 178.196 -0.407 18933 6648 1 10 . 1 1 10 10 ILE CA C 10 64.465 64.465 66.058 -1.593 18933 6649 1 10 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.277 -1.912 18933 6650 1 10 . 1 1 10 10 ILE H H 10 7.711 7.711 8.379 -0.668 18933 6651 1 10 . 1 1 11 11 VAL N N 11 120.258 120.258 120.019 0.239 18933 6652 1 10 . 1 1 11 11 VAL C C 11 177.372 177.372 177.616 -0.244 18933 6653 1 10 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.441 0.010 18933 6654 1 10 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.683 -1.149 18933 6655 1 10 . 1 1 11 11 VAL H H 11 7.918 7.918 8.501 -0.583 18933 6656 1 10 . 1 1 12 12 ASN N N 12 116.971 116.971 117.570 -0.599 18933 6657 1 10 . 1 1 12 12 ASN C C 12 177.445 177.445 177.364 0.081 18933 6658 1 10 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.436 -0.324 18933 6659 1 10 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.508 -0.875 18933 6660 1 10 . 1 1 12 12 ASN H H 12 7.993 7.993 8.615 -0.622 18933 6661 1 10 . 1 1 13 13 HIS N N 13 120.258 120.258 119.672 0.586 18933 6662 1 10 . 1 1 13 13 HIS C C 13 177.862 177.862 178.254 -0.392 18933 6663 1 10 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.304 -0.206 18933 6664 1 10 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.364 0.868 18933 6665 1 10 . 1 1 13 13 HIS H H 13 7.741 7.741 8.266 -0.525 18933 6666 1 10 . 1 1 14 14 LEU N N 14 116.641 116.641 120.300 -3.659 18933 6667 1 10 . 1 1 14 14 LEU C C 14 179.186 179.186 178.121 1.065 18933 6668 1 10 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.287 -1.530 18933 6669 1 10 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.656 -0.537 18933 6670 1 10 . 1 1 14 14 LEU H H 14 8.221 8.221 8.520 -0.299 18933 6671 1 10 . 1 1 15 15 ARG N N 15 115.957 115.957 114.572 1.385 18933 6672 1 10 . 1 1 15 15 ARG C C 15 176.330 176.330 178.233 -1.903 18933 6673 1 10 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.515 1.188 18933 6674 1 10 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.357 -1.280 18933 6675 1 10 . 1 1 15 15 ARG H H 15 7.968 7.968 8.350 -0.382 18933 6676 1 10 . 1 1 16 16 SER N N 16 109.395 109.395 115.760 -6.365 18933 6677 1 10 . 1 1 16 16 SER C C 16 176.024 176.024 175.093 0.931 18933 6678 1 10 . 1 1 16 16 SER CA C 16 57.282 57.282 60.252 -2.970 18933 6679 1 10 . 1 1 16 16 SER CB C 16 63.683 63.683 63.691 -0.008 18933 6680 1 10 . 1 1 16 16 SER H H 16 6.963 6.963 7.459 -0.496 18933 6681 1 10 . 1 1 17 17 ARG N N 17 122.775 122.775 121.867 0.908 18933 6682 1 10 . 1 1 17 17 ARG C C 17 174.590 174.590 174.095 0.495 18933 6683 1 10 . 1 1 17 17 ARG CA C 17 56.273 56.273 55.066 1.207 18933 6684 1 10 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.473 1.329 18933 6685 1 10 . 1 1 17 17 ARG H H 17 7.781 7.781 8.351 -0.570 18933 6686 1 10 . 1 1 18 18 LEU N N 18 122.421 122.421 125.726 -3.305 18933 6687 1 10 . 1 1 18 18 LEU C C 18 176.281 176.281 174.156 2.125 18933 6688 1 10 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.163 0.617 18933 6689 1 10 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.507 -3.296 18933 6690 1 10 . 1 1 18 18 LEU H H 18 8.650 8.650 7.777 0.873 18933 6691 1 10 . 1 1 19 19 ALA N N 19 126.441 126.441 127.231 -0.790 18933 6692 1 10 . 1 1 19 19 ALA C C 19 173.904 173.904 174.892 -0.988 18933 6693 1 10 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.618 -0.752 18933 6694 1 10 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.474 0.390 18933 6695 1 10 . 1 1 19 19 ALA H H 19 8.609 8.609 9.002 -0.393 18933 6696 1 10 . 1 1 20 20 PHE N N 20 114.600 114.600 118.911 -4.311 18933 6697 1 10 . 1 1 20 20 PHE C C 20 172.592 172.592 173.782 -1.190 18933 6698 1 10 . 1 1 20 20 PHE CA C 20 55.789 55.789 55.146 0.643 18933 6699 1 10 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.768 -1.079 18933 6700 1 10 . 1 1 20 20 PHE H H 20 8.801 8.801 9.074 -0.273 18933 6701 1 10 . 1 1 21 21 GLU N N 21 122.873 122.873 122.651 0.222 18933 6702 1 10 . 1 1 21 21 GLU C C 21 174.872 174.872 175.217 -0.345 18933 6703 1 10 . 1 1 21 21 GLU CA C 21 55.062 55.062 54.970 0.092 18933 6704 1 10 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.325 -0.600 18933 6705 1 10 . 1 1 21 21 GLU H H 21 7.847 7.847 9.180 -1.333 18933 6706 1 10 . 1 1 22 22 TYR N N 22 126.270 126.270 126.444 -0.174 18933 6707 1 10 . 1 1 22 22 TYR C C 22 174.872 174.872 174.748 0.124 18933 6708 1 10 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.618 -0.870 18933 6709 1 10 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.203 -1.098 18933 6710 1 10 . 1 1 22 22 TYR H H 22 8.806 8.806 9.179 -0.373 18933 6711 1 10 . 1 1 23 23 ASN N N 23 128.420 128.420 125.702 2.718 18933 6712 1 10 . 1 1 23 23 ASN C C 23 175.435 175.435 175.109 0.326 18933 6713 1 10 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.581 -0.577 18933 6714 1 10 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.811 -1.446 18933 6715 1 10 . 1 1 23 23 ASN H H 23 8.943 8.943 9.164 -0.221 18933 6716 1 10 . 1 1 24 24 GLY N N 24 104.067 104.067 102.084 1.983 18933 6717 1 10 . 1 1 24 24 GLY C C 24 173.707 173.707 173.892 -0.185 18933 6718 1 10 . 1 1 24 24 GLY CA C 24 44.934 44.934 45.003 -0.069 18933 6719 1 10 . 1 1 24 24 GLY H H 24 8.534 8.534 8.182 0.352 18933 6720 1 10 . 1 1 25 25 GLN N N 25 120.038 120.038 119.840 0.198 18933 6721 1 10 . 1 1 25 25 GLN C C 25 173.744 173.744 174.906 -1.162 18933 6722 1 10 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.483 -1.156 18933 6723 1 10 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.302 0.359 18933 6724 1 10 . 1 1 25 25 GLN H H 25 7.595 7.595 7.829 -0.234 18933 6725 1 10 . 1 1 26 26 LEU N N 26 124.681 124.681 125.047 -0.366 18933 6726 1 10 . 1 1 26 26 LEU C C 26 175.987 175.987 176.312 -0.325 18933 6727 1 10 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.605 -0.591 18933 6728 1 10 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.356 -1.491 18933 6729 1 10 . 1 1 26 26 LEU H H 26 8.382 8.382 8.601 -0.219 18933 6730 1 10 . 1 1 27 27 ILE N N 27 130.779 130.779 127.341 3.438 18933 6731 1 10 . 1 1 27 27 ILE C C 27 175.215 175.215 174.356 0.859 18933 6732 1 10 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.741 -0.482 18933 6733 1 10 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.141 -2.409 18933 6734 1 10 . 1 1 27 27 ILE H H 27 8.882 8.882 8.974 -0.092 18933 6735 1 10 . 1 1 28 28 LYS N N 28 126.160 126.160 127.590 -1.430 18933 6736 1 10 . 1 1 28 28 LYS C C 28 176.771 176.771 175.660 1.111 18933 6737 1 10 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.846 1.992 18933 6738 1 10 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.131 -1.392 18933 6739 1 10 . 1 1 28 28 LYS H H 28 8.165 8.165 8.352 -0.187 18933 6740 1 10 . 1 1 29 29 ILE N N 29 126.380 126.380 122.092 4.288 18933 6741 1 10 . 1 1 29 29 ILE C C 29 175.877 175.877 174.364 1.513 18933 6742 1 10 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.518 -0.210 18933 6743 1 10 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.584 -2.521 18933 6744 1 10 . 1 1 29 29 ILE H H 29 8.019 8.019 8.706 -0.687 18933 6745 1 10 . 1 1 30 30 LEU N N 30 129.215 129.215 122.279 6.936 18933 6746 1 10 . 1 1 30 30 LEU C C 30 178.867 178.867 178.109 0.758 18933 6747 1 10 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.389 1.230 18933 6748 1 10 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.642 -4.777 18933 6749 1 10 . 1 1 30 30 LEU H H 30 8.917 8.917 8.293 0.624 18933 6750 1 10 . 1 1 31 31 SER N N 31 117.997 117.997 116.319 1.678 18933 6751 1 10 . 1 1 31 31 SER C C 31 177.396 177.396 175.736 1.660 18933 6752 1 10 . 1 1 31 31 SER CA C 31 61.236 61.236 61.079 0.157 18933 6753 1 10 . 1 1 31 31 SER CB C 31 62.035 62.035 63.241 -1.206 18933 6754 1 10 . 1 1 31 31 SER H H 31 8.594 8.594 8.847 -0.253 18933 6755 1 10 . 1 1 32 32 LYS N N 32 116.189 116.189 118.654 -2.465 18933 6756 1 10 . 1 1 32 32 LYS C C 32 176.244 176.244 177.054 -0.810 18933 6757 1 10 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.233 -0.830 18933 6758 1 10 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.254 -1.973 18933 6759 1 10 . 1 1 32 32 LYS H H 32 8.029 8.029 8.293 -0.264 18933 6760 1 10 . 1 1 33 33 ASN N N 33 119.061 119.061 115.194 3.867 18933 6761 1 10 . 1 1 33 33 ASN C C 33 172.384 172.384 174.322 -1.938 18933 6762 1 10 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.348 -1.191 18933 6763 1 10 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.399 -3.132 18933 6764 1 10 . 1 1 33 33 ASN H H 33 7.902 7.902 7.813 0.089 18933 6765 1 10 . 1 1 34 34 ILE N N 34 120.038 120.038 119.985 0.053 18933 6766 1 10 . 1 1 34 34 ILE C C 34 175.607 175.607 174.112 1.495 18933 6767 1 10 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.543 0.007 18933 6768 1 10 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.585 -2.621 18933 6769 1 10 . 1 1 34 34 ILE H H 34 7.443 7.443 7.880 -0.437 18933 6770 1 10 . 1 1 35 35 VAL N N 35 129.435 129.435 126.265 3.170 18933 6771 1 10 . 1 1 35 35 VAL C C 35 175.386 175.386 174.529 0.857 18933 6772 1 10 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.228 -0.202 18933 6773 1 10 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.775 -0.994 18933 6774 1 10 . 1 1 35 35 VAL H H 35 9.533 9.533 8.799 0.734 18933 6775 1 10 . 1 1 36 36 ALA N N 36 130.571 130.571 128.731 1.840 18933 6776 1 10 . 1 1 36 36 ALA C C 36 177.347 177.347 176.309 1.038 18933 6777 1 10 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.936 0.463 18933 6778 1 10 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.721 -0.863 18933 6779 1 10 . 1 1 36 36 ALA H H 36 8.665 8.665 8.371 0.294 18933 6780 1 10 . 1 1 37 37 VAL N N 37 115.395 115.395 120.191 -4.796 18933 6781 1 10 . 1 1 37 37 VAL C C 37 174.455 174.455 175.717 -1.262 18933 6782 1 10 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.253 0.127 18933 6783 1 10 . 1 1 37 37 VAL CB C 37 32.943 32.943 33.945 -1.002 18933 6784 1 10 . 1 1 37 37 VAL H H 37 8.079 8.079 8.330 -0.251 18933 6785 1 10 . 1 1 38 38 GLY N N 38 107.672 107.672 107.796 -0.124 18933 6786 1 10 . 1 1 38 38 GLY C C 38 173.364 173.364 175.788 -2.424 18933 6787 1 10 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.471 -0.286 18933 6788 1 10 . 1 1 38 38 GLY H H 38 7.579 7.579 8.179 -0.600 18933 6789 1 10 . 1 1 39 39 SER N N 39 121.052 121.052 119.654 1.398 18933 6790 1 10 . 1 1 39 39 SER C C 39 175.570 175.570 176.615 -1.045 18933 6791 1 10 . 1 1 39 39 SER CA C 39 61.801 61.801 61.549 0.252 18933 6792 1 10 . 1 1 39 39 SER CB C 39 62.478 62.478 63.410 -0.932 18933 6793 1 10 . 1 1 39 39 SER H H 39 8.953 8.953 8.068 0.885 18933 6794 1 10 . 1 1 40 40 LEU N N 40 121.553 121.553 121.596 -0.043 18933 6795 1 10 . 1 1 40 40 LEU C C 40 180.203 180.203 178.351 1.852 18933 6796 1 10 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.312 -0.183 18933 6797 1 10 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.863 -0.110 18933 6798 1 10 . 1 1 40 40 LEU H H 40 8.195 8.195 7.335 0.860 18933 6799 1 10 . 1 1 41 41 ARG N N 41 121.956 121.956 118.425 3.531 18933 6800 1 10 . 1 1 41 41 ARG C C 41 177.323 177.323 178.251 -0.928 18933 6801 1 10 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.928 0.403 18933 6802 1 10 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.811 -1.368 18933 6803 1 10 . 1 1 41 41 ARG H H 41 6.873 6.873 7.402 -0.529 18933 6804 1 10 . 1 1 42 42 ARG N N 42 114.600 114.600 117.367 -2.767 18933 6805 1 10 . 1 1 42 42 ARG C C 42 172.911 172.911 176.052 -3.141 18933 6806 1 10 . 1 1 42 42 ARG CA C 42 57.242 57.242 57.463 -0.221 18933 6807 1 10 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.685 -1.545 18933 6808 1 10 . 1 1 42 42 ARG H H 42 7.438 7.438 8.163 -0.725 18933 6809 1 10 . 1 1 43 43 GLU N N 43 113.354 113.354 116.896 -3.542 18933 6810 1 10 . 1 1 43 43 GLU C C 43 175.999 175.999 175.564 0.435 18933 6811 1 10 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.189 -0.633 18933 6812 1 10 . 1 1 43 43 GLU CB C 43 25.337 25.337 26.922 -1.585 18933 6813 1 10 . 1 1 43 43 GLU H H 43 7.564 7.564 7.990 -0.426 18933 6814 1 10 . 1 1 44 44 GLU N N 44 119.696 119.696 122.575 -2.879 18933 6815 1 10 . 1 1 44 44 GLU C C 44 175.423 175.423 176.721 -1.298 18933 6816 1 10 . 1 1 44 44 GLU CA C 44 56.838 56.838 57.074 -0.236 18933 6817 1 10 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.083 -1.387 18933 6818 1 10 . 1 1 44 44 GLU H H 44 7.261 7.261 8.606 -1.345 18933 6819 1 10 . 1 1 45 45 LYS N N 45 117.435 117.435 117.985 -0.550 18933 6820 1 10 . 1 1 45 45 LYS C C 45 177.715 177.715 175.750 1.965 18933 6821 1 10 . 1 1 45 45 LYS CA C 45 59.219 59.219 56.581 2.638 18933 6822 1 10 . 1 1 45 45 LYS CB C 45 32.119 32.119 34.240 -2.121 18933 6823 1 10 . 1 1 45 45 LYS H H 45 7.938 7.938 8.272 -0.334 18933 6824 1 10 . 1 1 46 46 MET N N 46 115.847 115.847 118.068 -2.221 18933 6825 1 10 . 1 1 46 46 MET CA C 46 52.520 52.520 53.689 -1.169 18933 6826 1 10 . 1 1 46 46 MET CB C 46 33.450 33.450 34.810 -1.360 18933 6827 1 10 . 1 1 46 46 MET H H 46 7.595 7.595 7.693 -0.098 18933 6828 1 10 . 1 1 47 47 LEU N N 47 121.627 121.627 121.438 0.189 18933 6829 1 10 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.017 -0.891 18933 6830 1 10 . 1 1 47 47 LEU CB C 47 43.070 43.070 45.083 -2.013 18933 6831 1 10 . 1 1 47 47 LEU H H 47 9.220 9.220 8.858 0.362 18933 6832 1 10 . 1 1 49 49 ASP N N 49 117.093 117.093 119.083 -1.990 18933 6833 1 10 . 1 1 49 49 ASP C C 49 173.340 173.340 174.667 -1.327 18933 6834 1 10 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.482 -1.688 18933 6835 1 10 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.511 -1.505 18933 6836 1 10 . 1 1 49 49 ASP H H 49 7.761 7.761 7.801 -0.040 18933 6837 1 10 . 1 1 50 50 VAL N N 50 119.012 119.012 118.010 1.002 18933 6838 1 10 . 1 1 50 50 VAL C C 50 173.070 173.070 173.763 -0.693 18933 6839 1 10 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.162 1.680 18933 6840 1 10 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.494 -0.931 18933 6841 1 10 . 1 1 50 50 VAL H H 50 8.089 8.089 8.730 -0.641 18933 6842 1 10 . 1 1 51 51 ASP N N 51 127.064 127.064 125.091 1.973 18933 6843 1 10 . 1 1 51 51 ASP C C 51 174.565 174.565 175.276 -0.711 18933 6844 1 10 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.964 -0.807 18933 6845 1 10 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.338 -0.698 18933 6846 1 10 . 1 1 51 51 ASP H H 51 8.069 8.069 8.066 0.003 18933 6847 1 10 . 1 1 52 52 LEU N N 52 121.627 121.627 119.872 1.755 18933 6848 1 10 . 1 1 52 52 LEU C C 52 174.063 174.063 174.775 -0.712 18933 6849 1 10 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.336 -0.654 18933 6850 1 10 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.281 -2.930 18933 6851 1 10 . 1 1 52 52 LEU H H 52 8.852 8.852 9.021 -0.169 18933 6852 1 10 . 1 1 53 53 LEU N N 53 123.093 123.093 123.266 -0.173 18933 6853 1 10 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.274 1.717 18933 6854 1 10 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.592 -2.458 18933 6855 1 10 . 1 1 53 53 LEU H H 53 9.362 9.362 9.044 0.318 18933 6856 1 10 . 1 1 54 54 ILE N N 54 123.777 123.777 129.283 -5.506 18933 6857 1 10 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.168 -4.106 18933 6858 1 10 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.449 -7.379 18933 6859 1 10 . 1 1 54 54 ILE H H 54 8.907 8.907 9.293 -0.386 18933 6860 1 10 . 1 1 58 58 GLU N N 58 114.710 114.710 118.329 -3.619 18933 6861 1 10 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.629 -1.252 18933 6862 1 10 . 1 1 58 58 GLU CB C 58 31.422 31.422 33.263 -1.841 18933 6863 1 10 . 1 1 58 58 GLU H H 58 6.716 6.716 7.845 -1.129 18933 6864 1 10 . 1 1 61 61 LEU N N 61 115.957 115.957 119.856 -3.899 18933 6865 1 10 . 1 1 61 61 LEU C C 61 178.512 178.512 178.211 0.301 18933 6866 1 10 . 1 1 61 61 LEU CA C 61 54.780 54.780 56.967 -2.187 18933 6867 1 10 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.645 -0.526 18933 6868 1 10 . 1 1 61 61 LEU H H 61 7.307 7.307 7.771 -0.464 18933 6869 1 10 . 1 1 62 62 LEU N N 62 120.038 120.038 119.522 0.516 18933 6870 1 10 . 1 1 62 62 LEU C C 62 177.874 177.874 178.827 -0.953 18933 6871 1 10 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.462 0.474 18933 6872 1 10 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.973 -1.234 18933 6873 1 10 . 1 1 62 62 LEU H H 62 7.327 7.327 8.147 -0.820 18933 6874 1 10 . 1 1 63 63 LYS N N 63 114.600 114.600 115.747 -1.147 18933 6875 1 10 . 1 1 63 63 LYS C C 63 175.460 175.460 177.598 -2.138 18933 6876 1 10 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.864 -1.300 18933 6877 1 10 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.624 -1.899 18933 6878 1 10 . 1 1 63 63 LYS H H 63 7.973 7.973 7.801 0.172 18933 6879 1 10 . 1 1 64 64 HIS N N 64 115.273 115.273 116.018 -0.745 18933 6880 1 10 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.415 0.697 18933 6881 1 10 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.456 1.980 18933 6882 1 10 . 1 1 64 64 HIS H H 64 7.544 7.544 7.625 -0.080 18933 6883 1 10 . 1 1 65 65 VAL N N 65 118.682 118.682 119.203 -0.521 18933 6884 1 10 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.740 3.298 18933 6885 1 10 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.332 -2.305 18933 6886 1 10 . 1 1 65 65 VAL H H 65 6.787 6.787 7.194 -0.407 18933 6887 1 10 . 1 1 68 68 ASN N N 68 112.108 112.108 118.207 -6.099 18933 6888 1 10 . 1 1 68 68 ASN C C 68 174.884 174.884 173.925 0.959 18933 6889 1 10 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.410 -1.383 18933 6890 1 10 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.202 1.030 18933 6891 1 10 . 1 1 68 68 ASN H H 68 7.009 7.009 8.318 -1.309 18933 6892 1 10 . 1 1 69 69 ILE N N 69 123.325 123.325 123.136 0.189 18933 6893 1 10 . 1 1 69 69 ILE C C 69 174.394 174.394 175.424 -1.030 18933 6894 1 10 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.955 -1.848 18933 6895 1 10 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.573 -0.306 18933 6896 1 10 . 1 1 69 69 ILE H H 69 7.150 7.150 8.130 -0.980 18933 6897 1 10 . 1 1 70 70 ARG N N 70 126.722 126.722 128.186 -1.464 18933 6898 1 10 . 1 1 70 70 ARG C C 70 174.590 174.590 174.001 0.589 18933 6899 1 10 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.942 -1.695 18933 6900 1 10 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.860 -2.488 18933 6901 1 10 . 1 1 70 70 ARG H H 70 8.902 8.902 9.097 -0.195 18933 6902 1 10 . 1 1 71 71 ILE N N 71 119.978 119.978 120.978 -1.000 18933 6903 1 10 . 1 1 71 71 ILE C C 71 175.583 175.583 175.498 0.085 18933 6904 1 10 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.881 -0.057 18933 6905 1 10 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.219 -2.459 18933 6906 1 10 . 1 1 71 71 ILE H H 71 7.491 7.491 8.797 -1.306 18933 6907 1 10 . 1 1 72 72 LYS N N 72 128.530 128.530 125.473 3.057 18933 6908 1 10 . 1 1 72 72 LYS C C 72 177.703 177.703 176.112 1.591 18933 6909 1 10 . 1 1 72 72 LYS CA C 72 57.201 57.201 55.061 2.140 18933 6910 1 10 . 1 1 72 72 LYS CB C 72 31.485 31.485 30.860 0.625 18933 6911 1 10 . 1 1 72 72 LYS H H 72 8.523 8.523 8.555 -0.032 18933 6912 1 10 . 1 1 73 73 GLY N N 73 113.806 113.806 110.332 3.474 18933 6913 1 10 . 1 1 73 73 GLY C C 73 173.781 173.781 172.689 1.092 18933 6914 1 10 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.206 0.616 18933 6915 1 10 . 1 1 73 73 GLY H H 73 8.791 8.791 8.351 0.440 18933 6916 1 10 . 1 1 74 74 LEU N N 74 120.490 120.490 118.136 2.354 18933 6917 1 10 . 1 1 74 74 LEU C C 74 175.840 175.840 173.478 2.362 18933 6918 1 10 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.404 -0.713 18933 6919 1 10 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.076 -0.915 18933 6920 1 10 . 1 1 74 74 LEU H H 74 7.393 7.393 7.287 0.106 18933 6921 1 10 . 1 1 75 75 SER N N 75 120.038 120.038 115.918 4.120 18933 6922 1 10 . 1 1 75 75 SER C C 75 173.205 173.205 173.126 0.079 18933 6923 1 10 . 1 1 75 75 SER CA C 75 57.887 57.887 57.565 0.322 18933 6924 1 10 . 1 1 75 75 SER CB C 75 63.049 63.049 64.751 -1.702 18933 6925 1 10 . 1 1 75 75 SER H H 75 8.917 8.917 8.154 0.763 18933 6926 1 10 . 1 1 76 76 PHE N N 76 119.586 119.586 118.060 1.526 18933 6927 1 10 . 1 1 76 76 PHE C C 76 173.536 173.536 173.710 -0.174 18933 6928 1 10 . 1 1 76 76 PHE CA C 76 55.426 55.426 56.423 -0.997 18933 6929 1 10 . 1 1 76 76 PHE CB C 76 42.006 42.006 41.938 0.068 18933 6930 1 10 . 1 1 76 76 PHE H H 76 8.003 8.003 8.453 -0.450 18933 6931 1 10 . 1 1 77 77 SER N N 77 114.943 114.943 115.732 -0.789 18933 6932 1 10 . 1 1 77 77 SER C C 77 173.438 173.438 172.423 1.015 18933 6933 1 10 . 1 1 77 77 SER CA C 77 56.152 56.152 56.659 -0.507 18933 6934 1 10 . 1 1 77 77 SER CB C 77 65.204 65.204 65.855 -0.651 18933 6935 1 10 . 1 1 77 77 SER H H 77 8.907 8.907 8.725 0.182 18933 6936 1 10 . 1 1 78 78 VAL N N 78 124.791 124.791 124.195 0.596 18933 6937 1 10 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.667 1.377 18933 6938 1 10 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.200 -2.018 18933 6939 1 10 . 1 1 78 78 VAL H H 78 8.892 8.892 8.266 0.626 18933 6940 1 10 . 1 1 79 79 LYS N N 79 129.667 129.667 129.919 -0.252 18933 6941 1 10 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.469 1.723 18933 6942 1 10 . 1 1 79 79 LYS CB C 79 32.372 32.372 34.392 -2.020 18933 6943 1 10 . 1 1 79 79 LYS H H 79 9.049 9.049 8.535 0.514 18933 6944 1 10 . 1 1 82 82 GLY N N 82 117.263 117.263 113.891 3.372 18933 6945 1 10 . 1 1 82 82 GLY C C 82 171.710 171.710 174.278 -2.568 18933 6946 1 10 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.141 -2.216 18933 6947 1 10 . 1 1 82 82 GLY H H 82 8.044 8.044 8.452 -0.408 18933 6948 1 10 . 1 1 83 83 GLU N N 83 117.203 117.203 121.472 -4.269 18933 6949 1 10 . 1 1 83 83 GLU C C 83 178.695 178.695 177.840 0.855 18933 6950 1 10 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.055 1.922 18933 6951 1 10 . 1 1 83 83 GLU CB C 83 29.837 29.837 30.274 -0.437 18933 6952 1 10 . 1 1 83 83 GLU H H 83 8.296 8.296 8.475 -0.179 18933 6953 1 10 . 1 1 84 84 ARG N N 84 113.818 113.818 118.564 -4.746 18933 6954 1 10 . 1 1 84 84 ARG C C 84 175.877 175.877 175.009 0.868 18933 6955 1 10 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.088 -1.357 18933 6956 1 10 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.187 2.108 18933 6957 1 10 . 1 1 84 84 ARG H H 84 8.342 8.342 7.926 0.416 18933 6958 1 10 . 1 1 85 85 LYS N N 85 119.354 119.354 121.478 -2.124 18933 6959 1 10 . 1 1 85 85 LYS C C 85 174.516 174.516 174.126 0.390 18933 6960 1 10 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.582 -0.842 18933 6961 1 10 . 1 1 85 85 LYS CB C 85 34.844 34.844 34.839 0.005 18933 6962 1 10 . 1 1 85 85 LYS H H 85 6.822 6.822 7.637 -0.815 18933 6963 1 10 . 1 1 86 86 CYS N N 86 125.928 125.928 124.528 1.400 18933 6964 1 10 . 1 1 86 86 CYS C C 86 171.600 171.600 173.067 -1.467 18933 6965 1 10 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.979 -2.352 18933 6966 1 10 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.644 -0.300 18933 6967 1 10 . 1 1 86 86 CYS H H 86 9.084 9.084 9.296 -0.212 18933 6968 1 10 . 1 1 87 87 VAL N N 87 126.612 126.612 126.087 0.525 18933 6969 1 10 . 1 1 87 87 VAL C C 87 174.431 174.431 174.744 -0.313 18933 6970 1 10 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.872 -0.555 18933 6971 1 10 . 1 1 87 87 VAL CB C 87 33.196 33.196 31.702 1.494 18933 6972 1 10 . 1 1 87 87 VAL H H 87 8.705 8.705 9.035 -0.330 18933 6973 1 10 . 1 1 88 88 LEU N N 88 127.748 127.748 124.215 3.533 18933 6974 1 10 . 1 1 88 88 LEU C C 88 175.227 175.227 174.510 0.717 18933 6975 1 10 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.759 -0.239 18933 6976 1 10 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.022 -1.417 18933 6977 1 10 . 1 1 88 88 LEU H H 88 9.417 9.417 8.665 0.752 18933 6978 1 10 . 1 1 89 89 PHE N N 89 120.981 120.981 118.821 2.160 18933 6979 1 10 . 1 1 89 89 PHE C C 89 176.906 176.906 175.933 0.973 18933 6980 1 10 . 1 1 89 89 PHE CA C 89 55.587 55.587 56.012 -0.425 18933 6981 1 10 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.791 -2.890 18933 6982 1 10 . 1 1 89 89 PHE H H 89 8.937 8.937 8.579 0.358 18933 6983 1 10 . 1 1 90 90 ILE N N 90 119.928 119.928 117.661 2.267 18933 6984 1 10 . 1 1 90 90 ILE C C 90 173.781 173.781 174.949 -1.168 18933 6985 1 10 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.723 -1.069 18933 6986 1 10 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.908 0.704 18933 6987 1 10 . 1 1 90 90 ILE H H 90 9.230 9.230 9.056 0.174 18933 6988 1 10 . 1 1 91 91 GLU N N 91 124.339 124.339 124.478 -0.139 18933 6989 1 10 . 1 1 91 91 GLU C C 91 175.607 175.607 175.346 0.261 18933 6990 1 10 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.605 0.014 18933 6991 1 10 . 1 1 91 91 GLU CB C 91 29.837 29.837 33.365 -3.528 18933 6992 1 10 . 1 1 91 91 GLU H H 91 8.175 8.175 8.967 -0.792 18933 6993 1 10 . 1 1 92 92 TRP N N 92 127.516 127.516 124.356 3.160 18933 6994 1 10 . 1 1 92 92 TRP C C 92 175.203 175.203 176.216 -1.013 18933 6995 1 10 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.534 1.699 18933 6996 1 10 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.609 1.052 18933 6997 1 10 . 1 1 92 92 TRP H H 92 9.306 9.306 9.143 0.163 18933 6998 1 10 . 1 1 93 93 GLU N N 93 127.834 127.834 125.797 2.037 18933 6999 1 10 . 1 1 93 93 GLU C C 93 175.668 175.668 175.960 -0.292 18933 7000 1 10 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.312 -0.434 18933 7001 1 10 . 1 1 93 93 GLU CB C 93 26.034 26.034 28.442 -2.408 18933 7002 1 10 . 1 1 93 93 GLU H H 93 8.796 8.796 9.135 -0.339 18933 7003 1 10 . 1 1 94 94 LYS N N 94 108.931 108.931 112.552 -3.621 18933 7004 1 10 . 1 1 94 94 LYS C C 94 175.423 175.423 176.412 -0.989 18933 7005 1 10 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.526 -0.083 18933 7006 1 10 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.046 -2.413 18933 7007 1 10 . 1 1 94 94 LYS H H 94 8.498 8.498 8.550 -0.052 18933 7008 1 10 . 1 1 95 95 LYS N N 95 121.737 121.737 120.910 0.827 18933 7009 1 10 . 1 1 95 95 LYS C C 95 174.443 174.443 175.023 -0.580 18933 7010 1 10 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.376 -1.959 18933 7011 1 10 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.121 0.343 18933 7012 1 10 . 1 1 95 95 LYS H H 95 7.761 7.761 7.550 0.211 18933 7013 1 10 . 1 1 96 96 THR N N 96 116.067 116.067 117.795 -1.728 18933 7014 1 10 . 1 1 96 96 THR C C 96 174.296 174.296 173.701 0.595 18933 7015 1 10 . 1 1 96 96 THR CA C 96 61.115 61.115 60.844 0.271 18933 7016 1 10 . 1 1 96 96 THR CB C 96 69.450 69.450 71.341 -1.891 18933 7017 1 10 . 1 1 96 96 THR H H 96 7.761 7.761 8.149 -0.388 18933 7018 1 10 . 1 1 97 97 TYR N N 97 124.229 124.229 123.436 0.793 18933 7019 1 10 . 1 1 97 97 TYR C C 97 173.536 173.536 174.489 -0.953 18933 7020 1 10 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.542 -0.592 18933 7021 1 10 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.099 -0.916 18933 7022 1 10 . 1 1 97 97 TYR H H 97 9.018 9.018 9.285 -0.267 18933 7023 1 10 . 1 1 98 98 GLN N N 98 123.435 123.435 121.415 2.020 18933 7024 1 10 . 1 1 98 98 GLN C C 98 173.266 173.266 174.547 -1.281 18933 7025 1 10 . 1 1 98 98 GLN CA C 98 55.143 55.143 56.116 -0.973 18933 7026 1 10 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.536 -0.523 18933 7027 1 10 . 1 1 98 98 GLN H H 98 8.781 8.781 9.418 -0.637 18933 7028 1 10 . 1 1 99 99 LEU N N 99 130.119 130.119 127.351 2.768 18933 7029 1 10 . 1 1 99 99 LEU C C 99 173.867 173.867 174.354 -0.487 18933 7030 1 10 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.509 -0.989 18933 7031 1 10 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.960 -1.355 18933 7032 1 10 . 1 1 99 99 LEU H H 99 9.104 9.104 8.970 0.134 18933 7033 1 10 . 1 1 100 100 ASP N N 100 125.182 125.182 127.558 -2.376 18933 7034 1 10 . 1 1 100 100 ASP C C 100 172.837 172.837 174.466 -1.629 18933 7035 1 10 . 1 1 100 100 ASP CA C 100 51.754 51.754 54.556 -2.802 18933 7036 1 10 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.098 -3.754 18933 7037 1 10 . 1 1 100 100 ASP H H 100 9.089 9.089 8.766 0.323 18933 7038 1 10 . 1 1 101 101 LEU N N 101 121.174 121.174 127.583 -6.409 18933 7039 1 10 . 1 1 101 101 LEU C C 101 174.529 174.529 174.674 -0.145 18933 7040 1 10 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.959 -2.044 18933 7041 1 10 . 1 1 101 101 LEU CB C 101 43.908 43.908 44.975 -1.067 18933 7042 1 10 . 1 1 101 101 LEU H H 101 8.458 8.458 9.133 -0.675 18933 7043 1 10 . 1 1 102 102 PHE N N 102 119.464 119.464 126.834 -7.370 18933 7044 1 10 . 1 1 102 102 PHE C C 102 176.293 176.293 175.068 1.225 18933 7045 1 10 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.488 -1.434 18933 7046 1 10 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.204 -0.324 18933 7047 1 10 . 1 1 102 102 PHE H H 102 8.281 8.281 9.303 -1.022 18933 7048 1 10 . 1 1 103 103 THR N N 103 108.576 108.576 117.758 -9.182 18933 7049 1 10 . 1 1 103 103 THR C C 103 174.933 174.933 173.524 1.409 18933 7050 1 10 . 1 1 103 103 THR CA C 103 57.726 57.726 60.143 -2.417 18933 7051 1 10 . 1 1 103 103 THR CB C 103 71.288 71.288 69.325 1.963 18933 7052 1 10 . 1 1 103 103 THR H H 103 7.872 7.872 8.337 -0.465 18933 7053 1 10 . 1 1 104 104 ALA N N 104 122.885 122.885 128.794 -5.909 18933 7054 1 10 . 1 1 104 104 ALA C C 104 175.754 175.754 174.609 1.145 18933 7055 1 10 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.905 0.113 18933 7056 1 10 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.570 -0.085 18933 7057 1 10 . 1 1 104 104 ALA H H 104 8.660 8.660 9.185 -0.525 18933 7058 1 10 . 1 1 105 105 LEU N N 105 120.881 120.881 119.595 1.286 18933 7059 1 10 . 1 1 105 105 LEU C C 105 179.504 179.504 179.005 0.499 18933 7060 1 10 . 1 1 105 105 LEU CA C 105 53.247 53.247 53.682 -0.435 18933 7061 1 10 . 1 1 105 105 LEU CB C 105 41.753 41.753 44.174 -2.421 18933 7062 1 10 . 1 1 105 105 LEU H H 105 8.226 8.226 8.103 0.123 18933 7063 1 10 . 1 1 106 106 ALA N N 106 124.901 124.901 125.074 -0.173 18933 7064 1 10 . 1 1 106 106 ALA C C 106 181.269 181.269 178.976 2.293 18933 7065 1 10 . 1 1 106 106 ALA CA C 106 56.313 56.313 55.111 1.202 18933 7066 1 10 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.520 -1.296 18933 7067 1 10 . 1 1 106 106 ALA H H 106 8.392 8.392 8.641 -0.249 18933 7068 1 10 . 1 1 107 107 GLU N N 107 116.409 116.409 116.156 0.253 18933 7069 1 10 . 1 1 107 107 GLU C C 107 177.764 177.764 176.935 0.829 18933 7070 1 10 . 1 1 107 107 GLU CA C 107 58.533 58.533 57.704 0.829 18933 7071 1 10 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.787 -1.851 18933 7072 1 10 . 1 1 107 107 GLU H H 107 9.664 9.664 8.699 0.965 18933 7073 1 10 . 1 1 108 108 GLU N N 108 116.189 116.189 117.939 -1.750 18933 7074 1 10 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.596 -1.453 18933 7075 1 10 . 1 1 108 108 GLU CB C 108 29.837 29.837 29.534 0.303 18933 7076 1 10 . 1 1 108 108 GLU H H 108 7.589 7.589 7.776 -0.187 18933 7077 1 10 . 1 1 109 109 LYS N N 109 119.928 119.928 121.522 -1.594 18933 7078 1 10 . 1 1 109 109 LYS CA C 109 62.851 62.851 60.770 2.081 18933 7079 1 10 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.523 -0.052 18933 7080 1 10 . 1 1 109 109 LYS H H 109 7.514 7.514 7.639 -0.125 18933 7081 1 10 . 1 1 111 111 TYR N N 111 114.930 114.930 119.042 -4.112 18933 7082 1 10 . 1 1 111 111 TYR C C 111 179.504 179.504 177.741 1.763 18933 7083 1 10 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.503 -2.486 18933 7084 1 10 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.687 -2.019 18933 7085 1 10 . 1 1 111 111 TYR H H 111 6.393 6.393 8.456 -2.063 18933 7086 1 10 . 1 1 112 112 ALA N N 112 124.901 124.901 122.493 2.408 18933 7087 1 10 . 1 1 112 112 ALA C C 112 179.173 179.173 179.406 -0.233 18933 7088 1 10 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.579 -0.678 18933 7089 1 10 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.251 -0.139 18933 7090 1 10 . 1 1 112 112 ALA H H 112 8.554 8.554 8.391 0.163 18933 7091 1 10 . 1 1 113 113 ILE N N 113 119.464 119.464 119.885 -0.421 18933 7092 1 10 . 1 1 113 113 ILE C C 113 178.499 178.499 177.722 0.777 18933 7093 1 10 . 1 1 113 113 ILE CA C 113 66.281 66.281 64.002 2.279 18933 7094 1 10 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.813 -0.497 18933 7095 1 10 . 1 1 113 113 ILE H H 113 8.680 8.680 7.544 1.136 18933 7096 1 10 . 1 1 114 114 PHE N N 114 122.922 122.922 121.988 0.934 18933 7097 1 10 . 1 1 114 114 PHE C C 114 178.217 178.217 178.048 0.169 18933 7098 1 10 . 1 1 114 114 PHE CA C 114 61.559 61.559 60.257 1.302 18933 7099 1 10 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.544 0.927 18933 7100 1 10 . 1 1 114 114 PHE H H 114 7.721 7.721 8.384 -0.663 18933 7101 1 10 . 1 1 115 115 HIS N N 115 118.560 118.560 118.953 -0.393 18933 7102 1 10 . 1 1 115 115 HIS C C 115 177.286 177.286 176.614 0.672 18933 7103 1 10 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.629 -0.249 18933 7104 1 10 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.167 1.698 18933 7105 1 10 . 1 1 115 115 HIS H H 115 8.155 8.155 8.419 -0.264 18933 7106 1 10 . 1 1 116 116 PHE N N 116 111.472 111.472 116.316 -4.844 18933 7107 1 10 . 1 1 116 116 PHE C C 116 179.026 179.026 177.883 1.143 18933 7108 1 10 . 1 1 116 116 PHE CA C 116 59.461 59.461 59.819 -0.358 18933 7109 1 10 . 1 1 116 116 PHE CB C 116 37.189 37.189 39.024 -1.835 18933 7110 1 10 . 1 1 116 116 PHE H H 116 8.564 8.564 7.878 0.686 18933 7111 1 10 . 1 1 117 117 THR N N 117 119.012 119.012 112.751 6.261 18933 7112 1 10 . 1 1 117 117 THR C C 117 172.935 172.935 175.772 -2.837 18933 7113 1 10 . 1 1 117 117 THR CA C 117 67.088 67.088 65.140 1.948 18933 7114 1 10 . 1 1 117 117 THR CB C 117 37.126 37.126 69.061 -31.935 18933 7115 1 10 . 1 1 117 117 THR H H 117 7.620 7.620 8.367 -0.747 18933 7116 1 10 . 1 1 118 118 GLY N N 118 107.917 107.917 109.381 -1.464 18933 7117 1 10 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.279 1.888 18933 7118 1 10 . 1 1 118 118 GLY H H 118 6.666 6.666 7.633 -0.967 18933 7119 1 10 . 1 1 121 121 SER N N 121 113.354 113.354 118.324 -4.970 18933 7120 1 10 . 1 1 121 121 SER C C 121 176.061 176.061 175.826 0.235 18933 7121 1 10 . 1 1 121 121 SER CA C 121 61.035 61.035 62.464 -1.429 18933 7122 1 10 . 1 1 121 121 SER H H 121 8.322 8.322 8.283 0.039 18933 7123 1 10 . 1 1 122 122 TYR N N 122 124.681 124.681 120.983 3.698 18933 7124 1 10 . 1 1 122 122 TYR C C 122 176.293 176.293 176.816 -0.523 18933 7125 1 10 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.570 -1.513 18933 7126 1 10 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.032 0.679 18933 7127 1 10 . 1 1 122 122 TYR H H 122 6.514 6.514 8.169 -1.655 18933 7128 1 10 . 1 1 123 123 LEU N N 123 117.997 117.997 119.932 -1.935 18933 7129 1 10 . 1 1 123 123 LEU C C 123 179.774 179.774 178.988 0.786 18933 7130 1 10 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.680 0.198 18933 7131 1 10 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.947 -0.968 18933 7132 1 10 . 1 1 123 123 LEU H H 123 7.428 7.428 7.248 0.180 18933 7133 1 10 . 1 1 124 124 ILE N N 124 119.012 119.012 120.064 -1.052 18933 7134 1 10 . 1 1 124 124 ILE C C 124 178.830 178.830 177.897 0.933 18933 7135 1 10 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.314 -0.163 18933 7136 1 10 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.346 -0.283 18933 7137 1 10 . 1 1 124 124 ILE H H 124 8.453 8.453 8.416 0.037 18933 7138 1 10 . 1 1 125 125 ARG N N 125 121.174 121.174 120.019 1.155 18933 7139 1 10 . 1 1 125 125 ARG C C 125 179.762 179.762 178.611 1.151 18933 7140 1 10 . 1 1 125 125 ARG CA C 125 59.057 59.057 59.062 -0.005 18933 7141 1 10 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.500 -0.550 18933 7142 1 10 . 1 1 125 125 ARG H H 125 7.004 7.004 8.150 -1.146 18933 7143 1 10 . 1 1 126 126 ILE N N 126 122.299 122.299 120.822 1.477 18933 7144 1 10 . 1 1 126 126 ILE C C 126 178.352 178.352 177.313 1.039 18933 7145 1 10 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.766 -2.561 18933 7146 1 10 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.289 -1.875 18933 7147 1 10 . 1 1 126 126 ILE H H 126 7.579 7.579 7.863 -0.284 18933 7148 1 10 . 1 1 127 127 ARG N N 127 119.354 119.354 120.472 -1.118 18933 7149 1 10 . 1 1 127 127 ARG C C 127 179.786 179.786 178.681 1.105 18933 7150 1 10 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.738 0.248 18933 7151 1 10 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.080 -0.750 18933 7152 1 10 . 1 1 127 127 ARG H H 127 8.715 8.715 8.040 0.675 18933 7153 1 10 . 1 1 128 128 ALA N N 128 122.873 122.873 120.564 2.309 18933 7154 1 10 . 1 1 128 128 ALA C C 128 180.325 180.325 179.367 0.958 18933 7155 1 10 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.626 0.114 18933 7156 1 10 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.236 -1.075 18933 7157 1 10 . 1 1 128 128 ALA H H 128 7.978 7.978 8.076 -0.098 18933 7158 1 10 . 1 1 129 129 ALA N N 129 121.846 121.846 121.777 0.069 18933 7159 1 10 . 1 1 129 129 ALA C C 129 181.539 181.539 179.890 1.649 18933 7160 1 10 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.792 -0.294 18933 7161 1 10 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.616 -1.137 18933 7162 1 10 . 1 1 129 129 ALA H H 129 7.519 7.519 7.918 -0.399 18933 7163 1 10 . 1 1 130 130 LEU N N 130 119.134 119.134 118.132 1.002 18933 7164 1 10 . 1 1 130 130 LEU C C 130 179.909 179.909 179.053 0.856 18933 7165 1 10 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.035 -0.036 18933 7166 1 10 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.722 -1.300 18933 7167 1 10 . 1 1 130 130 LEU H H 130 8.296 8.296 8.649 -0.353 18933 7168 1 10 . 1 1 131 131 LYS N N 131 122.299 122.299 119.841 2.458 18933 7169 1 10 . 1 1 131 131 LYS C C 131 180.289 180.289 179.469 0.820 18933 7170 1 10 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.565 -0.548 18933 7171 1 10 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.097 -0.865 18933 7172 1 10 . 1 1 131 131 LYS H H 131 8.281 8.281 7.865 0.416 18933 7173 1 10 . 1 1 132 132 LYS N N 132 118.743 118.743 118.761 -0.018 18933 7174 1 10 . 1 1 132 132 LYS C C 132 177.482 177.482 177.910 -0.428 18933 7175 1 10 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.555 -0.063 18933 7176 1 10 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.297 -1.065 18933 7177 1 10 . 1 1 132 132 LYS H H 132 7.317 7.317 7.495 -0.178 18933 7178 1 10 . 1 1 133 133 LYS N N 133 117.093 117.093 117.042 0.051 18933 7179 1 10 . 1 1 133 133 LYS C C 133 174.614 174.614 176.053 -1.439 18933 7180 1 10 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.774 -0.994 18933 7181 1 10 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.956 -0.774 18933 7182 1 10 . 1 1 133 133 LYS H H 133 7.327 7.327 7.667 -0.340 18933 7183 1 10 . 1 1 134 134 ASN N N 134 113.012 113.012 115.729 -2.717 18933 7184 1 10 . 1 1 134 134 ASN C C 134 173.965 173.965 173.572 0.393 18933 7185 1 10 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.361 -0.065 18933 7186 1 10 . 1 1 134 134 ASN CB C 134 36.175 36.175 36.934 -0.759 18933 7187 1 10 . 1 1 134 134 ASN H H 134 7.938 7.938 7.880 0.058 18933 7188 1 10 . 1 1 135 135 TYR N N 135 115.725 115.725 119.324 -3.599 18933 7189 1 10 . 1 1 135 135 TYR C C 135 176.342 176.342 175.543 0.799 18933 7190 1 10 . 1 1 135 135 TYR CA C 135 55.668 55.668 58.293 -2.625 18933 7191 1 10 . 1 1 135 135 TYR CB C 135 41.563 41.563 39.780 1.783 18933 7192 1 10 . 1 1 135 135 TYR H H 135 7.741 7.741 8.254 -0.513 18933 7193 1 10 . 1 1 136 136 LYS N N 136 122.641 122.641 125.188 -2.547 18933 7194 1 10 . 1 1 136 136 LYS C C 136 173.475 173.475 174.772 -1.297 18933 7195 1 10 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.677 0.224 18933 7196 1 10 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.412 -1.694 18933 7197 1 10 . 1 1 136 136 LYS H H 136 9.296 9.296 8.772 0.524 18933 7198 1 10 . 1 1 137 137 LEU N N 137 127.284 127.284 122.844 4.440 18933 7199 1 10 . 1 1 137 137 LEU C C 137 175.423 175.423 176.261 -0.838 18933 7200 1 10 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.187 -0.061 18933 7201 1 10 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.319 3.427 18933 7202 1 10 . 1 1 137 137 LEU H H 137 8.776 8.776 8.518 0.258 18933 7203 1 10 . 1 1 138 138 ASN N N 138 125.818 125.818 118.902 6.916 18933 7204 1 10 . 1 1 138 138 ASN C C 138 174.933 174.933 175.317 -0.384 18933 7205 1 10 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.408 -0.291 18933 7206 1 10 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.349 -4.843 18933 7207 1 10 . 1 1 138 138 ASN H H 138 8.811 8.811 8.131 0.680 18933 7208 1 10 . 1 1 139 139 GLN N N 139 116.861 116.861 119.831 -2.970 18933 7209 1 10 . 1 1 139 139 GLN CA C 139 56.838 56.838 57.963 -1.125 18933 7210 1 10 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.246 -2.529 18933 7211 1 10 . 1 1 139 139 GLN H H 139 9.220 9.220 8.709 0.511 18933 7212 1 10 . 1 1 140 140 TYR N N 140 120.600 120.600 118.356 2.244 18933 7213 1 10 . 1 1 140 140 TYR CA C 140 56.757 56.757 56.802 -0.045 18933 7214 1 10 . 1 1 140 140 TYR CB C 140 37.570 37.570 37.422 0.148 18933 7215 1 10 . 1 1 140 140 TYR H H 140 8.549 8.549 7.519 1.030 18933 7216 1 10 . 1 1 141 141 GLY N N 141 105.986 105.986 107.803 -1.817 18933 7217 1 10 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.370 -0.526 18933 7218 1 10 . 1 1 141 141 GLY H H 141 7.186 7.186 7.831 -0.645 18933 7219 1 10 . 1 1 142 142 LEU N N 142 120.038 120.038 116.811 3.227 18933 7220 1 10 . 1 1 142 142 LEU C C 142 173.340 173.340 176.033 -2.693 18933 7221 1 10 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.359 -0.839 18933 7222 1 10 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.406 0.945 18933 7223 1 10 . 1 1 142 142 LEU H H 142 7.539 7.539 8.237 -0.698 18933 7224 1 10 . 1 1 143 143 PHE N N 143 124.229 124.229 119.519 4.710 18933 7225 1 10 . 1 1 143 143 PHE C C 143 173.977 173.977 175.038 -1.061 18933 7226 1 10 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.061 -2.420 18933 7227 1 10 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.428 4.240 18933 7228 1 10 . 1 1 143 143 PHE H H 143 9.084 9.084 8.937 0.147 18933 7229 1 10 . 1 1 144 144 LYS N N 144 127.858 127.858 122.943 4.915 18933 7230 1 10 . 1 1 144 144 LYS C C 144 175.092 175.092 176.700 -1.608 18933 7231 1 10 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.316 4.540 18933 7232 1 10 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.886 3.699 18933 7233 1 10 . 1 1 144 144 LYS H H 144 9.281 9.281 8.914 0.367 18933 7234 1 10 . 1 1 145 145 ASN N N 145 128.188 128.188 126.169 2.019 18933 7235 1 10 . 1 1 145 145 ASN C C 145 175.779 175.779 174.668 1.111 18933 7236 1 10 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.667 3.059 18933 7237 1 10 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.618 -2.964 18933 7238 1 10 . 1 1 145 145 ASN H H 145 9.205 9.205 8.922 0.283 18933 7239 1 10 . 1 1 146 146 GLN N N 146 129.655 129.655 112.659 16.996 18933 7240 1 10 . 1 1 146 146 GLN C C 146 175.399 175.399 173.977 1.422 18933 7241 1 10 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.157 1.658 18933 7242 1 10 . 1 1 146 146 GLN CB C 146 32.626 32.626 28.283 4.343 18933 7243 1 10 . 1 1 146 146 GLN H H 146 8.983 8.983 8.641 0.342 18933 7244 1 10 . 1 1 147 147 THR N N 147 117.936 117.936 115.437 2.499 18933 7245 1 10 . 1 1 147 147 THR C C 147 173.254 173.254 173.324 -0.070 18933 7246 1 10 . 1 1 147 147 THR CA C 147 61.721 61.721 61.406 0.315 18933 7247 1 10 . 1 1 147 147 THR CB C 147 70.274 70.274 69.578 0.696 18933 7248 1 10 . 1 1 147 147 THR H H 147 8.029 8.029 7.827 0.202 18933 7249 1 10 . 1 1 148 148 LEU N N 148 130.681 130.681 130.831 -0.150 18933 7250 1 10 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.314 0.152 18933 7251 1 10 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.713 -1.024 18933 7252 1 10 . 1 1 148 148 LEU H H 148 8.635 8.635 8.922 -0.287 18933 7253 1 10 . 1 1 149 149 VAL N N 149 130.803 130.803 128.729 2.074 18933 7254 1 10 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.023 1.155 18933 7255 1 10 . 1 1 149 149 VAL CB C 149 31.675 31.675 34.900 -3.225 18933 7256 1 10 . 1 1 149 149 VAL H H 149 8.968 8.968 9.182 -0.214 18933 7257 1 10 . 1 1 151 151 LEU N N 151 124.290 124.290 121.003 3.287 18933 7258 1 10 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.595 -2.582 18933 7259 1 10 . 1 1 151 151 LEU CB C 151 44.098 44.098 41.129 2.969 18933 7260 1 10 . 1 1 151 151 LEU H H 151 7.872 7.872 8.381 -0.509 18933 7261 1 10 . 1 1 153 153 ILE N N 153 114.943 114.943 114.087 0.856 18933 7262 1 10 . 1 1 153 153 ILE C C 153 175.877 175.877 175.036 0.841 18933 7263 1 10 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.858 -0.164 18933 7264 1 10 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.227 1.462 18933 7265 1 10 . 1 1 153 153 ILE H H 153 7.125 7.125 7.635 -0.510 18933 7266 1 10 . 1 1 154 154 THR N N 154 111.766 111.766 113.570 -1.804 18933 7267 1 10 . 1 1 154 154 THR C C 154 174.945 174.945 174.139 0.806 18933 7268 1 10 . 1 1 154 154 THR CA C 154 62.124 62.124 62.089 0.035 18933 7269 1 10 . 1 1 154 154 THR CB C 154 70.718 70.718 69.386 1.332 18933 7270 1 10 . 1 1 154 154 THR H H 154 9.286 9.286 8.356 0.930 18933 7271 1 10 . 1 1 155 155 THR N N 155 111.766 111.766 111.814 -0.048 18933 7272 1 10 . 1 1 155 155 THR CA C 155 58.936 58.936 59.392 -0.456 18933 7273 1 10 . 1 1 155 155 THR CB C 155 72.683 72.683 72.391 0.292 18933 7274 1 10 . 1 1 155 155 THR H H 155 7.645 7.645 7.509 0.136 18933 7275 1 10 . 1 1 157 157 LYS N N 157 119.464 119.464 118.876 0.588 18933 7276 1 10 . 1 1 157 157 LYS C C 157 178.781 178.781 178.287 0.494 18933 7277 1 10 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.993 0.033 18933 7278 1 10 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.619 -0.197 18933 7279 1 10 . 1 1 157 157 LYS H H 157 8.175 8.175 8.324 -0.149 18933 7280 1 10 . 1 1 158 158 GLU N N 158 118.340 118.340 117.475 0.865 18933 7281 1 10 . 1 1 158 158 GLU C C 158 178.867 178.867 178.932 -0.065 18933 7282 1 10 . 1 1 158 158 GLU CA C 158 58.492 58.492 58.957 -0.465 18933 7283 1 10 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.797 0.533 18933 7284 1 10 . 1 1 158 158 GLU H H 158 7.519 7.519 8.377 -0.858 18933 7285 1 10 . 1 1 159 159 LEU N N 159 120.710 120.710 120.909 -0.199 18933 7286 1 10 . 1 1 159 159 LEU C C 159 176.526 176.526 178.520 -1.994 18933 7287 1 10 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.423 -0.254 18933 7288 1 10 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.529 -1.613 18933 7289 1 10 . 1 1 159 159 LEU H H 159 7.524 7.524 7.889 -0.365 18933 7290 1 10 . 1 1 160 160 ILE N N 160 118.217 118.217 119.114 -0.897 18933 7291 1 10 . 1 1 160 160 ILE C C 160 177.213 177.213 177.909 -0.696 18933 7292 1 10 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.427 -0.397 18933 7293 1 10 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.201 0.305 18933 7294 1 10 . 1 1 160 160 ILE H H 160 7.741 7.741 7.934 -0.193 18933 7295 1 10 . 1 1 161 161 LYS N N 161 118.450 118.450 120.458 -2.008 18933 7296 1 10 . 1 1 161 161 LYS C C 161 180.999 180.999 179.791 1.208 18933 7297 1 10 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.704 -0.889 18933 7298 1 10 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.145 -1.167 18933 7299 1 10 . 1 1 161 161 LYS H H 161 7.382 7.382 8.186 -0.804 18933 7300 1 10 . 1 1 162 162 GLU N N 162 121.846 121.846 120.063 1.783 18933 7301 1 10 . 1 1 162 162 GLU C C 162 178.818 178.818 178.385 0.433 18933 7302 1 10 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.565 -0.516 18933 7303 1 10 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.284 -1.348 18933 7304 1 10 . 1 1 162 162 GLU H H 162 8.210 8.210 7.878 0.332 18933 7305 1 10 . 1 1 163 163 LEU N N 163 116.751 116.751 115.330 1.421 18933 7306 1 10 . 1 1 163 163 LEU C C 163 176.784 176.784 177.038 -0.254 18933 7307 1 10 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.016 0.006 18933 7308 1 10 . 1 1 163 163 LEU CB C 163 41.309 41.309 42.263 -0.954 18933 7309 1 10 . 1 1 163 163 LEU H H 163 7.796 7.796 7.429 0.367 18933 7310 1 10 . 1 1 164 164 GLY N N 164 104.849 104.849 105.359 -0.510 18933 7311 1 10 . 1 1 164 164 GLY C C 164 174.492 174.492 174.314 0.178 18933 7312 1 10 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.394 -0.662 18933 7313 1 10 . 1 1 164 164 GLY H H 164 7.589 7.589 7.446 0.143 18933 7314 1 10 . 1 1 165 165 PHE N N 165 118.902 118.902 119.640 -0.738 18933 7315 1 10 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.454 -0.786 18933 7316 1 10 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.022 -1.537 18933 7317 1 10 . 1 1 165 165 PHE H H 165 7.251 7.251 8.012 -0.761 18933 7318 1 10 . 1 1 166 166 THR N N 166 117.093 117.093 116.205 0.888 18933 7319 1 10 . 1 1 166 166 THR CA C 166 62.245 62.245 62.122 0.123 18933 7320 1 10 . 1 1 166 166 THR CB C 166 69.323 69.323 68.979 0.344 18933 7321 1 10 . 1 1 166 166 THR H H 166 8.407 8.407 8.338 0.069 18933 7322 1 10 . 1 1 168 168 ARG N N 168 127.431 127.431 121.396 6.035 18933 7323 1 10 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.567 -2.329 18933 7324 1 10 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.130 -1.138 18933 7325 1 10 . 1 1 168 168 ARG H H 168 7.160 7.160 8.637 -1.477 18933 7326 1 10 . 1 1 171 171 LYS N N 171 113.574 113.574 116.175 -2.601 18933 7327 1 10 . 1 1 171 171 LYS C C 171 176.416 176.416 177.108 -0.692 18933 7328 1 10 . 1 1 171 171 LYS CA C 171 57.605 57.605 57.574 0.031 18933 7329 1 10 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.181 0.748 18933 7330 1 10 . 1 1 171 171 LYS H H 171 8.210 8.210 8.133 0.077 18933 7331 1 10 . 1 1 172 172 LYS N N 172 117.313 117.313 119.055 -1.742 18933 7332 1 10 . 1 1 172 172 LYS C C 172 175.717 175.717 176.181 -0.464 18933 7333 1 10 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.468 -2.293 18933 7334 1 10 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.816 -1.204 18933 7335 1 10 . 1 1 172 172 LYS H H 172 7.761 7.761 7.786 -0.025 18933 7336 1 10 . 1 1 173 173 ARG N N 173 122.056 122.056 117.017 5.039 18933 7337 1 10 . 1 1 173 173 ARG C C 173 172.850 172.850 175.365 -2.515 18933 7338 1 10 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.350 0.528 18933 7339 1 10 . 1 1 173 173 ARG CB C 173 28.506 28.506 27.552 0.954 18933 7340 1 10 . 1 1 173 173 ARG H H 173 6.885 6.885 7.571 -0.686 18933 7341 1 11 . 1 1 2 2 LEU N N 2 122.812 122.812 121.531 1.281 18933 7342 1 11 . 1 1 2 2 LEU C C 2 175.742 175.742 175.897 -0.155 18933 7343 1 11 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.931 0.202 18933 7344 1 11 . 1 1 2 2 LEU CB C 2 42.842 42.842 44.831 -1.988 18933 7345 1 11 . 1 1 2 2 LEU H H 2 8.756 8.756 8.237 0.519 18933 7346 1 11 . 1 1 3 3 THR N N 3 113.000 113.000 111.698 1.302 18933 7347 1 11 . 1 1 3 3 THR C C 3 175.938 175.938 175.910 0.028 18933 7348 1 11 . 1 1 3 3 THR CA C 3 60.550 60.550 60.123 0.427 18933 7349 1 11 . 1 1 3 3 THR CB C 3 70.781 70.781 70.308 0.473 18933 7350 1 11 . 1 1 3 3 THR H H 3 8.428 8.428 8.120 0.308 18933 7351 1 11 . 1 1 4 4 LEU N N 4 122.531 122.531 122.974 -0.443 18933 7352 1 11 . 1 1 4 4 LEU C C 4 178.463 178.463 178.442 0.021 18933 7353 1 11 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.788 -0.659 18933 7354 1 11 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.065 -2.531 18933 7355 1 11 . 1 1 4 4 LEU H H 4 7.731 7.731 8.108 -0.377 18933 7356 1 11 . 1 1 5 5 ILE N N 5 115.505 115.505 116.777 -1.272 18933 7357 1 11 . 1 1 5 5 ILE C C 5 178.573 178.573 178.022 0.551 18933 7358 1 11 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.742 -1.004 18933 7359 1 11 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.315 -0.443 18933 7360 1 11 . 1 1 5 5 ILE H H 5 7.645 7.645 7.999 -0.354 18933 7361 1 11 . 1 1 6 6 GLN N N 6 121.626 121.626 119.466 2.160 18933 7362 1 11 . 1 1 6 6 GLN C C 6 179.014 179.014 178.783 0.231 18933 7363 1 11 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.147 -0.816 18933 7364 1 11 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.723 0.466 18933 7365 1 11 . 1 1 6 6 GLN H H 6 7.645 7.645 7.884 -0.239 18933 7366 1 11 . 1 1 7 7 GLY N N 7 107.684 107.684 106.949 0.735 18933 7367 1 11 . 1 1 7 7 GLY C C 7 174.749 174.749 176.249 -1.500 18933 7368 1 11 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.852 -0.062 18933 7369 1 11 . 1 1 7 7 GLY H H 7 8.660 8.660 8.211 0.449 18933 7370 1 11 . 1 1 8 8 LYS N N 8 120.942 120.942 122.476 -1.534 18933 7371 1 11 . 1 1 8 8 LYS C C 8 179.455 179.455 178.761 0.694 18933 7372 1 11 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.209 0.696 18933 7373 1 11 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.290 -0.868 18933 7374 1 11 . 1 1 8 8 LYS H H 8 8.518 8.518 7.761 0.757 18933 7375 1 11 . 1 1 9 9 LYS N N 9 120.710 120.710 119.673 1.037 18933 7376 1 11 . 1 1 9 9 LYS C C 9 179.823 179.823 179.014 0.809 18933 7377 1 11 . 1 1 9 9 LYS CA C 9 59.622 59.622 60.004 -0.382 18933 7378 1 11 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.480 -1.185 18933 7379 1 11 . 1 1 9 9 LYS H H 9 7.731 7.731 8.237 -0.506 18933 7380 1 11 . 1 1 10 10 ILE N N 10 121.345 121.345 121.005 0.340 18933 7381 1 11 . 1 1 10 10 ILE C C 10 177.789 177.789 177.870 -0.081 18933 7382 1 11 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.931 -1.466 18933 7383 1 11 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.188 -1.823 18933 7384 1 11 . 1 1 10 10 ILE H H 10 7.711 7.711 8.396 -0.685 18933 7385 1 11 . 1 1 11 11 VAL N N 11 120.258 120.258 120.281 -0.023 18933 7386 1 11 . 1 1 11 11 VAL C C 11 177.372 177.372 178.099 -0.727 18933 7387 1 11 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.114 0.337 18933 7388 1 11 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.087 -0.553 18933 7389 1 11 . 1 1 11 11 VAL H H 11 7.918 7.918 8.595 -0.677 18933 7390 1 11 . 1 1 12 12 ASN N N 12 116.971 116.971 117.871 -0.900 18933 7391 1 11 . 1 1 12 12 ASN C C 12 177.445 177.445 177.555 -0.110 18933 7392 1 11 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.292 -0.180 18933 7393 1 11 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.502 -0.869 18933 7394 1 11 . 1 1 12 12 ASN H H 12 7.993 7.993 8.569 -0.576 18933 7395 1 11 . 1 1 13 13 HIS N N 13 120.258 120.258 119.694 0.564 18933 7396 1 11 . 1 1 13 13 HIS C C 13 177.862 177.862 177.793 0.069 18933 7397 1 11 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.621 -0.523 18933 7398 1 11 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.536 0.696 18933 7399 1 11 . 1 1 13 13 HIS H H 13 7.741 7.741 8.303 -0.562 18933 7400 1 11 . 1 1 14 14 LEU N N 14 116.641 116.641 119.862 -3.221 18933 7401 1 11 . 1 1 14 14 LEU C C 14 179.186 179.186 178.347 0.839 18933 7402 1 11 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.432 -1.675 18933 7403 1 11 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.515 -0.396 18933 7404 1 11 . 1 1 14 14 LEU H H 14 8.221 8.221 8.599 -0.378 18933 7405 1 11 . 1 1 15 15 ARG N N 15 115.957 115.957 114.455 1.502 18933 7406 1 11 . 1 1 15 15 ARG C C 15 176.330 176.330 178.254 -1.924 18933 7407 1 11 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.497 1.206 18933 7408 1 11 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.380 -1.303 18933 7409 1 11 . 1 1 15 15 ARG H H 15 7.968 7.968 8.288 -0.320 18933 7410 1 11 . 1 1 16 16 SER N N 16 109.395 109.395 116.038 -6.643 18933 7411 1 11 . 1 1 16 16 SER C C 16 176.024 176.024 175.090 0.934 18933 7412 1 11 . 1 1 16 16 SER CA C 16 57.282 57.282 60.389 -3.107 18933 7413 1 11 . 1 1 16 16 SER CB C 16 63.683 63.683 63.674 0.009 18933 7414 1 11 . 1 1 16 16 SER H H 16 6.963 6.963 7.445 -0.482 18933 7415 1 11 . 1 1 17 17 ARG N N 17 122.775 122.775 121.853 0.922 18933 7416 1 11 . 1 1 17 17 ARG C C 17 174.590 174.590 174.015 0.575 18933 7417 1 11 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.947 1.326 18933 7418 1 11 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.424 1.378 18933 7419 1 11 . 1 1 17 17 ARG H H 17 7.781 7.781 8.320 -0.539 18933 7420 1 11 . 1 1 18 18 LEU N N 18 122.421 122.421 125.867 -3.446 18933 7421 1 11 . 1 1 18 18 LEU C C 18 176.281 176.281 174.100 2.181 18933 7422 1 11 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.449 0.331 18933 7423 1 11 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.971 -3.760 18933 7424 1 11 . 1 1 18 18 LEU H H 18 8.650 8.650 7.776 0.874 18933 7425 1 11 . 1 1 19 19 ALA N N 19 126.441 126.441 126.527 -0.086 18933 7426 1 11 . 1 1 19 19 ALA C C 19 173.904 173.904 174.811 -0.907 18933 7427 1 11 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.709 -0.843 18933 7428 1 11 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.247 0.618 18933 7429 1 11 . 1 1 19 19 ALA H H 19 8.609 8.609 8.905 -0.296 18933 7430 1 11 . 1 1 20 20 PHE N N 20 114.600 114.600 119.589 -4.989 18933 7431 1 11 . 1 1 20 20 PHE C C 20 172.592 172.592 173.938 -1.346 18933 7432 1 11 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.957 0.832 18933 7433 1 11 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.471 -0.782 18933 7434 1 11 . 1 1 20 20 PHE H H 20 8.801 8.801 9.093 -0.292 18933 7435 1 11 . 1 1 21 21 GLU N N 21 122.873 122.873 124.329 -1.456 18933 7436 1 11 . 1 1 21 21 GLU C C 21 174.872 174.872 175.205 -0.333 18933 7437 1 11 . 1 1 21 21 GLU CA C 21 55.062 55.062 55.137 -0.075 18933 7438 1 11 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.078 -0.353 18933 7439 1 11 . 1 1 21 21 GLU H H 21 7.847 7.847 9.273 -1.426 18933 7440 1 11 . 1 1 22 22 TYR N N 22 126.270 126.270 126.611 -0.341 18933 7441 1 11 . 1 1 22 22 TYR C C 22 174.872 174.872 174.746 0.126 18933 7442 1 11 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.622 -0.874 18933 7443 1 11 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.199 -1.094 18933 7444 1 11 . 1 1 22 22 TYR H H 22 8.806 8.806 9.190 -0.384 18933 7445 1 11 . 1 1 23 23 ASN N N 23 128.420 128.420 125.855 2.565 18933 7446 1 11 . 1 1 23 23 ASN C C 23 175.435 175.435 175.095 0.340 18933 7447 1 11 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.572 -0.567 18933 7448 1 11 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.745 -1.380 18933 7449 1 11 . 1 1 23 23 ASN H H 23 8.943 8.943 9.153 -0.210 18933 7450 1 11 . 1 1 24 24 GLY N N 24 104.067 104.067 102.003 2.064 18933 7451 1 11 . 1 1 24 24 GLY C C 24 173.707 173.707 173.789 -0.082 18933 7452 1 11 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.966 -0.032 18933 7453 1 11 . 1 1 24 24 GLY H H 24 8.534 8.534 8.176 0.358 18933 7454 1 11 . 1 1 25 25 GLN N N 25 120.038 120.038 119.777 0.261 18933 7455 1 11 . 1 1 25 25 GLN C C 25 173.744 173.744 174.726 -0.982 18933 7456 1 11 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.271 -0.944 18933 7457 1 11 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.544 0.117 18933 7458 1 11 . 1 1 25 25 GLN H H 25 7.595 7.595 7.800 -0.205 18933 7459 1 11 . 1 1 26 26 LEU N N 26 124.681 124.681 125.043 -0.362 18933 7460 1 11 . 1 1 26 26 LEU C C 26 175.987 175.987 176.320 -0.333 18933 7461 1 11 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.646 -0.633 18933 7462 1 11 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.485 -1.620 18933 7463 1 11 . 1 1 26 26 LEU H H 26 8.382 8.382 8.619 -0.237 18933 7464 1 11 . 1 1 27 27 ILE N N 27 130.779 130.779 127.370 3.409 18933 7465 1 11 . 1 1 27 27 ILE C C 27 175.215 175.215 174.541 0.674 18933 7466 1 11 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.696 -0.437 18933 7467 1 11 . 1 1 27 27 ILE CB C 27 35.732 35.732 37.666 -1.934 18933 7468 1 11 . 1 1 27 27 ILE H H 27 8.882 8.882 8.920 -0.038 18933 7469 1 11 . 1 1 28 28 LYS N N 28 126.160 126.160 127.612 -1.452 18933 7470 1 11 . 1 1 28 28 LYS C C 28 176.771 176.771 175.707 1.064 18933 7471 1 11 . 1 1 28 28 LYS CA C 28 56.838 56.838 55.073 1.765 18933 7472 1 11 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.004 -1.264 18933 7473 1 11 . 1 1 28 28 LYS H H 28 8.165 8.165 8.316 -0.151 18933 7474 1 11 . 1 1 29 29 ILE N N 29 126.380 126.380 122.296 4.084 18933 7475 1 11 . 1 1 29 29 ILE C C 29 175.877 175.877 174.356 1.521 18933 7476 1 11 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.517 -0.209 18933 7477 1 11 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.656 -2.593 18933 7478 1 11 . 1 1 29 29 ILE H H 29 8.019 8.019 8.616 -0.597 18933 7479 1 11 . 1 1 30 30 LEU N N 30 129.215 129.215 122.051 7.164 18933 7480 1 11 . 1 1 30 30 LEU C C 30 178.867 178.867 178.169 0.698 18933 7481 1 11 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.341 1.278 18933 7482 1 11 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.502 -4.637 18933 7483 1 11 . 1 1 30 30 LEU H H 30 8.917 8.917 8.320 0.597 18933 7484 1 11 . 1 1 31 31 SER N N 31 117.997 117.997 116.419 1.578 18933 7485 1 11 . 1 1 31 31 SER C C 31 177.396 177.396 175.686 1.710 18933 7486 1 11 . 1 1 31 31 SER CA C 31 61.236 61.236 60.760 0.476 18933 7487 1 11 . 1 1 31 31 SER CB C 31 62.035 62.035 63.228 -1.193 18933 7488 1 11 . 1 1 31 31 SER H H 31 8.594 8.594 8.855 -0.261 18933 7489 1 11 . 1 1 32 32 LYS N N 32 116.189 116.189 119.473 -3.284 18933 7490 1 11 . 1 1 32 32 LYS C C 32 176.244 176.244 177.264 -1.020 18933 7491 1 11 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.179 -0.776 18933 7492 1 11 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.413 -2.131 18933 7493 1 11 . 1 1 32 32 LYS H H 32 8.029 8.029 8.333 -0.304 18933 7494 1 11 . 1 1 33 33 ASN N N 33 119.061 119.061 115.240 3.821 18933 7495 1 11 . 1 1 33 33 ASN C C 33 172.384 172.384 174.307 -1.923 18933 7496 1 11 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.906 -1.749 18933 7497 1 11 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.073 -2.806 18933 7498 1 11 . 1 1 33 33 ASN H H 33 7.902 7.902 7.763 0.139 18933 7499 1 11 . 1 1 34 34 ILE N N 34 120.038 120.038 119.301 0.737 18933 7500 1 11 . 1 1 34 34 ILE C C 34 175.607 175.607 174.292 1.315 18933 7501 1 11 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.183 0.367 18933 7502 1 11 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.818 -2.854 18933 7503 1 11 . 1 1 34 34 ILE H H 34 7.443 7.443 7.774 -0.331 18933 7504 1 11 . 1 1 35 35 VAL N N 35 129.435 129.435 125.892 3.543 18933 7505 1 11 . 1 1 35 35 VAL C C 35 175.386 175.386 174.488 0.898 18933 7506 1 11 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.240 -0.214 18933 7507 1 11 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.963 -1.182 18933 7508 1 11 . 1 1 35 35 VAL H H 35 9.533 9.533 8.795 0.738 18933 7509 1 11 . 1 1 36 36 ALA N N 36 130.571 130.571 129.355 1.216 18933 7510 1 11 . 1 1 36 36 ALA C C 36 177.347 177.347 176.377 0.970 18933 7511 1 11 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.884 0.515 18933 7512 1 11 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.679 -0.821 18933 7513 1 11 . 1 1 36 36 ALA H H 36 8.665 8.665 8.460 0.205 18933 7514 1 11 . 1 1 37 37 VAL N N 37 115.395 115.395 120.212 -4.817 18933 7515 1 11 . 1 1 37 37 VAL C C 37 174.455 174.455 175.715 -1.260 18933 7516 1 11 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.204 0.176 18933 7517 1 11 . 1 1 37 37 VAL CB C 37 32.943 32.943 33.793 -0.850 18933 7518 1 11 . 1 1 37 37 VAL H H 37 8.079 8.079 8.268 -0.189 18933 7519 1 11 . 1 1 38 38 GLY N N 38 107.672 107.672 108.075 -0.403 18933 7520 1 11 . 1 1 38 38 GLY C C 38 173.364 173.364 175.816 -2.452 18933 7521 1 11 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.485 -0.300 18933 7522 1 11 . 1 1 38 38 GLY H H 38 7.579 7.579 8.196 -0.617 18933 7523 1 11 . 1 1 39 39 SER N N 39 121.052 121.052 119.457 1.595 18933 7524 1 11 . 1 1 39 39 SER C C 39 175.570 175.570 176.338 -0.768 18933 7525 1 11 . 1 1 39 39 SER CA C 39 61.801 61.801 61.966 -0.165 18933 7526 1 11 . 1 1 39 39 SER CB C 39 62.478 62.478 63.197 -0.719 18933 7527 1 11 . 1 1 39 39 SER H H 39 8.953 8.953 8.111 0.842 18933 7528 1 11 . 1 1 40 40 LEU N N 40 121.553 121.553 121.371 0.182 18933 7529 1 11 . 1 1 40 40 LEU C C 40 180.203 180.203 178.503 1.700 18933 7530 1 11 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.452 -0.323 18933 7531 1 11 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.898 -0.145 18933 7532 1 11 . 1 1 40 40 LEU H H 40 8.195 8.195 7.216 0.979 18933 7533 1 11 . 1 1 41 41 ARG N N 41 121.956 121.956 117.810 4.146 18933 7534 1 11 . 1 1 41 41 ARG C C 41 177.323 177.323 177.937 -0.614 18933 7535 1 11 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.853 0.478 18933 7536 1 11 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.883 -1.440 18933 7537 1 11 . 1 1 41 41 ARG H H 41 6.873 6.873 7.525 -0.652 18933 7538 1 11 . 1 1 42 42 ARG N N 42 114.600 114.600 116.759 -2.159 18933 7539 1 11 . 1 1 42 42 ARG C C 42 172.911 172.911 175.754 -2.843 18933 7540 1 11 . 1 1 42 42 ARG CA C 42 57.242 57.242 57.314 -0.072 18933 7541 1 11 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.958 -1.818 18933 7542 1 11 . 1 1 42 42 ARG H H 42 7.438 7.438 8.219 -0.781 18933 7543 1 11 . 1 1 43 43 GLU N N 43 113.354 113.354 113.867 -0.513 18933 7544 1 11 . 1 1 43 43 GLU C C 43 175.999 175.999 175.071 0.928 18933 7545 1 11 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.046 -0.490 18933 7546 1 11 . 1 1 43 43 GLU CB C 43 25.337 25.337 26.689 -1.352 18933 7547 1 11 . 1 1 43 43 GLU H H 43 7.564 7.564 7.924 -0.360 18933 7548 1 11 . 1 1 44 44 GLU N N 44 119.696 119.696 120.820 -1.124 18933 7549 1 11 . 1 1 44 44 GLU C C 44 175.423 175.423 176.284 -0.861 18933 7550 1 11 . 1 1 44 44 GLU CA C 44 56.838 56.838 54.066 2.772 18933 7551 1 11 . 1 1 44 44 GLU CB C 44 28.696 28.696 28.707 -0.011 18933 7552 1 11 . 1 1 44 44 GLU H H 44 7.261 7.261 7.641 -0.380 18933 7553 1 11 . 1 1 45 45 LYS N N 45 117.435 117.435 121.463 -4.028 18933 7554 1 11 . 1 1 45 45 LYS C C 45 177.715 177.715 176.406 1.309 18933 7555 1 11 . 1 1 45 45 LYS CA C 45 59.219 59.219 59.159 0.060 18933 7556 1 11 . 1 1 45 45 LYS CB C 45 32.119 32.119 32.533 -0.414 18933 7557 1 11 . 1 1 45 45 LYS H H 45 7.938 7.938 7.790 0.148 18933 7558 1 11 . 1 1 46 46 MET N N 46 115.847 115.847 118.695 -2.848 18933 7559 1 11 . 1 1 46 46 MET CA C 46 52.520 52.520 53.709 -1.189 18933 7560 1 11 . 1 1 46 46 MET CB C 46 33.450 33.450 31.729 1.721 18933 7561 1 11 . 1 1 46 46 MET H H 46 7.595 7.595 7.776 -0.181 18933 7562 1 11 . 1 1 47 47 LEU N N 47 121.627 121.627 126.382 -4.755 18933 7563 1 11 . 1 1 47 47 LEU CA C 47 53.126 53.126 55.116 -1.990 18933 7564 1 11 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.053 0.017 18933 7565 1 11 . 1 1 47 47 LEU H H 47 9.220 9.220 8.960 0.260 18933 7566 1 11 . 1 1 49 49 ASP N N 49 117.093 117.093 118.608 -1.515 18933 7567 1 11 . 1 1 49 49 ASP C C 49 173.340 173.340 174.453 -1.113 18933 7568 1 11 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.542 -1.748 18933 7569 1 11 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.483 -1.477 18933 7570 1 11 . 1 1 49 49 ASP H H 49 7.761 7.761 7.804 -0.043 18933 7571 1 11 . 1 1 50 50 VAL N N 50 119.012 119.012 117.835 1.177 18933 7572 1 11 . 1 1 50 50 VAL C C 50 173.070 173.070 173.712 -0.642 18933 7573 1 11 . 1 1 50 50 VAL CA C 50 61.842 61.842 59.744 2.098 18933 7574 1 11 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.293 -0.730 18933 7575 1 11 . 1 1 50 50 VAL H H 50 8.089 8.089 8.329 -0.240 18933 7576 1 11 . 1 1 51 51 ASP N N 51 127.064 127.064 125.901 1.163 18933 7577 1 11 . 1 1 51 51 ASP C C 51 174.565 174.565 175.264 -0.699 18933 7578 1 11 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.890 -0.733 18933 7579 1 11 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.428 -0.788 18933 7580 1 11 . 1 1 51 51 ASP H H 51 8.069 8.069 8.083 -0.014 18933 7581 1 11 . 1 1 52 52 LEU N N 52 121.627 121.627 119.976 1.651 18933 7582 1 11 . 1 1 52 52 LEU C C 52 174.063 174.063 174.619 -0.556 18933 7583 1 11 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.399 -0.717 18933 7584 1 11 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.278 -2.926 18933 7585 1 11 . 1 1 52 52 LEU H H 52 8.852 8.852 8.915 -0.063 18933 7586 1 11 . 1 1 53 53 LEU N N 53 123.093 123.093 123.398 -0.305 18933 7587 1 11 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.100 1.891 18933 7588 1 11 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.706 -2.573 18933 7589 1 11 . 1 1 53 53 LEU H H 53 9.362 9.362 9.001 0.361 18933 7590 1 11 . 1 1 54 54 ILE N N 54 123.777 123.777 129.295 -5.518 18933 7591 1 11 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.059 -3.997 18933 7592 1 11 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.357 -7.287 18933 7593 1 11 . 1 1 54 54 ILE H H 54 8.907 8.907 9.249 -0.342 18933 7594 1 11 . 1 1 58 58 GLU N N 58 114.710 114.710 116.827 -2.117 18933 7595 1 11 . 1 1 58 58 GLU CA C 58 54.377 54.377 56.023 -1.646 18933 7596 1 11 . 1 1 58 58 GLU CB C 58 31.422 31.422 33.084 -1.662 18933 7597 1 11 . 1 1 58 58 GLU H H 58 6.716 6.716 7.632 -0.916 18933 7598 1 11 . 1 1 61 61 LEU N N 61 115.957 115.957 120.167 -4.210 18933 7599 1 11 . 1 1 61 61 LEU C C 61 178.512 178.512 178.277 0.235 18933 7600 1 11 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.077 -2.297 18933 7601 1 11 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.467 -0.348 18933 7602 1 11 . 1 1 61 61 LEU H H 61 7.307 7.307 7.928 -0.621 18933 7603 1 11 . 1 1 62 62 LEU N N 62 120.038 120.038 119.433 0.605 18933 7604 1 11 . 1 1 62 62 LEU C C 62 177.874 177.874 178.813 -0.939 18933 7605 1 11 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.544 0.393 18933 7606 1 11 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.977 -1.238 18933 7607 1 11 . 1 1 62 62 LEU H H 62 7.327 7.327 8.086 -0.759 18933 7608 1 11 . 1 1 63 63 LYS N N 63 114.600 114.600 115.415 -0.815 18933 7609 1 11 . 1 1 63 63 LYS C C 63 175.460 175.460 177.174 -1.714 18933 7610 1 11 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.774 -1.210 18933 7611 1 11 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.660 -1.935 18933 7612 1 11 . 1 1 63 63 LYS H H 63 7.973 7.973 7.832 0.141 18933 7613 1 11 . 1 1 64 64 HIS N N 64 115.273 115.273 115.388 -0.115 18933 7614 1 11 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.292 0.820 18933 7615 1 11 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.456 1.980 18933 7616 1 11 . 1 1 64 64 HIS H H 64 7.544 7.544 7.572 -0.028 18933 7617 1 11 . 1 1 65 65 VAL N N 65 118.682 118.682 119.529 -0.847 18933 7618 1 11 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.734 3.304 18933 7619 1 11 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.311 -2.284 18933 7620 1 11 . 1 1 65 65 VAL H H 65 6.787 6.787 7.241 -0.454 18933 7621 1 11 . 1 1 68 68 ASN N N 68 112.108 112.108 118.140 -6.032 18933 7622 1 11 . 1 1 68 68 ASN C C 68 174.884 174.884 173.905 0.979 18933 7623 1 11 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.326 -1.299 18933 7624 1 11 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.280 0.952 18933 7625 1 11 . 1 1 68 68 ASN H H 68 7.009 7.009 8.323 -1.314 18933 7626 1 11 . 1 1 69 69 ILE N N 69 123.325 123.325 123.602 -0.277 18933 7627 1 11 . 1 1 69 69 ILE C C 69 174.394 174.394 175.599 -1.205 18933 7628 1 11 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.660 -1.553 18933 7629 1 11 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.578 -0.311 18933 7630 1 11 . 1 1 69 69 ILE H H 69 7.150 7.150 8.288 -1.138 18933 7631 1 11 . 1 1 70 70 ARG N N 70 126.722 126.722 128.159 -1.437 18933 7632 1 11 . 1 1 70 70 ARG C C 70 174.590 174.590 174.455 0.135 18933 7633 1 11 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.713 -1.466 18933 7634 1 11 . 1 1 70 70 ARG CB C 70 32.372 32.372 35.115 -2.743 18933 7635 1 11 . 1 1 70 70 ARG H H 70 8.902 8.902 9.345 -0.443 18933 7636 1 11 . 1 1 71 71 ILE N N 71 119.978 119.978 120.478 -0.500 18933 7637 1 11 . 1 1 71 71 ILE C C 71 175.583 175.583 175.737 -0.154 18933 7638 1 11 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.736 0.088 18933 7639 1 11 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.427 -2.667 18933 7640 1 11 . 1 1 71 71 ILE H H 71 7.491 7.491 8.863 -1.371 18933 7641 1 11 . 1 1 72 72 LYS N N 72 128.530 128.530 125.223 3.307 18933 7642 1 11 . 1 1 72 72 LYS C C 72 177.703 177.703 176.381 1.322 18933 7643 1 11 . 1 1 72 72 LYS CA C 72 57.201 57.201 54.727 2.474 18933 7644 1 11 . 1 1 72 72 LYS CB C 72 31.485 31.485 30.959 0.526 18933 7645 1 11 . 1 1 72 72 LYS H H 72 8.523 8.523 8.617 -0.094 18933 7646 1 11 . 1 1 73 73 GLY N N 73 113.806 113.806 110.125 3.681 18933 7647 1 11 . 1 1 73 73 GLY C C 73 173.781 173.781 172.874 0.907 18933 7648 1 11 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.220 0.602 18933 7649 1 11 . 1 1 73 73 GLY H H 73 8.791 8.791 8.281 0.510 18933 7650 1 11 . 1 1 74 74 LEU N N 74 120.490 120.490 118.385 2.105 18933 7651 1 11 . 1 1 74 74 LEU C C 74 175.840 175.840 173.675 2.165 18933 7652 1 11 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.356 -0.665 18933 7653 1 11 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.421 -1.260 18933 7654 1 11 . 1 1 74 74 LEU H H 74 7.393 7.393 7.253 0.140 18933 7655 1 11 . 1 1 75 75 SER N N 75 120.038 120.038 115.651 4.387 18933 7656 1 11 . 1 1 75 75 SER C C 75 173.205 173.205 173.477 -0.272 18933 7657 1 11 . 1 1 75 75 SER CA C 75 57.887 57.887 57.151 0.736 18933 7658 1 11 . 1 1 75 75 SER CB C 75 63.049 63.049 65.114 -2.064 18933 7659 1 11 . 1 1 75 75 SER H H 75 8.917 8.917 8.174 0.743 18933 7660 1 11 . 1 1 76 76 PHE N N 76 119.586 119.586 117.873 1.713 18933 7661 1 11 . 1 1 76 76 PHE C C 76 173.536 173.536 173.928 -0.392 18933 7662 1 11 . 1 1 76 76 PHE CA C 76 55.426 55.426 55.877 -0.452 18933 7663 1 11 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.487 -0.481 18933 7664 1 11 . 1 1 76 76 PHE H H 76 8.003 8.003 8.345 -0.342 18933 7665 1 11 . 1 1 77 77 SER N N 77 114.943 114.943 115.767 -0.824 18933 7666 1 11 . 1 1 77 77 SER C C 77 173.438 173.438 172.457 0.981 18933 7667 1 11 . 1 1 77 77 SER CA C 77 56.152 56.152 57.328 -1.176 18933 7668 1 11 . 1 1 77 77 SER CB C 77 65.204 65.204 66.201 -0.997 18933 7669 1 11 . 1 1 77 77 SER H H 77 8.907 8.907 8.647 0.260 18933 7670 1 11 . 1 1 78 78 VAL N N 78 124.791 124.791 124.255 0.536 18933 7671 1 11 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.029 2.015 18933 7672 1 11 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.230 -2.048 18933 7673 1 11 . 1 1 78 78 VAL H H 78 8.892 8.892 8.316 0.576 18933 7674 1 11 . 1 1 79 79 LYS N N 79 129.667 129.667 129.380 0.287 18933 7675 1 11 . 1 1 79 79 LYS CA C 79 56.192 56.192 53.782 2.410 18933 7676 1 11 . 1 1 79 79 LYS CB C 79 32.372 32.372 33.649 -1.277 18933 7677 1 11 . 1 1 79 79 LYS H H 79 9.049 9.049 8.817 0.232 18933 7678 1 11 . 1 1 82 82 GLY N N 82 117.263 117.263 113.426 3.837 18933 7679 1 11 . 1 1 82 82 GLY C C 82 171.710 171.710 174.301 -2.591 18933 7680 1 11 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.309 -2.384 18933 7681 1 11 . 1 1 82 82 GLY H H 82 8.044 8.044 8.487 -0.443 18933 7682 1 11 . 1 1 83 83 GLU N N 83 117.203 117.203 119.733 -2.530 18933 7683 1 11 . 1 1 83 83 GLU C C 83 178.695 178.695 177.724 0.971 18933 7684 1 11 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.360 1.617 18933 7685 1 11 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.816 0.021 18933 7686 1 11 . 1 1 83 83 GLU H H 83 8.296 8.296 8.496 -0.200 18933 7687 1 11 . 1 1 84 84 ARG N N 84 113.818 113.818 119.201 -5.383 18933 7688 1 11 . 1 1 84 84 ARG C C 84 175.877 175.877 175.131 0.746 18933 7689 1 11 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.548 -1.817 18933 7690 1 11 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.629 1.666 18933 7691 1 11 . 1 1 84 84 ARG H H 84 8.342 8.342 7.959 0.383 18933 7692 1 11 . 1 1 85 85 LYS N N 85 119.354 119.354 121.604 -2.250 18933 7693 1 11 . 1 1 85 85 LYS C C 85 174.516 174.516 174.308 0.208 18933 7694 1 11 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.560 -0.820 18933 7695 1 11 . 1 1 85 85 LYS CB C 85 34.844 34.844 34.418 0.426 18933 7696 1 11 . 1 1 85 85 LYS H H 85 6.822 6.822 7.624 -0.802 18933 7697 1 11 . 1 1 86 86 CYS N N 86 125.928 125.928 124.817 1.111 18933 7698 1 11 . 1 1 86 86 CYS C C 86 171.600 171.600 173.023 -1.423 18933 7699 1 11 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.955 -2.328 18933 7700 1 11 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.556 -0.212 18933 7701 1 11 . 1 1 86 86 CYS H H 86 9.084 9.084 9.363 -0.279 18933 7702 1 11 . 1 1 87 87 VAL N N 87 126.612 126.612 125.755 0.857 18933 7703 1 11 . 1 1 87 87 VAL C C 87 174.431 174.431 174.643 -0.212 18933 7704 1 11 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.660 -0.343 18933 7705 1 11 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.008 1.188 18933 7706 1 11 . 1 1 87 87 VAL H H 87 8.705 8.705 8.831 -0.126 18933 7707 1 11 . 1 1 88 88 LEU N N 88 127.748 127.748 123.374 4.374 18933 7708 1 11 . 1 1 88 88 LEU C C 88 175.227 175.227 174.489 0.738 18933 7709 1 11 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.698 -0.178 18933 7710 1 11 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.004 -1.399 18933 7711 1 11 . 1 1 88 88 LEU H H 88 9.417 9.417 8.560 0.857 18933 7712 1 11 . 1 1 89 89 PHE N N 89 120.981 120.981 118.703 2.278 18933 7713 1 11 . 1 1 89 89 PHE C C 89 176.906 176.906 176.094 0.812 18933 7714 1 11 . 1 1 89 89 PHE CA C 89 55.587 55.587 55.866 -0.279 18933 7715 1 11 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.207 -2.306 18933 7716 1 11 . 1 1 89 89 PHE H H 89 8.937 8.937 8.459 0.478 18933 7717 1 11 . 1 1 90 90 ILE N N 90 119.928 119.928 118.128 1.800 18933 7718 1 11 . 1 1 90 90 ILE C C 90 173.781 173.781 174.954 -1.173 18933 7719 1 11 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.754 -1.100 18933 7720 1 11 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.772 0.840 18933 7721 1 11 . 1 1 90 90 ILE H H 90 9.230 9.230 8.971 0.259 18933 7722 1 11 . 1 1 91 91 GLU N N 91 124.339 124.339 124.580 -0.241 18933 7723 1 11 . 1 1 91 91 GLU C C 91 175.607 175.607 175.334 0.273 18933 7724 1 11 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.698 -0.079 18933 7725 1 11 . 1 1 91 91 GLU CB C 91 29.837 29.837 33.258 -3.421 18933 7726 1 11 . 1 1 91 91 GLU H H 91 8.175 8.175 9.046 -0.871 18933 7727 1 11 . 1 1 92 92 TRP N N 92 127.516 127.516 124.822 2.694 18933 7728 1 11 . 1 1 92 92 TRP C C 92 175.203 175.203 175.830 -0.627 18933 7729 1 11 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.564 1.669 18933 7730 1 11 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.814 0.847 18933 7731 1 11 . 1 1 92 92 TRP H H 92 9.306 9.306 8.768 0.538 18933 7732 1 11 . 1 1 93 93 GLU N N 93 127.834 127.834 126.227 1.607 18933 7733 1 11 . 1 1 93 93 GLU C C 93 175.668 175.668 176.368 -0.700 18933 7734 1 11 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.432 -0.554 18933 7735 1 11 . 1 1 93 93 GLU CB C 93 26.034 26.034 28.661 -2.627 18933 7736 1 11 . 1 1 93 93 GLU H H 93 8.796 8.796 9.183 -0.387 18933 7737 1 11 . 1 1 94 94 LYS N N 94 108.931 108.931 111.951 -3.020 18933 7738 1 11 . 1 1 94 94 LYS C C 94 175.423 175.423 175.612 -0.189 18933 7739 1 11 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.842 -0.399 18933 7740 1 11 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.228 -2.595 18933 7741 1 11 . 1 1 94 94 LYS H H 94 8.498 8.498 8.643 -0.145 18933 7742 1 11 . 1 1 95 95 LYS N N 95 121.737 121.737 120.352 1.385 18933 7743 1 11 . 1 1 95 95 LYS C C 95 174.443 174.443 175.088 -0.645 18933 7744 1 11 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.022 -1.605 18933 7745 1 11 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.809 -0.346 18933 7746 1 11 . 1 1 95 95 LYS H H 95 7.761 7.761 7.663 0.098 18933 7747 1 11 . 1 1 96 96 THR N N 96 116.067 116.067 116.239 -0.172 18933 7748 1 11 . 1 1 96 96 THR C C 96 174.296 174.296 173.689 0.607 18933 7749 1 11 . 1 1 96 96 THR CA C 96 61.115 61.115 61.179 -0.064 18933 7750 1 11 . 1 1 96 96 THR CB C 96 69.450 69.450 71.722 -2.272 18933 7751 1 11 . 1 1 96 96 THR H H 96 7.761 7.761 8.405 -0.644 18933 7752 1 11 . 1 1 97 97 TYR N N 97 124.229 124.229 123.963 0.266 18933 7753 1 11 . 1 1 97 97 TYR C C 97 173.536 173.536 173.653 -0.117 18933 7754 1 11 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.482 -0.532 18933 7755 1 11 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.909 -1.727 18933 7756 1 11 . 1 1 97 97 TYR H H 97 9.018 9.018 9.383 -0.365 18933 7757 1 11 . 1 1 98 98 GLN N N 98 123.435 123.435 124.030 -0.595 18933 7758 1 11 . 1 1 98 98 GLN C C 98 173.266 173.266 174.011 -0.745 18933 7759 1 11 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.823 -0.680 18933 7760 1 11 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.214 -0.201 18933 7761 1 11 . 1 1 98 98 GLN H H 98 8.781 8.781 8.983 -0.202 18933 7762 1 11 . 1 1 99 99 LEU N N 99 130.119 130.119 127.783 2.336 18933 7763 1 11 . 1 1 99 99 LEU C C 99 173.867 173.867 174.270 -0.403 18933 7764 1 11 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.432 -0.912 18933 7765 1 11 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.643 -1.038 18933 7766 1 11 . 1 1 99 99 LEU H H 99 9.104 9.104 8.693 0.411 18933 7767 1 11 . 1 1 100 100 ASP N N 100 125.182 125.182 127.504 -2.322 18933 7768 1 11 . 1 1 100 100 ASP C C 100 172.837 172.837 174.343 -1.506 18933 7769 1 11 . 1 1 100 100 ASP CA C 100 51.754 51.754 54.430 -2.676 18933 7770 1 11 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.163 -3.819 18933 7771 1 11 . 1 1 100 100 ASP H H 100 9.089 9.089 8.890 0.199 18933 7772 1 11 . 1 1 101 101 LEU N N 101 121.174 121.174 127.292 -6.118 18933 7773 1 11 . 1 1 101 101 LEU C C 101 174.529 174.529 174.680 -0.151 18933 7774 1 11 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.756 -1.841 18933 7775 1 11 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.648 -1.740 18933 7776 1 11 . 1 1 101 101 LEU H H 101 8.458 8.458 9.076 -0.618 18933 7777 1 11 . 1 1 102 102 PHE N N 102 119.464 119.464 124.679 -5.215 18933 7778 1 11 . 1 1 102 102 PHE C C 102 176.293 176.293 175.049 1.244 18933 7779 1 11 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.251 -1.197 18933 7780 1 11 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.430 -0.550 18933 7781 1 11 . 1 1 102 102 PHE H H 102 8.281 8.281 9.287 -1.006 18933 7782 1 11 . 1 1 103 103 THR N N 103 108.576 108.576 116.677 -8.101 18933 7783 1 11 . 1 1 103 103 THR C C 103 174.933 174.933 173.392 1.541 18933 7784 1 11 . 1 1 103 103 THR CA C 103 57.726 57.726 60.322 -2.596 18933 7785 1 11 . 1 1 103 103 THR CB C 103 71.288 71.288 69.802 1.486 18933 7786 1 11 . 1 1 103 103 THR H H 103 7.872 7.872 8.368 -0.496 18933 7787 1 11 . 1 1 104 104 ALA N N 104 122.885 122.885 128.236 -5.351 18933 7788 1 11 . 1 1 104 104 ALA C C 104 175.754 175.754 175.272 0.482 18933 7789 1 11 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.898 0.120 18933 7790 1 11 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.184 0.301 18933 7791 1 11 . 1 1 104 104 ALA H H 104 8.660 8.660 9.270 -0.610 18933 7792 1 11 . 1 1 105 105 LEU N N 105 120.881 120.881 119.029 1.852 18933 7793 1 11 . 1 1 105 105 LEU C C 105 179.504 179.504 179.034 0.470 18933 7794 1 11 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.076 -0.829 18933 7795 1 11 . 1 1 105 105 LEU CB C 105 41.753 41.753 43.860 -2.107 18933 7796 1 11 . 1 1 105 105 LEU H H 105 8.226 8.226 8.374 -0.148 18933 7797 1 11 . 1 1 106 106 ALA N N 106 124.901 124.901 124.541 0.360 18933 7798 1 11 . 1 1 106 106 ALA C C 106 181.269 181.269 179.478 1.791 18933 7799 1 11 . 1 1 106 106 ALA CA C 106 56.313 56.313 55.018 1.295 18933 7800 1 11 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.667 -1.443 18933 7801 1 11 . 1 1 106 106 ALA H H 106 8.392 8.392 8.712 -0.320 18933 7802 1 11 . 1 1 107 107 GLU N N 107 116.409 116.409 115.612 0.797 18933 7803 1 11 . 1 1 107 107 GLU C C 107 177.764 177.764 176.980 0.784 18933 7804 1 11 . 1 1 107 107 GLU CA C 107 58.533 58.533 57.977 0.556 18933 7805 1 11 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.643 -1.707 18933 7806 1 11 . 1 1 107 107 GLU H H 107 9.664 9.664 8.637 1.027 18933 7807 1 11 . 1 1 108 108 GLU N N 108 116.189 116.189 117.921 -1.732 18933 7808 1 11 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.398 -1.255 18933 7809 1 11 . 1 1 108 108 GLU CB C 108 29.837 29.837 29.636 0.201 18933 7810 1 11 . 1 1 108 108 GLU H H 108 7.589 7.589 7.757 -0.168 18933 7811 1 11 . 1 1 109 109 LYS N N 109 119.928 119.928 121.520 -1.592 18933 7812 1 11 . 1 1 109 109 LYS CA C 109 62.851 62.851 60.547 2.304 18933 7813 1 11 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.498 -0.028 18933 7814 1 11 . 1 1 109 109 LYS H H 109 7.514 7.514 7.559 -0.045 18933 7815 1 11 . 1 1 111 111 TYR N N 111 114.930 114.930 119.276 -4.346 18933 7816 1 11 . 1 1 111 111 TYR C C 111 179.504 179.504 177.840 1.664 18933 7817 1 11 . 1 1 111 111 TYR CA C 111 59.017 59.017 60.710 -1.693 18933 7818 1 11 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.529 -1.861 18933 7819 1 11 . 1 1 111 111 TYR H H 111 6.393 6.393 8.484 -2.091 18933 7820 1 11 . 1 1 112 112 ALA N N 112 124.901 124.901 122.069 2.832 18933 7821 1 11 . 1 1 112 112 ALA C C 112 179.173 179.173 179.560 -0.387 18933 7822 1 11 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.480 -0.579 18933 7823 1 11 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.364 -0.252 18933 7824 1 11 . 1 1 112 112 ALA H H 112 8.554 8.554 8.307 0.247 18933 7825 1 11 . 1 1 113 113 ILE N N 113 119.464 119.464 120.099 -0.635 18933 7826 1 11 . 1 1 113 113 ILE C C 113 178.499 178.499 177.695 0.804 18933 7827 1 11 . 1 1 113 113 ILE CA C 113 66.281 66.281 63.837 2.444 18933 7828 1 11 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.806 -0.490 18933 7829 1 11 . 1 1 113 113 ILE H H 113 8.680 8.680 7.546 1.134 18933 7830 1 11 . 1 1 114 114 PHE N N 114 122.922 122.922 122.014 0.908 18933 7831 1 11 . 1 1 114 114 PHE C C 114 178.217 178.217 178.019 0.198 18933 7832 1 11 . 1 1 114 114 PHE CA C 114 61.559 61.559 59.824 1.735 18933 7833 1 11 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.525 0.946 18933 7834 1 11 . 1 1 114 114 PHE H H 114 7.721 7.721 8.810 -1.089 18933 7835 1 11 . 1 1 115 115 HIS N N 115 118.560 118.560 118.909 -0.349 18933 7836 1 11 . 1 1 115 115 HIS C C 115 177.286 177.286 176.892 0.394 18933 7837 1 11 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.554 -0.174 18933 7838 1 11 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.225 1.640 18933 7839 1 11 . 1 1 115 115 HIS H H 115 8.155 8.155 8.249 -0.094 18933 7840 1 11 . 1 1 116 116 PHE N N 116 111.472 111.472 117.688 -6.216 18933 7841 1 11 . 1 1 116 116 PHE C C 116 179.026 179.026 177.173 1.853 18933 7842 1 11 . 1 1 116 116 PHE CA C 116 59.461 59.461 59.983 -0.521 18933 7843 1 11 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.992 -1.803 18933 7844 1 11 . 1 1 116 116 PHE H H 116 8.564 8.564 7.991 0.573 18933 7845 1 11 . 1 1 117 117 THR N N 117 119.012 119.012 111.234 7.778 18933 7846 1 11 . 1 1 117 117 THR C C 117 172.935 172.935 176.413 -3.478 18933 7847 1 11 . 1 1 117 117 THR CA C 117 67.088 67.088 65.133 1.955 18933 7848 1 11 . 1 1 117 117 THR CB C 117 37.126 37.126 69.055 -31.929 18933 7849 1 11 . 1 1 117 117 THR H H 117 7.620 7.620 8.361 -0.741 18933 7850 1 11 . 1 1 118 118 GLY N N 118 107.917 107.917 110.049 -2.132 18933 7851 1 11 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.446 1.722 18933 7852 1 11 . 1 1 118 118 GLY H H 118 6.666 6.666 7.649 -0.983 18933 7853 1 11 . 1 1 121 121 SER N N 121 113.354 113.354 118.539 -5.185 18933 7854 1 11 . 1 1 121 121 SER C C 121 176.061 176.061 176.048 0.013 18933 7855 1 11 . 1 1 121 121 SER CA C 121 61.035 61.035 62.464 -1.429 18933 7856 1 11 . 1 1 121 121 SER H H 121 8.322 8.322 8.242 0.080 18933 7857 1 11 . 1 1 122 122 TYR N N 122 124.681 124.681 122.446 2.235 18933 7858 1 11 . 1 1 122 122 TYR C C 122 176.293 176.293 177.174 -0.881 18933 7859 1 11 . 1 1 122 122 TYR CA C 122 59.057 59.057 61.453 -2.397 18933 7860 1 11 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.415 0.296 18933 7861 1 11 . 1 1 122 122 TYR H H 122 6.514 6.514 8.504 -1.990 18933 7862 1 11 . 1 1 123 123 LEU N N 123 117.997 117.997 119.777 -1.780 18933 7863 1 11 . 1 1 123 123 LEU C C 123 179.774 179.774 178.958 0.816 18933 7864 1 11 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.838 0.040 18933 7865 1 11 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.738 -0.760 18933 7866 1 11 . 1 1 123 123 LEU H H 123 7.428 7.428 7.757 -0.329 18933 7867 1 11 . 1 1 124 124 ILE N N 124 119.012 119.012 120.109 -1.097 18933 7868 1 11 . 1 1 124 124 ILE C C 124 178.830 178.830 177.860 0.970 18933 7869 1 11 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.371 -0.220 18933 7870 1 11 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.328 -0.265 18933 7871 1 11 . 1 1 124 124 ILE H H 124 8.453 8.453 8.406 0.047 18933 7872 1 11 . 1 1 125 125 ARG N N 125 121.174 121.174 120.240 0.934 18933 7873 1 11 . 1 1 125 125 ARG C C 125 179.762 179.762 178.550 1.212 18933 7874 1 11 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.972 0.085 18933 7875 1 11 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.410 -0.460 18933 7876 1 11 . 1 1 125 125 ARG H H 125 7.004 7.004 8.092 -1.088 18933 7877 1 11 . 1 1 126 126 ILE N N 126 122.299 122.299 120.907 1.392 18933 7878 1 11 . 1 1 126 126 ILE C C 126 178.352 178.352 177.932 0.420 18933 7879 1 11 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.529 -2.324 18933 7880 1 11 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.130 -1.715 18933 7881 1 11 . 1 1 126 126 ILE H H 126 7.579 7.579 7.802 -0.223 18933 7882 1 11 . 1 1 127 127 ARG N N 127 119.354 119.354 119.691 -0.337 18933 7883 1 11 . 1 1 127 127 ARG C C 127 179.786 179.786 178.987 0.799 18933 7884 1 11 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.841 0.145 18933 7885 1 11 . 1 1 127 127 ARG CB C 127 29.330 29.330 29.960 -0.630 18933 7886 1 11 . 1 1 127 127 ARG H H 127 8.715 8.715 8.181 0.534 18933 7887 1 11 . 1 1 128 128 ALA N N 128 122.873 122.873 120.907 1.966 18933 7888 1 11 . 1 1 128 128 ALA C C 128 180.325 180.325 179.272 1.053 18933 7889 1 11 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.565 0.175 18933 7890 1 11 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.228 -1.067 18933 7891 1 11 . 1 1 128 128 ALA H H 128 7.978 7.978 8.126 -0.147 18933 7892 1 11 . 1 1 129 129 ALA N N 129 121.846 121.846 121.756 0.090 18933 7893 1 11 . 1 1 129 129 ALA C C 129 181.539 181.539 179.912 1.627 18933 7894 1 11 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.771 -0.273 18933 7895 1 11 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.671 -1.193 18933 7896 1 11 . 1 1 129 129 ALA H H 129 7.519 7.519 7.869 -0.350 18933 7897 1 11 . 1 1 130 130 LEU N N 130 119.134 119.134 118.225 0.909 18933 7898 1 11 . 1 1 130 130 LEU C C 130 179.909 179.909 178.912 0.997 18933 7899 1 11 . 1 1 130 130 LEU CA C 130 56.999 56.999 56.978 0.021 18933 7900 1 11 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.835 -1.413 18933 7901 1 11 . 1 1 130 130 LEU H H 130 8.296 8.296 8.694 -0.398 18933 7902 1 11 . 1 1 131 131 LYS N N 131 122.299 122.299 120.226 2.073 18933 7903 1 11 . 1 1 131 131 LYS C C 131 180.289 180.289 178.697 1.592 18933 7904 1 11 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.650 -0.633 18933 7905 1 11 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.188 -0.956 18933 7906 1 11 . 1 1 131 131 LYS H H 131 8.281 8.281 7.748 0.533 18933 7907 1 11 . 1 1 132 132 LYS N N 132 118.743 118.743 117.221 1.522 18933 7908 1 11 . 1 1 132 132 LYS C C 132 177.482 177.482 178.023 -0.541 18933 7909 1 11 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.513 -0.021 18933 7910 1 11 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.381 -1.149 18933 7911 1 11 . 1 1 132 132 LYS H H 132 7.317 7.317 7.706 -0.389 18933 7912 1 11 . 1 1 133 133 LYS N N 133 117.093 117.093 116.961 0.132 18933 7913 1 11 . 1 1 133 133 LYS C C 133 174.614 174.614 176.133 -1.519 18933 7914 1 11 . 1 1 133 133 LYS CA C 133 54.780 54.780 56.111 -1.331 18933 7915 1 11 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.844 -0.662 18933 7916 1 11 . 1 1 133 133 LYS H H 133 7.327 7.327 7.668 -0.341 18933 7917 1 11 . 1 1 134 134 ASN N N 134 113.012 113.012 115.565 -2.553 18933 7918 1 11 . 1 1 134 134 ASN C C 134 173.965 173.965 173.598 0.367 18933 7919 1 11 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.432 -0.136 18933 7920 1 11 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.089 -0.914 18933 7921 1 11 . 1 1 134 134 ASN H H 134 7.938 7.938 7.812 0.126 18933 7922 1 11 . 1 1 135 135 TYR N N 135 115.725 115.725 119.434 -3.709 18933 7923 1 11 . 1 1 135 135 TYR C C 135 176.342 176.342 175.020 1.322 18933 7924 1 11 . 1 1 135 135 TYR CA C 135 55.668 55.668 58.005 -2.337 18933 7925 1 11 . 1 1 135 135 TYR CB C 135 41.563 41.563 39.895 1.668 18933 7926 1 11 . 1 1 135 135 TYR H H 135 7.741 7.741 8.464 -0.723 18933 7927 1 11 . 1 1 136 136 LYS N N 136 122.641 122.641 124.652 -2.011 18933 7928 1 11 . 1 1 136 136 LYS C C 136 173.475 173.475 174.697 -1.222 18933 7929 1 11 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.780 0.121 18933 7930 1 11 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.519 -1.801 18933 7931 1 11 . 1 1 136 136 LYS H H 136 9.296 9.296 8.707 0.589 18933 7932 1 11 . 1 1 137 137 LEU N N 137 127.284 127.284 123.524 3.760 18933 7933 1 11 . 1 1 137 137 LEU C C 137 175.423 175.423 175.982 -0.559 18933 7934 1 11 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.335 -0.209 18933 7935 1 11 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.006 3.740 18933 7936 1 11 . 1 1 137 137 LEU H H 137 8.776 8.776 8.512 0.264 18933 7937 1 11 . 1 1 138 138 ASN N N 138 125.818 125.818 119.102 6.716 18933 7938 1 11 . 1 1 138 138 ASN C C 138 174.933 174.933 175.623 -0.690 18933 7939 1 11 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.916 -0.799 18933 7940 1 11 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.216 -4.710 18933 7941 1 11 . 1 1 138 138 ASN H H 138 8.811 8.811 8.295 0.516 18933 7942 1 11 . 1 1 139 139 GLN N N 139 116.861 116.861 119.162 -2.301 18933 7943 1 11 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.444 -1.606 18933 7944 1 11 . 1 1 139 139 GLN CB C 139 25.717 25.717 29.029 -3.312 18933 7945 1 11 . 1 1 139 139 GLN H H 139 9.220 9.220 8.932 0.288 18933 7946 1 11 . 1 1 140 140 TYR N N 140 120.600 120.600 120.376 0.224 18933 7947 1 11 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.525 -0.768 18933 7948 1 11 . 1 1 140 140 TYR CB C 140 37.570 37.570 37.598 -0.028 18933 7949 1 11 . 1 1 140 140 TYR H H 140 8.549 8.549 8.061 0.488 18933 7950 1 11 . 1 1 141 141 GLY N N 141 105.986 105.986 108.276 -2.290 18933 7951 1 11 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.626 -0.782 18933 7952 1 11 . 1 1 141 141 GLY H H 141 7.186 7.186 7.902 -0.716 18933 7953 1 11 . 1 1 142 142 LEU N N 142 120.038 120.038 117.145 2.893 18933 7954 1 11 . 1 1 142 142 LEU C C 142 173.340 173.340 176.105 -2.765 18933 7955 1 11 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.352 -0.832 18933 7956 1 11 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.413 0.938 18933 7957 1 11 . 1 1 142 142 LEU H H 142 7.539 7.539 8.282 -0.743 18933 7958 1 11 . 1 1 143 143 PHE N N 143 124.229 124.229 119.637 4.592 18933 7959 1 11 . 1 1 143 143 PHE C C 143 173.977 173.977 175.189 -1.212 18933 7960 1 11 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.216 -2.575 18933 7961 1 11 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.426 4.242 18933 7962 1 11 . 1 1 143 143 PHE H H 143 9.084 9.084 8.862 0.222 18933 7963 1 11 . 1 1 144 144 LYS N N 144 127.858 127.858 122.868 4.990 18933 7964 1 11 . 1 1 144 144 LYS C C 144 175.092 175.092 176.745 -1.653 18933 7965 1 11 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.459 4.397 18933 7966 1 11 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.835 3.749 18933 7967 1 11 . 1 1 144 144 LYS H H 144 9.281 9.281 8.889 0.392 18933 7968 1 11 . 1 1 145 145 ASN N N 145 128.188 128.188 126.082 2.106 18933 7969 1 11 . 1 1 145 145 ASN C C 145 175.779 175.779 174.782 0.997 18933 7970 1 11 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.563 3.163 18933 7971 1 11 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.806 -3.152 18933 7972 1 11 . 1 1 145 145 ASN H H 145 9.205 9.205 9.178 0.027 18933 7973 1 11 . 1 1 146 146 GLN N N 146 129.655 129.655 110.153 19.502 18933 7974 1 11 . 1 1 146 146 GLN C C 146 175.399 175.399 174.243 1.156 18933 7975 1 11 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.128 1.687 18933 7976 1 11 . 1 1 146 146 GLN CB C 146 32.626 32.626 27.595 5.031 18933 7977 1 11 . 1 1 146 146 GLN H H 146 8.983 8.983 8.710 0.273 18933 7978 1 11 . 1 1 147 147 THR N N 147 117.936 117.936 115.259 2.677 18933 7979 1 11 . 1 1 147 147 THR C C 147 173.254 173.254 173.315 -0.061 18933 7980 1 11 . 1 1 147 147 THR CA C 147 61.721 61.721 61.594 0.127 18933 7981 1 11 . 1 1 147 147 THR CB C 147 70.274 70.274 70.057 0.217 18933 7982 1 11 . 1 1 147 147 THR H H 147 8.029 8.029 7.766 0.263 18933 7983 1 11 . 1 1 148 148 LEU N N 148 130.681 130.681 130.723 -0.042 18933 7984 1 11 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.321 0.145 18933 7985 1 11 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.701 -1.012 18933 7986 1 11 . 1 1 148 148 LEU H H 148 8.635 8.635 8.934 -0.299 18933 7987 1 11 . 1 1 149 149 VAL N N 149 130.803 130.803 123.905 6.898 18933 7988 1 11 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.192 0.986 18933 7989 1 11 . 1 1 149 149 VAL CB C 149 31.675 31.675 33.585 -1.910 18933 7990 1 11 . 1 1 149 149 VAL H H 149 8.968 8.968 9.142 -0.174 18933 7991 1 11 . 1 1 151 151 LEU N N 151 124.290 124.290 120.476 3.814 18933 7992 1 11 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.285 -2.272 18933 7993 1 11 . 1 1 151 151 LEU CB C 151 44.098 44.098 40.836 3.262 18933 7994 1 11 . 1 1 151 151 LEU H H 151 7.872 7.872 8.112 -0.240 18933 7995 1 11 . 1 1 153 153 ILE N N 153 114.943 114.943 115.330 -0.387 18933 7996 1 11 . 1 1 153 153 ILE C C 153 175.877 175.877 175.311 0.566 18933 7997 1 11 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.725 -0.031 18933 7998 1 11 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.336 1.353 18933 7999 1 11 . 1 1 153 153 ILE H H 153 7.125 7.125 7.780 -0.655 18933 8000 1 11 . 1 1 154 154 THR N N 154 111.766 111.766 110.682 1.084 18933 8001 1 11 . 1 1 154 154 THR C C 154 174.945 174.945 174.565 0.380 18933 8002 1 11 . 1 1 154 154 THR CA C 154 62.124 62.124 62.784 -0.660 18933 8003 1 11 . 1 1 154 154 THR CB C 154 70.718 70.718 69.614 1.105 18933 8004 1 11 . 1 1 154 154 THR H H 154 9.286 9.286 8.374 0.912 18933 8005 1 11 . 1 1 155 155 THR N N 155 111.766 111.766 112.199 -0.433 18933 8006 1 11 . 1 1 155 155 THR CA C 155 58.936 58.936 59.913 -0.977 18933 8007 1 11 . 1 1 155 155 THR CB C 155 72.683 72.683 71.936 0.747 18933 8008 1 11 . 1 1 155 155 THR H H 155 7.645 7.645 7.326 0.319 18933 8009 1 11 . 1 1 157 157 LYS N N 157 119.464 119.464 118.749 0.715 18933 8010 1 11 . 1 1 157 157 LYS C C 157 178.781 178.781 178.730 0.051 18933 8011 1 11 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.742 0.284 18933 8012 1 11 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.830 -0.408 18933 8013 1 11 . 1 1 157 157 LYS H H 157 8.175 8.175 8.176 -0.001 18933 8014 1 11 . 1 1 158 158 GLU N N 158 118.340 118.340 118.226 0.114 18933 8015 1 11 . 1 1 158 158 GLU C C 158 178.867 178.867 179.104 -0.237 18933 8016 1 11 . 1 1 158 158 GLU CA C 158 58.492 58.492 59.109 -0.617 18933 8017 1 11 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.606 0.724 18933 8018 1 11 . 1 1 158 158 GLU H H 158 7.519 7.519 8.170 -0.651 18933 8019 1 11 . 1 1 159 159 LEU N N 159 120.710 120.710 122.170 -1.460 18933 8020 1 11 . 1 1 159 159 LEU C C 159 176.526 176.526 178.102 -1.576 18933 8021 1 11 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.398 -0.228 18933 8022 1 11 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.835 -1.920 18933 8023 1 11 . 1 1 159 159 LEU H H 159 7.524 7.524 7.753 -0.229 18933 8024 1 11 . 1 1 160 160 ILE N N 160 118.217 118.217 118.294 -0.077 18933 8025 1 11 . 1 1 160 160 ILE C C 160 177.213 177.213 177.893 -0.680 18933 8026 1 11 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.686 -0.656 18933 8027 1 11 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.260 0.246 18933 8028 1 11 . 1 1 160 160 ILE H H 160 7.741 7.741 7.911 -0.170 18933 8029 1 11 . 1 1 161 161 LYS N N 161 118.450 118.450 120.778 -2.328 18933 8030 1 11 . 1 1 161 161 LYS C C 161 180.999 180.999 179.585 1.414 18933 8031 1 11 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.587 -0.772 18933 8032 1 11 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.232 -1.254 18933 8033 1 11 . 1 1 161 161 LYS H H 161 7.382 7.382 8.088 -0.706 18933 8034 1 11 . 1 1 162 162 GLU N N 162 121.846 121.846 120.525 1.321 18933 8035 1 11 . 1 1 162 162 GLU C C 162 178.818 178.818 178.366 0.452 18933 8036 1 11 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.450 -0.401 18933 8037 1 11 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.297 -1.361 18933 8038 1 11 . 1 1 162 162 GLU H H 162 8.210 8.210 7.811 0.399 18933 8039 1 11 . 1 1 163 163 LEU N N 163 116.751 116.751 115.136 1.615 18933 8040 1 11 . 1 1 163 163 LEU C C 163 176.784 176.784 177.343 -0.559 18933 8041 1 11 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.054 -0.032 18933 8042 1 11 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.674 -0.365 18933 8043 1 11 . 1 1 163 163 LEU H H 163 7.796 7.796 7.389 0.407 18933 8044 1 11 . 1 1 164 164 GLY N N 164 104.849 104.849 105.730 -0.881 18933 8045 1 11 . 1 1 164 164 GLY C C 164 174.492 174.492 173.804 0.688 18933 8046 1 11 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.508 -0.776 18933 8047 1 11 . 1 1 164 164 GLY H H 164 7.589 7.589 7.541 0.048 18933 8048 1 11 . 1 1 165 165 PHE N N 165 118.902 118.902 119.235 -0.333 18933 8049 1 11 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.216 -0.548 18933 8050 1 11 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.747 -2.262 18933 8051 1 11 . 1 1 165 165 PHE H H 165 7.251 7.251 7.863 -0.612 18933 8052 1 11 . 1 1 166 166 THR N N 166 117.093 117.093 116.640 0.453 18933 8053 1 11 . 1 1 166 166 THR CA C 166 62.245 62.245 61.373 0.872 18933 8054 1 11 . 1 1 166 166 THR CB C 166 69.323 69.323 69.051 0.272 18933 8055 1 11 . 1 1 166 166 THR H H 166 8.407 8.407 8.380 0.027 18933 8056 1 11 . 1 1 168 168 ARG N N 168 127.431 127.431 120.378 7.053 18933 8057 1 11 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.630 -2.392 18933 8058 1 11 . 1 1 168 168 ARG CB C 168 31.992 31.992 32.343 -0.351 18933 8059 1 11 . 1 1 168 168 ARG H H 168 7.160 7.160 8.543 -1.383 18933 8060 1 11 . 1 1 171 171 LYS N N 171 113.574 113.574 117.684 -4.110 18933 8061 1 11 . 1 1 171 171 LYS C C 171 176.416 176.416 177.154 -0.738 18933 8062 1 11 . 1 1 171 171 LYS CA C 171 57.605 57.605 57.634 -0.029 18933 8063 1 11 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.616 0.314 18933 8064 1 11 . 1 1 171 171 LYS H H 171 8.210 8.210 8.277 -0.067 18933 8065 1 11 . 1 1 172 172 LYS N N 172 117.313 117.313 118.507 -1.194 18933 8066 1 11 . 1 1 172 172 LYS C C 172 175.717 175.717 176.291 -0.574 18933 8067 1 11 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.869 -2.694 18933 8068 1 11 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.631 -1.019 18933 8069 1 11 . 1 1 172 172 LYS H H 172 7.761 7.761 7.497 0.264 18933 8070 1 11 . 1 1 173 173 ARG N N 173 122.056 122.056 117.898 4.158 18933 8071 1 11 . 1 1 173 173 ARG C C 173 172.850 172.850 175.271 -2.421 18933 8072 1 11 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.250 0.628 18933 8073 1 11 . 1 1 173 173 ARG CB C 173 28.506 28.506 27.666 0.840 18933 8074 1 11 . 1 1 173 173 ARG H H 173 6.885 6.885 7.470 -0.585 18933 8075 1 12 . 1 1 2 2 LEU N N 2 122.812 122.812 123.991 -1.179 18933 8076 1 12 . 1 1 2 2 LEU C C 2 175.742 175.742 176.155 -0.413 18933 8077 1 12 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.999 0.135 18933 8078 1 12 . 1 1 2 2 LEU CB C 2 42.842 42.842 45.356 -2.514 18933 8079 1 12 . 1 1 2 2 LEU H H 2 8.756 8.756 8.547 0.209 18933 8080 1 12 . 1 1 3 3 THR N N 3 113.000 113.000 113.231 -0.231 18933 8081 1 12 . 1 1 3 3 THR C C 3 175.938 175.938 175.374 0.564 18933 8082 1 12 . 1 1 3 3 THR CA C 3 60.550 60.550 60.470 0.080 18933 8083 1 12 . 1 1 3 3 THR CB C 3 70.781 70.781 70.562 0.219 18933 8084 1 12 . 1 1 3 3 THR H H 3 8.428 8.428 8.068 0.360 18933 8085 1 12 . 1 1 4 4 LEU N N 4 122.531 122.531 123.105 -0.574 18933 8086 1 12 . 1 1 4 4 LEU C C 4 178.463 178.463 178.320 0.143 18933 8087 1 12 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.857 -0.728 18933 8088 1 12 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.065 -2.531 18933 8089 1 12 . 1 1 4 4 LEU H H 4 7.731 7.731 7.879 -0.148 18933 8090 1 12 . 1 1 5 5 ILE N N 5 115.505 115.505 117.109 -1.604 18933 8091 1 12 . 1 1 5 5 ILE C C 5 178.573 178.573 177.691 0.882 18933 8092 1 12 . 1 1 5 5 ILE CA C 5 63.738 63.738 65.008 -1.270 18933 8093 1 12 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.335 -0.463 18933 8094 1 12 . 1 1 5 5 ILE H H 5 7.645 7.645 8.157 -0.512 18933 8095 1 12 . 1 1 6 6 GLN N N 6 121.626 121.626 119.361 2.265 18933 8096 1 12 . 1 1 6 6 GLN C C 6 179.014 179.014 178.763 0.251 18933 8097 1 12 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.144 -0.813 18933 8098 1 12 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.609 0.580 18933 8099 1 12 . 1 1 6 6 GLN H H 6 7.645 7.645 8.045 -0.400 18933 8100 1 12 . 1 1 7 7 GLY N N 7 107.684 107.684 106.922 0.762 18933 8101 1 12 . 1 1 7 7 GLY C C 7 174.749 174.749 176.332 -1.583 18933 8102 1 12 . 1 1 7 7 GLY CA C 7 46.790 46.790 47.074 -0.284 18933 8103 1 12 . 1 1 7 7 GLY H H 7 8.660 8.660 8.118 0.542 18933 8104 1 12 . 1 1 8 8 LYS N N 8 120.942 120.942 122.428 -1.486 18933 8105 1 12 . 1 1 8 8 LYS C C 8 179.455 179.455 178.754 0.701 18933 8106 1 12 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.113 0.792 18933 8107 1 12 . 1 1 8 8 LYS CB C 8 31.422 31.422 31.923 -0.501 18933 8108 1 12 . 1 1 8 8 LYS H H 8 8.518 8.518 7.638 0.880 18933 8109 1 12 . 1 1 9 9 LYS N N 9 120.710 120.710 119.526 1.184 18933 8110 1 12 . 1 1 9 9 LYS C C 9 179.823 179.823 179.192 0.631 18933 8111 1 12 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.334 0.288 18933 8112 1 12 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.249 -0.954 18933 8113 1 12 . 1 1 9 9 LYS H H 9 7.731 7.731 8.172 -0.441 18933 8114 1 12 . 1 1 10 10 ILE N N 10 121.345 121.345 120.285 1.060 18933 8115 1 12 . 1 1 10 10 ILE C C 10 177.789 177.789 178.144 -0.355 18933 8116 1 12 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.896 -1.431 18933 8117 1 12 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.197 -1.832 18933 8118 1 12 . 1 1 10 10 ILE H H 10 7.711 7.711 8.266 -0.555 18933 8119 1 12 . 1 1 11 11 VAL N N 11 120.258 120.258 120.067 0.191 18933 8120 1 12 . 1 1 11 11 VAL C C 11 177.372 177.372 177.847 -0.475 18933 8121 1 12 . 1 1 11 11 VAL CA C 11 67.451 67.451 66.940 0.511 18933 8122 1 12 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.507 -0.973 18933 8123 1 12 . 1 1 11 11 VAL H H 11 7.918 7.918 8.420 -0.502 18933 8124 1 12 . 1 1 12 12 ASN N N 12 116.971 116.971 117.928 -0.957 18933 8125 1 12 . 1 1 12 12 ASN C C 12 177.445 177.445 178.216 -0.771 18933 8126 1 12 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.303 -0.191 18933 8127 1 12 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.529 -0.896 18933 8128 1 12 . 1 1 12 12 ASN H H 12 7.993 7.993 8.740 -0.747 18933 8129 1 12 . 1 1 13 13 HIS N N 13 120.258 120.258 120.537 -0.279 18933 8130 1 12 . 1 1 13 13 HIS C C 13 177.862 177.862 177.725 0.137 18933 8131 1 12 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.096 0.001 18933 8132 1 12 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.689 0.543 18933 8133 1 12 . 1 1 13 13 HIS H H 13 7.741 7.741 8.339 -0.598 18933 8134 1 12 . 1 1 14 14 LEU N N 14 116.641 116.641 119.645 -3.004 18933 8135 1 12 . 1 1 14 14 LEU C C 14 179.186 179.186 178.332 0.854 18933 8136 1 12 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.302 -1.545 18933 8137 1 12 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.596 -0.477 18933 8138 1 12 . 1 1 14 14 LEU H H 14 8.221 8.221 8.504 -0.283 18933 8139 1 12 . 1 1 15 15 ARG N N 15 115.957 115.957 114.850 1.107 18933 8140 1 12 . 1 1 15 15 ARG C C 15 176.330 176.330 178.164 -1.834 18933 8141 1 12 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.604 1.099 18933 8142 1 12 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.506 -1.429 18933 8143 1 12 . 1 1 15 15 ARG H H 15 7.968 7.968 8.306 -0.338 18933 8144 1 12 . 1 1 16 16 SER N N 16 109.395 109.395 114.987 -5.592 18933 8145 1 12 . 1 1 16 16 SER C C 16 176.024 176.024 174.979 1.045 18933 8146 1 12 . 1 1 16 16 SER CA C 16 57.282 57.282 60.109 -2.827 18933 8147 1 12 . 1 1 16 16 SER CB C 16 63.683 63.683 63.640 0.043 18933 8148 1 12 . 1 1 16 16 SER H H 16 6.963 6.963 7.426 -0.463 18933 8149 1 12 . 1 1 17 17 ARG N N 17 122.775 122.775 121.842 0.933 18933 8150 1 12 . 1 1 17 17 ARG C C 17 174.590 174.590 173.897 0.693 18933 8151 1 12 . 1 1 17 17 ARG CA C 17 56.273 56.273 55.038 1.235 18933 8152 1 12 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.408 1.394 18933 8153 1 12 . 1 1 17 17 ARG H H 17 7.781 7.781 8.226 -0.445 18933 8154 1 12 . 1 1 18 18 LEU N N 18 122.421 122.421 125.787 -3.366 18933 8155 1 12 . 1 1 18 18 LEU C C 18 176.281 176.281 174.085 2.196 18933 8156 1 12 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.431 0.349 18933 8157 1 12 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.933 -3.722 18933 8158 1 12 . 1 1 18 18 LEU H H 18 8.650 8.650 7.679 0.971 18933 8159 1 12 . 1 1 19 19 ALA N N 19 126.441 126.441 126.719 -0.278 18933 8160 1 12 . 1 1 19 19 ALA C C 19 173.904 173.904 174.880 -0.976 18933 8161 1 12 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.651 -0.785 18933 8162 1 12 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.223 0.642 18933 8163 1 12 . 1 1 19 19 ALA H H 19 8.609 8.609 8.931 -0.322 18933 8164 1 12 . 1 1 20 20 PHE N N 20 114.600 114.600 119.087 -4.487 18933 8165 1 12 . 1 1 20 20 PHE C C 20 172.592 172.592 173.937 -1.345 18933 8166 1 12 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.976 0.813 18933 8167 1 12 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.575 -0.886 18933 8168 1 12 . 1 1 20 20 PHE H H 20 8.801 8.801 9.050 -0.249 18933 8169 1 12 . 1 1 21 21 GLU N N 21 122.873 122.873 123.223 -0.350 18933 8170 1 12 . 1 1 21 21 GLU C C 21 174.872 174.872 175.193 -0.321 18933 8171 1 12 . 1 1 21 21 GLU CA C 21 55.062 55.062 55.084 -0.022 18933 8172 1 12 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.343 -0.618 18933 8173 1 12 . 1 1 21 21 GLU H H 21 7.847 7.847 9.146 -1.299 18933 8174 1 12 . 1 1 22 22 TYR N N 22 126.270 126.270 126.585 -0.315 18933 8175 1 12 . 1 1 22 22 TYR C C 22 174.872 174.872 174.705 0.167 18933 8176 1 12 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.711 -0.963 18933 8177 1 12 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.101 -0.996 18933 8178 1 12 . 1 1 22 22 TYR H H 22 8.806 8.806 9.206 -0.400 18933 8179 1 12 . 1 1 23 23 ASN N N 23 128.420 128.420 126.179 2.241 18933 8180 1 12 . 1 1 23 23 ASN C C 23 175.435 175.435 175.177 0.258 18933 8181 1 12 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.624 -0.619 18933 8182 1 12 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.558 -1.193 18933 8183 1 12 . 1 1 23 23 ASN H H 23 8.943 8.943 9.096 -0.153 18933 8184 1 12 . 1 1 24 24 GLY N N 24 104.067 104.067 102.995 1.072 18933 8185 1 12 . 1 1 24 24 GLY C C 24 173.707 173.707 173.863 -0.156 18933 8186 1 12 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.939 -0.005 18933 8187 1 12 . 1 1 24 24 GLY H H 24 8.534 8.534 8.187 0.347 18933 8188 1 12 . 1 1 25 25 GLN N N 25 120.038 120.038 120.173 -0.135 18933 8189 1 12 . 1 1 25 25 GLN C C 25 173.744 173.744 174.939 -1.195 18933 8190 1 12 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.774 -1.447 18933 8191 1 12 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.115 0.546 18933 8192 1 12 . 1 1 25 25 GLN H H 25 7.595 7.595 7.914 -0.319 18933 8193 1 12 . 1 1 26 26 LEU N N 26 124.681 124.681 124.878 -0.197 18933 8194 1 12 . 1 1 26 26 LEU C C 26 175.987 175.987 176.313 -0.326 18933 8195 1 12 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.613 -0.600 18933 8196 1 12 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.315 -1.450 18933 8197 1 12 . 1 1 26 26 LEU H H 26 8.382 8.382 8.579 -0.197 18933 8198 1 12 . 1 1 27 27 ILE N N 27 130.779 130.779 127.328 3.451 18933 8199 1 12 . 1 1 27 27 ILE C C 27 175.215 175.215 174.394 0.821 18933 8200 1 12 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.726 -0.467 18933 8201 1 12 . 1 1 27 27 ILE CB C 27 35.732 35.732 37.874 -2.142 18933 8202 1 12 . 1 1 27 27 ILE H H 27 8.882 8.882 8.927 -0.045 18933 8203 1 12 . 1 1 28 28 LYS N N 28 126.160 126.160 127.503 -1.343 18933 8204 1 12 . 1 1 28 28 LYS C C 28 176.771 176.771 175.676 1.095 18933 8205 1 12 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.949 1.889 18933 8206 1 12 . 1 1 28 28 LYS CB C 28 31.739 31.739 32.986 -1.247 18933 8207 1 12 . 1 1 28 28 LYS H H 28 8.165 8.165 8.315 -0.150 18933 8208 1 12 . 1 1 29 29 ILE N N 29 126.380 126.380 122.275 4.105 18933 8209 1 12 . 1 1 29 29 ILE C C 29 175.877 175.877 174.381 1.496 18933 8210 1 12 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.575 -0.267 18933 8211 1 12 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.364 -2.301 18933 8212 1 12 . 1 1 29 29 ILE H H 29 8.019 8.019 8.702 -0.683 18933 8213 1 12 . 1 1 30 30 LEU N N 30 129.215 129.215 122.399 6.816 18933 8214 1 12 . 1 1 30 30 LEU C C 30 178.867 178.867 178.148 0.719 18933 8215 1 12 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.407 1.212 18933 8216 1 12 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.432 -4.567 18933 8217 1 12 . 1 1 30 30 LEU H H 30 8.917 8.917 8.337 0.580 18933 8218 1 12 . 1 1 31 31 SER N N 31 117.997 117.997 116.522 1.475 18933 8219 1 12 . 1 1 31 31 SER C C 31 177.396 177.396 175.624 1.772 18933 8220 1 12 . 1 1 31 31 SER CA C 31 61.236 61.236 60.653 0.583 18933 8221 1 12 . 1 1 31 31 SER CB C 31 62.035 62.035 63.172 -1.137 18933 8222 1 12 . 1 1 31 31 SER H H 31 8.594 8.594 8.834 -0.240 18933 8223 1 12 . 1 1 32 32 LYS N N 32 116.189 116.189 119.704 -3.515 18933 8224 1 12 . 1 1 32 32 LYS C C 32 176.244 176.244 176.914 -0.670 18933 8225 1 12 . 1 1 32 32 LYS CA C 32 57.403 57.403 57.867 -0.464 18933 8226 1 12 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.528 -2.247 18933 8227 1 12 . 1 1 32 32 LYS H H 32 8.029 8.029 8.154 -0.125 18933 8228 1 12 . 1 1 33 33 ASN N N 33 119.061 119.061 116.273 2.788 18933 8229 1 12 . 1 1 33 33 ASN C C 33 172.384 172.384 173.754 -1.370 18933 8230 1 12 . 1 1 33 33 ASN CA C 33 52.157 52.157 54.082 -1.925 18933 8231 1 12 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.050 -2.783 18933 8232 1 12 . 1 1 33 33 ASN H H 33 7.902 7.902 7.786 0.116 18933 8233 1 12 . 1 1 34 34 ILE N N 34 120.038 120.038 119.566 0.472 18933 8234 1 12 . 1 1 34 34 ILE C C 34 175.607 175.607 174.383 1.224 18933 8235 1 12 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.107 0.443 18933 8236 1 12 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.611 -2.647 18933 8237 1 12 . 1 1 34 34 ILE H H 34 7.443 7.443 7.790 -0.347 18933 8238 1 12 . 1 1 35 35 VAL N N 35 129.435 129.435 125.643 3.792 18933 8239 1 12 . 1 1 35 35 VAL C C 35 175.386 175.386 174.529 0.857 18933 8240 1 12 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.234 -0.208 18933 8241 1 12 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.716 -0.935 18933 8242 1 12 . 1 1 35 35 VAL H H 35 9.533 9.533 8.825 0.708 18933 8243 1 12 . 1 1 36 36 ALA N N 36 130.571 130.571 129.232 1.339 18933 8244 1 12 . 1 1 36 36 ALA C C 36 177.347 177.347 176.431 0.916 18933 8245 1 12 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.606 0.793 18933 8246 1 12 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.730 -0.872 18933 8247 1 12 . 1 1 36 36 ALA H H 36 8.665 8.665 8.472 0.193 18933 8248 1 12 . 1 1 37 37 VAL N N 37 115.395 115.395 120.940 -5.545 18933 8249 1 12 . 1 1 37 37 VAL C C 37 174.455 174.455 175.522 -1.067 18933 8250 1 12 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.074 0.306 18933 8251 1 12 . 1 1 37 37 VAL CB C 37 32.943 32.943 34.905 -1.962 18933 8252 1 12 . 1 1 37 37 VAL H H 37 8.079 8.079 8.261 -0.182 18933 8253 1 12 . 1 1 38 38 GLY N N 38 107.672 107.672 107.679 -0.007 18933 8254 1 12 . 1 1 38 38 GLY C C 38 173.364 173.364 175.559 -2.195 18933 8255 1 12 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.162 0.023 18933 8256 1 12 . 1 1 38 38 GLY H H 38 7.579 7.579 8.105 -0.526 18933 8257 1 12 . 1 1 39 39 SER N N 39 121.052 121.052 119.659 1.393 18933 8258 1 12 . 1 1 39 39 SER C C 39 175.570 175.570 176.537 -0.967 18933 8259 1 12 . 1 1 39 39 SER CA C 39 61.801 61.801 61.812 -0.011 18933 8260 1 12 . 1 1 39 39 SER CB C 39 62.478 62.478 63.388 -0.910 18933 8261 1 12 . 1 1 39 39 SER H H 39 8.953 8.953 8.058 0.895 18933 8262 1 12 . 1 1 40 40 LEU N N 40 121.553 121.553 120.456 1.097 18933 8263 1 12 . 1 1 40 40 LEU C C 40 180.203 180.203 177.670 2.533 18933 8264 1 12 . 1 1 40 40 LEU CA C 40 58.129 58.129 57.736 0.393 18933 8265 1 12 . 1 1 40 40 LEU CB C 40 41.753 41.753 42.048 -0.295 18933 8266 1 12 . 1 1 40 40 LEU H H 40 8.195 8.195 7.235 0.960 18933 8267 1 12 . 1 1 41 41 ARG N N 41 121.956 121.956 117.189 4.767 18933 8268 1 12 . 1 1 41 41 ARG C C 41 177.323 177.323 177.620 -0.297 18933 8269 1 12 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.869 0.462 18933 8270 1 12 . 1 1 41 41 ARG CB C 41 28.443 28.443 30.037 -1.594 18933 8271 1 12 . 1 1 41 41 ARG H H 41 6.873 6.873 7.293 -0.420 18933 8272 1 12 . 1 1 42 42 ARG N N 42 114.600 114.600 116.214 -1.614 18933 8273 1 12 . 1 1 42 42 ARG C C 42 172.911 172.911 175.800 -2.889 18933 8274 1 12 . 1 1 42 42 ARG CA C 42 57.242 57.242 56.971 0.271 18933 8275 1 12 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.909 -1.769 18933 8276 1 12 . 1 1 42 42 ARG H H 42 7.438 7.438 7.968 -0.530 18933 8277 1 12 . 1 1 43 43 GLU N N 43 113.354 113.354 116.963 -3.609 18933 8278 1 12 . 1 1 43 43 GLU C C 43 175.999 175.999 175.360 0.639 18933 8279 1 12 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.548 -0.992 18933 8280 1 12 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.089 -1.752 18933 8281 1 12 . 1 1 43 43 GLU H H 43 7.564 7.564 8.149 -0.585 18933 8282 1 12 . 1 1 44 44 GLU N N 44 119.696 119.696 120.622 -0.926 18933 8283 1 12 . 1 1 44 44 GLU C C 44 175.423 175.423 177.379 -1.956 18933 8284 1 12 . 1 1 44 44 GLU CA C 44 56.838 56.838 57.230 -0.392 18933 8285 1 12 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.438 -1.742 18933 8286 1 12 . 1 1 44 44 GLU H H 44 7.261 7.261 8.492 -1.231 18933 8287 1 12 . 1 1 45 45 LYS N N 45 117.435 117.435 117.605 -0.170 18933 8288 1 12 . 1 1 45 45 LYS C C 45 177.715 177.715 175.074 2.641 18933 8289 1 12 . 1 1 45 45 LYS CA C 45 59.219 59.219 56.871 2.348 18933 8290 1 12 . 1 1 45 45 LYS CB C 45 32.119 32.119 34.033 -1.914 18933 8291 1 12 . 1 1 45 45 LYS H H 45 7.938 7.938 8.033 -0.095 18933 8292 1 12 . 1 1 46 46 MET N N 46 115.847 115.847 118.953 -3.106 18933 8293 1 12 . 1 1 46 46 MET CA C 46 52.520 52.520 53.825 -1.305 18933 8294 1 12 . 1 1 46 46 MET CB C 46 33.450 33.450 34.085 -0.635 18933 8295 1 12 . 1 1 46 46 MET H H 46 7.595 7.595 7.773 -0.178 18933 8296 1 12 . 1 1 47 47 LEU N N 47 121.627 121.627 123.627 -2.000 18933 8297 1 12 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.229 -1.103 18933 8298 1 12 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.528 -0.458 18933 8299 1 12 . 1 1 47 47 LEU H H 47 9.220 9.220 8.933 0.287 18933 8300 1 12 . 1 1 49 49 ASP N N 49 117.093 117.093 118.418 -1.325 18933 8301 1 12 . 1 1 49 49 ASP C C 49 173.340 173.340 174.317 -0.977 18933 8302 1 12 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.273 -1.478 18933 8303 1 12 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.882 -1.876 18933 8304 1 12 . 1 1 49 49 ASP H H 49 7.761 7.761 7.596 0.165 18933 8305 1 12 . 1 1 50 50 VAL N N 50 119.012 119.012 118.687 0.325 18933 8306 1 12 . 1 1 50 50 VAL C C 50 173.070 173.070 173.696 -0.626 18933 8307 1 12 . 1 1 50 50 VAL CA C 50 61.842 61.842 59.497 2.345 18933 8308 1 12 . 1 1 50 50 VAL CB C 50 32.563 32.563 32.865 -0.302 18933 8309 1 12 . 1 1 50 50 VAL H H 50 8.089 8.089 8.360 -0.271 18933 8310 1 12 . 1 1 51 51 ASP N N 51 127.064 127.064 126.102 0.962 18933 8311 1 12 . 1 1 51 51 ASP C C 51 174.565 174.565 175.337 -0.772 18933 8312 1 12 . 1 1 51 51 ASP CA C 51 52.157 52.157 53.046 -0.889 18933 8313 1 12 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.292 -0.652 18933 8314 1 12 . 1 1 51 51 ASP H H 51 8.069 8.069 8.063 0.006 18933 8315 1 12 . 1 1 52 52 LEU N N 52 121.627 121.627 120.046 1.581 18933 8316 1 12 . 1 1 52 52 LEU C C 52 174.063 174.063 174.823 -0.760 18933 8317 1 12 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.436 -0.754 18933 8318 1 12 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.241 -2.890 18933 8319 1 12 . 1 1 52 52 LEU H H 52 8.852 8.852 9.117 -0.265 18933 8320 1 12 . 1 1 53 53 LEU N N 53 123.093 123.093 122.676 0.417 18933 8321 1 12 . 1 1 53 53 LEU CA C 53 55.991 55.991 53.924 2.067 18933 8322 1 12 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.339 -2.206 18933 8323 1 12 . 1 1 53 53 LEU H H 53 9.362 9.362 9.051 0.311 18933 8324 1 12 . 1 1 54 54 ILE N N 54 123.777 123.777 128.849 -5.072 18933 8325 1 12 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.138 -4.076 18933 8326 1 12 . 1 1 54 54 ILE CB C 54 33.070 33.070 39.918 -6.848 18933 8327 1 12 . 1 1 54 54 ILE H H 54 8.907 8.907 9.321 -0.414 18933 8328 1 12 . 1 1 58 58 GLU N N 58 114.710 114.710 116.705 -1.995 18933 8329 1 12 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.655 -1.278 18933 8330 1 12 . 1 1 58 58 GLU CB C 58 31.422 31.422 32.955 -1.533 18933 8331 1 12 . 1 1 58 58 GLU H H 58 6.716 6.716 7.478 -0.762 18933 8332 1 12 . 1 1 61 61 LEU N N 61 115.957 115.957 120.243 -4.286 18933 8333 1 12 . 1 1 61 61 LEU C C 61 178.512 178.512 178.447 0.065 18933 8334 1 12 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.549 -2.769 18933 8335 1 12 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.939 -0.820 18933 8336 1 12 . 1 1 61 61 LEU H H 61 7.307 7.307 7.717 -0.410 18933 8337 1 12 . 1 1 62 62 LEU N N 62 120.038 120.038 119.613 0.425 18933 8338 1 12 . 1 1 62 62 LEU C C 62 177.874 177.874 178.683 -0.809 18933 8339 1 12 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.602 0.334 18933 8340 1 12 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.933 -1.194 18933 8341 1 12 . 1 1 62 62 LEU H H 62 7.327 7.327 8.213 -0.886 18933 8342 1 12 . 1 1 63 63 LYS N N 63 114.600 114.600 116.190 -1.590 18933 8343 1 12 . 1 1 63 63 LYS C C 63 175.460 175.460 177.790 -2.330 18933 8344 1 12 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.966 -1.402 18933 8345 1 12 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.443 -1.718 18933 8346 1 12 . 1 1 63 63 LYS H H 63 7.973 7.973 7.738 0.235 18933 8347 1 12 . 1 1 64 64 HIS N N 64 115.273 115.273 115.238 0.035 18933 8348 1 12 . 1 1 64 64 HIS CA C 64 56.112 56.112 54.529 1.583 18933 8349 1 12 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.269 2.167 18933 8350 1 12 . 1 1 64 64 HIS H H 64 7.544 7.544 7.425 0.119 18933 8351 1 12 . 1 1 65 65 VAL N N 65 118.682 118.682 118.839 -0.157 18933 8352 1 12 . 1 1 65 65 VAL CA C 65 66.038 66.038 63.193 2.845 18933 8353 1 12 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.257 -2.230 18933 8354 1 12 . 1 1 65 65 VAL H H 65 6.787 6.787 7.267 -0.480 18933 8355 1 12 . 1 1 68 68 ASN N N 68 112.108 112.108 117.627 -5.519 18933 8356 1 12 . 1 1 68 68 ASN C C 68 174.884 174.884 174.296 0.588 18933 8357 1 12 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.396 -1.369 18933 8358 1 12 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.366 0.866 18933 8359 1 12 . 1 1 68 68 ASN H H 68 7.009 7.009 8.268 -1.259 18933 8360 1 12 . 1 1 69 69 ILE N N 69 123.325 123.325 123.088 0.237 18933 8361 1 12 . 1 1 69 69 ILE C C 69 174.394 174.394 175.493 -1.099 18933 8362 1 12 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.587 -1.480 18933 8363 1 12 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.529 -0.262 18933 8364 1 12 . 1 1 69 69 ILE H H 69 7.150 7.150 8.143 -0.993 18933 8365 1 12 . 1 1 70 70 ARG N N 70 126.722 126.722 127.939 -1.217 18933 8366 1 12 . 1 1 70 70 ARG C C 70 174.590 174.590 174.172 0.418 18933 8367 1 12 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.828 -1.581 18933 8368 1 12 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.880 -2.508 18933 8369 1 12 . 1 1 70 70 ARG H H 70 8.902 8.902 9.224 -0.322 18933 8370 1 12 . 1 1 71 71 ILE N N 71 119.978 119.978 120.846 -0.868 18933 8371 1 12 . 1 1 71 71 ILE C C 71 175.583 175.583 175.740 -0.157 18933 8372 1 12 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.822 0.002 18933 8373 1 12 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.309 -2.549 18933 8374 1 12 . 1 1 71 71 ILE H H 71 7.491 7.491 8.874 -1.383 18933 8375 1 12 . 1 1 72 72 LYS N N 72 128.530 128.530 125.275 3.255 18933 8376 1 12 . 1 1 72 72 LYS C C 72 177.703 177.703 176.267 1.436 18933 8377 1 12 . 1 1 72 72 LYS CA C 72 57.201 57.201 54.731 2.470 18933 8378 1 12 . 1 1 72 72 LYS CB C 72 31.485 31.485 30.902 0.583 18933 8379 1 12 . 1 1 72 72 LYS H H 72 8.523 8.523 8.550 -0.027 18933 8380 1 12 . 1 1 73 73 GLY N N 73 113.806 113.806 109.952 3.854 18933 8381 1 12 . 1 1 73 73 GLY C C 73 173.781 173.781 172.846 0.935 18933 8382 1 12 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.136 0.685 18933 8383 1 12 . 1 1 73 73 GLY H H 73 8.791 8.791 8.207 0.584 18933 8384 1 12 . 1 1 74 74 LEU N N 74 120.490 120.490 118.574 1.916 18933 8385 1 12 . 1 1 74 74 LEU C C 74 175.840 175.840 173.731 2.109 18933 8386 1 12 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.256 -0.565 18933 8387 1 12 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.389 -1.228 18933 8388 1 12 . 1 1 74 74 LEU H H 74 7.393 7.393 7.259 0.134 18933 8389 1 12 . 1 1 75 75 SER N N 75 120.038 120.038 115.605 4.433 18933 8390 1 12 . 1 1 75 75 SER C C 75 173.205 173.205 173.374 -0.169 18933 8391 1 12 . 1 1 75 75 SER CA C 75 57.887 57.887 57.606 0.281 18933 8392 1 12 . 1 1 75 75 SER CB C 75 63.049 63.049 65.226 -2.177 18933 8393 1 12 . 1 1 75 75 SER H H 75 8.917 8.917 8.185 0.732 18933 8394 1 12 . 1 1 76 76 PHE N N 76 119.586 119.586 118.006 1.580 18933 8395 1 12 . 1 1 76 76 PHE C C 76 173.536 173.536 173.467 0.069 18933 8396 1 12 . 1 1 76 76 PHE CA C 76 55.426 55.426 56.054 -0.628 18933 8397 1 12 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.065 -0.059 18933 8398 1 12 . 1 1 76 76 PHE H H 76 8.003 8.003 8.283 -0.280 18933 8399 1 12 . 1 1 77 77 SER N N 77 114.943 114.943 115.977 -1.034 18933 8400 1 12 . 1 1 77 77 SER C C 77 173.438 173.438 172.277 1.161 18933 8401 1 12 . 1 1 77 77 SER CA C 77 56.152 56.152 56.911 -0.759 18933 8402 1 12 . 1 1 77 77 SER CB C 77 65.204 65.204 66.227 -1.023 18933 8403 1 12 . 1 1 77 77 SER H H 77 8.907 8.907 8.714 0.193 18933 8404 1 12 . 1 1 78 78 VAL N N 78 124.791 124.791 124.426 0.365 18933 8405 1 12 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.317 1.727 18933 8406 1 12 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.976 -2.794 18933 8407 1 12 . 1 1 78 78 VAL H H 78 8.892 8.892 8.285 0.607 18933 8408 1 12 . 1 1 79 79 LYS N N 79 129.667 129.667 130.201 -0.534 18933 8409 1 12 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.713 1.479 18933 8410 1 12 . 1 1 79 79 LYS CB C 79 32.372 32.372 33.648 -1.276 18933 8411 1 12 . 1 1 79 79 LYS H H 79 9.049 9.049 8.742 0.307 18933 8412 1 12 . 1 1 82 82 GLY N N 82 117.263 117.263 113.147 4.116 18933 8413 1 12 . 1 1 82 82 GLY C C 82 171.710 171.710 174.534 -2.824 18933 8414 1 12 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.800 -2.875 18933 8415 1 12 . 1 1 82 82 GLY H H 82 8.044 8.044 8.436 -0.392 18933 8416 1 12 . 1 1 83 83 GLU N N 83 117.203 117.203 122.265 -5.062 18933 8417 1 12 . 1 1 83 83 GLU C C 83 178.695 178.695 177.602 1.093 18933 8418 1 12 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.695 1.282 18933 8419 1 12 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.960 -0.123 18933 8420 1 12 . 1 1 83 83 GLU H H 83 8.296 8.296 8.299 -0.003 18933 8421 1 12 . 1 1 84 84 ARG N N 84 113.818 113.818 118.867 -5.049 18933 8422 1 12 . 1 1 84 84 ARG C C 84 175.877 175.877 175.352 0.525 18933 8423 1 12 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.245 -1.514 18933 8424 1 12 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.100 2.195 18933 8425 1 12 . 1 1 84 84 ARG H H 84 8.342 8.342 7.978 0.364 18933 8426 1 12 . 1 1 85 85 LYS N N 85 119.354 119.354 121.637 -2.283 18933 8427 1 12 . 1 1 85 85 LYS C C 85 174.516 174.516 174.058 0.458 18933 8428 1 12 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.730 -0.990 18933 8429 1 12 . 1 1 85 85 LYS CB C 85 34.844 34.844 34.841 0.003 18933 8430 1 12 . 1 1 85 85 LYS H H 85 6.822 6.822 7.735 -0.913 18933 8431 1 12 . 1 1 86 86 CYS N N 86 125.928 125.928 124.435 1.493 18933 8432 1 12 . 1 1 86 86 CYS C C 86 171.600 171.600 173.175 -1.575 18933 8433 1 12 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.855 -2.228 18933 8434 1 12 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.711 -0.367 18933 8435 1 12 . 1 1 86 86 CYS H H 86 9.084 9.084 9.294 -0.210 18933 8436 1 12 . 1 1 87 87 VAL N N 87 126.612 126.612 125.652 0.960 18933 8437 1 12 . 1 1 87 87 VAL C C 87 174.431 174.431 174.925 -0.494 18933 8438 1 12 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.854 -0.537 18933 8439 1 12 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.220 0.976 18933 8440 1 12 . 1 1 87 87 VAL H H 87 8.705 8.705 8.925 -0.220 18933 8441 1 12 . 1 1 88 88 LEU N N 88 127.748 127.748 123.629 4.119 18933 8442 1 12 . 1 1 88 88 LEU C C 88 175.227 175.227 174.610 0.617 18933 8443 1 12 . 1 1 88 88 LEU CA C 88 52.520 52.520 53.004 -0.484 18933 8444 1 12 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.168 -1.563 18933 8445 1 12 . 1 1 88 88 LEU H H 88 9.417 9.417 8.738 0.679 18933 8446 1 12 . 1 1 89 89 PHE N N 89 120.981 120.981 119.608 1.373 18933 8447 1 12 . 1 1 89 89 PHE C C 89 176.906 176.906 176.056 0.850 18933 8448 1 12 . 1 1 89 89 PHE CA C 89 55.587 55.587 56.195 -0.608 18933 8449 1 12 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.686 -2.785 18933 8450 1 12 . 1 1 89 89 PHE H H 89 8.937 8.937 8.703 0.234 18933 8451 1 12 . 1 1 90 90 ILE N N 90 119.928 119.928 118.339 1.589 18933 8452 1 12 . 1 1 90 90 ILE C C 90 173.781 173.781 174.952 -1.171 18933 8453 1 12 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.806 -1.152 18933 8454 1 12 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.858 0.754 18933 8455 1 12 . 1 1 90 90 ILE H H 90 9.230 9.230 9.060 0.170 18933 8456 1 12 . 1 1 91 91 GLU N N 91 124.339 124.339 124.214 0.125 18933 8457 1 12 . 1 1 91 91 GLU C C 91 175.607 175.607 175.225 0.382 18933 8458 1 12 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.927 -0.308 18933 8459 1 12 . 1 1 91 91 GLU CB C 91 29.837 29.837 33.132 -3.295 18933 8460 1 12 . 1 1 91 91 GLU H H 91 8.175 8.175 8.972 -0.797 18933 8461 1 12 . 1 1 92 92 TRP N N 92 127.516 127.516 124.761 2.755 18933 8462 1 12 . 1 1 92 92 TRP C C 92 175.203 175.203 176.309 -1.106 18933 8463 1 12 . 1 1 92 92 TRP CA C 92 56.233 56.233 55.088 1.145 18933 8464 1 12 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.482 1.179 18933 8465 1 12 . 1 1 92 92 TRP H H 92 9.306 9.306 8.910 0.396 18933 8466 1 12 . 1 1 93 93 GLU N N 93 127.834 127.834 125.737 2.097 18933 8467 1 12 . 1 1 93 93 GLU C C 93 175.668 175.668 176.035 -0.367 18933 8468 1 12 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.412 -0.534 18933 8469 1 12 . 1 1 93 93 GLU CB C 93 26.034 26.034 29.088 -3.054 18933 8470 1 12 . 1 1 93 93 GLU H H 93 8.796 8.796 8.986 -0.190 18933 8471 1 12 . 1 1 94 94 LYS N N 94 108.931 108.931 112.297 -3.366 18933 8472 1 12 . 1 1 94 94 LYS C C 94 175.423 175.423 176.424 -1.001 18933 8473 1 12 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.611 -0.168 18933 8474 1 12 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.305 -2.672 18933 8475 1 12 . 1 1 94 94 LYS H H 94 8.498 8.498 8.597 -0.099 18933 8476 1 12 . 1 1 95 95 LYS N N 95 121.737 121.737 120.052 1.685 18933 8477 1 12 . 1 1 95 95 LYS C C 95 174.443 174.443 175.546 -1.103 18933 8478 1 12 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.991 -2.574 18933 8479 1 12 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.174 0.290 18933 8480 1 12 . 1 1 95 95 LYS H H 95 7.761 7.761 7.611 0.150 18933 8481 1 12 . 1 1 96 96 THR N N 96 116.067 116.067 115.434 0.633 18933 8482 1 12 . 1 1 96 96 THR C C 96 174.296 174.296 173.676 0.620 18933 8483 1 12 . 1 1 96 96 THR CA C 96 61.115 61.115 61.059 0.056 18933 8484 1 12 . 1 1 96 96 THR CB C 96 69.450 69.450 71.418 -1.968 18933 8485 1 12 . 1 1 96 96 THR H H 96 7.761 7.761 8.458 -0.697 18933 8486 1 12 . 1 1 97 97 TYR N N 97 124.229 124.229 125.173 -0.944 18933 8487 1 12 . 1 1 97 97 TYR C C 97 173.536 173.536 173.880 -0.344 18933 8488 1 12 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.677 -0.727 18933 8489 1 12 . 1 1 97 97 TYR CB C 97 41.182 41.182 43.226 -2.044 18933 8490 1 12 . 1 1 97 97 TYR H H 97 9.018 9.018 9.244 -0.226 18933 8491 1 12 . 1 1 98 98 GLN N N 98 123.435 123.435 123.661 -0.226 18933 8492 1 12 . 1 1 98 98 GLN C C 98 173.266 173.266 173.605 -0.339 18933 8493 1 12 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.236 -0.093 18933 8494 1 12 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.728 -0.715 18933 8495 1 12 . 1 1 98 98 GLN H H 98 8.781 8.781 8.870 -0.089 18933 8496 1 12 . 1 1 99 99 LEU N N 99 130.119 130.119 127.768 2.351 18933 8497 1 12 . 1 1 99 99 LEU C C 99 173.867 173.867 174.131 -0.264 18933 8498 1 12 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.151 -0.631 18933 8499 1 12 . 1 1 99 99 LEU CB C 99 44.605 44.605 46.022 -1.417 18933 8500 1 12 . 1 1 99 99 LEU H H 99 9.104 9.104 8.630 0.474 18933 8501 1 12 . 1 1 100 100 ASP N N 100 125.182 125.182 127.263 -2.081 18933 8502 1 12 . 1 1 100 100 ASP C C 100 172.837 172.837 174.363 -1.526 18933 8503 1 12 . 1 1 100 100 ASP CA C 100 51.754 51.754 54.539 -2.785 18933 8504 1 12 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.359 -4.015 18933 8505 1 12 . 1 1 100 100 ASP H H 100 9.089 9.089 8.608 0.481 18933 8506 1 12 . 1 1 101 101 LEU N N 101 121.174 121.174 127.389 -6.215 18933 8507 1 12 . 1 1 101 101 LEU C C 101 174.529 174.529 174.641 -0.112 18933 8508 1 12 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.914 -1.999 18933 8509 1 12 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.188 -1.280 18933 8510 1 12 . 1 1 101 101 LEU H H 101 8.458 8.458 9.164 -0.706 18933 8511 1 12 . 1 1 102 102 PHE N N 102 119.464 119.464 126.506 -7.042 18933 8512 1 12 . 1 1 102 102 PHE C C 102 176.293 176.293 175.033 1.260 18933 8513 1 12 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.174 -1.120 18933 8514 1 12 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.031 -0.151 18933 8515 1 12 . 1 1 102 102 PHE H H 102 8.281 8.281 9.299 -1.018 18933 8516 1 12 . 1 1 103 103 THR N N 103 108.576 108.576 117.793 -9.217 18933 8517 1 12 . 1 1 103 103 THR C C 103 174.933 174.933 173.558 1.375 18933 8518 1 12 . 1 1 103 103 THR CA C 103 57.726 57.726 60.117 -2.392 18933 8519 1 12 . 1 1 103 103 THR CB C 103 71.288 71.288 69.287 2.001 18933 8520 1 12 . 1 1 103 103 THR H H 103 7.872 7.872 8.363 -0.491 18933 8521 1 12 . 1 1 104 104 ALA N N 104 122.885 122.885 128.712 -5.827 18933 8522 1 12 . 1 1 104 104 ALA C C 104 175.754 175.754 175.004 0.750 18933 8523 1 12 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.654 0.364 18933 8524 1 12 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.793 -0.308 18933 8525 1 12 . 1 1 104 104 ALA H H 104 8.660 8.660 9.177 -0.517 18933 8526 1 12 . 1 1 105 105 LEU N N 105 120.881 120.881 120.015 0.866 18933 8527 1 12 . 1 1 105 105 LEU C C 105 179.504 179.504 178.145 1.359 18933 8528 1 12 . 1 1 105 105 LEU CA C 105 53.247 53.247 53.808 -0.561 18933 8529 1 12 . 1 1 105 105 LEU CB C 105 41.753 41.753 42.675 -0.922 18933 8530 1 12 . 1 1 105 105 LEU H H 105 8.226 8.226 8.798 -0.572 18933 8531 1 12 . 1 1 106 106 ALA N N 106 124.901 124.901 122.603 2.298 18933 8532 1 12 . 1 1 106 106 ALA C C 106 181.269 181.269 179.215 2.054 18933 8533 1 12 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.674 1.639 18933 8534 1 12 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.955 -1.731 18933 8535 1 12 . 1 1 106 106 ALA H H 106 8.392 8.392 8.404 -0.012 18933 8536 1 12 . 1 1 107 107 GLU N N 107 116.409 116.409 117.295 -0.886 18933 8537 1 12 . 1 1 107 107 GLU C C 107 177.764 177.764 176.818 0.946 18933 8538 1 12 . 1 1 107 107 GLU CA C 107 58.533 58.533 57.943 0.591 18933 8539 1 12 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.747 -1.811 18933 8540 1 12 . 1 1 107 107 GLU H H 107 9.664 9.664 8.726 0.938 18933 8541 1 12 . 1 1 108 108 GLU N N 108 116.189 116.189 118.036 -1.847 18933 8542 1 12 . 1 1 108 108 GLU CA C 108 55.143 55.143 57.218 -2.075 18933 8543 1 12 . 1 1 108 108 GLU CB C 108 29.837 29.837 28.990 0.847 18933 8544 1 12 . 1 1 108 108 GLU H H 108 7.589 7.589 7.346 0.243 18933 8545 1 12 . 1 1 109 109 LYS N N 109 119.928 119.928 121.557 -1.629 18933 8546 1 12 . 1 1 109 109 LYS CA C 109 62.851 62.851 60.912 1.939 18933 8547 1 12 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.735 -0.264 18933 8548 1 12 . 1 1 109 109 LYS H H 109 7.514 7.514 7.899 -0.385 18933 8549 1 12 . 1 1 111 111 TYR N N 111 114.930 114.930 118.971 -4.041 18933 8550 1 12 . 1 1 111 111 TYR C C 111 179.504 179.504 177.696 1.808 18933 8551 1 12 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.696 -2.679 18933 8552 1 12 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.698 -2.030 18933 8553 1 12 . 1 1 111 111 TYR H H 111 6.393 6.393 8.498 -2.105 18933 8554 1 12 . 1 1 112 112 ALA N N 112 124.901 124.901 122.306 2.595 18933 8555 1 12 . 1 1 112 112 ALA C C 112 179.173 179.173 179.698 -0.525 18933 8556 1 12 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.539 -0.638 18933 8557 1 12 . 1 1 112 112 ALA CB C 112 18.112 18.112 17.995 0.117 18933 8558 1 12 . 1 1 112 112 ALA H H 112 8.554 8.554 8.029 0.525 18933 8559 1 12 . 1 1 113 113 ILE N N 113 119.464 119.464 119.739 -0.275 18933 8560 1 12 . 1 1 113 113 ILE C C 113 178.499 178.499 177.809 0.690 18933 8561 1 12 . 1 1 113 113 ILE CA C 113 66.281 66.281 63.972 2.309 18933 8562 1 12 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.892 -0.576 18933 8563 1 12 . 1 1 113 113 ILE H H 113 8.680 8.680 7.677 1.003 18933 8564 1 12 . 1 1 114 114 PHE N N 114 122.922 122.922 121.456 1.466 18933 8565 1 12 . 1 1 114 114 PHE C C 114 178.217 178.217 177.614 0.603 18933 8566 1 12 . 1 1 114 114 PHE CA C 114 61.559 61.559 60.809 0.750 18933 8567 1 12 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.660 0.811 18933 8568 1 12 . 1 1 114 114 PHE H H 114 7.721 7.721 8.446 -0.725 18933 8569 1 12 . 1 1 115 115 HIS N N 115 118.560 118.560 118.542 0.018 18933 8570 1 12 . 1 1 115 115 HIS C C 115 177.286 177.286 176.658 0.628 18933 8571 1 12 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.364 0.016 18933 8572 1 12 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.326 1.540 18933 8573 1 12 . 1 1 115 115 HIS H H 115 8.155 8.155 8.457 -0.302 18933 8574 1 12 . 1 1 116 116 PHE N N 116 111.472 111.472 116.649 -5.177 18933 8575 1 12 . 1 1 116 116 PHE C C 116 179.026 179.026 177.234 1.792 18933 8576 1 12 . 1 1 116 116 PHE CA C 116 59.461 59.461 60.075 -0.614 18933 8577 1 12 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.979 -1.790 18933 8578 1 12 . 1 1 116 116 PHE H H 116 8.564 8.564 8.135 0.429 18933 8579 1 12 . 1 1 117 117 THR N N 117 119.012 119.012 111.246 7.766 18933 8580 1 12 . 1 1 117 117 THR C C 117 172.935 172.935 175.261 -2.326 18933 8581 1 12 . 1 1 117 117 THR CA C 117 67.088 67.088 64.659 2.429 18933 8582 1 12 . 1 1 117 117 THR CB C 117 37.126 37.126 69.195 -32.069 18933 8583 1 12 . 1 1 117 117 THR H H 117 7.620 7.620 8.071 -0.451 18933 8584 1 12 . 1 1 118 118 GLY N N 118 107.917 107.917 110.205 -2.288 18933 8585 1 12 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.282 1.885 18933 8586 1 12 . 1 1 118 118 GLY H H 118 6.666 6.666 7.483 -0.817 18933 8587 1 12 . 1 1 121 121 SER N N 121 113.354 113.354 118.085 -4.731 18933 8588 1 12 . 1 1 121 121 SER C C 121 176.061 176.061 175.826 0.235 18933 8589 1 12 . 1 1 121 121 SER CA C 121 61.035 61.035 62.372 -1.337 18933 8590 1 12 . 1 1 121 121 SER H H 121 8.322 8.322 8.219 0.103 18933 8591 1 12 . 1 1 122 122 TYR N N 122 124.681 124.681 122.145 2.536 18933 8592 1 12 . 1 1 122 122 TYR C C 122 176.293 176.293 177.195 -0.902 18933 8593 1 12 . 1 1 122 122 TYR CA C 122 59.057 59.057 61.138 -2.081 18933 8594 1 12 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.334 0.377 18933 8595 1 12 . 1 1 122 122 TYR H H 122 6.514 6.514 8.435 -1.921 18933 8596 1 12 . 1 1 123 123 LEU N N 123 117.997 117.997 119.688 -1.691 18933 8597 1 12 . 1 1 123 123 LEU C C 123 179.774 179.774 179.017 0.757 18933 8598 1 12 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.999 -0.121 18933 8599 1 12 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.911 -0.933 18933 8600 1 12 . 1 1 123 123 LEU H H 123 7.428 7.428 7.774 -0.346 18933 8601 1 12 . 1 1 124 124 ILE N N 124 119.012 119.012 120.924 -1.912 18933 8602 1 12 . 1 1 124 124 ILE C C 124 178.830 178.830 178.038 0.792 18933 8603 1 12 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.332 -0.181 18933 8604 1 12 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.252 -0.188 18933 8605 1 12 . 1 1 124 124 ILE H H 124 8.453 8.453 8.421 0.032 18933 8606 1 12 . 1 1 125 125 ARG N N 125 121.174 121.174 119.141 2.033 18933 8607 1 12 . 1 1 125 125 ARG C C 125 179.762 179.762 178.964 0.798 18933 8608 1 12 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.067 0.990 18933 8609 1 12 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.314 -0.363 18933 8610 1 12 . 1 1 125 125 ARG H H 125 7.004 7.004 8.074 -1.070 18933 8611 1 12 . 1 1 126 126 ILE N N 126 122.299 122.299 120.394 1.905 18933 8612 1 12 . 1 1 126 126 ILE C C 126 178.352 178.352 177.537 0.815 18933 8613 1 12 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.681 -2.476 18933 8614 1 12 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.115 -1.700 18933 8615 1 12 . 1 1 126 126 ILE H H 126 7.579 7.579 7.982 -0.403 18933 8616 1 12 . 1 1 127 127 ARG N N 127 119.354 119.354 120.521 -1.167 18933 8617 1 12 . 1 1 127 127 ARG C C 127 179.786 179.786 178.706 1.080 18933 8618 1 12 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.693 0.293 18933 8619 1 12 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.144 -0.814 18933 8620 1 12 . 1 1 127 127 ARG H H 127 8.715 8.715 8.043 0.672 18933 8621 1 12 . 1 1 128 128 ALA N N 128 122.873 122.873 120.514 2.359 18933 8622 1 12 . 1 1 128 128 ALA C C 128 180.325 180.325 179.367 0.958 18933 8623 1 12 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.581 0.159 18933 8624 1 12 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.254 -1.093 18933 8625 1 12 . 1 1 128 128 ALA H H 128 7.978 7.978 8.237 -0.259 18933 8626 1 12 . 1 1 129 129 ALA N N 129 121.846 121.846 121.844 0.002 18933 8627 1 12 . 1 1 129 129 ALA C C 129 181.539 181.539 179.804 1.735 18933 8628 1 12 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.726 -0.228 18933 8629 1 12 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.575 -1.097 18933 8630 1 12 . 1 1 129 129 ALA H H 129 7.519 7.519 7.967 -0.448 18933 8631 1 12 . 1 1 130 130 LEU N N 130 119.134 119.134 118.287 0.847 18933 8632 1 12 . 1 1 130 130 LEU C C 130 179.909 179.909 178.980 0.929 18933 8633 1 12 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.038 -0.039 18933 8634 1 12 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.697 -1.275 18933 8635 1 12 . 1 1 130 130 LEU H H 130 8.296 8.296 8.587 -0.291 18933 8636 1 12 . 1 1 131 131 LYS N N 131 122.299 122.299 120.285 2.014 18933 8637 1 12 . 1 1 131 131 LYS C C 131 180.289 180.289 179.402 0.887 18933 8638 1 12 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.561 -0.544 18933 8639 1 12 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.068 -0.836 18933 8640 1 12 . 1 1 131 131 LYS H H 131 8.281 8.281 7.877 0.404 18933 8641 1 12 . 1 1 132 132 LYS N N 132 118.743 118.743 117.128 1.615 18933 8642 1 12 . 1 1 132 132 LYS C C 132 177.482 177.482 178.017 -0.535 18933 8643 1 12 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.306 0.186 18933 8644 1 12 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.377 -1.145 18933 8645 1 12 . 1 1 132 132 LYS H H 132 7.317 7.317 7.601 -0.284 18933 8646 1 12 . 1 1 133 133 LYS N N 133 117.093 117.093 117.674 -0.581 18933 8647 1 12 . 1 1 133 133 LYS C C 133 174.614 174.614 175.730 -1.116 18933 8648 1 12 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.610 -0.830 18933 8649 1 12 . 1 1 133 133 LYS CB C 133 32.182 32.182 33.152 -0.970 18933 8650 1 12 . 1 1 133 133 LYS H H 133 7.327 7.327 7.915 -0.588 18933 8651 1 12 . 1 1 134 134 ASN N N 134 113.012 113.012 115.841 -2.829 18933 8652 1 12 . 1 1 134 134 ASN C C 134 173.965 173.965 173.451 0.514 18933 8653 1 12 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.352 -0.056 18933 8654 1 12 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.200 -1.025 18933 8655 1 12 . 1 1 134 134 ASN H H 134 7.938 7.938 8.119 -0.181 18933 8656 1 12 . 1 1 135 135 TYR N N 135 115.725 115.725 119.256 -3.531 18933 8657 1 12 . 1 1 135 135 TYR C C 135 176.342 176.342 174.985 1.357 18933 8658 1 12 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.872 -2.204 18933 8659 1 12 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.147 1.416 18933 8660 1 12 . 1 1 135 135 TYR H H 135 7.741 7.741 8.348 -0.607 18933 8661 1 12 . 1 1 136 136 LYS N N 136 122.641 122.641 123.965 -1.324 18933 8662 1 12 . 1 1 136 136 LYS C C 136 173.475 173.475 174.542 -1.067 18933 8663 1 12 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.547 0.354 18933 8664 1 12 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.793 -2.075 18933 8665 1 12 . 1 1 136 136 LYS H H 136 9.296 9.296 8.761 0.535 18933 8666 1 12 . 1 1 137 137 LEU N N 137 127.284 127.284 123.099 4.185 18933 8667 1 12 . 1 1 137 137 LEU C C 137 175.423 175.423 176.087 -0.664 18933 8668 1 12 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.214 -0.088 18933 8669 1 12 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.260 3.486 18933 8670 1 12 . 1 1 137 137 LEU H H 137 8.776 8.776 8.515 0.261 18933 8671 1 12 . 1 1 138 138 ASN N N 138 125.818 125.818 119.094 6.724 18933 8672 1 12 . 1 1 138 138 ASN C C 138 174.933 174.933 175.609 -0.676 18933 8673 1 12 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.432 -0.315 18933 8674 1 12 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.301 -4.795 18933 8675 1 12 . 1 1 138 138 ASN H H 138 8.811 8.811 8.196 0.615 18933 8676 1 12 . 1 1 139 139 GLN N N 139 116.861 116.861 119.077 -2.216 18933 8677 1 12 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.471 -1.633 18933 8678 1 12 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.525 -2.808 18933 8679 1 12 . 1 1 139 139 GLN H H 139 9.220 9.220 8.870 0.350 18933 8680 1 12 . 1 1 140 140 TYR N N 140 120.600 120.600 120.496 0.104 18933 8681 1 12 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.771 -1.014 18933 8682 1 12 . 1 1 140 140 TYR CB C 140 37.570 37.570 38.346 -0.776 18933 8683 1 12 . 1 1 140 140 TYR H H 140 8.549 8.549 8.470 0.079 18933 8684 1 12 . 1 1 141 141 GLY N N 141 105.986 105.986 108.555 -2.569 18933 8685 1 12 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.427 -0.583 18933 8686 1 12 . 1 1 141 141 GLY H H 141 7.186 7.186 7.754 -0.568 18933 8687 1 12 . 1 1 142 142 LEU N N 142 120.038 120.038 116.992 3.046 18933 8688 1 12 . 1 1 142 142 LEU C C 142 173.340 173.340 175.945 -2.605 18933 8689 1 12 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.389 -0.869 18933 8690 1 12 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.322 1.028 18933 8691 1 12 . 1 1 142 142 LEU H H 142 7.539 7.539 8.404 -0.865 18933 8692 1 12 . 1 1 143 143 PHE N N 143 124.229 124.229 119.747 4.482 18933 8693 1 12 . 1 1 143 143 PHE C C 143 173.977 173.977 175.220 -1.243 18933 8694 1 12 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.055 -2.414 18933 8695 1 12 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.553 4.115 18933 8696 1 12 . 1 1 143 143 PHE H H 143 9.084 9.084 9.022 0.062 18933 8697 1 12 . 1 1 144 144 LYS N N 144 127.858 127.858 122.694 5.164 18933 8698 1 12 . 1 1 144 144 LYS C C 144 175.092 175.092 176.758 -1.666 18933 8699 1 12 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.510 4.346 18933 8700 1 12 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.821 3.763 18933 8701 1 12 . 1 1 144 144 LYS H H 144 9.281 9.281 8.911 0.370 18933 8702 1 12 . 1 1 145 145 ASN N N 145 128.188 128.188 126.277 1.911 18933 8703 1 12 . 1 1 145 145 ASN C C 145 175.779 175.779 174.673 1.106 18933 8704 1 12 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.475 3.251 18933 8705 1 12 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.784 -3.130 18933 8706 1 12 . 1 1 145 145 ASN H H 145 9.205 9.205 9.235 -0.030 18933 8707 1 12 . 1 1 146 146 GLN N N 146 129.655 129.655 112.012 17.643 18933 8708 1 12 . 1 1 146 146 GLN C C 146 175.399 175.399 174.559 0.840 18933 8709 1 12 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.074 1.741 18933 8710 1 12 . 1 1 146 146 GLN CB C 146 32.626 32.626 28.213 4.413 18933 8711 1 12 . 1 1 146 146 GLN H H 146 8.983 8.983 8.772 0.211 18933 8712 1 12 . 1 1 147 147 THR N N 147 117.936 117.936 115.962 1.974 18933 8713 1 12 . 1 1 147 147 THR C C 147 173.254 173.254 173.223 0.031 18933 8714 1 12 . 1 1 147 147 THR CA C 147 61.721 61.721 61.975 -0.254 18933 8715 1 12 . 1 1 147 147 THR CB C 147 70.274 70.274 69.716 0.559 18933 8716 1 12 . 1 1 147 147 THR H H 147 8.029 8.029 7.763 0.266 18933 8717 1 12 . 1 1 148 148 LEU N N 148 130.681 130.681 131.193 -0.512 18933 8718 1 12 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.260 0.206 18933 8719 1 12 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.833 -1.144 18933 8720 1 12 . 1 1 148 148 LEU H H 148 8.635 8.635 8.893 -0.258 18933 8721 1 12 . 1 1 149 149 VAL N N 149 130.803 130.803 128.422 2.381 18933 8722 1 12 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.424 0.754 18933 8723 1 12 . 1 1 149 149 VAL CB C 149 31.675 31.675 34.940 -3.265 18933 8724 1 12 . 1 1 149 149 VAL H H 149 8.968 8.968 9.320 -0.352 18933 8725 1 12 . 1 1 151 151 LEU N N 151 124.290 124.290 121.459 2.831 18933 8726 1 12 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.549 -2.536 18933 8727 1 12 . 1 1 151 151 LEU CB C 151 44.098 44.098 41.208 2.890 18933 8728 1 12 . 1 1 151 151 LEU H H 151 7.872 7.872 8.436 -0.564 18933 8729 1 12 . 1 1 153 153 ILE N N 153 114.943 114.943 113.467 1.476 18933 8730 1 12 . 1 1 153 153 ILE C C 153 175.877 175.877 175.108 0.769 18933 8731 1 12 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.828 -0.134 18933 8732 1 12 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.007 1.683 18933 8733 1 12 . 1 1 153 153 ILE H H 153 7.125 7.125 7.639 -0.514 18933 8734 1 12 . 1 1 154 154 THR N N 154 111.766 111.766 114.172 -2.406 18933 8735 1 12 . 1 1 154 154 THR C C 154 174.945 174.945 174.556 0.389 18933 8736 1 12 . 1 1 154 154 THR CA C 154 62.124 62.124 63.412 -1.288 18933 8737 1 12 . 1 1 154 154 THR CB C 154 70.718 70.718 69.523 1.195 18933 8738 1 12 . 1 1 154 154 THR H H 154 9.286 9.286 8.316 0.970 18933 8739 1 12 . 1 1 155 155 THR N N 155 111.766 111.766 111.227 0.539 18933 8740 1 12 . 1 1 155 155 THR CA C 155 58.936 58.936 58.945 -0.009 18933 8741 1 12 . 1 1 155 155 THR CB C 155 72.683 72.683 70.640 2.043 18933 8742 1 12 . 1 1 155 155 THR H H 155 7.645 7.645 7.379 0.266 18933 8743 1 12 . 1 1 157 157 LYS N N 157 119.464 119.464 119.195 0.269 18933 8744 1 12 . 1 1 157 157 LYS C C 157 178.781 178.781 178.505 0.276 18933 8745 1 12 . 1 1 157 157 LYS CA C 157 60.026 60.026 60.179 -0.153 18933 8746 1 12 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.459 -0.037 18933 8747 1 12 . 1 1 157 157 LYS H H 157 8.175 8.175 8.433 -0.258 18933 8748 1 12 . 1 1 158 158 GLU N N 158 118.340 118.340 117.475 0.865 18933 8749 1 12 . 1 1 158 158 GLU C C 158 178.867 178.867 178.883 -0.016 18933 8750 1 12 . 1 1 158 158 GLU CA C 158 58.492 58.492 58.938 -0.446 18933 8751 1 12 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.926 0.404 18933 8752 1 12 . 1 1 158 158 GLU H H 158 7.519 7.519 8.359 -0.840 18933 8753 1 12 . 1 1 159 159 LEU N N 159 120.710 120.710 121.904 -1.194 18933 8754 1 12 . 1 1 159 159 LEU C C 159 176.526 176.526 178.291 -1.765 18933 8755 1 12 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.095 0.075 18933 8756 1 12 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.614 -1.699 18933 8757 1 12 . 1 1 159 159 LEU H H 159 7.524 7.524 7.877 -0.353 18933 8758 1 12 . 1 1 160 160 ILE N N 160 118.217 118.217 118.574 -0.357 18933 8759 1 12 . 1 1 160 160 ILE C C 160 177.213 177.213 177.870 -0.657 18933 8760 1 12 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.506 -0.476 18933 8761 1 12 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.213 0.293 18933 8762 1 12 . 1 1 160 160 ILE H H 160 7.741 7.741 7.924 -0.183 18933 8763 1 12 . 1 1 161 161 LYS N N 161 118.450 118.450 119.690 -1.240 18933 8764 1 12 . 1 1 161 161 LYS C C 161 180.999 180.999 179.903 1.096 18933 8765 1 12 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.304 -0.489 18933 8766 1 12 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.209 -1.231 18933 8767 1 12 . 1 1 161 161 LYS H H 161 7.382 7.382 7.905 -0.523 18933 8768 1 12 . 1 1 162 162 GLU N N 162 121.846 121.846 120.745 1.101 18933 8769 1 12 . 1 1 162 162 GLU C C 162 178.818 178.818 177.896 0.922 18933 8770 1 12 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.440 -0.391 18933 8771 1 12 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.379 -1.443 18933 8772 1 12 . 1 1 162 162 GLU H H 162 8.210 8.210 7.805 0.405 18933 8773 1 12 . 1 1 163 163 LEU N N 163 116.751 116.751 115.791 0.960 18933 8774 1 12 . 1 1 163 163 LEU C C 163 176.784 176.784 177.519 -0.735 18933 8775 1 12 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.397 -0.375 18933 8776 1 12 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.876 -0.567 18933 8777 1 12 . 1 1 163 163 LEU H H 163 7.796 7.796 7.460 0.336 18933 8778 1 12 . 1 1 164 164 GLY N N 164 104.849 104.849 105.358 -0.509 18933 8779 1 12 . 1 1 164 164 GLY C C 164 174.492 174.492 174.175 0.317 18933 8780 1 12 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.383 -0.651 18933 8781 1 12 . 1 1 164 164 GLY H H 164 7.589 7.589 7.470 0.119 18933 8782 1 12 . 1 1 165 165 PHE N N 165 118.902 118.902 119.166 -0.264 18933 8783 1 12 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.520 -0.852 18933 8784 1 12 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.088 -1.603 18933 8785 1 12 . 1 1 165 165 PHE H H 165 7.251 7.251 7.595 -0.344 18933 8786 1 12 . 1 1 166 166 THR N N 166 117.093 117.093 115.176 1.917 18933 8787 1 12 . 1 1 166 166 THR CA C 166 62.245 62.245 60.408 1.837 18933 8788 1 12 . 1 1 166 166 THR CB C 166 69.323 69.323 69.395 -0.072 18933 8789 1 12 . 1 1 166 166 THR H H 166 8.407 8.407 8.257 0.150 18933 8790 1 12 . 1 1 168 168 ARG N N 168 127.431 127.431 120.365 7.066 18933 8791 1 12 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.525 -2.287 18933 8792 1 12 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.057 -1.065 18933 8793 1 12 . 1 1 168 168 ARG H H 168 7.160 7.160 8.343 -1.183 18933 8794 1 12 . 1 1 171 171 LYS N N 171 113.574 113.574 114.622 -1.048 18933 8795 1 12 . 1 1 171 171 LYS C C 171 176.416 176.416 177.245 -0.829 18933 8796 1 12 . 1 1 171 171 LYS CA C 171 57.605 57.605 57.802 -0.197 18933 8797 1 12 . 1 1 171 171 LYS CB C 171 31.929 31.929 30.726 1.203 18933 8798 1 12 . 1 1 171 171 LYS H H 171 8.210 8.210 8.273 -0.063 18933 8799 1 12 . 1 1 172 172 LYS N N 172 117.313 117.313 117.699 -0.386 18933 8800 1 12 . 1 1 172 172 LYS C C 172 175.717 175.717 176.159 -0.442 18933 8801 1 12 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.031 -1.856 18933 8802 1 12 . 1 1 172 172 LYS CB C 172 31.612 31.612 33.126 -1.514 18933 8803 1 12 . 1 1 172 172 LYS H H 172 7.761 7.761 7.588 0.173 18933 8804 1 12 . 1 1 173 173 ARG N N 173 122.056 122.056 118.944 3.112 18933 8805 1 12 . 1 1 173 173 ARG C C 173 172.850 172.850 175.103 -2.253 18933 8806 1 12 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.101 0.777 18933 8807 1 12 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.241 0.265 18933 8808 1 12 . 1 1 173 173 ARG H H 173 6.885 6.885 7.423 -0.538 18933 8809 1 13 . 1 1 2 2 LEU N N 2 122.812 122.812 122.536 0.276 18933 8810 1 13 . 1 1 2 2 LEU C C 2 175.742 175.742 176.326 -0.584 18933 8811 1 13 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.918 0.216 18933 8812 1 13 . 1 1 2 2 LEU CB C 2 42.842 42.842 45.182 -2.340 18933 8813 1 13 . 1 1 2 2 LEU H H 2 8.756 8.756 7.765 0.991 18933 8814 1 13 . 1 1 3 3 THR N N 3 113.000 113.000 113.447 -0.447 18933 8815 1 13 . 1 1 3 3 THR C C 3 175.938 175.938 175.422 0.516 18933 8816 1 13 . 1 1 3 3 THR CA C 3 60.550 60.550 59.879 0.671 18933 8817 1 13 . 1 1 3 3 THR CB C 3 70.781 70.781 70.843 -0.062 18933 8818 1 13 . 1 1 3 3 THR H H 3 8.428 8.428 8.032 0.396 18933 8819 1 13 . 1 1 4 4 LEU N N 4 122.531 122.531 123.162 -0.631 18933 8820 1 13 . 1 1 4 4 LEU C C 4 178.463 178.463 178.525 -0.062 18933 8821 1 13 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.546 -0.417 18933 8822 1 13 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.047 -2.513 18933 8823 1 13 . 1 1 4 4 LEU H H 4 7.731 7.731 8.243 -0.512 18933 8824 1 13 . 1 1 5 5 ILE N N 5 115.505 115.505 117.666 -2.161 18933 8825 1 13 . 1 1 5 5 ILE C C 5 178.573 178.573 177.964 0.609 18933 8826 1 13 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.386 -0.648 18933 8827 1 13 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.331 -0.459 18933 8828 1 13 . 1 1 5 5 ILE H H 5 7.645 7.645 7.926 -0.281 18933 8829 1 13 . 1 1 6 6 GLN N N 6 121.626 121.626 119.465 2.161 18933 8830 1 13 . 1 1 6 6 GLN C C 6 179.014 179.014 178.495 0.519 18933 8831 1 13 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.167 -0.836 18933 8832 1 13 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.644 0.545 18933 8833 1 13 . 1 1 6 6 GLN H H 6 7.645 7.645 8.089 -0.444 18933 8834 1 13 . 1 1 7 7 GLY N N 7 107.684 107.684 106.707 0.977 18933 8835 1 13 . 1 1 7 7 GLY C C 7 174.749 174.749 175.977 -1.228 18933 8836 1 13 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.829 -0.039 18933 8837 1 13 . 1 1 7 7 GLY H H 7 8.660 8.660 8.152 0.508 18933 8838 1 13 . 1 1 8 8 LYS N N 8 120.942 120.942 122.362 -1.420 18933 8839 1 13 . 1 1 8 8 LYS C C 8 179.455 179.455 178.462 0.993 18933 8840 1 13 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.129 0.776 18933 8841 1 13 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.226 -0.804 18933 8842 1 13 . 1 1 8 8 LYS H H 8 8.518 8.518 7.600 0.918 18933 8843 1 13 . 1 1 9 9 LYS N N 9 120.710 120.710 119.407 1.303 18933 8844 1 13 . 1 1 9 9 LYS C C 9 179.823 179.823 179.334 0.489 18933 8845 1 13 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.305 0.317 18933 8846 1 13 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.344 -1.049 18933 8847 1 13 . 1 1 9 9 LYS H H 9 7.731 7.731 8.288 -0.557 18933 8848 1 13 . 1 1 10 10 ILE N N 10 121.345 121.345 120.959 0.386 18933 8849 1 13 . 1 1 10 10 ILE C C 10 177.789 177.789 177.881 -0.092 18933 8850 1 13 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.957 -1.492 18933 8851 1 13 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.179 -1.815 18933 8852 1 13 . 1 1 10 10 ILE H H 10 7.711 7.711 8.467 -0.756 18933 8853 1 13 . 1 1 11 11 VAL N N 11 120.258 120.258 120.299 -0.041 18933 8854 1 13 . 1 1 11 11 VAL C C 11 177.372 177.372 178.013 -0.641 18933 8855 1 13 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.169 0.282 18933 8856 1 13 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.202 -0.668 18933 8857 1 13 . 1 1 11 11 VAL H H 11 7.918 7.918 8.280 -0.362 18933 8858 1 13 . 1 1 12 12 ASN N N 12 116.971 116.971 118.174 -1.203 18933 8859 1 13 . 1 1 12 12 ASN C C 12 177.445 177.445 178.114 -0.669 18933 8860 1 13 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.234 -0.122 18933 8861 1 13 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.452 -0.819 18933 8862 1 13 . 1 1 12 12 ASN H H 12 7.993 7.993 8.699 -0.706 18933 8863 1 13 . 1 1 13 13 HIS N N 13 120.258 120.258 119.641 0.617 18933 8864 1 13 . 1 1 13 13 HIS C C 13 177.862 177.862 177.778 0.084 18933 8865 1 13 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.521 -0.423 18933 8866 1 13 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.558 0.674 18933 8867 1 13 . 1 1 13 13 HIS H H 13 7.741 7.741 8.384 -0.643 18933 8868 1 13 . 1 1 14 14 LEU N N 14 116.641 116.641 119.767 -3.126 18933 8869 1 13 . 1 1 14 14 LEU C C 14 179.186 179.186 178.308 0.878 18933 8870 1 13 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.334 -1.577 18933 8871 1 13 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.522 -0.403 18933 8872 1 13 . 1 1 14 14 LEU H H 14 8.221 8.221 8.498 -0.277 18933 8873 1 13 . 1 1 15 15 ARG N N 15 115.957 115.957 114.510 1.447 18933 8874 1 13 . 1 1 15 15 ARG C C 15 176.330 176.330 178.201 -1.871 18933 8875 1 13 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.552 1.151 18933 8876 1 13 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.410 -1.333 18933 8877 1 13 . 1 1 15 15 ARG H H 15 7.968 7.968 8.382 -0.414 18933 8878 1 13 . 1 1 16 16 SER N N 16 109.395 109.395 115.975 -6.580 18933 8879 1 13 . 1 1 16 16 SER C C 16 176.024 176.024 175.044 0.980 18933 8880 1 13 . 1 1 16 16 SER CA C 16 57.282 57.282 60.360 -3.078 18933 8881 1 13 . 1 1 16 16 SER CB C 16 63.683 63.683 63.601 0.082 18933 8882 1 13 . 1 1 16 16 SER H H 16 6.963 6.963 7.417 -0.454 18933 8883 1 13 . 1 1 17 17 ARG N N 17 122.775 122.775 121.822 0.953 18933 8884 1 13 . 1 1 17 17 ARG C C 17 174.590 174.590 174.063 0.527 18933 8885 1 13 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.942 1.331 18933 8886 1 13 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.451 1.351 18933 8887 1 13 . 1 1 17 17 ARG H H 17 7.781 7.781 8.311 -0.530 18933 8888 1 13 . 1 1 18 18 LEU N N 18 122.421 122.421 125.792 -3.371 18933 8889 1 13 . 1 1 18 18 LEU C C 18 176.281 176.281 174.090 2.191 18933 8890 1 13 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.344 0.436 18933 8891 1 13 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.918 -3.707 18933 8892 1 13 . 1 1 18 18 LEU H H 18 8.650 8.650 7.762 0.888 18933 8893 1 13 . 1 1 19 19 ALA N N 19 126.441 126.441 126.666 -0.225 18933 8894 1 13 . 1 1 19 19 ALA C C 19 173.904 173.904 174.817 -0.913 18933 8895 1 13 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.693 -0.827 18933 8896 1 13 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.244 0.621 18933 8897 1 13 . 1 1 19 19 ALA H H 19 8.609 8.609 8.920 -0.311 18933 8898 1 13 . 1 1 20 20 PHE N N 20 114.600 114.600 119.460 -4.860 18933 8899 1 13 . 1 1 20 20 PHE C C 20 172.592 172.592 173.934 -1.342 18933 8900 1 13 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.974 0.815 18933 8901 1 13 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.541 -0.852 18933 8902 1 13 . 1 1 20 20 PHE H H 20 8.801 8.801 9.167 -0.366 18933 8903 1 13 . 1 1 21 21 GLU N N 21 122.873 122.873 124.237 -1.364 18933 8904 1 13 . 1 1 21 21 GLU C C 21 174.872 174.872 175.290 -0.418 18933 8905 1 13 . 1 1 21 21 GLU CA C 21 55.062 55.062 55.010 0.052 18933 8906 1 13 . 1 1 21 21 GLU CB C 21 30.725 30.725 30.896 -0.171 18933 8907 1 13 . 1 1 21 21 GLU H H 21 7.847 7.847 9.301 -1.454 18933 8908 1 13 . 1 1 22 22 TYR N N 22 126.270 126.270 126.939 -0.669 18933 8909 1 13 . 1 1 22 22 TYR C C 22 174.872 174.872 174.762 0.110 18933 8910 1 13 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.828 -1.080 18933 8911 1 13 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.136 -1.031 18933 8912 1 13 . 1 1 22 22 TYR H H 22 8.806 8.806 9.190 -0.384 18933 8913 1 13 . 1 1 23 23 ASN N N 23 128.420 128.420 126.556 1.864 18933 8914 1 13 . 1 1 23 23 ASN C C 23 175.435 175.435 175.163 0.272 18933 8915 1 13 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.613 -0.608 18933 8916 1 13 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.454 -1.089 18933 8917 1 13 . 1 1 23 23 ASN H H 23 8.943 8.943 9.176 -0.233 18933 8918 1 13 . 1 1 24 24 GLY N N 24 104.067 104.067 102.847 1.220 18933 8919 1 13 . 1 1 24 24 GLY C C 24 173.707 173.707 173.723 -0.016 18933 8920 1 13 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.942 -0.008 18933 8921 1 13 . 1 1 24 24 GLY H H 24 8.534 8.534 8.227 0.307 18933 8922 1 13 . 1 1 25 25 GLN N N 25 120.038 120.038 119.718 0.320 18933 8923 1 13 . 1 1 25 25 GLN C C 25 173.744 173.744 174.932 -1.188 18933 8924 1 13 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.292 -0.965 18933 8925 1 13 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.330 0.331 18933 8926 1 13 . 1 1 25 25 GLN H H 25 7.595 7.595 7.876 -0.281 18933 8927 1 13 . 1 1 26 26 LEU N N 26 124.681 124.681 124.755 -0.074 18933 8928 1 13 . 1 1 26 26 LEU C C 26 175.987 175.987 176.256 -0.269 18933 8929 1 13 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.577 -0.564 18933 8930 1 13 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.262 -1.397 18933 8931 1 13 . 1 1 26 26 LEU H H 26 8.382 8.382 8.581 -0.199 18933 8932 1 13 . 1 1 27 27 ILE N N 27 130.779 130.779 127.188 3.591 18933 8933 1 13 . 1 1 27 27 ILE C C 27 175.215 175.215 174.467 0.748 18933 8934 1 13 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.767 -0.507 18933 8935 1 13 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.008 -2.276 18933 8936 1 13 . 1 1 27 27 ILE H H 27 8.882 8.882 8.884 -0.002 18933 8937 1 13 . 1 1 28 28 LYS N N 28 126.160 126.160 127.635 -1.475 18933 8938 1 13 . 1 1 28 28 LYS C C 28 176.771 176.771 175.671 1.100 18933 8939 1 13 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.882 1.956 18933 8940 1 13 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.144 -1.405 18933 8941 1 13 . 1 1 28 28 LYS H H 28 8.165 8.165 8.365 -0.200 18933 8942 1 13 . 1 1 29 29 ILE N N 29 126.380 126.380 122.089 4.291 18933 8943 1 13 . 1 1 29 29 ILE C C 29 175.877 175.877 174.310 1.567 18933 8944 1 13 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.524 -0.216 18933 8945 1 13 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.582 -2.519 18933 8946 1 13 . 1 1 29 29 ILE H H 29 8.019 8.019 8.644 -0.625 18933 8947 1 13 . 1 1 30 30 LEU N N 30 129.215 129.215 122.246 6.969 18933 8948 1 13 . 1 1 30 30 LEU C C 30 178.867 178.867 178.145 0.722 18933 8949 1 13 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.289 1.330 18933 8950 1 13 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.630 -4.765 18933 8951 1 13 . 1 1 30 30 LEU H H 30 8.917 8.917 8.303 0.614 18933 8952 1 13 . 1 1 31 31 SER N N 31 117.997 117.997 116.216 1.781 18933 8953 1 13 . 1 1 31 31 SER C C 31 177.396 177.396 175.708 1.688 18933 8954 1 13 . 1 1 31 31 SER CA C 31 61.236 61.236 61.026 0.210 18933 8955 1 13 . 1 1 31 31 SER CB C 31 62.035 62.035 63.231 -1.196 18933 8956 1 13 . 1 1 31 31 SER H H 31 8.594 8.594 8.873 -0.279 18933 8957 1 13 . 1 1 32 32 LYS N N 32 116.189 116.189 118.938 -2.749 18933 8958 1 13 . 1 1 32 32 LYS C C 32 176.244 176.244 177.302 -1.058 18933 8959 1 13 . 1 1 32 32 LYS CA C 32 57.403 57.403 57.955 -0.552 18933 8960 1 13 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.380 -2.099 18933 8961 1 13 . 1 1 32 32 LYS H H 32 8.029 8.029 8.384 -0.355 18933 8962 1 13 . 1 1 33 33 ASN N N 33 119.061 119.061 115.160 3.901 18933 8963 1 13 . 1 1 33 33 ASN C C 33 172.384 172.384 174.260 -1.876 18933 8964 1 13 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.860 -1.703 18933 8965 1 13 . 1 1 33 33 ASN CB C 33 38.267 38.267 40.906 -2.639 18933 8966 1 13 . 1 1 33 33 ASN H H 33 7.902 7.902 7.828 0.074 18933 8967 1 13 . 1 1 34 34 ILE N N 34 120.038 120.038 119.328 0.710 18933 8968 1 13 . 1 1 34 34 ILE C C 34 175.607 175.607 174.313 1.294 18933 8969 1 13 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.252 0.298 18933 8970 1 13 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.692 -2.728 18933 8971 1 13 . 1 1 34 34 ILE H H 34 7.443 7.443 7.773 -0.330 18933 8972 1 13 . 1 1 35 35 VAL N N 35 129.435 129.435 125.570 3.865 18933 8973 1 13 . 1 1 35 35 VAL C C 35 175.386 175.386 174.510 0.876 18933 8974 1 13 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.252 -0.226 18933 8975 1 13 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.956 -1.175 18933 8976 1 13 . 1 1 35 35 VAL H H 35 9.533 9.533 8.988 0.545 18933 8977 1 13 . 1 1 36 36 ALA N N 36 130.571 130.571 128.879 1.692 18933 8978 1 13 . 1 1 36 36 ALA C C 36 177.347 177.347 176.257 1.090 18933 8979 1 13 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.544 0.855 18933 8980 1 13 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.977 -1.119 18933 8981 1 13 . 1 1 36 36 ALA H H 36 8.665 8.665 8.490 0.175 18933 8982 1 13 . 1 1 37 37 VAL N N 37 115.395 115.395 119.577 -4.182 18933 8983 1 13 . 1 1 37 37 VAL C C 37 174.455 174.455 176.109 -1.654 18933 8984 1 13 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.300 0.080 18933 8985 1 13 . 1 1 37 37 VAL CB C 37 32.943 32.943 33.951 -1.008 18933 8986 1 13 . 1 1 37 37 VAL H H 37 8.079 8.079 8.378 -0.299 18933 8987 1 13 . 1 1 38 38 GLY N N 38 107.672 107.672 107.762 -0.090 18933 8988 1 13 . 1 1 38 38 GLY C C 38 173.364 173.364 175.769 -2.405 18933 8989 1 13 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.544 -0.359 18933 8990 1 13 . 1 1 38 38 GLY H H 38 7.579 7.579 8.043 -0.464 18933 8991 1 13 . 1 1 39 39 SER N N 39 121.052 121.052 119.581 1.471 18933 8992 1 13 . 1 1 39 39 SER C C 39 175.570 175.570 176.627 -1.057 18933 8993 1 13 . 1 1 39 39 SER CA C 39 61.801 61.801 61.836 -0.035 18933 8994 1 13 . 1 1 39 39 SER CB C 39 62.478 62.478 63.168 -0.690 18933 8995 1 13 . 1 1 39 39 SER H H 39 8.953 8.953 8.070 0.883 18933 8996 1 13 . 1 1 40 40 LEU N N 40 121.553 121.553 122.146 -0.593 18933 8997 1 13 . 1 1 40 40 LEU C C 40 180.203 180.203 177.917 2.286 18933 8998 1 13 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.253 -0.124 18933 8999 1 13 . 1 1 40 40 LEU CB C 40 41.753 41.753 42.012 -0.259 18933 9000 1 13 . 1 1 40 40 LEU H H 40 8.195 8.195 7.217 0.978 18933 9001 1 13 . 1 1 41 41 ARG N N 41 121.956 121.956 116.968 4.988 18933 9002 1 13 . 1 1 41 41 ARG C C 41 177.323 177.323 177.886 -0.563 18933 9003 1 13 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.997 0.334 18933 9004 1 13 . 1 1 41 41 ARG CB C 41 28.443 28.443 30.302 -1.859 18933 9005 1 13 . 1 1 41 41 ARG H H 41 6.873 6.873 7.927 -1.054 18933 9006 1 13 . 1 1 42 42 ARG N N 42 114.600 114.600 116.930 -2.330 18933 9007 1 13 . 1 1 42 42 ARG C C 42 172.911 172.911 175.788 -2.877 18933 9008 1 13 . 1 1 42 42 ARG CA C 42 57.242 57.242 57.242 -0.000 18933 9009 1 13 . 1 1 42 42 ARG CB C 42 29.140 29.140 31.023 -1.883 18933 9010 1 13 . 1 1 42 42 ARG H H 42 7.438 7.438 8.076 -0.638 18933 9011 1 13 . 1 1 43 43 GLU N N 43 113.354 113.354 114.392 -1.038 18933 9012 1 13 . 1 1 43 43 GLU C C 43 175.999 175.999 175.339 0.660 18933 9013 1 13 . 1 1 43 43 GLU CA C 43 56.556 56.556 56.991 -0.435 18933 9014 1 13 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.261 -1.923 18933 9015 1 13 . 1 1 43 43 GLU H H 43 7.564 7.564 8.043 -0.479 18933 9016 1 13 . 1 1 44 44 GLU N N 44 119.696 119.696 120.408 -0.712 18933 9017 1 13 . 1 1 44 44 GLU C C 44 175.423 175.423 176.010 -0.587 18933 9018 1 13 . 1 1 44 44 GLU CA C 44 56.838 56.838 53.706 3.132 18933 9019 1 13 . 1 1 44 44 GLU CB C 44 28.696 28.696 28.435 0.261 18933 9020 1 13 . 1 1 44 44 GLU H H 44 7.261 7.261 7.595 -0.334 18933 9021 1 13 . 1 1 45 45 LYS N N 45 117.435 117.435 121.392 -3.957 18933 9022 1 13 . 1 1 45 45 LYS C C 45 177.715 177.715 176.619 1.096 18933 9023 1 13 . 1 1 45 45 LYS CA C 45 59.219 59.219 58.762 0.457 18933 9024 1 13 . 1 1 45 45 LYS CB C 45 32.119 32.119 32.548 -0.430 18933 9025 1 13 . 1 1 45 45 LYS H H 45 7.938 7.938 7.749 0.189 18933 9026 1 13 . 1 1 46 46 MET N N 46 115.847 115.847 117.121 -1.274 18933 9027 1 13 . 1 1 46 46 MET CA C 46 52.520 52.520 54.242 -1.722 18933 9028 1 13 . 1 1 46 46 MET CB C 46 33.450 33.450 31.844 1.606 18933 9029 1 13 . 1 1 46 46 MET H H 46 7.595 7.595 7.748 -0.153 18933 9030 1 13 . 1 1 47 47 LEU N N 47 121.627 121.627 124.916 -3.289 18933 9031 1 13 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.780 -1.654 18933 9032 1 13 . 1 1 47 47 LEU CB C 47 43.070 43.070 42.808 0.262 18933 9033 1 13 . 1 1 47 47 LEU H H 47 9.220 9.220 8.699 0.521 18933 9034 1 13 . 1 1 49 49 ASP N N 49 117.093 117.093 116.666 0.427 18933 9035 1 13 . 1 1 49 49 ASP C C 49 173.340 173.340 174.447 -1.107 18933 9036 1 13 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.142 -1.348 18933 9037 1 13 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.034 -1.028 18933 9038 1 13 . 1 1 49 49 ASP H H 49 7.761 7.761 7.503 0.258 18933 9039 1 13 . 1 1 50 50 VAL N N 50 119.012 119.012 115.066 3.946 18933 9040 1 13 . 1 1 50 50 VAL C C 50 173.070 173.070 174.063 -0.993 18933 9041 1 13 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.323 1.519 18933 9042 1 13 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.312 -0.749 18933 9043 1 13 . 1 1 50 50 VAL H H 50 8.089 8.089 8.424 -0.335 18933 9044 1 13 . 1 1 51 51 ASP N N 51 127.064 127.064 125.527 1.537 18933 9045 1 13 . 1 1 51 51 ASP C C 51 174.565 174.565 175.460 -0.895 18933 9046 1 13 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.600 -0.443 18933 9047 1 13 . 1 1 51 51 ASP CB C 51 42.640 42.640 42.868 -0.228 18933 9048 1 13 . 1 1 51 51 ASP H H 51 8.069 8.069 8.050 0.019 18933 9049 1 13 . 1 1 52 52 LEU N N 52 121.627 121.627 120.176 1.451 18933 9050 1 13 . 1 1 52 52 LEU C C 52 174.063 174.063 174.753 -0.690 18933 9051 1 13 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.489 -0.807 18933 9052 1 13 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.230 -2.879 18933 9053 1 13 . 1 1 52 52 LEU H H 52 8.852 8.852 9.034 -0.182 18933 9054 1 13 . 1 1 53 53 LEU N N 53 123.093 123.093 123.340 -0.247 18933 9055 1 13 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.169 1.822 18933 9056 1 13 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.824 -2.691 18933 9057 1 13 . 1 1 53 53 LEU H H 53 9.362 9.362 9.150 0.212 18933 9058 1 13 . 1 1 54 54 ILE N N 54 123.777 123.777 129.286 -5.509 18933 9059 1 13 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.175 -4.114 18933 9060 1 13 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.377 -7.308 18933 9061 1 13 . 1 1 54 54 ILE H H 54 8.907 8.907 9.336 -0.429 18933 9062 1 13 . 1 1 58 58 GLU N N 58 114.710 114.710 117.560 -2.850 18933 9063 1 13 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.019 -0.642 18933 9064 1 13 . 1 1 58 58 GLU CB C 58 31.422 31.422 32.405 -0.983 18933 9065 1 13 . 1 1 58 58 GLU H H 58 6.716 6.716 7.376 -0.660 18933 9066 1 13 . 1 1 61 61 LEU N N 61 115.957 115.957 119.940 -3.983 18933 9067 1 13 . 1 1 61 61 LEU C C 61 178.512 178.512 178.320 0.192 18933 9068 1 13 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.240 -2.460 18933 9069 1 13 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.560 -0.441 18933 9070 1 13 . 1 1 61 61 LEU H H 61 7.307 7.307 7.671 -0.364 18933 9071 1 13 . 1 1 62 62 LEU N N 62 120.038 120.038 119.265 0.773 18933 9072 1 13 . 1 1 62 62 LEU C C 62 177.874 177.874 178.754 -0.880 18933 9073 1 13 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.648 0.288 18933 9074 1 13 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.988 -1.249 18933 9075 1 13 . 1 1 62 62 LEU H H 62 7.327 7.327 8.251 -0.924 18933 9076 1 13 . 1 1 63 63 LYS N N 63 114.600 114.600 115.860 -1.260 18933 9077 1 13 . 1 1 63 63 LYS C C 63 175.460 175.460 177.696 -2.236 18933 9078 1 13 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.888 -1.323 18933 9079 1 13 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.484 -1.759 18933 9080 1 13 . 1 1 63 63 LYS H H 63 7.973 7.973 7.775 0.198 18933 9081 1 13 . 1 1 64 64 HIS N N 64 115.273 115.273 115.781 -0.508 18933 9082 1 13 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.601 0.511 18933 9083 1 13 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.006 2.429 18933 9084 1 13 . 1 1 64 64 HIS H H 64 7.544 7.544 7.634 -0.090 18933 9085 1 13 . 1 1 65 65 VAL N N 65 118.682 118.682 118.310 0.372 18933 9086 1 13 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.904 3.134 18933 9087 1 13 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.164 -2.138 18933 9088 1 13 . 1 1 65 65 VAL H H 65 6.787 6.787 7.139 -0.352 18933 9089 1 13 . 1 1 68 68 ASN N N 68 112.108 112.108 117.859 -5.751 18933 9090 1 13 . 1 1 68 68 ASN C C 68 174.884 174.884 173.942 0.942 18933 9091 1 13 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.401 -1.374 18933 9092 1 13 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.479 0.753 18933 9093 1 13 . 1 1 68 68 ASN H H 68 7.009 7.009 8.350 -1.341 18933 9094 1 13 . 1 1 69 69 ILE N N 69 123.325 123.325 123.199 0.126 18933 9095 1 13 . 1 1 69 69 ILE C C 69 174.394 174.394 175.558 -1.164 18933 9096 1 13 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.720 -1.613 18933 9097 1 13 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.526 -0.259 18933 9098 1 13 . 1 1 69 69 ILE H H 69 7.150 7.150 8.236 -1.086 18933 9099 1 13 . 1 1 70 70 ARG N N 70 126.722 126.722 128.510 -1.788 18933 9100 1 13 . 1 1 70 70 ARG C C 70 174.590 174.590 174.084 0.506 18933 9101 1 13 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.627 -1.380 18933 9102 1 13 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.841 -2.469 18933 9103 1 13 . 1 1 70 70 ARG H H 70 8.902 8.902 9.305 -0.403 18933 9104 1 13 . 1 1 71 71 ILE N N 71 119.978 119.978 121.130 -1.152 18933 9105 1 13 . 1 1 71 71 ILE C C 71 175.583 175.583 175.530 0.053 18933 9106 1 13 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.919 -0.095 18933 9107 1 13 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.435 -2.675 18933 9108 1 13 . 1 1 71 71 ILE H H 71 7.491 7.491 8.827 -1.336 18933 9109 1 13 . 1 1 72 72 LYS N N 72 128.530 128.530 125.782 2.748 18933 9110 1 13 . 1 1 72 72 LYS C C 72 177.703 177.703 176.275 1.428 18933 9111 1 13 . 1 1 72 72 LYS CA C 72 57.201 57.201 54.804 2.397 18933 9112 1 13 . 1 1 72 72 LYS CB C 72 31.485 31.485 31.268 0.217 18933 9113 1 13 . 1 1 72 72 LYS H H 72 8.523 8.523 8.729 -0.206 18933 9114 1 13 . 1 1 73 73 GLY N N 73 113.806 113.806 110.137 3.669 18933 9115 1 13 . 1 1 73 73 GLY C C 73 173.781 173.781 172.773 1.008 18933 9116 1 13 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.157 0.665 18933 9117 1 13 . 1 1 73 73 GLY H H 73 8.791 8.791 8.318 0.473 18933 9118 1 13 . 1 1 74 74 LEU N N 74 120.490 120.490 118.178 2.312 18933 9119 1 13 . 1 1 74 74 LEU C C 74 175.840 175.840 173.519 2.321 18933 9120 1 13 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.409 -0.718 18933 9121 1 13 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.312 -1.151 18933 9122 1 13 . 1 1 74 74 LEU H H 74 7.393 7.393 7.251 0.142 18933 9123 1 13 . 1 1 75 75 SER N N 75 120.038 120.038 115.512 4.526 18933 9124 1 13 . 1 1 75 75 SER C C 75 173.205 173.205 173.196 0.009 18933 9125 1 13 . 1 1 75 75 SER CA C 75 57.887 57.887 57.768 0.119 18933 9126 1 13 . 1 1 75 75 SER CB C 75 63.049 63.049 65.248 -2.199 18933 9127 1 13 . 1 1 75 75 SER H H 75 8.917 8.917 8.186 0.731 18933 9128 1 13 . 1 1 76 76 PHE N N 76 119.586 119.586 117.578 2.008 18933 9129 1 13 . 1 1 76 76 PHE C C 76 173.536 173.536 173.740 -0.204 18933 9130 1 13 . 1 1 76 76 PHE CA C 76 55.426 55.426 56.371 -0.945 18933 9131 1 13 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.260 -0.254 18933 9132 1 13 . 1 1 76 76 PHE H H 76 8.003 8.003 8.454 -0.451 18933 9133 1 13 . 1 1 77 77 SER N N 77 114.943 114.943 115.938 -0.995 18933 9134 1 13 . 1 1 77 77 SER C C 77 173.438 173.438 172.411 1.027 18933 9135 1 13 . 1 1 77 77 SER CA C 77 56.152 56.152 56.707 -0.555 18933 9136 1 13 . 1 1 77 77 SER CB C 77 65.204 65.204 65.900 -0.696 18933 9137 1 13 . 1 1 77 77 SER H H 77 8.907 8.907 8.817 0.090 18933 9138 1 13 . 1 1 78 78 VAL N N 78 124.791 124.791 124.280 0.511 18933 9139 1 13 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.429 1.615 18933 9140 1 13 . 1 1 78 78 VAL CB C 78 32.182 32.182 35.266 -3.084 18933 9141 1 13 . 1 1 78 78 VAL H H 78 8.892 8.892 8.215 0.677 18933 9142 1 13 . 1 1 79 79 LYS N N 79 129.667 129.667 129.981 -0.314 18933 9143 1 13 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.613 1.579 18933 9144 1 13 . 1 1 79 79 LYS CB C 79 32.372 32.372 34.432 -2.060 18933 9145 1 13 . 1 1 79 79 LYS H H 79 9.049 9.049 8.780 0.269 18933 9146 1 13 . 1 1 82 82 GLY N N 82 117.263 117.263 114.062 3.201 18933 9147 1 13 . 1 1 82 82 GLY C C 82 171.710 171.710 174.458 -2.748 18933 9148 1 13 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.086 -2.161 18933 9149 1 13 . 1 1 82 82 GLY H H 82 8.044 8.044 8.459 -0.415 18933 9150 1 13 . 1 1 83 83 GLU N N 83 117.203 117.203 122.501 -5.298 18933 9151 1 13 . 1 1 83 83 GLU C C 83 178.695 178.695 177.393 1.302 18933 9152 1 13 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.652 1.325 18933 9153 1 13 . 1 1 83 83 GLU CB C 83 29.837 29.837 30.611 -0.774 18933 9154 1 13 . 1 1 83 83 GLU H H 83 8.296 8.296 8.613 -0.317 18933 9155 1 13 . 1 1 84 84 ARG N N 84 113.818 113.818 119.142 -5.324 18933 9156 1 13 . 1 1 84 84 ARG C C 84 175.877 175.877 175.426 0.451 18933 9157 1 13 . 1 1 84 84 ARG CA C 84 53.731 53.731 54.857 -1.126 18933 9158 1 13 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.464 1.831 18933 9159 1 13 . 1 1 84 84 ARG H H 84 8.342 8.342 7.990 0.352 18933 9160 1 13 . 1 1 85 85 LYS N N 85 119.354 119.354 121.008 -1.654 18933 9161 1 13 . 1 1 85 85 LYS C C 85 174.516 174.516 174.796 -0.280 18933 9162 1 13 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.500 -0.760 18933 9163 1 13 . 1 1 85 85 LYS CB C 85 34.844 34.844 34.608 0.236 18933 9164 1 13 . 1 1 85 85 LYS H H 85 6.822 6.822 7.643 -0.821 18933 9165 1 13 . 1 1 86 86 CYS N N 86 125.928 125.928 125.107 0.821 18933 9166 1 13 . 1 1 86 86 CYS C C 86 171.600 171.600 173.322 -1.722 18933 9167 1 13 . 1 1 86 86 CYS CA C 86 55.627 55.627 58.015 -2.388 18933 9168 1 13 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.509 -0.165 18933 9169 1 13 . 1 1 86 86 CYS H H 86 9.084 9.084 9.363 -0.279 18933 9170 1 13 . 1 1 87 87 VAL N N 87 126.612 126.612 126.097 0.515 18933 9171 1 13 . 1 1 87 87 VAL C C 87 174.431 174.431 174.536 -0.105 18933 9172 1 13 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.849 -0.532 18933 9173 1 13 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.358 0.838 18933 9174 1 13 . 1 1 87 87 VAL H H 87 8.705 8.705 9.040 -0.335 18933 9175 1 13 . 1 1 88 88 LEU N N 88 127.748 127.748 123.530 4.218 18933 9176 1 13 . 1 1 88 88 LEU C C 88 175.227 175.227 174.598 0.629 18933 9177 1 13 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.836 -0.316 18933 9178 1 13 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.259 -1.654 18933 9179 1 13 . 1 1 88 88 LEU H H 88 9.417 9.417 8.571 0.846 18933 9180 1 13 . 1 1 89 89 PHE N N 89 120.981 120.981 119.264 1.717 18933 9181 1 13 . 1 1 89 89 PHE C C 89 176.906 176.906 175.859 1.047 18933 9182 1 13 . 1 1 89 89 PHE CA C 89 55.587 55.587 56.047 -0.460 18933 9183 1 13 . 1 1 89 89 PHE CB C 89 38.901 38.901 42.422 -3.521 18933 9184 1 13 . 1 1 89 89 PHE H H 89 8.937 8.937 8.757 0.180 18933 9185 1 13 . 1 1 90 90 ILE N N 90 119.928 119.928 118.992 0.936 18933 9186 1 13 . 1 1 90 90 ILE C C 90 173.781 173.781 174.955 -1.174 18933 9187 1 13 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.366 -0.712 18933 9188 1 13 . 1 1 90 90 ILE CB C 90 40.612 40.612 38.636 1.976 18933 9189 1 13 . 1 1 90 90 ILE H H 90 9.230 9.230 8.989 0.241 18933 9190 1 13 . 1 1 91 91 GLU N N 91 124.339 124.339 125.554 -1.215 18933 9191 1 13 . 1 1 91 91 GLU C C 91 175.607 175.607 175.404 0.203 18933 9192 1 13 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.725 -0.106 18933 9193 1 13 . 1 1 91 91 GLU CB C 91 29.837 29.837 32.539 -2.702 18933 9194 1 13 . 1 1 91 91 GLU H H 91 8.175 8.175 9.000 -0.825 18933 9195 1 13 . 1 1 92 92 TRP N N 92 127.516 127.516 124.477 3.039 18933 9196 1 13 . 1 1 92 92 TRP C C 92 175.203 175.203 176.232 -1.029 18933 9197 1 13 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.537 1.696 18933 9198 1 13 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.757 0.904 18933 9199 1 13 . 1 1 92 92 TRP H H 92 9.306 9.306 8.779 0.527 18933 9200 1 13 . 1 1 93 93 GLU N N 93 127.834 127.834 125.883 1.951 18933 9201 1 13 . 1 1 93 93 GLU C C 93 175.668 175.668 176.017 -0.349 18933 9202 1 13 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.522 -0.644 18933 9203 1 13 . 1 1 93 93 GLU CB C 93 26.034 26.034 29.109 -3.075 18933 9204 1 13 . 1 1 93 93 GLU H H 93 8.796 8.796 8.993 -0.197 18933 9205 1 13 . 1 1 94 94 LYS N N 94 108.931 108.931 112.829 -3.898 18933 9206 1 13 . 1 1 94 94 LYS C C 94 175.423 175.423 175.851 -0.428 18933 9207 1 13 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.679 -0.236 18933 9208 1 13 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.453 -2.820 18933 9209 1 13 . 1 1 94 94 LYS H H 94 8.498 8.498 8.570 -0.072 18933 9210 1 13 . 1 1 95 95 LYS N N 95 121.737 121.737 120.645 1.092 18933 9211 1 13 . 1 1 95 95 LYS C C 95 174.443 174.443 174.893 -0.450 18933 9212 1 13 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.360 -1.943 18933 9213 1 13 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.121 0.343 18933 9214 1 13 . 1 1 95 95 LYS H H 95 7.761 7.761 7.603 0.158 18933 9215 1 13 . 1 1 96 96 THR N N 96 116.067 116.067 116.208 -0.141 18933 9216 1 13 . 1 1 96 96 THR C C 96 174.296 174.296 173.731 0.565 18933 9217 1 13 . 1 1 96 96 THR CA C 96 61.115 61.115 61.135 -0.020 18933 9218 1 13 . 1 1 96 96 THR CB C 96 69.450 69.450 71.580 -2.130 18933 9219 1 13 . 1 1 96 96 THR H H 96 7.761 7.761 8.158 -0.397 18933 9220 1 13 . 1 1 97 97 TYR N N 97 124.229 124.229 123.734 0.495 18933 9221 1 13 . 1 1 97 97 TYR C C 97 173.536 173.536 174.284 -0.748 18933 9222 1 13 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.025 -0.075 18933 9223 1 13 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.283 -1.101 18933 9224 1 13 . 1 1 97 97 TYR H H 97 9.018 9.018 9.129 -0.111 18933 9225 1 13 . 1 1 98 98 GLN N N 98 123.435 123.435 122.889 0.546 18933 9226 1 13 . 1 1 98 98 GLN C C 98 173.266 173.266 173.759 -0.493 18933 9227 1 13 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.484 -0.341 18933 9228 1 13 . 1 1 98 98 GLN CB C 98 29.013 29.013 30.208 -1.195 18933 9229 1 13 . 1 1 98 98 GLN H H 98 8.781 8.781 9.180 -0.399 18933 9230 1 13 . 1 1 99 99 LEU N N 99 130.119 130.119 130.351 -0.232 18933 9231 1 13 . 1 1 99 99 LEU C C 99 173.867 173.867 174.307 -0.440 18933 9232 1 13 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.364 -0.844 18933 9233 1 13 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.611 -1.006 18933 9234 1 13 . 1 1 99 99 LEU H H 99 9.104 9.104 8.733 0.371 18933 9235 1 13 . 1 1 100 100 ASP N N 100 125.182 125.182 127.518 -2.336 18933 9236 1 13 . 1 1 100 100 ASP C C 100 172.837 172.837 174.721 -1.884 18933 9237 1 13 . 1 1 100 100 ASP CA C 100 51.754 51.754 55.219 -3.465 18933 9238 1 13 . 1 1 100 100 ASP CB C 100 39.344 39.344 42.744 -3.400 18933 9239 1 13 . 1 1 100 100 ASP H H 100 9.089 9.089 8.707 0.382 18933 9240 1 13 . 1 1 101 101 LEU N N 101 121.174 121.174 126.193 -5.019 18933 9241 1 13 . 1 1 101 101 LEU C C 101 174.529 174.529 174.832 -0.303 18933 9242 1 13 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.838 -1.923 18933 9243 1 13 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.842 -1.934 18933 9244 1 13 . 1 1 101 101 LEU H H 101 8.458 8.458 9.211 -0.753 18933 9245 1 13 . 1 1 102 102 PHE N N 102 119.464 119.464 124.038 -4.574 18933 9246 1 13 . 1 1 102 102 PHE C C 102 176.293 176.293 174.598 1.695 18933 9247 1 13 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.624 -1.570 18933 9248 1 13 . 1 1 102 102 PHE CB C 102 41.880 41.880 43.187 -1.307 18933 9249 1 13 . 1 1 102 102 PHE H H 102 8.281 8.281 9.162 -0.881 18933 9250 1 13 . 1 1 103 103 THR N N 103 108.576 108.576 118.040 -9.464 18933 9251 1 13 . 1 1 103 103 THR C C 103 174.933 174.933 173.486 1.447 18933 9252 1 13 . 1 1 103 103 THR CA C 103 57.726 57.726 60.063 -2.337 18933 9253 1 13 . 1 1 103 103 THR CB C 103 71.288 71.288 69.451 1.837 18933 9254 1 13 . 1 1 103 103 THR H H 103 7.872 7.872 8.257 -0.385 18933 9255 1 13 . 1 1 104 104 ALA N N 104 122.885 122.885 128.745 -5.860 18933 9256 1 13 . 1 1 104 104 ALA C C 104 175.754 175.754 174.881 0.873 18933 9257 1 13 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.771 0.247 18933 9258 1 13 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.743 -0.258 18933 9259 1 13 . 1 1 104 104 ALA H H 104 8.660 8.660 9.208 -0.548 18933 9260 1 13 . 1 1 105 105 LEU N N 105 120.881 120.881 120.513 0.368 18933 9261 1 13 . 1 1 105 105 LEU C C 105 179.504 179.504 178.217 1.287 18933 9262 1 13 . 1 1 105 105 LEU CA C 105 53.247 53.247 53.546 -0.299 18933 9263 1 13 . 1 1 105 105 LEU CB C 105 41.753 41.753 42.215 -0.462 18933 9264 1 13 . 1 1 105 105 LEU H H 105 8.226 8.226 8.192 0.034 18933 9265 1 13 . 1 1 106 106 ALA N N 106 124.901 124.901 123.364 1.537 18933 9266 1 13 . 1 1 106 106 ALA C C 106 181.269 181.269 179.373 1.896 18933 9267 1 13 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.491 1.822 18933 9268 1 13 . 1 1 106 106 ALA CB C 106 17.224 17.224 19.205 -1.981 18933 9269 1 13 . 1 1 106 106 ALA H H 106 8.392 8.392 8.446 -0.054 18933 9270 1 13 . 1 1 107 107 GLU N N 107 116.409 116.409 117.827 -1.418 18933 9271 1 13 . 1 1 107 107 GLU C C 107 177.764 177.764 177.241 0.523 18933 9272 1 13 . 1 1 107 107 GLU CA C 107 58.533 58.533 58.752 -0.219 18933 9273 1 13 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.841 -1.905 18933 9274 1 13 . 1 1 107 107 GLU H H 107 9.664 9.664 8.530 1.134 18933 9275 1 13 . 1 1 108 108 GLU N N 108 116.189 116.189 116.188 0.001 18933 9276 1 13 . 1 1 108 108 GLU CA C 108 55.143 55.143 57.191 -2.048 18933 9277 1 13 . 1 1 108 108 GLU CB C 108 29.837 29.837 28.947 0.890 18933 9278 1 13 . 1 1 108 108 GLU H H 108 7.589 7.589 8.468 -0.879 18933 9279 1 13 . 1 1 109 109 LYS N N 109 119.928 119.928 121.617 -1.689 18933 9280 1 13 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.288 1.563 18933 9281 1 13 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.541 -0.070 18933 9282 1 13 . 1 1 109 109 LYS H H 109 7.514 7.514 7.585 -0.071 18933 9283 1 13 . 1 1 111 111 TYR N N 111 114.930 114.930 119.255 -4.325 18933 9284 1 13 . 1 1 111 111 TYR C C 111 179.504 179.504 177.774 1.730 18933 9285 1 13 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.360 -2.343 18933 9286 1 13 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.602 -1.934 18933 9287 1 13 . 1 1 111 111 TYR H H 111 6.393 6.393 8.496 -2.103 18933 9288 1 13 . 1 1 112 112 ALA N N 112 124.901 124.901 121.836 3.065 18933 9289 1 13 . 1 1 112 112 ALA C C 112 179.173 179.173 179.463 -0.290 18933 9290 1 13 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.517 -0.616 18933 9291 1 13 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.366 -0.254 18933 9292 1 13 . 1 1 112 112 ALA H H 112 8.554 8.554 8.374 0.180 18933 9293 1 13 . 1 1 113 113 ILE N N 113 119.464 119.464 119.935 -0.471 18933 9294 1 13 . 1 1 113 113 ILE C C 113 178.499 178.499 177.644 0.855 18933 9295 1 13 . 1 1 113 113 ILE CA C 113 66.281 66.281 63.994 2.287 18933 9296 1 13 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.852 -0.536 18933 9297 1 13 . 1 1 113 113 ILE H H 113 8.680 8.680 7.602 1.078 18933 9298 1 13 . 1 1 114 114 PHE N N 114 122.922 122.922 121.843 1.079 18933 9299 1 13 . 1 1 114 114 PHE C C 114 178.217 178.217 178.000 0.217 18933 9300 1 13 . 1 1 114 114 PHE CA C 114 61.559 61.559 60.197 1.362 18933 9301 1 13 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.534 0.937 18933 9302 1 13 . 1 1 114 114 PHE H H 114 7.721 7.721 8.739 -1.018 18933 9303 1 13 . 1 1 115 115 HIS N N 115 118.560 118.560 118.673 -0.113 18933 9304 1 13 . 1 1 115 115 HIS C C 115 177.286 177.286 176.851 0.435 18933 9305 1 13 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.478 -0.098 18933 9306 1 13 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.323 1.542 18933 9307 1 13 . 1 1 115 115 HIS H H 115 8.155 8.155 8.441 -0.286 18933 9308 1 13 . 1 1 116 116 PHE N N 116 111.472 111.472 117.747 -6.275 18933 9309 1 13 . 1 1 116 116 PHE C C 116 179.026 179.026 177.855 1.171 18933 9310 1 13 . 1 1 116 116 PHE CA C 116 59.461 59.461 59.671 -0.210 18933 9311 1 13 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.704 -1.515 18933 9312 1 13 . 1 1 116 116 PHE H H 116 8.564 8.564 8.077 0.487 18933 9313 1 13 . 1 1 117 117 THR N N 117 119.012 119.012 113.560 5.452 18933 9314 1 13 . 1 1 117 117 THR C C 117 172.935 172.935 175.063 -2.128 18933 9315 1 13 . 1 1 117 117 THR CA C 117 67.088 67.088 65.259 1.829 18933 9316 1 13 . 1 1 117 117 THR CB C 117 37.126 37.126 68.694 -31.568 18933 9317 1 13 . 1 1 117 117 THR H H 117 7.620 7.620 8.658 -1.038 18933 9318 1 13 . 1 1 118 118 GLY N N 118 107.917 107.917 109.584 -1.667 18933 9319 1 13 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.114 2.053 18933 9320 1 13 . 1 1 118 118 GLY H H 118 6.666 6.666 7.605 -0.939 18933 9321 1 13 . 1 1 121 121 SER N N 121 113.354 113.354 118.252 -4.898 18933 9322 1 13 . 1 1 121 121 SER C C 121 176.061 176.061 175.927 0.134 18933 9323 1 13 . 1 1 121 121 SER CA C 121 61.035 61.035 61.445 -0.410 18933 9324 1 13 . 1 1 121 121 SER H H 121 8.322 8.322 8.192 0.130 18933 9325 1 13 . 1 1 122 122 TYR N N 122 124.681 124.681 120.974 3.707 18933 9326 1 13 . 1 1 122 122 TYR C C 122 176.293 176.293 177.179 -0.886 18933 9327 1 13 . 1 1 122 122 TYR CA C 122 59.057 59.057 61.327 -2.270 18933 9328 1 13 . 1 1 122 122 TYR CB C 122 38.711 38.711 37.986 0.725 18933 9329 1 13 . 1 1 122 122 TYR H H 122 6.514 6.514 8.180 -1.666 18933 9330 1 13 . 1 1 123 123 LEU N N 123 117.997 117.997 119.582 -1.585 18933 9331 1 13 . 1 1 123 123 LEU C C 123 179.774 179.774 178.953 0.821 18933 9332 1 13 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.617 0.261 18933 9333 1 13 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.866 -0.888 18933 9334 1 13 . 1 1 123 123 LEU H H 123 7.428 7.428 7.177 0.251 18933 9335 1 13 . 1 1 124 124 ILE N N 124 119.012 119.012 120.866 -1.854 18933 9336 1 13 . 1 1 124 124 ILE C C 124 178.830 178.830 178.049 0.781 18933 9337 1 13 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.256 -0.105 18933 9338 1 13 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.205 -0.142 18933 9339 1 13 . 1 1 124 124 ILE H H 124 8.453 8.453 8.437 0.016 18933 9340 1 13 . 1 1 125 125 ARG N N 125 121.174 121.174 119.164 2.010 18933 9341 1 13 . 1 1 125 125 ARG C C 125 179.762 179.762 178.882 0.880 18933 9342 1 13 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.128 0.929 18933 9343 1 13 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.277 -0.327 18933 9344 1 13 . 1 1 125 125 ARG H H 125 7.004 7.004 7.995 -0.991 18933 9345 1 13 . 1 1 126 126 ILE N N 126 122.299 122.299 120.625 1.674 18933 9346 1 13 . 1 1 126 126 ILE C C 126 178.352 178.352 177.869 0.483 18933 9347 1 13 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.722 -2.517 18933 9348 1 13 . 1 1 126 126 ILE CB C 126 35.415 35.415 36.937 -1.522 18933 9349 1 13 . 1 1 126 126 ILE H H 126 7.579 7.579 7.934 -0.355 18933 9350 1 13 . 1 1 127 127 ARG N N 127 119.354 119.354 119.437 -0.083 18933 9351 1 13 . 1 1 127 127 ARG C C 127 179.786 179.786 178.979 0.807 18933 9352 1 13 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.770 0.216 18933 9353 1 13 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.080 -0.750 18933 9354 1 13 . 1 1 127 127 ARG H H 127 8.715 8.715 8.059 0.656 18933 9355 1 13 . 1 1 128 128 ALA N N 128 122.873 122.873 121.099 1.774 18933 9356 1 13 . 1 1 128 128 ALA C C 128 180.325 180.325 179.346 0.979 18933 9357 1 13 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.595 0.145 18933 9358 1 13 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.250 -1.089 18933 9359 1 13 . 1 1 128 128 ALA H H 128 7.978 7.978 8.099 -0.121 18933 9360 1 13 . 1 1 129 129 ALA N N 129 121.846 121.846 121.782 0.064 18933 9361 1 13 . 1 1 129 129 ALA C C 129 181.539 181.539 179.850 1.689 18933 9362 1 13 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.777 -0.279 18933 9363 1 13 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.662 -1.184 18933 9364 1 13 . 1 1 129 129 ALA H H 129 7.519 7.519 8.111 -0.592 18933 9365 1 13 . 1 1 130 130 LEU N N 130 119.134 119.134 118.162 0.972 18933 9366 1 13 . 1 1 130 130 LEU C C 130 179.909 179.909 179.012 0.897 18933 9367 1 13 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.005 -0.006 18933 9368 1 13 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.748 -1.326 18933 9369 1 13 . 1 1 130 130 LEU H H 130 8.296 8.296 8.655 -0.359 18933 9370 1 13 . 1 1 131 131 LYS N N 131 122.299 122.299 120.260 2.039 18933 9371 1 13 . 1 1 131 131 LYS C C 131 180.289 180.289 179.488 0.801 18933 9372 1 13 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.654 -0.637 18933 9373 1 13 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.111 -0.879 18933 9374 1 13 . 1 1 131 131 LYS H H 131 8.281 8.281 7.825 0.456 18933 9375 1 13 . 1 1 132 132 LYS N N 132 118.743 118.743 118.586 0.157 18933 9376 1 13 . 1 1 132 132 LYS C C 132 177.482 177.482 177.800 -0.318 18933 9377 1 13 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.481 0.011 18933 9378 1 13 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.232 -1.000 18933 9379 1 13 . 1 1 132 132 LYS H H 132 7.317 7.317 7.620 -0.303 18933 9380 1 13 . 1 1 133 133 LYS N N 133 117.093 117.093 117.080 0.013 18933 9381 1 13 . 1 1 133 133 LYS C C 133 174.614 174.614 175.933 -1.319 18933 9382 1 13 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.713 -0.933 18933 9383 1 13 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.767 -0.585 18933 9384 1 13 . 1 1 133 133 LYS H H 133 7.327 7.327 7.647 -0.320 18933 9385 1 13 . 1 1 134 134 ASN N N 134 113.012 113.012 114.989 -1.977 18933 9386 1 13 . 1 1 134 134 ASN C C 134 173.965 173.965 173.728 0.237 18933 9387 1 13 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.114 0.182 18933 9388 1 13 . 1 1 134 134 ASN CB C 134 36.175 36.175 38.005 -1.830 18933 9389 1 13 . 1 1 134 134 ASN H H 134 7.938 7.938 7.882 0.056 18933 9390 1 13 . 1 1 135 135 TYR N N 135 115.725 115.725 119.422 -3.697 18933 9391 1 13 . 1 1 135 135 TYR C C 135 176.342 176.342 174.906 1.436 18933 9392 1 13 . 1 1 135 135 TYR CA C 135 55.668 55.668 56.525 -0.857 18933 9393 1 13 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.197 1.366 18933 9394 1 13 . 1 1 135 135 TYR H H 135 7.741 7.741 8.279 -0.538 18933 9395 1 13 . 1 1 136 136 LYS N N 136 122.641 122.641 124.865 -2.224 18933 9396 1 13 . 1 1 136 136 LYS C C 136 173.475 173.475 174.384 -0.909 18933 9397 1 13 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.573 0.328 18933 9398 1 13 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.786 -2.068 18933 9399 1 13 . 1 1 136 136 LYS H H 136 9.296 9.296 8.858 0.438 18933 9400 1 13 . 1 1 137 137 LEU N N 137 127.284 127.284 123.747 3.537 18933 9401 1 13 . 1 1 137 137 LEU C C 137 175.423 175.423 176.296 -0.873 18933 9402 1 13 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.336 -0.210 18933 9403 1 13 . 1 1 137 137 LEU CB C 137 45.746 45.746 41.980 3.766 18933 9404 1 13 . 1 1 137 137 LEU H H 137 8.776 8.776 8.564 0.212 18933 9405 1 13 . 1 1 138 138 ASN N N 138 125.818 125.818 120.007 5.811 18933 9406 1 13 . 1 1 138 138 ASN C C 138 174.933 174.933 175.345 -0.412 18933 9407 1 13 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.823 -0.706 18933 9408 1 13 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.120 -4.614 18933 9409 1 13 . 1 1 138 138 ASN H H 138 8.811 8.811 8.300 0.511 18933 9410 1 13 . 1 1 139 139 GLN N N 139 116.861 116.861 119.334 -2.473 18933 9411 1 13 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.949 -2.111 18933 9412 1 13 . 1 1 139 139 GLN CB C 139 25.717 25.717 29.079 -3.362 18933 9413 1 13 . 1 1 139 139 GLN H H 139 9.220 9.220 8.895 0.325 18933 9414 1 13 . 1 1 140 140 TYR N N 140 120.600 120.600 120.177 0.423 18933 9415 1 13 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.885 -1.128 18933 9416 1 13 . 1 1 140 140 TYR CB C 140 37.570 37.570 37.750 -0.180 18933 9417 1 13 . 1 1 140 140 TYR H H 140 8.549 8.549 8.447 0.102 18933 9418 1 13 . 1 1 141 141 GLY N N 141 105.986 105.986 108.096 -2.110 18933 9419 1 13 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.508 -0.664 18933 9420 1 13 . 1 1 141 141 GLY H H 141 7.186 7.186 7.766 -0.580 18933 9421 1 13 . 1 1 142 142 LEU N N 142 120.038 120.038 117.090 2.948 18933 9422 1 13 . 1 1 142 142 LEU C C 142 173.340 173.340 176.422 -3.082 18933 9423 1 13 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.502 -0.982 18933 9424 1 13 . 1 1 142 142 LEU CB C 142 44.351 44.351 42.891 1.460 18933 9425 1 13 . 1 1 142 142 LEU H H 142 7.539 7.539 8.304 -0.765 18933 9426 1 13 . 1 1 143 143 PHE N N 143 124.229 124.229 121.509 2.720 18933 9427 1 13 . 1 1 143 143 PHE C C 143 173.977 173.977 175.469 -1.492 18933 9428 1 13 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.136 -2.495 18933 9429 1 13 . 1 1 143 143 PHE CB C 143 44.668 44.668 39.745 4.923 18933 9430 1 13 . 1 1 143 143 PHE H H 143 9.084 9.084 9.087 -0.003 18933 9431 1 13 . 1 1 144 144 LYS N N 144 127.858 127.858 123.446 4.412 18933 9432 1 13 . 1 1 144 144 LYS C C 144 175.092 175.092 176.934 -1.842 18933 9433 1 13 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.321 4.535 18933 9434 1 13 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.390 4.194 18933 9435 1 13 . 1 1 144 144 LYS H H 144 9.281 9.281 8.944 0.337 18933 9436 1 13 . 1 1 145 145 ASN N N 145 128.188 128.188 126.885 1.303 18933 9437 1 13 . 1 1 145 145 ASN C C 145 175.779 175.779 174.502 1.277 18933 9438 1 13 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.482 3.244 18933 9439 1 13 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.986 -3.332 18933 9440 1 13 . 1 1 145 145 ASN H H 145 9.205 9.205 8.815 0.390 18933 9441 1 13 . 1 1 146 146 GLN N N 146 129.655 129.655 110.077 19.578 18933 9442 1 13 . 1 1 146 146 GLN C C 146 175.399 175.399 174.943 0.456 18933 9443 1 13 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.147 1.668 18933 9444 1 13 . 1 1 146 146 GLN CB C 146 32.626 32.626 27.873 4.753 18933 9445 1 13 . 1 1 146 146 GLN H H 146 8.983 8.983 8.686 0.297 18933 9446 1 13 . 1 1 147 147 THR N N 147 117.936 117.936 116.370 1.566 18933 9447 1 13 . 1 1 147 147 THR C C 147 173.254 173.254 173.488 -0.234 18933 9448 1 13 . 1 1 147 147 THR CA C 147 61.721 61.721 62.118 -0.397 18933 9449 1 13 . 1 1 147 147 THR CB C 147 70.274 70.274 69.820 0.454 18933 9450 1 13 . 1 1 147 147 THR H H 147 8.029 8.029 7.865 0.164 18933 9451 1 13 . 1 1 148 148 LEU N N 148 130.681 130.681 130.755 -0.074 18933 9452 1 13 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.448 0.018 18933 9453 1 13 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.926 -1.238 18933 9454 1 13 . 1 1 148 148 LEU H H 148 8.635 8.635 8.864 -0.229 18933 9455 1 13 . 1 1 149 149 VAL N N 149 130.803 130.803 128.515 2.288 18933 9456 1 13 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.113 1.065 18933 9457 1 13 . 1 1 149 149 VAL CB C 149 31.675 31.675 35.727 -4.052 18933 9458 1 13 . 1 1 149 149 VAL H H 149 8.968 8.968 9.325 -0.357 18933 9459 1 13 . 1 1 151 151 LEU N N 151 124.290 124.290 117.815 6.475 18933 9460 1 13 . 1 1 151 151 LEU CA C 151 54.013 54.013 53.605 0.408 18933 9461 1 13 . 1 1 151 151 LEU CB C 151 44.098 44.098 39.104 4.994 18933 9462 1 13 . 1 1 151 151 LEU H H 151 7.872 7.872 8.333 -0.461 18933 9463 1 13 . 1 1 153 153 ILE N N 153 114.943 114.943 119.707 -4.764 18933 9464 1 13 . 1 1 153 153 ILE C C 153 175.877 175.877 175.100 0.777 18933 9465 1 13 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.679 0.015 18933 9466 1 13 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.818 0.871 18933 9467 1 13 . 1 1 153 153 ILE H H 153 7.125 7.125 7.526 -0.401 18933 9468 1 13 . 1 1 154 154 THR N N 154 111.766 111.766 109.955 1.811 18933 9469 1 13 . 1 1 154 154 THR C C 154 174.945 174.945 174.284 0.661 18933 9470 1 13 . 1 1 154 154 THR CA C 154 62.124 62.124 62.996 -0.872 18933 9471 1 13 . 1 1 154 154 THR CB C 154 70.718 70.718 70.123 0.595 18933 9472 1 13 . 1 1 154 154 THR H H 154 9.286 9.286 8.240 1.046 18933 9473 1 13 . 1 1 155 155 THR N N 155 111.766 111.766 114.443 -2.677 18933 9474 1 13 . 1 1 155 155 THR CA C 155 58.936 58.936 59.545 -0.609 18933 9475 1 13 . 1 1 155 155 THR CB C 155 72.683 72.683 72.375 0.308 18933 9476 1 13 . 1 1 155 155 THR H H 155 7.645 7.645 7.559 0.086 18933 9477 1 13 . 1 1 157 157 LYS N N 157 119.464 119.464 118.929 0.535 18933 9478 1 13 . 1 1 157 157 LYS C C 157 178.781 178.781 178.628 0.153 18933 9479 1 13 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.744 0.282 18933 9480 1 13 . 1 1 157 157 LYS CB C 157 31.422 31.422 32.058 -0.636 18933 9481 1 13 . 1 1 157 157 LYS H H 157 8.175 8.175 8.292 -0.117 18933 9482 1 13 . 1 1 158 158 GLU N N 158 118.340 118.340 118.586 -0.246 18933 9483 1 13 . 1 1 158 158 GLU C C 158 178.867 178.867 179.183 -0.316 18933 9484 1 13 . 1 1 158 158 GLU CA C 158 58.492 58.492 58.908 -0.416 18933 9485 1 13 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.522 0.808 18933 9486 1 13 . 1 1 158 158 GLU H H 158 7.519 7.519 8.130 -0.611 18933 9487 1 13 . 1 1 159 159 LEU N N 159 120.710 120.710 121.515 -0.805 18933 9488 1 13 . 1 1 159 159 LEU C C 159 176.526 176.526 178.526 -2.000 18933 9489 1 13 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.071 0.099 18933 9490 1 13 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.751 -1.835 18933 9491 1 13 . 1 1 159 159 LEU H H 159 7.524 7.524 7.978 -0.454 18933 9492 1 13 . 1 1 160 160 ILE N N 160 118.217 118.217 118.430 -0.213 18933 9493 1 13 . 1 1 160 160 ILE C C 160 177.213 177.213 177.992 -0.779 18933 9494 1 13 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.563 -0.533 18933 9495 1 13 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.251 0.256 18933 9496 1 13 . 1 1 160 160 ILE H H 160 7.741 7.741 7.871 -0.130 18933 9497 1 13 . 1 1 161 161 LYS N N 161 118.450 118.450 119.870 -1.420 18933 9498 1 13 . 1 1 161 161 LYS C C 161 180.999 180.999 179.888 1.111 18933 9499 1 13 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.479 -0.664 18933 9500 1 13 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.177 -1.199 18933 9501 1 13 . 1 1 161 161 LYS H H 161 7.382 7.382 7.998 -0.616 18933 9502 1 13 . 1 1 162 162 GLU N N 162 121.846 121.846 121.044 0.802 18933 9503 1 13 . 1 1 162 162 GLU C C 162 178.818 178.818 178.614 0.204 18933 9504 1 13 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.751 -0.702 18933 9505 1 13 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.348 -1.412 18933 9506 1 13 . 1 1 162 162 GLU H H 162 8.210 8.210 7.872 0.338 18933 9507 1 13 . 1 1 163 163 LEU N N 163 116.751 116.751 115.299 1.452 18933 9508 1 13 . 1 1 163 163 LEU C C 163 176.784 176.784 177.569 -0.785 18933 9509 1 13 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.447 -0.425 18933 9510 1 13 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.778 -0.469 18933 9511 1 13 . 1 1 163 163 LEU H H 163 7.796 7.796 7.582 0.214 18933 9512 1 13 . 1 1 164 164 GLY N N 164 104.849 104.849 105.552 -0.703 18933 9513 1 13 . 1 1 164 164 GLY C C 164 174.492 174.492 174.263 0.229 18933 9514 1 13 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.463 -0.731 18933 9515 1 13 . 1 1 164 164 GLY H H 164 7.589 7.589 7.637 -0.048 18933 9516 1 13 . 1 1 165 165 PHE N N 165 118.902 118.902 119.372 -0.470 18933 9517 1 13 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.307 -0.639 18933 9518 1 13 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.212 -1.726 18933 9519 1 13 . 1 1 165 165 PHE H H 165 7.251 7.251 7.710 -0.459 18933 9520 1 13 . 1 1 166 166 THR N N 166 117.093 117.093 116.893 0.200 18933 9521 1 13 . 1 1 166 166 THR CA C 166 62.245 62.245 60.827 1.418 18933 9522 1 13 . 1 1 166 166 THR CB C 166 69.323 69.323 69.349 -0.026 18933 9523 1 13 . 1 1 166 166 THR H H 166 8.407 8.407 8.001 0.406 18933 9524 1 13 . 1 1 168 168 ARG N N 168 127.431 127.431 121.132 6.299 18933 9525 1 13 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.176 -1.938 18933 9526 1 13 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.631 -1.639 18933 9527 1 13 . 1 1 168 168 ARG H H 168 7.160 7.160 8.205 -1.045 18933 9528 1 13 . 1 1 171 171 LYS N N 171 113.574 113.574 116.264 -2.690 18933 9529 1 13 . 1 1 171 171 LYS C C 171 176.416 176.416 177.241 -0.825 18933 9530 1 13 . 1 1 171 171 LYS CA C 171 57.605 57.605 58.332 -0.727 18933 9531 1 13 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.285 0.644 18933 9532 1 13 . 1 1 171 171 LYS H H 171 8.210 8.210 8.187 0.023 18933 9533 1 13 . 1 1 172 172 LYS N N 172 117.313 117.313 117.023 0.290 18933 9534 1 13 . 1 1 172 172 LYS C C 172 175.717 175.717 176.793 -1.076 18933 9535 1 13 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.944 -2.769 18933 9536 1 13 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.959 -1.347 18933 9537 1 13 . 1 1 172 172 LYS H H 172 7.761 7.761 7.613 0.148 18933 9538 1 13 . 1 1 173 173 ARG N N 173 122.056 122.056 119.507 2.549 18933 9539 1 13 . 1 1 173 173 ARG C C 173 172.850 172.850 174.217 -1.367 18933 9540 1 13 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.449 0.429 18933 9541 1 13 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.209 0.297 18933 9542 1 13 . 1 1 173 173 ARG H H 173 6.885 6.885 7.679 -0.794 18933 9543 1 14 . 1 1 2 2 LEU N N 2 122.812 122.812 121.143 1.669 18933 9544 1 14 . 1 1 2 2 LEU C C 2 175.742 175.742 176.075 -0.333 18933 9545 1 14 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.754 0.380 18933 9546 1 14 . 1 1 2 2 LEU CB C 2 42.842 42.842 43.816 -0.974 18933 9547 1 14 . 1 1 2 2 LEU H H 2 8.756 8.756 7.694 1.062 18933 9548 1 14 . 1 1 3 3 THR N N 3 113.000 113.000 114.321 -1.321 18933 9549 1 14 . 1 1 3 3 THR C C 3 175.938 175.938 175.350 0.588 18933 9550 1 14 . 1 1 3 3 THR CA C 3 60.550 60.550 60.462 0.088 18933 9551 1 14 . 1 1 3 3 THR CB C 3 70.781 70.781 70.528 0.254 18933 9552 1 14 . 1 1 3 3 THR H H 3 8.428 8.428 8.103 0.325 18933 9553 1 14 . 1 1 4 4 LEU N N 4 122.531 122.531 123.431 -0.900 18933 9554 1 14 . 1 1 4 4 LEU C C 4 178.463 178.463 178.428 0.035 18933 9555 1 14 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.503 -0.374 18933 9556 1 14 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.042 -2.508 18933 9557 1 14 . 1 1 4 4 LEU H H 4 7.731 7.731 8.155 -0.424 18933 9558 1 14 . 1 1 5 5 ILE N N 5 115.505 115.505 117.320 -1.815 18933 9559 1 14 . 1 1 5 5 ILE C C 5 178.573 178.573 178.032 0.541 18933 9560 1 14 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.979 -1.241 18933 9561 1 14 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.316 -0.445 18933 9562 1 14 . 1 1 5 5 ILE H H 5 7.645 7.645 8.024 -0.379 18933 9563 1 14 . 1 1 6 6 GLN N N 6 121.626 121.626 119.425 2.201 18933 9564 1 14 . 1 1 6 6 GLN C C 6 179.014 179.014 178.774 0.240 18933 9565 1 14 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.226 -0.895 18933 9566 1 14 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.765 0.424 18933 9567 1 14 . 1 1 6 6 GLN H H 6 7.645 7.645 7.585 0.060 18933 9568 1 14 . 1 1 7 7 GLY N N 7 107.684 107.684 107.185 0.499 18933 9569 1 14 . 1 1 7 7 GLY C C 7 174.749 174.749 175.969 -1.220 18933 9570 1 14 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.994 -0.204 18933 9571 1 14 . 1 1 7 7 GLY H H 7 8.660 8.660 8.233 0.427 18933 9572 1 14 . 1 1 8 8 LYS N N 8 120.942 120.942 122.644 -1.702 18933 9573 1 14 . 1 1 8 8 LYS C C 8 179.455 179.455 178.402 1.053 18933 9574 1 14 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.222 0.683 18933 9575 1 14 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.224 -0.802 18933 9576 1 14 . 1 1 8 8 LYS H H 8 8.518 8.518 7.851 0.667 18933 9577 1 14 . 1 1 9 9 LYS N N 9 120.710 120.710 119.673 1.037 18933 9578 1 14 . 1 1 9 9 LYS C C 9 179.823 179.823 179.276 0.547 18933 9579 1 14 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.213 0.409 18933 9580 1 14 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.323 -1.028 18933 9581 1 14 . 1 1 9 9 LYS H H 9 7.731 7.731 8.073 -0.342 18933 9582 1 14 . 1 1 10 10 ILE N N 10 121.345 121.345 120.829 0.516 18933 9583 1 14 . 1 1 10 10 ILE C C 10 177.789 177.789 178.214 -0.425 18933 9584 1 14 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.936 -1.471 18933 9585 1 14 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.245 -1.880 18933 9586 1 14 . 1 1 10 10 ILE H H 10 7.711 7.711 8.457 -0.746 18933 9587 1 14 . 1 1 11 11 VAL N N 11 120.258 120.258 120.434 -0.176 18933 9588 1 14 . 1 1 11 11 VAL C C 11 177.372 177.372 178.202 -0.830 18933 9589 1 14 . 1 1 11 11 VAL CA C 11 67.451 67.451 66.965 0.486 18933 9590 1 14 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.012 -0.477 18933 9591 1 14 . 1 1 11 11 VAL H H 11 7.918 7.918 8.530 -0.612 18933 9592 1 14 . 1 1 12 12 ASN N N 12 116.971 116.971 117.791 -0.820 18933 9593 1 14 . 1 1 12 12 ASN C C 12 177.445 177.445 177.676 -0.231 18933 9594 1 14 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.500 -0.388 18933 9595 1 14 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.318 -0.685 18933 9596 1 14 . 1 1 12 12 ASN H H 12 7.993 7.993 8.521 -0.528 18933 9597 1 14 . 1 1 13 13 HIS N N 13 120.258 120.258 120.826 -0.568 18933 9598 1 14 . 1 1 13 13 HIS C C 13 177.862 177.862 177.911 -0.049 18933 9599 1 14 . 1 1 13 13 HIS CA C 13 59.098 59.098 58.181 0.917 18933 9600 1 14 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.654 0.578 18933 9601 1 14 . 1 1 13 13 HIS H H 13 7.741 7.741 8.272 -0.531 18933 9602 1 14 . 1 1 14 14 LEU N N 14 116.641 116.641 119.327 -2.686 18933 9603 1 14 . 1 1 14 14 LEU C C 14 179.186 179.186 178.267 0.919 18933 9604 1 14 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.336 -1.579 18933 9605 1 14 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.772 -0.653 18933 9606 1 14 . 1 1 14 14 LEU H H 14 8.221 8.221 8.536 -0.315 18933 9607 1 14 . 1 1 15 15 ARG N N 15 115.957 115.957 114.673 1.284 18933 9608 1 14 . 1 1 15 15 ARG C C 15 176.330 176.330 178.225 -1.895 18933 9609 1 14 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.582 1.121 18933 9610 1 14 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.388 -1.311 18933 9611 1 14 . 1 1 15 15 ARG H H 15 7.968 7.968 8.321 -0.353 18933 9612 1 14 . 1 1 16 16 SER N N 16 109.395 109.395 115.959 -6.564 18933 9613 1 14 . 1 1 16 16 SER C C 16 176.024 176.024 175.067 0.957 18933 9614 1 14 . 1 1 16 16 SER CA C 16 57.282 57.282 60.398 -3.116 18933 9615 1 14 . 1 1 16 16 SER CB C 16 63.683 63.683 63.738 -0.055 18933 9616 1 14 . 1 1 16 16 SER H H 16 6.963 6.963 7.455 -0.492 18933 9617 1 14 . 1 1 17 17 ARG N N 17 122.775 122.775 121.797 0.978 18933 9618 1 14 . 1 1 17 17 ARG C C 17 174.590 174.590 173.997 0.593 18933 9619 1 14 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.959 1.313 18933 9620 1 14 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.381 1.421 18933 9621 1 14 . 1 1 17 17 ARG H H 17 7.781 7.781 8.282 -0.501 18933 9622 1 14 . 1 1 18 18 LEU N N 18 122.421 122.421 125.786 -3.365 18933 9623 1 14 . 1 1 18 18 LEU C C 18 176.281 176.281 174.110 2.171 18933 9624 1 14 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.360 0.420 18933 9625 1 14 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.948 -3.737 18933 9626 1 14 . 1 1 18 18 LEU H H 18 8.650 8.650 7.751 0.899 18933 9627 1 14 . 1 1 19 19 ALA N N 19 126.441 126.441 126.599 -0.158 18933 9628 1 14 . 1 1 19 19 ALA C C 19 173.904 173.904 174.867 -0.963 18933 9629 1 14 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.638 -0.772 18933 9630 1 14 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.207 0.658 18933 9631 1 14 . 1 1 19 19 ALA H H 19 8.609 8.609 8.878 -0.269 18933 9632 1 14 . 1 1 20 20 PHE N N 20 114.600 114.600 119.160 -4.560 18933 9633 1 14 . 1 1 20 20 PHE C C 20 172.592 172.592 173.899 -1.307 18933 9634 1 14 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.912 0.877 18933 9635 1 14 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.599 -0.910 18933 9636 1 14 . 1 1 20 20 PHE H H 20 8.801 8.801 9.118 -0.317 18933 9637 1 14 . 1 1 21 21 GLU N N 21 122.873 122.873 123.224 -0.351 18933 9638 1 14 . 1 1 21 21 GLU C C 21 174.872 174.872 175.292 -0.420 18933 9639 1 14 . 1 1 21 21 GLU CA C 21 55.062 55.062 54.992 0.070 18933 9640 1 14 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.126 -0.401 18933 9641 1 14 . 1 1 21 21 GLU H H 21 7.847 7.847 9.259 -1.412 18933 9642 1 14 . 1 1 22 22 TYR N N 22 126.270 126.270 127.077 -0.807 18933 9643 1 14 . 1 1 22 22 TYR C C 22 174.872 174.872 174.688 0.184 18933 9644 1 14 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.548 -0.800 18933 9645 1 14 . 1 1 22 22 TYR CB C 22 40.105 40.105 40.507 -0.402 18933 9646 1 14 . 1 1 22 22 TYR H H 22 8.806 8.806 9.183 -0.377 18933 9647 1 14 . 1 1 23 23 ASN N N 23 128.420 128.420 126.458 1.962 18933 9648 1 14 . 1 1 23 23 ASN C C 23 175.435 175.435 175.130 0.305 18933 9649 1 14 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.747 -0.742 18933 9650 1 14 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.628 -1.263 18933 9651 1 14 . 1 1 23 23 ASN H H 23 8.943 8.943 9.245 -0.302 18933 9652 1 14 . 1 1 24 24 GLY N N 24 104.067 104.067 102.162 1.905 18933 9653 1 14 . 1 1 24 24 GLY C C 24 173.707 173.707 173.808 -0.101 18933 9654 1 14 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.909 0.025 18933 9655 1 14 . 1 1 24 24 GLY H H 24 8.534 8.534 8.164 0.370 18933 9656 1 14 . 1 1 25 25 GLN N N 25 120.038 120.038 120.169 -0.131 18933 9657 1 14 . 1 1 25 25 GLN C C 25 173.744 173.744 174.973 -1.229 18933 9658 1 14 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.598 -1.271 18933 9659 1 14 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.052 0.609 18933 9660 1 14 . 1 1 25 25 GLN H H 25 7.595 7.595 7.849 -0.254 18933 9661 1 14 . 1 1 26 26 LEU N N 26 124.681 124.681 125.127 -0.446 18933 9662 1 14 . 1 1 26 26 LEU C C 26 175.987 175.987 176.203 -0.216 18933 9663 1 14 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.470 -0.457 18933 9664 1 14 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.483 -1.619 18933 9665 1 14 . 1 1 26 26 LEU H H 26 8.382 8.382 8.582 -0.200 18933 9666 1 14 . 1 1 27 27 ILE N N 27 130.779 130.779 127.164 3.615 18933 9667 1 14 . 1 1 27 27 ILE C C 27 175.215 175.215 174.279 0.936 18933 9668 1 14 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.672 -0.413 18933 9669 1 14 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.304 -2.572 18933 9670 1 14 . 1 1 27 27 ILE H H 27 8.882 8.882 8.930 -0.048 18933 9671 1 14 . 1 1 28 28 LYS N N 28 126.160 126.160 127.467 -1.307 18933 9672 1 14 . 1 1 28 28 LYS C C 28 176.771 176.771 175.615 1.156 18933 9673 1 14 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.823 2.015 18933 9674 1 14 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.222 -1.483 18933 9675 1 14 . 1 1 28 28 LYS H H 28 8.165 8.165 8.367 -0.202 18933 9676 1 14 . 1 1 29 29 ILE N N 29 126.380 126.380 121.879 4.501 18933 9677 1 14 . 1 1 29 29 ILE C C 29 175.877 175.877 174.332 1.545 18933 9678 1 14 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.514 -0.206 18933 9679 1 14 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.656 -2.593 18933 9680 1 14 . 1 1 29 29 ILE H H 29 8.019 8.019 8.605 -0.586 18933 9681 1 14 . 1 1 30 30 LEU N N 30 129.215 129.215 122.240 6.975 18933 9682 1 14 . 1 1 30 30 LEU C C 30 178.867 178.867 178.183 0.684 18933 9683 1 14 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.344 1.275 18933 9684 1 14 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.638 -4.773 18933 9685 1 14 . 1 1 30 30 LEU H H 30 8.917 8.917 8.328 0.589 18933 9686 1 14 . 1 1 31 31 SER N N 31 117.997 117.997 116.571 1.426 18933 9687 1 14 . 1 1 31 31 SER C C 31 177.396 177.396 175.698 1.698 18933 9688 1 14 . 1 1 31 31 SER CA C 31 61.236 61.236 60.821 0.415 18933 9689 1 14 . 1 1 31 31 SER CB C 31 62.035 62.035 63.252 -1.217 18933 9690 1 14 . 1 1 31 31 SER H H 31 8.594 8.594 8.889 -0.295 18933 9691 1 14 . 1 1 32 32 LYS N N 32 116.189 116.189 119.051 -2.862 18933 9692 1 14 . 1 1 32 32 LYS C C 32 176.244 176.244 177.071 -0.827 18933 9693 1 14 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.443 -1.040 18933 9694 1 14 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.365 -2.084 18933 9695 1 14 . 1 1 32 32 LYS H H 32 8.029 8.029 8.246 -0.217 18933 9696 1 14 . 1 1 33 33 ASN N N 33 119.061 119.061 115.562 3.499 18933 9697 1 14 . 1 1 33 33 ASN C C 33 172.384 172.384 174.388 -2.004 18933 9698 1 14 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.206 -1.049 18933 9699 1 14 . 1 1 33 33 ASN CB C 33 38.267 38.267 40.916 -2.649 18933 9700 1 14 . 1 1 33 33 ASN H H 33 7.902 7.902 7.791 0.111 18933 9701 1 14 . 1 1 34 34 ILE N N 34 120.038 120.038 119.736 0.302 18933 9702 1 14 . 1 1 34 34 ILE C C 34 175.607 175.607 174.090 1.517 18933 9703 1 14 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.474 0.076 18933 9704 1 14 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.803 -2.839 18933 9705 1 14 . 1 1 34 34 ILE H H 34 7.443 7.443 7.795 -0.352 18933 9706 1 14 . 1 1 35 35 VAL N N 35 129.435 129.435 126.524 2.911 18933 9707 1 14 . 1 1 35 35 VAL C C 35 175.386 175.386 174.508 0.878 18933 9708 1 14 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.388 -0.362 18933 9709 1 14 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.535 -0.754 18933 9710 1 14 . 1 1 35 35 VAL H H 35 9.533 9.533 8.967 0.566 18933 9711 1 14 . 1 1 36 36 ALA N N 36 130.571 130.571 130.277 0.294 18933 9712 1 14 . 1 1 36 36 ALA C C 36 177.347 177.347 176.465 0.882 18933 9713 1 14 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.707 0.692 18933 9714 1 14 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.825 -0.967 18933 9715 1 14 . 1 1 36 36 ALA H H 36 8.665 8.665 8.581 0.084 18933 9716 1 14 . 1 1 37 37 VAL N N 37 115.395 115.395 120.162 -4.767 18933 9717 1 14 . 1 1 37 37 VAL C C 37 174.455 174.455 176.217 -1.762 18933 9718 1 14 . 1 1 37 37 VAL CA C 37 59.380 59.380 58.969 0.411 18933 9719 1 14 . 1 1 37 37 VAL CB C 37 32.943 32.943 34.232 -1.289 18933 9720 1 14 . 1 1 37 37 VAL H H 37 8.079 8.079 8.435 -0.356 18933 9721 1 14 . 1 1 38 38 GLY N N 38 107.672 107.672 108.314 -0.642 18933 9722 1 14 . 1 1 38 38 GLY C C 38 173.364 173.364 175.792 -2.428 18933 9723 1 14 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.332 -0.147 18933 9724 1 14 . 1 1 38 38 GLY H H 38 7.579 7.579 8.401 -0.822 18933 9725 1 14 . 1 1 39 39 SER N N 39 121.052 121.052 120.080 0.972 18933 9726 1 14 . 1 1 39 39 SER C C 39 175.570 175.570 176.430 -0.860 18933 9727 1 14 . 1 1 39 39 SER CA C 39 61.801 61.801 61.947 -0.146 18933 9728 1 14 . 1 1 39 39 SER CB C 39 62.478 62.478 63.375 -0.897 18933 9729 1 14 . 1 1 39 39 SER H H 39 8.953 8.953 8.126 0.827 18933 9730 1 14 . 1 1 40 40 LEU N N 40 121.553 121.553 120.128 1.425 18933 9731 1 14 . 1 1 40 40 LEU C C 40 180.203 180.203 178.514 1.689 18933 9732 1 14 . 1 1 40 40 LEU CA C 40 58.129 58.129 57.883 0.246 18933 9733 1 14 . 1 1 40 40 LEU CB C 40 41.753 41.753 42.020 -0.267 18933 9734 1 14 . 1 1 40 40 LEU H H 40 8.195 8.195 7.339 0.856 18933 9735 1 14 . 1 1 41 41 ARG N N 41 121.956 121.956 117.455 4.501 18933 9736 1 14 . 1 1 41 41 ARG C C 41 177.323 177.323 177.478 -0.155 18933 9737 1 14 . 1 1 41 41 ARG CA C 41 58.331 58.331 58.045 0.286 18933 9738 1 14 . 1 1 41 41 ARG CB C 41 28.443 28.443 30.079 -1.636 18933 9739 1 14 . 1 1 41 41 ARG H H 41 6.873 6.873 7.834 -0.961 18933 9740 1 14 . 1 1 42 42 ARG N N 42 114.600 114.600 116.408 -1.808 18933 9741 1 14 . 1 1 42 42 ARG C C 42 172.911 172.911 175.985 -3.074 18933 9742 1 14 . 1 1 42 42 ARG CA C 42 57.242 57.242 57.055 0.187 18933 9743 1 14 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.934 -1.794 18933 9744 1 14 . 1 1 42 42 ARG H H 42 7.438 7.438 7.863 -0.425 18933 9745 1 14 . 1 1 43 43 GLU N N 43 113.354 113.354 117.251 -3.897 18933 9746 1 14 . 1 1 43 43 GLU C C 43 175.999 175.999 174.907 1.092 18933 9747 1 14 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.448 -0.892 18933 9748 1 14 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.316 -1.979 18933 9749 1 14 . 1 1 43 43 GLU H H 43 7.564 7.564 8.006 -0.442 18933 9750 1 14 . 1 1 44 44 GLU N N 44 119.696 119.696 121.218 -1.522 18933 9751 1 14 . 1 1 44 44 GLU C C 44 175.423 175.423 176.575 -1.152 18933 9752 1 14 . 1 1 44 44 GLU CA C 44 56.838 56.838 57.252 -0.414 18933 9753 1 14 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.689 -1.993 18933 9754 1 14 . 1 1 44 44 GLU H H 44 7.261 7.261 8.478 -1.217 18933 9755 1 14 . 1 1 45 45 LYS N N 45 117.435 117.435 118.291 -0.856 18933 9756 1 14 . 1 1 45 45 LYS C C 45 177.715 177.715 175.372 2.343 18933 9757 1 14 . 1 1 45 45 LYS CA C 45 59.219 59.219 57.090 2.129 18933 9758 1 14 . 1 1 45 45 LYS CB C 45 32.119 32.119 33.684 -1.565 18933 9759 1 14 . 1 1 45 45 LYS H H 45 7.938 7.938 8.226 -0.288 18933 9760 1 14 . 1 1 46 46 MET N N 46 115.847 115.847 117.951 -2.104 18933 9761 1 14 . 1 1 46 46 MET CA C 46 52.520 52.520 53.776 -1.256 18933 9762 1 14 . 1 1 46 46 MET CB C 46 33.450 33.450 35.527 -2.077 18933 9763 1 14 . 1 1 46 46 MET H H 46 7.595 7.595 7.708 -0.113 18933 9764 1 14 . 1 1 47 47 LEU N N 47 121.627 121.627 122.662 -1.035 18933 9765 1 14 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.331 -1.205 18933 9766 1 14 . 1 1 47 47 LEU CB C 47 43.070 43.070 42.002 1.069 18933 9767 1 14 . 1 1 47 47 LEU H H 47 9.220 9.220 8.932 0.288 18933 9768 1 14 . 1 1 49 49 ASP N N 49 117.093 117.093 117.495 -0.402 18933 9769 1 14 . 1 1 49 49 ASP C C 49 173.340 173.340 174.379 -1.039 18933 9770 1 14 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.303 -1.509 18933 9771 1 14 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.840 -1.834 18933 9772 1 14 . 1 1 49 49 ASP H H 49 7.761 7.761 7.577 0.184 18933 9773 1 14 . 1 1 50 50 VAL N N 50 119.012 119.012 116.864 2.148 18933 9774 1 14 . 1 1 50 50 VAL C C 50 173.070 173.070 173.784 -0.714 18933 9775 1 14 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.266 1.576 18933 9776 1 14 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.074 -0.511 18933 9777 1 14 . 1 1 50 50 VAL H H 50 8.089 8.089 8.344 -0.255 18933 9778 1 14 . 1 1 51 51 ASP N N 51 127.064 127.064 125.029 2.035 18933 9779 1 14 . 1 1 51 51 ASP C C 51 174.565 174.565 175.148 -0.583 18933 9780 1 14 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.971 -0.814 18933 9781 1 14 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.567 -0.927 18933 9782 1 14 . 1 1 51 51 ASP H H 51 8.069 8.069 8.096 -0.027 18933 9783 1 14 . 1 1 52 52 LEU N N 52 121.627 121.627 120.279 1.348 18933 9784 1 14 . 1 1 52 52 LEU C C 52 174.063 174.063 174.628 -0.565 18933 9785 1 14 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.489 -0.807 18933 9786 1 14 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.368 -3.017 18933 9787 1 14 . 1 1 52 52 LEU H H 52 8.852 8.852 8.995 -0.143 18933 9788 1 14 . 1 1 53 53 LEU N N 53 123.093 123.093 123.511 -0.418 18933 9789 1 14 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.180 1.811 18933 9790 1 14 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.646 -2.513 18933 9791 1 14 . 1 1 53 53 LEU H H 53 9.362 9.362 9.123 0.239 18933 9792 1 14 . 1 1 54 54 ILE N N 54 123.777 123.777 129.109 -5.332 18933 9793 1 14 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.093 -4.031 18933 9794 1 14 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.625 -7.555 18933 9795 1 14 . 1 1 54 54 ILE H H 54 8.907 8.907 9.286 -0.379 18933 9796 1 14 . 1 1 58 58 GLU N N 58 114.710 114.710 117.165 -2.455 18933 9797 1 14 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.131 -0.754 18933 9798 1 14 . 1 1 58 58 GLU CB C 58 31.422 31.422 32.636 -1.214 18933 9799 1 14 . 1 1 58 58 GLU H H 58 6.716 6.716 7.364 -0.648 18933 9800 1 14 . 1 1 61 61 LEU N N 61 115.957 115.957 120.423 -4.466 18933 9801 1 14 . 1 1 61 61 LEU C C 61 178.512 178.512 178.563 -0.051 18933 9802 1 14 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.494 -2.714 18933 9803 1 14 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.927 -0.808 18933 9804 1 14 . 1 1 61 61 LEU H H 61 7.307 7.307 7.745 -0.438 18933 9805 1 14 . 1 1 62 62 LEU N N 62 120.038 120.038 119.521 0.517 18933 9806 1 14 . 1 1 62 62 LEU C C 62 177.874 177.874 178.758 -0.884 18933 9807 1 14 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.578 0.358 18933 9808 1 14 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.941 -1.202 18933 9809 1 14 . 1 1 62 62 LEU H H 62 7.327 7.327 8.221 -0.894 18933 9810 1 14 . 1 1 63 63 LYS N N 63 114.600 114.600 116.092 -1.492 18933 9811 1 14 . 1 1 63 63 LYS C C 63 175.460 175.460 177.823 -2.363 18933 9812 1 14 . 1 1 63 63 LYS CA C 63 57.564 57.564 59.035 -1.470 18933 9813 1 14 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.630 -1.905 18933 9814 1 14 . 1 1 63 63 LYS H H 63 7.973 7.973 7.812 0.161 18933 9815 1 14 . 1 1 64 64 HIS N N 64 115.273 115.273 115.746 -0.473 18933 9816 1 14 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.508 0.604 18933 9817 1 14 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.262 2.174 18933 9818 1 14 . 1 1 64 64 HIS H H 64 7.544 7.544 7.627 -0.083 18933 9819 1 14 . 1 1 65 65 VAL N N 65 118.682 118.682 119.588 -0.906 18933 9820 1 14 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.610 3.428 18933 9821 1 14 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.598 -2.571 18933 9822 1 14 . 1 1 65 65 VAL H H 65 6.787 6.787 7.237 -0.450 18933 9823 1 14 . 1 1 68 68 ASN N N 68 112.108 112.108 117.962 -5.854 18933 9824 1 14 . 1 1 68 68 ASN C C 68 174.884 174.884 173.910 0.974 18933 9825 1 14 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.368 -1.341 18933 9826 1 14 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.486 0.746 18933 9827 1 14 . 1 1 68 68 ASN H H 68 7.009 7.009 8.312 -1.303 18933 9828 1 14 . 1 1 69 69 ILE N N 69 123.325 123.325 123.435 -0.110 18933 9829 1 14 . 1 1 69 69 ILE C C 69 174.394 174.394 175.502 -1.108 18933 9830 1 14 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.624 -1.517 18933 9831 1 14 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.613 -0.346 18933 9832 1 14 . 1 1 69 69 ILE H H 69 7.150 7.150 8.326 -1.176 18933 9833 1 14 . 1 1 70 70 ARG N N 70 126.722 126.722 128.173 -1.451 18933 9834 1 14 . 1 1 70 70 ARG C C 70 174.590 174.590 174.079 0.511 18933 9835 1 14 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.533 -1.286 18933 9836 1 14 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.865 -2.493 18933 9837 1 14 . 1 1 70 70 ARG H H 70 8.902 8.902 9.282 -0.380 18933 9838 1 14 . 1 1 71 71 ILE N N 71 119.978 119.978 121.122 -1.144 18933 9839 1 14 . 1 1 71 71 ILE C C 71 175.583 175.583 175.622 -0.039 18933 9840 1 14 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.654 0.170 18933 9841 1 14 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.599 -2.839 18933 9842 1 14 . 1 1 71 71 ILE H H 71 7.491 7.491 8.865 -1.374 18933 9843 1 14 . 1 1 72 72 LYS N N 72 128.530 128.530 124.897 3.633 18933 9844 1 14 . 1 1 72 72 LYS C C 72 177.703 177.703 176.181 1.522 18933 9845 1 14 . 1 1 72 72 LYS CA C 72 57.201 57.201 54.796 2.405 18933 9846 1 14 . 1 1 72 72 LYS CB C 72 31.485 31.485 31.100 0.385 18933 9847 1 14 . 1 1 72 72 LYS H H 72 8.523 8.523 8.612 -0.089 18933 9848 1 14 . 1 1 73 73 GLY N N 73 113.806 113.806 110.172 3.634 18933 9849 1 14 . 1 1 73 73 GLY C C 73 173.781 173.781 172.895 0.886 18933 9850 1 14 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.183 0.639 18933 9851 1 14 . 1 1 73 73 GLY H H 73 8.791 8.791 8.280 0.511 18933 9852 1 14 . 1 1 74 74 LEU N N 74 120.490 120.490 118.410 2.080 18933 9853 1 14 . 1 1 74 74 LEU C C 74 175.840 175.840 173.570 2.270 18933 9854 1 14 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.280 -0.589 18933 9855 1 14 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.203 -1.042 18933 9856 1 14 . 1 1 74 74 LEU H H 74 7.393 7.393 7.256 0.137 18933 9857 1 14 . 1 1 75 75 SER N N 75 120.038 120.038 115.618 4.420 18933 9858 1 14 . 1 1 75 75 SER C C 75 173.205 173.205 173.007 0.198 18933 9859 1 14 . 1 1 75 75 SER CA C 75 57.887 57.887 57.596 0.291 18933 9860 1 14 . 1 1 75 75 SER CB C 75 63.049 63.049 64.882 -1.833 18933 9861 1 14 . 1 1 75 75 SER H H 75 8.917 8.917 8.181 0.736 18933 9862 1 14 . 1 1 76 76 PHE N N 76 119.586 119.586 118.363 1.223 18933 9863 1 14 . 1 1 76 76 PHE C C 76 173.536 173.536 173.360 0.176 18933 9864 1 14 . 1 1 76 76 PHE CA C 76 55.426 55.426 55.977 -0.551 18933 9865 1 14 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.362 -0.356 18933 9866 1 14 . 1 1 76 76 PHE H H 76 8.003 8.003 8.352 -0.349 18933 9867 1 14 . 1 1 77 77 SER N N 77 114.943 114.943 115.771 -0.828 18933 9868 1 14 . 1 1 77 77 SER C C 77 173.438 173.438 172.436 1.002 18933 9869 1 14 . 1 1 77 77 SER CA C 77 56.152 56.152 56.908 -0.756 18933 9870 1 14 . 1 1 77 77 SER CB C 77 65.204 65.204 65.773 -0.569 18933 9871 1 14 . 1 1 77 77 SER H H 77 8.907 8.907 8.824 0.083 18933 9872 1 14 . 1 1 78 78 VAL N N 78 124.791 124.791 124.282 0.509 18933 9873 1 14 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.203 1.841 18933 9874 1 14 . 1 1 78 78 VAL CB C 78 32.182 32.182 35.004 -2.821 18933 9875 1 14 . 1 1 78 78 VAL H H 78 8.892 8.892 8.269 0.623 18933 9876 1 14 . 1 1 79 79 LYS N N 79 129.667 129.667 129.183 0.484 18933 9877 1 14 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.536 1.656 18933 9878 1 14 . 1 1 79 79 LYS CB C 79 32.372 32.372 34.839 -2.467 18933 9879 1 14 . 1 1 79 79 LYS H H 79 9.049 9.049 8.937 0.112 18933 9880 1 14 . 1 1 82 82 GLY N N 82 117.263 117.263 113.055 4.208 18933 9881 1 14 . 1 1 82 82 GLY C C 82 171.710 171.710 174.687 -2.977 18933 9882 1 14 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.524 -2.599 18933 9883 1 14 . 1 1 82 82 GLY H H 82 8.044 8.044 8.410 -0.366 18933 9884 1 14 . 1 1 83 83 GLU N N 83 117.203 117.203 121.170 -3.967 18933 9885 1 14 . 1 1 83 83 GLU C C 83 178.695 178.695 177.945 0.750 18933 9886 1 14 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.608 1.369 18933 9887 1 14 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.868 -0.031 18933 9888 1 14 . 1 1 83 83 GLU H H 83 8.296 8.296 8.368 -0.072 18933 9889 1 14 . 1 1 84 84 ARG N N 84 113.818 113.818 119.285 -5.467 18933 9890 1 14 . 1 1 84 84 ARG C C 84 175.877 175.877 175.262 0.615 18933 9891 1 14 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.460 -1.729 18933 9892 1 14 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.332 1.963 18933 9893 1 14 . 1 1 84 84 ARG H H 84 8.342 8.342 7.984 0.358 18933 9894 1 14 . 1 1 85 85 LYS N N 85 119.354 119.354 121.532 -2.178 18933 9895 1 14 . 1 1 85 85 LYS C C 85 174.516 174.516 174.058 0.458 18933 9896 1 14 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.673 -0.933 18933 9897 1 14 . 1 1 85 85 LYS CB C 85 34.844 34.844 35.102 -0.258 18933 9898 1 14 . 1 1 85 85 LYS H H 85 6.822 6.822 7.603 -0.781 18933 9899 1 14 . 1 1 86 86 CYS N N 86 125.928 125.928 124.483 1.445 18933 9900 1 14 . 1 1 86 86 CYS C C 86 171.600 171.600 173.086 -1.486 18933 9901 1 14 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.977 -2.350 18933 9902 1 14 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.523 -0.179 18933 9903 1 14 . 1 1 86 86 CYS H H 86 9.084 9.084 9.345 -0.261 18933 9904 1 14 . 1 1 87 87 VAL N N 87 126.612 126.612 126.345 0.267 18933 9905 1 14 . 1 1 87 87 VAL C C 87 174.431 174.431 173.489 0.942 18933 9906 1 14 . 1 1 87 87 VAL CA C 87 61.317 61.317 59.891 1.427 18933 9907 1 14 . 1 1 87 87 VAL CB C 87 33.196 33.196 33.640 -0.444 18933 9908 1 14 . 1 1 87 87 VAL H H 87 8.705 8.705 9.030 -0.325 18933 9909 1 14 . 1 1 88 88 LEU N N 88 127.748 127.748 123.926 3.822 18933 9910 1 14 . 1 1 88 88 LEU C C 88 175.227 175.227 174.388 0.839 18933 9911 1 14 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.614 -0.094 18933 9912 1 14 . 1 1 88 88 LEU CB C 88 44.605 44.605 45.950 -1.345 18933 9913 1 14 . 1 1 88 88 LEU H H 88 9.417 9.417 8.668 0.749 18933 9914 1 14 . 1 1 89 89 PHE N N 89 120.981 120.981 118.726 2.255 18933 9915 1 14 . 1 1 89 89 PHE C C 89 176.906 176.906 176.204 0.702 18933 9916 1 14 . 1 1 89 89 PHE CA C 89 55.587 55.587 55.915 -0.328 18933 9917 1 14 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.443 -2.542 18933 9918 1 14 . 1 1 89 89 PHE H H 89 8.937 8.937 8.737 0.200 18933 9919 1 14 . 1 1 90 90 ILE N N 90 119.928 119.928 118.354 1.574 18933 9920 1 14 . 1 1 90 90 ILE C C 90 173.781 173.781 175.048 -1.267 18933 9921 1 14 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.900 -1.246 18933 9922 1 14 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.498 1.114 18933 9923 1 14 . 1 1 90 90 ILE H H 90 9.230 9.230 9.094 0.136 18933 9924 1 14 . 1 1 91 91 GLU N N 91 124.339 124.339 124.867 -0.528 18933 9925 1 14 . 1 1 91 91 GLU C C 91 175.607 175.607 175.164 0.443 18933 9926 1 14 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.790 -0.171 18933 9927 1 14 . 1 1 91 91 GLU CB C 91 29.837 29.837 32.776 -2.939 18933 9928 1 14 . 1 1 91 91 GLU H H 91 8.175 8.175 8.961 -0.786 18933 9929 1 14 . 1 1 92 92 TRP N N 92 127.516 127.516 124.622 2.894 18933 9930 1 14 . 1 1 92 92 TRP C C 92 175.203 175.203 176.615 -1.412 18933 9931 1 14 . 1 1 92 92 TRP CA C 92 56.233 56.233 55.084 1.149 18933 9932 1 14 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.442 1.219 18933 9933 1 14 . 1 1 92 92 TRP H H 92 9.306 9.306 8.024 1.282 18933 9934 1 14 . 1 1 93 93 GLU N N 93 127.834 127.834 125.508 2.326 18933 9935 1 14 . 1 1 93 93 GLU C C 93 175.668 175.668 176.064 -0.396 18933 9936 1 14 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.496 -0.618 18933 9937 1 14 . 1 1 93 93 GLU CB C 93 26.034 26.034 29.190 -3.156 18933 9938 1 14 . 1 1 93 93 GLU H H 93 8.796 8.796 8.954 -0.158 18933 9939 1 14 . 1 1 94 94 LYS N N 94 108.931 108.931 112.965 -4.034 18933 9940 1 14 . 1 1 94 94 LYS C C 94 175.423 175.423 176.293 -0.870 18933 9941 1 14 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.526 -0.083 18933 9942 1 14 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.253 -2.620 18933 9943 1 14 . 1 1 94 94 LYS H H 94 8.498 8.498 8.591 -0.093 18933 9944 1 14 . 1 1 95 95 LYS N N 95 121.737 121.737 119.965 1.772 18933 9945 1 14 . 1 1 95 95 LYS C C 95 174.443 174.443 175.464 -1.021 18933 9946 1 14 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.485 -2.068 18933 9947 1 14 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.510 -0.046 18933 9948 1 14 . 1 1 95 95 LYS H H 95 7.761 7.761 7.520 0.241 18933 9949 1 14 . 1 1 96 96 THR N N 96 116.067 116.067 116.082 -0.015 18933 9950 1 14 . 1 1 96 96 THR C C 96 174.296 174.296 173.899 0.397 18933 9951 1 14 . 1 1 96 96 THR CA C 96 61.115 61.115 61.403 -0.288 18933 9952 1 14 . 1 1 96 96 THR CB C 96 69.450 69.450 71.199 -1.749 18933 9953 1 14 . 1 1 96 96 THR H H 96 7.761 7.761 8.468 -0.707 18933 9954 1 14 . 1 1 97 97 TYR N N 97 124.229 124.229 125.351 -1.122 18933 9955 1 14 . 1 1 97 97 TYR C C 97 173.536 173.536 173.976 -0.440 18933 9956 1 14 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.611 -0.661 18933 9957 1 14 . 1 1 97 97 TYR CB C 97 41.182 41.182 43.270 -2.088 18933 9958 1 14 . 1 1 97 97 TYR H H 97 9.018 9.018 9.175 -0.157 18933 9959 1 14 . 1 1 98 98 GLN N N 98 123.435 123.435 123.939 -0.504 18933 9960 1 14 . 1 1 98 98 GLN C C 98 173.266 173.266 173.797 -0.531 18933 9961 1 14 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.560 -0.417 18933 9962 1 14 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.720 -0.707 18933 9963 1 14 . 1 1 98 98 GLN H H 98 8.781 8.781 8.900 -0.119 18933 9964 1 14 . 1 1 99 99 LEU N N 99 130.119 130.119 128.431 1.688 18933 9965 1 14 . 1 1 99 99 LEU C C 99 173.867 173.867 174.170 -0.303 18933 9966 1 14 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.504 -0.984 18933 9967 1 14 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.660 -1.055 18933 9968 1 14 . 1 1 99 99 LEU H H 99 9.104 9.104 8.911 0.193 18933 9969 1 14 . 1 1 100 100 ASP N N 100 125.182 125.182 128.341 -3.159 18933 9970 1 14 . 1 1 100 100 ASP C C 100 172.837 172.837 174.379 -1.542 18933 9971 1 14 . 1 1 100 100 ASP CA C 100 51.754 51.754 54.830 -3.076 18933 9972 1 14 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.140 -3.796 18933 9973 1 14 . 1 1 100 100 ASP H H 100 9.089 9.089 9.067 0.022 18933 9974 1 14 . 1 1 101 101 LEU N N 101 121.174 121.174 127.226 -6.052 18933 9975 1 14 . 1 1 101 101 LEU C C 101 174.529 174.529 174.682 -0.153 18933 9976 1 14 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.921 -2.006 18933 9977 1 14 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.285 -1.377 18933 9978 1 14 . 1 1 101 101 LEU H H 101 8.458 8.458 9.127 -0.669 18933 9979 1 14 . 1 1 102 102 PHE N N 102 119.464 119.464 126.668 -7.204 18933 9980 1 14 . 1 1 102 102 PHE C C 102 176.293 176.293 174.775 1.518 18933 9981 1 14 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.636 -1.582 18933 9982 1 14 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.604 -0.724 18933 9983 1 14 . 1 1 102 102 PHE H H 102 8.281 8.281 9.409 -1.128 18933 9984 1 14 . 1 1 103 103 THR N N 103 108.576 108.576 118.364 -9.788 18933 9985 1 14 . 1 1 103 103 THR C C 103 174.933 174.933 173.212 1.721 18933 9986 1 14 . 1 1 103 103 THR CA C 103 57.726 57.726 60.268 -2.542 18933 9987 1 14 . 1 1 103 103 THR CB C 103 71.288 71.288 69.137 2.151 18933 9988 1 14 . 1 1 103 103 THR H H 103 7.872 7.872 8.327 -0.455 18933 9989 1 14 . 1 1 104 104 ALA N N 104 122.885 122.885 129.337 -6.452 18933 9990 1 14 . 1 1 104 104 ALA C C 104 175.754 175.754 174.941 0.813 18933 9991 1 14 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.713 0.305 18933 9992 1 14 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.731 -0.246 18933 9993 1 14 . 1 1 104 104 ALA H H 104 8.660 8.660 9.234 -0.574 18933 9994 1 14 . 1 1 105 105 LEU N N 105 120.881 120.881 119.515 1.366 18933 9995 1 14 . 1 1 105 105 LEU C C 105 179.504 179.504 179.186 0.318 18933 9996 1 14 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.306 -1.059 18933 9997 1 14 . 1 1 105 105 LEU CB C 105 41.753 41.753 43.211 -1.458 18933 9998 1 14 . 1 1 105 105 LEU H H 105 8.226 8.226 8.168 0.058 18933 9999 1 14 . 1 1 106 106 ALA N N 106 124.901 124.901 125.243 -0.342 18933 10000 1 14 . 1 1 106 106 ALA C C 106 181.269 181.269 179.134 2.135 18933 10001 1 14 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.910 1.403 18933 10002 1 14 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.895 -1.671 18933 10003 1 14 . 1 1 106 106 ALA H H 106 8.392 8.392 8.688 -0.296 18933 10004 1 14 . 1 1 107 107 GLU N N 107 116.409 116.409 115.316 1.093 18933 10005 1 14 . 1 1 107 107 GLU C C 107 177.764 177.764 176.976 0.788 18933 10006 1 14 . 1 1 107 107 GLU CA C 107 58.533 58.533 57.771 0.762 18933 10007 1 14 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.248 -1.312 18933 10008 1 14 . 1 1 107 107 GLU H H 107 9.664 9.664 8.742 0.922 18933 10009 1 14 . 1 1 108 108 GLU N N 108 116.189 116.189 118.533 -2.344 18933 10010 1 14 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.048 -0.905 18933 10011 1 14 . 1 1 108 108 GLU CB C 108 29.837 29.837 29.022 0.815 18933 10012 1 14 . 1 1 108 108 GLU H H 108 7.589 7.589 7.769 -0.180 18933 10013 1 14 . 1 1 109 109 LYS N N 109 119.928 119.928 121.731 -1.803 18933 10014 1 14 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.209 1.642 18933 10015 1 14 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.467 0.004 18933 10016 1 14 . 1 1 109 109 LYS H H 109 7.514 7.514 7.504 0.010 18933 10017 1 14 . 1 1 111 111 TYR N N 111 114.930 114.930 119.064 -4.134 18933 10018 1 14 . 1 1 111 111 TYR C C 111 179.504 179.504 177.648 1.856 18933 10019 1 14 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.595 -2.578 18933 10020 1 14 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.676 -2.008 18933 10021 1 14 . 1 1 111 111 TYR H H 111 6.393 6.393 8.474 -2.081 18933 10022 1 14 . 1 1 112 112 ALA N N 112 124.901 124.901 121.770 3.131 18933 10023 1 14 . 1 1 112 112 ALA C C 112 179.173 179.173 179.398 -0.225 18933 10024 1 14 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.419 -0.518 18933 10025 1 14 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.262 -0.150 18933 10026 1 14 . 1 1 112 112 ALA H H 112 8.554 8.554 8.054 0.500 18933 10027 1 14 . 1 1 113 113 ILE N N 113 119.464 119.464 119.977 -0.513 18933 10028 1 14 . 1 1 113 113 ILE C C 113 178.499 178.499 177.623 0.876 18933 10029 1 14 . 1 1 113 113 ILE CA C 113 66.281 66.281 64.046 2.236 18933 10030 1 14 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.864 -0.548 18933 10031 1 14 . 1 1 113 113 ILE H H 113 8.680 8.680 7.584 1.096 18933 10032 1 14 . 1 1 114 114 PHE N N 114 122.922 122.922 122.268 0.654 18933 10033 1 14 . 1 1 114 114 PHE C C 114 178.217 178.217 178.001 0.216 18933 10034 1 14 . 1 1 114 114 PHE CA C 114 61.559 61.559 60.003 1.556 18933 10035 1 14 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.534 0.937 18933 10036 1 14 . 1 1 114 114 PHE H H 114 7.721 7.721 8.633 -0.912 18933 10037 1 14 . 1 1 115 115 HIS N N 115 118.560 118.560 119.497 -0.937 18933 10038 1 14 . 1 1 115 115 HIS C C 115 177.286 177.286 177.037 0.249 18933 10039 1 14 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.698 -0.318 18933 10040 1 14 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.052 1.813 18933 10041 1 14 . 1 1 115 115 HIS H H 115 8.155 8.155 8.573 -0.418 18933 10042 1 14 . 1 1 116 116 PHE N N 116 111.472 111.472 117.448 -5.976 18933 10043 1 14 . 1 1 116 116 PHE C C 116 179.026 179.026 177.658 1.368 18933 10044 1 14 . 1 1 116 116 PHE CA C 116 59.461 59.461 59.735 -0.274 18933 10045 1 14 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.695 -1.506 18933 10046 1 14 . 1 1 116 116 PHE H H 116 8.564 8.564 8.015 0.549 18933 10047 1 14 . 1 1 117 117 THR N N 117 119.012 119.012 113.063 5.949 18933 10048 1 14 . 1 1 117 117 THR C C 117 172.935 172.935 175.879 -2.944 18933 10049 1 14 . 1 1 117 117 THR CA C 117 67.088 67.088 65.529 1.559 18933 10050 1 14 . 1 1 117 117 THR CB C 117 37.126 37.126 68.998 -31.872 18933 10051 1 14 . 1 1 117 117 THR H H 117 7.620 7.620 8.566 -0.947 18933 10052 1 14 . 1 1 118 118 GLY N N 118 107.917 107.917 109.871 -1.954 18933 10053 1 14 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.346 1.821 18933 10054 1 14 . 1 1 118 118 GLY H H 118 6.666 6.666 7.865 -1.199 18933 10055 1 14 . 1 1 121 121 SER N N 121 113.354 113.354 117.841 -4.487 18933 10056 1 14 . 1 1 121 121 SER C C 121 176.061 176.061 175.761 0.300 18933 10057 1 14 . 1 1 121 121 SER CA C 121 61.035 61.035 62.436 -1.401 18933 10058 1 14 . 1 1 121 121 SER H H 121 8.322 8.322 8.388 -0.066 18933 10059 1 14 . 1 1 122 122 TYR N N 122 124.681 124.681 121.690 2.991 18933 10060 1 14 . 1 1 122 122 TYR C C 122 176.293 176.293 177.111 -0.818 18933 10061 1 14 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.541 -1.484 18933 10062 1 14 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.282 0.429 18933 10063 1 14 . 1 1 122 122 TYR H H 122 6.514 6.514 7.749 -1.235 18933 10064 1 14 . 1 1 123 123 LEU N N 123 117.997 117.997 119.610 -1.613 18933 10065 1 14 . 1 1 123 123 LEU C C 123 179.774 179.774 179.094 0.680 18933 10066 1 14 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.571 0.307 18933 10067 1 14 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.897 -0.919 18933 10068 1 14 . 1 1 123 123 LEU H H 123 7.428 7.428 7.146 0.282 18933 10069 1 14 . 1 1 124 124 ILE N N 124 119.012 119.012 120.293 -1.281 18933 10070 1 14 . 1 1 124 124 ILE C C 124 178.830 178.830 177.800 1.030 18933 10071 1 14 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.448 -0.297 18933 10072 1 14 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.349 -0.286 18933 10073 1 14 . 1 1 124 124 ILE H H 124 8.453 8.453 8.435 0.018 18933 10074 1 14 . 1 1 125 125 ARG N N 125 121.174 121.174 120.303 0.871 18933 10075 1 14 . 1 1 125 125 ARG C C 125 179.762 179.762 178.689 1.073 18933 10076 1 14 . 1 1 125 125 ARG CA C 125 59.057 59.057 59.340 -0.283 18933 10077 1 14 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.672 -0.722 18933 10078 1 14 . 1 1 125 125 ARG H H 125 7.004 7.004 8.075 -1.071 18933 10079 1 14 . 1 1 126 126 ILE N N 126 122.299 122.299 120.721 1.578 18933 10080 1 14 . 1 1 126 126 ILE C C 126 178.352 178.352 177.821 0.531 18933 10081 1 14 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.518 -2.313 18933 10082 1 14 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.053 -1.638 18933 10083 1 14 . 1 1 126 126 ILE H H 126 7.579 7.579 7.911 -0.332 18933 10084 1 14 . 1 1 127 127 ARG N N 127 119.354 119.354 120.424 -1.070 18933 10085 1 14 . 1 1 127 127 ARG C C 127 179.786 179.786 178.718 1.068 18933 10086 1 14 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.699 0.287 18933 10087 1 14 . 1 1 127 127 ARG CB C 127 29.330 29.330 29.974 -0.644 18933 10088 1 14 . 1 1 127 127 ARG H H 127 8.715 8.715 8.090 0.625 18933 10089 1 14 . 1 1 128 128 ALA N N 128 122.873 122.873 120.443 2.430 18933 10090 1 14 . 1 1 128 128 ALA C C 128 180.325 180.325 179.397 0.928 18933 10091 1 14 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.624 0.116 18933 10092 1 14 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.265 -1.104 18933 10093 1 14 . 1 1 128 128 ALA H H 128 7.978 7.978 8.225 -0.247 18933 10094 1 14 . 1 1 129 129 ALA N N 129 121.846 121.846 121.813 0.033 18933 10095 1 14 . 1 1 129 129 ALA C C 129 181.539 181.539 179.897 1.642 18933 10096 1 14 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.780 -0.282 18933 10097 1 14 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.710 -1.232 18933 10098 1 14 . 1 1 129 129 ALA H H 129 7.519 7.519 7.947 -0.428 18933 10099 1 14 . 1 1 130 130 LEU N N 130 119.134 119.134 118.396 0.738 18933 10100 1 14 . 1 1 130 130 LEU C C 130 179.909 179.909 178.868 1.041 18933 10101 1 14 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.029 -0.030 18933 10102 1 14 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.769 -1.347 18933 10103 1 14 . 1 1 130 130 LEU H H 130 8.296 8.296 8.682 -0.386 18933 10104 1 14 . 1 1 131 131 LYS N N 131 122.299 122.299 120.250 2.049 18933 10105 1 14 . 1 1 131 131 LYS C C 131 180.289 180.289 179.489 0.800 18933 10106 1 14 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.723 -0.706 18933 10107 1 14 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.112 -0.880 18933 10108 1 14 . 1 1 131 131 LYS H H 131 8.281 8.281 7.908 0.373 18933 10109 1 14 . 1 1 132 132 LYS N N 132 118.743 118.743 118.493 0.250 18933 10110 1 14 . 1 1 132 132 LYS C C 132 177.482 177.482 177.779 -0.297 18933 10111 1 14 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.553 -0.061 18933 10112 1 14 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.275 -1.043 18933 10113 1 14 . 1 1 132 132 LYS H H 132 7.317 7.317 7.638 -0.321 18933 10114 1 14 . 1 1 133 133 LYS N N 133 117.093 117.093 117.127 -0.034 18933 10115 1 14 . 1 1 133 133 LYS C C 133 174.614 174.614 176.127 -1.513 18933 10116 1 14 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.902 -1.122 18933 10117 1 14 . 1 1 133 133 LYS CB C 133 32.182 32.182 33.044 -0.862 18933 10118 1 14 . 1 1 133 133 LYS H H 133 7.327 7.327 7.679 -0.352 18933 10119 1 14 . 1 1 134 134 ASN N N 134 113.012 113.012 115.608 -2.596 18933 10120 1 14 . 1 1 134 134 ASN C C 134 173.965 173.965 173.471 0.494 18933 10121 1 14 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.553 -0.257 18933 10122 1 14 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.340 -1.165 18933 10123 1 14 . 1 1 134 134 ASN H H 134 7.938 7.938 7.935 0.003 18933 10124 1 14 . 1 1 135 135 TYR N N 135 115.725 115.725 119.536 -3.811 18933 10125 1 14 . 1 1 135 135 TYR C C 135 176.342 176.342 175.365 0.977 18933 10126 1 14 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.812 -2.144 18933 10127 1 14 . 1 1 135 135 TYR CB C 135 41.563 41.563 39.447 2.116 18933 10128 1 14 . 1 1 135 135 TYR H H 135 7.741 7.741 8.294 -0.553 18933 10129 1 14 . 1 1 136 136 LYS N N 136 122.641 122.641 125.471 -2.830 18933 10130 1 14 . 1 1 136 136 LYS C C 136 173.475 173.475 174.785 -1.310 18933 10131 1 14 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.789 0.112 18933 10132 1 14 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.208 -1.490 18933 10133 1 14 . 1 1 136 136 LYS H H 136 9.296 9.296 8.788 0.508 18933 10134 1 14 . 1 1 137 137 LEU N N 137 127.284 127.284 123.420 3.864 18933 10135 1 14 . 1 1 137 137 LEU C C 137 175.423 175.423 176.536 -1.113 18933 10136 1 14 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.050 0.076 18933 10137 1 14 . 1 1 137 137 LEU CB C 137 45.746 45.746 41.854 3.892 18933 10138 1 14 . 1 1 137 137 LEU H H 137 8.776 8.776 8.461 0.315 18933 10139 1 14 . 1 1 138 138 ASN N N 138 125.818 125.818 119.343 6.475 18933 10140 1 14 . 1 1 138 138 ASN C C 138 174.933 174.933 175.125 -0.192 18933 10141 1 14 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.211 -0.094 18933 10142 1 14 . 1 1 138 138 ASN CB C 138 37.506 37.506 41.730 -4.224 18933 10143 1 14 . 1 1 138 138 ASN H H 138 8.811 8.811 8.142 0.669 18933 10144 1 14 . 1 1 139 139 GLN N N 139 116.861 116.861 119.720 -2.859 18933 10145 1 14 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.219 -1.381 18933 10146 1 14 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.733 -3.016 18933 10147 1 14 . 1 1 139 139 GLN H H 139 9.220 9.220 8.929 0.291 18933 10148 1 14 . 1 1 140 140 TYR N N 140 120.600 120.600 119.671 0.929 18933 10149 1 14 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.895 -1.138 18933 10150 1 14 . 1 1 140 140 TYR CB C 140 37.570 37.570 38.138 -0.568 18933 10151 1 14 . 1 1 140 140 TYR H H 140 8.549 8.549 7.805 0.744 18933 10152 1 14 . 1 1 141 141 GLY N N 141 105.986 105.986 108.016 -2.030 18933 10153 1 14 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.407 -0.563 18933 10154 1 14 . 1 1 141 141 GLY H H 141 7.186 7.186 7.898 -0.712 18933 10155 1 14 . 1 1 142 142 LEU N N 142 120.038 120.038 116.914 3.124 18933 10156 1 14 . 1 1 142 142 LEU C C 142 173.340 173.340 176.031 -2.691 18933 10157 1 14 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.329 -0.809 18933 10158 1 14 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.293 1.058 18933 10159 1 14 . 1 1 142 142 LEU H H 142 7.539 7.539 8.336 -0.797 18933 10160 1 14 . 1 1 143 143 PHE N N 143 124.229 124.229 120.317 3.912 18933 10161 1 14 . 1 1 143 143 PHE C C 143 173.977 173.977 175.234 -1.257 18933 10162 1 14 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.193 -2.551 18933 10163 1 14 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.257 4.412 18933 10164 1 14 . 1 1 143 143 PHE H H 143 9.084 9.084 8.927 0.157 18933 10165 1 14 . 1 1 144 144 LYS N N 144 127.858 127.858 123.092 4.766 18933 10166 1 14 . 1 1 144 144 LYS C C 144 175.092 175.092 176.702 -1.610 18933 10167 1 14 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.345 4.511 18933 10168 1 14 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.759 3.825 18933 10169 1 14 . 1 1 144 144 LYS H H 144 9.281 9.281 8.958 0.323 18933 10170 1 14 . 1 1 145 145 ASN N N 145 128.188 128.188 125.711 2.477 18933 10171 1 14 . 1 1 145 145 ASN C C 145 175.779 175.779 175.030 0.749 18933 10172 1 14 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.662 3.064 18933 10173 1 14 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.351 -2.697 18933 10174 1 14 . 1 1 145 145 ASN H H 145 9.205 9.205 9.341 -0.136 18933 10175 1 14 . 1 1 146 146 GLN N N 146 129.655 129.655 112.804 16.851 18933 10176 1 14 . 1 1 146 146 GLN C C 146 175.399 175.399 174.258 1.141 18933 10177 1 14 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.292 1.523 18933 10178 1 14 . 1 1 146 146 GLN CB C 146 32.626 32.626 28.233 4.393 18933 10179 1 14 . 1 1 146 146 GLN H H 146 8.983 8.983 8.678 0.305 18933 10180 1 14 . 1 1 147 147 THR N N 147 117.936 117.936 115.895 2.041 18933 10181 1 14 . 1 1 147 147 THR C C 147 173.254 173.254 173.386 -0.132 18933 10182 1 14 . 1 1 147 147 THR CA C 147 61.721 61.721 61.556 0.165 18933 10183 1 14 . 1 1 147 147 THR CB C 147 70.274 70.274 69.437 0.837 18933 10184 1 14 . 1 1 147 147 THR H H 147 8.029 8.029 7.827 0.202 18933 10185 1 14 . 1 1 148 148 LEU N N 148 130.681 130.681 131.035 -0.354 18933 10186 1 14 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.415 0.051 18933 10187 1 14 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.872 -1.183 18933 10188 1 14 . 1 1 148 148 LEU H H 148 8.635 8.635 8.914 -0.279 18933 10189 1 14 . 1 1 149 149 VAL N N 149 130.803 130.803 128.748 2.055 18933 10190 1 14 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.051 1.127 18933 10191 1 14 . 1 1 149 149 VAL CB C 149 31.675 31.675 35.658 -3.983 18933 10192 1 14 . 1 1 149 149 VAL H H 149 8.968 8.968 9.244 -0.276 18933 10193 1 14 . 1 1 151 151 LEU N N 151 124.290 124.290 117.988 6.302 18933 10194 1 14 . 1 1 151 151 LEU CA C 151 54.013 54.013 53.602 0.411 18933 10195 1 14 . 1 1 151 151 LEU CB C 151 44.098 44.098 39.176 4.922 18933 10196 1 14 . 1 1 151 151 LEU H H 151 7.872 7.872 8.352 -0.480 18933 10197 1 14 . 1 1 153 153 ILE N N 153 114.943 114.943 121.768 -6.825 18933 10198 1 14 . 1 1 153 153 ILE C C 153 175.877 175.877 175.281 0.596 18933 10199 1 14 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.652 0.042 18933 10200 1 14 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.386 1.303 18933 10201 1 14 . 1 1 153 153 ILE H H 153 7.125 7.125 7.627 -0.502 18933 10202 1 14 . 1 1 154 154 THR N N 154 111.766 111.766 110.967 0.799 18933 10203 1 14 . 1 1 154 154 THR C C 154 174.945 174.945 174.541 0.404 18933 10204 1 14 . 1 1 154 154 THR CA C 154 62.124 62.124 63.440 -1.316 18933 10205 1 14 . 1 1 154 154 THR CB C 154 70.718 70.718 69.475 1.243 18933 10206 1 14 . 1 1 154 154 THR H H 154 9.286 9.286 8.367 0.919 18933 10207 1 14 . 1 1 155 155 THR N N 155 111.766 111.766 114.289 -2.523 18933 10208 1 14 . 1 1 155 155 THR CA C 155 58.936 58.936 60.442 -1.506 18933 10209 1 14 . 1 1 155 155 THR CB C 155 72.683 72.683 71.252 1.431 18933 10210 1 14 . 1 1 155 155 THR H H 155 7.645 7.645 7.384 0.261 18933 10211 1 14 . 1 1 157 157 LYS N N 157 119.464 119.464 119.064 0.400 18933 10212 1 14 . 1 1 157 157 LYS C C 157 178.781 178.781 178.580 0.201 18933 10213 1 14 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.638 0.388 18933 10214 1 14 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.820 -0.398 18933 10215 1 14 . 1 1 157 157 LYS H H 157 8.175 8.175 8.192 -0.017 18933 10216 1 14 . 1 1 158 158 GLU N N 158 118.340 118.340 118.398 -0.058 18933 10217 1 14 . 1 1 158 158 GLU C C 158 178.867 178.867 179.175 -0.308 18933 10218 1 14 . 1 1 158 158 GLU CA C 158 58.492 58.492 58.813 -0.321 18933 10219 1 14 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.530 0.800 18933 10220 1 14 . 1 1 158 158 GLU H H 158 7.519 7.519 8.135 -0.616 18933 10221 1 14 . 1 1 159 159 LEU N N 159 120.710 120.710 121.731 -1.021 18933 10222 1 14 . 1 1 159 159 LEU C C 159 176.526 176.526 178.528 -2.002 18933 10223 1 14 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.179 -0.009 18933 10224 1 14 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.693 -1.778 18933 10225 1 14 . 1 1 159 159 LEU H H 159 7.524 7.524 7.990 -0.466 18933 10226 1 14 . 1 1 160 160 ILE N N 160 118.217 118.217 118.580 -0.363 18933 10227 1 14 . 1 1 160 160 ILE C C 160 177.213 177.213 177.971 -0.758 18933 10228 1 14 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.520 -0.490 18933 10229 1 14 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.197 0.309 18933 10230 1 14 . 1 1 160 160 ILE H H 160 7.741 7.741 7.959 -0.218 18933 10231 1 14 . 1 1 161 161 LYS N N 161 118.450 118.450 119.979 -1.529 18933 10232 1 14 . 1 1 161 161 LYS C C 161 180.999 180.999 179.829 1.170 18933 10233 1 14 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.558 -0.743 18933 10234 1 14 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.201 -1.223 18933 10235 1 14 . 1 1 161 161 LYS H H 161 7.382 7.382 8.014 -0.632 18933 10236 1 14 . 1 1 162 162 GLU N N 162 121.846 121.846 120.840 1.006 18933 10237 1 14 . 1 1 162 162 GLU C C 162 178.818 178.818 178.385 0.433 18933 10238 1 14 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.724 -0.675 18933 10239 1 14 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.352 -1.417 18933 10240 1 14 . 1 1 162 162 GLU H H 162 8.210 8.210 7.820 0.390 18933 10241 1 14 . 1 1 163 163 LEU N N 163 116.751 116.751 115.068 1.683 18933 10242 1 14 . 1 1 163 163 LEU C C 163 176.784 176.784 177.342 -0.558 18933 10243 1 14 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.362 -0.340 18933 10244 1 14 . 1 1 163 163 LEU CB C 163 41.309 41.309 42.000 -0.691 18933 10245 1 14 . 1 1 163 163 LEU H H 163 7.796 7.796 7.527 0.269 18933 10246 1 14 . 1 1 164 164 GLY N N 164 104.849 104.849 105.335 -0.486 18933 10247 1 14 . 1 1 164 164 GLY C C 164 174.492 174.492 174.124 0.368 18933 10248 1 14 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.329 -0.597 18933 10249 1 14 . 1 1 164 164 GLY H H 164 7.589 7.589 7.531 0.058 18933 10250 1 14 . 1 1 165 165 PHE N N 165 118.902 118.902 118.898 0.004 18933 10251 1 14 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.431 -0.763 18933 10252 1 14 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.286 -1.801 18933 10253 1 14 . 1 1 165 165 PHE H H 165 7.251 7.251 7.698 -0.447 18933 10254 1 14 . 1 1 166 166 THR N N 166 117.093 117.093 115.756 1.337 18933 10255 1 14 . 1 1 166 166 THR CA C 166 62.245 62.245 60.448 1.797 18933 10256 1 14 . 1 1 166 166 THR CB C 166 69.323 69.323 69.410 -0.087 18933 10257 1 14 . 1 1 166 166 THR H H 166 8.407 8.407 8.306 0.101 18933 10258 1 14 . 1 1 168 168 ARG N N 168 127.431 127.431 120.332 7.099 18933 10259 1 14 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.611 -2.373 18933 10260 1 14 . 1 1 168 168 ARG CB C 168 31.992 31.992 32.843 -0.851 18933 10261 1 14 . 1 1 168 168 ARG H H 168 7.160 7.160 8.501 -1.341 18933 10262 1 14 . 1 1 171 171 LYS N N 171 113.574 113.574 113.249 0.325 18933 10263 1 14 . 1 1 171 171 LYS C C 171 176.416 176.416 176.841 -0.425 18933 10264 1 14 . 1 1 171 171 LYS CA C 171 57.605 57.605 57.182 0.423 18933 10265 1 14 . 1 1 171 171 LYS CB C 171 31.929 31.929 30.855 1.074 18933 10266 1 14 . 1 1 171 171 LYS H H 171 8.210 8.210 8.203 0.007 18933 10267 1 14 . 1 1 172 172 LYS N N 172 117.313 117.313 119.917 -2.604 18933 10268 1 14 . 1 1 172 172 LYS C C 172 175.717 175.717 176.775 -1.058 18933 10269 1 14 . 1 1 172 172 LYS CA C 172 54.175 54.175 55.856 -1.681 18933 10270 1 14 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.868 -1.256 18933 10271 1 14 . 1 1 172 172 LYS H H 172 7.761 7.761 7.683 0.078 18933 10272 1 14 . 1 1 173 173 ARG N N 173 122.056 122.056 120.336 1.720 18933 10273 1 14 . 1 1 173 173 ARG C C 173 172.850 172.850 174.350 -1.500 18933 10274 1 14 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.354 0.524 18933 10275 1 14 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.546 -0.040 18933 10276 1 14 . 1 1 173 173 ARG H H 173 6.885 6.885 7.874 -0.989 18933 10277 1 15 . 1 1 2 2 LEU N N 2 122.812 122.812 122.200 0.612 18933 10278 1 15 . 1 1 2 2 LEU C C 2 175.742 175.742 176.100 -0.358 18933 10279 1 15 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.787 0.347 18933 10280 1 15 . 1 1 2 2 LEU CB C 2 42.842 42.842 45.028 -2.186 18933 10281 1 15 . 1 1 2 2 LEU H H 2 8.756 8.756 8.559 0.197 18933 10282 1 15 . 1 1 3 3 THR N N 3 113.000 113.000 111.323 1.677 18933 10283 1 15 . 1 1 3 3 THR C C 3 175.938 175.938 175.678 0.260 18933 10284 1 15 . 1 1 3 3 THR CA C 3 60.550 60.550 59.941 0.609 18933 10285 1 15 . 1 1 3 3 THR CB C 3 70.781 70.781 70.553 0.228 18933 10286 1 15 . 1 1 3 3 THR H H 3 8.428 8.428 8.115 0.313 18933 10287 1 15 . 1 1 4 4 LEU N N 4 122.531 122.531 122.970 -0.439 18933 10288 1 15 . 1 1 4 4 LEU C C 4 178.463 178.463 178.451 0.012 18933 10289 1 15 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.405 -0.276 18933 10290 1 15 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.058 -2.524 18933 10291 1 15 . 1 1 4 4 LEU H H 4 7.731 7.731 8.200 -0.469 18933 10292 1 15 . 1 1 5 5 ILE N N 5 115.505 115.505 116.116 -0.611 18933 10293 1 15 . 1 1 5 5 ILE C C 5 178.573 178.573 177.898 0.675 18933 10294 1 15 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.416 -0.678 18933 10295 1 15 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.346 -0.474 18933 10296 1 15 . 1 1 5 5 ILE H H 5 7.645 7.645 7.926 -0.281 18933 10297 1 15 . 1 1 6 6 GLN N N 6 121.626 121.626 119.504 2.122 18933 10298 1 15 . 1 1 6 6 GLN C C 6 179.014 179.014 178.773 0.241 18933 10299 1 15 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.081 -0.750 18933 10300 1 15 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.807 0.382 18933 10301 1 15 . 1 1 6 6 GLN H H 6 7.645 7.645 7.681 -0.036 18933 10302 1 15 . 1 1 7 7 GLY N N 7 107.684 107.684 106.764 0.920 18933 10303 1 15 . 1 1 7 7 GLY C C 7 174.749 174.749 176.259 -1.510 18933 10304 1 15 . 1 1 7 7 GLY CA C 7 46.790 46.790 47.040 -0.250 18933 10305 1 15 . 1 1 7 7 GLY H H 7 8.660 8.660 8.080 0.580 18933 10306 1 15 . 1 1 8 8 LYS N N 8 120.942 120.942 122.415 -1.473 18933 10307 1 15 . 1 1 8 8 LYS C C 8 179.455 179.455 178.763 0.692 18933 10308 1 15 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.288 0.617 18933 10309 1 15 . 1 1 8 8 LYS CB C 8 31.422 31.422 31.970 -0.548 18933 10310 1 15 . 1 1 8 8 LYS H H 8 8.518 8.518 7.452 1.066 18933 10311 1 15 . 1 1 9 9 LYS N N 9 120.710 120.710 119.835 0.875 18933 10312 1 15 . 1 1 9 9 LYS C C 9 179.823 179.823 179.344 0.479 18933 10313 1 15 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.198 0.424 18933 10314 1 15 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.327 -1.032 18933 10315 1 15 . 1 1 9 9 LYS H H 9 7.731 7.731 8.061 -0.330 18933 10316 1 15 . 1 1 10 10 ILE N N 10 121.345 121.345 120.396 0.949 18933 10317 1 15 . 1 1 10 10 ILE C C 10 177.789 177.789 178.363 -0.574 18933 10318 1 15 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.888 -1.423 18933 10319 1 15 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.226 -1.861 18933 10320 1 15 . 1 1 10 10 ILE H H 10 7.711 7.711 8.260 -0.549 18933 10321 1 15 . 1 1 11 11 VAL N N 11 120.258 120.258 119.859 0.399 18933 10322 1 15 . 1 1 11 11 VAL C C 11 177.372 177.372 177.722 -0.350 18933 10323 1 15 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.189 0.262 18933 10324 1 15 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.607 -1.073 18933 10325 1 15 . 1 1 11 11 VAL H H 11 7.918 7.918 8.413 -0.495 18933 10326 1 15 . 1 1 12 12 ASN N N 12 116.971 116.971 117.700 -0.729 18933 10327 1 15 . 1 1 12 12 ASN C C 12 177.445 177.445 177.292 0.153 18933 10328 1 15 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.662 -0.550 18933 10329 1 15 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.583 -0.950 18933 10330 1 15 . 1 1 12 12 ASN H H 12 7.993 7.993 8.649 -0.656 18933 10331 1 15 . 1 1 13 13 HIS N N 13 120.258 120.258 119.891 0.367 18933 10332 1 15 . 1 1 13 13 HIS C C 13 177.862 177.862 178.211 -0.349 18933 10333 1 15 . 1 1 13 13 HIS CA C 13 59.098 59.098 58.336 0.762 18933 10334 1 15 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.418 0.814 18933 10335 1 15 . 1 1 13 13 HIS H H 13 7.741 7.741 8.247 -0.506 18933 10336 1 15 . 1 1 14 14 LEU N N 14 116.641 116.641 120.067 -3.426 18933 10337 1 15 . 1 1 14 14 LEU C C 14 179.186 179.186 178.131 1.055 18933 10338 1 15 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.258 -1.501 18933 10339 1 15 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.701 -0.582 18933 10340 1 15 . 1 1 14 14 LEU H H 14 8.221 8.221 8.515 -0.294 18933 10341 1 15 . 1 1 15 15 ARG N N 15 115.957 115.957 114.700 1.257 18933 10342 1 15 . 1 1 15 15 ARG C C 15 176.330 176.330 178.178 -1.848 18933 10343 1 15 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.552 1.151 18933 10344 1 15 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.381 -1.304 18933 10345 1 15 . 1 1 15 15 ARG H H 15 7.968 7.968 8.389 -0.421 18933 10346 1 15 . 1 1 16 16 SER N N 16 109.395 109.395 115.854 -6.459 18933 10347 1 15 . 1 1 16 16 SER C C 16 176.024 176.024 175.124 0.900 18933 10348 1 15 . 1 1 16 16 SER CA C 16 57.282 57.282 60.389 -3.107 18933 10349 1 15 . 1 1 16 16 SER CB C 16 63.683 63.683 63.803 -0.120 18933 10350 1 15 . 1 1 16 16 SER H H 16 6.963 6.963 7.486 -0.523 18933 10351 1 15 . 1 1 17 17 ARG N N 17 122.775 122.775 121.849 0.926 18933 10352 1 15 . 1 1 17 17 ARG C C 17 174.590 174.590 174.003 0.587 18933 10353 1 15 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.971 1.302 18933 10354 1 15 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.367 1.435 18933 10355 1 15 . 1 1 17 17 ARG H H 17 7.781 7.781 8.400 -0.619 18933 10356 1 15 . 1 1 18 18 LEU N N 18 122.421 122.421 125.794 -3.373 18933 10357 1 15 . 1 1 18 18 LEU C C 18 176.281 176.281 174.096 2.185 18933 10358 1 15 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.394 0.386 18933 10359 1 15 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.985 -3.774 18933 10360 1 15 . 1 1 18 18 LEU H H 18 8.650 8.650 7.725 0.925 18933 10361 1 15 . 1 1 19 19 ALA N N 19 126.441 126.441 126.470 -0.029 18933 10362 1 15 . 1 1 19 19 ALA C C 19 173.904 173.904 174.836 -0.932 18933 10363 1 15 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.697 -0.831 18933 10364 1 15 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.250 0.615 18933 10365 1 15 . 1 1 19 19 ALA H H 19 8.609 8.609 8.937 -0.328 18933 10366 1 15 . 1 1 20 20 PHE N N 20 114.600 114.600 119.426 -4.826 18933 10367 1 15 . 1 1 20 20 PHE C C 20 172.592 172.592 173.929 -1.337 18933 10368 1 15 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.895 0.894 18933 10369 1 15 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.546 -0.857 18933 10370 1 15 . 1 1 20 20 PHE H H 20 8.801 8.801 9.096 -0.295 18933 10371 1 15 . 1 1 21 21 GLU N N 21 122.873 122.873 123.970 -1.097 18933 10372 1 15 . 1 1 21 21 GLU C C 21 174.872 174.872 175.230 -0.358 18933 10373 1 15 . 1 1 21 21 GLU CA C 21 55.062 55.062 55.056 0.006 18933 10374 1 15 . 1 1 21 21 GLU CB C 21 30.725 30.725 30.969 -0.244 18933 10375 1 15 . 1 1 21 21 GLU H H 21 7.847 7.847 9.175 -1.328 18933 10376 1 15 . 1 1 22 22 TYR N N 22 126.270 126.270 126.617 -0.347 18933 10377 1 15 . 1 1 22 22 TYR C C 22 174.872 174.872 174.703 0.169 18933 10378 1 15 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.526 -0.778 18933 10379 1 15 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.039 -0.934 18933 10380 1 15 . 1 1 22 22 TYR H H 22 8.806 8.806 9.174 -0.368 18933 10381 1 15 . 1 1 23 23 ASN N N 23 128.420 128.420 125.497 2.923 18933 10382 1 15 . 1 1 23 23 ASN C C 23 175.435 175.435 175.061 0.374 18933 10383 1 15 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.594 -0.589 18933 10384 1 15 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.848 -1.483 18933 10385 1 15 . 1 1 23 23 ASN H H 23 8.943 8.943 9.078 -0.135 18933 10386 1 15 . 1 1 24 24 GLY N N 24 104.067 104.067 102.212 1.855 18933 10387 1 15 . 1 1 24 24 GLY C C 24 173.707 173.707 173.855 -0.148 18933 10388 1 15 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.916 0.018 18933 10389 1 15 . 1 1 24 24 GLY H H 24 8.534 8.534 8.098 0.436 18933 10390 1 15 . 1 1 25 25 GLN N N 25 120.038 120.038 120.041 -0.003 18933 10391 1 15 . 1 1 25 25 GLN C C 25 173.744 173.744 174.887 -1.143 18933 10392 1 15 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.530 -1.203 18933 10393 1 15 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.131 0.530 18933 10394 1 15 . 1 1 25 25 GLN H H 25 7.595 7.595 7.808 -0.213 18933 10395 1 15 . 1 1 26 26 LEU N N 26 124.681 124.681 124.926 -0.245 18933 10396 1 15 . 1 1 26 26 LEU C C 26 175.987 175.987 175.932 0.055 18933 10397 1 15 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.366 -0.353 18933 10398 1 15 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.636 -1.771 18933 10399 1 15 . 1 1 26 26 LEU H H 26 8.382 8.382 8.660 -0.278 18933 10400 1 15 . 1 1 27 27 ILE N N 27 130.779 130.779 126.915 3.864 18933 10401 1 15 . 1 1 27 27 ILE C C 27 175.215 175.215 174.436 0.779 18933 10402 1 15 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.539 -0.280 18933 10403 1 15 . 1 1 27 27 ILE CB C 27 35.732 35.732 37.618 -1.886 18933 10404 1 15 . 1 1 27 27 ILE H H 27 8.882 8.882 8.895 -0.013 18933 10405 1 15 . 1 1 28 28 LYS N N 28 126.160 126.160 127.634 -1.474 18933 10406 1 15 . 1 1 28 28 LYS C C 28 176.771 176.771 175.702 1.069 18933 10407 1 15 . 1 1 28 28 LYS CA C 28 56.838 56.838 55.024 1.814 18933 10408 1 15 . 1 1 28 28 LYS CB C 28 31.739 31.739 32.997 -1.258 18933 10409 1 15 . 1 1 28 28 LYS H H 28 8.165 8.165 8.336 -0.171 18933 10410 1 15 . 1 1 29 29 ILE N N 29 126.380 126.380 122.208 4.172 18933 10411 1 15 . 1 1 29 29 ILE C C 29 175.877 175.877 174.352 1.525 18933 10412 1 15 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.530 -0.222 18933 10413 1 15 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.560 -2.497 18933 10414 1 15 . 1 1 29 29 ILE H H 29 8.019 8.019 8.658 -0.639 18933 10415 1 15 . 1 1 30 30 LEU N N 30 129.215 129.215 122.182 7.033 18933 10416 1 15 . 1 1 30 30 LEU C C 30 178.867 178.867 178.173 0.694 18933 10417 1 15 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.322 1.298 18933 10418 1 15 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.463 -4.598 18933 10419 1 15 . 1 1 30 30 LEU H H 30 8.917 8.917 8.322 0.595 18933 10420 1 15 . 1 1 31 31 SER N N 31 117.997 117.997 115.764 2.233 18933 10421 1 15 . 1 1 31 31 SER C C 31 177.396 177.396 175.512 1.884 18933 10422 1 15 . 1 1 31 31 SER CA C 31 61.236 61.236 60.835 0.401 18933 10423 1 15 . 1 1 31 31 SER CB C 31 62.035 62.035 63.191 -1.157 18933 10424 1 15 . 1 1 31 31 SER H H 31 8.594 8.594 8.815 -0.221 18933 10425 1 15 . 1 1 32 32 LYS N N 32 116.189 116.189 118.494 -2.305 18933 10426 1 15 . 1 1 32 32 LYS C C 32 176.244 176.244 176.964 -0.720 18933 10427 1 15 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.232 -0.829 18933 10428 1 15 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.290 -2.009 18933 10429 1 15 . 1 1 32 32 LYS H H 32 8.029 8.029 8.188 -0.159 18933 10430 1 15 . 1 1 33 33 ASN N N 33 119.061 119.061 115.382 3.679 18933 10431 1 15 . 1 1 33 33 ASN C C 33 172.384 172.384 174.488 -2.104 18933 10432 1 15 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.905 -1.748 18933 10433 1 15 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.375 -3.108 18933 10434 1 15 . 1 1 33 33 ASN H H 33 7.902 7.902 7.805 0.097 18933 10435 1 15 . 1 1 34 34 ILE N N 34 120.038 120.038 120.051 -0.013 18933 10436 1 15 . 1 1 34 34 ILE C C 34 175.607 175.607 174.089 1.518 18933 10437 1 15 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.422 0.128 18933 10438 1 15 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.801 -2.837 18933 10439 1 15 . 1 1 34 34 ILE H H 34 7.443 7.443 7.810 -0.367 18933 10440 1 15 . 1 1 35 35 VAL N N 35 129.435 129.435 126.132 3.303 18933 10441 1 15 . 1 1 35 35 VAL C C 35 175.386 175.386 174.397 0.989 18933 10442 1 15 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.377 -0.351 18933 10443 1 15 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.890 -1.109 18933 10444 1 15 . 1 1 35 35 VAL H H 35 9.533 9.533 8.888 0.645 18933 10445 1 15 . 1 1 36 36 ALA N N 36 130.571 130.571 129.677 0.894 18933 10446 1 15 . 1 1 36 36 ALA C C 36 177.347 177.347 176.314 1.033 18933 10447 1 15 . 1 1 36 36 ALA CA C 36 52.399 52.399 52.154 0.244 18933 10448 1 15 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.735 -0.877 18933 10449 1 15 . 1 1 36 36 ALA H H 36 8.665 8.665 8.396 0.269 18933 10450 1 15 . 1 1 37 37 VAL N N 37 115.395 115.395 119.936 -4.541 18933 10451 1 15 . 1 1 37 37 VAL C C 37 174.455 174.455 175.770 -1.315 18933 10452 1 15 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.204 0.176 18933 10453 1 15 . 1 1 37 37 VAL CB C 37 32.943 32.943 33.833 -0.890 18933 10454 1 15 . 1 1 37 37 VAL H H 37 8.079 8.079 8.277 -0.198 18933 10455 1 15 . 1 1 38 38 GLY N N 38 107.672 107.672 107.832 -0.160 18933 10456 1 15 . 1 1 38 38 GLY C C 38 173.364 173.364 175.837 -2.473 18933 10457 1 15 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.544 -0.359 18933 10458 1 15 . 1 1 38 38 GLY H H 38 7.579 7.579 8.200 -0.621 18933 10459 1 15 . 1 1 39 39 SER N N 39 121.052 121.052 119.663 1.389 18933 10460 1 15 . 1 1 39 39 SER C C 39 175.570 175.570 176.667 -1.097 18933 10461 1 15 . 1 1 39 39 SER CA C 39 61.801 61.801 61.499 0.302 18933 10462 1 15 . 1 1 39 39 SER CB C 39 62.478 62.478 63.454 -0.976 18933 10463 1 15 . 1 1 39 39 SER H H 39 8.953 8.953 8.108 0.845 18933 10464 1 15 . 1 1 40 40 LEU N N 40 121.553 121.553 121.976 -0.423 18933 10465 1 15 . 1 1 40 40 LEU C C 40 180.203 180.203 178.272 1.931 18933 10466 1 15 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.438 -0.309 18933 10467 1 15 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.835 -0.082 18933 10468 1 15 . 1 1 40 40 LEU H H 40 8.195 8.195 7.370 0.825 18933 10469 1 15 . 1 1 41 41 ARG N N 41 121.956 121.956 117.693 4.263 18933 10470 1 15 . 1 1 41 41 ARG C C 41 177.323 177.323 178.130 -0.807 18933 10471 1 15 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.973 0.358 18933 10472 1 15 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.863 -1.420 18933 10473 1 15 . 1 1 41 41 ARG H H 41 6.873 6.873 7.364 -0.491 18933 10474 1 15 . 1 1 42 42 ARG N N 42 114.600 114.600 116.909 -2.309 18933 10475 1 15 . 1 1 42 42 ARG C C 42 172.911 172.911 175.705 -2.794 18933 10476 1 15 . 1 1 42 42 ARG CA C 42 57.242 57.242 56.977 0.265 18933 10477 1 15 . 1 1 42 42 ARG CB C 42 29.140 29.140 31.038 -1.898 18933 10478 1 15 . 1 1 42 42 ARG H H 42 7.438 7.438 8.061 -0.623 18933 10479 1 15 . 1 1 43 43 GLU N N 43 113.354 113.354 117.455 -4.101 18933 10480 1 15 . 1 1 43 43 GLU C C 43 175.999 175.999 175.707 0.292 18933 10481 1 15 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.316 -0.760 18933 10482 1 15 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.090 -1.753 18933 10483 1 15 . 1 1 43 43 GLU H H 43 7.564 7.564 8.043 -0.479 18933 10484 1 15 . 1 1 44 44 GLU N N 44 119.696 119.696 120.001 -0.305 18933 10485 1 15 . 1 1 44 44 GLU C C 44 175.423 175.423 177.021 -1.598 18933 10486 1 15 . 1 1 44 44 GLU CA C 44 56.838 56.838 56.806 0.032 18933 10487 1 15 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.140 -1.444 18933 10488 1 15 . 1 1 44 44 GLU H H 44 7.261 7.261 8.412 -1.151 18933 10489 1 15 . 1 1 45 45 LYS N N 45 117.435 117.435 118.013 -0.578 18933 10490 1 15 . 1 1 45 45 LYS C C 45 177.715 177.715 175.238 2.477 18933 10491 1 15 . 1 1 45 45 LYS CA C 45 59.219 59.219 57.015 2.204 18933 10492 1 15 . 1 1 45 45 LYS CB C 45 32.119 32.119 33.779 -1.659 18933 10493 1 15 . 1 1 45 45 LYS H H 45 7.938 7.938 8.123 -0.185 18933 10494 1 15 . 1 1 46 46 MET N N 46 115.847 115.847 118.168 -2.321 18933 10495 1 15 . 1 1 46 46 MET CA C 46 52.520 52.520 53.674 -1.154 18933 10496 1 15 . 1 1 46 46 MET CB C 46 33.450 33.450 35.388 -1.938 18933 10497 1 15 . 1 1 46 46 MET H H 46 7.595 7.595 7.709 -0.114 18933 10498 1 15 . 1 1 47 47 LEU N N 47 121.627 121.627 123.106 -1.479 18933 10499 1 15 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.272 -1.145 18933 10500 1 15 . 1 1 47 47 LEU CB C 47 43.070 43.070 42.766 0.304 18933 10501 1 15 . 1 1 47 47 LEU H H 47 9.220 9.220 9.071 0.149 18933 10502 1 15 . 1 1 49 49 ASP N N 49 117.093 117.093 117.425 -0.332 18933 10503 1 15 . 1 1 49 49 ASP C C 49 173.340 173.340 174.389 -1.049 18933 10504 1 15 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.429 -1.635 18933 10505 1 15 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.845 -1.839 18933 10506 1 15 . 1 1 49 49 ASP H H 49 7.761 7.761 7.573 0.188 18933 10507 1 15 . 1 1 50 50 VAL N N 50 119.012 119.012 115.881 3.131 18933 10508 1 15 . 1 1 50 50 VAL C C 50 173.070 173.070 173.721 -0.651 18933 10509 1 15 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.189 1.653 18933 10510 1 15 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.745 -1.182 18933 10511 1 15 . 1 1 50 50 VAL H H 50 8.089 8.089 8.434 -0.345 18933 10512 1 15 . 1 1 51 51 ASP N N 51 127.064 127.064 124.658 2.406 18933 10513 1 15 . 1 1 51 51 ASP C C 51 174.565 174.565 175.145 -0.580 18933 10514 1 15 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.761 -0.604 18933 10515 1 15 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.622 -0.982 18933 10516 1 15 . 1 1 51 51 ASP H H 51 8.069 8.069 8.101 -0.032 18933 10517 1 15 . 1 1 52 52 LEU N N 52 121.627 121.627 120.095 1.532 18933 10518 1 15 . 1 1 52 52 LEU C C 52 174.063 174.063 174.540 -0.477 18933 10519 1 15 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.446 -0.764 18933 10520 1 15 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.334 -2.983 18933 10521 1 15 . 1 1 52 52 LEU H H 52 8.852 8.852 8.912 -0.060 18933 10522 1 15 . 1 1 53 53 LEU N N 53 123.093 123.093 123.442 -0.349 18933 10523 1 15 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.145 1.846 18933 10524 1 15 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.682 -2.549 18933 10525 1 15 . 1 1 53 53 LEU H H 53 9.362 9.362 9.046 0.316 18933 10526 1 15 . 1 1 54 54 ILE N N 54 123.777 123.777 129.280 -5.503 18933 10527 1 15 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.134 -4.072 18933 10528 1 15 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.336 -7.266 18933 10529 1 15 . 1 1 54 54 ILE H H 54 8.907 8.907 9.216 -0.309 18933 10530 1 15 . 1 1 58 58 GLU N N 58 114.710 114.710 118.403 -3.693 18933 10531 1 15 . 1 1 58 58 GLU CA C 58 54.377 54.377 54.984 -0.607 18933 10532 1 15 . 1 1 58 58 GLU CB C 58 31.422 31.422 31.902 -0.480 18933 10533 1 15 . 1 1 58 58 GLU H H 58 6.716 6.716 7.843 -1.127 18933 10534 1 15 . 1 1 61 61 LEU N N 61 115.957 115.957 120.682 -4.725 18933 10535 1 15 . 1 1 61 61 LEU C C 61 178.512 178.512 178.201 0.311 18933 10536 1 15 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.261 -2.481 18933 10537 1 15 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.508 -0.389 18933 10538 1 15 . 1 1 61 61 LEU H H 61 7.307 7.307 7.927 -0.620 18933 10539 1 15 . 1 1 62 62 LEU N N 62 120.038 120.038 119.165 0.873 18933 10540 1 15 . 1 1 62 62 LEU C C 62 177.874 177.874 178.778 -0.904 18933 10541 1 15 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.502 0.434 18933 10542 1 15 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.998 -1.260 18933 10543 1 15 . 1 1 62 62 LEU H H 62 7.327 7.327 8.184 -0.857 18933 10544 1 15 . 1 1 63 63 LYS N N 63 114.600 114.600 114.916 -0.316 18933 10545 1 15 . 1 1 63 63 LYS C C 63 175.460 175.460 177.231 -1.771 18933 10546 1 15 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.420 -0.856 18933 10547 1 15 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.586 -1.861 18933 10548 1 15 . 1 1 63 63 LYS H H 63 7.973 7.973 7.638 0.335 18933 10549 1 15 . 1 1 64 64 HIS N N 64 115.273 115.273 115.254 0.019 18933 10550 1 15 . 1 1 64 64 HIS CA C 64 56.112 56.112 54.773 1.339 18933 10551 1 15 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.267 2.169 18933 10552 1 15 . 1 1 64 64 HIS H H 64 7.544 7.544 7.549 -0.005 18933 10553 1 15 . 1 1 65 65 VAL N N 65 118.682 118.682 119.199 -0.517 18933 10554 1 15 . 1 1 65 65 VAL CA C 65 66.038 66.038 63.062 2.976 18933 10555 1 15 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.394 -2.367 18933 10556 1 15 . 1 1 65 65 VAL H H 65 6.787 6.787 7.204 -0.417 18933 10557 1 15 . 1 1 68 68 ASN N N 68 112.108 112.108 118.265 -6.157 18933 10558 1 15 . 1 1 68 68 ASN C C 68 174.884 174.884 173.924 0.960 18933 10559 1 15 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.334 -1.307 18933 10560 1 15 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.188 1.044 18933 10561 1 15 . 1 1 68 68 ASN H H 68 7.009 7.009 8.285 -1.276 18933 10562 1 15 . 1 1 69 69 ILE N N 69 123.325 123.325 123.767 -0.442 18933 10563 1 15 . 1 1 69 69 ILE C C 69 174.394 174.394 175.341 -0.947 18933 10564 1 15 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.552 -1.445 18933 10565 1 15 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.488 -0.221 18933 10566 1 15 . 1 1 69 69 ILE H H 69 7.150 7.150 8.085 -0.935 18933 10567 1 15 . 1 1 70 70 ARG N N 70 126.722 126.722 127.750 -1.028 18933 10568 1 15 . 1 1 70 70 ARG C C 70 174.590 174.590 174.466 0.124 18933 10569 1 15 . 1 1 70 70 ARG CA C 70 53.247 53.247 53.883 -0.636 18933 10570 1 15 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.269 -1.897 18933 10571 1 15 . 1 1 70 70 ARG H H 70 8.902 8.902 9.200 -0.298 18933 10572 1 15 . 1 1 71 71 ILE N N 71 119.978 119.978 120.321 -0.343 18933 10573 1 15 . 1 1 71 71 ILE C C 71 175.583 175.583 175.894 -0.311 18933 10574 1 15 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.799 0.025 18933 10575 1 15 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.274 -2.514 18933 10576 1 15 . 1 1 71 71 ILE H H 71 7.491 7.491 8.835 -1.344 18933 10577 1 15 . 1 1 72 72 LYS N N 72 128.530 128.530 125.874 2.656 18933 10578 1 15 . 1 1 72 72 LYS C C 72 177.703 177.703 176.112 1.591 18933 10579 1 15 . 1 1 72 72 LYS CA C 72 57.201 57.201 55.124 2.077 18933 10580 1 15 . 1 1 72 72 LYS CB C 72 31.485 31.485 30.563 0.922 18933 10581 1 15 . 1 1 72 72 LYS H H 72 8.523 8.523 8.378 0.145 18933 10582 1 15 . 1 1 73 73 GLY N N 73 113.806 113.806 110.780 3.026 18933 10583 1 15 . 1 1 73 73 GLY C C 73 173.781 173.781 172.889 0.892 18933 10584 1 15 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.089 0.733 18933 10585 1 15 . 1 1 73 73 GLY H H 73 8.791 8.791 8.306 0.485 18933 10586 1 15 . 1 1 74 74 LEU N N 74 120.490 120.490 118.103 2.387 18933 10587 1 15 . 1 1 74 74 LEU C C 74 175.840 175.840 173.641 2.199 18933 10588 1 15 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.211 -0.520 18933 10589 1 15 . 1 1 74 74 LEU CB C 74 44.161 44.161 44.717 -0.556 18933 10590 1 15 . 1 1 74 74 LEU H H 74 7.393 7.393 7.269 0.124 18933 10591 1 15 . 1 1 75 75 SER N N 75 120.038 120.038 115.897 4.141 18933 10592 1 15 . 1 1 75 75 SER C C 75 173.205 173.205 173.130 0.075 18933 10593 1 15 . 1 1 75 75 SER CA C 75 57.887 57.887 57.441 0.446 18933 10594 1 15 . 1 1 75 75 SER CB C 75 63.049 63.049 64.695 -1.645 18933 10595 1 15 . 1 1 75 75 SER H H 75 8.917 8.917 8.127 0.790 18933 10596 1 15 . 1 1 76 76 PHE N N 76 119.586 119.586 117.711 1.875 18933 10597 1 15 . 1 1 76 76 PHE C C 76 173.536 173.536 173.677 -0.141 18933 10598 1 15 . 1 1 76 76 PHE CA C 76 55.426 55.426 56.530 -1.104 18933 10599 1 15 . 1 1 76 76 PHE CB C 76 42.006 42.006 41.872 0.134 18933 10600 1 15 . 1 1 76 76 PHE H H 76 8.003 8.003 8.462 -0.459 18933 10601 1 15 . 1 1 77 77 SER N N 77 114.943 114.943 116.147 -1.204 18933 10602 1 15 . 1 1 77 77 SER C C 77 173.438 173.438 172.300 1.138 18933 10603 1 15 . 1 1 77 77 SER CA C 77 56.152 56.152 57.060 -0.908 18933 10604 1 15 . 1 1 77 77 SER CB C 77 65.204 65.204 65.790 -0.586 18933 10605 1 15 . 1 1 77 77 SER H H 77 8.907 8.907 8.805 0.102 18933 10606 1 15 . 1 1 78 78 VAL N N 78 124.791 124.791 124.239 0.552 18933 10607 1 15 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.407 1.637 18933 10608 1 15 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.155 -1.973 18933 10609 1 15 . 1 1 78 78 VAL H H 78 8.892 8.892 8.300 0.592 18933 10610 1 15 . 1 1 79 79 LYS N N 79 129.667 129.667 129.412 0.255 18933 10611 1 15 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.489 1.703 18933 10612 1 15 . 1 1 79 79 LYS CB C 79 32.372 32.372 34.260 -1.888 18933 10613 1 15 . 1 1 79 79 LYS H H 79 9.049 9.049 8.661 0.388 18933 10614 1 15 . 1 1 82 82 GLY N N 82 117.263 117.263 114.810 2.453 18933 10615 1 15 . 1 1 82 82 GLY C C 82 171.710 171.710 175.156 -3.446 18933 10616 1 15 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.233 -2.308 18933 10617 1 15 . 1 1 82 82 GLY H H 82 8.044 8.044 8.518 -0.474 18933 10618 1 15 . 1 1 83 83 GLU N N 83 117.203 117.203 122.831 -5.628 18933 10619 1 15 . 1 1 83 83 GLU C C 83 178.695 178.695 178.176 0.519 18933 10620 1 15 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.970 1.007 18933 10621 1 15 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.812 0.025 18933 10622 1 15 . 1 1 83 83 GLU H H 83 8.296 8.296 8.595 -0.299 18933 10623 1 15 . 1 1 84 84 ARG N N 84 113.818 113.818 118.393 -4.575 18933 10624 1 15 . 1 1 84 84 ARG C C 84 175.877 175.877 175.191 0.686 18933 10625 1 15 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.087 -1.357 18933 10626 1 15 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.379 1.916 18933 10627 1 15 . 1 1 84 84 ARG H H 84 8.342 8.342 7.969 0.373 18933 10628 1 15 . 1 1 85 85 LYS N N 85 119.354 119.354 121.865 -2.511 18933 10629 1 15 . 1 1 85 85 LYS C C 85 174.516 174.516 174.037 0.479 18933 10630 1 15 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.547 -0.807 18933 10631 1 15 . 1 1 85 85 LYS CB C 85 34.844 34.844 34.684 0.160 18933 10632 1 15 . 1 1 85 85 LYS H H 85 6.822 6.822 7.645 -0.823 18933 10633 1 15 . 1 1 86 86 CYS N N 86 125.928 125.928 124.497 1.431 18933 10634 1 15 . 1 1 86 86 CYS C C 86 171.600 171.600 173.049 -1.449 18933 10635 1 15 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.975 -2.348 18933 10636 1 15 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.437 -0.093 18933 10637 1 15 . 1 1 86 86 CYS H H 86 9.084 9.084 9.193 -0.109 18933 10638 1 15 . 1 1 87 87 VAL N N 87 126.612 126.612 126.273 0.339 18933 10639 1 15 . 1 1 87 87 VAL C C 87 174.431 174.431 174.607 -0.176 18933 10640 1 15 . 1 1 87 87 VAL CA C 87 61.317 61.317 62.009 -0.692 18933 10641 1 15 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.254 0.942 18933 10642 1 15 . 1 1 87 87 VAL H H 87 8.705 8.705 9.057 -0.352 18933 10643 1 15 . 1 1 88 88 LEU N N 88 127.748 127.748 123.156 4.592 18933 10644 1 15 . 1 1 88 88 LEU C C 88 175.227 175.227 174.492 0.735 18933 10645 1 15 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.705 -0.185 18933 10646 1 15 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.294 -1.689 18933 10647 1 15 . 1 1 88 88 LEU H H 88 9.417 9.417 8.642 0.775 18933 10648 1 15 . 1 1 89 89 PHE N N 89 120.981 120.981 118.923 2.058 18933 10649 1 15 . 1 1 89 89 PHE C C 89 176.906 176.906 176.174 0.732 18933 10650 1 15 . 1 1 89 89 PHE CA C 89 55.587 55.587 55.998 -0.411 18933 10651 1 15 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.529 -2.628 18933 10652 1 15 . 1 1 89 89 PHE H H 89 8.937 8.937 8.652 0.285 18933 10653 1 15 . 1 1 90 90 ILE N N 90 119.928 119.928 118.494 1.434 18933 10654 1 15 . 1 1 90 90 ILE C C 90 173.781 173.781 175.026 -1.245 18933 10655 1 15 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.852 -1.198 18933 10656 1 15 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.465 1.147 18933 10657 1 15 . 1 1 90 90 ILE H H 90 9.230 9.230 9.125 0.105 18933 10658 1 15 . 1 1 91 91 GLU N N 91 124.339 124.339 125.282 -0.943 18933 10659 1 15 . 1 1 91 91 GLU C C 91 175.607 175.607 175.275 0.332 18933 10660 1 15 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.820 -0.201 18933 10661 1 15 . 1 1 91 91 GLU CB C 91 29.837 29.837 32.614 -2.777 18933 10662 1 15 . 1 1 91 91 GLU H H 91 8.175 8.175 8.970 -0.795 18933 10663 1 15 . 1 1 92 92 TRP N N 92 127.516 127.516 124.902 2.614 18933 10664 1 15 . 1 1 92 92 TRP C C 92 175.203 175.203 176.476 -1.273 18933 10665 1 15 . 1 1 92 92 TRP CA C 92 56.233 56.233 55.278 0.955 18933 10666 1 15 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.191 1.470 18933 10667 1 15 . 1 1 92 92 TRP H H 92 9.306 9.306 8.049 1.257 18933 10668 1 15 . 1 1 93 93 GLU N N 93 127.834 127.834 126.466 1.368 18933 10669 1 15 . 1 1 93 93 GLU C C 93 175.668 175.668 176.059 -0.391 18933 10670 1 15 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.337 -0.459 18933 10671 1 15 . 1 1 93 93 GLU CB C 93 26.034 26.034 27.863 -1.829 18933 10672 1 15 . 1 1 93 93 GLU H H 93 8.796 8.796 9.089 -0.293 18933 10673 1 15 . 1 1 94 94 LYS N N 94 108.931 108.931 112.372 -3.441 18933 10674 1 15 . 1 1 94 94 LYS C C 94 175.423 175.423 176.309 -0.886 18933 10675 1 15 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.465 -0.022 18933 10676 1 15 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.584 -2.951 18933 10677 1 15 . 1 1 94 94 LYS H H 94 8.498 8.498 8.654 -0.156 18933 10678 1 15 . 1 1 95 95 LYS N N 95 121.737 121.737 119.589 2.148 18933 10679 1 15 . 1 1 95 95 LYS C C 95 174.443 174.443 175.055 -0.612 18933 10680 1 15 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.411 -1.994 18933 10681 1 15 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.438 0.026 18933 10682 1 15 . 1 1 95 95 LYS H H 95 7.761 7.761 7.639 0.122 18933 10683 1 15 . 1 1 96 96 THR N N 96 116.067 116.067 115.576 0.491 18933 10684 1 15 . 1 1 96 96 THR C C 96 174.296 174.296 173.679 0.617 18933 10685 1 15 . 1 1 96 96 THR CA C 96 61.115 61.115 61.264 -0.149 18933 10686 1 15 . 1 1 96 96 THR CB C 96 69.450 69.450 71.596 -2.146 18933 10687 1 15 . 1 1 96 96 THR H H 96 7.761 7.761 8.447 -0.686 18933 10688 1 15 . 1 1 97 97 TYR N N 97 124.229 124.229 125.660 -1.431 18933 10689 1 15 . 1 1 97 97 TYR C C 97 173.536 173.536 173.720 -0.184 18933 10690 1 15 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.633 -0.683 18933 10691 1 15 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.741 -1.559 18933 10692 1 15 . 1 1 97 97 TYR H H 97 9.018 9.018 9.336 -0.318 18933 10693 1 15 . 1 1 98 98 GLN N N 98 123.435 123.435 124.383 -0.948 18933 10694 1 15 . 1 1 98 98 GLN C C 98 173.266 173.266 173.726 -0.460 18933 10695 1 15 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.628 -0.485 18933 10696 1 15 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.796 -0.783 18933 10697 1 15 . 1 1 98 98 GLN H H 98 8.781 8.781 8.917 -0.136 18933 10698 1 15 . 1 1 99 99 LEU N N 99 130.119 130.119 127.629 2.490 18933 10699 1 15 . 1 1 99 99 LEU C C 99 173.867 173.867 174.022 -0.155 18933 10700 1 15 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.491 -0.971 18933 10701 1 15 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.569 -0.964 18933 10702 1 15 . 1 1 99 99 LEU H H 99 9.104 9.104 8.876 0.228 18933 10703 1 15 . 1 1 100 100 ASP N N 100 125.182 125.182 128.344 -3.162 18933 10704 1 15 . 1 1 100 100 ASP C C 100 172.837 172.837 174.191 -1.354 18933 10705 1 15 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.987 -2.233 18933 10706 1 15 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.260 -3.916 18933 10707 1 15 . 1 1 100 100 ASP H H 100 9.089 9.089 8.949 0.140 18933 10708 1 15 . 1 1 101 101 LEU N N 101 121.174 121.174 127.929 -6.755 18933 10709 1 15 . 1 1 101 101 LEU C C 101 174.529 174.529 174.548 -0.019 18933 10710 1 15 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.765 -1.850 18933 10711 1 15 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.418 -1.510 18933 10712 1 15 . 1 1 101 101 LEU H H 101 8.458 8.458 9.127 -0.669 18933 10713 1 15 . 1 1 102 102 PHE N N 102 119.464 119.464 125.957 -6.493 18933 10714 1 15 . 1 1 102 102 PHE C C 102 176.293 176.293 174.966 1.327 18933 10715 1 15 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.622 -1.568 18933 10716 1 15 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.614 -0.734 18933 10717 1 15 . 1 1 102 102 PHE H H 102 8.281 8.281 9.345 -1.064 18933 10718 1 15 . 1 1 103 103 THR N N 103 108.576 108.576 117.833 -9.257 18933 10719 1 15 . 1 1 103 103 THR C C 103 174.933 174.933 173.533 1.400 18933 10720 1 15 . 1 1 103 103 THR CA C 103 57.726 57.726 60.163 -2.437 18933 10721 1 15 . 1 1 103 103 THR CB C 103 71.288 71.288 69.346 1.942 18933 10722 1 15 . 1 1 103 103 THR H H 103 7.872 7.872 8.351 -0.479 18933 10723 1 15 . 1 1 104 104 ALA N N 104 122.885 122.885 128.559 -5.674 18933 10724 1 15 . 1 1 104 104 ALA C C 104 175.754 175.754 174.771 0.983 18933 10725 1 15 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.727 0.291 18933 10726 1 15 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.657 -0.172 18933 10727 1 15 . 1 1 104 104 ALA H H 104 8.660 8.660 9.273 -0.613 18933 10728 1 15 . 1 1 105 105 LEU N N 105 120.881 120.881 119.378 1.503 18933 10729 1 15 . 1 1 105 105 LEU C C 105 179.504 179.504 179.145 0.359 18933 10730 1 15 . 1 1 105 105 LEU CA C 105 53.247 53.247 53.453 -0.206 18933 10731 1 15 . 1 1 105 105 LEU CB C 105 41.753 41.753 43.789 -2.036 18933 10732 1 15 . 1 1 105 105 LEU H H 105 8.226 8.226 8.418 -0.192 18933 10733 1 15 . 1 1 106 106 ALA N N 106 124.901 124.901 124.493 0.408 18933 10734 1 15 . 1 1 106 106 ALA C C 106 181.269 181.269 179.215 2.054 18933 10735 1 15 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.909 1.404 18933 10736 1 15 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.774 -1.550 18933 10737 1 15 . 1 1 106 106 ALA H H 106 8.392 8.392 8.705 -0.313 18933 10738 1 15 . 1 1 107 107 GLU N N 107 116.409 116.409 115.543 0.866 18933 10739 1 15 . 1 1 107 107 GLU C C 107 177.764 177.764 177.056 0.708 18933 10740 1 15 . 1 1 107 107 GLU CA C 107 58.533 58.533 58.055 0.478 18933 10741 1 15 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.348 -1.412 18933 10742 1 15 . 1 1 107 107 GLU H H 107 9.664 9.664 8.635 1.029 18933 10743 1 15 . 1 1 108 108 GLU N N 108 116.189 116.189 117.890 -1.701 18933 10744 1 15 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.246 -1.103 18933 10745 1 15 . 1 1 108 108 GLU CB C 108 29.837 29.837 29.250 0.587 18933 10746 1 15 . 1 1 108 108 GLU H H 108 7.589 7.589 7.816 -0.227 18933 10747 1 15 . 1 1 109 109 LYS N N 109 119.928 119.928 121.524 -1.596 18933 10748 1 15 . 1 1 109 109 LYS CA C 109 62.851 62.851 60.668 2.183 18933 10749 1 15 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.588 -0.117 18933 10750 1 15 . 1 1 109 109 LYS H H 109 7.514 7.514 7.537 -0.023 18933 10751 1 15 . 1 1 111 111 TYR N N 111 114.930 114.930 118.119 -3.189 18933 10752 1 15 . 1 1 111 111 TYR C C 111 179.504 179.504 177.710 1.794 18933 10753 1 15 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.308 -2.291 18933 10754 1 15 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.455 -1.787 18933 10755 1 15 . 1 1 111 111 TYR H H 111 6.393 6.393 8.506 -2.113 18933 10756 1 15 . 1 1 112 112 ALA N N 112 124.901 124.901 121.975 2.926 18933 10757 1 15 . 1 1 112 112 ALA C C 112 179.173 179.173 179.384 -0.211 18933 10758 1 15 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.428 -0.527 18933 10759 1 15 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.269 -0.157 18933 10760 1 15 . 1 1 112 112 ALA H H 112 8.554 8.554 8.266 0.288 18933 10761 1 15 . 1 1 113 113 ILE N N 113 119.464 119.464 119.906 -0.442 18933 10762 1 15 . 1 1 113 113 ILE C C 113 178.499 178.499 177.983 0.516 18933 10763 1 15 . 1 1 113 113 ILE CA C 113 66.281 66.281 63.773 2.508 18933 10764 1 15 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.797 -0.480 18933 10765 1 15 . 1 1 113 113 ILE H H 113 8.680 8.680 7.675 1.005 18933 10766 1 15 . 1 1 114 114 PHE N N 114 122.922 122.922 122.407 0.515 18933 10767 1 15 . 1 1 114 114 PHE C C 114 178.217 178.217 177.873 0.344 18933 10768 1 15 . 1 1 114 114 PHE CA C 114 61.559 61.559 60.501 1.058 18933 10769 1 15 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.548 0.923 18933 10770 1 15 . 1 1 114 114 PHE H H 114 7.721 7.721 8.475 -0.754 18933 10771 1 15 . 1 1 115 115 HIS N N 115 118.560 118.560 118.702 -0.142 18933 10772 1 15 . 1 1 115 115 HIS C C 115 177.286 177.286 176.589 0.697 18933 10773 1 15 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.491 -0.111 18933 10774 1 15 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.163 1.702 18933 10775 1 15 . 1 1 115 115 HIS H H 115 8.155 8.155 8.414 -0.259 18933 10776 1 15 . 1 1 116 116 PHE N N 116 111.472 111.472 115.857 -4.385 18933 10777 1 15 . 1 1 116 116 PHE C C 116 179.026 179.026 178.147 0.879 18933 10778 1 15 . 1 1 116 116 PHE CA C 116 59.461 59.461 60.181 -0.720 18933 10779 1 15 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.995 -1.806 18933 10780 1 15 . 1 1 116 116 PHE H H 116 8.564 8.564 8.100 0.464 18933 10781 1 15 . 1 1 117 117 THR N N 117 119.012 119.012 112.595 6.417 18933 10782 1 15 . 1 1 117 117 THR C C 117 172.935 172.935 175.833 -2.898 18933 10783 1 15 . 1 1 117 117 THR CA C 117 67.088 67.088 64.936 2.152 18933 10784 1 15 . 1 1 117 117 THR CB C 117 37.126 37.126 68.985 -31.859 18933 10785 1 15 . 1 1 117 117 THR H H 117 7.620 7.620 8.196 -0.576 18933 10786 1 15 . 1 1 118 118 GLY N N 118 107.917 107.917 110.283 -2.366 18933 10787 1 15 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.530 1.637 18933 10788 1 15 . 1 1 118 118 GLY H H 118 6.666 6.666 7.556 -0.890 18933 10789 1 15 . 1 1 121 121 SER N N 121 113.354 113.354 117.721 -4.367 18933 10790 1 15 . 1 1 121 121 SER C C 121 176.061 176.061 176.071 -0.010 18933 10791 1 15 . 1 1 121 121 SER CA C 121 61.035 61.035 61.434 -0.399 18933 10792 1 15 . 1 1 121 121 SER H H 121 8.322 8.322 8.322 0.000 18933 10793 1 15 . 1 1 122 122 TYR N N 122 124.681 124.681 122.272 2.409 18933 10794 1 15 . 1 1 122 122 TYR C C 122 176.293 176.293 177.062 -0.769 18933 10795 1 15 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.964 -1.907 18933 10796 1 15 . 1 1 122 122 TYR CB C 122 38.711 38.711 37.994 0.717 18933 10797 1 15 . 1 1 122 122 TYR H H 122 6.514 6.514 8.348 -1.834 18933 10798 1 15 . 1 1 123 123 LEU N N 123 117.997 117.997 119.956 -1.959 18933 10799 1 15 . 1 1 123 123 LEU C C 123 179.774 179.774 178.877 0.897 18933 10800 1 15 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.574 0.304 18933 10801 1 15 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.924 -0.946 18933 10802 1 15 . 1 1 123 123 LEU H H 123 7.428 7.428 7.293 0.135 18933 10803 1 15 . 1 1 124 124 ILE N N 124 119.012 119.012 120.251 -1.239 18933 10804 1 15 . 1 1 124 124 ILE C C 124 178.830 178.830 177.774 1.056 18933 10805 1 15 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.356 -0.205 18933 10806 1 15 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.322 -0.258 18933 10807 1 15 . 1 1 124 124 ILE H H 124 8.453 8.453 8.416 0.037 18933 10808 1 15 . 1 1 125 125 ARG N N 125 121.174 121.174 120.382 0.792 18933 10809 1 15 . 1 1 125 125 ARG C C 125 179.762 179.762 178.543 1.219 18933 10810 1 15 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.945 0.112 18933 10811 1 15 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.281 -0.331 18933 10812 1 15 . 1 1 125 125 ARG H H 125 7.004 7.004 8.149 -1.145 18933 10813 1 15 . 1 1 126 126 ILE N N 126 122.299 122.299 120.924 1.375 18933 10814 1 15 . 1 1 126 126 ILE C C 126 178.352 178.352 177.756 0.596 18933 10815 1 15 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.695 -2.490 18933 10816 1 15 . 1 1 126 126 ILE CB C 126 35.415 35.415 36.956 -1.541 18933 10817 1 15 . 1 1 126 126 ILE H H 126 7.579 7.579 7.723 -0.144 18933 10818 1 15 . 1 1 127 127 ARG N N 127 119.354 119.354 120.423 -1.069 18933 10819 1 15 . 1 1 127 127 ARG C C 127 179.786 179.786 178.852 0.934 18933 10820 1 15 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.823 0.163 18933 10821 1 15 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.171 -0.841 18933 10822 1 15 . 1 1 127 127 ARG H H 127 8.715 8.715 8.246 0.469 18933 10823 1 15 . 1 1 128 128 ALA N N 128 122.873 122.873 120.425 2.448 18933 10824 1 15 . 1 1 128 128 ALA C C 128 180.325 180.325 179.370 0.955 18933 10825 1 15 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.685 0.055 18933 10826 1 15 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.223 -1.062 18933 10827 1 15 . 1 1 128 128 ALA H H 128 7.978 7.978 8.300 -0.322 18933 10828 1 15 . 1 1 129 129 ALA N N 129 121.846 121.846 121.852 -0.006 18933 10829 1 15 . 1 1 129 129 ALA C C 129 181.539 181.539 179.909 1.630 18933 10830 1 15 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.799 -0.301 18933 10831 1 15 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.644 -1.166 18933 10832 1 15 . 1 1 129 129 ALA H H 129 7.519 7.519 7.809 -0.290 18933 10833 1 15 . 1 1 130 130 LEU N N 130 119.134 119.134 118.313 0.821 18933 10834 1 15 . 1 1 130 130 LEU C C 130 179.909 179.909 179.132 0.777 18933 10835 1 15 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.172 -0.173 18933 10836 1 15 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.732 -1.310 18933 10837 1 15 . 1 1 130 130 LEU H H 130 8.296 8.296 8.743 -0.447 18933 10838 1 15 . 1 1 131 131 LYS N N 131 122.299 122.299 120.124 2.175 18933 10839 1 15 . 1 1 131 131 LYS C C 131 180.289 180.289 179.540 0.749 18933 10840 1 15 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.646 -0.629 18933 10841 1 15 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.112 -0.880 18933 10842 1 15 . 1 1 131 131 LYS H H 131 8.281 8.281 7.925 0.356 18933 10843 1 15 . 1 1 132 132 LYS N N 132 118.743 118.743 118.742 0.001 18933 10844 1 15 . 1 1 132 132 LYS C C 132 177.482 177.482 177.787 -0.305 18933 10845 1 15 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.568 -0.076 18933 10846 1 15 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.346 -1.114 18933 10847 1 15 . 1 1 132 132 LYS H H 132 7.317 7.317 7.616 -0.299 18933 10848 1 15 . 1 1 133 133 LYS N N 133 117.093 117.093 117.098 -0.005 18933 10849 1 15 . 1 1 133 133 LYS C C 133 174.614 174.614 176.109 -1.495 18933 10850 1 15 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.893 -1.113 18933 10851 1 15 . 1 1 133 133 LYS CB C 133 32.182 32.182 33.024 -0.842 18933 10852 1 15 . 1 1 133 133 LYS H H 133 7.327 7.327 7.633 -0.306 18933 10853 1 15 . 1 1 134 134 ASN N N 134 113.012 113.012 115.601 -2.589 18933 10854 1 15 . 1 1 134 134 ASN C C 134 173.965 173.965 173.444 0.521 18933 10855 1 15 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.427 -0.131 18933 10856 1 15 . 1 1 134 134 ASN CB C 134 36.175 36.175 36.917 -0.742 18933 10857 1 15 . 1 1 134 134 ASN H H 134 7.938 7.938 7.929 0.009 18933 10858 1 15 . 1 1 135 135 TYR N N 135 115.725 115.725 119.253 -3.528 18933 10859 1 15 . 1 1 135 135 TYR C C 135 176.342 176.342 174.953 1.389 18933 10860 1 15 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.851 -2.183 18933 10861 1 15 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.337 1.226 18933 10862 1 15 . 1 1 135 135 TYR H H 135 7.741 7.741 8.481 -0.740 18933 10863 1 15 . 1 1 136 136 LYS N N 136 122.641 122.641 124.469 -1.828 18933 10864 1 15 . 1 1 136 136 LYS C C 136 173.475 173.475 174.546 -1.071 18933 10865 1 15 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.604 0.297 18933 10866 1 15 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.658 -1.940 18933 10867 1 15 . 1 1 136 136 LYS H H 136 9.296 9.296 8.762 0.534 18933 10868 1 15 . 1 1 137 137 LEU N N 137 127.284 127.284 123.600 3.684 18933 10869 1 15 . 1 1 137 137 LEU C C 137 175.423 175.423 176.089 -0.666 18933 10870 1 15 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.352 -0.226 18933 10871 1 15 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.129 3.617 18933 10872 1 15 . 1 1 137 137 LEU H H 137 8.776 8.776 8.581 0.195 18933 10873 1 15 . 1 1 138 138 ASN N N 138 125.818 125.818 119.283 6.535 18933 10874 1 15 . 1 1 138 138 ASN C C 138 174.933 174.933 175.605 -0.672 18933 10875 1 15 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.451 -0.334 18933 10876 1 15 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.360 -4.854 18933 10877 1 15 . 1 1 138 138 ASN H H 138 8.811 8.811 8.224 0.587 18933 10878 1 15 . 1 1 139 139 GLN N N 139 116.861 116.861 120.563 -3.702 18933 10879 1 15 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.541 -1.703 18933 10880 1 15 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.627 -2.910 18933 10881 1 15 . 1 1 139 139 GLN H H 139 9.220 9.220 9.003 0.217 18933 10882 1 15 . 1 1 140 140 TYR N N 140 120.600 120.600 121.530 -0.930 18933 10883 1 15 . 1 1 140 140 TYR CA C 140 56.757 56.757 58.034 -1.277 18933 10884 1 15 . 1 1 140 140 TYR CB C 140 37.570 37.570 38.552 -0.982 18933 10885 1 15 . 1 1 140 140 TYR H H 140 8.549 8.549 8.782 -0.233 18933 10886 1 15 . 1 1 141 141 GLY N N 141 105.986 105.986 110.045 -4.059 18933 10887 1 15 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.512 -0.668 18933 10888 1 15 . 1 1 141 141 GLY H H 141 7.186 7.186 7.914 -0.728 18933 10889 1 15 . 1 1 142 142 LEU N N 142 120.038 120.038 117.209 2.829 18933 10890 1 15 . 1 1 142 142 LEU C C 142 173.340 173.340 175.912 -2.572 18933 10891 1 15 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.233 -0.713 18933 10892 1 15 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.404 0.947 18933 10893 1 15 . 1 1 142 142 LEU H H 142 7.539 7.539 8.489 -0.950 18933 10894 1 15 . 1 1 143 143 PHE N N 143 124.229 124.229 120.116 4.113 18933 10895 1 15 . 1 1 143 143 PHE C C 143 173.977 173.977 175.283 -1.306 18933 10896 1 15 . 1 1 143 143 PHE CA C 143 52.641 52.641 54.986 -2.345 18933 10897 1 15 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.346 4.322 18933 10898 1 15 . 1 1 143 143 PHE H H 143 9.084 9.084 8.992 0.092 18933 10899 1 15 . 1 1 144 144 LYS N N 144 127.858 127.858 123.004 4.854 18933 10900 1 15 . 1 1 144 144 LYS C C 144 175.092 175.092 176.799 -1.707 18933 10901 1 15 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.398 4.458 18933 10902 1 15 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.753 3.831 18933 10903 1 15 . 1 1 144 144 LYS H H 144 9.281 9.281 8.906 0.375 18933 10904 1 15 . 1 1 145 145 ASN N N 145 128.188 128.188 126.341 1.847 18933 10905 1 15 . 1 1 145 145 ASN C C 145 175.779 175.779 174.811 0.968 18933 10906 1 15 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.528 3.198 18933 10907 1 15 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.828 -3.174 18933 10908 1 15 . 1 1 145 145 ASN H H 145 9.205 9.205 9.157 0.048 18933 10909 1 15 . 1 1 146 146 GLN N N 146 129.655 129.655 111.416 18.239 18933 10910 1 15 . 1 1 146 146 GLN C C 146 175.399 175.399 174.092 1.307 18933 10911 1 15 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.123 1.692 18933 10912 1 15 . 1 1 146 146 GLN CB C 146 32.626 32.626 28.334 4.292 18933 10913 1 15 . 1 1 146 146 GLN H H 146 8.983 8.983 8.727 0.256 18933 10914 1 15 . 1 1 147 147 THR N N 147 117.936 117.936 115.789 2.147 18933 10915 1 15 . 1 1 147 147 THR C C 147 173.254 173.254 173.219 0.035 18933 10916 1 15 . 1 1 147 147 THR CA C 147 61.721 61.721 61.459 0.262 18933 10917 1 15 . 1 1 147 147 THR CB C 147 70.274 70.274 69.606 0.668 18933 10918 1 15 . 1 1 147 147 THR H H 147 8.029 8.029 7.801 0.228 18933 10919 1 15 . 1 1 148 148 LEU N N 148 130.681 130.681 131.196 -0.515 18933 10920 1 15 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.122 0.344 18933 10921 1 15 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.807 -1.118 18933 10922 1 15 . 1 1 148 148 LEU H H 148 8.635 8.635 8.911 -0.276 18933 10923 1 15 . 1 1 149 149 VAL N N 149 130.803 130.803 128.299 2.504 18933 10924 1 15 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.388 0.790 18933 10925 1 15 . 1 1 149 149 VAL CB C 149 31.675 31.675 34.901 -3.227 18933 10926 1 15 . 1 1 149 149 VAL H H 149 8.968 8.968 9.269 -0.301 18933 10927 1 15 . 1 1 151 151 LEU N N 151 124.290 124.290 120.937 3.353 18933 10928 1 15 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.642 -2.630 18933 10929 1 15 . 1 1 151 151 LEU CB C 151 44.098 44.098 40.845 3.253 18933 10930 1 15 . 1 1 151 151 LEU H H 151 7.872 7.872 8.159 -0.287 18933 10931 1 15 . 1 1 153 153 ILE N N 153 114.943 114.943 114.565 0.378 18933 10932 1 15 . 1 1 153 153 ILE C C 153 175.877 175.877 175.482 0.395 18933 10933 1 15 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.804 -0.111 18933 10934 1 15 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.956 0.732 18933 10935 1 15 . 1 1 153 153 ILE H H 153 7.125 7.125 7.773 -0.648 18933 10936 1 15 . 1 1 154 154 THR N N 154 111.766 111.766 110.746 1.020 18933 10937 1 15 . 1 1 154 154 THR C C 154 174.945 174.945 174.577 0.368 18933 10938 1 15 . 1 1 154 154 THR CA C 154 62.124 62.124 63.444 -1.320 18933 10939 1 15 . 1 1 154 154 THR CB C 154 70.718 70.718 69.478 1.240 18933 10940 1 15 . 1 1 154 154 THR H H 154 9.286 9.286 8.318 0.968 18933 10941 1 15 . 1 1 155 155 THR N N 155 111.766 111.766 113.307 -1.541 18933 10942 1 15 . 1 1 155 155 THR CA C 155 58.936 58.936 59.653 -0.717 18933 10943 1 15 . 1 1 155 155 THR CB C 155 72.683 72.683 72.483 0.200 18933 10944 1 15 . 1 1 155 155 THR H H 155 7.645 7.645 7.198 0.447 18933 10945 1 15 . 1 1 157 157 LYS N N 157 119.464 119.464 118.995 0.469 18933 10946 1 15 . 1 1 157 157 LYS C C 157 178.781 178.781 178.942 -0.161 18933 10947 1 15 . 1 1 157 157 LYS CA C 157 60.026 60.026 60.030 -0.004 18933 10948 1 15 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.912 -0.490 18933 10949 1 15 . 1 1 157 157 LYS H H 157 8.175 8.175 8.181 -0.006 18933 10950 1 15 . 1 1 158 158 GLU N N 158 118.340 118.340 118.238 0.102 18933 10951 1 15 . 1 1 158 158 GLU C C 158 178.867 178.867 179.112 -0.245 18933 10952 1 15 . 1 1 158 158 GLU CA C 158 58.492 58.492 59.302 -0.810 18933 10953 1 15 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.693 0.637 18933 10954 1 15 . 1 1 158 158 GLU H H 158 7.519 7.519 8.264 -0.745 18933 10955 1 15 . 1 1 159 159 LEU N N 159 120.710 120.710 121.929 -1.219 18933 10956 1 15 . 1 1 159 159 LEU C C 159 176.526 176.526 178.104 -1.578 18933 10957 1 15 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.324 -0.154 18933 10958 1 15 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.617 -1.702 18933 10959 1 15 . 1 1 159 159 LEU H H 159 7.524 7.524 7.621 -0.097 18933 10960 1 15 . 1 1 160 160 ILE N N 160 118.217 118.217 119.251 -1.034 18933 10961 1 15 . 1 1 160 160 ILE C C 160 177.213 177.213 177.906 -0.693 18933 10962 1 15 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.850 -0.820 18933 10963 1 15 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.456 0.050 18933 10964 1 15 . 1 1 160 160 ILE H H 160 7.741 7.741 7.979 -0.238 18933 10965 1 15 . 1 1 161 161 LYS N N 161 118.450 118.450 119.723 -1.273 18933 10966 1 15 . 1 1 161 161 LYS C C 161 180.999 180.999 179.788 1.211 18933 10967 1 15 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.599 -0.784 18933 10968 1 15 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.205 -1.227 18933 10969 1 15 . 1 1 161 161 LYS H H 161 7.382 7.382 8.045 -0.663 18933 10970 1 15 . 1 1 162 162 GLU N N 162 121.846 121.846 120.800 1.046 18933 10971 1 15 . 1 1 162 162 GLU C C 162 178.818 178.818 178.167 0.651 18933 10972 1 15 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.509 -0.460 18933 10973 1 15 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.317 -1.381 18933 10974 1 15 . 1 1 162 162 GLU H H 162 8.210 8.210 7.855 0.355 18933 10975 1 15 . 1 1 163 163 LEU N N 163 116.751 116.751 115.305 1.446 18933 10976 1 15 . 1 1 163 163 LEU C C 163 176.784 176.784 177.422 -0.638 18933 10977 1 15 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.304 -0.282 18933 10978 1 15 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.869 -0.560 18933 10979 1 15 . 1 1 163 163 LEU H H 163 7.796 7.796 7.475 0.321 18933 10980 1 15 . 1 1 164 164 GLY N N 164 104.849 104.849 105.907 -1.058 18933 10981 1 15 . 1 1 164 164 GLY C C 164 174.492 174.492 174.223 0.269 18933 10982 1 15 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.410 -0.678 18933 10983 1 15 . 1 1 164 164 GLY H H 164 7.589 7.589 7.444 0.145 18933 10984 1 15 . 1 1 165 165 PHE N N 165 118.902 118.902 118.584 0.318 18933 10985 1 15 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.302 -0.634 18933 10986 1 15 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.264 -1.779 18933 10987 1 15 . 1 1 165 165 PHE H H 165 7.251 7.251 7.748 -0.497 18933 10988 1 15 . 1 1 166 166 THR N N 166 117.093 117.093 117.457 -0.364 18933 10989 1 15 . 1 1 166 166 THR CA C 166 62.245 62.245 61.192 1.053 18933 10990 1 15 . 1 1 166 166 THR CB C 166 69.323 69.323 69.304 0.019 18933 10991 1 15 . 1 1 166 166 THR H H 166 8.407 8.407 8.234 0.173 18933 10992 1 15 . 1 1 168 168 ARG N N 168 127.431 127.431 120.935 6.496 18933 10993 1 15 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.593 -2.356 18933 10994 1 15 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.204 -1.212 18933 10995 1 15 . 1 1 168 168 ARG H H 168 7.160 7.160 8.303 -1.143 18933 10996 1 15 . 1 1 171 171 LYS N N 171 113.574 113.574 113.625 -0.051 18933 10997 1 15 . 1 1 171 171 LYS C C 171 176.416 176.416 176.938 -0.522 18933 10998 1 15 . 1 1 171 171 LYS CA C 171 57.605 57.605 56.758 0.847 18933 10999 1 15 . 1 1 171 171 LYS CB C 171 31.929 31.929 30.824 1.105 18933 11000 1 15 . 1 1 171 171 LYS H H 171 8.210 8.210 8.259 -0.049 18933 11001 1 15 . 1 1 172 172 LYS N N 172 117.313 117.313 119.388 -2.075 18933 11002 1 15 . 1 1 172 172 LYS C C 172 175.717 175.717 176.164 -0.447 18933 11003 1 15 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.119 -1.944 18933 11004 1 15 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.865 -1.253 18933 11005 1 15 . 1 1 172 172 LYS H H 172 7.761 7.761 7.769 -0.008 18933 11006 1 15 . 1 1 173 173 ARG N N 173 122.056 122.056 117.755 4.301 18933 11007 1 15 . 1 1 173 173 ARG C C 173 172.850 172.850 175.635 -2.785 18933 11008 1 15 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.206 0.672 18933 11009 1 15 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.461 0.045 18933 11010 1 15 . 1 1 173 173 ARG H H 173 6.885 6.885 7.896 -1.011 18933 11011 1 16 . 1 1 2 2 LEU N N 2 122.812 122.812 122.626 0.186 18933 11012 1 16 . 1 1 2 2 LEU C C 2 175.742 175.742 176.169 -0.427 18933 11013 1 16 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.172 0.962 18933 11014 1 16 . 1 1 2 2 LEU CB C 2 42.842 42.842 45.167 -2.325 18933 11015 1 16 . 1 1 2 2 LEU H H 2 8.756 8.756 8.267 0.489 18933 11016 1 16 . 1 1 3 3 THR N N 3 113.000 113.000 113.818 -0.818 18933 11017 1 16 . 1 1 3 3 THR C C 3 175.938 175.938 175.281 0.657 18933 11018 1 16 . 1 1 3 3 THR CA C 3 60.550 60.550 60.477 0.073 18933 11019 1 16 . 1 1 3 3 THR CB C 3 70.781 70.781 70.460 0.321 18933 11020 1 16 . 1 1 3 3 THR H H 3 8.428 8.428 8.181 0.247 18933 11021 1 16 . 1 1 4 4 LEU N N 4 122.531 122.531 123.264 -0.733 18933 11022 1 16 . 1 1 4 4 LEU C C 4 178.463 178.463 178.525 -0.062 18933 11023 1 16 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.418 -0.289 18933 11024 1 16 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.007 -2.473 18933 11025 1 16 . 1 1 4 4 LEU H H 4 7.731 7.731 7.940 -0.209 18933 11026 1 16 . 1 1 5 5 ILE N N 5 115.505 115.505 116.801 -1.296 18933 11027 1 16 . 1 1 5 5 ILE C C 5 178.573 178.573 177.903 0.670 18933 11028 1 16 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.655 -0.917 18933 11029 1 16 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.309 -0.437 18933 11030 1 16 . 1 1 5 5 ILE H H 5 7.645 7.645 7.964 -0.319 18933 11031 1 16 . 1 1 6 6 GLN N N 6 121.626 121.626 119.420 2.206 18933 11032 1 16 . 1 1 6 6 GLN C C 6 179.014 179.014 178.713 0.301 18933 11033 1 16 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.136 -0.805 18933 11034 1 16 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.647 0.542 18933 11035 1 16 . 1 1 6 6 GLN H H 6 7.645 7.645 7.871 -0.226 18933 11036 1 16 . 1 1 7 7 GLY N N 7 107.684 107.684 106.896 0.788 18933 11037 1 16 . 1 1 7 7 GLY C C 7 174.749 174.749 176.201 -1.452 18933 11038 1 16 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.981 -0.191 18933 11039 1 16 . 1 1 7 7 GLY H H 7 8.660 8.660 8.024 0.636 18933 11040 1 16 . 1 1 8 8 LYS N N 8 120.942 120.942 122.296 -1.354 18933 11041 1 16 . 1 1 8 8 LYS C C 8 179.455 179.455 178.822 0.633 18933 11042 1 16 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.267 0.638 18933 11043 1 16 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.012 -0.590 18933 11044 1 16 . 1 1 8 8 LYS H H 8 8.518 8.518 7.462 1.056 18933 11045 1 16 . 1 1 9 9 LYS N N 9 120.710 120.710 119.819 0.891 18933 11046 1 16 . 1 1 9 9 LYS C C 9 179.823 179.823 179.273 0.550 18933 11047 1 16 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.417 0.205 18933 11048 1 16 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.306 -1.011 18933 11049 1 16 . 1 1 9 9 LYS H H 9 7.731 7.731 8.207 -0.476 18933 11050 1 16 . 1 1 10 10 ILE N N 10 121.345 121.345 120.627 0.718 18933 11051 1 16 . 1 1 10 10 ILE C C 10 177.789 177.789 177.964 -0.175 18933 11052 1 16 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.899 -1.434 18933 11053 1 16 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.126 -1.761 18933 11054 1 16 . 1 1 10 10 ILE H H 10 7.711 7.711 8.393 -0.682 18933 11055 1 16 . 1 1 11 11 VAL N N 11 120.258 120.258 120.251 0.007 18933 11056 1 16 . 1 1 11 11 VAL C C 11 177.372 177.372 178.125 -0.753 18933 11057 1 16 . 1 1 11 11 VAL CA C 11 67.451 67.451 66.966 0.485 18933 11058 1 16 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.077 -0.543 18933 11059 1 16 . 1 1 11 11 VAL H H 11 7.918 7.918 8.488 -0.570 18933 11060 1 16 . 1 1 12 12 ASN N N 12 116.971 116.971 118.237 -1.266 18933 11061 1 16 . 1 1 12 12 ASN C C 12 177.445 177.445 177.719 -0.274 18933 11062 1 16 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.354 -0.242 18933 11063 1 16 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.486 -0.853 18933 11064 1 16 . 1 1 12 12 ASN H H 12 7.993 7.993 8.780 -0.787 18933 11065 1 16 . 1 1 13 13 HIS N N 13 120.258 120.258 120.354 -0.096 18933 11066 1 16 . 1 1 13 13 HIS C C 13 177.862 177.862 177.766 0.096 18933 11067 1 16 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.621 -0.523 18933 11068 1 16 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.561 0.671 18933 11069 1 16 . 1 1 13 13 HIS H H 13 7.741 7.741 8.399 -0.658 18933 11070 1 16 . 1 1 14 14 LEU N N 14 116.641 116.641 119.950 -3.309 18933 11071 1 16 . 1 1 14 14 LEU C C 14 179.186 179.186 178.344 0.842 18933 11072 1 16 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.243 -1.486 18933 11073 1 16 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.529 -0.410 18933 11074 1 16 . 1 1 14 14 LEU H H 14 8.221 8.221 8.509 -0.288 18933 11075 1 16 . 1 1 15 15 ARG N N 15 115.957 115.957 114.869 1.088 18933 11076 1 16 . 1 1 15 15 ARG C C 15 176.330 176.330 178.314 -1.984 18933 11077 1 16 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.388 1.315 18933 11078 1 16 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.470 -1.393 18933 11079 1 16 . 1 1 15 15 ARG H H 15 7.968 7.968 8.515 -0.547 18933 11080 1 16 . 1 1 16 16 SER N N 16 109.395 109.395 115.787 -6.392 18933 11081 1 16 . 1 1 16 16 SER C C 16 176.024 176.024 175.094 0.930 18933 11082 1 16 . 1 1 16 16 SER CA C 16 57.282 57.282 60.381 -3.099 18933 11083 1 16 . 1 1 16 16 SER CB C 16 63.683 63.683 63.992 -0.309 18933 11084 1 16 . 1 1 16 16 SER H H 16 6.963 6.963 7.651 -0.688 18933 11085 1 16 . 1 1 17 17 ARG N N 17 122.775 122.775 121.764 1.011 18933 11086 1 16 . 1 1 17 17 ARG C C 17 174.590 174.590 173.985 0.605 18933 11087 1 16 . 1 1 17 17 ARG CA C 17 56.273 56.273 55.012 1.261 18933 11088 1 16 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.561 1.241 18933 11089 1 16 . 1 1 17 17 ARG H H 17 7.781 7.781 8.255 -0.474 18933 11090 1 16 . 1 1 18 18 LEU N N 18 122.421 122.421 125.955 -3.534 18933 11091 1 16 . 1 1 18 18 LEU C C 18 176.281 176.281 174.039 2.242 18933 11092 1 16 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.440 0.340 18933 11093 1 16 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.948 -3.737 18933 11094 1 16 . 1 1 18 18 LEU H H 18 8.650 8.650 7.718 0.932 18933 11095 1 16 . 1 1 19 19 ALA N N 19 126.441 126.441 126.690 -0.249 18933 11096 1 16 . 1 1 19 19 ALA C C 19 173.904 173.904 174.917 -1.013 18933 11097 1 16 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.609 -0.743 18933 11098 1 16 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.256 0.609 18933 11099 1 16 . 1 1 19 19 ALA H H 19 8.609 8.609 8.968 -0.359 18933 11100 1 16 . 1 1 20 20 PHE N N 20 114.600 114.600 118.890 -4.290 18933 11101 1 16 . 1 1 20 20 PHE C C 20 172.592 172.592 173.894 -1.302 18933 11102 1 16 . 1 1 20 20 PHE CA C 20 55.789 55.789 55.041 0.748 18933 11103 1 16 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.745 -1.056 18933 11104 1 16 . 1 1 20 20 PHE H H 20 8.801 8.801 9.116 -0.315 18933 11105 1 16 . 1 1 21 21 GLU N N 21 122.873 122.873 122.993 -0.120 18933 11106 1 16 . 1 1 21 21 GLU C C 21 174.872 174.872 175.281 -0.409 18933 11107 1 16 . 1 1 21 21 GLU CA C 21 55.062 55.062 54.896 0.166 18933 11108 1 16 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.163 -0.438 18933 11109 1 16 . 1 1 21 21 GLU H H 21 7.847 7.847 9.042 -1.195 18933 11110 1 16 . 1 1 22 22 TYR N N 22 126.270 126.270 126.612 -0.342 18933 11111 1 16 . 1 1 22 22 TYR C C 22 174.872 174.872 174.671 0.201 18933 11112 1 16 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.832 -1.084 18933 11113 1 16 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.155 -1.050 18933 11114 1 16 . 1 1 22 22 TYR H H 22 8.806 8.806 9.144 -0.338 18933 11115 1 16 . 1 1 23 23 ASN N N 23 128.420 128.420 125.805 2.615 18933 11116 1 16 . 1 1 23 23 ASN C C 23 175.435 175.435 175.093 0.342 18933 11117 1 16 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.480 -0.475 18933 11118 1 16 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.678 -1.313 18933 11119 1 16 . 1 1 23 23 ASN H H 23 8.943 8.943 9.116 -0.173 18933 11120 1 16 . 1 1 24 24 GLY N N 24 104.067 104.067 102.102 1.965 18933 11121 1 16 . 1 1 24 24 GLY C C 24 173.707 173.707 173.822 -0.115 18933 11122 1 16 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.972 -0.038 18933 11123 1 16 . 1 1 24 24 GLY H H 24 8.534 8.534 8.165 0.369 18933 11124 1 16 . 1 1 25 25 GLN N N 25 120.038 120.038 119.548 0.490 18933 11125 1 16 . 1 1 25 25 GLN C C 25 173.744 173.744 174.884 -1.140 18933 11126 1 16 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.235 -0.908 18933 11127 1 16 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.335 0.325 18933 11128 1 16 . 1 1 25 25 GLN H H 25 7.595 7.595 7.754 -0.159 18933 11129 1 16 . 1 1 26 26 LEU N N 26 124.681 124.681 124.558 0.123 18933 11130 1 16 . 1 1 26 26 LEU C C 26 175.987 175.987 176.231 -0.244 18933 11131 1 16 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.359 -0.346 18933 11132 1 16 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.524 -1.659 18933 11133 1 16 . 1 1 26 26 LEU H H 26 8.382 8.382 8.560 -0.178 18933 11134 1 16 . 1 1 27 27 ILE N N 27 130.779 130.779 127.281 3.498 18933 11135 1 16 . 1 1 27 27 ILE C C 27 175.215 175.215 174.364 0.851 18933 11136 1 16 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.649 -0.390 18933 11137 1 16 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.122 -2.390 18933 11138 1 16 . 1 1 27 27 ILE H H 27 8.882 8.882 8.955 -0.073 18933 11139 1 16 . 1 1 28 28 LYS N N 28 126.160 126.160 127.648 -1.488 18933 11140 1 16 . 1 1 28 28 LYS C C 28 176.771 176.771 175.724 1.047 18933 11141 1 16 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.930 1.908 18933 11142 1 16 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.115 -1.376 18933 11143 1 16 . 1 1 28 28 LYS H H 28 8.165 8.165 8.361 -0.196 18933 11144 1 16 . 1 1 29 29 ILE N N 29 126.380 126.380 121.972 4.408 18933 11145 1 16 . 1 1 29 29 ILE C C 29 175.877 175.877 174.327 1.550 18933 11146 1 16 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.478 -0.170 18933 11147 1 16 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.678 -2.615 18933 11148 1 16 . 1 1 29 29 ILE H H 29 8.019 8.019 8.741 -0.722 18933 11149 1 16 . 1 1 30 30 LEU N N 30 129.215 129.215 122.165 7.050 18933 11150 1 16 . 1 1 30 30 LEU C C 30 178.867 178.867 178.175 0.692 18933 11151 1 16 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.370 1.249 18933 11152 1 16 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.601 -4.736 18933 11153 1 16 . 1 1 30 30 LEU H H 30 8.917 8.917 8.352 0.565 18933 11154 1 16 . 1 1 31 31 SER N N 31 117.997 117.997 116.617 1.380 18933 11155 1 16 . 1 1 31 31 SER C C 31 177.396 177.396 175.655 1.741 18933 11156 1 16 . 1 1 31 31 SER CA C 31 61.236 61.236 60.717 0.519 18933 11157 1 16 . 1 1 31 31 SER CB C 31 62.035 62.035 63.240 -1.205 18933 11158 1 16 . 1 1 31 31 SER H H 31 8.594 8.594 8.877 -0.283 18933 11159 1 16 . 1 1 32 32 LYS N N 32 116.189 116.189 119.596 -3.407 18933 11160 1 16 . 1 1 32 32 LYS C C 32 176.244 176.244 177.265 -1.021 18933 11161 1 16 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.207 -0.804 18933 11162 1 16 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.403 -2.122 18933 11163 1 16 . 1 1 32 32 LYS H H 32 8.029 8.029 8.301 -0.272 18933 11164 1 16 . 1 1 33 33 ASN N N 33 119.061 119.061 115.377 3.684 18933 11165 1 16 . 1 1 33 33 ASN C C 33 172.384 172.384 174.350 -1.966 18933 11166 1 16 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.538 -1.381 18933 11167 1 16 . 1 1 33 33 ASN CB C 33 38.267 38.267 40.859 -2.592 18933 11168 1 16 . 1 1 33 33 ASN H H 33 7.902 7.902 7.809 0.093 18933 11169 1 16 . 1 1 34 34 ILE N N 34 120.038 120.038 119.413 0.625 18933 11170 1 16 . 1 1 34 34 ILE C C 34 175.607 175.607 174.203 1.404 18933 11171 1 16 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.465 0.084 18933 11172 1 16 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.616 -2.652 18933 11173 1 16 . 1 1 34 34 ILE H H 34 7.443 7.443 7.768 -0.325 18933 11174 1 16 . 1 1 35 35 VAL N N 35 129.435 129.435 126.133 3.302 18933 11175 1 16 . 1 1 35 35 VAL C C 35 175.386 175.386 174.634 0.752 18933 11176 1 16 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.154 -0.128 18933 11177 1 16 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.703 -0.922 18933 11178 1 16 . 1 1 35 35 VAL H H 35 9.533 9.533 8.939 0.594 18933 11179 1 16 . 1 1 36 36 ALA N N 36 130.571 130.571 129.522 1.049 18933 11180 1 16 . 1 1 36 36 ALA C C 36 177.347 177.347 176.196 1.151 18933 11181 1 16 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.903 0.496 18933 11182 1 16 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.645 -0.787 18933 11183 1 16 . 1 1 36 36 ALA H H 36 8.665 8.665 8.474 0.191 18933 11184 1 16 . 1 1 37 37 VAL N N 37 115.395 115.395 121.391 -5.996 18933 11185 1 16 . 1 1 37 37 VAL C C 37 174.455 174.455 176.149 -1.694 18933 11186 1 16 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.520 -0.140 18933 11187 1 16 . 1 1 37 37 VAL CB C 37 32.943 32.943 34.610 -1.667 18933 11188 1 16 . 1 1 37 37 VAL H H 37 8.079 8.079 8.220 -0.141 18933 11189 1 16 . 1 1 38 38 GLY N N 38 107.672 107.672 107.680 -0.008 18933 11190 1 16 . 1 1 38 38 GLY C C 38 173.364 173.364 175.723 -2.359 18933 11191 1 16 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.408 -0.223 18933 11192 1 16 . 1 1 38 38 GLY H H 38 7.579 7.579 8.074 -0.495 18933 11193 1 16 . 1 1 39 39 SER N N 39 121.052 121.052 119.634 1.418 18933 11194 1 16 . 1 1 39 39 SER C C 39 175.570 175.570 176.484 -0.914 18933 11195 1 16 . 1 1 39 39 SER CA C 39 61.801 61.801 61.589 0.212 18933 11196 1 16 . 1 1 39 39 SER CB C 39 62.478 62.478 63.403 -0.925 18933 11197 1 16 . 1 1 39 39 SER H H 39 8.953 8.953 8.131 0.822 18933 11198 1 16 . 1 1 40 40 LEU N N 40 121.553 121.553 121.961 -0.408 18933 11199 1 16 . 1 1 40 40 LEU C C 40 180.203 180.203 177.758 2.445 18933 11200 1 16 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.082 0.047 18933 11201 1 16 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.954 -0.201 18933 11202 1 16 . 1 1 40 40 LEU H H 40 8.195 8.195 7.312 0.883 18933 11203 1 16 . 1 1 41 41 ARG N N 41 121.956 121.956 116.679 5.277 18933 11204 1 16 . 1 1 41 41 ARG C C 41 177.323 177.323 178.179 -0.856 18933 11205 1 16 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.582 0.749 18933 11206 1 16 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.939 -1.496 18933 11207 1 16 . 1 1 41 41 ARG H H 41 6.873 6.873 7.321 -0.448 18933 11208 1 16 . 1 1 42 42 ARG N N 42 114.600 114.600 117.009 -2.409 18933 11209 1 16 . 1 1 42 42 ARG C C 42 172.911 172.911 175.701 -2.790 18933 11210 1 16 . 1 1 42 42 ARG CA C 42 57.242 57.242 56.913 0.328 18933 11211 1 16 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.955 -1.815 18933 11212 1 16 . 1 1 42 42 ARG H H 42 7.438 7.438 8.064 -0.626 18933 11213 1 16 . 1 1 43 43 GLU N N 43 113.354 113.354 117.062 -3.708 18933 11214 1 16 . 1 1 43 43 GLU C C 43 175.999 175.999 175.440 0.559 18933 11215 1 16 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.254 -0.698 18933 11216 1 16 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.012 -1.675 18933 11217 1 16 . 1 1 43 43 GLU H H 43 7.564 7.564 7.975 -0.411 18933 11218 1 16 . 1 1 44 44 GLU N N 44 119.696 119.696 121.450 -1.754 18933 11219 1 16 . 1 1 44 44 GLU C C 44 175.423 175.423 177.350 -1.927 18933 11220 1 16 . 1 1 44 44 GLU CA C 44 56.838 56.838 57.031 -0.193 18933 11221 1 16 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.277 -1.581 18933 11222 1 16 . 1 1 44 44 GLU H H 44 7.261 7.261 8.500 -1.239 18933 11223 1 16 . 1 1 45 45 LYS N N 45 117.435 117.435 117.252 0.183 18933 11224 1 16 . 1 1 45 45 LYS C C 45 177.715 177.715 175.210 2.505 18933 11225 1 16 . 1 1 45 45 LYS CA C 45 59.219 59.219 57.236 1.983 18933 11226 1 16 . 1 1 45 45 LYS CB C 45 32.119 32.119 33.719 -1.600 18933 11227 1 16 . 1 1 45 45 LYS H H 45 7.938 7.938 8.074 -0.136 18933 11228 1 16 . 1 1 46 46 MET N N 46 115.847 115.847 117.789 -1.942 18933 11229 1 16 . 1 1 46 46 MET CA C 46 52.520 52.520 53.585 -1.065 18933 11230 1 16 . 1 1 46 46 MET CB C 46 33.450 33.450 35.221 -1.770 18933 11231 1 16 . 1 1 46 46 MET H H 46 7.595 7.595 7.664 -0.069 18933 11232 1 16 . 1 1 47 47 LEU N N 47 121.627 121.627 122.658 -1.031 18933 11233 1 16 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.108 -0.982 18933 11234 1 16 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.585 -0.515 18933 11235 1 16 . 1 1 47 47 LEU H H 47 9.220 9.220 8.871 0.349 18933 11236 1 16 . 1 1 49 49 ASP N N 49 117.093 117.093 118.485 -1.392 18933 11237 1 16 . 1 1 49 49 ASP C C 49 173.340 173.340 174.316 -0.976 18933 11238 1 16 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.604 -1.810 18933 11239 1 16 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.955 -1.948 18933 11240 1 16 . 1 1 49 49 ASP H H 49 7.761 7.761 7.508 0.253 18933 11241 1 16 . 1 1 50 50 VAL N N 50 119.012 119.012 119.788 -0.776 18933 11242 1 16 . 1 1 50 50 VAL C C 50 173.070 173.070 174.040 -0.970 18933 11243 1 16 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.485 1.357 18933 11244 1 16 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.069 -0.506 18933 11245 1 16 . 1 1 50 50 VAL H H 50 8.089 8.089 8.590 -0.501 18933 11246 1 16 . 1 1 51 51 ASP N N 51 127.064 127.064 126.009 1.055 18933 11247 1 16 . 1 1 51 51 ASP C C 51 174.565 174.565 175.460 -0.895 18933 11248 1 16 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.804 -0.647 18933 11249 1 16 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.377 -0.737 18933 11250 1 16 . 1 1 51 51 ASP H H 51 8.069 8.069 8.141 -0.072 18933 11251 1 16 . 1 1 52 52 LEU N N 52 121.627 121.627 120.048 1.579 18933 11252 1 16 . 1 1 52 52 LEU C C 52 174.063 174.063 174.785 -0.722 18933 11253 1 16 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.512 -0.830 18933 11254 1 16 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.368 -3.017 18933 11255 1 16 . 1 1 52 52 LEU H H 52 8.852 8.852 9.090 -0.238 18933 11256 1 16 . 1 1 53 53 LEU N N 53 123.093 123.093 123.341 -0.248 18933 11257 1 16 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.189 1.802 18933 11258 1 16 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.683 -2.550 18933 11259 1 16 . 1 1 53 53 LEU H H 53 9.362 9.362 9.086 0.276 18933 11260 1 16 . 1 1 54 54 ILE N N 54 123.777 123.777 129.345 -5.568 18933 11261 1 16 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.056 -3.994 18933 11262 1 16 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.502 -7.432 18933 11263 1 16 . 1 1 54 54 ILE H H 54 8.907 8.907 9.366 -0.459 18933 11264 1 16 . 1 1 58 58 GLU N N 58 114.710 114.710 117.070 -2.360 18933 11265 1 16 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.862 -1.485 18933 11266 1 16 . 1 1 58 58 GLU CB C 58 31.422 31.422 32.962 -1.540 18933 11267 1 16 . 1 1 58 58 GLU H H 58 6.716 6.716 7.691 -0.975 18933 11268 1 16 . 1 1 61 61 LEU N N 61 115.957 115.957 119.955 -3.998 18933 11269 1 16 . 1 1 61 61 LEU C C 61 178.512 178.512 178.456 0.056 18933 11270 1 16 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.395 -2.615 18933 11271 1 16 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.842 -0.723 18933 11272 1 16 . 1 1 61 61 LEU H H 61 7.307 7.307 7.814 -0.507 18933 11273 1 16 . 1 1 62 62 LEU N N 62 120.038 120.038 119.583 0.455 18933 11274 1 16 . 1 1 62 62 LEU C C 62 177.874 177.874 178.756 -0.882 18933 11275 1 16 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.532 0.404 18933 11276 1 16 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.931 -1.192 18933 11277 1 16 . 1 1 62 62 LEU H H 62 7.327 7.327 8.264 -0.937 18933 11278 1 16 . 1 1 63 63 LYS N N 63 114.600 114.600 116.029 -1.429 18933 11279 1 16 . 1 1 63 63 LYS C C 63 175.460 175.460 177.704 -2.244 18933 11280 1 16 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.974 -1.410 18933 11281 1 16 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.488 -1.763 18933 11282 1 16 . 1 1 63 63 LYS H H 63 7.973 7.973 7.795 0.178 18933 11283 1 16 . 1 1 64 64 HIS N N 64 115.273 115.273 115.762 -0.489 18933 11284 1 16 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.710 0.402 18933 11285 1 16 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.474 1.962 18933 11286 1 16 . 1 1 64 64 HIS H H 64 7.544 7.544 7.621 -0.077 18933 11287 1 16 . 1 1 65 65 VAL N N 65 118.682 118.682 119.721 -1.039 18933 11288 1 16 . 1 1 65 65 VAL CA C 65 66.038 66.038 63.041 2.997 18933 11289 1 16 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.498 -2.471 18933 11290 1 16 . 1 1 65 65 VAL H H 65 6.787 6.787 7.405 -0.619 18933 11291 1 16 . 1 1 68 68 ASN N N 68 112.108 112.108 117.881 -5.773 18933 11292 1 16 . 1 1 68 68 ASN C C 68 174.884 174.884 173.988 0.896 18933 11293 1 16 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.400 -1.373 18933 11294 1 16 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.381 0.851 18933 11295 1 16 . 1 1 68 68 ASN H H 68 7.009 7.009 8.317 -1.308 18933 11296 1 16 . 1 1 69 69 ILE N N 69 123.325 123.325 123.823 -0.498 18933 11297 1 16 . 1 1 69 69 ILE C C 69 174.394 174.394 175.244 -0.850 18933 11298 1 16 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.412 -1.305 18933 11299 1 16 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.760 -0.492 18933 11300 1 16 . 1 1 69 69 ILE H H 69 7.150 7.150 8.122 -0.972 18933 11301 1 16 . 1 1 70 70 ARG N N 70 126.722 126.722 125.274 1.448 18933 11302 1 16 . 1 1 70 70 ARG C C 70 174.590 174.590 173.898 0.692 18933 11303 1 16 . 1 1 70 70 ARG CA C 70 53.247 53.247 53.677 -0.430 18933 11304 1 16 . 1 1 70 70 ARG CB C 70 32.372 32.372 32.971 -0.599 18933 11305 1 16 . 1 1 70 70 ARG H H 70 8.902 8.902 9.148 -0.246 18933 11306 1 16 . 1 1 71 71 ILE N N 71 119.978 119.978 119.705 0.273 18933 11307 1 16 . 1 1 71 71 ILE C C 71 175.583 175.583 176.094 -0.511 18933 11308 1 16 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.644 0.180 18933 11309 1 16 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.756 -2.996 18933 11310 1 16 . 1 1 71 71 ILE H H 71 7.491 7.491 8.779 -1.288 18933 11311 1 16 . 1 1 72 72 LYS N N 72 128.530 128.530 125.029 3.501 18933 11312 1 16 . 1 1 72 72 LYS C C 72 177.703 177.703 176.033 1.670 18933 11313 1 16 . 1 1 72 72 LYS CA C 72 57.201 57.201 55.834 1.367 18933 11314 1 16 . 1 1 72 72 LYS CB C 72 31.485 31.485 31.473 0.012 18933 11315 1 16 . 1 1 72 72 LYS H H 72 8.523 8.523 8.588 -0.065 18933 11316 1 16 . 1 1 73 73 GLY N N 73 113.806 113.806 110.224 3.582 18933 11317 1 16 . 1 1 73 73 GLY C C 73 173.781 173.781 172.848 0.933 18933 11318 1 16 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.094 0.728 18933 11319 1 16 . 1 1 73 73 GLY H H 73 8.791 8.791 8.368 0.423 18933 11320 1 16 . 1 1 74 74 LEU N N 74 120.490 120.490 118.356 2.134 18933 11321 1 16 . 1 1 74 74 LEU C C 74 175.840 175.840 173.526 2.314 18933 11322 1 16 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.358 -0.667 18933 11323 1 16 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.091 -0.930 18933 11324 1 16 . 1 1 74 74 LEU H H 74 7.393 7.393 7.293 0.100 18933 11325 1 16 . 1 1 75 75 SER N N 75 120.038 120.038 115.608 4.430 18933 11326 1 16 . 1 1 75 75 SER C C 75 173.205 173.205 173.055 0.150 18933 11327 1 16 . 1 1 75 75 SER CA C 75 57.887 57.887 57.677 0.210 18933 11328 1 16 . 1 1 75 75 SER CB C 75 63.049 63.049 65.141 -2.092 18933 11329 1 16 . 1 1 75 75 SER H H 75 8.917 8.917 8.118 0.799 18933 11330 1 16 . 1 1 76 76 PHE N N 76 119.586 119.586 117.803 1.783 18933 11331 1 16 . 1 1 76 76 PHE C C 76 173.536 173.536 173.674 -0.138 18933 11332 1 16 . 1 1 76 76 PHE CA C 76 55.426 55.426 55.999 -0.573 18933 11333 1 16 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.169 -0.163 18933 11334 1 16 . 1 1 76 76 PHE H H 76 8.003 8.003 8.376 -0.373 18933 11335 1 16 . 1 1 77 77 SER N N 77 114.943 114.943 117.443 -2.500 18933 11336 1 16 . 1 1 77 77 SER C C 77 173.438 173.438 172.876 0.562 18933 11337 1 16 . 1 1 77 77 SER CA C 77 56.152 56.152 57.208 -1.056 18933 11338 1 16 . 1 1 77 77 SER CB C 77 65.204 65.204 65.578 -0.374 18933 11339 1 16 . 1 1 77 77 SER H H 77 8.907 8.907 8.813 0.094 18933 11340 1 16 . 1 1 78 78 VAL N N 78 124.791 124.791 124.007 0.784 18933 11341 1 16 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.286 1.758 18933 11342 1 16 . 1 1 78 78 VAL CB C 78 32.182 32.182 33.883 -1.701 18933 11343 1 16 . 1 1 78 78 VAL H H 78 8.892 8.892 8.439 0.453 18933 11344 1 16 . 1 1 79 79 LYS N N 79 129.667 129.667 129.422 0.245 18933 11345 1 16 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.028 2.164 18933 11346 1 16 . 1 1 79 79 LYS CB C 79 32.372 32.372 34.444 -2.072 18933 11347 1 16 . 1 1 79 79 LYS H H 79 9.049 9.049 8.750 0.299 18933 11348 1 16 . 1 1 82 82 GLY N N 82 117.263 117.263 114.393 2.870 18933 11349 1 16 . 1 1 82 82 GLY C C 82 171.710 171.710 174.521 -2.811 18933 11350 1 16 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.652 -2.727 18933 11351 1 16 . 1 1 82 82 GLY H H 82 8.044 8.044 8.719 -0.675 18933 11352 1 16 . 1 1 83 83 GLU N N 83 117.203 117.203 121.506 -4.303 18933 11353 1 16 . 1 1 83 83 GLU C C 83 178.695 178.695 177.533 1.162 18933 11354 1 16 . 1 1 83 83 GLU CA C 83 58.977 58.977 56.894 2.083 18933 11355 1 16 . 1 1 83 83 GLU CB C 83 29.837 29.837 30.027 -0.190 18933 11356 1 16 . 1 1 83 83 GLU H H 83 8.296 8.296 8.323 -0.027 18933 11357 1 16 . 1 1 84 84 ARG N N 84 113.818 113.818 118.780 -4.962 18933 11358 1 16 . 1 1 84 84 ARG C C 84 175.877 175.877 175.203 0.674 18933 11359 1 16 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.305 -1.574 18933 11360 1 16 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.666 1.629 18933 11361 1 16 . 1 1 84 84 ARG H H 84 8.342 8.342 7.935 0.407 18933 11362 1 16 . 1 1 85 85 LYS N N 85 119.354 119.354 121.540 -2.186 18933 11363 1 16 . 1 1 85 85 LYS C C 85 174.516 174.516 174.086 0.430 18933 11364 1 16 . 1 1 85 85 LYS CA C 85 54.740 54.740 54.953 -0.213 18933 11365 1 16 . 1 1 85 85 LYS CB C 85 34.844 34.844 35.475 -0.631 18933 11366 1 16 . 1 1 85 85 LYS H H 85 6.822 6.822 7.508 -0.686 18933 11367 1 16 . 1 1 86 86 CYS N N 86 125.928 125.928 124.871 1.057 18933 11368 1 16 . 1 1 86 86 CYS C C 86 171.600 171.600 173.242 -1.642 18933 11369 1 16 . 1 1 86 86 CYS CA C 86 55.627 55.627 58.052 -2.425 18933 11370 1 16 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.339 0.005 18933 11371 1 16 . 1 1 86 86 CYS H H 86 9.084 9.084 9.416 -0.332 18933 11372 1 16 . 1 1 87 87 VAL N N 87 126.612 126.612 126.140 0.472 18933 11373 1 16 . 1 1 87 87 VAL C C 87 174.431 174.431 174.669 -0.238 18933 11374 1 16 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.837 -0.520 18933 11375 1 16 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.377 0.819 18933 11376 1 16 . 1 1 87 87 VAL H H 87 8.705 8.705 9.133 -0.428 18933 11377 1 16 . 1 1 88 88 LEU N N 88 127.748 127.748 123.675 4.073 18933 11378 1 16 . 1 1 88 88 LEU C C 88 175.227 175.227 174.799 0.428 18933 11379 1 16 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.818 -0.298 18933 11380 1 16 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.227 -1.621 18933 11381 1 16 . 1 1 88 88 LEU H H 88 9.417 9.417 8.743 0.674 18933 11382 1 16 . 1 1 89 89 PHE N N 89 120.981 120.981 119.483 1.498 18933 11383 1 16 . 1 1 89 89 PHE C C 89 176.906 176.906 175.935 0.971 18933 11384 1 16 . 1 1 89 89 PHE CA C 89 55.587 55.587 55.990 -0.403 18933 11385 1 16 . 1 1 89 89 PHE CB C 89 38.901 38.901 42.004 -3.103 18933 11386 1 16 . 1 1 89 89 PHE H H 89 8.937 8.937 8.857 0.080 18933 11387 1 16 . 1 1 90 90 ILE N N 90 119.928 119.928 119.073 0.855 18933 11388 1 16 . 1 1 90 90 ILE C C 90 173.781 173.781 175.042 -1.261 18933 11389 1 16 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.496 -0.842 18933 11390 1 16 . 1 1 90 90 ILE CB C 90 40.612 40.612 38.632 1.980 18933 11391 1 16 . 1 1 90 90 ILE H H 90 9.230 9.230 9.098 0.132 18933 11392 1 16 . 1 1 91 91 GLU N N 91 124.339 124.339 125.690 -1.351 18933 11393 1 16 . 1 1 91 91 GLU C C 91 175.607 175.607 175.435 0.172 18933 11394 1 16 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.674 -0.055 18933 11395 1 16 . 1 1 91 91 GLU CB C 91 29.837 29.837 32.500 -2.663 18933 11396 1 16 . 1 1 91 91 GLU H H 91 8.175 8.175 9.009 -0.834 18933 11397 1 16 . 1 1 92 92 TRP N N 92 127.516 127.516 124.778 2.738 18933 11398 1 16 . 1 1 92 92 TRP C C 92 175.203 175.203 176.264 -1.061 18933 11399 1 16 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.669 1.564 18933 11400 1 16 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.410 1.251 18933 11401 1 16 . 1 1 92 92 TRP H H 92 9.306 9.306 8.586 0.720 18933 11402 1 16 . 1 1 93 93 GLU N N 93 127.834 127.834 126.540 1.294 18933 11403 1 16 . 1 1 93 93 GLU C C 93 175.668 175.668 176.342 -0.674 18933 11404 1 16 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.492 -0.614 18933 11405 1 16 . 1 1 93 93 GLU CB C 93 26.034 26.034 28.011 -1.977 18933 11406 1 16 . 1 1 93 93 GLU H H 93 8.796 8.796 9.229 -0.433 18933 11407 1 16 . 1 1 94 94 LYS N N 94 108.931 108.931 110.883 -1.952 18933 11408 1 16 . 1 1 94 94 LYS C C 94 175.423 175.423 175.852 -0.429 18933 11409 1 16 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.585 -0.142 18933 11410 1 16 . 1 1 94 94 LYS CB C 94 28.633 28.633 30.724 -2.091 18933 11411 1 16 . 1 1 94 94 LYS H H 94 8.498 8.498 8.629 -0.131 18933 11412 1 16 . 1 1 95 95 LYS N N 95 121.737 121.737 120.930 0.807 18933 11413 1 16 . 1 1 95 95 LYS C C 95 174.443 174.443 174.998 -0.555 18933 11414 1 16 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.308 -1.891 18933 11415 1 16 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.128 0.336 18933 11416 1 16 . 1 1 95 95 LYS H H 95 7.761 7.761 7.674 0.087 18933 11417 1 16 . 1 1 96 96 THR N N 96 116.067 116.067 116.058 0.009 18933 11418 1 16 . 1 1 96 96 THR C C 96 174.296 174.296 173.485 0.811 18933 11419 1 16 . 1 1 96 96 THR CA C 96 61.115 61.115 61.100 0.015 18933 11420 1 16 . 1 1 96 96 THR CB C 96 69.450 69.450 71.312 -1.862 18933 11421 1 16 . 1 1 96 96 THR H H 96 7.761 7.761 8.056 -0.295 18933 11422 1 16 . 1 1 97 97 TYR N N 97 124.229 124.229 123.755 0.474 18933 11423 1 16 . 1 1 97 97 TYR C C 97 173.536 173.536 174.430 -0.894 18933 11424 1 16 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.528 -0.578 18933 11425 1 16 . 1 1 97 97 TYR CB C 97 41.182 41.182 41.879 -0.697 18933 11426 1 16 . 1 1 97 97 TYR H H 97 9.018 9.018 9.223 -0.205 18933 11427 1 16 . 1 1 98 98 GLN N N 98 123.435 123.435 121.111 2.324 18933 11428 1 16 . 1 1 98 98 GLN C C 98 173.266 173.266 174.100 -0.834 18933 11429 1 16 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.660 -0.517 18933 11430 1 16 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.642 -0.629 18933 11431 1 16 . 1 1 98 98 GLN H H 98 8.781 8.781 9.187 -0.406 18933 11432 1 16 . 1 1 99 99 LEU N N 99 130.119 130.119 127.291 2.828 18933 11433 1 16 . 1 1 99 99 LEU C C 99 173.867 173.867 174.132 -0.265 18933 11434 1 16 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.172 -0.652 18933 11435 1 16 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.766 -1.161 18933 11436 1 16 . 1 1 99 99 LEU H H 99 9.104 9.104 8.749 0.355 18933 11437 1 16 . 1 1 100 100 ASP N N 100 125.182 125.182 127.405 -2.223 18933 11438 1 16 . 1 1 100 100 ASP C C 100 172.837 172.837 174.395 -1.558 18933 11439 1 16 . 1 1 100 100 ASP CA C 100 51.754 51.754 54.116 -2.362 18933 11440 1 16 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.441 -4.097 18933 11441 1 16 . 1 1 100 100 ASP H H 100 9.089 9.089 8.646 0.443 18933 11442 1 16 . 1 1 101 101 LEU N N 101 121.174 121.174 127.785 -6.611 18933 11443 1 16 . 1 1 101 101 LEU C C 101 174.529 174.529 174.557 -0.028 18933 11444 1 16 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.739 -1.824 18933 11445 1 16 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.726 -1.818 18933 11446 1 16 . 1 1 101 101 LEU H H 101 8.458 8.458 9.248 -0.790 18933 11447 1 16 . 1 1 102 102 PHE N N 102 119.464 119.464 125.075 -5.611 18933 11448 1 16 . 1 1 102 102 PHE C C 102 176.293 176.293 174.581 1.712 18933 11449 1 16 . 1 1 102 102 PHE CA C 102 54.054 54.054 56.138 -2.084 18933 11450 1 16 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.906 -1.026 18933 11451 1 16 . 1 1 102 102 PHE H H 102 8.281 8.281 9.303 -1.022 18933 11452 1 16 . 1 1 103 103 THR N N 103 108.576 108.576 117.974 -9.398 18933 11453 1 16 . 1 1 103 103 THR C C 103 174.933 174.933 173.291 1.642 18933 11454 1 16 . 1 1 103 103 THR CA C 103 57.726 57.726 60.175 -2.449 18933 11455 1 16 . 1 1 103 103 THR CB C 103 71.288 71.288 69.830 1.458 18933 11456 1 16 . 1 1 103 103 THR H H 103 7.872 7.872 8.181 -0.309 18933 11457 1 16 . 1 1 104 104 ALA N N 104 122.885 122.885 128.779 -5.894 18933 11458 1 16 . 1 1 104 104 ALA C C 104 175.754 175.754 175.042 0.712 18933 11459 1 16 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.651 0.367 18933 11460 1 16 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.950 -0.465 18933 11461 1 16 . 1 1 104 104 ALA H H 104 8.660 8.660 9.317 -0.657 18933 11462 1 16 . 1 1 105 105 LEU N N 105 120.881 120.881 119.743 1.138 18933 11463 1 16 . 1 1 105 105 LEU C C 105 179.504 179.504 179.046 0.458 18933 11464 1 16 . 1 1 105 105 LEU CA C 105 53.247 53.247 53.780 -0.533 18933 11465 1 16 . 1 1 105 105 LEU CB C 105 41.753 41.753 43.282 -1.529 18933 11466 1 16 . 1 1 105 105 LEU H H 105 8.226 8.226 8.325 -0.099 18933 11467 1 16 . 1 1 106 106 ALA N N 106 124.901 124.901 124.240 0.661 18933 11468 1 16 . 1 1 106 106 ALA C C 106 181.269 181.269 179.036 2.233 18933 11469 1 16 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.913 1.399 18933 11470 1 16 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.844 -1.620 18933 11471 1 16 . 1 1 106 106 ALA H H 106 8.392 8.392 8.727 -0.335 18933 11472 1 16 . 1 1 107 107 GLU N N 107 116.409 116.409 116.958 -0.549 18933 11473 1 16 . 1 1 107 107 GLU C C 107 177.764 177.764 176.982 0.782 18933 11474 1 16 . 1 1 107 107 GLU CA C 107 58.533 58.533 58.159 0.374 18933 11475 1 16 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.803 -1.867 18933 11476 1 16 . 1 1 107 107 GLU H H 107 9.664 9.664 8.798 0.866 18933 11477 1 16 . 1 1 108 108 GLU N N 108 116.189 116.189 117.726 -1.537 18933 11478 1 16 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.465 -1.322 18933 11479 1 16 . 1 1 108 108 GLU CB C 108 29.837 29.837 29.241 0.596 18933 11480 1 16 . 1 1 108 108 GLU H H 108 7.589 7.589 7.608 -0.019 18933 11481 1 16 . 1 1 109 109 LYS N N 109 119.928 119.928 121.748 -1.820 18933 11482 1 16 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.198 1.653 18933 11483 1 16 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.465 0.006 18933 11484 1 16 . 1 1 109 109 LYS H H 109 7.514 7.514 7.616 -0.102 18933 11485 1 16 . 1 1 111 111 TYR N N 111 114.930 114.930 119.083 -4.153 18933 11486 1 16 . 1 1 111 111 TYR C C 111 179.504 179.504 177.639 1.865 18933 11487 1 16 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.383 -2.366 18933 11488 1 16 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.682 -2.014 18933 11489 1 16 . 1 1 111 111 TYR H H 111 6.393 6.393 8.404 -2.011 18933 11490 1 16 . 1 1 112 112 ALA N N 112 124.901 124.901 122.089 2.812 18933 11491 1 16 . 1 1 112 112 ALA C C 112 179.173 179.173 179.261 -0.088 18933 11492 1 16 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.416 -0.515 18933 11493 1 16 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.317 -0.205 18933 11494 1 16 . 1 1 112 112 ALA H H 112 8.554 8.554 8.391 0.163 18933 11495 1 16 . 1 1 113 113 ILE N N 113 119.464 119.464 119.569 -0.105 18933 11496 1 16 . 1 1 113 113 ILE C C 113 178.499 178.499 177.544 0.955 18933 11497 1 16 . 1 1 113 113 ILE CA C 113 66.281 66.281 63.896 2.385 18933 11498 1 16 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.834 -0.518 18933 11499 1 16 . 1 1 113 113 ILE H H 113 8.680 8.680 7.604 1.076 18933 11500 1 16 . 1 1 114 114 PHE N N 114 122.922 122.922 122.110 0.812 18933 11501 1 16 . 1 1 114 114 PHE C C 114 178.217 178.217 177.220 0.997 18933 11502 1 16 . 1 1 114 114 PHE CA C 114 61.559 61.559 60.301 1.258 18933 11503 1 16 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.640 0.831 18933 11504 1 16 . 1 1 114 114 PHE H H 114 7.721 7.721 8.073 -0.352 18933 11505 1 16 . 1 1 115 115 HIS N N 115 118.560 118.560 117.504 1.056 18933 11506 1 16 . 1 1 115 115 HIS C C 115 177.286 177.286 176.615 0.671 18933 11507 1 16 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.283 0.097 18933 11508 1 16 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.183 1.682 18933 11509 1 16 . 1 1 115 115 HIS H H 115 8.155 8.155 8.150 0.005 18933 11510 1 16 . 1 1 116 116 PHE N N 116 111.472 111.472 116.752 -5.280 18933 11511 1 16 . 1 1 116 116 PHE C C 116 179.026 179.026 176.968 2.058 18933 11512 1 16 . 1 1 116 116 PHE CA C 116 59.461 59.461 59.866 -0.405 18933 11513 1 16 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.962 -1.773 18933 11514 1 16 . 1 1 116 116 PHE H H 116 8.564 8.564 7.797 0.767 18933 11515 1 16 . 1 1 117 117 THR N N 117 119.012 119.012 112.071 6.941 18933 11516 1 16 . 1 1 117 117 THR C C 117 172.935 172.935 175.240 -2.305 18933 11517 1 16 . 1 1 117 117 THR CA C 117 67.088 67.088 64.957 2.131 18933 11518 1 16 . 1 1 117 117 THR CB C 117 37.126 37.126 68.998 -31.872 18933 11519 1 16 . 1 1 117 117 THR H H 117 7.620 7.620 8.177 -0.557 18933 11520 1 16 . 1 1 118 118 GLY N N 118 107.917 107.917 109.507 -1.590 18933 11521 1 16 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.310 1.857 18933 11522 1 16 . 1 1 118 118 GLY H H 118 6.666 6.666 7.430 -0.764 18933 11523 1 16 . 1 1 121 121 SER N N 121 113.354 113.354 117.875 -4.521 18933 11524 1 16 . 1 1 121 121 SER C C 121 176.061 176.061 176.058 0.003 18933 11525 1 16 . 1 1 121 121 SER CA C 121 61.035 61.035 61.461 -0.426 18933 11526 1 16 . 1 1 121 121 SER H H 121 8.322 8.322 8.286 0.036 18933 11527 1 16 . 1 1 122 122 TYR N N 122 124.681 124.681 122.092 2.589 18933 11528 1 16 . 1 1 122 122 TYR C C 122 176.293 176.293 177.589 -1.296 18933 11529 1 16 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.915 -1.858 18933 11530 1 16 . 1 1 122 122 TYR CB C 122 38.711 38.711 37.860 0.851 18933 11531 1 16 . 1 1 122 122 TYR H H 122 6.514 6.514 8.427 -1.913 18933 11532 1 16 . 1 1 123 123 LEU N N 123 117.997 117.997 119.878 -1.881 18933 11533 1 16 . 1 1 123 123 LEU C C 123 179.774 179.774 178.872 0.902 18933 11534 1 16 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.969 -0.091 18933 11535 1 16 . 1 1 123 123 LEU CB C 123 39.978 39.978 41.143 -1.165 18933 11536 1 16 . 1 1 123 123 LEU H H 123 7.428 7.428 7.282 0.146 18933 11537 1 16 . 1 1 124 124 ILE N N 124 119.012 119.012 120.269 -1.257 18933 11538 1 16 . 1 1 124 124 ILE C C 124 178.830 178.830 177.799 1.031 18933 11539 1 16 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.330 -0.179 18933 11540 1 16 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.343 -0.280 18933 11541 1 16 . 1 1 124 124 ILE H H 124 8.453 8.453 8.440 0.013 18933 11542 1 16 . 1 1 125 125 ARG N N 125 121.174 121.174 119.982 1.192 18933 11543 1 16 . 1 1 125 125 ARG C C 125 179.762 179.762 178.651 1.111 18933 11544 1 16 . 1 1 125 125 ARG CA C 125 59.057 59.057 59.064 -0.007 18933 11545 1 16 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.439 -0.489 18933 11546 1 16 . 1 1 125 125 ARG H H 125 7.004 7.004 8.130 -1.126 18933 11547 1 16 . 1 1 126 126 ILE N N 126 122.299 122.299 120.890 1.409 18933 11548 1 16 . 1 1 126 126 ILE C C 126 178.352 178.352 177.703 0.649 18933 11549 1 16 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.641 -2.436 18933 11550 1 16 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.124 -1.709 18933 11551 1 16 . 1 1 126 126 ILE H H 126 7.579 7.579 7.888 -0.309 18933 11552 1 16 . 1 1 127 127 ARG N N 127 119.354 119.354 120.422 -1.068 18933 11553 1 16 . 1 1 127 127 ARG C C 127 179.786 179.786 178.754 1.032 18933 11554 1 16 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.783 0.202 18933 11555 1 16 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.121 -0.791 18933 11556 1 16 . 1 1 127 127 ARG H H 127 8.715 8.715 8.082 0.633 18933 11557 1 16 . 1 1 128 128 ALA N N 128 122.873 122.873 120.597 2.276 18933 11558 1 16 . 1 1 128 128 ALA C C 128 180.325 180.325 179.368 0.957 18933 11559 1 16 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.675 0.065 18933 11560 1 16 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.229 -1.068 18933 11561 1 16 . 1 1 128 128 ALA H H 128 7.978 7.978 8.174 -0.196 18933 11562 1 16 . 1 1 129 129 ALA N N 129 121.846 121.846 121.686 0.160 18933 11563 1 16 . 1 1 129 129 ALA C C 129 181.539 181.539 180.238 1.301 18933 11564 1 16 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.709 -0.211 18933 11565 1 16 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.611 -1.133 18933 11566 1 16 . 1 1 129 129 ALA H H 129 7.519 7.519 7.863 -0.344 18933 11567 1 16 . 1 1 130 130 LEU N N 130 119.134 119.134 118.759 0.375 18933 11568 1 16 . 1 1 130 130 LEU C C 130 179.909 179.909 178.858 1.051 18933 11569 1 16 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.194 -0.195 18933 11570 1 16 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.729 -1.307 18933 11571 1 16 . 1 1 130 130 LEU H H 130 8.296 8.296 8.741 -0.445 18933 11572 1 16 . 1 1 131 131 LYS N N 131 122.299 122.299 119.858 2.441 18933 11573 1 16 . 1 1 131 131 LYS C C 131 180.289 180.289 179.502 0.787 18933 11574 1 16 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.569 -0.552 18933 11575 1 16 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.111 -0.879 18933 11576 1 16 . 1 1 131 131 LYS H H 131 8.281 8.281 7.899 0.382 18933 11577 1 16 . 1 1 132 132 LYS N N 132 118.743 118.743 118.755 -0.012 18933 11578 1 16 . 1 1 132 132 LYS C C 132 177.482 177.482 177.735 -0.253 18933 11579 1 16 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.361 0.131 18933 11580 1 16 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.365 -1.133 18933 11581 1 16 . 1 1 132 132 LYS H H 132 7.317 7.317 7.498 -0.181 18933 11582 1 16 . 1 1 133 133 LYS N N 133 117.093 117.093 117.251 -0.158 18933 11583 1 16 . 1 1 133 133 LYS C C 133 174.614 174.614 176.093 -1.479 18933 11584 1 16 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.852 -1.072 18933 11585 1 16 . 1 1 133 133 LYS CB C 133 32.182 32.182 33.045 -0.863 18933 11586 1 16 . 1 1 133 133 LYS H H 133 7.327 7.327 7.671 -0.344 18933 11587 1 16 . 1 1 134 134 ASN N N 134 113.012 113.012 115.597 -2.585 18933 11588 1 16 . 1 1 134 134 ASN C C 134 173.965 173.965 173.456 0.509 18933 11589 1 16 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.454 -0.158 18933 11590 1 16 . 1 1 134 134 ASN CB C 134 36.175 36.175 36.944 -0.769 18933 11591 1 16 . 1 1 134 134 ASN H H 134 7.938 7.938 7.830 0.108 18933 11592 1 16 . 1 1 135 135 TYR N N 135 115.725 115.725 119.151 -3.426 18933 11593 1 16 . 1 1 135 135 TYR C C 135 176.342 176.342 175.089 1.253 18933 11594 1 16 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.914 -2.246 18933 11595 1 16 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.115 1.448 18933 11596 1 16 . 1 1 135 135 TYR H H 135 7.741 7.741 8.432 -0.691 18933 11597 1 16 . 1 1 136 136 LYS N N 136 122.641 122.641 124.461 -1.820 18933 11598 1 16 . 1 1 136 136 LYS C C 136 173.475 173.475 174.571 -1.096 18933 11599 1 16 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.647 0.255 18933 11600 1 16 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.654 -1.936 18933 11601 1 16 . 1 1 136 136 LYS H H 136 9.296 9.296 8.825 0.471 18933 11602 1 16 . 1 1 137 137 LEU N N 137 127.284 127.284 123.099 4.185 18933 11603 1 16 . 1 1 137 137 LEU C C 137 175.423 175.423 176.502 -1.079 18933 11604 1 16 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.145 -0.019 18933 11605 1 16 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.196 3.550 18933 11606 1 16 . 1 1 137 137 LEU H H 137 8.776 8.776 8.461 0.315 18933 11607 1 16 . 1 1 138 138 ASN N N 138 125.818 125.818 119.613 6.205 18933 11608 1 16 . 1 1 138 138 ASN C C 138 174.933 174.933 175.374 -0.441 18933 11609 1 16 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.079 0.038 18933 11610 1 16 . 1 1 138 138 ASN CB C 138 37.506 37.506 41.704 -4.198 18933 11611 1 16 . 1 1 138 138 ASN H H 138 8.811 8.811 8.244 0.567 18933 11612 1 16 . 1 1 139 139 GLN N N 139 116.861 116.861 119.308 -2.447 18933 11613 1 16 . 1 1 139 139 GLN CA C 139 56.838 56.838 57.981 -1.143 18933 11614 1 16 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.500 -2.783 18933 11615 1 16 . 1 1 139 139 GLN H H 139 9.220 9.220 8.821 0.399 18933 11616 1 16 . 1 1 140 140 TYR N N 140 120.600 120.600 117.669 2.931 18933 11617 1 16 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.307 -0.550 18933 11618 1 16 . 1 1 140 140 TYR CB C 140 37.570 37.570 37.768 -0.198 18933 11619 1 16 . 1 1 140 140 TYR H H 140 8.549 8.549 7.655 0.894 18933 11620 1 16 . 1 1 141 141 GLY N N 141 105.986 105.986 107.819 -1.833 18933 11621 1 16 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.375 -0.531 18933 11622 1 16 . 1 1 141 141 GLY H H 141 7.186 7.186 7.878 -0.692 18933 11623 1 16 . 1 1 142 142 LEU N N 142 120.038 120.038 116.500 3.538 18933 11624 1 16 . 1 1 142 142 LEU C C 142 173.340 173.340 175.894 -2.554 18933 11625 1 16 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.256 -0.736 18933 11626 1 16 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.462 0.889 18933 11627 1 16 . 1 1 142 142 LEU H H 142 7.539 7.539 8.366 -0.827 18933 11628 1 16 . 1 1 143 143 PHE N N 143 124.229 124.229 119.078 5.151 18933 11629 1 16 . 1 1 143 143 PHE C C 143 173.977 173.977 175.104 -1.127 18933 11630 1 16 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.351 -2.710 18933 11631 1 16 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.534 4.134 18933 11632 1 16 . 1 1 143 143 PHE H H 143 9.084 9.084 9.009 0.075 18933 11633 1 16 . 1 1 144 144 LYS N N 144 127.858 127.858 123.175 4.683 18933 11634 1 16 . 1 1 144 144 LYS C C 144 175.092 175.092 176.743 -1.651 18933 11635 1 16 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.199 4.657 18933 11636 1 16 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.794 3.791 18933 11637 1 16 . 1 1 144 144 LYS H H 144 9.281 9.281 8.928 0.353 18933 11638 1 16 . 1 1 145 145 ASN N N 145 128.188 128.188 125.276 2.912 18933 11639 1 16 . 1 1 145 145 ASN C C 145 175.779 175.779 175.073 0.706 18933 11640 1 16 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.502 3.224 18933 11641 1 16 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.852 -3.198 18933 11642 1 16 . 1 1 145 145 ASN H H 145 9.205 9.205 9.287 -0.082 18933 11643 1 16 . 1 1 146 146 GLN N N 146 129.655 129.655 113.408 16.247 18933 11644 1 16 . 1 1 146 146 GLN C C 146 175.399 175.399 174.259 1.140 18933 11645 1 16 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.144 1.671 18933 11646 1 16 . 1 1 146 146 GLN CB C 146 32.626 32.626 28.236 4.390 18933 11647 1 16 . 1 1 146 146 GLN H H 146 8.983 8.983 8.699 0.284 18933 11648 1 16 . 1 1 147 147 THR N N 147 117.936 117.936 115.842 2.094 18933 11649 1 16 . 1 1 147 147 THR C C 147 173.254 173.254 173.388 -0.134 18933 11650 1 16 . 1 1 147 147 THR CA C 147 61.721 61.721 61.534 0.187 18933 11651 1 16 . 1 1 147 147 THR CB C 147 70.274 70.274 69.634 0.640 18933 11652 1 16 . 1 1 147 147 THR H H 147 8.029 8.029 7.838 0.191 18933 11653 1 16 . 1 1 148 148 LEU N N 148 130.681 130.681 130.974 -0.293 18933 11654 1 16 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.420 0.046 18933 11655 1 16 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.813 -1.124 18933 11656 1 16 . 1 1 148 148 LEU H H 148 8.635 8.635 8.848 -0.213 18933 11657 1 16 . 1 1 149 149 VAL N N 149 130.803 130.803 128.310 2.493 18933 11658 1 16 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.176 1.002 18933 11659 1 16 . 1 1 149 149 VAL CB C 149 31.675 31.675 35.812 -4.137 18933 11660 1 16 . 1 1 149 149 VAL H H 149 8.968 8.968 9.318 -0.350 18933 11661 1 16 . 1 1 151 151 LEU N N 151 124.290 124.290 121.608 2.682 18933 11662 1 16 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.569 -2.556 18933 11663 1 16 . 1 1 151 151 LEU CB C 151 44.098 44.098 40.785 3.313 18933 11664 1 16 . 1 1 151 151 LEU H H 151 7.872 7.872 8.306 -0.434 18933 11665 1 16 . 1 1 153 153 ILE N N 153 114.943 114.943 113.746 1.197 18933 11666 1 16 . 1 1 153 153 ILE C C 153 175.877 175.877 174.482 1.395 18933 11667 1 16 . 1 1 153 153 ILE CA C 153 58.694 58.694 59.099 -0.405 18933 11668 1 16 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.002 1.687 18933 11669 1 16 . 1 1 153 153 ILE H H 153 7.125 7.125 7.740 -0.615 18933 11670 1 16 . 1 1 154 154 THR N N 154 111.766 111.766 112.708 -0.942 18933 11671 1 16 . 1 1 154 154 THR C C 154 174.945 174.945 173.791 1.154 18933 11672 1 16 . 1 1 154 154 THR CA C 154 62.124 62.124 61.520 0.604 18933 11673 1 16 . 1 1 154 154 THR CB C 154 70.718 70.718 69.586 1.132 18933 11674 1 16 . 1 1 154 154 THR H H 154 9.286 9.286 8.281 1.005 18933 11675 1 16 . 1 1 155 155 THR N N 155 111.766 111.766 112.699 -0.933 18933 11676 1 16 . 1 1 155 155 THR CA C 155 58.936 58.936 60.395 -1.459 18933 11677 1 16 . 1 1 155 155 THR CB C 155 72.683 72.683 71.868 0.815 18933 11678 1 16 . 1 1 155 155 THR H H 155 7.645 7.645 7.427 0.218 18933 11679 1 16 . 1 1 157 157 LYS N N 157 119.464 119.464 118.957 0.507 18933 11680 1 16 . 1 1 157 157 LYS C C 157 178.781 178.781 178.479 0.302 18933 11681 1 16 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.943 0.083 18933 11682 1 16 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.741 -0.320 18933 11683 1 16 . 1 1 157 157 LYS H H 157 8.175 8.175 8.299 -0.124 18933 11684 1 16 . 1 1 158 158 GLU N N 158 118.340 118.340 117.672 0.668 18933 11685 1 16 . 1 1 158 158 GLU C C 158 178.867 178.867 178.813 0.054 18933 11686 1 16 . 1 1 158 158 GLU CA C 158 58.492 58.492 59.012 -0.520 18933 11687 1 16 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.654 0.676 18933 11688 1 16 . 1 1 158 158 GLU H H 158 7.519 7.519 8.343 -0.824 18933 11689 1 16 . 1 1 159 159 LEU N N 159 120.710 120.710 120.754 -0.044 18933 11690 1 16 . 1 1 159 159 LEU C C 159 176.526 176.526 178.382 -1.856 18933 11691 1 16 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.428 -0.258 18933 11692 1 16 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.536 -1.621 18933 11693 1 16 . 1 1 159 159 LEU H H 159 7.524 7.524 7.896 -0.372 18933 11694 1 16 . 1 1 160 160 ILE N N 160 118.217 118.217 119.000 -0.783 18933 11695 1 16 . 1 1 160 160 ILE C C 160 177.213 177.213 178.127 -0.914 18933 11696 1 16 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.373 -0.343 18933 11697 1 16 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.169 0.337 18933 11698 1 16 . 1 1 160 160 ILE H H 160 7.741 7.741 7.866 -0.125 18933 11699 1 16 . 1 1 161 161 LYS N N 161 118.450 118.450 120.109 -1.659 18933 11700 1 16 . 1 1 161 161 LYS C C 161 180.999 180.999 179.816 1.183 18933 11701 1 16 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.550 -0.735 18933 11702 1 16 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.158 -1.180 18933 11703 1 16 . 1 1 161 161 LYS H H 161 7.382 7.382 8.022 -0.640 18933 11704 1 16 . 1 1 162 162 GLU N N 162 121.846 121.846 120.402 1.444 18933 11705 1 16 . 1 1 162 162 GLU C C 162 178.818 178.818 178.506 0.312 18933 11706 1 16 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.530 -0.481 18933 11707 1 16 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.294 -1.358 18933 11708 1 16 . 1 1 162 162 GLU H H 162 8.210 8.210 7.824 0.386 18933 11709 1 16 . 1 1 163 163 LEU N N 163 116.751 116.751 116.121 0.630 18933 11710 1 16 . 1 1 163 163 LEU C C 163 176.784 176.784 177.468 -0.684 18933 11711 1 16 . 1 1 163 163 LEU CA C 163 55.022 55.022 54.913 0.109 18933 11712 1 16 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.851 -0.542 18933 11713 1 16 . 1 1 163 163 LEU H H 163 7.796 7.796 7.418 0.378 18933 11714 1 16 . 1 1 164 164 GLY N N 164 104.849 104.849 105.660 -0.811 18933 11715 1 16 . 1 1 164 164 GLY C C 164 174.492 174.492 173.946 0.546 18933 11716 1 16 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.365 -0.633 18933 11717 1 16 . 1 1 164 164 GLY H H 164 7.589 7.589 7.568 0.021 18933 11718 1 16 . 1 1 165 165 PHE N N 165 118.902 118.902 118.753 0.149 18933 11719 1 16 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.410 -0.742 18933 11720 1 16 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.119 -1.634 18933 11721 1 16 . 1 1 165 165 PHE H H 165 7.251 7.251 7.592 -0.341 18933 11722 1 16 . 1 1 166 166 THR N N 166 117.093 117.093 117.459 -0.366 18933 11723 1 16 . 1 1 166 166 THR CA C 166 62.245 62.245 61.454 0.791 18933 11724 1 16 . 1 1 166 166 THR CB C 166 69.323 69.323 69.183 0.140 18933 11725 1 16 . 1 1 166 166 THR H H 166 8.407 8.407 8.197 0.210 18933 11726 1 16 . 1 1 168 168 ARG N N 168 127.431 127.431 121.616 5.815 18933 11727 1 16 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.356 -2.118 18933 11728 1 16 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.681 -1.689 18933 11729 1 16 . 1 1 168 168 ARG H H 168 7.160 7.160 8.428 -1.268 18933 11730 1 16 . 1 1 171 171 LYS N N 171 113.574 113.574 117.008 -3.434 18933 11731 1 16 . 1 1 171 171 LYS C C 171 176.416 176.416 176.962 -0.546 18933 11732 1 16 . 1 1 171 171 LYS CA C 171 57.605 57.605 58.431 -0.826 18933 11733 1 16 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.484 0.445 18933 11734 1 16 . 1 1 171 171 LYS H H 171 8.210 8.210 8.226 -0.016 18933 11735 1 16 . 1 1 172 172 LYS N N 172 117.313 117.313 117.124 0.189 18933 11736 1 16 . 1 1 172 172 LYS C C 172 175.717 175.717 176.008 -0.291 18933 11737 1 16 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.214 -2.039 18933 11738 1 16 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.942 -1.330 18933 11739 1 16 . 1 1 172 172 LYS H H 172 7.761 7.761 7.554 0.207 18933 11740 1 16 . 1 1 173 173 ARG N N 173 122.056 122.056 118.024 4.032 18933 11741 1 16 . 1 1 173 173 ARG C C 173 172.850 172.850 175.523 -2.673 18933 11742 1 16 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.552 0.326 18933 11743 1 16 . 1 1 173 173 ARG CB C 173 28.506 28.506 27.835 0.671 18933 11744 1 16 . 1 1 173 173 ARG H H 173 6.885 6.885 7.598 -0.713 18933 11745 1 17 . 1 1 2 2 LEU N N 2 122.812 122.812 125.497 -2.685 18933 11746 1 17 . 1 1 2 2 LEU C C 2 175.742 175.742 176.273 -0.531 18933 11747 1 17 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.661 0.473 18933 11748 1 17 . 1 1 2 2 LEU CB C 2 42.842 42.842 44.998 -2.156 18933 11749 1 17 . 1 1 2 2 LEU H H 2 8.756 8.756 8.630 0.126 18933 11750 1 17 . 1 1 3 3 THR N N 3 113.000 113.000 113.914 -0.914 18933 11751 1 17 . 1 1 3 3 THR C C 3 175.938 175.938 175.213 0.725 18933 11752 1 17 . 1 1 3 3 THR CA C 3 60.550 60.550 60.628 -0.078 18933 11753 1 17 . 1 1 3 3 THR CB C 3 70.781 70.781 70.477 0.304 18933 11754 1 17 . 1 1 3 3 THR H H 3 8.428 8.428 8.153 0.275 18933 11755 1 17 . 1 1 4 4 LEU N N 4 122.531 122.531 123.263 -0.732 18933 11756 1 17 . 1 1 4 4 LEU C C 4 178.463 178.463 178.579 -0.116 18933 11757 1 17 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.522 -0.393 18933 11758 1 17 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.024 -2.490 18933 11759 1 17 . 1 1 4 4 LEU H H 4 7.731 7.731 7.909 -0.178 18933 11760 1 17 . 1 1 5 5 ILE N N 5 115.505 115.505 117.694 -2.189 18933 11761 1 17 . 1 1 5 5 ILE C C 5 178.573 178.573 177.852 0.721 18933 11762 1 17 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.373 -0.635 18933 11763 1 17 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.312 -0.440 18933 11764 1 17 . 1 1 5 5 ILE H H 5 7.645 7.645 7.993 -0.348 18933 11765 1 17 . 1 1 6 6 GLN N N 6 121.626 121.626 119.450 2.176 18933 11766 1 17 . 1 1 6 6 GLN C C 6 179.014 179.014 178.743 0.271 18933 11767 1 17 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.169 -0.838 18933 11768 1 17 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.638 0.551 18933 11769 1 17 . 1 1 6 6 GLN H H 6 7.645 7.645 8.017 -0.372 18933 11770 1 17 . 1 1 7 7 GLY N N 7 107.684 107.684 106.875 0.809 18933 11771 1 17 . 1 1 7 7 GLY C C 7 174.749 174.749 176.184 -1.435 18933 11772 1 17 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.822 -0.032 18933 11773 1 17 . 1 1 7 7 GLY H H 7 8.660 8.660 8.124 0.536 18933 11774 1 17 . 1 1 8 8 LYS N N 8 120.942 120.942 122.416 -1.474 18933 11775 1 17 . 1 1 8 8 LYS C C 8 179.455 179.455 178.745 0.710 18933 11776 1 17 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.135 0.770 18933 11777 1 17 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.264 -0.842 18933 11778 1 17 . 1 1 8 8 LYS H H 8 8.518 8.518 7.643 0.875 18933 11779 1 17 . 1 1 9 9 LYS N N 9 120.710 120.710 119.820 0.890 18933 11780 1 17 . 1 1 9 9 LYS C C 9 179.823 179.823 179.288 0.535 18933 11781 1 17 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.672 -0.050 18933 11782 1 17 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.478 -1.183 18933 11783 1 17 . 1 1 9 9 LYS H H 9 7.731 7.731 8.158 -0.427 18933 11784 1 17 . 1 1 10 10 ILE N N 10 121.345 121.345 121.192 0.153 18933 11785 1 17 . 1 1 10 10 ILE C C 10 177.789 177.789 178.118 -0.329 18933 11786 1 17 . 1 1 10 10 ILE CA C 10 64.465 64.465 66.056 -1.591 18933 11787 1 17 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.308 -1.943 18933 11788 1 17 . 1 1 10 10 ILE H H 10 7.711 7.711 8.385 -0.674 18933 11789 1 17 . 1 1 11 11 VAL N N 11 120.258 120.258 119.919 0.339 18933 11790 1 17 . 1 1 11 11 VAL C C 11 177.372 177.372 177.544 -0.172 18933 11791 1 17 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.488 -0.037 18933 11792 1 17 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.610 -1.076 18933 11793 1 17 . 1 1 11 11 VAL H H 11 7.918 7.918 8.482 -0.564 18933 11794 1 17 . 1 1 12 12 ASN N N 12 116.971 116.971 117.908 -0.937 18933 11795 1 17 . 1 1 12 12 ASN C C 12 177.445 177.445 177.323 0.122 18933 11796 1 17 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.900 -0.788 18933 11797 1 17 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.583 -0.950 18933 11798 1 17 . 1 1 12 12 ASN H H 12 7.993 7.993 8.360 -0.367 18933 11799 1 17 . 1 1 13 13 HIS N N 13 120.258 120.258 120.144 0.114 18933 11800 1 17 . 1 1 13 13 HIS C C 13 177.862 177.862 178.387 -0.525 18933 11801 1 17 . 1 1 13 13 HIS CA C 13 59.098 59.098 58.325 0.773 18933 11802 1 17 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.563 0.669 18933 11803 1 17 . 1 1 13 13 HIS H H 13 7.741 7.741 8.311 -0.570 18933 11804 1 17 . 1 1 14 14 LEU N N 14 116.641 116.641 120.200 -3.559 18933 11805 1 17 . 1 1 14 14 LEU C C 14 179.186 179.186 178.155 1.031 18933 11806 1 17 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.319 -1.562 18933 11807 1 17 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.646 -0.527 18933 11808 1 17 . 1 1 14 14 LEU H H 14 8.221 8.221 8.520 -0.299 18933 11809 1 17 . 1 1 15 15 ARG N N 15 115.957 115.957 114.738 1.219 18933 11810 1 17 . 1 1 15 15 ARG C C 15 176.330 176.330 178.353 -2.023 18933 11811 1 17 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.393 1.310 18933 11812 1 17 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.321 -1.244 18933 11813 1 17 . 1 1 15 15 ARG H H 15 7.968 7.968 8.407 -0.439 18933 11814 1 17 . 1 1 16 16 SER N N 16 109.395 109.395 116.587 -7.192 18933 11815 1 17 . 1 1 16 16 SER C C 16 176.024 176.024 175.084 0.940 18933 11816 1 17 . 1 1 16 16 SER CA C 16 57.282 57.282 60.390 -3.108 18933 11817 1 17 . 1 1 16 16 SER CB C 16 63.683 63.683 63.883 -0.200 18933 11818 1 17 . 1 1 16 16 SER H H 16 6.963 6.963 7.665 -0.702 18933 11819 1 17 . 1 1 17 17 ARG N N 17 122.775 122.775 121.598 1.177 18933 11820 1 17 . 1 1 17 17 ARG C C 17 174.590 174.590 173.955 0.635 18933 11821 1 17 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.950 1.323 18933 11822 1 17 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.400 1.402 18933 11823 1 17 . 1 1 17 17 ARG H H 17 7.781 7.781 8.286 -0.505 18933 11824 1 17 . 1 1 18 18 LEU N N 18 122.421 122.421 125.677 -3.256 18933 11825 1 17 . 1 1 18 18 LEU C C 18 176.281 176.281 174.154 2.127 18933 11826 1 17 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.126 0.654 18933 11827 1 17 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.498 -3.288 18933 11828 1 17 . 1 1 18 18 LEU H H 18 8.650 8.650 7.793 0.857 18933 11829 1 17 . 1 1 19 19 ALA N N 19 126.441 126.441 127.079 -0.638 18933 11830 1 17 . 1 1 19 19 ALA C C 19 173.904 173.904 174.835 -0.931 18933 11831 1 17 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.633 -0.766 18933 11832 1 17 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.491 0.374 18933 11833 1 17 . 1 1 19 19 ALA H H 19 8.609 8.609 8.961 -0.352 18933 11834 1 17 . 1 1 20 20 PHE N N 20 114.600 114.600 118.929 -4.329 18933 11835 1 17 . 1 1 20 20 PHE C C 20 172.592 172.592 173.767 -1.175 18933 11836 1 17 . 1 1 20 20 PHE CA C 20 55.789 55.789 55.050 0.739 18933 11837 1 17 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.642 -0.952 18933 11838 1 17 . 1 1 20 20 PHE H H 20 8.801 8.801 9.038 -0.237 18933 11839 1 17 . 1 1 21 21 GLU N N 21 122.873 122.873 123.100 -0.227 18933 11840 1 17 . 1 1 21 21 GLU C C 21 174.872 174.872 175.142 -0.270 18933 11841 1 17 . 1 1 21 21 GLU CA C 21 55.062 55.062 55.011 0.051 18933 11842 1 17 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.326 -0.601 18933 11843 1 17 . 1 1 21 21 GLU H H 21 7.847 7.847 9.146 -1.299 18933 11844 1 17 . 1 1 22 22 TYR N N 22 126.270 126.270 126.015 0.255 18933 11845 1 17 . 1 1 22 22 TYR C C 22 174.872 174.872 174.757 0.115 18933 11846 1 17 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.266 -0.518 18933 11847 1 17 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.196 -1.091 18933 11848 1 17 . 1 1 22 22 TYR H H 22 8.806 8.806 9.113 -0.307 18933 11849 1 17 . 1 1 23 23 ASN N N 23 128.420 128.420 126.047 2.373 18933 11850 1 17 . 1 1 23 23 ASN C C 23 175.435 175.435 175.049 0.386 18933 11851 1 17 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.679 -0.674 18933 11852 1 17 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.685 -1.321 18933 11853 1 17 . 1 1 23 23 ASN H H 23 8.943 8.943 9.156 -0.213 18933 11854 1 17 . 1 1 24 24 GLY N N 24 104.067 104.067 103.636 0.431 18933 11855 1 17 . 1 1 24 24 GLY C C 24 173.707 173.707 173.677 0.030 18933 11856 1 17 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.892 0.042 18933 11857 1 17 . 1 1 24 24 GLY H H 24 8.534 8.534 8.215 0.319 18933 11858 1 17 . 1 1 25 25 GLN N N 25 120.038 120.038 119.888 0.150 18933 11859 1 17 . 1 1 25 25 GLN C C 25 173.744 173.744 174.807 -1.063 18933 11860 1 17 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.476 -1.149 18933 11861 1 17 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.233 0.428 18933 11862 1 17 . 1 1 25 25 GLN H H 25 7.595 7.595 7.897 -0.302 18933 11863 1 17 . 1 1 26 26 LEU N N 26 124.681 124.681 124.878 -0.197 18933 11864 1 17 . 1 1 26 26 LEU C C 26 175.987 175.987 176.222 -0.235 18933 11865 1 17 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.490 -0.477 18933 11866 1 17 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.456 -1.591 18933 11867 1 17 . 1 1 26 26 LEU H H 26 8.382 8.382 8.571 -0.189 18933 11868 1 17 . 1 1 27 27 ILE N N 27 130.779 130.779 127.336 3.443 18933 11869 1 17 . 1 1 27 27 ILE C C 27 175.215 175.215 174.284 0.931 18933 11870 1 17 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.646 -0.387 18933 11871 1 17 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.097 -2.365 18933 11872 1 17 . 1 1 27 27 ILE H H 27 8.882 8.882 8.933 -0.051 18933 11873 1 17 . 1 1 28 28 LYS N N 28 126.160 126.160 127.506 -1.346 18933 11874 1 17 . 1 1 28 28 LYS C C 28 176.771 176.771 175.615 1.156 18933 11875 1 17 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.839 1.999 18933 11876 1 17 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.194 -1.455 18933 11877 1 17 . 1 1 28 28 LYS H H 28 8.165 8.165 8.334 -0.169 18933 11878 1 17 . 1 1 29 29 ILE N N 29 126.380 126.380 121.856 4.524 18933 11879 1 17 . 1 1 29 29 ILE C C 29 175.877 175.877 174.310 1.567 18933 11880 1 17 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.511 -0.203 18933 11881 1 17 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.630 -2.567 18933 11882 1 17 . 1 1 29 29 ILE H H 29 8.019 8.019 8.650 -0.631 18933 11883 1 17 . 1 1 30 30 LEU N N 30 129.215 129.215 122.327 6.888 18933 11884 1 17 . 1 1 30 30 LEU C C 30 178.867 178.867 178.114 0.753 18933 11885 1 17 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.255 1.364 18933 11886 1 17 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.631 -4.766 18933 11887 1 17 . 1 1 30 30 LEU H H 30 8.917 8.917 8.330 0.587 18933 11888 1 17 . 1 1 31 31 SER N N 31 117.997 117.997 116.136 1.861 18933 11889 1 17 . 1 1 31 31 SER C C 31 177.396 177.396 175.699 1.697 18933 11890 1 17 . 1 1 31 31 SER CA C 31 61.236 61.236 60.931 0.305 18933 11891 1 17 . 1 1 31 31 SER CB C 31 62.035 62.035 63.210 -1.175 18933 11892 1 17 . 1 1 31 31 SER H H 31 8.594 8.594 8.881 -0.287 18933 11893 1 17 . 1 1 32 32 LYS N N 32 116.189 116.189 118.954 -2.765 18933 11894 1 17 . 1 1 32 32 LYS C C 32 176.244 176.244 177.058 -0.814 18933 11895 1 17 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.295 -0.892 18933 11896 1 17 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.358 -2.077 18933 11897 1 17 . 1 1 32 32 LYS H H 32 8.029 8.029 8.251 -0.222 18933 11898 1 17 . 1 1 33 33 ASN N N 33 119.061 119.061 115.546 3.515 18933 11899 1 17 . 1 1 33 33 ASN C C 33 172.384 172.384 174.353 -1.969 18933 11900 1 17 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.330 -1.173 18933 11901 1 17 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.254 -2.987 18933 11902 1 17 . 1 1 33 33 ASN H H 33 7.902 7.902 7.813 0.089 18933 11903 1 17 . 1 1 34 34 ILE N N 34 120.038 120.038 120.250 -0.212 18933 11904 1 17 . 1 1 34 34 ILE C C 34 175.607 175.607 174.277 1.330 18933 11905 1 17 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.226 0.324 18933 11906 1 17 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.469 -2.505 18933 11907 1 17 . 1 1 34 34 ILE H H 34 7.443 7.443 7.982 -0.539 18933 11908 1 17 . 1 1 35 35 VAL N N 35 129.435 129.435 126.413 3.022 18933 11909 1 17 . 1 1 35 35 VAL C C 35 175.386 175.386 174.642 0.744 18933 11910 1 17 . 1 1 35 35 VAL CA C 35 60.026 60.026 59.737 0.289 18933 11911 1 17 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.623 -0.842 18933 11912 1 17 . 1 1 35 35 VAL H H 35 9.533 9.533 8.820 0.713 18933 11913 1 17 . 1 1 36 36 ALA N N 36 130.571 130.571 129.029 1.542 18933 11914 1 17 . 1 1 36 36 ALA C C 36 177.347 177.347 176.235 1.112 18933 11915 1 17 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.616 0.783 18933 11916 1 17 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.828 -0.970 18933 11917 1 17 . 1 1 36 36 ALA H H 36 8.665 8.665 8.376 0.289 18933 11918 1 17 . 1 1 37 37 VAL N N 37 115.395 115.395 119.591 -4.196 18933 11919 1 17 . 1 1 37 37 VAL C C 37 174.455 174.455 176.327 -1.872 18933 11920 1 17 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.235 0.145 18933 11921 1 17 . 1 1 37 37 VAL CB C 37 32.943 32.943 34.502 -1.559 18933 11922 1 17 . 1 1 37 37 VAL H H 37 8.079 8.079 8.323 -0.244 18933 11923 1 17 . 1 1 38 38 GLY N N 38 107.672 107.672 107.954 -0.282 18933 11924 1 17 . 1 1 38 38 GLY C C 38 173.364 173.364 175.763 -2.399 18933 11925 1 17 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.265 -0.080 18933 11926 1 17 . 1 1 38 38 GLY H H 38 7.579 7.579 8.104 -0.525 18933 11927 1 17 . 1 1 39 39 SER N N 39 121.052 121.052 119.492 1.560 18933 11928 1 17 . 1 1 39 39 SER C C 39 175.570 175.570 176.723 -1.153 18933 11929 1 17 . 1 1 39 39 SER CA C 39 61.801 61.801 61.921 -0.120 18933 11930 1 17 . 1 1 39 39 SER CB C 39 62.478 62.478 63.197 -0.719 18933 11931 1 17 . 1 1 39 39 SER H H 39 8.953 8.953 8.038 0.915 18933 11932 1 17 . 1 1 40 40 LEU N N 40 121.553 121.553 121.735 -0.182 18933 11933 1 17 . 1 1 40 40 LEU C C 40 180.203 180.203 178.377 1.826 18933 11934 1 17 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.504 -0.374 18933 11935 1 17 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.851 -0.098 18933 11936 1 17 . 1 1 40 40 LEU H H 40 8.195 8.195 7.300 0.895 18933 11937 1 17 . 1 1 41 41 ARG N N 41 121.956 121.956 117.831 4.125 18933 11938 1 17 . 1 1 41 41 ARG C C 41 177.323 177.323 177.925 -0.602 18933 11939 1 17 . 1 1 41 41 ARG CA C 41 58.331 58.331 58.271 0.060 18933 11940 1 17 . 1 1 41 41 ARG CB C 41 28.443 28.443 30.163 -1.720 18933 11941 1 17 . 1 1 41 41 ARG H H 41 6.873 6.873 7.377 -0.504 18933 11942 1 17 . 1 1 42 42 ARG N N 42 114.600 114.600 116.528 -1.928 18933 11943 1 17 . 1 1 42 42 ARG C C 42 172.911 172.911 175.760 -2.849 18933 11944 1 17 . 1 1 42 42 ARG CA C 42 57.242 57.242 56.873 0.369 18933 11945 1 17 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.903 -1.763 18933 11946 1 17 . 1 1 42 42 ARG H H 42 7.438 7.438 8.030 -0.592 18933 11947 1 17 . 1 1 43 43 GLU N N 43 113.354 113.354 117.442 -4.088 18933 11948 1 17 . 1 1 43 43 GLU C C 43 175.999 175.999 175.689 0.310 18933 11949 1 17 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.244 -0.688 18933 11950 1 17 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.398 -2.061 18933 11951 1 17 . 1 1 43 43 GLU H H 43 7.564 7.564 7.968 -0.404 18933 11952 1 17 . 1 1 44 44 GLU N N 44 119.696 119.696 123.779 -4.083 18933 11953 1 17 . 1 1 44 44 GLU C C 44 175.423 175.423 176.354 -0.931 18933 11954 1 17 . 1 1 44 44 GLU CA C 44 56.838 56.838 57.981 -1.143 18933 11955 1 17 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.268 -1.572 18933 11956 1 17 . 1 1 44 44 GLU H H 44 7.261 7.261 8.695 -1.434 18933 11957 1 17 . 1 1 45 45 LYS N N 45 117.435 117.435 117.095 0.340 18933 11958 1 17 . 1 1 45 45 LYS C C 45 177.715 177.715 176.176 1.539 18933 11959 1 17 . 1 1 45 45 LYS CA C 45 59.219 59.219 56.877 2.342 18933 11960 1 17 . 1 1 45 45 LYS CB C 45 32.119 32.119 34.606 -2.487 18933 11961 1 17 . 1 1 45 45 LYS H H 45 7.938 7.938 8.184 -0.246 18933 11962 1 17 . 1 1 46 46 MET N N 46 115.847 115.847 118.053 -2.206 18933 11963 1 17 . 1 1 46 46 MET CA C 46 52.520 52.520 54.220 -1.700 18933 11964 1 17 . 1 1 46 46 MET CB C 46 33.450 33.450 35.744 -2.294 18933 11965 1 17 . 1 1 46 46 MET H H 46 7.595 7.595 8.634 -1.039 18933 11966 1 17 . 1 1 47 47 LEU N N 47 121.627 121.627 122.190 -0.563 18933 11967 1 17 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.206 -1.080 18933 11968 1 17 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.171 -0.101 18933 11969 1 17 . 1 1 47 47 LEU H H 47 9.220 9.220 8.876 0.344 18933 11970 1 17 . 1 1 49 49 ASP N N 49 117.093 117.093 116.980 0.113 18933 11971 1 17 . 1 1 49 49 ASP C C 49 173.340 173.340 174.323 -0.983 18933 11972 1 17 . 1 1 49 49 ASP CA C 49 51.794 51.794 52.922 -1.129 18933 11973 1 17 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.373 -1.367 18933 11974 1 17 . 1 1 49 49 ASP H H 49 7.761 7.761 7.547 0.214 18933 11975 1 17 . 1 1 50 50 VAL N N 50 119.012 119.012 116.213 2.799 18933 11976 1 17 . 1 1 50 50 VAL C C 50 173.070 173.070 173.866 -0.796 18933 11977 1 17 . 1 1 50 50 VAL CA C 50 61.842 61.842 59.825 2.017 18933 11978 1 17 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.234 -0.671 18933 11979 1 17 . 1 1 50 50 VAL H H 50 8.089 8.089 8.269 -0.180 18933 11980 1 17 . 1 1 51 51 ASP N N 51 127.064 127.064 125.472 1.592 18933 11981 1 17 . 1 1 51 51 ASP C C 51 174.565 174.565 175.349 -0.784 18933 11982 1 17 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.924 -0.767 18933 11983 1 17 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.239 -0.599 18933 11984 1 17 . 1 1 51 51 ASP H H 51 8.069 8.069 8.010 0.059 18933 11985 1 17 . 1 1 52 52 LEU N N 52 121.627 121.627 120.166 1.461 18933 11986 1 17 . 1 1 52 52 LEU C C 52 174.063 174.063 174.784 -0.721 18933 11987 1 17 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.423 -0.741 18933 11988 1 17 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.230 -2.879 18933 11989 1 17 . 1 1 52 52 LEU H H 52 8.852 8.852 9.056 -0.204 18933 11990 1 17 . 1 1 53 53 LEU N N 53 123.093 123.093 122.720 0.373 18933 11991 1 17 . 1 1 53 53 LEU CA C 53 55.991 55.991 53.928 2.063 18933 11992 1 17 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.406 -2.272 18933 11993 1 17 . 1 1 53 53 LEU H H 53 9.362 9.362 9.047 0.315 18933 11994 1 17 . 1 1 54 54 ILE N N 54 123.777 123.777 128.710 -4.933 18933 11995 1 17 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.106 -4.044 18933 11996 1 17 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.106 -7.036 18933 11997 1 17 . 1 1 54 54 ILE H H 54 8.907 8.907 9.289 -0.382 18933 11998 1 17 . 1 1 58 58 GLU N N 58 114.710 114.710 117.191 -2.481 18933 11999 1 17 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.250 -0.873 18933 12000 1 17 . 1 1 58 58 GLU CB C 58 31.422 31.422 33.091 -1.669 18933 12001 1 17 . 1 1 58 58 GLU H H 58 6.716 6.716 7.483 -0.767 18933 12002 1 17 . 1 1 61 61 LEU N N 61 115.957 115.957 120.522 -4.565 18933 12003 1 17 . 1 1 61 61 LEU C C 61 178.512 178.512 178.350 0.162 18933 12004 1 17 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.340 -2.560 18933 12005 1 17 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.666 -0.547 18933 12006 1 17 . 1 1 61 61 LEU H H 61 7.307 7.307 8.007 -0.700 18933 12007 1 17 . 1 1 62 62 LEU N N 62 120.038 120.038 119.444 0.594 18933 12008 1 17 . 1 1 62 62 LEU C C 62 177.874 177.874 178.757 -0.883 18933 12009 1 17 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.557 0.379 18933 12010 1 17 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.931 -1.192 18933 12011 1 17 . 1 1 62 62 LEU H H 62 7.327 7.327 8.182 -0.855 18933 12012 1 17 . 1 1 63 63 LYS N N 63 114.600 114.600 116.189 -1.589 18933 12013 1 17 . 1 1 63 63 LYS C C 63 175.460 175.460 177.801 -2.341 18933 12014 1 17 . 1 1 63 63 LYS CA C 63 57.564 57.564 59.026 -1.462 18933 12015 1 17 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.442 -1.717 18933 12016 1 17 . 1 1 63 63 LYS H H 63 7.973 7.973 7.756 0.217 18933 12017 1 17 . 1 1 64 64 HIS N N 64 115.273 115.273 115.600 -0.327 18933 12018 1 17 . 1 1 64 64 HIS CA C 64 56.112 56.112 54.630 1.482 18933 12019 1 17 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.247 2.189 18933 12020 1 17 . 1 1 64 64 HIS H H 64 7.544 7.544 7.478 0.066 18933 12021 1 17 . 1 1 65 65 VAL N N 65 118.682 118.682 118.715 -0.033 18933 12022 1 17 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.913 3.125 18933 12023 1 17 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.436 -2.409 18933 12024 1 17 . 1 1 65 65 VAL H H 65 6.787 6.787 7.243 -0.456 18933 12025 1 17 . 1 1 68 68 ASN N N 68 112.108 112.108 118.029 -5.921 18933 12026 1 17 . 1 1 68 68 ASN C C 68 174.884 174.884 173.942 0.942 18933 12027 1 17 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.349 -1.322 18933 12028 1 17 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.075 1.157 18933 12029 1 17 . 1 1 68 68 ASN H H 68 7.009 7.009 8.282 -1.273 18933 12030 1 17 . 1 1 69 69 ILE N N 69 123.325 123.325 123.479 -0.154 18933 12031 1 17 . 1 1 69 69 ILE C C 69 174.394 174.394 175.290 -0.896 18933 12032 1 17 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.945 -1.838 18933 12033 1 17 . 1 1 69 69 ILE CB C 69 38.267 38.267 39.005 -0.739 18933 12034 1 17 . 1 1 69 69 ILE H H 69 7.150 7.150 7.941 -0.791 18933 12035 1 17 . 1 1 70 70 ARG N N 70 126.722 126.722 125.423 1.299 18933 12036 1 17 . 1 1 70 70 ARG C C 70 174.590 174.590 173.939 0.651 18933 12037 1 17 . 1 1 70 70 ARG CA C 70 53.247 53.247 53.966 -0.719 18933 12038 1 17 . 1 1 70 70 ARG CB C 70 32.372 32.372 33.154 -0.782 18933 12039 1 17 . 1 1 70 70 ARG H H 70 8.902 8.902 9.142 -0.240 18933 12040 1 17 . 1 1 71 71 ILE N N 71 119.978 119.978 119.870 0.108 18933 12041 1 17 . 1 1 71 71 ILE C C 71 175.583 175.583 175.939 -0.356 18933 12042 1 17 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.574 0.250 18933 12043 1 17 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.496 -2.736 18933 12044 1 17 . 1 1 71 71 ILE H H 71 7.491 7.491 8.780 -1.289 18933 12045 1 17 . 1 1 72 72 LYS N N 72 128.530 128.530 124.550 3.980 18933 12046 1 17 . 1 1 72 72 LYS C C 72 177.703 177.703 176.247 1.456 18933 12047 1 17 . 1 1 72 72 LYS CA C 72 57.201 57.201 54.813 2.388 18933 12048 1 17 . 1 1 72 72 LYS CB C 72 31.485 31.485 30.993 0.492 18933 12049 1 17 . 1 1 72 72 LYS H H 72 8.523 8.523 8.447 0.076 18933 12050 1 17 . 1 1 73 73 GLY N N 73 113.806 113.806 110.033 3.773 18933 12051 1 17 . 1 1 73 73 GLY C C 73 173.781 173.781 172.844 0.937 18933 12052 1 17 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.176 0.646 18933 12053 1 17 . 1 1 73 73 GLY H H 73 8.791 8.791 8.272 0.519 18933 12054 1 17 . 1 1 74 74 LEU N N 74 120.490 120.490 118.265 2.225 18933 12055 1 17 . 1 1 74 74 LEU C C 74 175.840 175.840 173.685 2.155 18933 12056 1 17 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.304 -0.613 18933 12057 1 17 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.339 -1.178 18933 12058 1 17 . 1 1 74 74 LEU H H 74 7.393 7.393 7.225 0.168 18933 12059 1 17 . 1 1 75 75 SER N N 75 120.038 120.038 115.287 4.751 18933 12060 1 17 . 1 1 75 75 SER C C 75 173.205 173.205 173.446 -0.241 18933 12061 1 17 . 1 1 75 75 SER CA C 75 57.887 57.887 57.185 0.702 18933 12062 1 17 . 1 1 75 75 SER CB C 75 63.049 63.049 65.366 -2.317 18933 12063 1 17 . 1 1 75 75 SER H H 75 8.917 8.917 8.158 0.759 18933 12064 1 17 . 1 1 76 76 PHE N N 76 119.586 119.586 118.428 1.158 18933 12065 1 17 . 1 1 76 76 PHE C C 76 173.536 173.536 173.529 0.007 18933 12066 1 17 . 1 1 76 76 PHE CA C 76 55.426 55.426 55.865 -0.439 18933 12067 1 17 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.186 -0.180 18933 12068 1 17 . 1 1 76 76 PHE H H 76 8.003 8.003 8.350 -0.347 18933 12069 1 17 . 1 1 77 77 SER N N 77 114.943 114.943 114.757 0.186 18933 12070 1 17 . 1 1 77 77 SER C C 77 173.438 173.438 172.102 1.336 18933 12071 1 17 . 1 1 77 77 SER CA C 77 56.152 56.152 57.447 -1.296 18933 12072 1 17 . 1 1 77 77 SER CB C 77 65.204 65.204 65.185 0.019 18933 12073 1 17 . 1 1 77 77 SER H H 77 8.907 8.907 8.684 0.223 18933 12074 1 17 . 1 1 78 78 VAL N N 78 124.791 124.791 122.922 1.869 18933 12075 1 17 . 1 1 78 78 VAL CA C 78 62.044 62.044 59.858 2.186 18933 12076 1 17 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.525 -2.343 18933 12077 1 17 . 1 1 78 78 VAL H H 78 8.892 8.892 8.295 0.597 18933 12078 1 17 . 1 1 79 79 LYS N N 79 129.667 129.667 128.525 1.142 18933 12079 1 17 . 1 1 79 79 LYS CA C 79 56.192 56.192 53.693 2.499 18933 12080 1 17 . 1 1 79 79 LYS CB C 79 32.372 32.372 33.821 -1.449 18933 12081 1 17 . 1 1 79 79 LYS H H 79 9.049 9.049 8.801 0.248 18933 12082 1 17 . 1 1 82 82 GLY N N 82 117.263 117.263 113.255 4.008 18933 12083 1 17 . 1 1 82 82 GLY C C 82 171.710 171.710 174.722 -3.012 18933 12084 1 17 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.304 -2.380 18933 12085 1 17 . 1 1 82 82 GLY H H 82 8.044 8.044 8.504 -0.460 18933 12086 1 17 . 1 1 83 83 GLU N N 83 117.203 117.203 121.811 -4.608 18933 12087 1 17 . 1 1 83 83 GLU C C 83 178.695 178.695 177.416 1.279 18933 12088 1 17 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.981 0.996 18933 12089 1 17 . 1 1 83 83 GLU CB C 83 29.837 29.837 30.314 -0.477 18933 12090 1 17 . 1 1 83 83 GLU H H 83 8.296 8.296 8.540 -0.244 18933 12091 1 17 . 1 1 84 84 ARG N N 84 113.818 113.818 118.039 -4.221 18933 12092 1 17 . 1 1 84 84 ARG C C 84 175.877 175.877 175.273 0.604 18933 12093 1 17 . 1 1 84 84 ARG CA C 84 53.731 53.731 54.883 -1.152 18933 12094 1 17 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.306 1.989 18933 12095 1 17 . 1 1 84 84 ARG H H 84 8.342 8.342 7.937 0.405 18933 12096 1 17 . 1 1 85 85 LYS N N 85 119.354 119.354 121.713 -2.359 18933 12097 1 17 . 1 1 85 85 LYS C C 85 174.516 174.516 174.296 0.220 18933 12098 1 17 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.620 -0.880 18933 12099 1 17 . 1 1 85 85 LYS CB C 85 34.844 34.844 34.774 0.070 18933 12100 1 17 . 1 1 85 85 LYS H H 85 6.822 6.822 7.783 -0.961 18933 12101 1 17 . 1 1 86 86 CYS N N 86 125.928 125.928 124.427 1.501 18933 12102 1 17 . 1 1 86 86 CYS C C 86 171.600 171.600 173.406 -1.806 18933 12103 1 17 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.903 -2.276 18933 12104 1 17 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.454 -0.110 18933 12105 1 17 . 1 1 86 86 CYS H H 86 9.084 9.084 9.339 -0.255 18933 12106 1 17 . 1 1 87 87 VAL N N 87 126.612 126.612 126.248 0.364 18933 12107 1 17 . 1 1 87 87 VAL C C 87 174.431 174.431 174.612 -0.181 18933 12108 1 17 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.894 -0.577 18933 12109 1 17 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.236 0.960 18933 12110 1 17 . 1 1 87 87 VAL H H 87 8.705 8.705 9.014 -0.309 18933 12111 1 17 . 1 1 88 88 LEU N N 88 127.748 127.748 123.660 4.088 18933 12112 1 17 . 1 1 88 88 LEU C C 88 175.227 175.227 174.627 0.600 18933 12113 1 17 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.719 -0.199 18933 12114 1 17 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.170 -1.565 18933 12115 1 17 . 1 1 88 88 LEU H H 88 9.417 9.417 8.661 0.756 18933 12116 1 17 . 1 1 89 89 PHE N N 89 120.981 120.981 119.626 1.355 18933 12117 1 17 . 1 1 89 89 PHE C C 89 176.906 176.906 175.824 1.082 18933 12118 1 17 . 1 1 89 89 PHE CA C 89 55.587 55.587 55.995 -0.408 18933 12119 1 17 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.932 -3.031 18933 12120 1 17 . 1 1 89 89 PHE H H 89 8.937 8.937 8.807 0.130 18933 12121 1 17 . 1 1 90 90 ILE N N 90 119.928 119.928 118.800 1.128 18933 12122 1 17 . 1 1 90 90 ILE C C 90 173.781 173.781 175.023 -1.242 18933 12123 1 17 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.438 -0.784 18933 12124 1 17 . 1 1 90 90 ILE CB C 90 40.612 40.612 38.811 1.801 18933 12125 1 17 . 1 1 90 90 ILE H H 90 9.230 9.230 9.127 0.103 18933 12126 1 17 . 1 1 91 91 GLU N N 91 124.339 124.339 125.615 -1.276 18933 12127 1 17 . 1 1 91 91 GLU C C 91 175.607 175.607 175.246 0.361 18933 12128 1 17 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.902 -0.283 18933 12129 1 17 . 1 1 91 91 GLU CB C 91 29.837 29.837 32.824 -2.987 18933 12130 1 17 . 1 1 91 91 GLU H H 91 8.175 8.175 9.013 -0.838 18933 12131 1 17 . 1 1 92 92 TRP N N 92 127.516 127.516 124.826 2.690 18933 12132 1 17 . 1 1 92 92 TRP C C 92 175.203 175.203 176.428 -1.225 18933 12133 1 17 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.972 1.261 18933 12134 1 17 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.068 1.593 18933 12135 1 17 . 1 1 92 92 TRP H H 92 9.306 9.306 8.092 1.214 18933 12136 1 17 . 1 1 93 93 GLU N N 93 127.834 127.834 125.564 2.270 18933 12137 1 17 . 1 1 93 93 GLU C C 93 175.668 175.668 176.167 -0.499 18933 12138 1 17 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.562 -0.684 18933 12139 1 17 . 1 1 93 93 GLU CB C 93 26.034 26.034 28.443 -2.409 18933 12140 1 17 . 1 1 93 93 GLU H H 93 8.796 8.796 9.014 -0.218 18933 12141 1 17 . 1 1 94 94 LYS N N 94 108.931 108.931 111.907 -2.976 18933 12142 1 17 . 1 1 94 94 LYS C C 94 175.423 175.423 176.340 -0.917 18933 12143 1 17 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.674 -0.231 18933 12144 1 17 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.637 -3.004 18933 12145 1 17 . 1 1 94 94 LYS H H 94 8.498 8.498 8.689 -0.191 18933 12146 1 17 . 1 1 95 95 LYS N N 95 121.737 121.737 120.117 1.620 18933 12147 1 17 . 1 1 95 95 LYS C C 95 174.443 174.443 175.300 -0.857 18933 12148 1 17 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.559 -2.143 18933 12149 1 17 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.290 0.174 18933 12150 1 17 . 1 1 95 95 LYS H H 95 7.761 7.761 7.552 0.209 18933 12151 1 17 . 1 1 96 96 THR N N 96 116.067 116.067 115.440 0.627 18933 12152 1 17 . 1 1 96 96 THR C C 96 174.296 174.296 173.688 0.608 18933 12153 1 17 . 1 1 96 96 THR CA C 96 61.115 61.115 61.484 -0.369 18933 12154 1 17 . 1 1 96 96 THR CB C 96 69.450 69.450 71.343 -1.893 18933 12155 1 17 . 1 1 96 96 THR H H 96 7.761 7.761 8.497 -0.736 18933 12156 1 17 . 1 1 97 97 TYR N N 97 124.229 124.229 125.673 -1.444 18933 12157 1 17 . 1 1 97 97 TYR C C 97 173.536 173.536 173.873 -0.337 18933 12158 1 17 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.537 -0.587 18933 12159 1 17 . 1 1 97 97 TYR CB C 97 41.182 41.182 43.099 -1.917 18933 12160 1 17 . 1 1 97 97 TYR H H 97 9.018 9.018 9.264 -0.246 18933 12161 1 17 . 1 1 98 98 GLN N N 98 123.435 123.435 124.937 -1.502 18933 12162 1 17 . 1 1 98 98 GLN C C 98 173.266 173.266 173.252 0.014 18933 12163 1 17 . 1 1 98 98 GLN CA C 98 55.143 55.143 54.877 0.266 18933 12164 1 17 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.385 -0.372 18933 12165 1 17 . 1 1 98 98 GLN H H 98 8.781 8.781 8.825 -0.044 18933 12166 1 17 . 1 1 99 99 LEU N N 99 130.119 130.119 127.207 2.912 18933 12167 1 17 . 1 1 99 99 LEU C C 99 173.867 173.867 173.978 -0.111 18933 12168 1 17 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.253 -0.733 18933 12169 1 17 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.696 -1.091 18933 12170 1 17 . 1 1 99 99 LEU H H 99 9.104 9.104 8.863 0.241 18933 12171 1 17 . 1 1 100 100 ASP N N 100 125.182 125.182 127.573 -2.391 18933 12172 1 17 . 1 1 100 100 ASP C C 100 172.837 172.837 174.193 -1.356 18933 12173 1 17 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.666 -1.912 18933 12174 1 17 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.123 -3.779 18933 12175 1 17 . 1 1 100 100 ASP H H 100 9.089 9.089 8.766 0.323 18933 12176 1 17 . 1 1 101 101 LEU N N 101 121.174 121.174 128.052 -6.878 18933 12177 1 17 . 1 1 101 101 LEU C C 101 174.529 174.529 174.560 -0.031 18933 12178 1 17 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.723 -1.808 18933 12179 1 17 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.220 -1.312 18933 12180 1 17 . 1 1 101 101 LEU H H 101 8.458 8.458 9.138 -0.680 18933 12181 1 17 . 1 1 102 102 PHE N N 102 119.464 119.464 125.622 -6.158 18933 12182 1 17 . 1 1 102 102 PHE C C 102 176.293 176.293 175.236 1.057 18933 12183 1 17 . 1 1 102 102 PHE CA C 102 54.054 54.054 54.940 -0.886 18933 12184 1 17 . 1 1 102 102 PHE CB C 102 41.880 41.880 41.704 0.176 18933 12185 1 17 . 1 1 102 102 PHE H H 102 8.281 8.281 9.267 -0.986 18933 12186 1 17 . 1 1 103 103 THR N N 103 108.576 108.576 116.143 -7.567 18933 12187 1 17 . 1 1 103 103 THR C C 103 174.933 174.933 173.402 1.531 18933 12188 1 17 . 1 1 103 103 THR CA C 103 57.726 57.726 60.314 -2.588 18933 12189 1 17 . 1 1 103 103 THR CB C 103 71.288 71.288 69.649 1.639 18933 12190 1 17 . 1 1 103 103 THR H H 103 7.872 7.872 8.392 -0.520 18933 12191 1 17 . 1 1 104 104 ALA N N 104 122.885 122.885 127.723 -4.838 18933 12192 1 17 . 1 1 104 104 ALA C C 104 175.754 175.754 175.053 0.701 18933 12193 1 17 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.621 0.397 18933 12194 1 17 . 1 1 104 104 ALA CB C 104 22.485 22.485 21.883 0.602 18933 12195 1 17 . 1 1 104 104 ALA H H 104 8.660 8.660 9.001 -0.341 18933 12196 1 17 . 1 1 105 105 LEU N N 105 120.881 120.881 118.906 1.975 18933 12197 1 17 . 1 1 105 105 LEU C C 105 179.504 179.504 177.835 1.669 18933 12198 1 17 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.457 -1.210 18933 12199 1 17 . 1 1 105 105 LEU CB C 105 41.753 41.753 44.097 -2.344 18933 12200 1 17 . 1 1 105 105 LEU H H 105 8.226 8.226 8.270 -0.044 18933 12201 1 17 . 1 1 106 106 ALA N N 106 124.901 124.901 123.531 1.370 18933 12202 1 17 . 1 1 106 106 ALA C C 106 181.269 181.269 179.514 1.755 18933 12203 1 17 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.755 1.558 18933 12204 1 17 . 1 1 106 106 ALA CB C 106 17.224 17.224 19.042 -1.818 18933 12205 1 17 . 1 1 106 106 ALA H H 106 8.392 8.392 8.529 -0.137 18933 12206 1 17 . 1 1 107 107 GLU N N 107 116.409 116.409 117.509 -1.100 18933 12207 1 17 . 1 1 107 107 GLU C C 107 177.764 177.764 177.092 0.672 18933 12208 1 17 . 1 1 107 107 GLU CA C 107 58.533 58.533 58.709 -0.176 18933 12209 1 17 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.849 -1.913 18933 12210 1 17 . 1 1 107 107 GLU H H 107 9.664 9.664 8.636 1.028 18933 12211 1 17 . 1 1 108 108 GLU N N 108 116.189 116.189 115.423 0.766 18933 12212 1 17 . 1 1 108 108 GLU CA C 108 55.143 55.143 57.162 -2.019 18933 12213 1 17 . 1 1 108 108 GLU CB C 108 29.837 29.837 28.609 1.228 18933 12214 1 17 . 1 1 108 108 GLU H H 108 7.589 7.589 8.546 -0.957 18933 12215 1 17 . 1 1 109 109 LYS N N 109 119.928 119.928 121.641 -1.713 18933 12216 1 17 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.409 1.442 18933 12217 1 17 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.426 0.045 18933 12218 1 17 . 1 1 109 109 LYS H H 109 7.514 7.514 7.547 -0.033 18933 12219 1 17 . 1 1 111 111 TYR N N 111 114.930 114.930 119.190 -4.260 18933 12220 1 17 . 1 1 111 111 TYR C C 111 179.504 179.504 177.799 1.705 18933 12221 1 17 . 1 1 111 111 TYR CA C 111 59.017 59.017 60.848 -1.831 18933 12222 1 17 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.524 -1.856 18933 12223 1 17 . 1 1 111 111 TYR H H 111 6.393 6.393 8.437 -2.044 18933 12224 1 17 . 1 1 112 112 ALA N N 112 124.901 124.901 122.418 2.483 18933 12225 1 17 . 1 1 112 112 ALA C C 112 179.173 179.173 179.604 -0.431 18933 12226 1 17 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.487 -0.586 18933 12227 1 17 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.415 -0.303 18933 12228 1 17 . 1 1 112 112 ALA H H 112 8.554 8.554 8.212 0.342 18933 12229 1 17 . 1 1 113 113 ILE N N 113 119.464 119.464 119.760 -0.296 18933 12230 1 17 . 1 1 113 113 ILE C C 113 178.499 178.499 177.708 0.791 18933 12231 1 17 . 1 1 113 113 ILE CA C 113 66.281 66.281 64.326 1.955 18933 12232 1 17 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.796 -0.480 18933 12233 1 17 . 1 1 113 113 ILE H H 113 8.680 8.680 7.701 0.979 18933 12234 1 17 . 1 1 114 114 PHE N N 114 122.922 122.922 121.849 1.073 18933 12235 1 17 . 1 1 114 114 PHE C C 114 178.217 178.217 178.153 0.064 18933 12236 1 17 . 1 1 114 114 PHE CA C 114 61.559 61.559 59.891 1.668 18933 12237 1 17 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.575 0.896 18933 12238 1 17 . 1 1 114 114 PHE H H 114 7.721 7.721 8.778 -1.057 18933 12239 1 17 . 1 1 115 115 HIS N N 115 118.560 118.560 118.749 -0.189 18933 12240 1 17 . 1 1 115 115 HIS C C 115 177.286 177.286 176.870 0.416 18933 12241 1 17 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.447 -0.067 18933 12242 1 17 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.268 1.597 18933 12243 1 17 . 1 1 115 115 HIS H H 115 8.155 8.155 8.408 -0.253 18933 12244 1 17 . 1 1 116 116 PHE N N 116 111.472 111.472 116.777 -5.305 18933 12245 1 17 . 1 1 116 116 PHE C C 116 179.026 179.026 177.331 1.695 18933 12246 1 17 . 1 1 116 116 PHE CA C 116 59.461 59.461 60.054 -0.593 18933 12247 1 17 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.987 -1.798 18933 12248 1 17 . 1 1 116 116 PHE H H 116 8.564 8.564 8.059 0.505 18933 12249 1 17 . 1 1 117 117 THR N N 117 119.012 119.012 111.019 7.993 18933 12250 1 17 . 1 1 117 117 THR C C 117 172.935 172.935 175.403 -2.468 18933 12251 1 17 . 1 1 117 117 THR CA C 117 67.088 67.088 64.737 2.351 18933 12252 1 17 . 1 1 117 117 THR CB C 117 37.126 37.126 69.219 -32.093 18933 12253 1 17 . 1 1 117 117 THR H H 117 7.620 7.620 8.213 -0.593 18933 12254 1 17 . 1 1 118 118 GLY N N 118 107.917 107.917 110.169 -2.252 18933 12255 1 17 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.292 1.875 18933 12256 1 17 . 1 1 118 118 GLY H H 118 6.666 6.666 7.589 -0.923 18933 12257 1 17 . 1 1 121 121 SER N N 121 113.354 113.354 118.394 -5.040 18933 12258 1 17 . 1 1 121 121 SER C C 121 176.061 176.061 175.873 0.188 18933 12259 1 17 . 1 1 121 121 SER CA C 121 61.035 61.035 62.484 -1.449 18933 12260 1 17 . 1 1 121 121 SER H H 121 8.322 8.322 8.349 -0.027 18933 12261 1 17 . 1 1 122 122 TYR N N 122 124.681 124.681 120.920 3.761 18933 12262 1 17 . 1 1 122 122 TYR C C 122 176.293 176.293 176.784 -0.491 18933 12263 1 17 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.688 -1.631 18933 12264 1 17 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.055 0.656 18933 12265 1 17 . 1 1 122 122 TYR H H 122 6.514 6.514 8.186 -1.672 18933 12266 1 17 . 1 1 123 123 LEU N N 123 117.997 117.997 119.915 -1.918 18933 12267 1 17 . 1 1 123 123 LEU C C 123 179.774 179.774 178.968 0.806 18933 12268 1 17 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.562 0.316 18933 12269 1 17 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.859 -0.881 18933 12270 1 17 . 1 1 123 123 LEU H H 123 7.428 7.428 7.304 0.124 18933 12271 1 17 . 1 1 124 124 ILE N N 124 119.012 119.012 120.743 -1.731 18933 12272 1 17 . 1 1 124 124 ILE C C 124 178.830 178.830 178.104 0.726 18933 12273 1 17 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.266 -0.115 18933 12274 1 17 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.213 -0.150 18933 12275 1 17 . 1 1 124 124 ILE H H 124 8.453 8.453 8.395 0.058 18933 12276 1 17 . 1 1 125 125 ARG N N 125 121.174 121.174 119.298 1.876 18933 12277 1 17 . 1 1 125 125 ARG C C 125 179.762 179.762 178.918 0.844 18933 12278 1 17 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.019 1.038 18933 12279 1 17 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.324 -0.374 18933 12280 1 17 . 1 1 125 125 ARG H H 125 7.004 7.004 8.060 -1.056 18933 12281 1 17 . 1 1 126 126 ILE N N 126 122.299 122.299 120.544 1.755 18933 12282 1 17 . 1 1 126 126 ILE C C 126 178.352 178.352 177.815 0.537 18933 12283 1 17 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.704 -2.499 18933 12284 1 17 . 1 1 126 126 ILE CB C 126 35.415 35.415 36.992 -1.577 18933 12285 1 17 . 1 1 126 126 ILE H H 126 7.579 7.579 7.973 -0.394 18933 12286 1 17 . 1 1 127 127 ARG N N 127 119.354 119.354 119.502 -0.148 18933 12287 1 17 . 1 1 127 127 ARG C C 127 179.786 179.786 178.963 0.823 18933 12288 1 17 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.772 0.214 18933 12289 1 17 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.045 -0.715 18933 12290 1 17 . 1 1 127 127 ARG H H 127 8.715 8.715 8.028 0.687 18933 12291 1 17 . 1 1 128 128 ALA N N 128 122.873 122.873 121.157 1.716 18933 12292 1 17 . 1 1 128 128 ALA C C 128 180.325 180.325 179.325 1.000 18933 12293 1 17 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.639 0.101 18933 12294 1 17 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.238 -1.077 18933 12295 1 17 . 1 1 128 128 ALA H H 128 7.978 7.978 8.103 -0.125 18933 12296 1 17 . 1 1 129 129 ALA N N 129 121.846 121.846 121.745 0.101 18933 12297 1 17 . 1 1 129 129 ALA C C 129 181.539 181.539 179.905 1.634 18933 12298 1 17 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.820 -0.322 18933 12299 1 17 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.645 -1.167 18933 12300 1 17 . 1 1 129 129 ALA H H 129 7.519 7.519 8.144 -0.625 18933 12301 1 17 . 1 1 130 130 LEU N N 130 119.134 119.134 118.316 0.818 18933 12302 1 17 . 1 1 130 130 LEU C C 130 179.909 179.909 178.905 1.004 18933 12303 1 17 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.083 -0.084 18933 12304 1 17 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.716 -1.294 18933 12305 1 17 . 1 1 130 130 LEU H H 130 8.296 8.296 8.647 -0.351 18933 12306 1 17 . 1 1 131 131 LYS N N 131 122.299 122.299 120.878 1.421 18933 12307 1 17 . 1 1 131 131 LYS C C 131 180.289 180.289 179.614 0.675 18933 12308 1 17 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.704 -0.687 18933 12309 1 17 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.102 -0.870 18933 12310 1 17 . 1 1 131 131 LYS H H 131 8.281 8.281 7.880 0.401 18933 12311 1 17 . 1 1 132 132 LYS N N 132 118.743 118.743 118.507 0.236 18933 12312 1 17 . 1 1 132 132 LYS C C 132 177.482 177.482 177.897 -0.415 18933 12313 1 17 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.523 -0.031 18933 12314 1 17 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.302 -1.070 18933 12315 1 17 . 1 1 132 132 LYS H H 132 7.317 7.317 7.616 -0.299 18933 12316 1 17 . 1 1 133 133 LYS N N 133 117.093 117.093 117.087 0.006 18933 12317 1 17 . 1 1 133 133 LYS C C 133 174.614 174.614 176.118 -1.504 18933 12318 1 17 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.946 -1.166 18933 12319 1 17 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.914 -0.732 18933 12320 1 17 . 1 1 133 133 LYS H H 133 7.327 7.327 7.585 -0.258 18933 12321 1 17 . 1 1 134 134 ASN N N 134 113.012 113.012 115.855 -2.843 18933 12322 1 17 . 1 1 134 134 ASN C C 134 173.965 173.965 173.356 0.609 18933 12323 1 17 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.543 -0.247 18933 12324 1 17 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.404 -1.228 18933 12325 1 17 . 1 1 134 134 ASN H H 134 7.938 7.938 7.947 -0.009 18933 12326 1 17 . 1 1 135 135 TYR N N 135 115.725 115.725 119.396 -3.671 18933 12327 1 17 . 1 1 135 135 TYR C C 135 176.342 176.342 175.148 1.194 18933 12328 1 17 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.060 -1.392 18933 12329 1 17 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.049 1.514 18933 12330 1 17 . 1 1 135 135 TYR H H 135 7.741 7.741 8.358 -0.617 18933 12331 1 17 . 1 1 136 136 LYS N N 136 122.641 122.641 125.631 -2.990 18933 12332 1 17 . 1 1 136 136 LYS C C 136 173.475 173.475 174.684 -1.209 18933 12333 1 17 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.596 0.305 18933 12334 1 17 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.432 -1.714 18933 12335 1 17 . 1 1 136 136 LYS H H 136 9.296 9.296 8.992 0.304 18933 12336 1 17 . 1 1 137 137 LEU N N 137 127.284 127.284 122.859 4.425 18933 12337 1 17 . 1 1 137 137 LEU C C 137 175.423 175.423 176.170 -0.747 18933 12338 1 17 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.089 0.037 18933 12339 1 17 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.312 3.434 18933 12340 1 17 . 1 1 137 137 LEU H H 137 8.776 8.776 8.565 0.211 18933 12341 1 17 . 1 1 138 138 ASN N N 138 125.818 125.818 119.648 6.170 18933 12342 1 17 . 1 1 138 138 ASN C C 138 174.933 174.933 175.548 -0.615 18933 12343 1 17 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.508 -0.391 18933 12344 1 17 . 1 1 138 138 ASN CB C 138 37.506 37.506 41.969 -4.463 18933 12345 1 17 . 1 1 138 138 ASN H H 138 8.811 8.811 8.203 0.608 18933 12346 1 17 . 1 1 139 139 GLN N N 139 116.861 116.861 119.154 -2.293 18933 12347 1 17 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.550 -1.712 18933 12348 1 17 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.720 -3.003 18933 12349 1 17 . 1 1 139 139 GLN H H 139 9.220 9.220 8.738 0.482 18933 12350 1 17 . 1 1 140 140 TYR N N 140 120.600 120.600 117.095 3.505 18933 12351 1 17 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.120 -0.363 18933 12352 1 17 . 1 1 140 140 TYR CB C 140 37.570 37.570 38.228 -0.658 18933 12353 1 17 . 1 1 140 140 TYR H H 140 8.549 8.549 7.776 0.773 18933 12354 1 17 . 1 1 141 141 GLY N N 141 105.986 105.986 107.923 -1.937 18933 12355 1 17 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.411 -0.567 18933 12356 1 17 . 1 1 141 141 GLY H H 141 7.186 7.186 8.091 -0.905 18933 12357 1 17 . 1 1 142 142 LEU N N 142 120.038 120.038 116.914 3.124 18933 12358 1 17 . 1 1 142 142 LEU C C 142 173.340 173.340 175.938 -2.598 18933 12359 1 17 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.275 -0.755 18933 12360 1 17 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.557 0.794 18933 12361 1 17 . 1 1 142 142 LEU H H 142 7.539 7.539 8.377 -0.838 18933 12362 1 17 . 1 1 143 143 PHE N N 143 124.229 124.229 118.608 5.621 18933 12363 1 17 . 1 1 143 143 PHE C C 143 173.977 173.977 175.092 -1.115 18933 12364 1 17 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.487 -2.846 18933 12365 1 17 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.852 3.816 18933 12366 1 17 . 1 1 143 143 PHE H H 143 9.084 9.084 9.017 0.067 18933 12367 1 17 . 1 1 144 144 LYS N N 144 127.858 127.858 123.238 4.620 18933 12368 1 17 . 1 1 144 144 LYS C C 144 175.092 175.092 176.871 -1.779 18933 12369 1 17 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.428 4.428 18933 12370 1 17 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.881 3.703 18933 12371 1 17 . 1 1 144 144 LYS H H 144 9.281 9.281 8.877 0.404 18933 12372 1 17 . 1 1 145 145 ASN N N 145 128.188 128.188 126.009 2.179 18933 12373 1 17 . 1 1 145 145 ASN C C 145 175.779 175.779 175.133 0.646 18933 12374 1 17 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.632 3.094 18933 12375 1 17 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.629 -2.974 18933 12376 1 17 . 1 1 145 145 ASN H H 145 9.205 9.205 9.275 -0.070 18933 12377 1 17 . 1 1 146 146 GLN N N 146 129.655 129.655 112.165 17.490 18933 12378 1 17 . 1 1 146 146 GLN C C 146 175.399 175.399 174.588 0.811 18933 12379 1 17 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.218 1.597 18933 12380 1 17 . 1 1 146 146 GLN CB C 146 32.626 32.626 27.382 5.244 18933 12381 1 17 . 1 1 146 146 GLN H H 146 8.983 8.983 8.853 0.130 18933 12382 1 17 . 1 1 147 147 THR N N 147 117.936 117.936 116.205 1.731 18933 12383 1 17 . 1 1 147 147 THR C C 147 173.254 173.254 173.442 -0.188 18933 12384 1 17 . 1 1 147 147 THR CA C 147 61.721 61.721 61.428 0.292 18933 12385 1 17 . 1 1 147 147 THR CB C 147 70.274 70.274 69.762 0.512 18933 12386 1 17 . 1 1 147 147 THR H H 147 8.029 8.029 7.825 0.204 18933 12387 1 17 . 1 1 148 148 LEU N N 148 130.681 130.681 131.467 -0.786 18933 12388 1 17 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.483 -0.017 18933 12389 1 17 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.726 -1.037 18933 12390 1 17 . 1 1 148 148 LEU H H 148 8.635 8.635 8.914 -0.279 18933 12391 1 17 . 1 1 149 149 VAL N N 149 130.803 130.803 123.908 6.895 18933 12392 1 17 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.517 0.662 18933 12393 1 17 . 1 1 149 149 VAL CB C 149 31.675 31.675 33.695 -2.020 18933 12394 1 17 . 1 1 149 149 VAL H H 149 8.968 8.968 9.284 -0.316 18933 12395 1 17 . 1 1 151 151 LEU N N 151 124.290 124.290 120.951 3.339 18933 12396 1 17 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.248 -2.235 18933 12397 1 17 . 1 1 151 151 LEU CB C 151 44.098 44.098 40.722 3.376 18933 12398 1 17 . 1 1 151 151 LEU H H 151 7.872 7.872 8.305 -0.433 18933 12399 1 17 . 1 1 153 153 ILE N N 153 114.943 114.943 114.692 0.251 18933 12400 1 17 . 1 1 153 153 ILE C C 153 175.877 175.877 175.156 0.721 18933 12401 1 17 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.747 -0.053 18933 12402 1 17 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.539 1.150 18933 12403 1 17 . 1 1 153 153 ILE H H 153 7.125 7.125 7.689 -0.564 18933 12404 1 17 . 1 1 154 154 THR N N 154 111.766 111.766 114.084 -2.318 18933 12405 1 17 . 1 1 154 154 THR C C 154 174.945 174.945 174.457 0.488 18933 12406 1 17 . 1 1 154 154 THR CA C 154 62.124 62.124 63.357 -1.233 18933 12407 1 17 . 1 1 154 154 THR CB C 154 70.718 70.718 69.524 1.194 18933 12408 1 17 . 1 1 154 154 THR H H 154 9.286 9.286 8.361 0.925 18933 12409 1 17 . 1 1 155 155 THR N N 155 111.766 111.766 111.873 -0.107 18933 12410 1 17 . 1 1 155 155 THR CA C 155 58.936 58.936 59.471 -0.535 18933 12411 1 17 . 1 1 155 155 THR CB C 155 72.683 72.683 71.928 0.755 18933 12412 1 17 . 1 1 155 155 THR H H 155 7.645 7.645 7.371 0.274 18933 12413 1 17 . 1 1 157 157 LYS N N 157 119.464 119.464 118.851 0.613 18933 12414 1 17 . 1 1 157 157 LYS C C 157 178.781 178.781 178.613 0.168 18933 12415 1 17 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.679 0.346 18933 12416 1 17 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.816 -0.394 18933 12417 1 17 . 1 1 157 157 LYS H H 157 8.175 8.175 8.202 -0.027 18933 12418 1 17 . 1 1 158 158 GLU N N 158 118.340 118.340 117.846 0.494 18933 12419 1 17 . 1 1 158 158 GLU C C 158 178.867 178.867 178.774 0.093 18933 12420 1 17 . 1 1 158 158 GLU CA C 158 58.492 58.492 59.053 -0.561 18933 12421 1 17 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.750 0.580 18933 12422 1 17 . 1 1 158 158 GLU H H 158 7.519 7.519 8.329 -0.810 18933 12423 1 17 . 1 1 159 159 LEU N N 159 120.710 120.710 121.998 -1.288 18933 12424 1 17 . 1 1 159 159 LEU C C 159 176.526 176.526 178.127 -1.601 18933 12425 1 17 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.309 -0.139 18933 12426 1 17 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.749 -1.834 18933 12427 1 17 . 1 1 159 159 LEU H H 159 7.524 7.524 7.742 -0.218 18933 12428 1 17 . 1 1 160 160 ILE N N 160 118.217 118.217 118.696 -0.479 18933 12429 1 17 . 1 1 160 160 ILE C C 160 177.213 177.213 177.980 -0.767 18933 12430 1 17 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.685 -0.655 18933 12431 1 17 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.366 0.140 18933 12432 1 17 . 1 1 160 160 ILE H H 160 7.741 7.741 8.153 -0.412 18933 12433 1 17 . 1 1 161 161 LYS N N 161 118.450 118.450 119.638 -1.188 18933 12434 1 17 . 1 1 161 161 LYS C C 161 180.999 180.999 179.097 1.902 18933 12435 1 17 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.380 -0.565 18933 12436 1 17 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.306 -1.328 18933 12437 1 17 . 1 1 161 161 LYS H H 161 7.382 7.382 8.006 -0.624 18933 12438 1 17 . 1 1 162 162 GLU N N 162 121.846 121.846 119.824 2.022 18933 12439 1 17 . 1 1 162 162 GLU C C 162 178.818 178.818 178.759 0.059 18933 12440 1 17 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.882 -0.833 18933 12441 1 17 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.615 -1.679 18933 12442 1 17 . 1 1 162 162 GLU H H 162 8.210 8.210 7.842 0.368 18933 12443 1 17 . 1 1 163 163 LEU N N 163 116.751 116.751 112.682 4.069 18933 12444 1 17 . 1 1 163 163 LEU C C 163 176.784 176.784 176.872 -0.088 18933 12445 1 17 . 1 1 163 163 LEU CA C 163 55.022 55.022 54.596 0.426 18933 12446 1 17 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.217 0.092 18933 12447 1 17 . 1 1 163 163 LEU H H 163 7.796 7.796 7.482 0.314 18933 12448 1 17 . 1 1 164 164 GLY N N 164 104.849 104.849 107.005 -2.156 18933 12449 1 17 . 1 1 164 164 GLY C C 164 174.492 174.492 173.954 0.538 18933 12450 1 17 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.472 -0.740 18933 12451 1 17 . 1 1 164 164 GLY H H 164 7.589 7.589 7.421 0.168 18933 12452 1 17 . 1 1 165 165 PHE N N 165 118.902 118.902 119.534 -0.632 18933 12453 1 17 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.383 -0.715 18933 12454 1 17 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.593 -2.107 18933 12455 1 17 . 1 1 165 165 PHE H H 165 7.251 7.251 8.201 -0.950 18933 12456 1 17 . 1 1 166 166 THR N N 166 117.093 117.093 115.807 1.286 18933 12457 1 17 . 1 1 166 166 THR CA C 166 62.245 62.245 60.930 1.315 18933 12458 1 17 . 1 1 166 166 THR CB C 166 69.323 69.323 69.396 -0.073 18933 12459 1 17 . 1 1 166 166 THR H H 166 8.407 8.407 8.231 0.176 18933 12460 1 17 . 1 1 168 168 ARG N N 168 127.431 127.431 120.993 6.438 18933 12461 1 17 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.578 -2.340 18933 12462 1 17 . 1 1 168 168 ARG CB C 168 31.992 31.992 32.673 -0.681 18933 12463 1 17 . 1 1 168 168 ARG H H 168 7.160 7.160 8.609 -1.449 18933 12464 1 17 . 1 1 171 171 LYS N N 171 113.574 113.574 115.547 -1.973 18933 12465 1 17 . 1 1 171 171 LYS C C 171 176.416 176.416 177.568 -1.152 18933 12466 1 17 . 1 1 171 171 LYS CA C 171 57.605 57.605 58.160 -0.555 18933 12467 1 17 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.465 0.464 18933 12468 1 17 . 1 1 171 171 LYS H H 171 8.210 8.210 8.371 -0.161 18933 12469 1 17 . 1 1 172 172 LYS N N 172 117.313 117.313 118.585 -1.272 18933 12470 1 17 . 1 1 172 172 LYS C C 172 175.717 175.717 176.278 -0.561 18933 12471 1 17 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.088 -1.913 18933 12472 1 17 . 1 1 172 172 LYS CB C 172 31.612 31.612 33.117 -1.505 18933 12473 1 17 . 1 1 172 172 LYS H H 172 7.761 7.761 7.493 0.268 18933 12474 1 17 . 1 1 173 173 ARG N N 173 122.056 122.056 119.029 3.027 18933 12475 1 17 . 1 1 173 173 ARG C C 173 172.850 172.850 174.411 -1.561 18933 12476 1 17 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.704 0.174 18933 12477 1 17 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.852 -0.346 18933 12478 1 17 . 1 1 173 173 ARG H H 173 6.885 6.885 7.383 -0.498 18933 12479 1 18 . 1 1 2 2 LEU N N 2 122.812 122.812 120.477 2.335 18933 12480 1 18 . 1 1 2 2 LEU C C 2 175.742 175.742 176.406 -0.664 18933 12481 1 18 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.892 0.242 18933 12482 1 18 . 1 1 2 2 LEU CB C 2 42.842 42.842 44.851 -2.009 18933 12483 1 18 . 1 1 2 2 LEU H H 2 8.756 8.756 9.007 -0.251 18933 12484 1 18 . 1 1 3 3 THR N N 3 113.000 113.000 112.646 0.354 18933 12485 1 18 . 1 1 3 3 THR C C 3 175.938 175.938 175.730 0.208 18933 12486 1 18 . 1 1 3 3 THR CA C 3 60.550 60.550 60.545 0.005 18933 12487 1 18 . 1 1 3 3 THR CB C 3 70.781 70.781 70.497 0.284 18933 12488 1 18 . 1 1 3 3 THR H H 3 8.428 8.428 8.112 0.316 18933 12489 1 18 . 1 1 4 4 LEU N N 4 122.531 122.531 123.285 -0.754 18933 12490 1 18 . 1 1 4 4 LEU C C 4 178.463 178.463 178.560 -0.097 18933 12491 1 18 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.492 -0.363 18933 12492 1 18 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.011 -2.477 18933 12493 1 18 . 1 1 4 4 LEU H H 4 7.731 7.731 7.932 -0.201 18933 12494 1 18 . 1 1 5 5 ILE N N 5 115.505 115.505 116.546 -1.041 18933 12495 1 18 . 1 1 5 5 ILE C C 5 178.573 178.573 177.968 0.605 18933 12496 1 18 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.666 -0.928 18933 12497 1 18 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.312 -0.440 18933 12498 1 18 . 1 1 5 5 ILE H H 5 7.645 7.645 7.984 -0.339 18933 12499 1 18 . 1 1 6 6 GLN N N 6 121.626 121.626 119.507 2.119 18933 12500 1 18 . 1 1 6 6 GLN C C 6 179.014 179.014 178.797 0.217 18933 12501 1 18 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.079 -0.748 18933 12502 1 18 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.780 0.409 18933 12503 1 18 . 1 1 6 6 GLN H H 6 7.645 7.645 7.720 -0.075 18933 12504 1 18 . 1 1 7 7 GLY N N 7 107.684 107.684 106.883 0.801 18933 12505 1 18 . 1 1 7 7 GLY C C 7 174.749 174.749 176.186 -1.437 18933 12506 1 18 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.813 -0.023 18933 12507 1 18 . 1 1 7 7 GLY H H 7 8.660 8.660 8.159 0.501 18933 12508 1 18 . 1 1 8 8 LYS N N 8 120.942 120.942 122.630 -1.688 18933 12509 1 18 . 1 1 8 8 LYS C C 8 179.455 179.455 178.499 0.956 18933 12510 1 18 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.153 0.752 18933 12511 1 18 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.223 -0.801 18933 12512 1 18 . 1 1 8 8 LYS H H 8 8.518 8.518 7.654 0.864 18933 12513 1 18 . 1 1 9 9 LYS N N 9 120.710 120.710 119.516 1.194 18933 12514 1 18 . 1 1 9 9 LYS C C 9 179.823 179.823 179.029 0.794 18933 12515 1 18 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.801 -0.179 18933 12516 1 18 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.347 -1.052 18933 12517 1 18 . 1 1 9 9 LYS H H 9 7.731 7.731 8.204 -0.473 18933 12518 1 18 . 1 1 10 10 ILE N N 10 121.345 121.345 120.232 1.113 18933 12519 1 18 . 1 1 10 10 ILE C C 10 177.789 177.789 178.071 -0.282 18933 12520 1 18 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.880 -1.415 18933 12521 1 18 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.270 -1.905 18933 12522 1 18 . 1 1 10 10 ILE H H 10 7.711 7.711 8.226 -0.515 18933 12523 1 18 . 1 1 11 11 VAL N N 11 120.258 120.258 120.306 -0.048 18933 12524 1 18 . 1 1 11 11 VAL C C 11 177.372 177.372 177.756 -0.384 18933 12525 1 18 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.499 -0.048 18933 12526 1 18 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.705 -1.171 18933 12527 1 18 . 1 1 11 11 VAL H H 11 7.918 7.918 8.461 -0.543 18933 12528 1 18 . 1 1 12 12 ASN N N 12 116.971 116.971 117.823 -0.852 18933 12529 1 18 . 1 1 12 12 ASN C C 12 177.445 177.445 177.949 -0.504 18933 12530 1 18 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.210 -0.098 18933 12531 1 18 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.362 -0.729 18933 12532 1 18 . 1 1 12 12 ASN H H 12 7.993 7.993 8.620 -0.627 18933 12533 1 18 . 1 1 13 13 HIS N N 13 120.258 120.258 119.767 0.491 18933 12534 1 18 . 1 1 13 13 HIS C C 13 177.862 177.862 177.824 0.038 18933 12535 1 18 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.553 -0.456 18933 12536 1 18 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.531 0.701 18933 12537 1 18 . 1 1 13 13 HIS H H 13 7.741 7.741 8.311 -0.570 18933 12538 1 18 . 1 1 14 14 LEU N N 14 116.641 116.641 119.966 -3.325 18933 12539 1 18 . 1 1 14 14 LEU C C 14 179.186 179.186 178.361 0.825 18933 12540 1 18 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.357 -1.600 18933 12541 1 18 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.551 -0.432 18933 12542 1 18 . 1 1 14 14 LEU H H 14 8.221 8.221 8.587 -0.366 18933 12543 1 18 . 1 1 15 15 ARG N N 15 115.957 115.957 114.728 1.229 18933 12544 1 18 . 1 1 15 15 ARG C C 15 176.330 176.330 178.116 -1.786 18933 12545 1 18 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.648 1.055 18933 12546 1 18 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.410 -1.333 18933 12547 1 18 . 1 1 15 15 ARG H H 15 7.968 7.968 8.333 -0.365 18933 12548 1 18 . 1 1 16 16 SER N N 16 109.395 109.395 115.692 -6.297 18933 12549 1 18 . 1 1 16 16 SER C C 16 176.024 176.024 175.003 1.021 18933 12550 1 18 . 1 1 16 16 SER CA C 16 57.282 57.282 60.181 -2.899 18933 12551 1 18 . 1 1 16 16 SER CB C 16 63.683 63.683 63.531 0.152 18933 12552 1 18 . 1 1 16 16 SER H H 16 6.963 6.963 7.401 -0.438 18933 12553 1 18 . 1 1 17 17 ARG N N 17 122.775 122.775 121.919 0.856 18933 12554 1 18 . 1 1 17 17 ARG C C 17 174.590 174.590 174.072 0.518 18933 12555 1 18 . 1 1 17 17 ARG CA C 17 56.273 56.273 55.027 1.246 18933 12556 1 18 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.464 1.338 18933 12557 1 18 . 1 1 17 17 ARG H H 17 7.781 7.781 8.374 -0.593 18933 12558 1 18 . 1 1 18 18 LEU N N 18 122.421 122.421 125.844 -3.423 18933 12559 1 18 . 1 1 18 18 LEU C C 18 176.281 176.281 174.067 2.214 18933 12560 1 18 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.497 0.283 18933 12561 1 18 . 1 1 18 18 LEU CB C 18 43.211 43.211 47.024 -3.813 18933 12562 1 18 . 1 1 18 18 LEU H H 18 8.650 8.650 7.801 0.849 18933 12563 1 18 . 1 1 19 19 ALA N N 19 126.441 126.441 126.497 -0.056 18933 12564 1 18 . 1 1 19 19 ALA C C 19 173.904 173.904 174.836 -0.932 18933 12565 1 18 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.663 -0.797 18933 12566 1 18 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.262 0.603 18933 12567 1 18 . 1 1 19 19 ALA H H 19 8.609 8.609 8.916 -0.307 18933 12568 1 18 . 1 1 20 20 PHE N N 20 114.600 114.600 119.486 -4.886 18933 12569 1 18 . 1 1 20 20 PHE C C 20 172.592 172.592 173.897 -1.305 18933 12570 1 18 . 1 1 20 20 PHE CA C 20 55.789 55.789 55.006 0.783 18933 12571 1 18 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.583 -0.894 18933 12572 1 18 . 1 1 20 20 PHE H H 20 8.801 8.801 9.184 -0.383 18933 12573 1 18 . 1 1 21 21 GLU N N 21 122.873 122.873 123.982 -1.109 18933 12574 1 18 . 1 1 21 21 GLU C C 21 174.872 174.872 175.239 -0.367 18933 12575 1 18 . 1 1 21 21 GLU CA C 21 55.062 55.062 54.990 0.072 18933 12576 1 18 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.106 -0.381 18933 12577 1 18 . 1 1 21 21 GLU H H 21 7.847 7.847 9.332 -1.485 18933 12578 1 18 . 1 1 22 22 TYR N N 22 126.270 126.270 126.853 -0.583 18933 12579 1 18 . 1 1 22 22 TYR C C 22 174.872 174.872 174.697 0.175 18933 12580 1 18 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.711 -0.963 18933 12581 1 18 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.239 -1.134 18933 12582 1 18 . 1 1 22 22 TYR H H 22 8.806 8.806 9.148 -0.342 18933 12583 1 18 . 1 1 23 23 ASN N N 23 128.420 128.420 125.797 2.623 18933 12584 1 18 . 1 1 23 23 ASN C C 23 175.435 175.435 175.147 0.288 18933 12585 1 18 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.600 -0.595 18933 12586 1 18 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.636 -1.271 18933 12587 1 18 . 1 1 23 23 ASN H H 23 8.943 8.943 9.130 -0.187 18933 12588 1 18 . 1 1 24 24 GLY N N 24 104.067 104.067 102.250 1.817 18933 12589 1 18 . 1 1 24 24 GLY C C 24 173.707 173.707 173.843 -0.136 18933 12590 1 18 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.947 -0.013 18933 12591 1 18 . 1 1 24 24 GLY H H 24 8.534 8.534 8.156 0.378 18933 12592 1 18 . 1 1 25 25 GLN N N 25 120.038 120.038 119.874 0.164 18933 12593 1 18 . 1 1 25 25 GLN C C 25 173.744 173.744 174.978 -1.234 18933 12594 1 18 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.499 -1.172 18933 12595 1 18 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.095 0.566 18933 12596 1 18 . 1 1 25 25 GLN H H 25 7.595 7.595 7.824 -0.229 18933 12597 1 18 . 1 1 26 26 LEU N N 26 124.681 124.681 124.806 -0.125 18933 12598 1 18 . 1 1 26 26 LEU C C 26 175.987 175.987 175.965 0.022 18933 12599 1 18 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.431 -0.418 18933 12600 1 18 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.434 -1.569 18933 12601 1 18 . 1 1 26 26 LEU H H 26 8.382 8.382 8.605 -0.223 18933 12602 1 18 . 1 1 27 27 ILE N N 27 130.779 130.779 126.397 4.382 18933 12603 1 18 . 1 1 27 27 ILE C C 27 175.215 175.215 174.545 0.670 18933 12604 1 18 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.712 -0.453 18933 12605 1 18 . 1 1 27 27 ILE CB C 27 35.732 35.732 37.915 -2.183 18933 12606 1 18 . 1 1 27 27 ILE H H 27 8.882 8.882 8.827 0.055 18933 12607 1 18 . 1 1 28 28 LYS N N 28 126.160 126.160 127.633 -1.473 18933 12608 1 18 . 1 1 28 28 LYS C C 28 176.771 176.771 175.662 1.109 18933 12609 1 18 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.841 1.997 18933 12610 1 18 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.188 -1.449 18933 12611 1 18 . 1 1 28 28 LYS H H 28 8.165 8.165 8.361 -0.196 18933 12612 1 18 . 1 1 29 29 ILE N N 29 126.380 126.380 122.220 4.160 18933 12613 1 18 . 1 1 29 29 ILE C C 29 175.877 175.877 174.321 1.556 18933 12614 1 18 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.547 -0.239 18933 12615 1 18 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.691 -2.628 18933 12616 1 18 . 1 1 29 29 ILE H H 29 8.019 8.019 8.654 -0.635 18933 12617 1 18 . 1 1 30 30 LEU N N 30 129.215 129.215 122.168 7.047 18933 12618 1 18 . 1 1 30 30 LEU C C 30 178.867 178.867 178.096 0.771 18933 12619 1 18 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.331 1.288 18933 12620 1 18 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.635 -4.770 18933 12621 1 18 . 1 1 30 30 LEU H H 30 8.917 8.917 8.308 0.609 18933 12622 1 18 . 1 1 31 31 SER N N 31 117.997 117.997 116.148 1.849 18933 12623 1 18 . 1 1 31 31 SER C C 31 177.396 177.396 175.668 1.728 18933 12624 1 18 . 1 1 31 31 SER CA C 31 61.236 61.236 60.870 0.366 18933 12625 1 18 . 1 1 31 31 SER CB C 31 62.035 62.035 63.208 -1.173 18933 12626 1 18 . 1 1 31 31 SER H H 31 8.594 8.594 8.865 -0.271 18933 12627 1 18 . 1 1 32 32 LYS N N 32 116.189 116.189 119.303 -3.114 18933 12628 1 18 . 1 1 32 32 LYS C C 32 176.244 176.244 177.100 -0.856 18933 12629 1 18 . 1 1 32 32 LYS CA C 32 57.403 57.403 57.951 -0.548 18933 12630 1 18 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.466 -2.185 18933 12631 1 18 . 1 1 32 32 LYS H H 32 8.029 8.029 8.325 -0.296 18933 12632 1 18 . 1 1 33 33 ASN N N 33 119.061 119.061 115.054 4.007 18933 12633 1 18 . 1 1 33 33 ASN C C 33 172.384 172.384 174.170 -1.786 18933 12634 1 18 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.874 -1.717 18933 12635 1 18 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.191 -2.924 18933 12636 1 18 . 1 1 33 33 ASN H H 33 7.902 7.902 7.841 0.061 18933 12637 1 18 . 1 1 34 34 ILE N N 34 120.038 120.038 119.429 0.609 18933 12638 1 18 . 1 1 34 34 ILE C C 34 175.607 175.607 174.197 1.410 18933 12639 1 18 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.249 0.301 18933 12640 1 18 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.705 -2.741 18933 12641 1 18 . 1 1 34 34 ILE H H 34 7.443 7.443 7.846 -0.403 18933 12642 1 18 . 1 1 35 35 VAL N N 35 129.435 129.435 125.718 3.717 18933 12643 1 18 . 1 1 35 35 VAL C C 35 175.386 175.386 174.537 0.849 18933 12644 1 18 . 1 1 35 35 VAL CA C 35 60.026 60.026 59.792 0.234 18933 12645 1 18 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.622 -0.841 18933 12646 1 18 . 1 1 35 35 VAL H H 35 9.533 9.533 8.807 0.726 18933 12647 1 18 . 1 1 36 36 ALA N N 36 130.571 130.571 129.376 1.195 18933 12648 1 18 . 1 1 36 36 ALA C C 36 177.347 177.347 176.270 1.077 18933 12649 1 18 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.538 0.861 18933 12650 1 18 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.891 -1.033 18933 12651 1 18 . 1 1 36 36 ALA H H 36 8.665 8.665 8.400 0.265 18933 12652 1 18 . 1 1 37 37 VAL N N 37 115.395 115.395 121.114 -5.719 18933 12653 1 18 . 1 1 37 37 VAL C C 37 174.455 174.455 176.047 -1.592 18933 12654 1 18 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.271 0.109 18933 12655 1 18 . 1 1 37 37 VAL CB C 37 32.943 32.943 34.875 -1.932 18933 12656 1 18 . 1 1 37 37 VAL H H 37 8.079 8.079 8.282 -0.203 18933 12657 1 18 . 1 1 38 38 GLY N N 38 107.672 107.672 107.752 -0.080 18933 12658 1 18 . 1 1 38 38 GLY C C 38 173.364 173.364 175.763 -2.399 18933 12659 1 18 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.248 -0.063 18933 12660 1 18 . 1 1 38 38 GLY H H 38 7.579 7.579 8.258 -0.679 18933 12661 1 18 . 1 1 39 39 SER N N 39 121.052 121.052 119.430 1.622 18933 12662 1 18 . 1 1 39 39 SER C C 39 175.570 175.570 176.720 -1.150 18933 12663 1 18 . 1 1 39 39 SER CA C 39 61.801 61.801 62.041 -0.240 18933 12664 1 18 . 1 1 39 39 SER CB C 39 62.478 62.478 63.208 -0.730 18933 12665 1 18 . 1 1 39 39 SER H H 39 8.953 8.953 8.040 0.913 18933 12666 1 18 . 1 1 40 40 LEU N N 40 121.553 121.553 121.552 0.001 18933 12667 1 18 . 1 1 40 40 LEU C C 40 180.203 180.203 178.106 2.097 18933 12668 1 18 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.254 -0.124 18933 12669 1 18 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.934 -0.181 18933 12670 1 18 . 1 1 40 40 LEU H H 40 8.195 8.195 7.278 0.917 18933 12671 1 18 . 1 1 41 41 ARG N N 41 121.956 121.956 117.247 4.709 18933 12672 1 18 . 1 1 41 41 ARG C C 41 177.323 177.323 177.804 -0.481 18933 12673 1 18 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.950 0.381 18933 12674 1 18 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.989 -1.546 18933 12675 1 18 . 1 1 41 41 ARG H H 41 6.873 6.873 7.369 -0.496 18933 12676 1 18 . 1 1 42 42 ARG N N 42 114.600 114.600 116.289 -1.689 18933 12677 1 18 . 1 1 42 42 ARG C C 42 172.911 172.911 175.780 -2.869 18933 12678 1 18 . 1 1 42 42 ARG CA C 42 57.242 57.242 56.715 0.527 18933 12679 1 18 . 1 1 42 42 ARG CB C 42 29.140 29.140 31.198 -2.058 18933 12680 1 18 . 1 1 42 42 ARG H H 42 7.438 7.438 8.029 -0.591 18933 12681 1 18 . 1 1 43 43 GLU N N 43 113.354 113.354 117.616 -4.262 18933 12682 1 18 . 1 1 43 43 GLU C C 43 175.999 175.999 175.523 0.476 18933 12683 1 18 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.318 -0.762 18933 12684 1 18 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.688 -2.351 18933 12685 1 18 . 1 1 43 43 GLU H H 43 7.564 7.564 8.131 -0.567 18933 12686 1 18 . 1 1 44 44 GLU N N 44 119.696 119.696 122.960 -3.264 18933 12687 1 18 . 1 1 44 44 GLU C C 44 175.423 175.423 176.807 -1.384 18933 12688 1 18 . 1 1 44 44 GLU CA C 44 56.838 56.838 57.770 -0.932 18933 12689 1 18 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.534 -1.837 18933 12690 1 18 . 1 1 44 44 GLU H H 44 7.261 7.261 8.623 -1.362 18933 12691 1 18 . 1 1 45 45 LYS N N 45 117.435 117.435 116.247 1.188 18933 12692 1 18 . 1 1 45 45 LYS C C 45 177.715 177.715 175.336 2.379 18933 12693 1 18 . 1 1 45 45 LYS CA C 45 59.219 59.219 56.904 2.314 18933 12694 1 18 . 1 1 45 45 LYS CB C 45 32.119 32.119 34.270 -2.151 18933 12695 1 18 . 1 1 45 45 LYS H H 45 7.938 7.938 8.264 -0.326 18933 12696 1 18 . 1 1 46 46 MET N N 46 115.847 115.847 118.249 -2.402 18933 12697 1 18 . 1 1 46 46 MET CA C 46 52.520 52.520 54.024 -1.504 18933 12698 1 18 . 1 1 46 46 MET CB C 46 33.450 33.450 35.387 -1.937 18933 12699 1 18 . 1 1 46 46 MET H H 46 7.595 7.595 7.623 -0.028 18933 12700 1 18 . 1 1 47 47 LEU N N 47 121.627 121.627 122.599 -0.972 18933 12701 1 18 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.192 -1.066 18933 12702 1 18 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.914 -0.844 18933 12703 1 18 . 1 1 47 47 LEU H H 47 9.220 9.220 8.945 0.275 18933 12704 1 18 . 1 1 49 49 ASP N N 49 117.093 117.093 117.058 0.035 18933 12705 1 18 . 1 1 49 49 ASP C C 49 173.340 173.340 174.409 -1.069 18933 12706 1 18 . 1 1 49 49 ASP CA C 49 51.794 51.794 52.661 -0.868 18933 12707 1 18 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.173 -1.167 18933 12708 1 18 . 1 1 49 49 ASP H H 49 7.761 7.761 7.615 0.146 18933 12709 1 18 . 1 1 50 50 VAL N N 50 119.012 119.012 115.669 3.343 18933 12710 1 18 . 1 1 50 50 VAL C C 50 173.070 173.070 173.886 -0.816 18933 12711 1 18 . 1 1 50 50 VAL CA C 50 61.842 61.842 59.857 1.985 18933 12712 1 18 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.481 -0.918 18933 12713 1 18 . 1 1 50 50 VAL H H 50 8.089 8.089 8.377 -0.288 18933 12714 1 18 . 1 1 51 51 ASP N N 51 127.064 127.064 125.622 1.442 18933 12715 1 18 . 1 1 51 51 ASP C C 51 174.565 174.565 175.387 -0.822 18933 12716 1 18 . 1 1 51 51 ASP CA C 51 52.157 52.157 53.011 -0.854 18933 12717 1 18 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.267 -0.627 18933 12718 1 18 . 1 1 51 51 ASP H H 51 8.069 8.069 8.047 0.022 18933 12719 1 18 . 1 1 52 52 LEU N N 52 121.627 121.627 119.930 1.697 18933 12720 1 18 . 1 1 52 52 LEU C C 52 174.063 174.063 174.821 -0.758 18933 12721 1 18 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.350 -0.668 18933 12722 1 18 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.271 -2.920 18933 12723 1 18 . 1 1 52 52 LEU H H 52 8.852 8.852 9.049 -0.197 18933 12724 1 18 . 1 1 53 53 LEU N N 53 123.093 123.093 123.303 -0.210 18933 12725 1 18 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.255 1.736 18933 12726 1 18 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.526 -2.393 18933 12727 1 18 . 1 1 53 53 LEU H H 53 9.362 9.362 9.072 0.290 18933 12728 1 18 . 1 1 54 54 ILE N N 54 123.777 123.777 129.300 -5.523 18933 12729 1 18 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.164 -4.102 18933 12730 1 18 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.426 -7.356 18933 12731 1 18 . 1 1 54 54 ILE H H 54 8.907 8.907 9.348 -0.441 18933 12732 1 18 . 1 1 58 58 GLU N N 58 114.710 114.710 117.726 -3.016 18933 12733 1 18 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.281 -0.903 18933 12734 1 18 . 1 1 58 58 GLU CB C 58 31.422 31.422 33.313 -1.891 18933 12735 1 18 . 1 1 58 58 GLU H H 58 6.716 6.716 7.511 -0.795 18933 12736 1 18 . 1 1 61 61 LEU N N 61 115.957 115.957 119.981 -4.024 18933 12737 1 18 . 1 1 61 61 LEU C C 61 178.512 178.512 178.134 0.378 18933 12738 1 18 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.090 -2.310 18933 12739 1 18 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.427 -0.308 18933 12740 1 18 . 1 1 61 61 LEU H H 61 7.307 7.307 7.954 -0.647 18933 12741 1 18 . 1 1 62 62 LEU N N 62 120.038 120.038 119.208 0.830 18933 12742 1 18 . 1 1 62 62 LEU C C 62 177.874 177.874 178.784 -0.910 18933 12743 1 18 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.498 0.438 18933 12744 1 18 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.938 -1.199 18933 12745 1 18 . 1 1 62 62 LEU H H 62 7.327 7.327 8.157 -0.830 18933 12746 1 18 . 1 1 63 63 LYS N N 63 114.600 114.600 115.854 -1.254 18933 12747 1 18 . 1 1 63 63 LYS C C 63 175.460 175.460 177.478 -2.018 18933 12748 1 18 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.776 -1.212 18933 12749 1 18 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.440 -1.715 18933 12750 1 18 . 1 1 63 63 LYS H H 63 7.973 7.973 7.726 0.247 18933 12751 1 18 . 1 1 64 64 HIS N N 64 115.273 115.273 115.550 -0.277 18933 12752 1 18 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.323 0.789 18933 12753 1 18 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.051 2.385 18933 12754 1 18 . 1 1 64 64 HIS H H 64 7.544 7.544 7.569 -0.025 18933 12755 1 18 . 1 1 65 65 VAL N N 65 118.682 118.682 120.041 -1.359 18933 12756 1 18 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.797 3.241 18933 12757 1 18 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.320 -2.293 18933 12758 1 18 . 1 1 65 65 VAL H H 65 6.787 6.787 7.271 -0.484 18933 12759 1 18 . 1 1 68 68 ASN N N 68 112.108 112.108 118.008 -5.900 18933 12760 1 18 . 1 1 68 68 ASN C C 68 174.884 174.884 173.904 0.980 18933 12761 1 18 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.422 -1.395 18933 12762 1 18 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.542 0.690 18933 12763 1 18 . 1 1 68 68 ASN H H 68 7.009 7.009 8.353 -1.344 18933 12764 1 18 . 1 1 69 69 ILE N N 69 123.325 123.325 123.439 -0.114 18933 12765 1 18 . 1 1 69 69 ILE C C 69 174.394 174.394 175.552 -1.158 18933 12766 1 18 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.666 -1.559 18933 12767 1 18 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.723 -0.456 18933 12768 1 18 . 1 1 69 69 ILE H H 69 7.150 7.150 8.358 -1.208 18933 12769 1 18 . 1 1 70 70 ARG N N 70 126.722 126.722 128.570 -1.848 18933 12770 1 18 . 1 1 70 70 ARG C C 70 174.590 174.590 173.996 0.594 18933 12771 1 18 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.423 -1.176 18933 12772 1 18 . 1 1 70 70 ARG CB C 70 32.372 32.372 35.016 -2.644 18933 12773 1 18 . 1 1 70 70 ARG H H 70 8.902 8.902 9.256 -0.354 18933 12774 1 18 . 1 1 71 71 ILE N N 71 119.978 119.978 121.165 -1.187 18933 12775 1 18 . 1 1 71 71 ILE C C 71 175.583 175.583 175.656 -0.073 18933 12776 1 18 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.668 0.156 18933 12777 1 18 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.617 -2.857 18933 12778 1 18 . 1 1 71 71 ILE H H 71 7.491 7.491 8.841 -1.350 18933 12779 1 18 . 1 1 72 72 LYS N N 72 128.530 128.530 125.620 2.910 18933 12780 1 18 . 1 1 72 72 LYS C C 72 177.703 177.703 176.515 1.188 18933 12781 1 18 . 1 1 72 72 LYS CA C 72 57.201 57.201 55.997 1.204 18933 12782 1 18 . 1 1 72 72 LYS CB C 72 31.485 31.485 31.062 0.423 18933 12783 1 18 . 1 1 72 72 LYS H H 72 8.523 8.523 8.663 -0.140 18933 12784 1 18 . 1 1 73 73 GLY N N 73 113.806 113.806 110.935 2.871 18933 12785 1 18 . 1 1 73 73 GLY C C 73 173.781 173.781 172.958 0.823 18933 12786 1 18 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.184 0.638 18933 12787 1 18 . 1 1 73 73 GLY H H 73 8.791 8.791 8.677 0.114 18933 12788 1 18 . 1 1 74 74 LEU N N 74 120.490 120.490 117.903 2.587 18933 12789 1 18 . 1 1 74 74 LEU C C 74 175.840 175.840 173.605 2.235 18933 12790 1 18 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.405 -0.714 18933 12791 1 18 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.031 -0.870 18933 12792 1 18 . 1 1 74 74 LEU H H 74 7.393 7.393 7.290 0.103 18933 12793 1 18 . 1 1 75 75 SER N N 75 120.038 120.038 115.656 4.382 18933 12794 1 18 . 1 1 75 75 SER C C 75 173.205 173.205 173.303 -0.098 18933 12795 1 18 . 1 1 75 75 SER CA C 75 57.887 57.887 57.656 0.231 18933 12796 1 18 . 1 1 75 75 SER CB C 75 63.049 63.049 64.857 -1.808 18933 12797 1 18 . 1 1 75 75 SER H H 75 8.917 8.917 8.108 0.809 18933 12798 1 18 . 1 1 76 76 PHE N N 76 119.586 119.586 117.689 1.897 18933 12799 1 18 . 1 1 76 76 PHE C C 76 173.536 173.536 173.791 -0.255 18933 12800 1 18 . 1 1 76 76 PHE CA C 76 55.426 55.426 56.269 -0.843 18933 12801 1 18 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.391 -0.385 18933 12802 1 18 . 1 1 76 76 PHE H H 76 8.003 8.003 8.389 -0.386 18933 12803 1 18 . 1 1 77 77 SER N N 77 114.943 114.943 115.028 -0.085 18933 12804 1 18 . 1 1 77 77 SER C C 77 173.438 173.438 172.361 1.077 18933 12805 1 18 . 1 1 77 77 SER CA C 77 56.152 56.152 57.047 -0.895 18933 12806 1 18 . 1 1 77 77 SER CB C 77 65.204 65.204 65.862 -0.658 18933 12807 1 18 . 1 1 77 77 SER H H 77 8.907 8.907 8.695 0.212 18933 12808 1 18 . 1 1 78 78 VAL N N 78 124.791 124.791 124.022 0.769 18933 12809 1 18 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.431 1.613 18933 12810 1 18 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.178 -1.996 18933 12811 1 18 . 1 1 78 78 VAL H H 78 8.892 8.892 8.342 0.550 18933 12812 1 18 . 1 1 79 79 LYS N N 79 129.667 129.667 129.462 0.205 18933 12813 1 18 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.067 2.125 18933 12814 1 18 . 1 1 79 79 LYS CB C 79 32.372 32.372 32.919 -0.547 18933 12815 1 18 . 1 1 79 79 LYS H H 79 9.049 9.049 8.761 0.288 18933 12816 1 18 . 1 1 82 82 GLY N N 82 117.263 117.263 112.114 5.149 18933 12817 1 18 . 1 1 82 82 GLY C C 82 171.710 171.710 174.518 -2.808 18933 12818 1 18 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.700 -2.776 18933 12819 1 18 . 1 1 82 82 GLY H H 82 8.044 8.044 8.421 -0.377 18933 12820 1 18 . 1 1 83 83 GLU N N 83 117.203 117.203 120.611 -3.408 18933 12821 1 18 . 1 1 83 83 GLU C C 83 178.695 178.695 178.006 0.689 18933 12822 1 18 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.397 1.580 18933 12823 1 18 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.637 0.201 18933 12824 1 18 . 1 1 83 83 GLU H H 83 8.296 8.296 8.487 -0.191 18933 12825 1 18 . 1 1 84 84 ARG N N 84 113.818 113.818 120.119 -6.301 18933 12826 1 18 . 1 1 84 84 ARG C C 84 175.877 175.877 174.877 1.000 18933 12827 1 18 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.111 -1.380 18933 12828 1 18 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.096 2.199 18933 12829 1 18 . 1 1 84 84 ARG H H 84 8.342 8.342 7.915 0.427 18933 12830 1 18 . 1 1 85 85 LYS N N 85 119.354 119.354 121.361 -2.007 18933 12831 1 18 . 1 1 85 85 LYS C C 85 174.516 174.516 174.331 0.185 18933 12832 1 18 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.721 -0.981 18933 12833 1 18 . 1 1 85 85 LYS CB C 85 34.844 34.844 34.650 0.194 18933 12834 1 18 . 1 1 85 85 LYS H H 85 6.822 6.822 7.562 -0.740 18933 12835 1 18 . 1 1 86 86 CYS N N 86 125.928 125.928 125.049 0.879 18933 12836 1 18 . 1 1 86 86 CYS C C 86 171.600 171.600 173.003 -1.403 18933 12837 1 18 . 1 1 86 86 CYS CA C 86 55.627 55.627 58.240 -2.613 18933 12838 1 18 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.210 0.134 18933 12839 1 18 . 1 1 86 86 CYS H H 86 9.084 9.084 9.499 -0.415 18933 12840 1 18 . 1 1 87 87 VAL N N 87 126.612 126.612 126.586 0.026 18933 12841 1 18 . 1 1 87 87 VAL C C 87 174.431 174.431 174.747 -0.316 18933 12842 1 18 . 1 1 87 87 VAL CA C 87 61.317 61.317 62.310 -0.993 18933 12843 1 18 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.242 0.954 18933 12844 1 18 . 1 1 87 87 VAL H H 87 8.705 8.705 8.891 -0.186 18933 12845 1 18 . 1 1 88 88 LEU N N 88 127.748 127.748 123.139 4.609 18933 12846 1 18 . 1 1 88 88 LEU C C 88 175.227 175.227 174.718 0.509 18933 12847 1 18 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.871 -0.351 18933 12848 1 18 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.153 -1.548 18933 12849 1 18 . 1 1 88 88 LEU H H 88 9.417 9.417 8.704 0.713 18933 12850 1 18 . 1 1 89 89 PHE N N 89 120.981 120.981 118.984 1.997 18933 12851 1 18 . 1 1 89 89 PHE C C 89 176.906 176.906 176.088 0.818 18933 12852 1 18 . 1 1 89 89 PHE CA C 89 55.587 55.587 56.160 -0.573 18933 12853 1 18 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.966 -3.065 18933 12854 1 18 . 1 1 89 89 PHE H H 89 8.937 8.937 8.692 0.245 18933 12855 1 18 . 1 1 90 90 ILE N N 90 119.928 119.928 118.697 1.231 18933 12856 1 18 . 1 1 90 90 ILE C C 90 173.781 173.781 174.973 -1.192 18933 12857 1 18 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.836 -1.182 18933 12858 1 18 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.363 1.249 18933 12859 1 18 . 1 1 90 90 ILE H H 90 9.230 9.230 9.089 0.141 18933 12860 1 18 . 1 1 91 91 GLU N N 91 124.339 124.339 124.823 -0.484 18933 12861 1 18 . 1 1 91 91 GLU C C 91 175.607 175.607 175.233 0.374 18933 12862 1 18 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.912 -0.293 18933 12863 1 18 . 1 1 91 91 GLU CB C 91 29.837 29.837 32.592 -2.755 18933 12864 1 18 . 1 1 91 91 GLU H H 91 8.175 8.175 8.984 -0.809 18933 12865 1 18 . 1 1 92 92 TRP N N 92 127.516 127.516 124.837 2.679 18933 12866 1 18 . 1 1 92 92 TRP C C 92 175.203 175.203 176.322 -1.119 18933 12867 1 18 . 1 1 92 92 TRP CA C 92 56.233 56.233 55.346 0.887 18933 12868 1 18 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.471 1.190 18933 12869 1 18 . 1 1 92 92 TRP H H 92 9.306 9.306 8.918 0.388 18933 12870 1 18 . 1 1 93 93 GLU N N 93 127.834 127.834 126.766 1.068 18933 12871 1 18 . 1 1 93 93 GLU C C 93 175.668 175.668 176.352 -0.684 18933 12872 1 18 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.388 -0.510 18933 12873 1 18 . 1 1 93 93 GLU CB C 93 26.034 26.034 28.420 -2.386 18933 12874 1 18 . 1 1 93 93 GLU H H 93 8.796 8.796 9.207 -0.411 18933 12875 1 18 . 1 1 94 94 LYS N N 94 108.931 108.931 112.167 -3.236 18933 12876 1 18 . 1 1 94 94 LYS C C 94 175.423 175.423 176.426 -1.003 18933 12877 1 18 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.578 -0.135 18933 12878 1 18 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.133 -2.500 18933 12879 1 18 . 1 1 94 94 LYS H H 94 8.498 8.498 8.565 -0.067 18933 12880 1 18 . 1 1 95 95 LYS N N 95 121.737 121.737 120.222 1.515 18933 12881 1 18 . 1 1 95 95 LYS C C 95 174.443 174.443 174.917 -0.474 18933 12882 1 18 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.564 -2.147 18933 12883 1 18 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.400 0.064 18933 12884 1 18 . 1 1 95 95 LYS H H 95 7.761 7.761 7.636 0.125 18933 12885 1 18 . 1 1 96 96 THR N N 96 116.067 116.067 114.255 1.812 18933 12886 1 18 . 1 1 96 96 THR C C 96 174.296 174.296 173.645 0.651 18933 12887 1 18 . 1 1 96 96 THR CA C 96 61.115 61.115 61.600 -0.485 18933 12888 1 18 . 1 1 96 96 THR CB C 96 69.450 69.450 71.622 -2.172 18933 12889 1 18 . 1 1 96 96 THR H H 96 7.761 7.761 8.396 -0.635 18933 12890 1 18 . 1 1 97 97 TYR N N 97 124.229 124.229 124.631 -0.402 18933 12891 1 18 . 1 1 97 97 TYR C C 97 173.536 173.536 173.400 0.136 18933 12892 1 18 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.879 -0.929 18933 12893 1 18 . 1 1 97 97 TYR CB C 97 41.182 41.182 43.052 -1.870 18933 12894 1 18 . 1 1 97 97 TYR H H 97 9.018 9.018 9.296 -0.278 18933 12895 1 18 . 1 1 98 98 GLN N N 98 123.435 123.435 126.544 -3.109 18933 12896 1 18 . 1 1 98 98 GLN C C 98 173.266 173.266 173.407 -0.141 18933 12897 1 18 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.271 -0.128 18933 12898 1 18 . 1 1 98 98 GLN CB C 98 29.013 29.013 30.080 -1.067 18933 12899 1 18 . 1 1 98 98 GLN H H 98 8.781 8.781 8.807 -0.026 18933 12900 1 18 . 1 1 99 99 LEU N N 99 130.119 130.119 129.713 0.406 18933 12901 1 18 . 1 1 99 99 LEU C C 99 173.867 173.867 174.037 -0.170 18933 12902 1 18 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.109 -0.589 18933 12903 1 18 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.469 -0.864 18933 12904 1 18 . 1 1 99 99 LEU H H 99 9.104 9.104 8.868 0.236 18933 12905 1 18 . 1 1 100 100 ASP N N 100 125.182 125.182 127.758 -2.576 18933 12906 1 18 . 1 1 100 100 ASP C C 100 172.837 172.837 174.291 -1.454 18933 12907 1 18 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.714 -1.960 18933 12908 1 18 . 1 1 100 100 ASP CB C 100 39.344 39.344 42.858 -3.514 18933 12909 1 18 . 1 1 100 100 ASP H H 100 9.089 9.089 8.621 0.468 18933 12910 1 18 . 1 1 101 101 LEU N N 101 121.174 121.174 127.870 -6.696 18933 12911 1 18 . 1 1 101 101 LEU C C 101 174.529 174.529 174.562 -0.033 18933 12912 1 18 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.759 -1.844 18933 12913 1 18 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.496 -1.588 18933 12914 1 18 . 1 1 101 101 LEU H H 101 8.458 8.458 9.233 -0.775 18933 12915 1 18 . 1 1 102 102 PHE N N 102 119.464 119.464 125.315 -5.851 18933 12916 1 18 . 1 1 102 102 PHE C C 102 176.293 176.293 175.135 1.158 18933 12917 1 18 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.116 -1.062 18933 12918 1 18 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.210 -0.330 18933 12919 1 18 . 1 1 102 102 PHE H H 102 8.281 8.281 9.267 -0.986 18933 12920 1 18 . 1 1 103 103 THR N N 103 108.576 108.576 116.792 -8.216 18933 12921 1 18 . 1 1 103 103 THR C C 103 174.933 174.933 173.369 1.564 18933 12922 1 18 . 1 1 103 103 THR CA C 103 57.726 57.726 60.304 -2.578 18933 12923 1 18 . 1 1 103 103 THR CB C 103 71.288 71.288 69.772 1.516 18933 12924 1 18 . 1 1 103 103 THR H H 103 7.872 7.872 8.366 -0.494 18933 12925 1 18 . 1 1 104 104 ALA N N 104 122.885 122.885 128.451 -5.566 18933 12926 1 18 . 1 1 104 104 ALA C C 104 175.754 175.754 175.079 0.675 18933 12927 1 18 . 1 1 104 104 ALA CA C 104 50.018 50.018 50.054 -0.036 18933 12928 1 18 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.379 0.106 18933 12929 1 18 . 1 1 104 104 ALA H H 104 8.660 8.660 9.277 -0.617 18933 12930 1 18 . 1 1 105 105 LEU N N 105 120.881 120.881 119.232 1.649 18933 12931 1 18 . 1 1 105 105 LEU C C 105 179.504 179.504 179.053 0.451 18933 12932 1 18 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.365 -1.118 18933 12933 1 18 . 1 1 105 105 LEU CB C 105 41.753 41.753 43.450 -1.697 18933 12934 1 18 . 1 1 105 105 LEU H H 105 8.226 8.226 8.403 -0.177 18933 12935 1 18 . 1 1 106 106 ALA N N 106 124.901 124.901 124.872 0.029 18933 12936 1 18 . 1 1 106 106 ALA C C 106 181.269 181.269 179.345 1.924 18933 12937 1 18 . 1 1 106 106 ALA CA C 106 56.313 56.313 55.001 1.312 18933 12938 1 18 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.776 -1.552 18933 12939 1 18 . 1 1 106 106 ALA H H 106 8.392 8.392 8.673 -0.281 18933 12940 1 18 . 1 1 107 107 GLU N N 107 116.409 116.409 115.053 1.356 18933 12941 1 18 . 1 1 107 107 GLU C C 107 177.764 177.764 176.685 1.079 18933 12942 1 18 . 1 1 107 107 GLU CA C 107 58.533 58.533 57.899 0.634 18933 12943 1 18 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.568 -1.632 18933 12944 1 18 . 1 1 107 107 GLU H H 107 9.664 9.664 8.549 1.115 18933 12945 1 18 . 1 1 108 108 GLU N N 108 116.189 116.189 117.948 -1.759 18933 12946 1 18 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.188 -1.044 18933 12947 1 18 . 1 1 108 108 GLU CB C 108 29.837 29.837 30.021 -0.184 18933 12948 1 18 . 1 1 108 108 GLU H H 108 7.589 7.589 7.736 -0.147 18933 12949 1 18 . 1 1 109 109 LYS N N 109 119.928 119.928 121.195 -1.267 18933 12950 1 18 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.615 1.236 18933 12951 1 18 . 1 1 109 109 LYS CB C 109 30.471 30.471 31.026 -0.555 18933 12952 1 18 . 1 1 109 109 LYS H H 109 7.514 7.514 7.497 0.017 18933 12953 1 18 . 1 1 111 111 TYR N N 111 114.930 114.930 118.914 -3.984 18933 12954 1 18 . 1 1 111 111 TYR C C 111 179.504 179.504 177.876 1.628 18933 12955 1 18 . 1 1 111 111 TYR CA C 111 59.017 59.017 60.263 -1.246 18933 12956 1 18 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.356 -1.688 18933 12957 1 18 . 1 1 111 111 TYR H H 111 6.393 6.393 8.422 -2.029 18933 12958 1 18 . 1 1 112 112 ALA N N 112 124.901 124.901 122.322 2.579 18933 12959 1 18 . 1 1 112 112 ALA C C 112 179.173 179.173 179.684 -0.511 18933 12960 1 18 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.552 -0.651 18933 12961 1 18 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.267 -0.155 18933 12962 1 18 . 1 1 112 112 ALA H H 112 8.554 8.554 8.063 0.491 18933 12963 1 18 . 1 1 113 113 ILE N N 113 119.464 119.464 119.748 -0.284 18933 12964 1 18 . 1 1 113 113 ILE C C 113 178.499 178.499 177.736 0.763 18933 12965 1 18 . 1 1 113 113 ILE CA C 113 66.281 66.281 63.953 2.329 18933 12966 1 18 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.931 -0.614 18933 12967 1 18 . 1 1 113 113 ILE H H 113 8.680 8.680 7.699 0.981 18933 12968 1 18 . 1 1 114 114 PHE N N 114 122.922 122.922 122.072 0.850 18933 12969 1 18 . 1 1 114 114 PHE C C 114 178.217 178.217 177.999 0.218 18933 12970 1 18 . 1 1 114 114 PHE CA C 114 61.559 61.559 59.997 1.562 18933 12971 1 18 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.787 0.684 18933 12972 1 18 . 1 1 114 114 PHE H H 114 7.721 7.721 8.621 -0.900 18933 12973 1 18 . 1 1 115 115 HIS N N 115 118.560 118.560 118.615 -0.055 18933 12974 1 18 . 1 1 115 115 HIS C C 115 177.286 177.286 176.507 0.779 18933 12975 1 18 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.446 -0.066 18933 12976 1 18 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.298 1.567 18933 12977 1 18 . 1 1 115 115 HIS H H 115 8.155 8.155 8.407 -0.252 18933 12978 1 18 . 1 1 116 116 PHE N N 116 111.472 111.472 116.559 -5.087 18933 12979 1 18 . 1 1 116 116 PHE C C 116 179.026 179.026 177.066 1.960 18933 12980 1 18 . 1 1 116 116 PHE CA C 116 59.461 59.461 60.072 -0.611 18933 12981 1 18 . 1 1 116 116 PHE CB C 116 37.189 37.189 39.026 -1.837 18933 12982 1 18 . 1 1 116 116 PHE H H 116 8.564 8.564 8.033 0.531 18933 12983 1 18 . 1 1 117 117 THR N N 117 119.012 119.012 112.195 6.817 18933 12984 1 18 . 1 1 117 117 THR C C 117 172.935 172.935 175.214 -2.279 18933 12985 1 18 . 1 1 117 117 THR CA C 117 67.088 67.088 64.764 2.324 18933 12986 1 18 . 1 1 117 117 THR CB C 117 37.126 37.126 69.073 -31.947 18933 12987 1 18 . 1 1 117 117 THR H H 117 7.620 7.620 8.195 -0.575 18933 12988 1 18 . 1 1 118 118 GLY N N 118 107.917 107.917 109.467 -1.550 18933 12989 1 18 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.293 1.874 18933 12990 1 18 . 1 1 118 118 GLY H H 118 6.666 6.666 7.474 -0.808 18933 12991 1 18 . 1 1 121 121 SER N N 121 113.354 113.354 118.162 -4.808 18933 12992 1 18 . 1 1 121 121 SER C C 121 176.061 176.061 175.960 0.101 18933 12993 1 18 . 1 1 121 121 SER CA C 121 61.035 61.035 61.460 -0.425 18933 12994 1 18 . 1 1 121 121 SER H H 121 8.322 8.322 8.363 -0.041 18933 12995 1 18 . 1 1 122 122 TYR N N 122 124.681 124.681 121.925 2.756 18933 12996 1 18 . 1 1 122 122 TYR C C 122 176.293 176.293 177.224 -0.931 18933 12997 1 18 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.382 -1.325 18933 12998 1 18 . 1 1 122 122 TYR CB C 122 38.711 38.711 37.929 0.782 18933 12999 1 18 . 1 1 122 122 TYR H H 122 6.514 6.514 8.370 -1.856 18933 13000 1 18 . 1 1 123 123 LEU N N 123 117.997 117.997 120.133 -2.136 18933 13001 1 18 . 1 1 123 123 LEU C C 123 179.774 179.774 178.912 0.862 18933 13002 1 18 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.719 0.159 18933 13003 1 18 . 1 1 123 123 LEU CB C 123 39.978 39.978 41.007 -1.029 18933 13004 1 18 . 1 1 123 123 LEU H H 123 7.428 7.428 7.327 0.101 18933 13005 1 18 . 1 1 124 124 ILE N N 124 119.012 119.012 120.805 -1.793 18933 13006 1 18 . 1 1 124 124 ILE C C 124 178.830 178.830 178.128 0.702 18933 13007 1 18 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.289 -0.138 18933 13008 1 18 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.213 -0.150 18933 13009 1 18 . 1 1 124 124 ILE H H 124 8.453 8.453 8.440 0.013 18933 13010 1 18 . 1 1 125 125 ARG N N 125 121.174 121.174 119.186 1.988 18933 13011 1 18 . 1 1 125 125 ARG C C 125 179.762 179.762 179.013 0.749 18933 13012 1 18 . 1 1 125 125 ARG CA C 125 59.057 59.057 57.864 1.193 18933 13013 1 18 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.343 -0.393 18933 13014 1 18 . 1 1 125 125 ARG H H 125 7.004 7.004 8.107 -1.103 18933 13015 1 18 . 1 1 126 126 ILE N N 126 122.299 122.299 120.590 1.709 18933 13016 1 18 . 1 1 126 126 ILE C C 126 178.352 178.352 177.288 1.064 18933 13017 1 18 . 1 1 126 126 ILE CA C 126 62.205 62.205 65.122 -2.917 18933 13018 1 18 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.126 -1.711 18933 13019 1 18 . 1 1 126 126 ILE H H 126 7.579 7.579 8.112 -0.533 18933 13020 1 18 . 1 1 127 127 ARG N N 127 119.354 119.354 120.588 -1.234 18933 13021 1 18 . 1 1 127 127 ARG C C 127 179.786 179.786 178.637 1.149 18933 13022 1 18 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.641 0.345 18933 13023 1 18 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.131 -0.801 18933 13024 1 18 . 1 1 127 127 ARG H H 127 8.715 8.715 8.105 0.610 18933 13025 1 18 . 1 1 128 128 ALA N N 128 122.873 122.873 120.465 2.408 18933 13026 1 18 . 1 1 128 128 ALA C C 128 180.325 180.325 179.391 0.934 18933 13027 1 18 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.552 0.188 18933 13028 1 18 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.257 -1.096 18933 13029 1 18 . 1 1 128 128 ALA H H 128 7.978 7.978 8.098 -0.120 18933 13030 1 18 . 1 1 129 129 ALA N N 129 121.846 121.846 121.871 -0.025 18933 13031 1 18 . 1 1 129 129 ALA C C 129 181.539 181.539 179.874 1.665 18933 13032 1 18 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.766 -0.268 18933 13033 1 18 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.683 -1.205 18933 13034 1 18 . 1 1 129 129 ALA H H 129 7.519 7.519 8.078 -0.559 18933 13035 1 18 . 1 1 130 130 LEU N N 130 119.134 119.134 118.362 0.772 18933 13036 1 18 . 1 1 130 130 LEU C C 130 179.909 179.909 179.021 0.888 18933 13037 1 18 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.073 -0.074 18933 13038 1 18 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.713 -1.291 18933 13039 1 18 . 1 1 130 130 LEU H H 130 8.296 8.296 8.643 -0.347 18933 13040 1 18 . 1 1 131 131 LYS N N 131 122.299 122.299 120.431 1.868 18933 13041 1 18 . 1 1 131 131 LYS C C 131 180.289 180.289 179.518 0.771 18933 13042 1 18 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.706 -0.689 18933 13043 1 18 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.119 -0.887 18933 13044 1 18 . 1 1 131 131 LYS H H 131 8.281 8.281 7.946 0.335 18933 13045 1 18 . 1 1 132 132 LYS N N 132 118.743 118.743 118.446 0.297 18933 13046 1 18 . 1 1 132 132 LYS C C 132 177.482 177.482 177.816 -0.334 18933 13047 1 18 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.597 -0.105 18933 13048 1 18 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.316 -1.084 18933 13049 1 18 . 1 1 132 132 LYS H H 132 7.317 7.317 7.679 -0.362 18933 13050 1 18 . 1 1 133 133 LYS N N 133 117.093 117.093 117.306 -0.213 18933 13051 1 18 . 1 1 133 133 LYS C C 133 174.614 174.614 176.170 -1.556 18933 13052 1 18 . 1 1 133 133 LYS CA C 133 54.780 54.780 56.019 -1.239 18933 13053 1 18 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.777 -0.595 18933 13054 1 18 . 1 1 133 133 LYS H H 133 7.327 7.327 7.649 -0.322 18933 13055 1 18 . 1 1 134 134 ASN N N 134 113.012 113.012 114.873 -1.861 18933 13056 1 18 . 1 1 134 134 ASN C C 134 173.965 173.965 173.414 0.551 18933 13057 1 18 . 1 1 134 134 ASN CA C 134 54.296 54.296 53.978 0.318 18933 13058 1 18 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.758 -1.583 18933 13059 1 18 . 1 1 134 134 ASN H H 134 7.938 7.938 7.933 0.005 18933 13060 1 18 . 1 1 135 135 TYR N N 135 115.725 115.725 119.285 -3.560 18933 13061 1 18 . 1 1 135 135 TYR C C 135 176.342 176.342 174.956 1.386 18933 13062 1 18 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.080 -1.412 18933 13063 1 18 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.230 1.333 18933 13064 1 18 . 1 1 135 135 TYR H H 135 7.741 7.741 8.425 -0.684 18933 13065 1 18 . 1 1 136 136 LYS N N 136 122.641 122.641 124.783 -2.142 18933 13066 1 18 . 1 1 136 136 LYS C C 136 173.475 173.475 174.442 -0.967 18933 13067 1 18 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.453 0.448 18933 13068 1 18 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.607 -1.889 18933 13069 1 18 . 1 1 136 136 LYS H H 136 9.296 9.296 8.774 0.522 18933 13070 1 18 . 1 1 137 137 LEU N N 137 127.284 127.284 123.810 3.474 18933 13071 1 18 . 1 1 137 137 LEU C C 137 175.423 175.423 176.311 -0.888 18933 13072 1 18 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.372 -0.246 18933 13073 1 18 . 1 1 137 137 LEU CB C 137 45.746 45.746 41.850 3.896 18933 13074 1 18 . 1 1 137 137 LEU H H 137 8.776 8.776 8.581 0.195 18933 13075 1 18 . 1 1 138 138 ASN N N 138 125.818 125.818 120.487 5.331 18933 13076 1 18 . 1 1 138 138 ASN C C 138 174.933 174.933 175.315 -0.382 18933 13077 1 18 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.792 -0.675 18933 13078 1 18 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.305 -4.799 18933 13079 1 18 . 1 1 138 138 ASN H H 138 8.811 8.811 8.387 0.424 18933 13080 1 18 . 1 1 139 139 GLN N N 139 116.861 116.861 118.907 -2.046 18933 13081 1 18 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.372 -1.534 18933 13082 1 18 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.756 -3.039 18933 13083 1 18 . 1 1 139 139 GLN H H 139 9.220 9.220 8.875 0.345 18933 13084 1 18 . 1 1 140 140 TYR N N 140 120.600 120.600 120.271 0.329 18933 13085 1 18 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.755 -0.998 18933 13086 1 18 . 1 1 140 140 TYR CB C 140 37.570 37.570 37.958 -0.388 18933 13087 1 18 . 1 1 140 140 TYR H H 140 8.549 8.549 8.438 0.111 18933 13088 1 18 . 1 1 141 141 GLY N N 141 105.986 105.986 108.580 -2.594 18933 13089 1 18 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.617 -0.773 18933 13090 1 18 . 1 1 141 141 GLY H H 141 7.186 7.186 7.940 -0.754 18933 13091 1 18 . 1 1 142 142 LEU N N 142 120.038 120.038 116.882 3.156 18933 13092 1 18 . 1 1 142 142 LEU C C 142 173.340 173.340 176.221 -2.881 18933 13093 1 18 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.260 -0.740 18933 13094 1 18 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.348 1.003 18933 13095 1 18 . 1 1 142 142 LEU H H 142 7.539 7.539 8.274 -0.735 18933 13096 1 18 . 1 1 143 143 PHE N N 143 124.229 124.229 119.300 4.929 18933 13097 1 18 . 1 1 143 143 PHE C C 143 173.977 173.977 175.260 -1.283 18933 13098 1 18 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.172 -2.531 18933 13099 1 18 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.591 4.077 18933 13100 1 18 . 1 1 143 143 PHE H H 143 9.084 9.084 8.949 0.135 18933 13101 1 18 . 1 1 144 144 LYS N N 144 127.858 127.858 123.229 4.629 18933 13102 1 18 . 1 1 144 144 LYS C C 144 175.092 175.092 176.356 -1.264 18933 13103 1 18 . 1 1 144 144 LYS CA C 144 58.856 58.856 53.978 4.878 18933 13104 1 18 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.748 3.837 18933 13105 1 18 . 1 1 144 144 LYS H H 144 9.281 9.281 8.788 0.493 18933 13106 1 18 . 1 1 145 145 ASN N N 145 128.188 128.188 126.677 1.511 18933 13107 1 18 . 1 1 145 145 ASN C C 145 175.779 175.779 174.811 0.968 18933 13108 1 18 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.459 3.267 18933 13109 1 18 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.699 -3.045 18933 13110 1 18 . 1 1 145 145 ASN H H 145 9.205 9.205 8.886 0.319 18933 13111 1 18 . 1 1 146 146 GLN N N 146 129.655 129.655 110.984 18.671 18933 13112 1 18 . 1 1 146 146 GLN C C 146 175.399 175.399 174.570 0.829 18933 13113 1 18 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.599 1.216 18933 13114 1 18 . 1 1 146 146 GLN CB C 146 32.626 32.626 27.982 4.644 18933 13115 1 18 . 1 1 146 146 GLN H H 146 8.983 8.983 8.750 0.233 18933 13116 1 18 . 1 1 147 147 THR N N 147 117.936 117.936 115.762 2.174 18933 13117 1 18 . 1 1 147 147 THR C C 147 173.254 173.254 173.465 -0.211 18933 13118 1 18 . 1 1 147 147 THR CA C 147 61.721 61.721 62.048 -0.327 18933 13119 1 18 . 1 1 147 147 THR CB C 147 70.274 70.274 69.397 0.877 18933 13120 1 18 . 1 1 147 147 THR H H 147 8.029 8.029 7.848 0.181 18933 13121 1 18 . 1 1 148 148 LEU N N 148 130.681 130.681 131.238 -0.557 18933 13122 1 18 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.413 0.053 18933 13123 1 18 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.781 -1.092 18933 13124 1 18 . 1 1 148 148 LEU H H 148 8.635 8.635 8.880 -0.245 18933 13125 1 18 . 1 1 149 149 VAL N N 149 130.803 130.803 124.293 6.510 18933 13126 1 18 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.547 0.631 18933 13127 1 18 . 1 1 149 149 VAL CB C 149 31.675 31.675 33.462 -1.787 18933 13128 1 18 . 1 1 149 149 VAL H H 149 8.968 8.968 9.356 -0.388 18933 13129 1 18 . 1 1 151 151 LEU N N 151 124.290 124.290 121.193 3.097 18933 13130 1 18 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.388 -2.375 18933 13131 1 18 . 1 1 151 151 LEU CB C 151 44.098 44.098 40.918 3.180 18933 13132 1 18 . 1 1 151 151 LEU H H 151 7.872 7.872 8.123 -0.251 18933 13133 1 18 . 1 1 153 153 ILE N N 153 114.943 114.943 113.873 1.070 18933 13134 1 18 . 1 1 153 153 ILE C C 153 175.877 175.877 175.119 0.758 18933 13135 1 18 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.695 -0.001 18933 13136 1 18 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.131 1.558 18933 13137 1 18 . 1 1 153 153 ILE H H 153 7.125 7.125 7.628 -0.503 18933 13138 1 18 . 1 1 154 154 THR N N 154 111.766 111.766 113.032 -1.266 18933 13139 1 18 . 1 1 154 154 THR C C 154 174.945 174.945 173.999 0.946 18933 13140 1 18 . 1 1 154 154 THR CA C 154 62.124 62.124 62.105 0.019 18933 13141 1 18 . 1 1 154 154 THR CB C 154 70.718 70.718 69.034 1.684 18933 13142 1 18 . 1 1 154 154 THR H H 154 9.286 9.286 8.466 0.820 18933 13143 1 18 . 1 1 155 155 THR N N 155 111.766 111.766 112.159 -0.393 18933 13144 1 18 . 1 1 155 155 THR CA C 155 58.936 58.936 60.085 -1.149 18933 13145 1 18 . 1 1 155 155 THR CB C 155 72.683 72.683 71.653 1.030 18933 13146 1 18 . 1 1 155 155 THR H H 155 7.645 7.645 7.297 0.348 18933 13147 1 18 . 1 1 157 157 LYS N N 157 119.464 119.464 118.949 0.515 18933 13148 1 18 . 1 1 157 157 LYS C C 157 178.781 178.781 178.305 0.476 18933 13149 1 18 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.937 0.089 18933 13150 1 18 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.605 -0.183 18933 13151 1 18 . 1 1 157 157 LYS H H 157 8.175 8.175 8.366 -0.191 18933 13152 1 18 . 1 1 158 158 GLU N N 158 118.340 118.340 117.331 1.009 18933 13153 1 18 . 1 1 158 158 GLU C C 158 178.867 178.867 178.849 0.018 18933 13154 1 18 . 1 1 158 158 GLU CA C 158 58.492 58.492 58.658 -0.166 18933 13155 1 18 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.725 0.605 18933 13156 1 18 . 1 1 158 158 GLU H H 158 7.519 7.519 8.421 -0.902 18933 13157 1 18 . 1 1 159 159 LEU N N 159 120.710 120.710 122.118 -1.408 18933 13158 1 18 . 1 1 159 159 LEU C C 159 176.526 176.526 178.230 -1.704 18933 13159 1 18 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.209 -0.040 18933 13160 1 18 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.702 -1.787 18933 13161 1 18 . 1 1 159 159 LEU H H 159 7.524 7.524 7.791 -0.267 18933 13162 1 18 . 1 1 160 160 ILE N N 160 118.217 118.217 118.484 -0.267 18933 13163 1 18 . 1 1 160 160 ILE C C 160 177.213 177.213 177.924 -0.711 18933 13164 1 18 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.541 -0.511 18933 13165 1 18 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.274 0.232 18933 13166 1 18 . 1 1 160 160 ILE H H 160 7.741 7.741 7.923 -0.182 18933 13167 1 18 . 1 1 161 161 LYS N N 161 118.450 118.450 119.845 -1.395 18933 13168 1 18 . 1 1 161 161 LYS C C 161 180.999 180.999 179.795 1.204 18933 13169 1 18 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.377 -0.562 18933 13170 1 18 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.118 -1.140 18933 13171 1 18 . 1 1 161 161 LYS H H 161 7.382 7.382 7.894 -0.512 18933 13172 1 18 . 1 1 162 162 GLU N N 162 121.846 121.846 120.951 0.895 18933 13173 1 18 . 1 1 162 162 GLU C C 162 178.818 178.818 178.291 0.527 18933 13174 1 18 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.797 -0.749 18933 13175 1 18 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.480 -1.544 18933 13176 1 18 . 1 1 162 162 GLU H H 162 8.210 8.210 7.882 0.328 18933 13177 1 18 . 1 1 163 163 LEU N N 163 116.751 116.751 112.922 3.829 18933 13178 1 18 . 1 1 163 163 LEU C C 163 176.784 176.784 177.246 -0.462 18933 13179 1 18 . 1 1 163 163 LEU CA C 163 55.022 55.022 54.392 0.631 18933 13180 1 18 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.148 0.161 18933 13181 1 18 . 1 1 163 163 LEU H H 163 7.796 7.796 7.345 0.451 18933 13182 1 18 . 1 1 164 164 GLY N N 164 104.849 104.849 107.047 -2.198 18933 13183 1 18 . 1 1 164 164 GLY C C 164 174.492 174.492 174.060 0.432 18933 13184 1 18 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.669 -0.937 18933 13185 1 18 . 1 1 164 164 GLY H H 164 7.589 7.589 7.587 0.002 18933 13186 1 18 . 1 1 165 165 PHE N N 165 118.902 118.902 119.410 -0.508 18933 13187 1 18 . 1 1 165 165 PHE CA C 165 55.668 55.668 55.995 -0.327 18933 13188 1 18 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.861 -2.376 18933 13189 1 18 . 1 1 165 165 PHE H H 165 7.251 7.251 7.972 -0.721 18933 13190 1 18 . 1 1 166 166 THR N N 166 117.093 117.093 115.485 1.608 18933 13191 1 18 . 1 1 166 166 THR CA C 166 62.245 62.245 61.401 0.844 18933 13192 1 18 . 1 1 166 166 THR CB C 166 69.323 69.323 69.270 0.053 18933 13193 1 18 . 1 1 166 166 THR H H 166 8.407 8.407 8.424 -0.017 18933 13194 1 18 . 1 1 168 168 ARG N N 168 127.431 127.431 122.931 4.500 18933 13195 1 18 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.738 -2.500 18933 13196 1 18 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.334 -1.341 18933 13197 1 18 . 1 1 168 168 ARG H H 168 7.160 7.160 8.748 -1.588 18933 13198 1 18 . 1 1 171 171 LYS N N 171 113.574 113.574 115.597 -2.023 18933 13199 1 18 . 1 1 171 171 LYS C C 171 176.416 176.416 178.069 -1.653 18933 13200 1 18 . 1 1 171 171 LYS CA C 171 57.605 57.605 58.526 -0.921 18933 13201 1 18 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.766 0.163 18933 13202 1 18 . 1 1 171 171 LYS H H 171 8.210 8.210 8.303 -0.093 18933 13203 1 18 . 1 1 172 172 LYS N N 172 117.313 117.313 118.716 -1.403 18933 13204 1 18 . 1 1 172 172 LYS C C 172 175.717 175.717 176.215 -0.498 18933 13205 1 18 . 1 1 172 172 LYS CA C 172 54.175 54.175 55.861 -1.686 18933 13206 1 18 . 1 1 172 172 LYS CB C 172 31.612 31.612 33.537 -1.925 18933 13207 1 18 . 1 1 172 172 LYS H H 172 7.761 7.761 7.525 0.236 18933 13208 1 18 . 1 1 173 173 ARG N N 173 122.056 122.056 116.908 5.148 18933 13209 1 18 . 1 1 173 173 ARG C C 173 172.850 172.850 175.358 -2.508 18933 13210 1 18 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.707 0.171 18933 13211 1 18 . 1 1 173 173 ARG CB C 173 28.506 28.506 29.034 -0.528 18933 13212 1 18 . 1 1 173 173 ARG H H 173 6.885 6.885 7.503 -0.618 18933 13213 1 19 . 1 1 2 2 LEU N N 2 122.812 122.812 123.481 -0.669 18933 13214 1 19 . 1 1 2 2 LEU C C 2 175.742 175.742 175.830 -0.088 18933 13215 1 19 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.953 0.181 18933 13216 1 19 . 1 1 2 2 LEU CB C 2 42.842 42.842 45.418 -2.576 18933 13217 1 19 . 1 1 2 2 LEU H H 2 8.756 8.756 8.348 0.408 18933 13218 1 19 . 1 1 3 3 THR N N 3 113.000 113.000 111.506 1.494 18933 13219 1 19 . 1 1 3 3 THR C C 3 175.938 175.938 175.798 0.140 18933 13220 1 19 . 1 1 3 3 THR CA C 3 60.550 60.550 60.193 0.357 18933 13221 1 19 . 1 1 3 3 THR CB C 3 70.781 70.781 70.471 0.311 18933 13222 1 19 . 1 1 3 3 THR H H 3 8.428 8.428 8.092 0.336 18933 13223 1 19 . 1 1 4 4 LEU N N 4 122.531 122.531 122.678 -0.147 18933 13224 1 19 . 1 1 4 4 LEU C C 4 178.463 178.463 178.382 0.081 18933 13225 1 19 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.617 -0.488 18933 13226 1 19 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.050 -2.516 18933 13227 1 19 . 1 1 4 4 LEU H H 4 7.731 7.731 8.124 -0.393 18933 13228 1 19 . 1 1 5 5 ILE N N 5 115.505 115.505 115.964 -0.459 18933 13229 1 19 . 1 1 5 5 ILE C C 5 178.573 178.573 177.673 0.900 18933 13230 1 19 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.660 -0.922 18933 13231 1 19 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.304 -0.432 18933 13232 1 19 . 1 1 5 5 ILE H H 5 7.645 7.645 8.113 -0.468 18933 13233 1 19 . 1 1 6 6 GLN N N 6 121.626 121.626 119.411 2.215 18933 13234 1 19 . 1 1 6 6 GLN C C 6 179.014 179.014 178.789 0.225 18933 13235 1 19 . 1 1 6 6 GLN CA C 6 58.331 58.331 58.922 -0.591 18933 13236 1 19 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.717 0.472 18933 13237 1 19 . 1 1 6 6 GLN H H 6 7.645 7.645 7.712 -0.067 18933 13238 1 19 . 1 1 7 7 GLY N N 7 107.684 107.684 106.829 0.855 18933 13239 1 19 . 1 1 7 7 GLY C C 7 174.749 174.749 176.371 -1.622 18933 13240 1 19 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.815 -0.025 18933 13241 1 19 . 1 1 7 7 GLY H H 7 8.660 8.660 8.112 0.548 18933 13242 1 19 . 1 1 8 8 LYS N N 8 120.942 120.942 122.504 -1.562 18933 13243 1 19 . 1 1 8 8 LYS C C 8 179.455 179.455 178.732 0.723 18933 13244 1 19 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.336 0.569 18933 13245 1 19 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.224 -0.802 18933 13246 1 19 . 1 1 8 8 LYS H H 8 8.518 8.518 7.619 0.899 18933 13247 1 19 . 1 1 9 9 LYS N N 9 120.710 120.710 119.936 0.774 18933 13248 1 19 . 1 1 9 9 LYS C C 9 179.823 179.823 179.208 0.615 18933 13249 1 19 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.288 0.334 18933 13250 1 19 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.375 -1.080 18933 13251 1 19 . 1 1 9 9 LYS H H 9 7.731 7.731 8.089 -0.358 18933 13252 1 19 . 1 1 10 10 ILE N N 10 121.345 121.345 120.435 0.910 18933 13253 1 19 . 1 1 10 10 ILE C C 10 177.789 177.789 178.259 -0.470 18933 13254 1 19 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.853 -1.389 18933 13255 1 19 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.173 -1.808 18933 13256 1 19 . 1 1 10 10 ILE H H 10 7.711 7.711 8.238 -0.527 18933 13257 1 19 . 1 1 11 11 VAL N N 11 120.258 120.258 119.764 0.494 18933 13258 1 19 . 1 1 11 11 VAL C C 11 177.372 177.372 177.538 -0.166 18933 13259 1 19 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.357 0.094 18933 13260 1 19 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.513 -0.979 18933 13261 1 19 . 1 1 11 11 VAL H H 11 7.918 7.918 8.327 -0.409 18933 13262 1 19 . 1 1 12 12 ASN N N 12 116.971 116.971 117.993 -1.022 18933 13263 1 19 . 1 1 12 12 ASN C C 12 177.445 177.445 177.994 -0.549 18933 13264 1 19 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.767 -0.656 18933 13265 1 19 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.529 -0.896 18933 13266 1 19 . 1 1 12 12 ASN H H 12 7.993 7.993 8.555 -0.562 18933 13267 1 19 . 1 1 13 13 HIS N N 13 120.258 120.258 120.882 -0.624 18933 13268 1 19 . 1 1 13 13 HIS C C 13 177.862 177.862 177.906 -0.044 18933 13269 1 19 . 1 1 13 13 HIS CA C 13 59.098 59.098 58.272 0.826 18933 13270 1 19 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.636 0.596 18933 13271 1 19 . 1 1 13 13 HIS H H 13 7.741 7.741 8.333 -0.592 18933 13272 1 19 . 1 1 14 14 LEU N N 14 116.641 116.641 119.658 -3.017 18933 13273 1 19 . 1 1 14 14 LEU C C 14 179.186 179.186 178.356 0.830 18933 13274 1 19 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.249 -1.492 18933 13275 1 19 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.659 -0.540 18933 13276 1 19 . 1 1 14 14 LEU H H 14 8.221 8.221 8.458 -0.237 18933 13277 1 19 . 1 1 15 15 ARG N N 15 115.957 115.957 114.903 1.054 18933 13278 1 19 . 1 1 15 15 ARG C C 15 176.330 176.330 178.247 -1.917 18933 13279 1 19 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.472 1.231 18933 13280 1 19 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.406 -1.329 18933 13281 1 19 . 1 1 15 15 ARG H H 15 7.968 7.968 8.462 -0.494 18933 13282 1 19 . 1 1 16 16 SER N N 16 109.395 109.395 115.383 -5.988 18933 13283 1 19 . 1 1 16 16 SER C C 16 176.024 176.024 175.137 0.887 18933 13284 1 19 . 1 1 16 16 SER CA C 16 57.282 57.282 60.309 -3.027 18933 13285 1 19 . 1 1 16 16 SER CB C 16 63.683 63.683 64.082 -0.399 18933 13286 1 19 . 1 1 16 16 SER H H 16 6.963 6.963 7.671 -0.708 18933 13287 1 19 . 1 1 17 17 ARG N N 17 122.775 122.775 121.690 1.085 18933 13288 1 19 . 1 1 17 17 ARG C C 17 174.590 174.590 173.891 0.699 18933 13289 1 19 . 1 1 17 17 ARG CA C 17 56.273 56.273 55.011 1.262 18933 13290 1 19 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.528 1.274 18933 13291 1 19 . 1 1 17 17 ARG H H 17 7.781 7.781 8.284 -0.503 18933 13292 1 19 . 1 1 18 18 LEU N N 18 122.421 122.421 125.894 -3.473 18933 13293 1 19 . 1 1 18 18 LEU C C 18 176.281 176.281 174.021 2.260 18933 13294 1 19 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.465 0.315 18933 13295 1 19 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.909 -3.698 18933 13296 1 19 . 1 1 18 18 LEU H H 18 8.650 8.650 7.722 0.928 18933 13297 1 19 . 1 1 19 19 ALA N N 19 126.441 126.441 126.906 -0.465 18933 13298 1 19 . 1 1 19 19 ALA C C 19 173.904 173.904 174.899 -0.995 18933 13299 1 19 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.481 -0.615 18933 13300 1 19 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.304 0.561 18933 13301 1 19 . 1 1 19 19 ALA H H 19 8.609 8.609 8.954 -0.345 18933 13302 1 19 . 1 1 20 20 PHE N N 20 114.600 114.600 119.229 -4.629 18933 13303 1 19 . 1 1 20 20 PHE C C 20 172.592 172.592 173.931 -1.339 18933 13304 1 19 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.936 0.853 18933 13305 1 19 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.633 -0.944 18933 13306 1 19 . 1 1 20 20 PHE H H 20 8.801 8.801 9.114 -0.313 18933 13307 1 19 . 1 1 21 21 GLU N N 21 122.873 122.873 123.269 -0.396 18933 13308 1 19 . 1 1 21 21 GLU C C 21 174.872 174.872 175.240 -0.368 18933 13309 1 19 . 1 1 21 21 GLU CA C 21 55.062 55.062 55.040 0.022 18933 13310 1 19 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.012 -0.287 18933 13311 1 19 . 1 1 21 21 GLU H H 21 7.847 7.847 9.254 -1.407 18933 13312 1 19 . 1 1 22 22 TYR N N 22 126.270 126.270 126.207 0.063 18933 13313 1 19 . 1 1 22 22 TYR C C 22 174.872 174.872 174.795 0.077 18933 13314 1 19 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.553 -0.805 18933 13315 1 19 . 1 1 22 22 TYR CB C 22 40.105 40.105 40.934 -0.829 18933 13316 1 19 . 1 1 22 22 TYR H H 22 8.806 8.806 9.183 -0.377 18933 13317 1 19 . 1 1 23 23 ASN N N 23 128.420 128.420 126.558 1.862 18933 13318 1 19 . 1 1 23 23 ASN C C 23 175.435 175.435 175.112 0.323 18933 13319 1 19 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.769 -0.764 18933 13320 1 19 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.704 -1.339 18933 13321 1 19 . 1 1 23 23 ASN H H 23 8.943 8.943 9.276 -0.333 18933 13322 1 19 . 1 1 24 24 GLY N N 24 104.067 104.067 103.532 0.535 18933 13323 1 19 . 1 1 24 24 GLY C C 24 173.707 173.707 173.766 -0.059 18933 13324 1 19 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.945 -0.011 18933 13325 1 19 . 1 1 24 24 GLY H H 24 8.534 8.534 8.274 0.260 18933 13326 1 19 . 1 1 25 25 GLN N N 25 120.038 120.038 119.819 0.219 18933 13327 1 19 . 1 1 25 25 GLN C C 25 173.744 173.744 174.794 -1.050 18933 13328 1 19 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.411 -1.084 18933 13329 1 19 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.414 0.247 18933 13330 1 19 . 1 1 25 25 GLN H H 25 7.595 7.595 7.821 -0.226 18933 13331 1 19 . 1 1 26 26 LEU N N 26 124.681 124.681 124.717 -0.036 18933 13332 1 19 . 1 1 26 26 LEU C C 26 175.987 175.987 176.350 -0.363 18933 13333 1 19 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.546 -0.533 18933 13334 1 19 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.682 -1.817 18933 13335 1 19 . 1 1 26 26 LEU H H 26 8.382 8.382 8.577 -0.195 18933 13336 1 19 . 1 1 27 27 ILE N N 27 130.779 130.779 127.187 3.592 18933 13337 1 19 . 1 1 27 27 ILE C C 27 175.215 175.215 174.301 0.914 18933 13338 1 19 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.593 -0.334 18933 13339 1 19 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.420 -2.688 18933 13340 1 19 . 1 1 27 27 ILE H H 27 8.882 8.882 8.977 -0.095 18933 13341 1 19 . 1 1 28 28 LYS N N 28 126.160 126.160 127.559 -1.399 18933 13342 1 19 . 1 1 28 28 LYS C C 28 176.771 176.771 175.739 1.032 18933 13343 1 19 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.903 1.935 18933 13344 1 19 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.053 -1.314 18933 13345 1 19 . 1 1 28 28 LYS H H 28 8.165 8.165 8.381 -0.216 18933 13346 1 19 . 1 1 29 29 ILE N N 29 126.380 126.380 122.323 4.057 18933 13347 1 19 . 1 1 29 29 ILE C C 29 175.877 175.877 174.368 1.509 18933 13348 1 19 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.512 -0.204 18933 13349 1 19 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.541 -2.478 18933 13350 1 19 . 1 1 29 29 ILE H H 29 8.019 8.019 8.731 -0.712 18933 13351 1 19 . 1 1 30 30 LEU N N 30 129.215 129.215 122.247 6.968 18933 13352 1 19 . 1 1 30 30 LEU C C 30 178.867 178.867 178.162 0.705 18933 13353 1 19 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.334 1.285 18933 13354 1 19 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.595 -4.730 18933 13355 1 19 . 1 1 30 30 LEU H H 30 8.917 8.917 8.366 0.551 18933 13356 1 19 . 1 1 31 31 SER N N 31 117.997 117.997 116.524 1.473 18933 13357 1 19 . 1 1 31 31 SER C C 31 177.396 177.396 176.020 1.376 18933 13358 1 19 . 1 1 31 31 SER CA C 31 61.236 61.236 60.606 0.630 18933 13359 1 19 . 1 1 31 31 SER CB C 31 62.035 62.035 63.052 -1.017 18933 13360 1 19 . 1 1 31 31 SER H H 31 8.594 8.594 8.933 -0.339 18933 13361 1 19 . 1 1 32 32 LYS N N 32 116.189 116.189 121.326 -5.137 18933 13362 1 19 . 1 1 32 32 LYS C C 32 176.244 176.244 177.277 -1.033 18933 13363 1 19 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.430 -1.027 18933 13364 1 19 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.359 -2.078 18933 13365 1 19 . 1 1 32 32 LYS H H 32 8.029 8.029 8.344 -0.315 18933 13366 1 19 . 1 1 33 33 ASN N N 33 119.061 119.061 115.355 3.706 18933 13367 1 19 . 1 1 33 33 ASN C C 33 172.384 172.384 174.340 -1.956 18933 13368 1 19 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.889 -1.732 18933 13369 1 19 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.104 -2.837 18933 13370 1 19 . 1 1 33 33 ASN H H 33 7.902 7.902 7.792 0.110 18933 13371 1 19 . 1 1 34 34 ILE N N 34 120.038 120.038 119.705 0.333 18933 13372 1 19 . 1 1 34 34 ILE C C 34 175.607 175.607 174.143 1.464 18933 13373 1 19 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.263 0.287 18933 13374 1 19 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.816 -2.852 18933 13375 1 19 . 1 1 34 34 ILE H H 34 7.443 7.443 7.983 -0.540 18933 13376 1 19 . 1 1 35 35 VAL N N 35 129.435 129.435 127.130 2.305 18933 13377 1 19 . 1 1 35 35 VAL C C 35 175.386 175.386 174.517 0.869 18933 13378 1 19 . 1 1 35 35 VAL CA C 35 60.026 60.026 59.896 0.130 18933 13379 1 19 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.504 -0.723 18933 13380 1 19 . 1 1 35 35 VAL H H 35 9.533 9.533 8.874 0.659 18933 13381 1 19 . 1 1 36 36 ALA N N 36 130.571 130.571 130.410 0.161 18933 13382 1 19 . 1 1 36 36 ALA C C 36 177.347 177.347 176.226 1.121 18933 13383 1 19 . 1 1 36 36 ALA CA C 36 52.399 52.399 52.112 0.287 18933 13384 1 19 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.634 -0.776 18933 13385 1 19 . 1 1 36 36 ALA H H 36 8.665 8.665 8.502 0.163 18933 13386 1 19 . 1 1 37 37 VAL N N 37 115.395 115.395 119.460 -4.065 18933 13387 1 19 . 1 1 37 37 VAL C C 37 174.455 174.455 176.033 -1.578 18933 13388 1 19 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.242 0.138 18933 13389 1 19 . 1 1 37 37 VAL CB C 37 32.943 32.943 33.885 -0.942 18933 13390 1 19 . 1 1 37 37 VAL H H 37 8.079 8.079 8.302 -0.223 18933 13391 1 19 . 1 1 38 38 GLY N N 38 107.672 107.672 107.881 -0.209 18933 13392 1 19 . 1 1 38 38 GLY C C 38 173.364 173.364 175.778 -2.414 18933 13393 1 19 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.524 -0.339 18933 13394 1 19 . 1 1 38 38 GLY H H 38 7.579 7.579 8.058 -0.479 18933 13395 1 19 . 1 1 39 39 SER N N 39 121.052 121.052 119.572 1.480 18933 13396 1 19 . 1 1 39 39 SER C C 39 175.570 175.570 176.433 -0.863 18933 13397 1 19 . 1 1 39 39 SER CA C 39 61.801 61.801 61.966 -0.165 18933 13398 1 19 . 1 1 39 39 SER CB C 39 62.478 62.478 63.208 -0.730 18933 13399 1 19 . 1 1 39 39 SER H H 39 8.953 8.953 8.219 0.734 18933 13400 1 19 . 1 1 40 40 LEU N N 40 121.553 121.553 121.429 0.124 18933 13401 1 19 . 1 1 40 40 LEU C C 40 180.203 180.203 177.832 2.371 18933 13402 1 19 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.061 0.068 18933 13403 1 19 . 1 1 40 40 LEU CB C 40 41.753 41.753 42.031 -0.278 18933 13404 1 19 . 1 1 40 40 LEU H H 40 8.195 8.195 7.261 0.934 18933 13405 1 19 . 1 1 41 41 ARG N N 41 121.956 121.956 116.615 5.341 18933 13406 1 19 . 1 1 41 41 ARG C C 41 177.323 177.323 178.019 -0.696 18933 13407 1 19 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.710 0.621 18933 13408 1 19 . 1 1 41 41 ARG CB C 41 28.443 28.443 30.092 -1.649 18933 13409 1 19 . 1 1 41 41 ARG H H 41 6.873 6.873 7.364 -0.491 18933 13410 1 19 . 1 1 42 42 ARG N N 42 114.600 114.600 116.602 -2.002 18933 13411 1 19 . 1 1 42 42 ARG C C 42 172.911 172.911 175.943 -3.032 18933 13412 1 19 . 1 1 42 42 ARG CA C 42 57.242 57.242 57.059 0.183 18933 13413 1 19 . 1 1 42 42 ARG CB C 42 29.140 29.140 31.029 -1.889 18933 13414 1 19 . 1 1 42 42 ARG H H 42 7.438 7.438 8.182 -0.744 18933 13415 1 19 . 1 1 43 43 GLU N N 43 113.354 113.354 114.614 -1.260 18933 13416 1 19 . 1 1 43 43 GLU C C 43 175.999 175.999 175.379 0.620 18933 13417 1 19 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.156 -0.600 18933 13418 1 19 . 1 1 43 43 GLU CB C 43 25.337 25.337 26.929 -1.592 18933 13419 1 19 . 1 1 43 43 GLU H H 43 7.564 7.564 7.905 -0.341 18933 13420 1 19 . 1 1 44 44 GLU N N 44 119.696 119.696 120.508 -0.812 18933 13421 1 19 . 1 1 44 44 GLU C C 44 175.423 175.423 176.059 -0.636 18933 13422 1 19 . 1 1 44 44 GLU CA C 44 56.838 56.838 54.005 2.833 18933 13423 1 19 . 1 1 44 44 GLU CB C 44 28.696 28.696 28.491 0.204 18933 13424 1 19 . 1 1 44 44 GLU H H 44 7.261 7.261 7.630 -0.369 18933 13425 1 19 . 1 1 45 45 LYS N N 45 117.435 117.435 121.665 -4.230 18933 13426 1 19 . 1 1 45 45 LYS C C 45 177.715 177.715 176.173 1.542 18933 13427 1 19 . 1 1 45 45 LYS CA C 45 59.219 59.219 59.010 0.209 18933 13428 1 19 . 1 1 45 45 LYS CB C 45 32.119 32.119 32.645 -0.526 18933 13429 1 19 . 1 1 45 45 LYS H H 45 7.938 7.938 7.618 0.320 18933 13430 1 19 . 1 1 46 46 MET N N 46 115.847 115.847 117.051 -1.204 18933 13431 1 19 . 1 1 46 46 MET CA C 46 52.520 52.520 53.882 -1.362 18933 13432 1 19 . 1 1 46 46 MET CB C 46 33.450 33.450 31.322 2.128 18933 13433 1 19 . 1 1 46 46 MET H H 46 7.595 7.595 7.721 -0.126 18933 13434 1 19 . 1 1 47 47 LEU N N 47 121.627 121.627 125.675 -4.048 18933 13435 1 19 . 1 1 47 47 LEU CA C 47 53.126 53.126 55.084 -1.958 18933 13436 1 19 . 1 1 47 47 LEU CB C 47 43.070 43.070 42.869 0.201 18933 13437 1 19 . 1 1 47 47 LEU H H 47 9.220 9.220 8.837 0.383 18933 13438 1 19 . 1 1 49 49 ASP N N 49 117.093 117.093 115.887 1.206 18933 13439 1 19 . 1 1 49 49 ASP C C 49 173.340 173.340 174.194 -0.854 18933 13440 1 19 . 1 1 49 49 ASP CA C 49 51.794 51.794 52.925 -1.131 18933 13441 1 19 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.196 -1.190 18933 13442 1 19 . 1 1 49 49 ASP H H 49 7.761 7.761 7.582 0.179 18933 13443 1 19 . 1 1 50 50 VAL N N 50 119.012 119.012 114.609 4.403 18933 13444 1 19 . 1 1 50 50 VAL C C 50 173.070 173.070 174.183 -1.113 18933 13445 1 19 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.581 1.260 18933 13446 1 19 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.748 -1.185 18933 13447 1 19 . 1 1 50 50 VAL H H 50 8.089 8.089 8.198 -0.109 18933 13448 1 19 . 1 1 51 51 ASP N N 51 127.064 127.064 125.589 1.475 18933 13449 1 19 . 1 1 51 51 ASP C C 51 174.565 174.565 175.282 -0.717 18933 13450 1 19 . 1 1 51 51 ASP CA C 51 52.157 52.157 53.146 -0.989 18933 13451 1 19 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.514 -0.875 18933 13452 1 19 . 1 1 51 51 ASP H H 51 8.069 8.069 8.144 -0.075 18933 13453 1 19 . 1 1 52 52 LEU N N 52 121.627 121.627 119.990 1.637 18933 13454 1 19 . 1 1 52 52 LEU C C 52 174.063 174.063 174.607 -0.544 18933 13455 1 19 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.443 -0.761 18933 13456 1 19 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.303 -2.952 18933 13457 1 19 . 1 1 52 52 LEU H H 52 8.852 8.852 8.893 -0.041 18933 13458 1 19 . 1 1 53 53 LEU N N 53 123.093 123.093 123.426 -0.333 18933 13459 1 19 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.101 1.890 18933 13460 1 19 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.633 -2.500 18933 13461 1 19 . 1 1 53 53 LEU H H 53 9.362 9.362 8.964 0.398 18933 13462 1 19 . 1 1 54 54 ILE N N 54 123.777 123.777 129.286 -5.509 18933 13463 1 19 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.076 -4.014 18933 13464 1 19 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.408 -7.338 18933 13465 1 19 . 1 1 54 54 ILE H H 54 8.907 8.907 9.230 -0.323 18933 13466 1 19 . 1 1 58 58 GLU N N 58 114.710 114.710 117.273 -2.563 18933 13467 1 19 . 1 1 58 58 GLU CA C 58 54.377 54.377 54.685 -0.308 18933 13468 1 19 . 1 1 58 58 GLU CB C 58 31.422 31.422 32.764 -1.342 18933 13469 1 19 . 1 1 58 58 GLU H H 58 6.716 6.716 7.428 -0.712 18933 13470 1 19 . 1 1 61 61 LEU N N 61 115.957 115.957 120.336 -4.379 18933 13471 1 19 . 1 1 61 61 LEU C C 61 178.512 178.512 178.315 0.197 18933 13472 1 19 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.121 -2.341 18933 13473 1 19 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.549 -0.430 18933 13474 1 19 . 1 1 61 61 LEU H H 61 7.307 7.307 7.894 -0.587 18933 13475 1 19 . 1 1 62 62 LEU N N 62 120.038 120.038 119.580 0.458 18933 13476 1 19 . 1 1 62 62 LEU C C 62 177.874 177.874 178.779 -0.905 18933 13477 1 19 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.568 0.368 18933 13478 1 19 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.945 -1.206 18933 13479 1 19 . 1 1 62 62 LEU H H 62 7.327 7.327 8.193 -0.866 18933 13480 1 19 . 1 1 63 63 LYS N N 63 114.600 114.600 116.068 -1.468 18933 13481 1 19 . 1 1 63 63 LYS C C 63 175.460 175.460 177.776 -2.316 18933 13482 1 19 . 1 1 63 63 LYS CA C 63 57.564 57.564 59.016 -1.452 18933 13483 1 19 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.650 -1.925 18933 13484 1 19 . 1 1 63 63 LYS H H 63 7.973 7.973 7.783 0.190 18933 13485 1 19 . 1 1 64 64 HIS N N 64 115.273 115.273 115.865 -0.592 18933 13486 1 19 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.542 0.570 18933 13487 1 19 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.338 2.098 18933 13488 1 19 . 1 1 64 64 HIS H H 64 7.544 7.544 7.643 -0.099 18933 13489 1 19 . 1 1 65 65 VAL N N 65 118.682 118.682 118.863 -0.181 18933 13490 1 19 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.800 3.238 18933 13491 1 19 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.532 -2.505 18933 13492 1 19 . 1 1 65 65 VAL H H 65 6.787 6.787 7.140 -0.353 18933 13493 1 19 . 1 1 68 68 ASN N N 68 112.108 112.108 117.756 -5.648 18933 13494 1 19 . 1 1 68 68 ASN C C 68 174.884 174.884 173.916 0.968 18933 13495 1 19 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.406 -1.379 18933 13496 1 19 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.550 0.682 18933 13497 1 19 . 1 1 68 68 ASN H H 68 7.009 7.009 8.315 -1.306 18933 13498 1 19 . 1 1 69 69 ILE N N 69 123.325 123.325 123.605 -0.280 18933 13499 1 19 . 1 1 69 69 ILE C C 69 174.394 174.394 175.394 -1.000 18933 13500 1 19 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.633 -1.526 18933 13501 1 19 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.402 -0.135 18933 13502 1 19 . 1 1 69 69 ILE H H 69 7.150 7.150 8.237 -1.087 18933 13503 1 19 . 1 1 70 70 ARG N N 70 126.722 126.722 127.790 -1.068 18933 13504 1 19 . 1 1 70 70 ARG C C 70 174.590 174.590 174.552 0.038 18933 13505 1 19 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.551 -1.304 18933 13506 1 19 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.899 -2.527 18933 13507 1 19 . 1 1 70 70 ARG H H 70 8.902 8.902 9.259 -0.357 18933 13508 1 19 . 1 1 71 71 ILE N N 71 119.978 119.978 119.872 0.106 18933 13509 1 19 . 1 1 71 71 ILE C C 71 175.583 175.583 175.852 -0.269 18933 13510 1 19 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.678 0.145 18933 13511 1 19 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.199 -2.439 18933 13512 1 19 . 1 1 71 71 ILE H H 71 7.491 7.491 8.787 -1.296 18933 13513 1 19 . 1 1 72 72 LYS N N 72 128.530 128.530 124.494 4.036 18933 13514 1 19 . 1 1 72 72 LYS C C 72 177.703 177.703 176.067 1.636 18933 13515 1 19 . 1 1 72 72 LYS CA C 72 57.201 57.201 54.932 2.269 18933 13516 1 19 . 1 1 72 72 LYS CB C 72 31.485 31.485 31.116 0.369 18933 13517 1 19 . 1 1 72 72 LYS H H 72 8.523 8.523 8.576 -0.053 18933 13518 1 19 . 1 1 73 73 GLY N N 73 113.806 113.806 109.973 3.833 18933 13519 1 19 . 1 1 73 73 GLY C C 73 173.781 173.781 172.901 0.880 18933 13520 1 19 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.184 0.638 18933 13521 1 19 . 1 1 73 73 GLY H H 73 8.791 8.791 8.296 0.495 18933 13522 1 19 . 1 1 74 74 LEU N N 74 120.490 120.490 118.164 2.326 18933 13523 1 19 . 1 1 74 74 LEU C C 74 175.840 175.840 173.523 2.317 18933 13524 1 19 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.580 -0.889 18933 13525 1 19 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.221 -1.060 18933 13526 1 19 . 1 1 74 74 LEU H H 74 7.393 7.393 7.282 0.111 18933 13527 1 19 . 1 1 75 75 SER N N 75 120.038 120.038 115.771 4.267 18933 13528 1 19 . 1 1 75 75 SER C C 75 173.205 173.205 173.289 -0.084 18933 13529 1 19 . 1 1 75 75 SER CA C 75 57.887 57.887 57.794 0.093 18933 13530 1 19 . 1 1 75 75 SER CB C 75 63.049 63.049 65.053 -2.004 18933 13531 1 19 . 1 1 75 75 SER H H 75 8.917 8.917 8.114 0.803 18933 13532 1 19 . 1 1 76 76 PHE N N 76 119.586 119.586 118.457 1.129 18933 13533 1 19 . 1 1 76 76 PHE C C 76 173.536 173.536 173.448 0.088 18933 13534 1 19 . 1 1 76 76 PHE CA C 76 55.426 55.426 55.885 -0.459 18933 13535 1 19 . 1 1 76 76 PHE CB C 76 42.006 42.006 41.881 0.125 18933 13536 1 19 . 1 1 76 76 PHE H H 76 8.003 8.003 8.324 -0.321 18933 13537 1 19 . 1 1 77 77 SER N N 77 114.943 114.943 116.094 -1.151 18933 13538 1 19 . 1 1 77 77 SER C C 77 173.438 173.438 172.076 1.362 18933 13539 1 19 . 1 1 77 77 SER CA C 77 56.152 56.152 57.005 -0.853 18933 13540 1 19 . 1 1 77 77 SER CB C 77 65.204 65.204 66.095 -0.891 18933 13541 1 19 . 1 1 77 77 SER H H 77 8.907 8.907 8.882 0.025 18933 13542 1 19 . 1 1 78 78 VAL N N 78 124.791 124.791 124.656 0.135 18933 13543 1 19 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.210 1.834 18933 13544 1 19 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.743 -2.561 18933 13545 1 19 . 1 1 78 78 VAL H H 78 8.892 8.892 8.214 0.678 18933 13546 1 19 . 1 1 79 79 LYS N N 79 129.667 129.667 129.514 0.153 18933 13547 1 19 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.176 2.016 18933 13548 1 19 . 1 1 79 79 LYS CB C 79 32.372 32.372 33.794 -1.421 18933 13549 1 19 . 1 1 79 79 LYS H H 79 9.049 9.049 8.578 0.471 18933 13550 1 19 . 1 1 82 82 GLY N N 82 117.263 117.263 115.541 1.722 18933 13551 1 19 . 1 1 82 82 GLY C C 82 171.710 171.710 174.213 -2.503 18933 13552 1 19 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.744 -2.819 18933 13553 1 19 . 1 1 82 82 GLY H H 82 8.044 8.044 8.439 -0.395 18933 13554 1 19 . 1 1 83 83 GLU N N 83 117.203 117.203 120.182 -2.979 18933 13555 1 19 . 1 1 83 83 GLU C C 83 178.695 178.695 177.753 0.942 18933 13556 1 19 . 1 1 83 83 GLU CA C 83 58.977 58.977 56.933 2.044 18933 13557 1 19 . 1 1 83 83 GLU CB C 83 29.837 29.837 30.113 -0.276 18933 13558 1 19 . 1 1 83 83 GLU H H 83 8.296 8.296 8.412 -0.116 18933 13559 1 19 . 1 1 84 84 ARG N N 84 113.818 113.818 119.225 -5.407 18933 13560 1 19 . 1 1 84 84 ARG C C 84 175.877 175.877 175.072 0.805 18933 13561 1 19 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.357 -1.626 18933 13562 1 19 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.591 1.704 18933 13563 1 19 . 1 1 84 84 ARG H H 84 8.342 8.342 8.046 0.296 18933 13564 1 19 . 1 1 85 85 LYS N N 85 119.354 119.354 121.401 -2.047 18933 13565 1 19 . 1 1 85 85 LYS C C 85 174.516 174.516 174.317 0.199 18933 13566 1 19 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.581 -0.841 18933 13567 1 19 . 1 1 85 85 LYS CB C 85 34.844 34.844 34.312 0.532 18933 13568 1 19 . 1 1 85 85 LYS H H 85 6.822 6.822 7.603 -0.781 18933 13569 1 19 . 1 1 86 86 CYS N N 86 125.928 125.928 124.540 1.388 18933 13570 1 19 . 1 1 86 86 CYS C C 86 171.600 171.600 173.055 -1.455 18933 13571 1 19 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.850 -2.223 18933 13572 1 19 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.833 -0.489 18933 13573 1 19 . 1 1 86 86 CYS H H 86 9.084 9.084 9.340 -0.256 18933 13574 1 19 . 1 1 87 87 VAL N N 87 126.612 126.612 125.606 1.006 18933 13575 1 19 . 1 1 87 87 VAL C C 87 174.431 174.431 174.607 -0.176 18933 13576 1 19 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.658 -0.341 18933 13577 1 19 . 1 1 87 87 VAL CB C 87 33.196 33.196 31.880 1.316 18933 13578 1 19 . 1 1 87 87 VAL H H 87 8.705 8.705 8.886 -0.181 18933 13579 1 19 . 1 1 88 88 LEU N N 88 127.748 127.748 124.185 3.563 18933 13580 1 19 . 1 1 88 88 LEU C C 88 175.227 175.227 174.503 0.724 18933 13581 1 19 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.773 -0.253 18933 13582 1 19 . 1 1 88 88 LEU CB C 88 44.605 44.605 45.866 -1.261 18933 13583 1 19 . 1 1 88 88 LEU H H 88 9.417 9.417 8.568 0.849 18933 13584 1 19 . 1 1 89 89 PHE N N 89 120.981 120.981 118.577 2.404 18933 13585 1 19 . 1 1 89 89 PHE C C 89 176.906 176.906 175.910 0.996 18933 13586 1 19 . 1 1 89 89 PHE CA C 89 55.587 55.587 55.301 0.286 18933 13587 1 19 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.272 -2.371 18933 13588 1 19 . 1 1 89 89 PHE H H 89 8.937 8.937 8.397 0.540 18933 13589 1 19 . 1 1 90 90 ILE N N 90 119.928 119.928 117.954 1.974 18933 13590 1 19 . 1 1 90 90 ILE C C 90 173.781 173.781 175.069 -1.288 18933 13591 1 19 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.403 -0.749 18933 13592 1 19 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.358 1.254 18933 13593 1 19 . 1 1 90 90 ILE H H 90 9.230 9.230 9.021 0.209 18933 13594 1 19 . 1 1 91 91 GLU N N 91 124.339 124.339 124.852 -0.513 18933 13595 1 19 . 1 1 91 91 GLU C C 91 175.607 175.607 175.469 0.138 18933 13596 1 19 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.626 -0.007 18933 13597 1 19 . 1 1 91 91 GLU CB C 91 29.837 29.837 32.829 -2.992 18933 13598 1 19 . 1 1 91 91 GLU H H 91 8.175 8.175 9.025 -0.850 18933 13599 1 19 . 1 1 92 92 TRP N N 92 127.516 127.516 124.874 2.642 18933 13600 1 19 . 1 1 92 92 TRP C C 92 175.203 175.203 176.424 -1.221 18933 13601 1 19 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.965 1.268 18933 13602 1 19 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.557 1.104 18933 13603 1 19 . 1 1 92 92 TRP H H 92 9.306 9.306 8.526 0.780 18933 13604 1 19 . 1 1 93 93 GLU N N 93 127.834 127.834 125.156 2.678 18933 13605 1 19 . 1 1 93 93 GLU C C 93 175.668 175.668 176.280 -0.612 18933 13606 1 19 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.465 -0.587 18933 13607 1 19 . 1 1 93 93 GLU CB C 93 26.034 26.034 29.089 -3.055 18933 13608 1 19 . 1 1 93 93 GLU H H 93 8.796 8.796 9.096 -0.300 18933 13609 1 19 . 1 1 94 94 LYS N N 94 108.931 108.931 111.630 -2.699 18933 13610 1 19 . 1 1 94 94 LYS C C 94 175.423 175.423 176.555 -1.132 18933 13611 1 19 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.786 -0.343 18933 13612 1 19 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.478 -2.845 18933 13613 1 19 . 1 1 94 94 LYS H H 94 8.498 8.498 8.565 -0.067 18933 13614 1 19 . 1 1 95 95 LYS N N 95 121.737 121.737 120.934 0.803 18933 13615 1 19 . 1 1 95 95 LYS C C 95 174.443 174.443 175.572 -1.129 18933 13616 1 19 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.812 -2.395 18933 13617 1 19 . 1 1 95 95 LYS CB C 95 34.464 34.464 33.732 0.732 18933 13618 1 19 . 1 1 95 95 LYS H H 95 7.761 7.761 7.777 -0.016 18933 13619 1 19 . 1 1 96 96 THR N N 96 116.067 116.067 116.183 -0.116 18933 13620 1 19 . 1 1 96 96 THR C C 96 174.296 174.296 173.756 0.540 18933 13621 1 19 . 1 1 96 96 THR CA C 96 61.115 61.115 61.328 -0.213 18933 13622 1 19 . 1 1 96 96 THR CB C 96 69.450 69.450 71.243 -1.793 18933 13623 1 19 . 1 1 96 96 THR H H 96 7.761 7.761 8.352 -0.591 18933 13624 1 19 . 1 1 97 97 TYR N N 97 124.229 124.229 125.625 -1.396 18933 13625 1 19 . 1 1 97 97 TYR C C 97 173.536 173.536 173.756 -0.220 18933 13626 1 19 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.491 -0.541 18933 13627 1 19 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.507 -1.325 18933 13628 1 19 . 1 1 97 97 TYR H H 97 9.018 9.018 9.288 -0.270 18933 13629 1 19 . 1 1 98 98 GLN N N 98 123.435 123.435 123.520 -0.085 18933 13630 1 19 . 1 1 98 98 GLN C C 98 173.266 173.266 173.738 -0.472 18933 13631 1 19 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.092 0.051 18933 13632 1 19 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.582 -0.569 18933 13633 1 19 . 1 1 98 98 GLN H H 98 8.781 8.781 8.775 0.006 18933 13634 1 19 . 1 1 99 99 LEU N N 99 130.119 130.119 127.712 2.407 18933 13635 1 19 . 1 1 99 99 LEU C C 99 173.867 173.867 174.375 -0.508 18933 13636 1 19 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.432 -0.912 18933 13637 1 19 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.311 -0.706 18933 13638 1 19 . 1 1 99 99 LEU H H 99 9.104 9.104 9.063 0.041 18933 13639 1 19 . 1 1 100 100 ASP N N 100 125.182 125.182 127.809 -2.627 18933 13640 1 19 . 1 1 100 100 ASP C C 100 172.837 172.837 174.486 -1.649 18933 13641 1 19 . 1 1 100 100 ASP CA C 100 51.754 51.754 54.893 -3.139 18933 13642 1 19 . 1 1 100 100 ASP CB C 100 39.344 39.344 42.745 -3.401 18933 13643 1 19 . 1 1 100 100 ASP H H 100 9.089 9.089 8.578 0.511 18933 13644 1 19 . 1 1 101 101 LEU N N 101 121.174 121.174 127.577 -6.403 18933 13645 1 19 . 1 1 101 101 LEU C C 101 174.529 174.529 174.710 -0.181 18933 13646 1 19 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.879 -1.964 18933 13647 1 19 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.786 -1.878 18933 13648 1 19 . 1 1 101 101 LEU H H 101 8.458 8.458 9.089 -0.631 18933 13649 1 19 . 1 1 102 102 PHE N N 102 119.464 119.464 124.340 -4.876 18933 13650 1 19 . 1 1 102 102 PHE C C 102 176.293 176.293 174.706 1.587 18933 13651 1 19 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.487 -1.433 18933 13652 1 19 . 1 1 102 102 PHE CB C 102 41.880 41.880 43.039 -1.159 18933 13653 1 19 . 1 1 102 102 PHE H H 102 8.281 8.281 9.227 -0.946 18933 13654 1 19 . 1 1 103 103 THR N N 103 108.576 108.576 117.970 -9.394 18933 13655 1 19 . 1 1 103 103 THR C C 103 174.933 174.933 173.537 1.396 18933 13656 1 19 . 1 1 103 103 THR CA C 103 57.726 57.726 60.220 -2.494 18933 13657 1 19 . 1 1 103 103 THR CB C 103 71.288 71.288 69.373 1.915 18933 13658 1 19 . 1 1 103 103 THR H H 103 7.872 7.872 8.321 -0.449 18933 13659 1 19 . 1 1 104 104 ALA N N 104 122.885 122.885 128.597 -5.712 18933 13660 1 19 . 1 1 104 104 ALA C C 104 175.754 175.754 174.975 0.779 18933 13661 1 19 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.348 0.670 18933 13662 1 19 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.875 -0.390 18933 13663 1 19 . 1 1 104 104 ALA H H 104 8.660 8.660 9.321 -0.661 18933 13664 1 19 . 1 1 105 105 LEU N N 105 120.881 120.881 119.738 1.143 18933 13665 1 19 . 1 1 105 105 LEU C C 105 179.504 179.504 179.089 0.415 18933 13666 1 19 . 1 1 105 105 LEU CA C 105 53.247 53.247 53.683 -0.436 18933 13667 1 19 . 1 1 105 105 LEU CB C 105 41.753 41.753 43.465 -1.712 18933 13668 1 19 . 1 1 105 105 LEU H H 105 8.226 8.226 8.223 0.003 18933 13669 1 19 . 1 1 106 106 ALA N N 106 124.901 124.901 124.260 0.641 18933 13670 1 19 . 1 1 106 106 ALA C C 106 181.269 181.269 179.240 2.029 18933 13671 1 19 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.985 1.328 18933 13672 1 19 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.877 -1.653 18933 13673 1 19 . 1 1 106 106 ALA H H 106 8.392 8.392 8.622 -0.230 18933 13674 1 19 . 1 1 107 107 GLU N N 107 116.409 116.409 116.035 0.374 18933 13675 1 19 . 1 1 107 107 GLU C C 107 177.764 177.764 177.103 0.661 18933 13676 1 19 . 1 1 107 107 GLU CA C 107 58.533 58.533 57.915 0.618 18933 13677 1 19 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.570 -1.634 18933 13678 1 19 . 1 1 107 107 GLU H H 107 9.664 9.664 8.661 1.003 18933 13679 1 19 . 1 1 108 108 GLU N N 108 116.189 116.189 117.771 -1.582 18933 13680 1 19 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.368 -1.225 18933 13681 1 19 . 1 1 108 108 GLU CB C 108 29.837 29.837 29.109 0.728 18933 13682 1 19 . 1 1 108 108 GLU H H 108 7.589 7.589 7.672 -0.083 18933 13683 1 19 . 1 1 109 109 LYS N N 109 119.928 119.928 121.688 -1.760 18933 13684 1 19 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.203 1.648 18933 13685 1 19 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.495 -0.024 18933 13686 1 19 . 1 1 109 109 LYS H H 109 7.514 7.514 7.526 -0.012 18933 13687 1 19 . 1 1 111 111 TYR N N 111 114.930 114.930 119.098 -4.168 18933 13688 1 19 . 1 1 111 111 TYR C C 111 179.504 179.504 177.666 1.838 18933 13689 1 19 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.280 -2.263 18933 13690 1 19 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.595 -1.927 18933 13691 1 19 . 1 1 111 111 TYR H H 111 6.393 6.393 8.479 -2.086 18933 13692 1 19 . 1 1 112 112 ALA N N 112 124.901 124.901 122.200 2.701 18933 13693 1 19 . 1 1 112 112 ALA C C 112 179.173 179.173 179.729 -0.556 18933 13694 1 19 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.478 -0.577 18933 13695 1 19 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.006 0.106 18933 13696 1 19 . 1 1 112 112 ALA H H 112 8.554 8.554 7.985 0.569 18933 13697 1 19 . 1 1 113 113 ILE N N 113 119.464 119.464 119.784 -0.320 18933 13698 1 19 . 1 1 113 113 ILE C C 113 178.499 178.499 177.662 0.837 18933 13699 1 19 . 1 1 113 113 ILE CA C 113 66.281 66.281 63.970 2.311 18933 13700 1 19 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.855 -0.538 18933 13701 1 19 . 1 1 113 113 ILE H H 113 8.680 8.680 7.674 1.006 18933 13702 1 19 . 1 1 114 114 PHE N N 114 122.922 122.922 122.167 0.755 18933 13703 1 19 . 1 1 114 114 PHE C C 114 178.217 178.217 177.977 0.240 18933 13704 1 19 . 1 1 114 114 PHE CA C 114 61.559 61.559 59.820 1.739 18933 13705 1 19 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.511 0.960 18933 13706 1 19 . 1 1 114 114 PHE H H 114 7.721 7.721 8.537 -0.816 18933 13707 1 19 . 1 1 115 115 HIS N N 115 118.560 118.560 118.853 -0.293 18933 13708 1 19 . 1 1 115 115 HIS C C 115 177.286 177.286 176.848 0.438 18933 13709 1 19 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.530 -0.150 18933 13710 1 19 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.094 1.771 18933 13711 1 19 . 1 1 115 115 HIS H H 115 8.155 8.155 8.503 -0.348 18933 13712 1 19 . 1 1 116 116 PHE N N 116 111.472 111.472 116.834 -5.362 18933 13713 1 19 . 1 1 116 116 PHE C C 116 179.026 179.026 177.790 1.236 18933 13714 1 19 . 1 1 116 116 PHE CA C 116 59.461 59.461 60.405 -0.944 18933 13715 1 19 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.757 -1.568 18933 13716 1 19 . 1 1 116 116 PHE H H 116 8.564 8.564 7.974 0.590 18933 13717 1 19 . 1 1 117 117 THR N N 117 119.012 119.012 112.131 6.881 18933 13718 1 19 . 1 1 117 117 THR C C 117 172.935 172.935 175.212 -2.277 18933 13719 1 19 . 1 1 117 117 THR CA C 117 67.088 67.088 64.810 2.278 18933 13720 1 19 . 1 1 117 117 THR CB C 117 37.126 37.126 69.087 -31.960 18933 13721 1 19 . 1 1 117 117 THR H H 117 7.620 7.620 8.313 -0.693 18933 13722 1 19 . 1 1 118 118 GLY N N 118 107.917 107.917 110.093 -2.176 18933 13723 1 19 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.283 1.884 18933 13724 1 19 . 1 1 118 118 GLY H H 118 6.666 6.666 7.606 -0.940 18933 13725 1 19 . 1 1 121 121 SER N N 121 113.354 113.354 117.996 -4.642 18933 13726 1 19 . 1 1 121 121 SER C C 121 176.061 176.061 176.102 -0.041 18933 13727 1 19 . 1 1 121 121 SER CA C 121 61.035 61.035 61.546 -0.511 18933 13728 1 19 . 1 1 121 121 SER H H 121 8.322 8.322 8.302 0.020 18933 13729 1 19 . 1 1 122 122 TYR N N 122 124.681 124.681 122.022 2.659 18933 13730 1 19 . 1 1 122 122 TYR C C 122 176.293 176.293 177.160 -0.867 18933 13731 1 19 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.608 -1.551 18933 13732 1 19 . 1 1 122 122 TYR CB C 122 38.711 38.711 37.929 0.782 18933 13733 1 19 . 1 1 122 122 TYR H H 122 6.514 6.514 8.354 -1.840 18933 13734 1 19 . 1 1 123 123 LEU N N 123 117.997 117.997 120.030 -2.033 18933 13735 1 19 . 1 1 123 123 LEU C C 123 179.774 179.774 178.901 0.873 18933 13736 1 19 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.739 0.139 18933 13737 1 19 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.991 -1.013 18933 13738 1 19 . 1 1 123 123 LEU H H 123 7.428 7.428 7.278 0.150 18933 13739 1 19 . 1 1 124 124 ILE N N 124 119.012 119.012 120.808 -1.796 18933 13740 1 19 . 1 1 124 124 ILE C C 124 178.830 178.830 178.110 0.720 18933 13741 1 19 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.288 -0.137 18933 13742 1 19 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.175 -0.112 18933 13743 1 19 . 1 1 124 124 ILE H H 124 8.453 8.453 8.444 0.009 18933 13744 1 19 . 1 1 125 125 ARG N N 125 121.174 121.174 119.277 1.897 18933 13745 1 19 . 1 1 125 125 ARG C C 125 179.762 179.762 178.976 0.786 18933 13746 1 19 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.194 0.863 18933 13747 1 19 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.386 -0.436 18933 13748 1 19 . 1 1 125 125 ARG H H 125 7.004 7.004 8.059 -1.055 18933 13749 1 19 . 1 1 126 126 ILE N N 126 122.299 122.299 120.680 1.619 18933 13750 1 19 . 1 1 126 126 ILE C C 126 178.352 178.352 177.784 0.568 18933 13751 1 19 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.765 -2.560 18933 13752 1 19 . 1 1 126 126 ILE CB C 126 35.415 35.415 36.934 -1.519 18933 13753 1 19 . 1 1 126 126 ILE H H 126 7.579 7.579 8.002 -0.423 18933 13754 1 19 . 1 1 127 127 ARG N N 127 119.354 119.354 119.708 -0.354 18933 13755 1 19 . 1 1 127 127 ARG C C 127 179.786 179.786 178.986 0.800 18933 13756 1 19 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.867 0.119 18933 13757 1 19 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.058 -0.728 18933 13758 1 19 . 1 1 127 127 ARG H H 127 8.715 8.715 8.158 0.557 18933 13759 1 19 . 1 1 128 128 ALA N N 128 122.873 122.873 121.030 1.843 18933 13760 1 19 . 1 1 128 128 ALA C C 128 180.325 180.325 179.370 0.955 18933 13761 1 19 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.641 0.099 18933 13762 1 19 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.241 -1.081 18933 13763 1 19 . 1 1 128 128 ALA H H 128 7.978 7.978 8.194 -0.216 18933 13764 1 19 . 1 1 129 129 ALA N N 129 121.846 121.846 121.807 0.039 18933 13765 1 19 . 1 1 129 129 ALA C C 129 181.539 181.539 179.929 1.610 18933 13766 1 19 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.851 -0.353 18933 13767 1 19 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.642 -1.164 18933 13768 1 19 . 1 1 129 129 ALA H H 129 7.519 7.519 8.150 -0.631 18933 13769 1 19 . 1 1 130 130 LEU N N 130 119.134 119.134 118.172 0.962 18933 13770 1 19 . 1 1 130 130 LEU C C 130 179.909 179.909 179.027 0.882 18933 13771 1 19 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.080 -0.081 18933 13772 1 19 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.785 -1.363 18933 13773 1 19 . 1 1 130 130 LEU H H 130 8.296 8.296 8.748 -0.452 18933 13774 1 19 . 1 1 131 131 LYS N N 131 122.299 122.299 119.869 2.430 18933 13775 1 19 . 1 1 131 131 LYS C C 131 180.289 180.289 178.787 1.502 18933 13776 1 19 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.573 -0.556 18933 13777 1 19 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.167 -0.935 18933 13778 1 19 . 1 1 131 131 LYS H H 131 8.281 8.281 7.747 0.534 18933 13779 1 19 . 1 1 132 132 LYS N N 132 118.743 118.743 117.413 1.330 18933 13780 1 19 . 1 1 132 132 LYS C C 132 177.482 177.482 178.100 -0.618 18933 13781 1 19 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.227 0.265 18933 13782 1 19 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.263 -1.031 18933 13783 1 19 . 1 1 132 132 LYS H H 132 7.317 7.317 7.542 -0.225 18933 13784 1 19 . 1 1 133 133 LYS N N 133 117.093 117.093 117.263 -0.170 18933 13785 1 19 . 1 1 133 133 LYS C C 133 174.614 174.614 176.095 -1.481 18933 13786 1 19 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.898 -1.118 18933 13787 1 19 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.946 -0.764 18933 13788 1 19 . 1 1 133 133 LYS H H 133 7.327 7.327 7.652 -0.325 18933 13789 1 19 . 1 1 134 134 ASN N N 134 113.012 113.012 115.615 -2.603 18933 13790 1 19 . 1 1 134 134 ASN C C 134 173.965 173.965 173.508 0.457 18933 13791 1 19 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.346 -0.050 18933 13792 1 19 . 1 1 134 134 ASN CB C 134 36.175 36.175 36.944 -0.769 18933 13793 1 19 . 1 1 134 134 ASN H H 134 7.938 7.938 7.780 0.158 18933 13794 1 19 . 1 1 135 135 TYR N N 135 115.725 115.725 119.398 -3.673 18933 13795 1 19 . 1 1 135 135 TYR C C 135 176.342 176.342 174.941 1.401 18933 13796 1 19 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.679 -2.011 18933 13797 1 19 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.307 1.256 18933 13798 1 19 . 1 1 135 135 TYR H H 135 7.741 7.741 8.432 -0.691 18933 13799 1 19 . 1 1 136 136 LYS N N 136 122.641 122.641 124.740 -2.099 18933 13800 1 19 . 1 1 136 136 LYS C C 136 173.475 173.475 174.740 -1.265 18933 13801 1 19 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.769 0.132 18933 13802 1 19 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.360 -1.642 18933 13803 1 19 . 1 1 136 136 LYS H H 136 9.296 9.296 8.834 0.462 18933 13804 1 19 . 1 1 137 137 LEU N N 137 127.284 127.284 122.341 4.943 18933 13805 1 19 . 1 1 137 137 LEU C C 137 175.423 175.423 176.102 -0.679 18933 13806 1 19 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.109 0.017 18933 13807 1 19 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.699 3.047 18933 13808 1 19 . 1 1 137 137 LEU H H 137 8.776 8.776 8.566 0.210 18933 13809 1 19 . 1 1 138 138 ASN N N 138 125.818 125.818 119.188 6.630 18933 13810 1 19 . 1 1 138 138 ASN C C 138 174.933 174.933 175.286 -0.353 18933 13811 1 19 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.583 -0.466 18933 13812 1 19 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.066 -4.560 18933 13813 1 19 . 1 1 138 138 ASN H H 138 8.811 8.811 8.201 0.610 18933 13814 1 19 . 1 1 139 139 GLN N N 139 116.861 116.861 119.558 -2.697 18933 13815 1 19 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.443 -1.605 18933 13816 1 19 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.757 -3.040 18933 13817 1 19 . 1 1 139 139 GLN H H 139 9.220 9.220 8.891 0.329 18933 13818 1 19 . 1 1 140 140 TYR N N 140 120.600 120.600 119.522 1.078 18933 13819 1 19 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.902 -1.145 18933 13820 1 19 . 1 1 140 140 TYR CB C 140 37.570 37.570 38.127 -0.557 18933 13821 1 19 . 1 1 140 140 TYR H H 140 8.549 8.549 7.777 0.772 18933 13822 1 19 . 1 1 141 141 GLY N N 141 105.986 105.986 108.196 -2.210 18933 13823 1 19 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.364 -0.520 18933 13824 1 19 . 1 1 141 141 GLY H H 141 7.186 7.186 7.911 -0.725 18933 13825 1 19 . 1 1 142 142 LEU N N 142 120.038 120.038 117.720 2.318 18933 13826 1 19 . 1 1 142 142 LEU C C 142 173.340 173.340 176.005 -2.665 18933 13827 1 19 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.536 -1.016 18933 13828 1 19 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.370 0.981 18933 13829 1 19 . 1 1 142 142 LEU H H 142 7.539 7.539 8.261 -0.722 18933 13830 1 19 . 1 1 143 143 PHE N N 143 124.229 124.229 119.788 4.441 18933 13831 1 19 . 1 1 143 143 PHE C C 143 173.977 173.977 175.094 -1.117 18933 13832 1 19 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.181 -2.540 18933 13833 1 19 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.472 4.196 18933 13834 1 19 . 1 1 143 143 PHE H H 143 9.084 9.084 8.960 0.123 18933 13835 1 19 . 1 1 144 144 LYS N N 144 127.858 127.858 123.623 4.235 18933 13836 1 19 . 1 1 144 144 LYS C C 144 175.092 175.092 177.012 -1.920 18933 13837 1 19 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.250 4.606 18933 13838 1 19 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.210 4.374 18933 13839 1 19 . 1 1 144 144 LYS H H 144 9.281 9.281 8.811 0.470 18933 13840 1 19 . 1 1 145 145 ASN N N 145 128.188 128.188 126.624 1.564 18933 13841 1 19 . 1 1 145 145 ASN C C 145 175.779 175.779 174.824 0.955 18933 13842 1 19 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.398 3.328 18933 13843 1 19 . 1 1 145 145 ASN CB C 145 34.654 34.654 38.002 -3.348 18933 13844 1 19 . 1 1 145 145 ASN H H 145 9.205 9.205 9.231 -0.026 18933 13845 1 19 . 1 1 146 146 GLN N N 146 129.655 129.655 112.554 17.101 18933 13846 1 19 . 1 1 146 146 GLN C C 146 175.399 175.399 174.555 0.844 18933 13847 1 19 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.080 1.735 18933 13848 1 19 . 1 1 146 146 GLN CB C 146 32.626 32.626 27.998 4.628 18933 13849 1 19 . 1 1 146 146 GLN H H 146 8.983 8.983 8.792 0.191 18933 13850 1 19 . 1 1 147 147 THR N N 147 117.936 117.936 115.935 2.001 18933 13851 1 19 . 1 1 147 147 THR C C 147 173.254 173.254 173.411 -0.157 18933 13852 1 19 . 1 1 147 147 THR CA C 147 61.721 61.721 61.711 0.010 18933 13853 1 19 . 1 1 147 147 THR CB C 147 70.274 70.274 69.530 0.744 18933 13854 1 19 . 1 1 147 147 THR H H 147 8.029 8.029 7.861 0.168 18933 13855 1 19 . 1 1 148 148 LEU N N 148 130.681 130.681 131.426 -0.745 18933 13856 1 19 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.507 -0.041 18933 13857 1 19 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.900 -1.210 18933 13858 1 19 . 1 1 148 148 LEU H H 148 8.635 8.635 8.874 -0.239 18933 13859 1 19 . 1 1 149 149 VAL N N 149 130.803 130.803 128.951 1.852 18933 13860 1 19 . 1 1 149 149 VAL CA C 149 59.178 59.178 57.961 1.217 18933 13861 1 19 . 1 1 149 149 VAL CB C 149 31.675 31.675 35.023 -3.348 18933 13862 1 19 . 1 1 149 149 VAL H H 149 8.968 8.968 9.234 -0.266 18933 13863 1 19 . 1 1 151 151 LEU N N 151 124.290 124.290 120.186 4.104 18933 13864 1 19 . 1 1 151 151 LEU CA C 151 54.013 54.013 53.996 0.017 18933 13865 1 19 . 1 1 151 151 LEU CB C 151 44.098 44.098 38.780 5.318 18933 13866 1 19 . 1 1 151 151 LEU H H 151 7.872 7.872 8.424 -0.552 18933 13867 1 19 . 1 1 153 153 ILE N N 153 114.943 114.943 119.201 -4.258 18933 13868 1 19 . 1 1 153 153 ILE C C 153 175.877 175.877 174.929 0.948 18933 13869 1 19 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.768 -0.074 18933 13870 1 19 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.020 1.669 18933 13871 1 19 . 1 1 153 153 ILE H H 153 7.125 7.125 7.469 -0.344 18933 13872 1 19 . 1 1 154 154 THR N N 154 111.766 111.766 113.478 -1.712 18933 13873 1 19 . 1 1 154 154 THR C C 154 174.945 174.945 173.873 1.072 18933 13874 1 19 . 1 1 154 154 THR CA C 154 62.124 62.124 62.500 -0.376 18933 13875 1 19 . 1 1 154 154 THR CB C 154 70.718 70.718 69.476 1.242 18933 13876 1 19 . 1 1 154 154 THR H H 154 9.286 9.286 8.473 0.813 18933 13877 1 19 . 1 1 155 155 THR N N 155 111.766 111.766 113.176 -1.410 18933 13878 1 19 . 1 1 155 155 THR CA C 155 58.936 58.936 60.478 -1.542 18933 13879 1 19 . 1 1 155 155 THR CB C 155 72.683 72.683 71.340 1.343 18933 13880 1 19 . 1 1 155 155 THR H H 155 7.645 7.645 7.335 0.310 18933 13881 1 19 . 1 1 157 157 LYS N N 157 119.464 119.464 118.760 0.704 18933 13882 1 19 . 1 1 157 157 LYS C C 157 178.781 178.781 178.448 0.333 18933 13883 1 19 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.606 0.420 18933 13884 1 19 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.555 -0.133 18933 13885 1 19 . 1 1 157 157 LYS H H 157 8.175 8.175 8.210 -0.035 18933 13886 1 19 . 1 1 158 158 GLU N N 158 118.340 118.340 117.433 0.907 18933 13887 1 19 . 1 1 158 158 GLU C C 158 178.867 178.867 178.873 -0.006 18933 13888 1 19 . 1 1 158 158 GLU CA C 158 58.492 58.492 58.688 -0.196 18933 13889 1 19 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.735 0.595 18933 13890 1 19 . 1 1 158 158 GLU H H 158 7.519 7.519 8.374 -0.855 18933 13891 1 19 . 1 1 159 159 LEU N N 159 120.710 120.710 121.740 -1.030 18933 13892 1 19 . 1 1 159 159 LEU C C 159 176.526 176.526 178.434 -1.908 18933 13893 1 19 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.220 -0.050 18933 13894 1 19 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.763 -1.848 18933 13895 1 19 . 1 1 159 159 LEU H H 159 7.524 7.524 7.818 -0.294 18933 13896 1 19 . 1 1 160 160 ILE N N 160 118.217 118.217 118.493 -0.276 18933 13897 1 19 . 1 1 160 160 ILE C C 160 177.213 177.213 178.085 -0.872 18933 13898 1 19 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.556 -0.526 18933 13899 1 19 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.258 0.248 18933 13900 1 19 . 1 1 160 160 ILE H H 160 7.741 7.741 7.769 -0.028 18933 13901 1 19 . 1 1 161 161 LYS N N 161 118.450 118.450 120.222 -1.772 18933 13902 1 19 . 1 1 161 161 LYS C C 161 180.999 180.999 179.863 1.136 18933 13903 1 19 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.505 -0.690 18933 13904 1 19 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.174 -1.196 18933 13905 1 19 . 1 1 161 161 LYS H H 161 7.382 7.382 7.998 -0.616 18933 13906 1 19 . 1 1 162 162 GLU N N 162 121.846 121.846 120.657 1.189 18933 13907 1 19 . 1 1 162 162 GLU C C 162 178.818 178.818 178.515 0.303 18933 13908 1 19 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.913 -0.864 18933 13909 1 19 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.511 -1.575 18933 13910 1 19 . 1 1 162 162 GLU H H 162 8.210 8.210 7.882 0.328 18933 13911 1 19 . 1 1 163 163 LEU N N 163 116.751 116.751 112.419 4.332 18933 13912 1 19 . 1 1 163 163 LEU C C 163 176.784 176.784 177.009 -0.225 18933 13913 1 19 . 1 1 163 163 LEU CA C 163 55.022 55.022 54.642 0.380 18933 13914 1 19 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.330 -0.021 18933 13915 1 19 . 1 1 163 163 LEU H H 163 7.796 7.796 7.384 0.412 18933 13916 1 19 . 1 1 164 164 GLY N N 164 104.849 104.849 106.439 -1.590 18933 13917 1 19 . 1 1 164 164 GLY C C 164 174.492 174.492 173.854 0.638 18933 13918 1 19 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.362 -0.630 18933 13919 1 19 . 1 1 164 164 GLY H H 164 7.589 7.589 7.504 0.085 18933 13920 1 19 . 1 1 165 165 PHE N N 165 118.902 118.902 119.038 -0.136 18933 13921 1 19 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.819 -1.151 18933 13922 1 19 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.703 -2.219 18933 13923 1 19 . 1 1 165 165 PHE H H 165 7.251 7.251 8.093 -0.842 18933 13924 1 19 . 1 1 166 166 THR N N 166 117.093 117.093 114.868 2.225 18933 13925 1 19 . 1 1 166 166 THR CA C 166 62.245 62.245 60.439 1.806 18933 13926 1 19 . 1 1 166 166 THR CB C 166 69.323 69.323 70.635 -1.312 18933 13927 1 19 . 1 1 166 166 THR H H 166 8.407 8.407 8.606 -0.199 18933 13928 1 19 . 1 1 168 168 ARG N N 168 127.431 127.431 120.472 6.959 18933 13929 1 19 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.275 -2.037 18933 13930 1 19 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.143 -1.151 18933 13931 1 19 . 1 1 168 168 ARG H H 168 7.160 7.160 8.312 -1.152 18933 13932 1 19 . 1 1 171 171 LYS N N 171 113.574 113.574 118.178 -4.604 18933 13933 1 19 . 1 1 171 171 LYS C C 171 176.416 176.416 178.302 -1.886 18933 13934 1 19 . 1 1 171 171 LYS CA C 171 57.605 57.605 59.130 -1.525 18933 13935 1 19 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.850 0.079 18933 13936 1 19 . 1 1 171 171 LYS H H 171 8.210 8.210 8.293 -0.083 18933 13937 1 19 . 1 1 172 172 LYS N N 172 117.313 117.313 117.177 0.136 18933 13938 1 19 . 1 1 172 172 LYS C C 172 175.717 175.717 176.560 -0.843 18933 13939 1 19 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.450 -2.275 18933 13940 1 19 . 1 1 172 172 LYS CB C 172 31.612 31.612 33.140 -1.528 18933 13941 1 19 . 1 1 172 172 LYS H H 172 7.761 7.761 7.596 0.165 18933 13942 1 19 . 1 1 173 173 ARG N N 173 122.056 122.056 118.110 3.946 18933 13943 1 19 . 1 1 173 173 ARG C C 173 172.850 172.850 175.066 -2.216 18933 13944 1 19 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.719 0.159 18933 13945 1 19 . 1 1 173 173 ARG CB C 173 28.506 28.506 29.209 -0.703 18933 13946 1 19 . 1 1 173 173 ARG H H 173 6.885 6.885 7.594 -0.709 18933 13947 1 20 . 1 1 2 2 LEU N N 2 122.812 122.812 124.356 -1.544 18933 13948 1 20 . 1 1 2 2 LEU C C 2 175.742 175.742 176.492 -0.750 18933 13949 1 20 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.482 0.652 18933 13950 1 20 . 1 1 2 2 LEU CB C 2 42.842 42.842 45.351 -2.509 18933 13951 1 20 . 1 1 2 2 LEU H H 2 8.756 8.756 8.453 0.303 18933 13952 1 20 . 1 1 3 3 THR N N 3 113.000 113.000 113.039 -0.039 18933 13953 1 20 . 1 1 3 3 THR C C 3 175.938 175.938 175.428 0.510 18933 13954 1 20 . 1 1 3 3 THR CA C 3 60.550 60.550 60.355 0.195 18933 13955 1 20 . 1 1 3 3 THR CB C 3 70.781 70.781 70.554 0.227 18933 13956 1 20 . 1 1 3 3 THR H H 3 8.428 8.428 8.115 0.313 18933 13957 1 20 . 1 1 4 4 LEU N N 4 122.531 122.531 123.093 -0.562 18933 13958 1 20 . 1 1 4 4 LEU C C 4 178.463 178.463 178.319 0.144 18933 13959 1 20 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.667 -0.538 18933 13960 1 20 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.061 -2.527 18933 13961 1 20 . 1 1 4 4 LEU H H 4 7.731 7.731 7.894 -0.163 18933 13962 1 20 . 1 1 5 5 ILE N N 5 115.505 115.505 116.279 -0.774 18933 13963 1 20 . 1 1 5 5 ILE C C 5 178.573 178.573 177.923 0.650 18933 13964 1 20 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.504 -0.766 18933 13965 1 20 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.332 -0.460 18933 13966 1 20 . 1 1 5 5 ILE H H 5 7.645 7.645 7.938 -0.293 18933 13967 1 20 . 1 1 6 6 GLN N N 6 121.626 121.626 119.479 2.147 18933 13968 1 20 . 1 1 6 6 GLN C C 6 179.014 179.014 178.750 0.264 18933 13969 1 20 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.133 -0.801 18933 13970 1 20 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.833 0.356 18933 13971 1 20 . 1 1 6 6 GLN H H 6 7.645 7.645 7.695 -0.050 18933 13972 1 20 . 1 1 7 7 GLY N N 7 107.684 107.684 106.916 0.768 18933 13973 1 20 . 1 1 7 7 GLY C C 7 174.749 174.749 176.249 -1.500 18933 13974 1 20 . 1 1 7 7 GLY CA C 7 46.790 46.790 47.004 -0.214 18933 13975 1 20 . 1 1 7 7 GLY H H 7 8.660 8.660 8.035 0.625 18933 13976 1 20 . 1 1 8 8 LYS N N 8 120.942 120.942 122.276 -1.334 18933 13977 1 20 . 1 1 8 8 LYS C C 8 179.455 179.455 178.911 0.544 18933 13978 1 20 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.260 0.645 18933 13979 1 20 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.011 -0.589 18933 13980 1 20 . 1 1 8 8 LYS H H 8 8.518 8.518 7.555 0.963 18933 13981 1 20 . 1 1 9 9 LYS N N 9 120.710 120.710 119.546 1.164 18933 13982 1 20 . 1 1 9 9 LYS C C 9 179.823 179.823 179.255 0.568 18933 13983 1 20 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.871 -0.249 18933 13984 1 20 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.427 -1.132 18933 13985 1 20 . 1 1 9 9 LYS H H 9 7.731 7.731 8.274 -0.543 18933 13986 1 20 . 1 1 10 10 ILE N N 10 121.345 121.345 120.777 0.568 18933 13987 1 20 . 1 1 10 10 ILE C C 10 177.789 177.789 177.994 -0.205 18933 13988 1 20 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.918 -1.453 18933 13989 1 20 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.192 -1.827 18933 13990 1 20 . 1 1 10 10 ILE H H 10 7.711 7.711 8.369 -0.658 18933 13991 1 20 . 1 1 11 11 VAL N N 11 120.258 120.258 120.062 0.196 18933 13992 1 20 . 1 1 11 11 VAL C C 11 177.372 177.372 177.804 -0.432 18933 13993 1 20 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.110 0.341 18933 13994 1 20 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.520 -0.986 18933 13995 1 20 . 1 1 11 11 VAL H H 11 7.918 7.918 8.372 -0.454 18933 13996 1 20 . 1 1 12 12 ASN N N 12 116.971 116.971 117.762 -0.791 18933 13997 1 20 . 1 1 12 12 ASN C C 12 177.445 177.445 177.409 0.036 18933 13998 1 20 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.328 -0.216 18933 13999 1 20 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.496 -0.863 18933 14000 1 20 . 1 1 12 12 ASN H H 12 7.993 7.993 8.589 -0.596 18933 14001 1 20 . 1 1 13 13 HIS N N 13 120.258 120.258 119.682 0.576 18933 14002 1 20 . 1 1 13 13 HIS C C 13 177.862 177.862 177.745 0.117 18933 14003 1 20 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.593 -0.495 18933 14004 1 20 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.636 0.596 18933 14005 1 20 . 1 1 13 13 HIS H H 13 7.741 7.741 8.301 -0.560 18933 14006 1 20 . 1 1 14 14 LEU N N 14 116.641 116.641 119.671 -3.030 18933 14007 1 20 . 1 1 14 14 LEU C C 14 179.186 179.186 178.365 0.821 18933 14008 1 20 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.373 -1.616 18933 14009 1 20 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.532 -0.413 18933 14010 1 20 . 1 1 14 14 LEU H H 14 8.221 8.221 8.496 -0.275 18933 14011 1 20 . 1 1 15 15 ARG N N 15 115.957 115.957 114.606 1.351 18933 14012 1 20 . 1 1 15 15 ARG C C 15 176.330 176.330 178.235 -1.905 18933 14013 1 20 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.547 1.156 18933 14014 1 20 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.378 -1.301 18933 14015 1 20 . 1 1 15 15 ARG H H 15 7.968 7.968 8.403 -0.435 18933 14016 1 20 . 1 1 16 16 SER N N 16 109.395 109.395 115.844 -6.449 18933 14017 1 20 . 1 1 16 16 SER C C 16 176.024 176.024 175.043 0.981 18933 14018 1 20 . 1 1 16 16 SER CA C 16 57.282 57.282 60.384 -3.102 18933 14019 1 20 . 1 1 16 16 SER CB C 16 63.683 63.683 63.587 0.096 18933 14020 1 20 . 1 1 16 16 SER H H 16 6.963 6.963 7.415 -0.452 18933 14021 1 20 . 1 1 17 17 ARG N N 17 122.775 122.775 121.792 0.983 18933 14022 1 20 . 1 1 17 17 ARG C C 17 174.590 174.590 174.002 0.588 18933 14023 1 20 . 1 1 17 17 ARG CA C 17 56.273 56.273 55.001 1.272 18933 14024 1 20 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.347 1.455 18933 14025 1 20 . 1 1 17 17 ARG H H 17 7.781 7.781 8.352 -0.571 18933 14026 1 20 . 1 1 18 18 LEU N N 18 122.421 122.421 125.869 -3.448 18933 14027 1 20 . 1 1 18 18 LEU C C 18 176.281 176.281 174.042 2.239 18933 14028 1 20 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.461 0.320 18933 14029 1 20 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.937 -3.726 18933 14030 1 20 . 1 1 18 18 LEU H H 18 8.650 8.650 7.725 0.925 18933 14031 1 20 . 1 1 19 19 ALA N N 19 126.441 126.441 126.885 -0.444 18933 14032 1 20 . 1 1 19 19 ALA C C 19 173.904 173.904 174.899 -0.995 18933 14033 1 20 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.581 -0.715 18933 14034 1 20 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.279 0.586 18933 14035 1 20 . 1 1 19 19 ALA H H 19 8.609 8.609 8.938 -0.329 18933 14036 1 20 . 1 1 20 20 PHE N N 20 114.600 114.600 119.404 -4.804 18933 14037 1 20 . 1 1 20 20 PHE C C 20 172.592 172.592 173.925 -1.333 18933 14038 1 20 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.933 0.856 18933 14039 1 20 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.574 -0.885 18933 14040 1 20 . 1 1 20 20 PHE H H 20 8.801 8.801 9.130 -0.329 18933 14041 1 20 . 1 1 21 21 GLU N N 21 122.873 122.873 123.634 -0.761 18933 14042 1 20 . 1 1 21 21 GLU C C 21 174.872 174.872 175.223 -0.351 18933 14043 1 20 . 1 1 21 21 GLU CA C 21 55.062 55.062 55.070 -0.008 18933 14044 1 20 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.022 -0.297 18933 14045 1 20 . 1 1 21 21 GLU H H 21 7.847 7.847 9.258 -1.411 18933 14046 1 20 . 1 1 22 22 TYR N N 22 126.270 126.270 126.519 -0.249 18933 14047 1 20 . 1 1 22 22 TYR C C 22 174.872 174.872 174.697 0.175 18933 14048 1 20 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.758 -1.010 18933 14049 1 20 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.362 -1.257 18933 14050 1 20 . 1 1 22 22 TYR H H 22 8.806 8.806 9.168 -0.362 18933 14051 1 20 . 1 1 23 23 ASN N N 23 128.420 128.420 125.798 2.622 18933 14052 1 20 . 1 1 23 23 ASN C C 23 175.435 175.435 175.124 0.311 18933 14053 1 20 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.458 -0.453 18933 14054 1 20 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.733 -1.368 18933 14055 1 20 . 1 1 23 23 ASN H H 23 8.943 8.943 9.029 -0.086 18933 14056 1 20 . 1 1 24 24 GLY N N 24 104.067 104.067 102.052 2.015 18933 14057 1 20 . 1 1 24 24 GLY C C 24 173.707 173.707 173.847 -0.140 18933 14058 1 20 . 1 1 24 24 GLY CA C 24 44.934 44.934 45.028 -0.094 18933 14059 1 20 . 1 1 24 24 GLY H H 24 8.534 8.534 8.197 0.337 18933 14060 1 20 . 1 1 25 25 GLN N N 25 120.038 120.038 119.641 0.397 18933 14061 1 20 . 1 1 25 25 GLN C C 25 173.744 173.744 174.887 -1.143 18933 14062 1 20 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.334 -1.007 18933 14063 1 20 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.309 0.352 18933 14064 1 20 . 1 1 25 25 GLN H H 25 7.595 7.595 7.808 -0.213 18933 14065 1 20 . 1 1 26 26 LEU N N 26 124.681 124.681 124.977 -0.296 18933 14066 1 20 . 1 1 26 26 LEU C C 26 175.987 175.987 176.231 -0.244 18933 14067 1 20 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.446 -0.433 18933 14068 1 20 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.412 -1.547 18933 14069 1 20 . 1 1 26 26 LEU H H 26 8.382 8.382 8.594 -0.212 18933 14070 1 20 . 1 1 27 27 ILE N N 27 130.779 130.779 127.194 3.585 18933 14071 1 20 . 1 1 27 27 ILE C C 27 175.215 175.215 174.421 0.794 18933 14072 1 20 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.686 -0.427 18933 14073 1 20 . 1 1 27 27 ILE CB C 27 35.732 35.732 37.944 -2.212 18933 14074 1 20 . 1 1 27 27 ILE H H 27 8.882 8.882 8.912 -0.030 18933 14075 1 20 . 1 1 28 28 LYS N N 28 126.160 126.160 127.591 -1.431 18933 14076 1 20 . 1 1 28 28 LYS C C 28 176.771 176.771 175.749 1.022 18933 14077 1 20 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.927 1.911 18933 14078 1 20 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.063 -1.325 18933 14079 1 20 . 1 1 28 28 LYS H H 28 8.165 8.165 8.348 -0.183 18933 14080 1 20 . 1 1 29 29 ILE N N 29 126.380 126.380 122.269 4.111 18933 14081 1 20 . 1 1 29 29 ILE C C 29 175.877 175.877 174.328 1.549 18933 14082 1 20 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.512 -0.204 18933 14083 1 20 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.593 -2.530 18933 14084 1 20 . 1 1 29 29 ILE H H 29 8.019 8.019 8.739 -0.720 18933 14085 1 20 . 1 1 30 30 LEU N N 30 129.215 129.215 122.103 7.112 18933 14086 1 20 . 1 1 30 30 LEU C C 30 178.867 178.867 178.146 0.721 18933 14087 1 20 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.346 1.273 18933 14088 1 20 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.587 -4.722 18933 14089 1 20 . 1 1 30 30 LEU H H 30 8.917 8.917 8.294 0.623 18933 14090 1 20 . 1 1 31 31 SER N N 31 117.997 117.997 116.333 1.664 18933 14091 1 20 . 1 1 31 31 SER C C 31 177.396 177.396 175.711 1.685 18933 14092 1 20 . 1 1 31 31 SER CA C 31 61.236 61.236 60.982 0.254 18933 14093 1 20 . 1 1 31 31 SER CB C 31 62.035 62.035 63.264 -1.229 18933 14094 1 20 . 1 1 31 31 SER H H 31 8.594 8.594 8.869 -0.275 18933 14095 1 20 . 1 1 32 32 LYS N N 32 116.189 116.189 118.677 -2.488 18933 14096 1 20 . 1 1 32 32 LYS C C 32 176.244 176.244 176.953 -0.709 18933 14097 1 20 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.385 -0.982 18933 14098 1 20 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.317 -2.036 18933 14099 1 20 . 1 1 32 32 LYS H H 32 8.029 8.029 8.229 -0.200 18933 14100 1 20 . 1 1 33 33 ASN N N 33 119.061 119.061 115.420 3.641 18933 14101 1 20 . 1 1 33 33 ASN C C 33 172.384 172.384 174.500 -2.116 18933 14102 1 20 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.825 -1.668 18933 14103 1 20 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.362 -3.095 18933 14104 1 20 . 1 1 33 33 ASN H H 33 7.902 7.902 7.838 0.064 18933 14105 1 20 . 1 1 34 34 ILE N N 34 120.038 120.038 120.125 -0.087 18933 14106 1 20 . 1 1 34 34 ILE C C 34 175.607 175.607 174.200 1.407 18933 14107 1 20 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.430 0.120 18933 14108 1 20 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.609 -2.645 18933 14109 1 20 . 1 1 34 34 ILE H H 34 7.443 7.443 7.788 -0.345 18933 14110 1 20 . 1 1 35 35 VAL N N 35 129.435 129.435 125.820 3.615 18933 14111 1 20 . 1 1 35 35 VAL C C 35 175.386 175.386 174.569 0.817 18933 14112 1 20 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.195 -0.169 18933 14113 1 20 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.735 -0.954 18933 14114 1 20 . 1 1 35 35 VAL H H 35 9.533 9.533 9.001 0.532 18933 14115 1 20 . 1 1 36 36 ALA N N 36 130.571 130.571 129.451 1.120 18933 14116 1 20 . 1 1 36 36 ALA C C 36 177.347 177.347 176.241 1.106 18933 14117 1 20 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.754 0.645 18933 14118 1 20 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.634 -0.776 18933 14119 1 20 . 1 1 36 36 ALA H H 36 8.665 8.665 8.413 0.252 18933 14120 1 20 . 1 1 37 37 VAL N N 37 115.395 115.395 120.884 -5.489 18933 14121 1 20 . 1 1 37 37 VAL C C 37 174.455 174.455 175.652 -1.197 18933 14122 1 20 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.187 0.193 18933 14123 1 20 . 1 1 37 37 VAL CB C 37 32.943 32.943 34.690 -1.747 18933 14124 1 20 . 1 1 37 37 VAL H H 37 8.079 8.079 8.208 -0.129 18933 14125 1 20 . 1 1 38 38 GLY N N 38 107.672 107.672 107.825 -0.153 18933 14126 1 20 . 1 1 38 38 GLY C C 38 173.364 173.364 175.538 -2.174 18933 14127 1 20 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.304 -0.119 18933 14128 1 20 . 1 1 38 38 GLY H H 38 7.579 7.579 8.208 -0.629 18933 14129 1 20 . 1 1 39 39 SER N N 39 121.052 121.052 119.636 1.416 18933 14130 1 20 . 1 1 39 39 SER C C 39 175.570 175.570 176.431 -0.861 18933 14131 1 20 . 1 1 39 39 SER CA C 39 61.801 61.801 62.026 -0.225 18933 14132 1 20 . 1 1 39 39 SER CB C 39 62.478 62.478 63.324 -0.846 18933 14133 1 20 . 1 1 39 39 SER H H 39 8.953 8.953 8.116 0.837 18933 14134 1 20 . 1 1 40 40 LEU N N 40 121.553 121.553 121.975 -0.422 18933 14135 1 20 . 1 1 40 40 LEU C C 40 180.203 180.203 178.429 1.774 18933 14136 1 20 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.575 -0.446 18933 14137 1 20 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.801 -0.048 18933 14138 1 20 . 1 1 40 40 LEU H H 40 8.195 8.195 7.323 0.872 18933 14139 1 20 . 1 1 41 41 ARG N N 41 121.956 121.956 117.681 4.275 18933 14140 1 20 . 1 1 41 41 ARG C C 41 177.323 177.323 178.101 -0.778 18933 14141 1 20 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.956 0.374 18933 14142 1 20 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.909 -1.466 18933 14143 1 20 . 1 1 41 41 ARG H H 41 6.873 6.873 7.419 -0.546 18933 14144 1 20 . 1 1 42 42 ARG N N 42 114.600 114.600 117.034 -2.434 18933 14145 1 20 . 1 1 42 42 ARG C C 42 172.911 172.911 176.029 -3.118 18933 14146 1 20 . 1 1 42 42 ARG CA C 42 57.242 57.242 57.047 0.195 18933 14147 1 20 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.958 -1.818 18933 14148 1 20 . 1 1 42 42 ARG H H 42 7.438 7.438 8.159 -0.721 18933 14149 1 20 . 1 1 43 43 GLU N N 43 113.354 113.354 116.938 -3.584 18933 14150 1 20 . 1 1 43 43 GLU C C 43 175.999 175.999 175.173 0.826 18933 14151 1 20 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.119 -0.563 18933 14152 1 20 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.133 -1.796 18933 14153 1 20 . 1 1 43 43 GLU H H 43 7.564 7.564 8.014 -0.450 18933 14154 1 20 . 1 1 44 44 GLU N N 44 119.696 119.696 122.482 -2.786 18933 14155 1 20 . 1 1 44 44 GLU C C 44 175.423 175.423 176.802 -1.379 18933 14156 1 20 . 1 1 44 44 GLU CA C 44 56.838 56.838 57.696 -0.858 18933 14157 1 20 . 1 1 44 44 GLU CB C 44 28.696 28.696 30.408 -1.712 18933 14158 1 20 . 1 1 44 44 GLU H H 44 7.261 7.261 8.678 -1.417 18933 14159 1 20 . 1 1 45 45 LYS N N 45 117.435 117.435 117.009 0.426 18933 14160 1 20 . 1 1 45 45 LYS C C 45 177.715 177.715 175.746 1.969 18933 14161 1 20 . 1 1 45 45 LYS CA C 45 59.219 59.219 57.059 2.160 18933 14162 1 20 . 1 1 45 45 LYS CB C 45 32.119 32.119 33.738 -1.619 18933 14163 1 20 . 1 1 45 45 LYS H H 45 7.938 7.938 8.189 -0.251 18933 14164 1 20 . 1 1 46 46 MET N N 46 115.847 115.847 118.700 -2.853 18933 14165 1 20 . 1 1 46 46 MET CA C 46 52.520 52.520 54.011 -1.491 18933 14166 1 20 . 1 1 46 46 MET CB C 46 33.450 33.450 35.498 -2.048 18933 14167 1 20 . 1 1 46 46 MET H H 46 7.595 7.595 7.675 -0.080 18933 14168 1 20 . 1 1 47 47 LEU N N 47 121.627 121.627 122.841 -1.214 18933 14169 1 20 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.061 -0.935 18933 14170 1 20 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.617 -0.547 18933 14171 1 20 . 1 1 47 47 LEU H H 47 9.220 9.220 8.891 0.329 18933 14172 1 20 . 1 1 49 49 ASP N N 49 117.093 117.093 118.835 -1.742 18933 14173 1 20 . 1 1 49 49 ASP C C 49 173.340 173.340 174.639 -1.299 18933 14174 1 20 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.326 -1.532 18933 14175 1 20 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.441 -1.435 18933 14176 1 20 . 1 1 49 49 ASP H H 49 7.761 7.761 7.575 0.186 18933 14177 1 20 . 1 1 50 50 VAL N N 50 119.012 119.012 117.635 1.377 18933 14178 1 20 . 1 1 50 50 VAL C C 50 173.070 173.070 174.057 -0.987 18933 14179 1 20 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.407 1.435 18933 14180 1 20 . 1 1 50 50 VAL CB C 50 32.563 32.563 32.815 -0.252 18933 14181 1 20 . 1 1 50 50 VAL H H 50 8.089 8.089 8.619 -0.530 18933 14182 1 20 . 1 1 51 51 ASP N N 51 127.064 127.064 126.258 0.806 18933 14183 1 20 . 1 1 51 51 ASP C C 51 174.565 174.565 175.400 -0.835 18933 14184 1 20 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.928 -0.771 18933 14185 1 20 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.297 -0.657 18933 14186 1 20 . 1 1 51 51 ASP H H 51 8.069 8.069 8.119 -0.050 18933 14187 1 20 . 1 1 52 52 LEU N N 52 121.627 121.627 120.121 1.506 18933 14188 1 20 . 1 1 52 52 LEU C C 52 174.063 174.063 174.721 -0.658 18933 14189 1 20 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.495 -0.813 18933 14190 1 20 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.264 -2.913 18933 14191 1 20 . 1 1 52 52 LEU H H 52 8.852 8.852 9.038 -0.186 18933 14192 1 20 . 1 1 53 53 LEU N N 53 123.093 123.093 123.306 -0.213 18933 14193 1 20 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.147 1.844 18933 14194 1 20 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.733 -2.600 18933 14195 1 20 . 1 1 53 53 LEU H H 53 9.362 9.362 9.115 0.247 18933 14196 1 20 . 1 1 54 54 ILE N N 54 123.777 123.777 129.050 -5.273 18933 14197 1 20 . 1 1 54 54 ILE CA C 54 55.062 55.062 58.962 -3.900 18933 14198 1 20 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.938 -7.868 18933 14199 1 20 . 1 1 54 54 ILE H H 54 8.907 8.907 9.312 -0.405 18933 14200 1 20 . 1 1 58 58 GLU N N 58 114.710 114.710 116.603 -1.893 18933 14201 1 20 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.634 -1.257 18933 14202 1 20 . 1 1 58 58 GLU CB C 58 31.422 31.422 33.094 -1.672 18933 14203 1 20 . 1 1 58 58 GLU H H 58 6.716 6.716 7.463 -0.747 18933 14204 1 20 . 1 1 61 61 LEU N N 61 115.957 115.957 119.915 -3.958 18933 14205 1 20 . 1 1 61 61 LEU C C 61 178.512 178.512 178.359 0.153 18933 14206 1 20 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.367 -2.587 18933 14207 1 20 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.795 -0.676 18933 14208 1 20 . 1 1 61 61 LEU H H 61 7.307 7.307 7.777 -0.470 18933 14209 1 20 . 1 1 62 62 LEU N N 62 120.038 120.038 119.543 0.495 18933 14210 1 20 . 1 1 62 62 LEU C C 62 177.874 177.874 178.779 -0.905 18933 14211 1 20 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.498 0.438 18933 14212 1 20 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.899 -1.160 18933 14213 1 20 . 1 1 62 62 LEU H H 62 7.327 7.327 8.116 -0.789 18933 14214 1 20 . 1 1 63 63 LYS N N 63 114.600 114.600 115.578 -0.978 18933 14215 1 20 . 1 1 63 63 LYS C C 63 175.460 175.460 177.137 -1.677 18933 14216 1 20 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.813 -1.249 18933 14217 1 20 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.563 -1.838 18933 14218 1 20 . 1 1 63 63 LYS H H 63 7.973 7.973 7.734 0.239 18933 14219 1 20 . 1 1 64 64 HIS N N 64 115.273 115.273 115.330 -0.057 18933 14220 1 20 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.238 0.874 18933 14221 1 20 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.314 2.122 18933 14222 1 20 . 1 1 64 64 HIS H H 64 7.544 7.544 7.505 0.039 18933 14223 1 20 . 1 1 65 65 VAL N N 65 118.682 118.682 119.241 -0.559 18933 14224 1 20 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.370 3.667 18933 14225 1 20 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.580 -2.553 18933 14226 1 20 . 1 1 65 65 VAL H H 65 6.787 6.787 7.179 -0.392 18933 14227 1 20 . 1 1 68 68 ASN N N 68 112.108 112.108 117.949 -5.841 18933 14228 1 20 . 1 1 68 68 ASN C C 68 174.884 174.884 173.933 0.951 18933 14229 1 20 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.347 -1.320 18933 14230 1 20 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.319 0.913 18933 14231 1 20 . 1 1 68 68 ASN H H 68 7.009 7.009 8.318 -1.309 18933 14232 1 20 . 1 1 69 69 ILE N N 69 123.325 123.325 123.585 -0.260 18933 14233 1 20 . 1 1 69 69 ILE C C 69 174.394 174.394 175.370 -0.976 18933 14234 1 20 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.667 -1.560 18933 14235 1 20 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.316 -0.049 18933 14236 1 20 . 1 1 69 69 ILE H H 69 7.150 7.150 8.221 -1.071 18933 14237 1 20 . 1 1 70 70 ARG N N 70 126.722 126.722 127.904 -1.182 18933 14238 1 20 . 1 1 70 70 ARG C C 70 174.590 174.590 174.356 0.234 18933 14239 1 20 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.681 -1.434 18933 14240 1 20 . 1 1 70 70 ARG CB C 70 32.372 32.372 35.079 -2.707 18933 14241 1 20 . 1 1 70 70 ARG H H 70 8.902 8.902 9.138 -0.236 18933 14242 1 20 . 1 1 71 71 ILE N N 71 119.978 119.978 120.032 -0.054 18933 14243 1 20 . 1 1 71 71 ILE C C 71 175.583 175.583 175.955 -0.372 18933 14244 1 20 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.812 0.012 18933 14245 1 20 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.411 -2.651 18933 14246 1 20 . 1 1 71 71 ILE H H 71 7.491 7.491 8.895 -1.404 18933 14247 1 20 . 1 1 72 72 LYS N N 72 128.530 128.530 124.571 3.959 18933 14248 1 20 . 1 1 72 72 LYS C C 72 177.703 177.703 176.531 1.172 18933 14249 1 20 . 1 1 72 72 LYS CA C 72 57.201 57.201 55.537 1.664 18933 14250 1 20 . 1 1 72 72 LYS CB C 72 31.485 31.485 31.433 0.052 18933 14251 1 20 . 1 1 72 72 LYS H H 72 8.523 8.523 8.522 0.001 18933 14252 1 20 . 1 1 73 73 GLY N N 73 113.806 113.806 110.105 3.701 18933 14253 1 20 . 1 1 73 73 GLY C C 73 173.781 173.781 173.081 0.700 18933 14254 1 20 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.104 0.718 18933 14255 1 20 . 1 1 73 73 GLY H H 73 8.791 8.791 8.413 0.378 18933 14256 1 20 . 1 1 74 74 LEU N N 74 120.490 120.490 118.439 2.051 18933 14257 1 20 . 1 1 74 74 LEU C C 74 175.840 175.840 173.573 2.267 18933 14258 1 20 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.425 -0.734 18933 14259 1 20 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.369 -1.208 18933 14260 1 20 . 1 1 74 74 LEU H H 74 7.393 7.393 7.289 0.104 18933 14261 1 20 . 1 1 75 75 SER N N 75 120.038 120.038 115.783 4.255 18933 14262 1 20 . 1 1 75 75 SER C C 75 173.205 173.205 173.224 -0.019 18933 14263 1 20 . 1 1 75 75 SER CA C 75 57.887 57.887 57.972 -0.085 18933 14264 1 20 . 1 1 75 75 SER CB C 75 63.049 63.049 64.995 -1.946 18933 14265 1 20 . 1 1 75 75 SER H H 75 8.917 8.917 8.162 0.755 18933 14266 1 20 . 1 1 76 76 PHE N N 76 119.586 119.586 118.415 1.171 18933 14267 1 20 . 1 1 76 76 PHE C C 76 173.536 173.536 173.813 -0.277 18933 14268 1 20 . 1 1 76 76 PHE CA C 76 55.426 55.426 55.957 -0.531 18933 14269 1 20 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.587 -0.581 18933 14270 1 20 . 1 1 76 76 PHE H H 76 8.003 8.003 8.254 -0.251 18933 14271 1 20 . 1 1 77 77 SER N N 77 114.943 114.943 116.942 -1.999 18933 14272 1 20 . 1 1 77 77 SER C C 77 173.438 173.438 172.782 0.656 18933 14273 1 20 . 1 1 77 77 SER CA C 77 56.152 56.152 57.081 -0.929 18933 14274 1 20 . 1 1 77 77 SER CB C 77 65.204 65.204 65.627 -0.423 18933 14275 1 20 . 1 1 77 77 SER H H 77 8.907 8.907 8.801 0.106 18933 14276 1 20 . 1 1 78 78 VAL N N 78 124.791 124.791 124.670 0.121 18933 14277 1 20 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.716 1.328 18933 14278 1 20 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.483 -2.301 18933 14279 1 20 . 1 1 78 78 VAL H H 78 8.892 8.892 8.403 0.489 18933 14280 1 20 . 1 1 79 79 LYS N N 79 129.667 129.667 129.595 0.072 18933 14281 1 20 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.551 1.641 18933 14282 1 20 . 1 1 79 79 LYS CB C 79 32.372 32.372 34.444 -2.072 18933 14283 1 20 . 1 1 79 79 LYS H H 79 9.049 9.049 8.939 0.110 18933 14284 1 20 . 1 1 82 82 GLY N N 82 117.263 117.263 114.531 2.732 18933 14285 1 20 . 1 1 82 82 GLY C C 82 171.710 171.710 174.490 -2.780 18933 14286 1 20 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.731 -2.807 18933 14287 1 20 . 1 1 82 82 GLY H H 82 8.044 8.044 8.489 -0.445 18933 14288 1 20 . 1 1 83 83 GLU N N 83 117.203 117.203 120.227 -3.024 18933 14289 1 20 . 1 1 83 83 GLU C C 83 178.695 178.695 177.879 0.816 18933 14290 1 20 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.423 1.554 18933 14291 1 20 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.822 0.015 18933 14292 1 20 . 1 1 83 83 GLU H H 83 8.296 8.296 8.528 -0.232 18933 14293 1 20 . 1 1 84 84 ARG N N 84 113.818 113.818 120.035 -6.217 18933 14294 1 20 . 1 1 84 84 ARG C C 84 175.877 175.877 175.504 0.373 18933 14295 1 20 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.427 -1.696 18933 14296 1 20 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.454 1.841 18933 14297 1 20 . 1 1 84 84 ARG H H 84 8.342 8.342 8.025 0.317 18933 14298 1 20 . 1 1 85 85 LYS N N 85 119.354 119.354 120.429 -1.075 18933 14299 1 20 . 1 1 85 85 LYS C C 85 174.516 174.516 174.216 0.300 18933 14300 1 20 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.457 -0.717 18933 14301 1 20 . 1 1 85 85 LYS CB C 85 34.844 34.844 35.401 -0.557 18933 14302 1 20 . 1 1 85 85 LYS H H 85 6.822 6.822 7.570 -0.748 18933 14303 1 20 . 1 1 86 86 CYS N N 86 125.928 125.928 124.578 1.350 18933 14304 1 20 . 1 1 86 86 CYS C C 86 171.600 171.600 173.098 -1.498 18933 14305 1 20 . 1 1 86 86 CYS CA C 86 55.627 55.627 58.106 -2.479 18933 14306 1 20 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.271 0.073 18933 14307 1 20 . 1 1 86 86 CYS H H 86 9.084 9.084 9.353 -0.269 18933 14308 1 20 . 1 1 87 87 VAL N N 87 126.612 126.612 126.420 0.192 18933 14309 1 20 . 1 1 87 87 VAL C C 87 174.431 174.431 174.534 -0.103 18933 14310 1 20 . 1 1 87 87 VAL CA C 87 61.317 61.317 62.310 -0.993 18933 14311 1 20 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.087 1.109 18933 14312 1 20 . 1 1 87 87 VAL H H 87 8.705 8.705 9.051 -0.346 18933 14313 1 20 . 1 1 88 88 LEU N N 88 127.748 127.748 122.758 4.990 18933 14314 1 20 . 1 1 88 88 LEU C C 88 175.227 175.227 174.618 0.609 18933 14315 1 20 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.729 -0.209 18933 14316 1 20 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.309 -1.704 18933 14317 1 20 . 1 1 88 88 LEU H H 88 9.417 9.417 8.657 0.760 18933 14318 1 20 . 1 1 89 89 PHE N N 89 120.981 120.981 118.557 2.424 18933 14319 1 20 . 1 1 89 89 PHE C C 89 176.906 176.906 176.208 0.698 18933 14320 1 20 . 1 1 89 89 PHE CA C 89 55.587 55.587 55.944 -0.357 18933 14321 1 20 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.308 -2.407 18933 14322 1 20 . 1 1 89 89 PHE H H 89 8.937 8.937 8.416 0.521 18933 14323 1 20 . 1 1 90 90 ILE N N 90 119.928 119.928 118.269 1.659 18933 14324 1 20 . 1 1 90 90 ILE C C 90 173.781 173.781 174.905 -1.124 18933 14325 1 20 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.862 -1.208 18933 14326 1 20 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.931 0.681 18933 14327 1 20 . 1 1 90 90 ILE H H 90 9.230 9.230 9.087 0.143 18933 14328 1 20 . 1 1 91 91 GLU N N 91 124.339 124.339 124.733 -0.394 18933 14329 1 20 . 1 1 91 91 GLU C C 91 175.607 175.607 175.420 0.187 18933 14330 1 20 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.491 0.128 18933 14331 1 20 . 1 1 91 91 GLU CB C 91 29.837 29.837 33.248 -3.411 18933 14332 1 20 . 1 1 91 91 GLU H H 91 8.175 8.175 9.015 -0.840 18933 14333 1 20 . 1 1 92 92 TRP N N 92 127.516 127.516 124.682 2.834 18933 14334 1 20 . 1 1 92 92 TRP C C 92 175.203 175.203 176.266 -1.063 18933 14335 1 20 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.425 1.808 18933 14336 1 20 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.437 1.224 18933 14337 1 20 . 1 1 92 92 TRP H H 92 9.306 9.306 8.491 0.815 18933 14338 1 20 . 1 1 93 93 GLU N N 93 127.834 127.834 126.433 1.401 18933 14339 1 20 . 1 1 93 93 GLU C C 93 175.668 175.668 176.061 -0.393 18933 14340 1 20 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.301 -0.423 18933 14341 1 20 . 1 1 93 93 GLU CB C 93 26.034 26.034 28.514 -2.480 18933 14342 1 20 . 1 1 93 93 GLU H H 93 8.796 8.796 9.157 -0.361 18933 14343 1 20 . 1 1 94 94 LYS N N 94 108.931 108.931 113.136 -4.205 18933 14344 1 20 . 1 1 94 94 LYS C C 94 175.423 175.423 175.971 -0.548 18933 14345 1 20 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.714 -0.271 18933 14346 1 20 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.296 -2.663 18933 14347 1 20 . 1 1 94 94 LYS H H 94 8.498 8.498 8.596 -0.098 18933 14348 1 20 . 1 1 95 95 LYS N N 95 121.737 121.737 120.566 1.171 18933 14349 1 20 . 1 1 95 95 LYS C C 95 174.443 174.443 175.201 -0.758 18933 14350 1 20 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.529 -2.112 18933 14351 1 20 . 1 1 95 95 LYS CB C 95 34.464 34.464 33.970 0.494 18933 14352 1 20 . 1 1 95 95 LYS H H 95 7.761 7.761 7.553 0.208 18933 14353 1 20 . 1 1 96 96 THR N N 96 116.067 116.067 116.453 -0.386 18933 14354 1 20 . 1 1 96 96 THR C C 96 174.296 174.296 173.726 0.570 18933 14355 1 20 . 1 1 96 96 THR CA C 96 61.115 61.115 60.657 0.459 18933 14356 1 20 . 1 1 96 96 THR CB C 96 69.450 69.450 71.486 -2.036 18933 14357 1 20 . 1 1 96 96 THR H H 96 7.761 7.761 8.199 -0.438 18933 14358 1 20 . 1 1 97 97 TYR N N 97 124.229 124.229 124.250 -0.021 18933 14359 1 20 . 1 1 97 97 TYR C C 97 173.536 173.536 174.604 -1.068 18933 14360 1 20 . 1 1 97 97 TYR CA C 97 55.950 55.950 55.749 0.201 18933 14361 1 20 . 1 1 97 97 TYR CB C 97 41.182 41.182 41.612 -0.430 18933 14362 1 20 . 1 1 97 97 TYR H H 97 9.018 9.018 9.247 -0.229 18933 14363 1 20 . 1 1 98 98 GLN N N 98 123.435 123.435 122.096 1.339 18933 14364 1 20 . 1 1 98 98 GLN C C 98 173.266 173.266 174.493 -1.227 18933 14365 1 20 . 1 1 98 98 GLN CA C 98 55.143 55.143 56.064 -0.921 18933 14366 1 20 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.120 -0.107 18933 14367 1 20 . 1 1 98 98 GLN H H 98 8.781 8.781 9.346 -0.565 18933 14368 1 20 . 1 1 99 99 LEU N N 99 130.119 130.119 127.615 2.504 18933 14369 1 20 . 1 1 99 99 LEU C C 99 173.867 173.867 174.252 -0.385 18933 14370 1 20 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.521 -1.001 18933 14371 1 20 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.687 -1.081 18933 14372 1 20 . 1 1 99 99 LEU H H 99 9.104 9.104 8.888 0.216 18933 14373 1 20 . 1 1 100 100 ASP N N 100 125.182 125.182 127.494 -2.312 18933 14374 1 20 . 1 1 100 100 ASP C C 100 172.837 172.837 174.461 -1.624 18933 14375 1 20 . 1 1 100 100 ASP CA C 100 51.754 51.754 53.662 -1.908 18933 14376 1 20 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.070 -3.726 18933 14377 1 20 . 1 1 100 100 ASP H H 100 9.089 9.089 8.670 0.419 18933 14378 1 20 . 1 1 101 101 LEU N N 101 121.174 121.174 126.656 -5.482 18933 14379 1 20 . 1 1 101 101 LEU C C 101 174.529 174.529 175.028 -0.499 18933 14380 1 20 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.954 -2.039 18933 14381 1 20 . 1 1 101 101 LEU CB C 101 43.908 43.908 46.487 -2.579 18933 14382 1 20 . 1 1 101 101 LEU H H 101 8.458 8.458 9.282 -0.824 18933 14383 1 20 . 1 1 102 102 PHE N N 102 119.464 119.464 121.945 -2.481 18933 14384 1 20 . 1 1 102 102 PHE C C 102 176.293 176.293 174.613 1.680 18933 14385 1 20 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.557 -1.503 18933 14386 1 20 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.897 -1.017 18933 14387 1 20 . 1 1 102 102 PHE H H 102 8.281 8.281 9.319 -1.038 18933 14388 1 20 . 1 1 103 103 THR N N 103 108.576 108.576 116.795 -8.219 18933 14389 1 20 . 1 1 103 103 THR C C 103 174.933 174.933 173.288 1.645 18933 14390 1 20 . 1 1 103 103 THR CA C 103 57.726 57.726 60.379 -2.653 18933 14391 1 20 . 1 1 103 103 THR CB C 103 71.288 71.288 69.790 1.498 18933 14392 1 20 . 1 1 103 103 THR H H 103 7.872 7.872 8.280 -0.408 18933 14393 1 20 . 1 1 104 104 ALA N N 104 122.885 122.885 127.904 -5.019 18933 14394 1 20 . 1 1 104 104 ALA C C 104 175.754 175.754 174.619 1.135 18933 14395 1 20 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.675 0.343 18933 14396 1 20 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.157 0.328 18933 14397 1 20 . 1 1 104 104 ALA H H 104 8.660 8.660 9.127 -0.467 18933 14398 1 20 . 1 1 105 105 LEU N N 105 120.881 120.881 118.844 2.037 18933 14399 1 20 . 1 1 105 105 LEU C C 105 179.504 179.504 178.775 0.729 18933 14400 1 20 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.273 -1.026 18933 14401 1 20 . 1 1 105 105 LEU CB C 105 41.753 41.753 44.239 -2.486 18933 14402 1 20 . 1 1 105 105 LEU H H 105 8.226 8.226 8.217 0.009 18933 14403 1 20 . 1 1 106 106 ALA N N 106 124.901 124.901 124.397 0.504 18933 14404 1 20 . 1 1 106 106 ALA C C 106 181.269 181.269 179.289 1.980 18933 14405 1 20 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.837 1.476 18933 14406 1 20 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.865 -1.641 18933 14407 1 20 . 1 1 106 106 ALA H H 106 8.392 8.392 8.626 -0.234 18933 14408 1 20 . 1 1 107 107 GLU N N 107 116.409 116.409 116.056 0.353 18933 14409 1 20 . 1 1 107 107 GLU C C 107 177.764 177.764 176.785 0.979 18933 14410 1 20 . 1 1 107 107 GLU CA C 107 58.533 58.533 58.378 0.155 18933 14411 1 20 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.679 -1.743 18933 14412 1 20 . 1 1 107 107 GLU H H 107 9.664 9.664 8.680 0.984 18933 14413 1 20 . 1 1 108 108 GLU N N 108 116.189 116.189 117.737 -1.548 18933 14414 1 20 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.173 -1.030 18933 14415 1 20 . 1 1 108 108 GLU CB C 108 29.837 29.837 28.841 0.996 18933 14416 1 20 . 1 1 108 108 GLU H H 108 7.589 7.589 7.483 0.106 18933 14417 1 20 . 1 1 109 109 LYS N N 109 119.928 119.928 121.783 -1.855 18933 14418 1 20 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.142 1.709 18933 14419 1 20 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.480 -0.009 18933 14420 1 20 . 1 1 109 109 LYS H H 109 7.514 7.514 7.540 -0.026 18933 14421 1 20 . 1 1 111 111 TYR N N 111 114.930 114.930 119.065 -4.135 18933 14422 1 20 . 1 1 111 111 TYR C C 111 179.504 179.504 177.640 1.864 18933 14423 1 20 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.684 -2.667 18933 14424 1 20 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.681 -2.013 18933 14425 1 20 . 1 1 111 111 TYR H H 111 6.393 6.393 8.487 -2.094 18933 14426 1 20 . 1 1 112 112 ALA N N 112 124.901 124.901 122.047 2.854 18933 14427 1 20 . 1 1 112 112 ALA C C 112 179.173 179.173 179.724 -0.551 18933 14428 1 20 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.504 -0.603 18933 14429 1 20 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.042 0.070 18933 14430 1 20 . 1 1 112 112 ALA H H 112 8.554 8.554 7.971 0.583 18933 14431 1 20 . 1 1 113 113 ILE N N 113 119.464 119.464 119.434 0.030 18933 14432 1 20 . 1 1 113 113 ILE C C 113 178.499 178.499 177.988 0.511 18933 14433 1 20 . 1 1 113 113 ILE CA C 113 66.281 66.281 64.055 2.226 18933 14434 1 20 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.843 -0.527 18933 14435 1 20 . 1 1 113 113 ILE H H 113 8.680 8.680 7.617 1.063 18933 14436 1 20 . 1 1 114 114 PHE N N 114 122.922 122.922 121.417 1.505 18933 14437 1 20 . 1 1 114 114 PHE C C 114 178.217 178.217 177.775 0.442 18933 14438 1 20 . 1 1 114 114 PHE CA C 114 61.559 61.559 62.015 -0.456 18933 14439 1 20 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.740 0.731 18933 14440 1 20 . 1 1 114 114 PHE H H 114 7.721 7.721 8.688 -0.967 18933 14441 1 20 . 1 1 115 115 HIS N N 115 118.560 118.560 118.265 0.295 18933 14442 1 20 . 1 1 115 115 HIS C C 115 177.286 177.286 176.641 0.645 18933 14443 1 20 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.309 0.071 18933 14444 1 20 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.387 1.478 18933 14445 1 20 . 1 1 115 115 HIS H H 115 8.155 8.155 8.420 -0.265 18933 14446 1 20 . 1 1 116 116 PHE N N 116 111.472 111.472 116.724 -5.252 18933 14447 1 20 . 1 1 116 116 PHE C C 116 179.026 179.026 177.099 1.927 18933 14448 1 20 . 1 1 116 116 PHE CA C 116 59.461 59.461 60.068 -0.607 18933 14449 1 20 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.857 -1.668 18933 14450 1 20 . 1 1 116 116 PHE H H 116 8.564 8.564 8.019 0.545 18933 14451 1 20 . 1 1 117 117 THR N N 117 119.012 119.012 111.375 7.637 18933 14452 1 20 . 1 1 117 117 THR C C 117 172.935 172.935 175.224 -2.289 18933 14453 1 20 . 1 1 117 117 THR CA C 117 67.088 67.088 64.194 2.894 18933 14454 1 20 . 1 1 117 117 THR CB C 117 37.126 37.126 68.942 -31.816 18933 14455 1 20 . 1 1 117 117 THR H H 117 7.620 7.620 8.183 -0.563 18933 14456 1 20 . 1 1 118 118 GLY N N 118 107.917 107.917 109.673 -1.756 18933 14457 1 20 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.218 1.949 18933 14458 1 20 . 1 1 118 118 GLY H H 118 6.666 6.666 7.439 -0.773 18933 14459 1 20 . 1 1 121 121 SER N N 121 113.354 113.354 118.020 -4.666 18933 14460 1 20 . 1 1 121 121 SER C C 121 176.061 176.061 175.796 0.265 18933 14461 1 20 . 1 1 121 121 SER CA C 121 61.035 61.035 62.693 -1.658 18933 14462 1 20 . 1 1 121 121 SER H H 121 8.322 8.322 8.265 0.057 18933 14463 1 20 . 1 1 122 122 TYR N N 122 124.681 124.681 120.746 3.935 18933 14464 1 20 . 1 1 122 122 TYR C C 122 176.293 176.293 176.925 -0.632 18933 14465 1 20 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.946 -1.889 18933 14466 1 20 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.021 0.690 18933 14467 1 20 . 1 1 122 122 TYR H H 122 6.514 6.514 8.176 -1.662 18933 14468 1 20 . 1 1 123 123 LEU N N 123 117.997 117.997 119.848 -1.851 18933 14469 1 20 . 1 1 123 123 LEU C C 123 179.774 179.774 178.990 0.784 18933 14470 1 20 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.932 -0.054 18933 14471 1 20 . 1 1 123 123 LEU CB C 123 39.978 39.978 41.104 -1.126 18933 14472 1 20 . 1 1 123 123 LEU H H 123 7.428 7.428 7.254 0.174 18933 14473 1 20 . 1 1 124 124 ILE N N 124 119.012 119.012 120.093 -1.081 18933 14474 1 20 . 1 1 124 124 ILE C C 124 178.830 178.830 177.833 0.997 18933 14475 1 20 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.251 -0.100 18933 14476 1 20 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.351 -0.288 18933 14477 1 20 . 1 1 124 124 ILE H H 124 8.453 8.453 8.504 -0.051 18933 14478 1 20 . 1 1 125 125 ARG N N 125 121.174 121.174 120.394 0.780 18933 14479 1 20 . 1 1 125 125 ARG C C 125 179.762 179.762 178.542 1.220 18933 14480 1 20 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.898 0.159 18933 14481 1 20 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.345 -0.395 18933 14482 1 20 . 1 1 125 125 ARG H H 125 7.004 7.004 8.218 -1.214 18933 14483 1 20 . 1 1 126 126 ILE N N 126 122.299 122.299 120.798 1.501 18933 14484 1 20 . 1 1 126 126 ILE C C 126 178.352 178.352 177.778 0.574 18933 14485 1 20 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.556 -2.351 18933 14486 1 20 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.143 -1.728 18933 14487 1 20 . 1 1 126 126 ILE H H 126 7.579 7.579 7.879 -0.300 18933 14488 1 20 . 1 1 127 127 ARG N N 127 119.354 119.354 120.307 -0.953 18933 14489 1 20 . 1 1 127 127 ARG C C 127 179.786 179.786 178.825 0.961 18933 14490 1 20 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.895 0.091 18933 14491 1 20 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.116 -0.786 18933 14492 1 20 . 1 1 127 127 ARG H H 127 8.715 8.715 8.020 0.695 18933 14493 1 20 . 1 1 128 128 ALA N N 128 122.873 122.873 120.462 2.411 18933 14494 1 20 . 1 1 128 128 ALA C C 128 180.325 180.325 179.318 1.007 18933 14495 1 20 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.701 0.039 18933 14496 1 20 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.215 -1.054 18933 14497 1 20 . 1 1 128 128 ALA H H 128 7.978 7.978 8.243 -0.265 18933 14498 1 20 . 1 1 129 129 ALA N N 129 121.846 121.846 121.784 0.062 18933 14499 1 20 . 1 1 129 129 ALA C C 129 181.539 181.539 179.900 1.639 18933 14500 1 20 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.777 -0.279 18933 14501 1 20 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.579 -1.101 18933 14502 1 20 . 1 1 129 129 ALA H H 129 7.519 7.519 7.756 -0.237 18933 14503 1 20 . 1 1 130 130 LEU N N 130 119.134 119.134 118.263 0.871 18933 14504 1 20 . 1 1 130 130 LEU C C 130 179.909 179.909 178.971 0.938 18933 14505 1 20 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.042 -0.043 18933 14506 1 20 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.640 -1.218 18933 14507 1 20 . 1 1 130 130 LEU H H 130 8.296 8.296 8.640 -0.344 18933 14508 1 20 . 1 1 131 131 LYS N N 131 122.299 122.299 120.512 1.787 18933 14509 1 20 . 1 1 131 131 LYS C C 131 180.289 180.289 179.482 0.807 18933 14510 1 20 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.737 -0.720 18933 14511 1 20 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.117 -0.885 18933 14512 1 20 . 1 1 131 131 LYS H H 131 8.281 8.281 7.867 0.414 18933 14513 1 20 . 1 1 132 132 LYS N N 132 118.743 118.743 118.422 0.321 18933 14514 1 20 . 1 1 132 132 LYS C C 132 177.482 177.482 177.821 -0.339 18933 14515 1 20 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.397 0.095 18933 14516 1 20 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.127 -0.895 18933 14517 1 20 . 1 1 132 132 LYS H H 132 7.317 7.317 7.674 -0.357 18933 14518 1 20 . 1 1 133 133 LYS N N 133 117.093 117.093 117.202 -0.109 18933 14519 1 20 . 1 1 133 133 LYS C C 133 174.614 174.614 176.118 -1.504 18933 14520 1 20 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.894 -1.114 18933 14521 1 20 . 1 1 133 133 LYS CB C 133 32.182 32.182 33.009 -0.827 18933 14522 1 20 . 1 1 133 133 LYS H H 133 7.327 7.327 7.620 -0.293 18933 14523 1 20 . 1 1 134 134 ASN N N 134 113.012 113.012 115.689 -2.677 18933 14524 1 20 . 1 1 134 134 ASN C C 134 173.965 173.965 173.405 0.560 18933 14525 1 20 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.416 -0.120 18933 14526 1 20 . 1 1 134 134 ASN CB C 134 36.175 36.175 36.926 -0.751 18933 14527 1 20 . 1 1 134 134 ASN H H 134 7.938 7.938 7.957 -0.019 18933 14528 1 20 . 1 1 135 135 TYR N N 135 115.725 115.725 119.399 -3.674 18933 14529 1 20 . 1 1 135 135 TYR C C 135 176.342 176.342 174.853 1.489 18933 14530 1 20 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.005 -1.337 18933 14531 1 20 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.261 1.302 18933 14532 1 20 . 1 1 135 135 TYR H H 135 7.741 7.741 8.430 -0.689 18933 14533 1 20 . 1 1 136 136 LYS N N 136 122.641 122.641 124.779 -2.138 18933 14534 1 20 . 1 1 136 136 LYS C C 136 173.475 173.475 174.504 -1.029 18933 14535 1 20 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.561 0.340 18933 14536 1 20 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.520 -1.802 18933 14537 1 20 . 1 1 136 136 LYS H H 136 9.296 9.296 8.852 0.444 18933 14538 1 20 . 1 1 137 137 LEU N N 137 127.284 127.284 123.478 3.806 18933 14539 1 20 . 1 1 137 137 LEU C C 137 175.423 175.423 176.172 -0.749 18933 14540 1 20 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.210 -0.084 18933 14541 1 20 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.307 3.439 18933 14542 1 20 . 1 1 137 137 LEU H H 137 8.776 8.776 8.588 0.188 18933 14543 1 20 . 1 1 138 138 ASN N N 138 125.818 125.818 119.531 6.287 18933 14544 1 20 . 1 1 138 138 ASN C C 138 174.933 174.933 175.404 -0.471 18933 14545 1 20 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.617 -0.500 18933 14546 1 20 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.396 -4.890 18933 14547 1 20 . 1 1 138 138 ASN H H 138 8.811 8.811 8.244 0.567 18933 14548 1 20 . 1 1 139 139 GLN N N 139 116.861 116.861 119.804 -2.943 18933 14549 1 20 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.598 -1.760 18933 14550 1 20 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.712 -2.995 18933 14551 1 20 . 1 1 139 139 GLN H H 139 9.220 9.220 9.043 0.177 18933 14552 1 20 . 1 1 140 140 TYR N N 140 120.600 120.600 121.259 -0.659 18933 14553 1 20 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.829 -1.072 18933 14554 1 20 . 1 1 140 140 TYR CB C 140 37.570 37.570 37.681 -0.111 18933 14555 1 20 . 1 1 140 140 TYR H H 140 8.549 8.549 8.608 -0.059 18933 14556 1 20 . 1 1 141 141 GLY N N 141 105.986 105.986 108.315 -2.329 18933 14557 1 20 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.369 -0.525 18933 14558 1 20 . 1 1 141 141 GLY H H 141 7.186 7.186 7.848 -0.662 18933 14559 1 20 . 1 1 142 142 LEU N N 142 120.038 120.038 116.610 3.428 18933 14560 1 20 . 1 1 142 142 LEU C C 142 173.340 173.340 175.866 -2.526 18933 14561 1 20 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.220 -0.700 18933 14562 1 20 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.462 0.889 18933 14563 1 20 . 1 1 142 142 LEU H H 142 7.539 7.539 8.310 -0.771 18933 14564 1 20 . 1 1 143 143 PHE N N 143 124.229 124.229 118.983 5.246 18933 14565 1 20 . 1 1 143 143 PHE C C 143 173.977 173.977 175.147 -1.170 18933 14566 1 20 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.295 -2.654 18933 14567 1 20 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.767 3.901 18933 14568 1 20 . 1 1 143 143 PHE H H 143 9.084 9.084 9.003 0.081 18933 14569 1 20 . 1 1 144 144 LYS N N 144 127.858 127.858 122.868 4.990 18933 14570 1 20 . 1 1 144 144 LYS C C 144 175.092 175.092 176.849 -1.757 18933 14571 1 20 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.470 4.386 18933 14572 1 20 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.794 3.790 18933 14573 1 20 . 1 1 144 144 LYS H H 144 9.281 9.281 8.952 0.329 18933 14574 1 20 . 1 1 145 145 ASN N N 145 128.188 128.188 126.395 1.793 18933 14575 1 20 . 1 1 145 145 ASN C C 145 175.779 175.779 174.926 0.853 18933 14576 1 20 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.573 3.153 18933 14577 1 20 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.716 -3.062 18933 14578 1 20 . 1 1 145 145 ASN H H 145 9.205 9.205 9.195 0.010 18933 14579 1 20 . 1 1 146 146 GLN N N 146 129.655 129.655 112.044 17.611 18933 14580 1 20 . 1 1 146 146 GLN C C 146 175.399 175.399 174.669 0.730 18933 14581 1 20 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.136 1.679 18933 14582 1 20 . 1 1 146 146 GLN CB C 146 32.626 32.626 28.044 4.582 18933 14583 1 20 . 1 1 146 146 GLN H H 146 8.983 8.983 8.812 0.171 18933 14584 1 20 . 1 1 147 147 THR N N 147 117.936 117.936 115.589 2.347 18933 14585 1 20 . 1 1 147 147 THR C C 147 173.254 173.254 173.412 -0.158 18933 14586 1 20 . 1 1 147 147 THR CA C 147 61.721 61.721 61.371 0.350 18933 14587 1 20 . 1 1 147 147 THR CB C 147 70.274 70.274 69.766 0.508 18933 14588 1 20 . 1 1 147 147 THR H H 147 8.029 8.029 7.867 0.162 18933 14589 1 20 . 1 1 148 148 LEU N N 148 130.681 130.681 131.667 -0.986 18933 14590 1 20 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.432 0.034 18933 14591 1 20 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.611 -0.922 18933 14592 1 20 . 1 1 148 148 LEU H H 148 8.635 8.635 8.886 -0.251 18933 14593 1 20 . 1 1 149 149 VAL N N 149 130.803 130.803 124.491 6.312 18933 14594 1 20 . 1 1 149 149 VAL CA C 149 59.178 59.178 57.860 1.318 18933 14595 1 20 . 1 1 149 149 VAL CB C 149 31.675 31.675 33.273 -1.598 18933 14596 1 20 . 1 1 149 149 VAL H H 149 8.968 8.968 9.297 -0.329 18933 14597 1 20 . 1 1 151 151 LEU N N 151 124.290 124.290 121.132 3.158 18933 14598 1 20 . 1 1 151 151 LEU CA C 151 54.013 54.013 56.583 -2.570 18933 14599 1 20 . 1 1 151 151 LEU CB C 151 44.098 44.098 40.987 3.111 18933 14600 1 20 . 1 1 151 151 LEU H H 151 7.872 7.872 8.177 -0.305 18933 14601 1 20 . 1 1 153 153 ILE N N 153 114.943 114.943 113.949 0.994 18933 14602 1 20 . 1 1 153 153 ILE C C 153 175.877 175.877 174.871 1.006 18933 14603 1 20 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.956 -0.262 18933 14604 1 20 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.725 0.964 18933 14605 1 20 . 1 1 153 153 ILE H H 153 7.125 7.125 7.785 -0.660 18933 14606 1 20 . 1 1 154 154 THR N N 154 111.766 111.766 113.277 -1.511 18933 14607 1 20 . 1 1 154 154 THR C C 154 174.945 174.945 174.494 0.451 18933 14608 1 20 . 1 1 154 154 THR CA C 154 62.124 62.124 62.798 -0.674 18933 14609 1 20 . 1 1 154 154 THR CB C 154 70.718 70.718 69.488 1.230 18933 14610 1 20 . 1 1 154 154 THR H H 154 9.286 9.286 8.414 0.872 18933 14611 1 20 . 1 1 155 155 THR N N 155 111.766 111.766 112.611 -0.845 18933 14612 1 20 . 1 1 155 155 THR CA C 155 58.936 58.936 60.395 -1.459 18933 14613 1 20 . 1 1 155 155 THR CB C 155 72.683 72.683 70.934 1.749 18933 14614 1 20 . 1 1 155 155 THR H H 155 7.645 7.645 7.317 0.328 18933 14615 1 20 . 1 1 157 157 LYS N N 157 119.464 119.464 119.724 -0.260 18933 14616 1 20 . 1 1 157 157 LYS C C 157 178.781 178.781 178.412 0.369 18933 14617 1 20 . 1 1 157 157 LYS CA C 157 60.026 60.026 60.618 -0.592 18933 14618 1 20 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.813 -0.391 18933 14619 1 20 . 1 1 157 157 LYS H H 157 8.175 8.175 8.448 -0.273 18933 14620 1 20 . 1 1 158 158 GLU N N 158 118.340 118.340 117.494 0.846 18933 14621 1 20 . 1 1 158 158 GLU C C 158 178.867 178.867 178.950 -0.083 18933 14622 1 20 . 1 1 158 158 GLU CA C 158 58.492 58.492 58.858 -0.366 18933 14623 1 20 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.949 0.381 18933 14624 1 20 . 1 1 158 158 GLU H H 158 7.519 7.519 8.311 -0.792 18933 14625 1 20 . 1 1 159 159 LEU N N 159 120.710 120.710 122.116 -1.406 18933 14626 1 20 . 1 1 159 159 LEU C C 159 176.526 176.526 178.343 -1.817 18933 14627 1 20 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.120 0.050 18933 14628 1 20 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.555 -1.640 18933 14629 1 20 . 1 1 159 159 LEU H H 159 7.524 7.524 8.110 -0.586 18933 14630 1 20 . 1 1 160 160 ILE N N 160 118.217 118.217 118.615 -0.398 18933 14631 1 20 . 1 1 160 160 ILE C C 160 177.213 177.213 178.079 -0.866 18933 14632 1 20 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.520 -0.490 18933 14633 1 20 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.305 0.201 18933 14634 1 20 . 1 1 160 160 ILE H H 160 7.741 7.741 8.339 -0.598 18933 14635 1 20 . 1 1 161 161 LYS N N 161 118.450 118.450 120.089 -1.639 18933 14636 1 20 . 1 1 161 161 LYS C C 161 180.999 180.999 179.887 1.112 18933 14637 1 20 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.550 -0.736 18933 14638 1 20 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.181 -1.203 18933 14639 1 20 . 1 1 161 161 LYS H H 161 7.382 7.382 8.033 -0.651 18933 14640 1 20 . 1 1 162 162 GLU N N 162 121.846 121.846 121.056 0.790 18933 14641 1 20 . 1 1 162 162 GLU C C 162 178.818 178.818 178.395 0.423 18933 14642 1 20 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.552 -0.503 18933 14643 1 20 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.259 -1.323 18933 14644 1 20 . 1 1 162 162 GLU H H 162 8.210 8.210 7.872 0.338 18933 14645 1 20 . 1 1 163 163 LEU N N 163 116.751 116.751 115.465 1.286 18933 14646 1 20 . 1 1 163 163 LEU C C 163 176.784 176.784 177.559 -0.775 18933 14647 1 20 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.535 -0.513 18933 14648 1 20 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.696 -0.387 18933 14649 1 20 . 1 1 163 163 LEU H H 163 7.796 7.796 7.515 0.281 18933 14650 1 20 . 1 1 164 164 GLY N N 164 104.849 104.849 105.341 -0.492 18933 14651 1 20 . 1 1 164 164 GLY C C 164 174.492 174.492 174.556 -0.064 18933 14652 1 20 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.398 -0.666 18933 14653 1 20 . 1 1 164 164 GLY H H 164 7.589 7.589 7.476 0.113 18933 14654 1 20 . 1 1 165 165 PHE N N 165 118.902 118.902 119.284 -0.382 18933 14655 1 20 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.501 -0.833 18933 14656 1 20 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.028 -1.543 18933 14657 1 20 . 1 1 165 165 PHE H H 165 7.251 7.251 8.051 -0.800 18933 14658 1 20 . 1 1 166 166 THR N N 166 117.093 117.093 116.922 0.171 18933 14659 1 20 . 1 1 166 166 THR CA C 166 62.245 62.245 60.901 1.344 18933 14660 1 20 . 1 1 166 166 THR CB C 166 69.323 69.323 69.231 0.092 18933 14661 1 20 . 1 1 166 166 THR H H 166 8.407 8.407 8.162 0.245 18933 14662 1 20 . 1 1 168 168 ARG N N 168 127.431 127.431 121.240 6.191 18933 14663 1 20 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.439 -2.201 18933 14664 1 20 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.398 -1.406 18933 14665 1 20 . 1 1 168 168 ARG H H 168 7.160 7.160 8.406 -1.246 18933 14666 1 20 . 1 1 171 171 LYS N N 171 113.574 113.574 117.557 -3.983 18933 14667 1 20 . 1 1 171 171 LYS C C 171 176.416 176.416 177.928 -1.512 18933 14668 1 20 . 1 1 171 171 LYS CA C 171 57.605 57.605 58.565 -0.959 18933 14669 1 20 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.291 0.638 18933 14670 1 20 . 1 1 171 171 LYS H H 171 8.210 8.210 8.356 -0.146 18933 14671 1 20 . 1 1 172 172 LYS N N 172 117.313 117.313 118.740 -1.427 18933 14672 1 20 . 1 1 172 172 LYS C C 172 175.717 175.717 176.645 -0.928 18933 14673 1 20 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.233 -2.058 18933 14674 1 20 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.657 -1.045 18933 14675 1 20 . 1 1 172 172 LYS H H 172 7.761 7.761 7.486 0.275 18933 14676 1 20 . 1 1 173 173 ARG N N 173 122.056 122.056 119.114 2.942 18933 14677 1 20 . 1 1 173 173 ARG C C 173 172.850 172.850 174.982 -2.132 18933 14678 1 20 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.488 0.390 18933 14679 1 20 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.354 0.152 18933 14680 1 20 . 1 1 173 173 ARG H H 173 6.885 6.885 7.482 -0.597 18933 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 153 3.112 -0.212 3.115 18933 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 18933 3 1 1 "Average Difference" C 131 1.140 -0.014 1.145 18933 4 1 1 "Average Difference" CA 153 1.293 0.213 1.280 18933 5 1 1 "Average Difference" CB 144 3.247 1.030 3.090 18933 6 1 1 "Average Difference" HN 153 0.586 0.177 0.561 18933 7 1 2 "Average Difference" N 153 3.299 -0.183 3.305 18933 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 18933 9 1 2 "Average Difference" C 131 1.166 -0.013 1.171 18933 10 1 2 "Average Difference" CA 153 1.303 0.232 1.287 18933 11 1 2 "Average Difference" CB 144 3.277 1.078 3.106 18933 12 1 2 "Average Difference" HN 153 0.583 0.163 0.561 18933 13 1 3 "Average Difference" N 153 3.207 -0.085 3.217 18933 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 18933 15 1 3 "Average Difference" C 131 1.172 -0.039 1.175 18933 16 1 3 "Average Difference" CA 153 1.328 0.257 1.307 18933 17 1 3 "Average Difference" CB 144 3.247 1.043 3.086 18933 18 1 3 "Average Difference" HN 153 0.595 0.179 0.569 18933 19 1 4 "Average Difference" N 153 3.185 -0.058 3.195 18933 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 18933 21 1 4 "Average Difference" C 131 1.156 -0.005 1.160 18933 22 1 4 "Average Difference" CA 153 1.354 0.279 1.329 18933 23 1 4 "Average Difference" CB 144 3.246 0.980 3.106 18933 24 1 4 "Average Difference" HN 153 0.585 0.156 0.566 18933 25 1 5 "Average Difference" N 153 3.276 -0.080 3.286 18933 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 18933 27 1 5 "Average Difference" C 131 1.163 -0.002 1.167 18933 28 1 5 "Average Difference" CA 153 1.315 0.245 1.296 18933 29 1 5 "Average Difference" CB 144 3.246 1.005 3.098 18933 30 1 5 "Average Difference" HN 153 0.591 0.173 0.567 18933 31 1 6 "Average Difference" N 153 3.259 -0.147 3.267 18933 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 18933 33 1 6 "Average Difference" C 131 1.177 0.023 1.181 18933 34 1 6 "Average Difference" CA 153 1.353 0.221 1.339 18933 35 1 6 "Average Difference" CB 144 3.249 1.040 3.089 18933 36 1 6 "Average Difference" HN 153 0.593 0.177 0.568 18933 37 1 7 "Average Difference" N 153 3.212 -0.068 3.222 18933 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 18933 39 1 7 "Average Difference" C 131 1.170 -0.004 1.174 18933 40 1 7 "Average Difference" CA 153 1.314 0.249 1.294 18933 41 1 7 "Average Difference" CB 144 3.248 1.065 3.079 18933 42 1 7 "Average Difference" HN 153 0.576 0.172 0.551 18933 43 1 8 "Average Difference" N 153 3.251 -0.134 3.259 18933 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 18933 45 1 8 "Average Difference" C 131 1.121 -0.012 1.125 18933 46 1 8 "Average Difference" CA 153 1.322 0.193 1.312 18933 47 1 8 "Average Difference" CB 144 3.245 0.958 3.111 18933 48 1 8 "Average Difference" HN 153 0.571 0.151 0.553 18933 49 1 9 "Average Difference" N 153 3.286 -0.172 3.293 18933 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 18933 51 1 9 "Average Difference" C 131 1.134 -0.010 1.138 18933 52 1 9 "Average Difference" CA 153 1.312 0.254 1.291 18933 53 1 9 "Average Difference" CB 144 3.294 1.013 3.145 18933 54 1 9 "Average Difference" HN 153 0.572 0.154 0.553 18933 55 1 10 "Average Difference" N 153 3.173 -0.075 3.183 18933 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 18933 57 1 10 "Average Difference" C 131 1.162 -0.003 1.166 18933 58 1 10 "Average Difference" CA 153 1.323 0.256 1.302 18933 59 1 10 "Average Difference" CB 144 3.239 1.030 3.082 18933 60 1 10 "Average Difference" HN 153 0.591 0.167 0.569 18933 61 1 11 "Average Difference" N 153 3.301 -0.160 3.308 18933 62 1 11 "Average Difference" HA 0 0.000 0.000 0.000 18933 63 1 11 "Average Difference" C 131 1.124 0.006 1.128 18933 64 1 11 "Average Difference" CA 153 1.367 0.271 1.345 18933 65 1 11 "Average Difference" CB 144 3.233 0.978 3.092 18933 66 1 11 "Average Difference" HN 153 0.586 0.160 0.566 18933 67 1 12 "Average Difference" N 153 3.168 -0.116 3.176 18933 68 1 12 "Average Difference" HA 0 0.000 0.000 0.000 18933 69 1 12 "Average Difference" C 131 1.152 -0.025 1.156 18933 70 1 12 "Average Difference" CA 153 1.367 0.263 1.346 18933 71 1 12 "Average Difference" CB 144 3.254 1.039 3.094 18933 72 1 12 "Average Difference" HN 153 0.573 0.159 0.553 18933 73 1 13 "Average Difference" N 153 3.232 -0.055 3.242 18933 74 1 13 "Average Difference" HA 0 0.000 0.000 0.000 18933 75 1 13 "Average Difference" C 131 1.134 0.021 1.138 18933 76 1 13 "Average Difference" CA 153 1.336 0.234 1.319 18933 77 1 13 "Average Difference" CB 144 3.265 0.999 3.120 18933 78 1 13 "Average Difference" HN 153 0.584 0.159 0.563 18933 79 1 14 "Average Difference" N 153 3.233 0.015 3.243 18933 80 1 14 "Average Difference" HA 0 0.000 0.000 0.000 18933 81 1 14 "Average Difference" C 131 1.161 -0.006 1.166 18933 82 1 14 "Average Difference" CA 153 1.329 0.237 1.312 18933 83 1 14 "Average Difference" CB 144 3.275 1.024 3.121 18933 84 1 14 "Average Difference" HN 153 0.589 0.164 0.568 18933 85 1 15 "Average Difference" N 153 3.190 -0.076 3.199 18933 86 1 15 "Average Difference" HA 0 0.000 0.000 0.000 18933 87 1 15 "Average Difference" C 131 1.154 0.005 1.158 18933 88 1 15 "Average Difference" CA 153 1.300 0.245 1.281 18933 89 1 15 "Average Difference" CB 144 3.230 1.021 3.075 18933 90 1 15 "Average Difference" HN 153 0.585 0.165 0.563 18933 91 1 16 "Average Difference" N 153 3.103 -0.107 3.112 18933 92 1 16 "Average Difference" HA 0 0.000 0.000 0.000 18933 93 1 16 "Average Difference" C 131 1.197 -0.018 1.201 18933 94 1 16 "Average Difference" CA 153 1.308 0.240 1.290 18933 95 1 16 "Average Difference" CB 144 3.236 1.038 3.075 18933 96 1 16 "Average Difference" HN 153 0.581 0.158 0.561 18933 97 1 17 "Average Difference" N 153 3.246 -0.191 3.251 18933 98 1 17 "Average Difference" HA 0 0.000 0.000 0.000 18933 99 1 17 "Average Difference" C 131 1.131 -0.008 1.135 18933 100 1 17 "Average Difference" CA 153 1.327 0.229 1.311 18933 101 1 17 "Average Difference" CB 144 3.254 1.026 3.099 18933 102 1 17 "Average Difference" HN 153 0.599 0.172 0.575 18933 103 1 18 "Average Difference" N 153 3.259 -0.155 3.266 18933 104 1 18 "Average Difference" HA 0 0.000 0.000 0.000 18933 105 1 18 "Average Difference" C 131 1.148 -0.011 1.153 18933 106 1 18 "Average Difference" CA 153 1.302 0.257 1.280 18933 107 1 18 "Average Difference" CB 144 3.254 1.051 3.091 18933 108 1 18 "Average Difference" HN 153 0.586 0.180 0.560 18933 109 1 19 "Average Difference" N 153 3.196 -0.085 3.205 18933 110 1 19 "Average Difference" HA 0 0.000 0.000 0.000 18933 111 1 19 "Average Difference" C 131 1.157 0.017 1.162 18933 112 1 19 "Average Difference" CA 153 1.353 0.221 1.339 18933 113 1 19 "Average Difference" CB 144 3.270 0.985 3.129 18933 114 1 19 "Average Difference" HN 153 0.577 0.147 0.559 18933 115 1 20 "Average Difference" N 153 3.151 -0.129 3.159 18933 116 1 20 "Average Difference" HA 0 0.000 0.000 0.000 18933 117 1 20 "Average Difference" C 131 1.141 0.021 1.146 18933 118 1 20 "Average Difference" CA 153 1.342 0.307 1.310 18933 119 1 20 "Average Difference" CB 144 3.243 1.048 3.080 18933 120 1 20 "Average Difference" HN 153 0.582 0.170 0.558 18933 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 18933 _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 LEU N N 2 122.812 122.812 122.366 0.446 18933 2 1 . 1 1 2 2 LEU C C 2 175.742 175.742 176.163 -0.421 18933 3 1 . 1 1 2 2 LEU CA C 2 54.134 54.134 53.706 0.428 18933 4 1 . 1 1 2 2 LEU CB C 2 42.842 42.842 44.792 -1.950 18933 5 1 . 1 1 2 2 LEU H H 2 8.756 8.756 8.345 0.411 18933 6 1 . 1 1 3 3 THR N N 3 113.000 113.000 113.262 -0.262 18933 7 1 . 1 1 3 3 THR C C 3 175.938 175.938 175.481 0.457 18933 8 1 . 1 1 3 3 THR CA C 3 60.550 60.550 60.383 0.167 18933 9 1 . 1 1 3 3 THR CB C 3 70.781 70.781 70.494 0.287 18933 10 1 . 1 1 3 3 THR H H 3 8.428 8.428 8.094 0.334 18933 11 1 . 1 1 4 4 LEU N N 4 122.531 122.531 123.231 -0.700 18933 12 1 . 1 1 4 4 LEU C C 4 178.463 178.463 178.453 0.010 18933 13 1 . 1 1 4 4 LEU CA C 4 58.129 58.129 58.607 -0.478 18933 14 1 . 1 1 4 4 LEU CB C 4 39.534 39.534 42.038 -2.504 18933 15 1 . 1 1 4 4 LEU H H 4 7.731 7.731 8.039 -0.308 18933 16 1 . 1 1 5 5 ILE N N 5 115.505 115.505 116.968 -1.463 18933 17 1 . 1 1 5 5 ILE C C 5 178.573 178.573 177.878 0.695 18933 18 1 . 1 1 5 5 ILE CA C 5 63.738 63.738 64.613 -0.875 18933 19 1 . 1 1 5 5 ILE CB C 5 36.872 36.872 37.332 -0.460 18933 20 1 . 1 1 5 5 ILE H H 5 7.645 7.645 8.004 -0.359 18933 21 1 . 1 1 6 6 GLN N N 6 121.626 121.626 119.427 2.199 18933 22 1 . 1 1 6 6 GLN C C 6 179.014 179.014 178.717 0.296 18933 23 1 . 1 1 6 6 GLN CA C 6 58.331 58.331 59.093 -0.762 18933 24 1 . 1 1 6 6 GLN CB C 6 28.189 28.189 27.671 0.518 18933 25 1 . 1 1 6 6 GLN H H 6 7.645 7.645 7.877 -0.232 18933 26 1 . 1 1 7 7 GLY N N 7 107.684 107.684 106.886 0.798 18933 27 1 . 1 1 7 7 GLY C C 7 174.749 174.749 176.206 -1.457 18933 28 1 . 1 1 7 7 GLY CA C 7 46.790 46.790 46.886 -0.096 18933 29 1 . 1 1 7 7 GLY H H 7 8.660 8.660 8.108 0.552 18933 30 1 . 1 1 8 8 LYS N N 8 120.942 120.942 122.432 -1.490 18933 31 1 . 1 1 8 8 LYS C C 8 179.455 179.455 178.710 0.744 18933 32 1 . 1 1 8 8 LYS CA C 8 59.905 59.905 59.267 0.638 18933 33 1 . 1 1 8 8 LYS CB C 8 31.422 31.422 32.144 -0.722 18933 34 1 . 1 1 8 8 LYS H H 8 8.518 8.518 7.625 0.893 18933 35 1 . 1 1 9 9 LYS N N 9 120.710 120.710 119.646 1.064 18933 36 1 . 1 1 9 9 LYS C C 9 179.823 179.823 179.218 0.605 18933 37 1 . 1 1 9 9 LYS CA C 9 59.622 59.622 59.430 0.192 18933 38 1 . 1 1 9 9 LYS CB C 9 31.295 31.295 32.350 -1.055 18933 39 1 . 1 1 9 9 LYS H H 9 7.731 7.731 8.170 -0.439 18933 40 1 . 1 1 10 10 ILE N N 10 121.345 121.345 120.740 0.605 18933 41 1 . 1 1 10 10 ILE C C 10 177.789 177.789 178.127 -0.338 18933 42 1 . 1 1 10 10 ILE CA C 10 64.465 64.465 65.883 -1.418 18933 43 1 . 1 1 10 10 ILE CB C 10 36.365 36.365 38.203 -1.838 18933 44 1 . 1 1 10 10 ILE H H 10 7.711 7.711 8.335 -0.624 18933 45 1 . 1 1 11 11 VAL N N 11 120.258 120.258 120.136 0.122 18933 46 1 . 1 1 11 11 VAL C C 11 177.372 177.372 177.869 -0.497 18933 47 1 . 1 1 11 11 VAL CA C 11 67.451 67.451 67.189 0.262 18933 48 1 . 1 1 11 11 VAL CB C 11 30.534 30.534 31.395 -0.861 18933 49 1 . 1 1 11 11 VAL H H 11 7.918 7.918 8.446 -0.528 18933 50 1 . 1 1 12 12 ASN N N 12 116.971 116.971 117.925 -0.954 18933 51 1 . 1 1 12 12 ASN C C 12 177.445 177.445 177.735 -0.290 18933 52 1 . 1 1 12 12 ASN CA C 12 56.112 56.112 56.399 -0.288 18933 53 1 . 1 1 12 12 ASN CB C 12 37.633 37.633 38.496 -0.863 18933 54 1 . 1 1 12 12 ASN H H 12 7.993 7.993 8.616 -0.623 18933 55 1 . 1 1 13 13 HIS N N 13 120.258 120.258 119.939 0.319 18933 56 1 . 1 1 13 13 HIS C C 13 177.862 177.862 177.947 -0.085 18933 57 1 . 1 1 13 13 HIS CA C 13 59.098 59.098 59.018 0.080 18933 58 1 . 1 1 13 13 HIS CB C 13 31.232 31.232 30.521 0.711 18933 59 1 . 1 1 13 13 HIS H H 13 7.741 7.741 8.322 -0.581 18933 60 1 . 1 1 14 14 LEU N N 14 116.641 116.641 119.880 -3.239 18933 61 1 . 1 1 14 14 LEU C C 14 179.186 179.186 178.274 0.912 18933 62 1 . 1 1 14 14 LEU CA C 14 56.757 56.757 58.297 -1.540 18933 63 1 . 1 1 14 14 LEU CB C 14 41.119 41.119 41.597 -0.478 18933 64 1 . 1 1 14 14 LEU H H 14 8.221 8.221 8.519 -0.298 18933 65 1 . 1 1 15 15 ARG N N 15 115.957 115.957 114.714 1.243 18933 66 1 . 1 1 15 15 ARG C C 15 176.330 176.330 178.190 -1.860 18933 67 1 . 1 1 15 15 ARG CA C 15 59.703 59.703 58.511 1.192 18933 68 1 . 1 1 15 15 ARG CB C 15 29.077 29.077 30.401 -1.324 18933 69 1 . 1 1 15 15 ARG H H 15 7.968 7.968 8.386 -0.418 18933 70 1 . 1 1 16 16 SER N N 16 109.395 109.395 115.768 -6.373 18933 71 1 . 1 1 16 16 SER C C 16 176.024 176.024 175.055 0.969 18933 72 1 . 1 1 16 16 SER CA C 16 57.282 57.282 60.222 -2.940 18933 73 1 . 1 1 16 16 SER CB C 16 63.683 63.683 63.717 -0.034 18933 74 1 . 1 1 16 16 SER H H 16 6.963 6.963 7.535 -0.572 18933 75 1 . 1 1 17 17 ARG N N 17 122.775 122.775 121.781 0.994 18933 76 1 . 1 1 17 17 ARG C C 17 174.590 174.590 173.987 0.603 18933 77 1 . 1 1 17 17 ARG CA C 17 56.273 56.273 54.982 1.291 18933 78 1 . 1 1 17 17 ARG CB C 17 31.802 31.802 30.461 1.341 18933 79 1 . 1 1 17 17 ARG H H 17 7.781 7.781 8.294 -0.513 18933 80 1 . 1 1 18 18 LEU N N 18 122.421 122.421 125.841 -3.420 18933 81 1 . 1 1 18 18 LEU C C 18 176.281 176.281 174.070 2.211 18933 82 1 . 1 1 18 18 LEU CA C 18 54.780 54.780 54.398 0.382 18933 83 1 . 1 1 18 18 LEU CB C 18 43.211 43.211 46.873 -3.662 18933 84 1 . 1 1 18 18 LEU H H 18 8.650 8.650 7.759 0.891 18933 85 1 . 1 1 19 19 ALA N N 19 126.441 126.441 126.786 -0.345 18933 86 1 . 1 1 19 19 ALA C C 19 173.904 173.904 174.865 -0.961 18933 87 1 . 1 1 19 19 ALA CA C 19 50.866 50.866 51.615 -0.749 18933 88 1 . 1 1 19 19 ALA CB C 19 22.865 22.865 22.297 0.567 18933 89 1 . 1 1 19 19 ALA H H 19 8.609 8.609 8.926 -0.317 18933 90 1 . 1 1 20 20 PHE N N 20 114.600 114.600 119.199 -4.599 18933 91 1 . 1 1 20 20 PHE C C 20 172.592 172.592 173.897 -1.305 18933 92 1 . 1 1 20 20 PHE CA C 20 55.789 55.789 54.988 0.801 18933 93 1 . 1 1 20 20 PHE CB C 20 41.689 41.689 42.617 -0.928 18933 94 1 . 1 1 20 20 PHE H H 20 8.801 8.801 9.109 -0.308 18933 95 1 . 1 1 21 21 GLU N N 21 122.873 122.873 123.460 -0.587 18933 96 1 . 1 1 21 21 GLU C C 21 174.872 174.872 175.234 -0.362 18933 97 1 . 1 1 21 21 GLU CA C 21 55.062 55.062 55.006 0.056 18933 98 1 . 1 1 21 21 GLU CB C 21 30.725 30.725 31.160 -0.435 18933 99 1 . 1 1 21 21 GLU H H 21 7.847 7.847 9.199 -1.352 18933 100 1 . 1 1 22 22 TYR N N 22 126.270 126.270 126.564 -0.294 18933 101 1 . 1 1 22 22 TYR C C 22 174.872 174.872 174.741 0.131 18933 102 1 . 1 1 22 22 TYR CA C 22 55.748 55.748 56.636 -0.888 18933 103 1 . 1 1 22 22 TYR CB C 22 40.105 40.105 41.110 -1.005 18933 104 1 . 1 1 22 22 TYR H H 22 8.806 8.806 9.158 -0.352 18933 105 1 . 1 1 23 23 ASN N N 23 128.420 128.420 125.998 2.422 18933 106 1 . 1 1 23 23 ASN C C 23 175.435 175.435 175.103 0.332 18933 107 1 . 1 1 23 23 ASN CA C 23 53.005 53.005 53.582 -0.577 18933 108 1 . 1 1 23 23 ASN CB C 23 36.365 36.365 37.692 -1.327 18933 109 1 . 1 1 23 23 ASN H H 23 8.943 8.943 9.144 -0.201 18933 110 1 . 1 1 24 24 GLY N N 24 104.067 104.067 102.423 1.644 18933 111 1 . 1 1 24 24 GLY C C 24 173.707 173.707 173.797 -0.090 18933 112 1 . 1 1 24 24 GLY CA C 24 44.934 44.934 44.950 -0.016 18933 113 1 . 1 1 24 24 GLY H H 24 8.534 8.534 8.182 0.352 18933 114 1 . 1 1 25 25 GLN N N 25 120.038 120.038 119.800 0.238 18933 115 1 . 1 1 25 25 GLN C C 25 173.744 173.744 174.878 -1.134 18933 116 1 . 1 1 25 25 GLN CA C 25 53.327 53.327 54.402 -1.075 18933 117 1 . 1 1 25 25 GLN CB C 25 30.661 30.661 30.282 0.378 18933 118 1 . 1 1 25 25 GLN H H 25 7.595 7.595 7.832 -0.237 18933 119 1 . 1 1 26 26 LEU N N 26 124.681 124.681 124.907 -0.226 18933 120 1 . 1 1 26 26 LEU C C 26 175.987 175.987 176.197 -0.210 18933 121 1 . 1 1 26 26 LEU CA C 26 54.013 54.013 54.491 -0.478 18933 122 1 . 1 1 26 26 LEU CB C 26 40.865 40.865 42.452 -1.587 18933 123 1 . 1 1 26 26 LEU H H 26 8.382 8.382 8.599 -0.217 18933 124 1 . 1 1 27 27 ILE N N 27 130.779 130.779 127.210 3.569 18933 125 1 . 1 1 27 27 ILE C C 27 175.215 175.215 174.373 0.842 18933 126 1 . 1 1 27 27 ILE CA C 27 59.259 59.259 59.693 -0.434 18933 127 1 . 1 1 27 27 ILE CB C 27 35.732 35.732 38.053 -2.321 18933 128 1 . 1 1 27 27 ILE H H 27 8.882 8.882 8.923 -0.041 18933 129 1 . 1 1 28 28 LYS N N 28 126.160 126.160 127.562 -1.402 18933 130 1 . 1 1 28 28 LYS C C 28 176.771 176.771 175.692 1.078 18933 131 1 . 1 1 28 28 LYS CA C 28 56.838 56.838 54.889 1.949 18933 132 1 . 1 1 28 28 LYS CB C 28 31.739 31.739 33.121 -1.382 18933 133 1 . 1 1 28 28 LYS H H 28 8.165 8.165 8.350 -0.185 18933 134 1 . 1 1 29 29 ILE N N 29 126.380 126.380 122.019 4.361 18933 135 1 . 1 1 29 29 ILE C C 29 175.877 175.877 174.282 1.595 18933 136 1 . 1 1 29 29 ILE CA C 29 60.308 60.308 60.508 -0.200 18933 137 1 . 1 1 29 29 ILE CB C 29 37.063 37.063 39.592 -2.529 18933 138 1 . 1 1 29 29 ILE H H 29 8.019 8.019 8.695 -0.676 18933 139 1 . 1 1 30 30 LEU N N 30 129.215 129.215 122.249 6.966 18933 140 1 . 1 1 30 30 LEU C C 30 178.867 178.867 178.145 0.721 18933 141 1 . 1 1 30 30 LEU CA C 30 54.619 54.619 53.338 1.281 18933 142 1 . 1 1 30 30 LEU CB C 30 40.865 40.865 45.592 -4.727 18933 143 1 . 1 1 30 30 LEU H H 30 8.917 8.917 8.319 0.598 18933 144 1 . 1 1 31 31 SER N N 31 117.997 117.997 116.294 1.703 18933 145 1 . 1 1 31 31 SER C C 31 177.396 177.396 175.683 1.713 18933 146 1 . 1 1 31 31 SER CA C 31 61.236 61.236 60.853 0.383 18933 147 1 . 1 1 31 31 SER CB C 31 62.035 62.035 63.212 -1.177 18933 148 1 . 1 1 31 31 SER H H 31 8.594 8.594 8.864 -0.270 18933 149 1 . 1 1 32 32 LYS N N 32 116.189 116.189 119.240 -3.051 18933 150 1 . 1 1 32 32 LYS C C 32 176.244 176.244 177.099 -0.855 18933 151 1 . 1 1 32 32 LYS CA C 32 57.403 57.403 58.108 -0.705 18933 152 1 . 1 1 32 32 LYS CB C 32 30.281 30.281 32.398 -2.117 18933 153 1 . 1 1 32 32 LYS H H 32 8.029 8.029 8.255 -0.226 18933 154 1 . 1 1 33 33 ASN N N 33 119.061 119.061 115.555 3.506 18933 155 1 . 1 1 33 33 ASN C C 33 172.384 172.384 174.191 -1.807 18933 156 1 . 1 1 33 33 ASN CA C 33 52.157 52.157 53.719 -1.562 18933 157 1 . 1 1 33 33 ASN CB C 33 38.267 38.267 41.116 -2.849 18933 158 1 . 1 1 33 33 ASN H H 33 7.902 7.902 7.815 0.087 18933 159 1 . 1 1 34 34 ILE N N 34 120.038 120.038 119.672 0.366 18933 160 1 . 1 1 34 34 ILE C C 34 175.607 175.607 174.244 1.363 18933 161 1 . 1 1 34 34 ILE CA C 34 60.550 60.550 60.315 0.235 18933 162 1 . 1 1 34 34 ILE CB C 34 38.964 38.964 41.702 -2.738 18933 163 1 . 1 1 34 34 ILE H H 34 7.443 7.443 7.823 -0.380 18933 164 1 . 1 1 35 35 VAL N N 35 129.435 129.435 126.000 3.435 18933 165 1 . 1 1 35 35 VAL C C 35 175.386 175.386 174.526 0.860 18933 166 1 . 1 1 35 35 VAL CA C 35 60.026 60.026 60.124 -0.098 18933 167 1 . 1 1 35 35 VAL CB C 35 34.781 34.781 35.724 -0.943 18933 168 1 . 1 1 35 35 VAL H H 35 9.533 9.533 8.879 0.654 18933 169 1 . 1 1 36 36 ALA N N 36 130.571 130.571 129.492 1.079 18933 170 1 . 1 1 36 36 ALA C C 36 177.347 177.347 176.327 1.020 18933 171 1 . 1 1 36 36 ALA CA C 36 52.399 52.399 51.772 0.627 18933 172 1 . 1 1 36 36 ALA CB C 36 17.858 17.858 18.767 -0.909 18933 173 1 . 1 1 36 36 ALA H H 36 8.665 8.665 8.461 0.204 18933 174 1 . 1 1 37 37 VAL N N 37 115.395 115.395 120.381 -4.986 18933 175 1 . 1 1 37 37 VAL C C 37 174.455 174.455 175.941 -1.486 18933 176 1 . 1 1 37 37 VAL CA C 37 59.380 59.380 59.242 0.138 18933 177 1 . 1 1 37 37 VAL CB C 37 32.943 32.943 34.374 -1.431 18933 178 1 . 1 1 37 37 VAL H H 37 8.079 8.079 8.288 -0.209 18933 179 1 . 1 1 38 38 GLY N N 38 107.672 107.672 107.956 -0.284 18933 180 1 . 1 1 38 38 GLY C C 38 173.364 173.364 175.706 -2.342 18933 181 1 . 1 1 38 38 GLY CA C 38 46.185 46.185 46.328 -0.142 18933 182 1 . 1 1 38 38 GLY H H 38 7.579 7.579 8.215 -0.636 18933 183 1 . 1 1 39 39 SER N N 39 121.052 121.052 119.737 1.315 18933 184 1 . 1 1 39 39 SER C C 39 175.570 175.570 176.475 -0.905 18933 185 1 . 1 1 39 39 SER CA C 39 61.801 61.801 61.803 -0.002 18933 186 1 . 1 1 39 39 SER CB C 39 62.478 62.478 63.287 -0.809 18933 187 1 . 1 1 39 39 SER H H 39 8.953 8.953 8.120 0.833 18933 188 1 . 1 1 40 40 LEU N N 40 121.553 121.553 121.421 0.132 18933 189 1 . 1 1 40 40 LEU C C 40 180.203 180.203 178.139 2.064 18933 190 1 . 1 1 40 40 LEU CA C 40 58.129 58.129 58.186 -0.056 18933 191 1 . 1 1 40 40 LEU CB C 40 41.753 41.753 41.918 -0.165 18933 192 1 . 1 1 40 40 LEU H H 40 8.195 8.195 7.285 0.910 18933 193 1 . 1 1 41 41 ARG N N 41 121.956 121.956 117.346 4.610 18933 194 1 . 1 1 41 41 ARG C C 41 177.323 177.323 177.931 -0.608 18933 195 1 . 1 1 41 41 ARG CA C 41 58.331 58.331 57.925 0.406 18933 196 1 . 1 1 41 41 ARG CB C 41 28.443 28.443 29.978 -1.535 18933 197 1 . 1 1 41 41 ARG H H 41 6.873 6.873 7.519 -0.646 18933 198 1 . 1 1 42 42 ARG N N 42 114.600 114.600 116.690 -2.090 18933 199 1 . 1 1 42 42 ARG C C 42 172.911 172.911 175.887 -2.976 18933 200 1 . 1 1 42 42 ARG CA C 42 57.242 57.242 57.050 0.192 18933 201 1 . 1 1 42 42 ARG CB C 42 29.140 29.140 30.940 -1.800 18933 202 1 . 1 1 42 42 ARG H H 42 7.438 7.438 8.076 -0.638 18933 203 1 . 1 1 43 43 GLU N N 43 113.354 113.354 116.258 -2.904 18933 204 1 . 1 1 43 43 GLU C C 43 175.999 175.999 175.418 0.581 18933 205 1 . 1 1 43 43 GLU CA C 43 56.556 56.556 57.208 -0.652 18933 206 1 . 1 1 43 43 GLU CB C 43 25.337 25.337 27.160 -1.823 18933 207 1 . 1 1 43 43 GLU H H 43 7.564 7.564 8.018 -0.454 18933 208 1 . 1 1 44 44 GLU N N 44 119.696 119.696 121.681 -1.985 18933 209 1 . 1 1 44 44 GLU C C 44 175.423 175.423 176.625 -1.202 18933 210 1 . 1 1 44 44 GLU CA C 44 56.838 56.838 56.409 0.429 18933 211 1 . 1 1 44 44 GLU CB C 44 28.696 28.696 29.765 -1.069 18933 212 1 . 1 1 44 44 GLU H H 44 7.261 7.261 8.315 -1.054 18933 213 1 . 1 1 45 45 LYS N N 45 117.435 117.435 118.732 -1.297 18933 214 1 . 1 1 45 45 LYS C C 45 177.715 177.715 175.841 1.874 18933 215 1 . 1 1 45 45 LYS CA C 45 59.219 59.219 57.532 1.687 18933 216 1 . 1 1 45 45 LYS CB C 45 32.119 32.119 33.597 -1.478 18933 217 1 . 1 1 45 45 LYS H H 45 7.938 7.938 8.069 -0.131 18933 218 1 . 1 1 46 46 MET N N 46 115.847 115.847 117.920 -2.073 18933 219 1 . 1 1 46 46 MET CA C 46 52.520 52.520 53.807 -1.287 18933 220 1 . 1 1 46 46 MET CB C 46 33.450 33.450 34.142 -0.691 18933 221 1 . 1 1 46 46 MET H H 46 7.595 7.595 7.780 -0.185 18933 222 1 . 1 1 47 47 LEU N N 47 121.627 121.627 123.370 -1.743 18933 223 1 . 1 1 47 47 LEU CA C 47 53.126 53.126 54.398 -1.272 18933 224 1 . 1 1 47 47 LEU CB C 47 43.070 43.070 43.320 -0.250 18933 225 1 . 1 1 47 47 LEU H H 47 9.220 9.220 8.888 0.332 18933 226 1 . 1 1 49 49 ASP N N 49 117.093 117.093 117.764 -0.671 18933 227 1 . 1 1 49 49 ASP C C 49 173.340 173.340 174.389 -1.049 18933 228 1 . 1 1 49 49 ASP CA C 49 51.794 51.794 53.292 -1.498 18933 229 1 . 1 1 49 49 ASP CB C 49 43.006 43.006 44.634 -1.628 18933 230 1 . 1 1 49 49 ASP H H 49 7.761 7.761 7.617 0.144 18933 231 1 . 1 1 50 50 VAL N N 50 119.012 119.012 117.129 1.883 18933 232 1 . 1 1 50 50 VAL C C 50 173.070 173.070 173.881 -0.811 18933 233 1 . 1 1 50 50 VAL CA C 50 61.842 61.842 60.106 1.736 18933 234 1 . 1 1 50 50 VAL CB C 50 32.563 32.563 33.378 -0.815 18933 235 1 . 1 1 50 50 VAL H H 50 8.089 8.089 8.452 -0.363 18933 236 1 . 1 1 51 51 ASP N N 51 127.064 127.064 125.445 1.619 18933 237 1 . 1 1 51 51 ASP C C 51 174.565 174.565 175.294 -0.729 18933 238 1 . 1 1 51 51 ASP CA C 51 52.157 52.157 52.853 -0.696 18933 239 1 . 1 1 51 51 ASP CB C 51 42.640 42.640 43.495 -0.855 18933 240 1 . 1 1 51 51 ASP H H 51 8.069 8.069 8.086 -0.017 18933 241 1 . 1 1 52 52 LEU N N 52 121.627 121.627 119.992 1.635 18933 242 1 . 1 1 52 52 LEU C C 52 174.063 174.063 174.700 -0.637 18933 243 1 . 1 1 52 52 LEU CA C 52 52.682 52.682 53.448 -0.766 18933 244 1 . 1 1 52 52 LEU CB C 52 44.351 44.351 47.281 -2.929 18933 245 1 . 1 1 52 52 LEU H H 52 8.852 8.852 8.993 -0.141 18933 246 1 . 1 1 53 53 LEU N N 53 123.093 123.093 123.196 -0.103 18933 247 1 . 1 1 53 53 LEU CA C 53 55.991 55.991 54.100 1.891 18933 248 1 . 1 1 53 53 LEU CB C 53 42.133 42.133 44.630 -2.497 18933 249 1 . 1 1 53 53 LEU H H 53 9.362 9.362 9.069 0.293 18933 250 1 . 1 1 54 54 ILE N N 54 123.777 123.777 128.974 -5.197 18933 251 1 . 1 1 54 54 ILE CA C 54 55.062 55.062 59.224 -4.162 18933 252 1 . 1 1 54 54 ILE CB C 54 33.070 33.070 40.155 -7.085 18933 253 1 . 1 1 54 54 ILE H H 54 8.907 8.907 9.302 -0.395 18933 254 1 . 1 1 58 58 GLU N N 58 114.710 114.710 117.202 -2.492 18933 255 1 . 1 1 58 58 GLU CA C 58 54.377 54.377 55.350 -0.973 18933 256 1 . 1 1 58 58 GLU CB C 58 31.422 31.422 32.829 -1.407 18933 257 1 . 1 1 58 58 GLU H H 58 6.716 6.716 7.497 -0.781 18933 258 1 . 1 1 61 61 LEU N N 61 115.957 115.957 120.146 -4.190 18933 259 1 . 1 1 61 61 LEU C C 61 178.512 178.512 178.352 0.160 18933 260 1 . 1 1 61 61 LEU CA C 61 54.780 54.780 57.258 -2.478 18933 261 1 . 1 1 61 61 LEU CB C 61 41.119 41.119 41.679 -0.560 18933 262 1 . 1 1 61 61 LEU H H 61 7.307 7.307 7.833 -0.526 18933 263 1 . 1 1 62 62 LEU N N 62 120.038 120.038 119.434 0.604 18933 264 1 . 1 1 62 62 LEU C C 62 177.874 177.874 178.767 -0.893 18933 265 1 . 1 1 62 62 LEU CA C 62 58.936 58.936 58.533 0.403 18933 266 1 . 1 1 62 62 LEU CB C 62 40.739 40.739 41.959 -1.220 18933 267 1 . 1 1 62 62 LEU H H 62 7.327 7.327 8.153 -0.826 18933 268 1 . 1 1 63 63 LYS N N 63 114.600 114.600 115.791 -1.191 18933 269 1 . 1 1 63 63 LYS C C 63 175.460 175.460 177.634 -2.174 18933 270 1 . 1 1 63 63 LYS CA C 63 57.564 57.564 58.814 -1.250 18933 271 1 . 1 1 63 63 LYS CB C 63 30.725 30.725 32.550 -1.825 18933 272 1 . 1 1 63 63 LYS H H 63 7.973 7.973 7.757 0.216 18933 273 1 . 1 1 64 64 HIS N N 64 115.273 115.273 115.699 -0.426 18933 274 1 . 1 1 64 64 HIS CA C 64 56.112 56.112 55.207 0.905 18933 275 1 . 1 1 64 64 HIS CB C 64 32.436 32.436 30.250 2.186 18933 276 1 . 1 1 64 64 HIS H H 64 7.544 7.544 7.558 -0.014 18933 277 1 . 1 1 65 65 VAL N N 65 118.682 118.682 118.964 -0.282 18933 278 1 . 1 1 65 65 VAL CA C 65 66.038 66.038 62.779 3.259 18933 279 1 . 1 1 65 65 VAL CB C 65 30.027 30.027 32.356 -2.329 18933 280 1 . 1 1 65 65 VAL H H 65 6.787 6.787 7.191 -0.404 18933 281 1 . 1 1 68 68 ASN N N 68 112.108 112.108 117.967 -5.859 18933 282 1 . 1 1 68 68 ASN C C 68 174.884 174.884 173.930 0.954 18933 283 1 . 1 1 68 68 ASN CA C 68 51.027 51.027 52.379 -1.352 18933 284 1 . 1 1 68 68 ASN CB C 68 40.232 40.232 39.381 0.851 18933 285 1 . 1 1 68 68 ASN H H 68 7.009 7.009 8.314 -1.305 18933 286 1 . 1 1 69 69 ILE N N 69 123.325 123.325 123.495 -0.170 18933 287 1 . 1 1 69 69 ILE C C 69 174.394 174.394 175.438 -1.044 18933 288 1 . 1 1 69 69 ILE CA C 69 60.107 60.107 61.657 -1.550 18933 289 1 . 1 1 69 69 ILE CB C 69 38.267 38.267 38.557 -0.290 18933 290 1 . 1 1 69 69 ILE H H 69 7.150 7.150 8.211 -1.061 18933 291 1 . 1 1 70 70 ARG N N 70 126.722 126.722 127.740 -1.018 18933 292 1 . 1 1 70 70 ARG C C 70 174.590 174.590 174.256 0.334 18933 293 1 . 1 1 70 70 ARG CA C 70 53.247 53.247 54.475 -1.228 18933 294 1 . 1 1 70 70 ARG CB C 70 32.372 32.372 34.658 -2.286 18933 295 1 . 1 1 70 70 ARG H H 70 8.902 8.902 9.219 -0.317 18933 296 1 . 1 1 71 71 ILE N N 71 119.978 119.978 120.393 -0.415 18933 297 1 . 1 1 71 71 ILE C C 71 175.583 175.583 175.777 -0.194 18933 298 1 . 1 1 71 71 ILE CA C 71 59.824 59.824 59.760 0.064 18933 299 1 . 1 1 71 71 ILE CB C 71 37.760 37.760 40.348 -2.588 18933 300 1 . 1 1 71 71 ILE H H 71 7.491 7.491 8.823 -1.332 18933 301 1 . 1 1 72 72 LYS N N 72 128.530 128.530 125.097 3.433 18933 302 1 . 1 1 72 72 LYS C C 72 177.703 177.703 176.285 1.418 18933 303 1 . 1 1 72 72 LYS CA C 72 57.201 57.201 55.107 2.094 18933 304 1 . 1 1 72 72 LYS CB C 72 31.485 31.485 31.049 0.436 18933 305 1 . 1 1 72 72 LYS H H 72 8.523 8.523 8.563 -0.040 18933 306 1 . 1 1 73 73 GLY N N 73 113.806 113.806 110.322 3.484 18933 307 1 . 1 1 73 73 GLY C C 73 173.781 173.781 172.907 0.874 18933 308 1 . 1 1 73 73 GLY CA C 73 45.822 45.822 45.194 0.628 18933 309 1 . 1 1 73 73 GLY H H 73 8.791 8.791 8.356 0.435 18933 310 1 . 1 1 74 74 LEU N N 74 120.490 120.490 118.268 2.222 18933 311 1 . 1 1 74 74 LEU C C 74 175.840 175.840 173.590 2.250 18933 312 1 . 1 1 74 74 LEU CA C 74 53.691 53.691 54.351 -0.660 18933 313 1 . 1 1 74 74 LEU CB C 74 44.161 44.161 45.190 -1.029 18933 314 1 . 1 1 74 74 LEU H H 74 7.393 7.393 7.265 0.128 18933 315 1 . 1 1 75 75 SER N N 75 120.038 120.038 115.664 4.374 18933 316 1 . 1 1 75 75 SER C C 75 173.205 173.205 173.221 -0.016 18933 317 1 . 1 1 75 75 SER CA C 75 57.887 57.887 57.593 0.294 18933 318 1 . 1 1 75 75 SER CB C 75 63.049 63.049 64.972 -1.923 18933 319 1 . 1 1 75 75 SER H H 75 8.917 8.917 8.141 0.776 18933 320 1 . 1 1 76 76 PHE N N 76 119.586 119.586 117.993 1.593 18933 321 1 . 1 1 76 76 PHE C C 76 173.536 173.536 173.693 -0.157 18933 322 1 . 1 1 76 76 PHE CA C 76 55.426 55.426 56.098 -0.672 18933 323 1 . 1 1 76 76 PHE CB C 76 42.006 42.006 42.236 -0.230 18933 324 1 . 1 1 76 76 PHE H H 76 8.003 8.003 8.380 -0.377 18933 325 1 . 1 1 77 77 SER N N 77 114.943 114.943 116.055 -1.112 18933 326 1 . 1 1 77 77 SER C C 77 173.438 173.438 172.454 0.984 18933 327 1 . 1 1 77 77 SER CA C 77 56.152 56.152 57.097 -0.945 18933 328 1 . 1 1 77 77 SER CB C 77 65.204 65.204 65.789 -0.585 18933 329 1 . 1 1 77 77 SER H H 77 8.907 8.907 8.758 0.149 18933 330 1 . 1 1 78 78 VAL N N 78 124.791 124.791 124.194 0.597 18933 331 1 . 1 1 78 78 VAL CA C 78 62.044 62.044 60.332 1.712 18933 332 1 . 1 1 78 78 VAL CB C 78 32.182 32.182 34.425 -2.243 18933 333 1 . 1 1 78 78 VAL H H 78 8.892 8.892 8.319 0.573 18933 334 1 . 1 1 79 79 LYS N N 79 129.667 129.667 129.333 0.334 18933 335 1 . 1 1 79 79 LYS CA C 79 56.192 56.192 54.272 1.920 18933 336 1 . 1 1 79 79 LYS CB C 79 32.372 32.372 34.283 -1.911 18933 337 1 . 1 1 79 79 LYS H H 79 9.049 9.049 8.787 0.262 18933 338 1 . 1 1 82 82 GLY N N 82 117.263 117.263 113.719 3.544 18933 339 1 . 1 1 82 82 GLY C C 82 171.710 171.710 174.558 -2.848 18933 340 1 . 1 1 82 82 GLY CA C 82 43.925 43.925 46.474 -2.550 18933 341 1 . 1 1 82 82 GLY H H 82 8.044 8.044 8.473 -0.429 18933 342 1 . 1 1 83 83 GLU N N 83 117.203 117.203 121.345 -4.142 18933 343 1 . 1 1 83 83 GLU C C 83 178.695 178.695 177.870 0.824 18933 344 1 . 1 1 83 83 GLU CA C 83 58.977 58.977 57.537 1.440 18933 345 1 . 1 1 83 83 GLU CB C 83 29.837 29.837 29.973 -0.136 18933 346 1 . 1 1 83 83 GLU H H 83 8.296 8.296 8.479 -0.183 18933 347 1 . 1 1 84 84 ARG N N 84 113.818 113.818 119.240 -5.422 18933 348 1 . 1 1 84 84 ARG C C 84 175.877 175.877 175.231 0.646 18933 349 1 . 1 1 84 84 ARG CA C 84 53.731 53.731 55.224 -1.493 18933 350 1 . 1 1 84 84 ARG CB C 84 31.295 31.295 29.312 1.983 18933 351 1 . 1 1 84 84 ARG H H 84 8.342 8.342 7.971 0.371 18933 352 1 . 1 1 85 85 LYS N N 85 119.354 119.354 121.277 -1.923 18933 353 1 . 1 1 85 85 LYS C C 85 174.516 174.516 174.237 0.279 18933 354 1 . 1 1 85 85 LYS CA C 85 54.740 54.740 55.550 -0.810 18933 355 1 . 1 1 85 85 LYS CB C 85 34.844 34.844 34.975 -0.131 18933 356 1 . 1 1 85 85 LYS H H 85 6.822 6.822 7.636 -0.814 18933 357 1 . 1 1 86 86 CYS N N 86 125.928 125.928 124.571 1.357 18933 358 1 . 1 1 86 86 CYS C C 86 171.600 171.600 173.138 -1.538 18933 359 1 . 1 1 86 86 CYS CA C 86 55.627 55.627 57.930 -2.303 18933 360 1 . 1 1 86 86 CYS CB C 86 30.344 30.344 30.462 -0.118 18933 361 1 . 1 1 86 86 CYS H H 86 9.084 9.084 9.353 -0.269 18933 362 1 . 1 1 87 87 VAL N N 87 126.612 126.612 126.243 0.369 18933 363 1 . 1 1 87 87 VAL C C 87 174.431 174.431 174.498 -0.067 18933 364 1 . 1 1 87 87 VAL CA C 87 61.317 61.317 61.580 -0.263 18933 365 1 . 1 1 87 87 VAL CB C 87 33.196 33.196 32.436 0.760 18933 366 1 . 1 1 87 87 VAL H H 87 8.705 8.705 8.991 -0.286 18933 367 1 . 1 1 88 88 LEU N N 88 127.748 127.748 123.559 4.189 18933 368 1 . 1 1 88 88 LEU C C 88 175.227 175.227 174.580 0.647 18933 369 1 . 1 1 88 88 LEU CA C 88 52.520 52.520 52.768 -0.248 18933 370 1 . 1 1 88 88 LEU CB C 88 44.605 44.605 46.145 -1.540 18933 371 1 . 1 1 88 88 LEU H H 88 9.417 9.417 8.667 0.750 18933 372 1 . 1 1 89 89 PHE N N 89 120.981 120.981 118.988 1.993 18933 373 1 . 1 1 89 89 PHE C C 89 176.906 176.906 176.044 0.862 18933 374 1 . 1 1 89 89 PHE CA C 89 55.587 55.587 56.002 -0.415 18933 375 1 . 1 1 89 89 PHE CB C 89 38.901 38.901 41.714 -2.813 18933 376 1 . 1 1 89 89 PHE H H 89 8.937 8.937 8.630 0.307 18933 377 1 . 1 1 90 90 ILE N N 90 119.928 119.928 118.413 1.515 18933 378 1 . 1 1 90 90 ILE C C 90 173.781 173.781 174.989 -1.208 18933 379 1 . 1 1 90 90 ILE CA C 90 58.654 58.654 59.736 -1.082 18933 380 1 . 1 1 90 90 ILE CB C 90 40.612 40.612 39.467 1.145 18933 381 1 . 1 1 90 90 ILE H H 90 9.230 9.230 9.076 0.154 18933 382 1 . 1 1 91 91 GLU N N 91 124.339 124.339 124.974 -0.635 18933 383 1 . 1 1 91 91 GLU C C 91 175.607 175.607 175.341 0.266 18933 384 1 . 1 1 91 91 GLU CA C 91 54.619 54.619 54.713 -0.094 18933 385 1 . 1 1 91 91 GLU CB C 91 29.837 29.837 32.961 -3.124 18933 386 1 . 1 1 91 91 GLU H H 91 8.175 8.175 9.002 -0.827 18933 387 1 . 1 1 92 92 TRP N N 92 127.516 127.516 124.799 2.717 18933 388 1 . 1 1 92 92 TRP C C 92 175.203 175.203 176.258 -1.055 18933 389 1 . 1 1 92 92 TRP CA C 92 56.233 56.233 54.766 1.467 18933 390 1 . 1 1 92 92 TRP CB C 92 30.661 30.661 29.486 1.175 18933 391 1 . 1 1 92 92 TRP H H 92 9.306 9.306 8.577 0.729 18933 392 1 . 1 1 93 93 GLU N N 93 127.834 127.834 125.812 2.022 18933 393 1 . 1 1 93 93 GLU C C 93 175.668 175.668 176.195 -0.527 18933 394 1 . 1 1 93 93 GLU CA C 93 56.878 56.878 57.491 -0.613 18933 395 1 . 1 1 93 93 GLU CB C 93 26.034 26.034 28.598 -2.564 18933 396 1 . 1 1 93 93 GLU H H 93 8.796 8.796 9.103 -0.307 18933 397 1 . 1 1 94 94 LYS N N 94 108.931 108.931 112.689 -3.758 18933 398 1 . 1 1 94 94 LYS C C 94 175.423 175.423 176.015 -0.592 18933 399 1 . 1 1 94 94 LYS CA C 94 57.443 57.443 57.681 -0.238 18933 400 1 . 1 1 94 94 LYS CB C 94 28.633 28.633 31.330 -2.697 18933 401 1 . 1 1 94 94 LYS H H 94 8.498 8.498 8.588 -0.090 18933 402 1 . 1 1 95 95 LYS N N 95 121.737 121.737 120.387 1.350 18933 403 1 . 1 1 95 95 LYS C C 95 174.443 174.443 175.167 -0.724 18933 404 1 . 1 1 95 95 LYS CA C 95 54.417 54.417 56.403 -1.986 18933 405 1 . 1 1 95 95 LYS CB C 95 34.464 34.464 34.252 0.212 18933 406 1 . 1 1 95 95 LYS H H 95 7.761 7.761 7.618 0.143 18933 407 1 . 1 1 96 96 THR N N 96 116.067 116.067 116.133 -0.066 18933 408 1 . 1 1 96 96 THR C C 96 174.296 174.296 173.665 0.631 18933 409 1 . 1 1 96 96 THR CA C 96 61.115 61.115 61.134 -0.019 18933 410 1 . 1 1 96 96 THR CB C 96 69.450 69.450 71.467 -2.017 18933 411 1 . 1 1 96 96 THR H H 96 7.761 7.761 8.296 -0.535 18933 412 1 . 1 1 97 97 TYR N N 97 124.229 124.229 124.605 -0.376 18933 413 1 . 1 1 97 97 TYR C C 97 173.536 173.536 174.039 -0.503 18933 414 1 . 1 1 97 97 TYR CA C 97 55.950 55.950 56.474 -0.524 18933 415 1 . 1 1 97 97 TYR CB C 97 41.182 41.182 42.662 -1.479 18933 416 1 . 1 1 97 97 TYR H H 97 9.018 9.018 9.259 -0.241 18933 417 1 . 1 1 98 98 GLN N N 98 123.435 123.435 123.722 -0.287 18933 418 1 . 1 1 98 98 GLN C C 98 173.266 173.266 173.884 -0.618 18933 419 1 . 1 1 98 98 GLN CA C 98 55.143 55.143 55.632 -0.489 18933 420 1 . 1 1 98 98 GLN CB C 98 29.013 29.013 29.576 -0.563 18933 421 1 . 1 1 98 98 GLN H H 98 8.781 8.781 9.012 -0.231 18933 422 1 . 1 1 99 99 LEU N N 99 130.119 130.119 128.275 1.844 18933 423 1 . 1 1 99 99 LEU C C 99 173.867 173.867 174.175 -0.308 18933 424 1 . 1 1 99 99 LEU CA C 99 52.520 52.520 53.365 -0.845 18933 425 1 . 1 1 99 99 LEU CB C 99 44.605 44.605 45.571 -0.966 18933 426 1 . 1 1 99 99 LEU H H 99 9.104 9.104 8.801 0.303 18933 427 1 . 1 1 100 100 ASP N N 100 125.182 125.182 127.653 -2.471 18933 428 1 . 1 1 100 100 ASP C C 100 172.837 172.837 174.418 -1.581 18933 429 1 . 1 1 100 100 ASP CA C 100 51.754 51.754 54.026 -2.272 18933 430 1 . 1 1 100 100 ASP CB C 100 39.344 39.344 43.160 -3.816 18933 431 1 . 1 1 100 100 ASP H H 100 9.089 9.089 8.771 0.318 18933 432 1 . 1 1 101 101 LEU N N 101 121.174 121.174 126.994 -5.820 18933 433 1 . 1 1 101 101 LEU C C 101 174.529 174.529 174.796 -0.267 18933 434 1 . 1 1 101 101 LEU CA C 101 51.915 51.915 53.755 -1.840 18933 435 1 . 1 1 101 101 LEU CB C 101 43.908 43.908 45.532 -1.624 18933 436 1 . 1 1 101 101 LEU H H 101 8.458 8.458 9.173 -0.715 18933 437 1 . 1 1 102 102 PHE N N 102 119.464 119.464 124.746 -5.282 18933 438 1 . 1 1 102 102 PHE C C 102 176.293 176.293 174.891 1.402 18933 439 1 . 1 1 102 102 PHE CA C 102 54.054 54.054 55.423 -1.369 18933 440 1 . 1 1 102 102 PHE CB C 102 41.880 41.880 42.536 -0.656 18933 441 1 . 1 1 102 102 PHE H H 102 8.281 8.281 9.289 -1.008 18933 442 1 . 1 1 103 103 THR N N 103 108.576 108.576 117.505 -8.929 18933 443 1 . 1 1 103 103 THR C C 103 174.933 174.933 173.369 1.564 18933 444 1 . 1 1 103 103 THR CA C 103 57.726 57.726 60.233 -2.507 18933 445 1 . 1 1 103 103 THR CB C 103 71.288 71.288 69.475 1.813 18933 446 1 . 1 1 103 103 THR H H 103 7.872 7.872 8.325 -0.453 18933 447 1 . 1 1 104 104 ALA N N 104 122.885 122.885 128.674 -5.789 18933 448 1 . 1 1 104 104 ALA C C 104 175.754 175.754 174.918 0.836 18933 449 1 . 1 1 104 104 ALA CA C 104 50.018 50.018 49.759 0.259 18933 450 1 . 1 1 104 104 ALA CB C 104 22.485 22.485 22.546 -0.061 18933 451 1 . 1 1 104 104 ALA H H 104 8.660 8.660 9.225 -0.565 18933 452 1 . 1 1 105 105 LEU N N 105 120.881 120.881 119.552 1.329 18933 453 1 . 1 1 105 105 LEU C C 105 179.504 179.504 178.690 0.814 18933 454 1 . 1 1 105 105 LEU CA C 105 53.247 53.247 54.050 -0.803 18933 455 1 . 1 1 105 105 LEU CB C 105 41.753 41.753 43.455 -1.702 18933 456 1 . 1 1 105 105 LEU H H 105 8.226 8.226 8.344 -0.118 18933 457 1 . 1 1 106 106 ALA N N 106 124.901 124.901 124.087 0.814 18933 458 1 . 1 1 106 106 ALA C C 106 181.269 181.269 179.230 2.039 18933 459 1 . 1 1 106 106 ALA CA C 106 56.313 56.313 54.823 1.490 18933 460 1 . 1 1 106 106 ALA CB C 106 17.224 17.224 18.900 -1.676 18933 461 1 . 1 1 106 106 ALA H H 106 8.392 8.392 8.597 -0.205 18933 462 1 . 1 1 107 107 GLU N N 107 116.409 116.409 116.532 -0.123 18933 463 1 . 1 1 107 107 GLU C C 107 177.764 177.764 177.013 0.751 18933 464 1 . 1 1 107 107 GLU CA C 107 58.533 58.533 58.174 0.359 18933 465 1 . 1 1 107 107 GLU CB C 107 27.936 27.936 29.637 -1.701 18933 466 1 . 1 1 107 107 GLU H H 107 9.664 9.664 8.665 0.999 18933 467 1 . 1 1 108 108 GLU N N 108 116.189 116.189 117.534 -1.345 18933 468 1 . 1 1 108 108 GLU CA C 108 55.143 55.143 56.628 -1.485 18933 469 1 . 1 1 108 108 GLU CB C 108 29.837 29.837 29.059 0.778 18933 470 1 . 1 1 108 108 GLU H H 108 7.589 7.589 7.816 -0.227 18933 471 1 . 1 1 109 109 LYS N N 109 119.928 119.928 121.483 -1.555 18933 472 1 . 1 1 109 109 LYS CA C 109 62.851 62.851 61.141 1.710 18933 473 1 . 1 1 109 109 LYS CB C 109 30.471 30.471 30.599 -0.128 18933 474 1 . 1 1 109 109 LYS H H 109 7.514 7.514 7.588 -0.074 18933 475 1 . 1 1 111 111 TYR N N 111 114.930 114.930 119.025 -4.095 18933 476 1 . 1 1 111 111 TYR C C 111 179.504 179.504 177.751 1.753 18933 477 1 . 1 1 111 111 TYR CA C 111 59.017 59.017 61.232 -2.215 18933 478 1 . 1 1 111 111 TYR CB C 111 35.668 35.668 37.581 -1.913 18933 479 1 . 1 1 111 111 TYR H H 111 6.393 6.393 8.468 -2.075 18933 480 1 . 1 1 112 112 ALA N N 112 124.901 124.901 122.151 2.750 18933 481 1 . 1 1 112 112 ALA C C 112 179.173 179.173 179.522 -0.349 18933 482 1 . 1 1 112 112 ALA CA C 112 54.901 54.901 55.497 -0.596 18933 483 1 . 1 1 112 112 ALA CB C 112 18.112 18.112 18.258 -0.146 18933 484 1 . 1 1 112 112 ALA H H 112 8.554 8.554 8.201 0.353 18933 485 1 . 1 1 113 113 ILE N N 113 119.464 119.464 119.732 -0.268 18933 486 1 . 1 1 113 113 ILE C C 113 178.499 178.499 177.740 0.759 18933 487 1 . 1 1 113 113 ILE CA C 113 66.281 66.281 64.045 2.236 18933 488 1 . 1 1 113 113 ILE CB C 113 37.316 37.316 37.862 -0.546 18933 489 1 . 1 1 113 113 ILE H H 113 8.680 8.680 7.628 1.052 18933 490 1 . 1 1 114 114 PHE N N 114 122.922 122.922 121.971 0.951 18933 491 1 . 1 1 114 114 PHE C C 114 178.217 178.217 177.797 0.420 18933 492 1 . 1 1 114 114 PHE CA C 114 61.559 61.559 60.535 1.024 18933 493 1 . 1 1 114 114 PHE CB C 114 39.471 39.471 38.645 0.826 18933 494 1 . 1 1 114 114 PHE H H 114 7.721 7.721 8.582 -0.861 18933 495 1 . 1 1 115 115 HIS N N 115 118.560 118.560 118.578 -0.018 18933 496 1 . 1 1 115 115 HIS C C 115 177.286 177.286 176.733 0.553 18933 497 1 . 1 1 115 115 HIS CA C 115 59.380 59.380 59.445 -0.065 18933 498 1 . 1 1 115 115 HIS CB C 115 31.865 31.865 30.259 1.606 18933 499 1 . 1 1 115 115 HIS H H 115 8.155 8.155 8.388 -0.233 18933 500 1 . 1 1 116 116 PHE N N 116 111.472 111.472 116.859 -5.387 18933 501 1 . 1 1 116 116 PHE C C 116 179.026 179.026 177.410 1.616 18933 502 1 . 1 1 116 116 PHE CA C 116 59.461 59.461 59.993 -0.532 18933 503 1 . 1 1 116 116 PHE CB C 116 37.189 37.189 38.913 -1.724 18933 504 1 . 1 1 116 116 PHE H H 116 8.564 8.564 7.990 0.574 18933 505 1 . 1 1 117 117 THR N N 117 119.012 119.012 111.946 7.066 18933 506 1 . 1 1 117 117 THR C C 117 172.935 172.935 175.458 -2.523 18933 507 1 . 1 1 117 117 THR CA C 117 67.088 67.088 64.874 2.214 18933 508 1 . 1 1 117 117 THR CB C 117 37.126 37.126 69.050 -31.925 18933 509 1 . 1 1 117 117 THR H H 117 7.620 7.620 8.283 -0.663 18933 510 1 . 1 1 118 118 GLY N N 118 107.917 107.917 109.866 -1.949 18933 511 1 . 1 1 118 118 GLY CA C 118 44.167 44.167 42.294 1.874 18933 512 1 . 1 1 118 118 GLY H H 118 6.666 6.666 7.554 -0.888 18933 513 1 . 1 1 121 121 SER N N 121 113.354 113.354 118.134 -4.780 18933 514 1 . 1 1 121 121 SER C C 121 176.061 176.061 175.931 0.130 18933 515 1 . 1 1 121 121 SER CA C 121 61.035 61.035 62.079 -1.044 18933 516 1 . 1 1 121 121 SER H H 121 8.322 8.322 8.292 0.030 18933 517 1 . 1 1 122 122 TYR N N 122 124.681 124.681 121.553 3.128 18933 518 1 . 1 1 122 122 TYR C C 122 176.293 176.293 177.112 -0.818 18933 519 1 . 1 1 122 122 TYR CA C 122 59.057 59.057 60.859 -1.802 18933 520 1 . 1 1 122 122 TYR CB C 122 38.711 38.711 38.083 0.628 18933 521 1 . 1 1 122 122 TYR H H 122 6.514 6.514 8.259 -1.745 18933 522 1 . 1 1 123 123 LEU N N 123 117.997 117.997 119.835 -1.838 18933 523 1 . 1 1 123 123 LEU C C 123 179.774 179.774 178.974 0.800 18933 524 1 . 1 1 123 123 LEU CA C 123 56.878 56.878 56.744 0.134 18933 525 1 . 1 1 123 123 LEU CB C 123 39.978 39.978 40.947 -0.969 18933 526 1 . 1 1 123 123 LEU H H 123 7.428 7.428 7.337 0.091 18933 527 1 . 1 1 124 124 ILE N N 124 119.012 119.012 120.513 -1.501 18933 528 1 . 1 1 124 124 ILE C C 124 178.830 178.830 177.960 0.870 18933 529 1 . 1 1 124 124 ILE CA C 124 65.151 65.151 65.319 -0.168 18933 530 1 . 1 1 124 124 ILE CB C 124 37.063 37.063 37.285 -0.222 18933 531 1 . 1 1 124 124 ILE H H 124 8.453 8.453 8.433 0.020 18933 532 1 . 1 1 125 125 ARG N N 125 121.174 121.174 119.677 1.497 18933 533 1 . 1 1 125 125 ARG C C 125 179.762 179.762 178.791 0.971 18933 534 1 . 1 1 125 125 ARG CA C 125 59.057 59.057 58.527 0.530 18933 535 1 . 1 1 125 125 ARG CB C 125 28.950 28.950 29.380 -0.430 18933 536 1 . 1 1 125 125 ARG H H 125 7.004 7.004 8.106 -1.102 18933 537 1 . 1 1 126 126 ILE N N 126 122.299 122.299 120.683 1.616 18933 538 1 . 1 1 126 126 ILE C C 126 178.352 178.352 177.621 0.731 18933 539 1 . 1 1 126 126 ILE CA C 126 62.205 62.205 64.701 -2.496 18933 540 1 . 1 1 126 126 ILE CB C 126 35.415 35.415 37.107 -1.692 18933 541 1 . 1 1 126 126 ILE H H 126 7.579 7.579 7.931 -0.352 18933 542 1 . 1 1 127 127 ARG N N 127 119.354 119.354 120.299 -0.945 18933 543 1 . 1 1 127 127 ARG C C 127 179.786 179.786 178.772 1.014 18933 544 1 . 1 1 127 127 ARG CA C 127 59.986 59.986 59.728 0.258 18933 545 1 . 1 1 127 127 ARG CB C 127 29.330 29.330 30.092 -0.762 18933 546 1 . 1 1 127 127 ARG H H 127 8.715 8.715 8.092 0.623 18933 547 1 . 1 1 128 128 ALA N N 128 122.873 122.873 120.625 2.248 18933 548 1 . 1 1 128 128 ALA C C 128 180.325 180.325 179.360 0.965 18933 549 1 . 1 1 128 128 ALA CA C 128 54.740 54.740 54.618 0.122 18933 550 1 . 1 1 128 128 ALA CB C 128 17.161 17.161 18.251 -1.090 18933 551 1 . 1 1 128 128 ALA H H 128 7.978 7.978 8.162 -0.184 18933 552 1 . 1 1 129 129 ALA N N 129 121.846 121.846 121.807 0.039 18933 553 1 . 1 1 129 129 ALA C C 129 181.539 181.539 179.901 1.638 18933 554 1 . 1 1 129 129 ALA CA C 129 54.498 54.498 54.776 -0.278 18933 555 1 . 1 1 129 129 ALA CB C 129 17.478 17.478 18.646 -1.168 18933 556 1 . 1 1 129 129 ALA H H 129 7.519 7.519 7.966 -0.447 18933 557 1 . 1 1 130 130 LEU N N 130 119.134 119.134 118.326 0.808 18933 558 1 . 1 1 130 130 LEU C C 130 179.909 179.909 178.965 0.944 18933 559 1 . 1 1 130 130 LEU CA C 130 56.999 56.999 57.078 -0.079 18933 560 1 . 1 1 130 130 LEU CB C 130 40.422 40.422 41.719 -1.297 18933 561 1 . 1 1 130 130 LEU H H 130 8.296 8.296 8.672 -0.376 18933 562 1 . 1 1 131 131 LYS N N 131 122.299 122.299 120.294 2.005 18933 563 1 . 1 1 131 131 LYS C C 131 180.289 180.289 179.380 0.909 18933 564 1 . 1 1 131 131 LYS CA C 131 59.017 59.017 59.696 -0.679 18933 565 1 . 1 1 131 131 LYS CB C 131 31.232 31.232 32.118 -0.886 18933 566 1 . 1 1 131 131 LYS H H 131 8.281 8.281 7.865 0.416 18933 567 1 . 1 1 132 132 LYS N N 132 118.743 118.743 118.301 0.442 18933 568 1 . 1 1 132 132 LYS C C 132 177.482 177.482 177.866 -0.384 18933 569 1 . 1 1 132 132 LYS CA C 132 58.492 58.492 58.464 0.028 18933 570 1 . 1 1 132 132 LYS CB C 132 31.232 31.232 32.257 -1.025 18933 571 1 . 1 1 132 132 LYS H H 132 7.317 7.317 7.639 -0.322 18933 572 1 . 1 1 133 133 LYS N N 133 117.093 117.093 117.222 -0.129 18933 573 1 . 1 1 133 133 LYS C C 133 174.614 174.614 176.050 -1.436 18933 574 1 . 1 1 133 133 LYS CA C 133 54.780 54.780 55.876 -1.096 18933 575 1 . 1 1 133 133 LYS CB C 133 32.182 32.182 32.919 -0.737 18933 576 1 . 1 1 133 133 LYS H H 133 7.327 7.327 7.652 -0.325 18933 577 1 . 1 1 134 134 ASN N N 134 113.012 113.012 115.530 -2.518 18933 578 1 . 1 1 134 134 ASN C C 134 173.965 173.965 173.449 0.516 18933 579 1 . 1 1 134 134 ASN CA C 134 54.296 54.296 54.342 -0.046 18933 580 1 . 1 1 134 134 ASN CB C 134 36.175 36.175 37.316 -1.141 18933 581 1 . 1 1 134 134 ASN H H 134 7.938 7.938 7.930 0.008 18933 582 1 . 1 1 135 135 TYR N N 135 115.725 115.725 119.322 -3.597 18933 583 1 . 1 1 135 135 TYR C C 135 176.342 176.342 175.035 1.307 18933 584 1 . 1 1 135 135 TYR CA C 135 55.668 55.668 57.436 -1.768 18933 585 1 . 1 1 135 135 TYR CB C 135 41.563 41.563 40.125 1.438 18933 586 1 . 1 1 135 135 TYR H H 135 7.741 7.741 8.390 -0.649 18933 587 1 . 1 1 136 136 LYS N N 136 122.641 122.641 124.864 -2.223 18933 588 1 . 1 1 136 136 LYS C C 136 173.475 173.475 174.585 -1.110 18933 589 1 . 1 1 136 136 LYS CA C 136 54.901 54.901 54.617 0.284 18933 590 1 . 1 1 136 136 LYS CB C 136 34.718 34.718 36.541 -1.823 18933 591 1 . 1 1 136 136 LYS H H 136 9.296 9.296 8.829 0.467 18933 592 1 . 1 1 137 137 LEU N N 137 127.284 127.284 123.339 3.945 18933 593 1 . 1 1 137 137 LEU C C 137 175.423 175.423 176.177 -0.754 18933 594 1 . 1 1 137 137 LEU CA C 137 53.126 53.126 53.217 -0.091 18933 595 1 . 1 1 137 137 LEU CB C 137 45.746 45.746 42.180 3.566 18933 596 1 . 1 1 137 137 LEU H H 137 8.776 8.776 8.541 0.235 18933 597 1 . 1 1 138 138 ASN N N 138 125.818 125.818 119.484 6.334 18933 598 1 . 1 1 138 138 ASN C C 138 174.933 174.933 175.392 -0.459 18933 599 1 . 1 1 138 138 ASN CA C 138 52.117 52.117 52.510 -0.393 18933 600 1 . 1 1 138 138 ASN CB C 138 37.506 37.506 42.204 -4.698 18933 601 1 . 1 1 138 138 ASN H H 138 8.811 8.811 8.225 0.586 18933 602 1 . 1 1 139 139 GLN N N 139 116.861 116.861 119.338 -2.477 18933 603 1 . 1 1 139 139 GLN CA C 139 56.838 56.838 58.399 -1.561 18933 604 1 . 1 1 139 139 GLN CB C 139 25.717 25.717 28.663 -2.947 18933 605 1 . 1 1 139 139 GLN H H 139 9.220 9.220 8.895 0.325 18933 606 1 . 1 1 140 140 TYR N N 140 120.600 120.600 119.865 0.735 18933 607 1 . 1 1 140 140 TYR CA C 140 56.757 56.757 57.664 -0.907 18933 608 1 . 1 1 140 140 TYR CB C 140 37.570 37.570 37.990 -0.420 18933 609 1 . 1 1 140 140 TYR H H 140 8.549 8.549 8.141 0.408 18933 610 1 . 1 1 141 141 GLY N N 141 105.986 105.986 108.299 -2.313 18933 611 1 . 1 1 141 141 GLY CA C 141 43.844 43.844 44.458 -0.614 18933 612 1 . 1 1 141 141 GLY H H 141 7.186 7.186 7.880 -0.694 18933 613 1 . 1 1 142 142 LEU N N 142 120.038 120.038 116.941 3.097 18933 614 1 . 1 1 142 142 LEU C C 142 173.340 173.340 176.028 -2.688 18933 615 1 . 1 1 142 142 LEU CA C 142 52.520 52.520 53.326 -0.806 18933 616 1 . 1 1 142 142 LEU CB C 142 44.351 44.351 43.347 1.004 18933 617 1 . 1 1 142 142 LEU H H 142 7.539 7.539 8.335 -0.796 18933 618 1 . 1 1 143 143 PHE N N 143 124.229 124.229 119.686 4.543 18933 619 1 . 1 1 143 143 PHE C C 143 173.977 173.977 175.184 -1.207 18933 620 1 . 1 1 143 143 PHE CA C 143 52.641 52.641 55.167 -2.526 18933 621 1 . 1 1 143 143 PHE CB C 143 44.668 44.668 40.433 4.235 18933 622 1 . 1 1 143 143 PHE H H 143 9.084 9.084 8.996 0.088 18933 623 1 . 1 1 144 144 LYS N N 144 127.858 127.858 123.117 4.741 18933 624 1 . 1 1 144 144 LYS C C 144 175.092 175.092 176.738 -1.646 18933 625 1 . 1 1 144 144 LYS CA C 144 58.856 58.856 54.330 4.526 18933 626 1 . 1 1 144 144 LYS CB C 144 38.584 38.584 34.680 3.904 18933 627 1 . 1 1 144 144 LYS H H 144 9.281 9.281 8.884 0.397 18933 628 1 . 1 1 145 145 ASN N N 145 128.188 128.188 126.262 1.926 18933 629 1 . 1 1 145 145 ASN C C 145 175.779 175.779 174.846 0.933 18933 630 1 . 1 1 145 145 ASN CA C 145 57.726 57.726 54.515 3.211 18933 631 1 . 1 1 145 145 ASN CB C 145 34.654 34.654 37.734 -3.080 18933 632 1 . 1 1 145 145 ASN H H 145 9.205 9.205 9.151 0.054 18933 633 1 . 1 1 146 146 GLN N N 146 129.655 129.655 111.761 17.893 18933 634 1 . 1 1 146 146 GLN C C 146 175.399 175.399 174.432 0.967 18933 635 1 . 1 1 146 146 GLN CA C 146 58.815 58.815 57.242 1.573 18933 636 1 . 1 1 146 146 GLN CB C 146 32.626 32.626 27.984 4.642 18933 637 1 . 1 1 146 146 GLN H H 146 8.983 8.983 8.743 0.240 18933 638 1 . 1 1 147 147 THR N N 147 117.936 117.936 115.708 2.228 18933 639 1 . 1 1 147 147 THR C C 147 173.254 173.254 173.403 -0.149 18933 640 1 . 1 1 147 147 THR CA C 147 61.721 61.721 61.633 0.088 18933 641 1 . 1 1 147 147 THR CB C 147 70.274 70.274 69.616 0.658 18933 642 1 . 1 1 147 147 THR H H 147 8.029 8.029 7.835 0.194 18933 643 1 . 1 1 148 148 LEU N N 148 130.681 130.681 131.150 -0.469 18933 644 1 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.395 0.071 18933 645 1 . 1 1 148 148 LEU CB C 148 41.689 41.689 42.756 -1.067 18933 646 1 . 1 1 148 148 LEU H H 148 8.635 8.635 8.893 -0.259 18933 647 1 . 1 1 149 149 VAL N N 149 130.803 130.803 127.036 3.767 18933 648 1 . 1 1 149 149 VAL CA C 149 59.178 59.178 58.164 1.014 18933 649 1 . 1 1 149 149 VAL CB C 149 31.675 31.675 34.700 -3.026 18933 650 1 . 1 1 149 149 VAL H H 149 8.968 8.968 9.270 -0.302 18933 651 1 . 1 1 151 151 LEU N N 151 124.290 124.290 120.112 4.178 18933 652 1 . 1 1 151 151 LEU CA C 151 54.013 54.013 55.573 -1.560 18933 653 1 . 1 1 151 151 LEU CB C 151 44.098 44.098 40.324 3.774 18933 654 1 . 1 1 151 151 LEU H H 151 7.872 7.872 8.279 -0.407 18933 655 1 . 1 1 153 153 ILE N N 153 114.943 114.943 115.936 -0.993 18933 656 1 . 1 1 153 153 ILE C C 153 175.877 175.877 175.012 0.865 18933 657 1 . 1 1 153 153 ILE CA C 153 58.694 58.694 58.794 -0.100 18933 658 1 . 1 1 153 153 ILE CB C 153 41.689 41.689 40.242 1.447 18933 659 1 . 1 1 153 153 ILE H H 153 7.125 7.125 7.633 -0.508 18933 660 1 . 1 1 154 154 THR N N 154 111.766 111.766 111.828 -0.062 18933 661 1 . 1 1 154 154 THR C C 154 174.945 174.945 174.288 0.657 18933 662 1 . 1 1 154 154 THR CA C 154 62.124 62.124 62.766 -0.643 18933 663 1 . 1 1 154 154 THR CB C 154 70.718 70.718 69.654 1.064 18933 664 1 . 1 1 154 154 THR H H 154 9.286 9.286 8.368 0.918 18933 665 1 . 1 1 155 155 THR N N 155 111.766 111.766 112.916 -1.150 18933 666 1 . 1 1 155 155 THR CA C 155 58.936 58.936 59.856 -0.920 18933 667 1 . 1 1 155 155 THR CB C 155 72.683 72.683 71.755 0.928 18933 668 1 . 1 1 155 155 THR H H 155 7.645 7.645 7.413 0.232 18933 669 1 . 1 1 157 157 LYS N N 157 119.464 119.464 118.939 0.525 18933 670 1 . 1 1 157 157 LYS C C 157 178.781 178.781 178.528 0.253 18933 671 1 . 1 1 157 157 LYS CA C 157 60.026 60.026 59.957 0.069 18933 672 1 . 1 1 157 157 LYS CB C 157 31.422 31.422 31.765 -0.343 18933 673 1 . 1 1 157 157 LYS H H 157 8.175 8.175 8.306 -0.131 18933 674 1 . 1 1 158 158 GLU N N 158 118.340 118.340 118.009 0.331 18933 675 1 . 1 1 158 158 GLU C C 158 178.867 178.867 178.998 -0.131 18933 676 1 . 1 1 158 158 GLU CA C 158 58.492 58.492 59.007 -0.515 18933 677 1 . 1 1 158 158 GLU CB C 158 29.330 29.330 28.772 0.558 18933 678 1 . 1 1 158 158 GLU H H 158 7.519 7.519 8.259 -0.740 18933 679 1 . 1 1 159 159 LEU N N 159 120.710 120.710 121.539 -0.829 18933 680 1 . 1 1 159 159 LEU C C 159 176.526 176.526 178.353 -1.827 18933 681 1 . 1 1 159 159 LEU CA C 159 58.170 58.170 58.260 -0.091 18933 682 1 . 1 1 159 159 LEU CB C 159 39.915 39.915 41.647 -1.732 18933 683 1 . 1 1 159 159 LEU H H 159 7.524 7.524 7.902 -0.378 18933 684 1 . 1 1 160 160 ILE N N 160 118.217 118.217 118.698 -0.481 18933 685 1 . 1 1 160 160 ILE C C 160 177.213 177.213 178.002 -0.789 18933 686 1 . 1 1 160 160 ILE CA C 160 65.030 65.030 65.541 -0.511 18933 687 1 . 1 1 160 160 ILE CB C 160 37.506 37.506 37.270 0.236 18933 688 1 . 1 1 160 160 ILE H H 160 7.741 7.741 8.024 -0.283 18933 689 1 . 1 1 161 161 LYS N N 161 118.450 118.450 120.029 -1.579 18933 690 1 . 1 1 161 161 LYS C C 161 180.999 180.999 179.698 1.301 18933 691 1 . 1 1 161 161 LYS CA C 161 58.815 58.815 59.485 -0.670 18933 692 1 . 1 1 161 161 LYS CB C 161 30.978 30.978 32.198 -1.220 18933 693 1 . 1 1 161 161 LYS H H 161 7.382 7.382 8.021 -0.639 18933 694 1 . 1 1 162 162 GLU N N 162 121.846 121.846 120.653 1.193 18933 695 1 . 1 1 162 162 GLU C C 162 178.818 178.818 178.408 0.410 18933 696 1 . 1 1 162 162 GLU CA C 162 58.049 58.049 58.648 -0.599 18933 697 1 . 1 1 162 162 GLU CB C 162 27.936 27.936 29.358 -1.423 18933 698 1 . 1 1 162 162 GLU H H 162 8.210 8.210 7.852 0.358 18933 699 1 . 1 1 163 163 LEU N N 163 116.751 116.751 114.663 2.088 18933 700 1 . 1 1 163 163 LEU C C 163 176.784 176.784 177.264 -0.480 18933 701 1 . 1 1 163 163 LEU CA C 163 55.022 55.022 55.080 -0.058 18933 702 1 . 1 1 163 163 LEU CB C 163 41.309 41.309 41.731 -0.422 18933 703 1 . 1 1 163 163 LEU H H 163 7.796 7.796 7.473 0.323 18933 704 1 . 1 1 164 164 GLY N N 164 104.849 104.849 105.850 -1.001 18933 705 1 . 1 1 164 164 GLY C C 164 174.492 174.492 174.077 0.415 18933 706 1 . 1 1 164 164 GLY CA C 164 44.732 44.732 45.429 -0.697 18933 707 1 . 1 1 164 164 GLY H H 164 7.589 7.589 7.520 0.069 18933 708 1 . 1 1 165 165 PHE N N 165 118.902 118.902 119.144 -0.242 18933 709 1 . 1 1 165 165 PHE CA C 165 55.668 55.668 56.403 -0.735 18933 710 1 . 1 1 165 165 PHE CB C 165 40.485 40.485 42.370 -1.885 18933 711 1 . 1 1 165 165 PHE H H 165 7.251 7.251 7.872 -0.621 18933 712 1 . 1 1 166 166 THR N N 166 117.093 117.093 116.302 0.791 18933 713 1 . 1 1 166 166 THR CA C 166 62.245 62.245 60.993 1.252 18933 714 1 . 1 1 166 166 THR CB C 166 69.323 69.323 69.378 -0.055 18933 715 1 . 1 1 166 166 THR H H 166 8.407 8.407 8.288 0.119 18933 716 1 . 1 1 168 168 ARG N N 168 127.431 127.431 121.222 6.209 18933 717 1 . 1 1 168 168 ARG CA C 168 52.238 52.238 54.437 -2.199 18933 718 1 . 1 1 168 168 ARG CB C 168 31.992 31.992 33.144 -1.152 18933 719 1 . 1 1 168 168 ARG H H 168 7.160 7.160 8.448 -1.288 18933 720 1 . 1 1 171 171 LYS N N 171 113.574 113.574 116.528 -2.954 18933 721 1 . 1 1 171 171 LYS C C 171 176.416 176.416 177.519 -1.103 18933 722 1 . 1 1 171 171 LYS CA C 171 57.605 57.605 58.101 -0.496 18933 723 1 . 1 1 171 171 LYS CB C 171 31.929 31.929 31.329 0.600 18933 724 1 . 1 1 171 171 LYS H H 171 8.210 8.210 8.288 -0.078 18933 725 1 . 1 1 172 172 LYS N N 172 117.313 117.313 118.279 -0.966 18933 726 1 . 1 1 172 172 LYS C C 172 175.717 175.717 176.342 -0.625 18933 727 1 . 1 1 172 172 LYS CA C 172 54.175 54.175 56.381 -2.206 18933 728 1 . 1 1 172 172 LYS CB C 172 31.612 31.612 32.865 -1.253 18933 729 1 . 1 1 172 172 LYS H H 172 7.761 7.761 7.584 0.177 18933 730 1 . 1 1 173 173 ARG N N 173 122.056 122.056 118.112 3.944 18933 731 1 . 1 1 173 173 ARG C C 173 172.850 172.850 175.039 -2.189 18933 732 1 . 1 1 173 173 ARG CA C 173 56.878 56.878 56.533 0.345 18933 733 1 . 1 1 173 173 ARG CB C 173 28.506 28.506 28.265 0.241 18933 734 1 . 1 1 173 173 ARG H H 173 6.885 6.885 7.565 -0.680 18933 stop_ save_