NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype |
|
|
617152 |
5x39   |
36055 | cing | 3-converted-DOCR | XPLOR/CNS | coordinate | ensemble |
ATOM 1 C THR A 1 -3.052 -9.234 -1.899 1.00 0.00 A ATOM 2 CA THR A 1 -3.982 -10.063 -2.756 1.00 0.00 A ATOM 3 CB THR A 1 -5.192 -10.546 -1.943 1.00 0.00 A ATOM 4 CG2 THR A 1 -6.360 -10.893 -2.858 1.00 0.00 A ATOM 5 HT1 THR A 1 -3.897 -11.769 -3.911 1.00 0.00 A ATOM 6 HT2 THR A 1 -2.988 -11.786 -2.480 1.00 0.00 A ATOM 7 HT3 THR A 1 -2.435 -10.907 -3.810 1.00 0.00 A ATOM 8 HA THR A 1 -4.333 -9.433 -3.557 1.00 0.00 A ATOM 9 HB THR A 1 -5.489 -9.760 -1.263 1.00 0.00 A ATOM 10 HG1 THR A 1 -4.580 -11.454 -0.286 1.00 0.00 A ATOM 11 HG21 THR A 1 -6.651 -10.016 -3.417 1.00 0.00 A ATOM 12 HG22 THR A 1 -7.194 -11.234 -2.263 1.00 0.00 A ATOM 13 HG23 THR A 1 -6.059 -11.673 -3.542 1.00 0.00 A ATOM 14 N THR A 1 -3.282 -11.207 -3.292 1.00 0.00 A ATOM 15 O THR A 1 -1.969 -9.685 -1.546 1.00 0.00 A ATOM 16 OG1 THR A 1 -4.813 -11.707 -1.188 1.00 0.00 A ATOM 17 C ALA A 2 -2.883 -7.583 0.676 1.00 0.00 A ATOM 18 CA ALA A 2 -2.657 -7.173 -0.767 1.00 0.00 A ATOM 19 CB ALA A 2 -2.961 -5.704 -0.997 1.00 0.00 A ATOM 20 HN ALA A 2 -4.255 -7.665 -2.039 1.00 0.00 A ATOM 21 HA ALA A 2 -1.618 -7.355 -1.003 1.00 0.00 A ATOM 22 HB1 ALA A 2 -3.982 -5.478 -0.731 1.00 0.00 A ATOM 23 HB2 ALA A 2 -2.800 -5.476 -2.041 1.00 0.00 A ATOM 24 HB3 ALA A 2 -2.291 -5.105 -0.399 1.00 0.00 A ATOM 25 N ALA A 2 -3.431 -8.012 -1.628 1.00 0.00 A ATOM 26 O ALA A 2 -3.930 -8.163 1.027 1.00 0.00 A ATOM 27 C SER A 3 -2.213 -6.568 3.787 1.00 0.00 A ATOM 28 CA SER A 3 -1.901 -7.727 2.851 1.00 0.00 A ATOM 29 CB SER A 3 -0.515 -8.306 3.113 1.00 0.00 A ATOM 30 HN SER A 3 -1.165 -6.776 1.168 1.00 0.00 A ATOM 31 HA SER A 3 -2.630 -8.515 2.978 1.00 0.00 A ATOM 32 HB2 SER A 3 -0.332 -8.312 4.178 1.00 0.00 A ATOM 33 HB1 SER A 3 -0.433 -9.309 2.725 1.00 0.00 A ATOM 34 N SER A 3 -1.927 -7.308 1.479 1.00 0.00 A ATOM 35 O SER A 3 -1.969 -5.398 3.457 1.00 0.00 A ATOM 36 OG SER A 3 0.484 -7.466 2.463 1.00 0.00 A ATOM 37 C HIS A 4 -1.854 -5.295 6.504 1.00 0.00 A ATOM 38 CA HIS A 4 -3.124 -5.908 5.933 1.00 0.00 A ATOM 39 CB HIS A 4 -3.941 -6.588 7.039 1.00 0.00 A ATOM 40 CD2 HIS A 4 -5.271 -4.469 7.749 1.00 0.00 A ATOM 41 CE1 HIS A 4 -5.637 -5.019 9.826 1.00 0.00 A ATOM 42 CG HIS A 4 -4.663 -5.658 7.972 1.00 0.00 A ATOM 43 HN HIS A 4 -2.865 -7.842 5.160 1.00 0.00 A ATOM 44 HA HIS A 4 -3.720 -5.143 5.458 1.00 0.00 A ATOM 45 HB2 HIS A 4 -4.676 -7.241 6.596 1.00 0.00 A ATOM 46 HB1 HIS A 4 -3.267 -7.188 7.633 1.00 0.00 A ATOM 47 HD1 HIS A 4 -4.594 -6.767 9.761 1.00 0.00 A ATOM 48 HD2 HIS A 4 -5.275 -3.914 6.822 1.00 0.00 A ATOM 49 HE1 HIS A 4 -5.984 -4.995 10.848 1.00 0.00 A ATOM 50 HE2 HIS A 4 -6.368 -3.271 9.075 1.00 0.00 A ATOM 51 N HIS A 4 -2.746 -6.892 4.942 1.00 0.00 A ATOM 52 ND1 HIS A 4 -4.909 -5.963 9.283 1.00 0.00 A ATOM 53 NE2 HIS A 4 -5.867 -4.103 8.917 1.00 0.00 A ATOM 54 O HIS A 4 -0.974 -6.019 6.953 1.00 0.00 A ATOM 55 C TYR A 5 0.559 -3.273 5.873 1.00 0.00 A ATOM 56 CA TYR A 5 -0.589 -3.193 6.852 1.00 0.00 A ATOM 57 CB TYR A 5 -0.132 -3.503 8.287 1.00 0.00 A ATOM 58 CD1 TYR A 5 -2.049 -3.843 9.873 1.00 0.00 A ATOM 59 CD2 TYR A 5 -0.994 -1.718 9.823 1.00 0.00 A ATOM 60 CE1 TYR A 5 -2.909 -3.392 10.846 1.00 0.00 A ATOM 61 CE2 TYR A 5 -1.855 -1.261 10.795 1.00 0.00 A ATOM 62 CG TYR A 5 -1.078 -3.017 9.347 1.00 0.00 A ATOM 63 CZ TYR A 5 -2.810 -2.103 11.303 1.00 0.00 A ATOM 64 HN TYR A 5 -2.488 -3.483 5.968 1.00 0.00 A ATOM 65 HA TYR A 5 -0.928 -2.167 6.814 1.00 0.00 A ATOM 66 HB2 TYR A 5 -0.043 -4.574 8.398 1.00 0.00 A ATOM 67 HB1 TYR A 5 0.831 -3.046 8.459 1.00 0.00 A ATOM 68 HD1 TYR A 5 -2.132 -4.858 9.512 1.00 0.00 A ATOM 69 HD2 TYR A 5 -0.241 -1.058 9.418 1.00 0.00 A ATOM 70 HE1 TYR A 5 -3.663 -4.054 11.243 1.00 0.00 A ATOM 71 HE2 TYR A 5 -1.775 -0.245 11.150 1.00 0.00 A ATOM 72 HH TYR A 5 -4.008 -0.793 11.997 1.00 0.00 A ATOM 73 N TYR A 5 -1.752 -3.978 6.404 1.00 0.00 A ATOM 74 O TYR A 5 1.642 -2.751 6.129 1.00 0.00 A ATOM 75 OH TYR A 5 -3.676 -1.656 12.282 1.00 0.00 A ATOM 76 C GLY A 6 0.917 -2.964 2.634 1.00 0.00 A ATOM 77 CA GLY A 6 1.274 -3.947 3.711 1.00 0.00 A ATOM 78 HN GLY A 6 -0.573 -4.297 4.599 1.00 0.00 A ATOM 79 HA2 GLY A 6 2.249 -3.713 4.113 1.00 0.00 A ATOM 80 HA1 GLY A 6 1.280 -4.940 3.289 1.00 0.00 A ATOM 81 N GLY A 6 0.304 -3.884 4.750 1.00 0.00 A ATOM 82 O GLY A 6 -0.212 -2.422 2.635 1.00 0.00 A ATOM 83 C GLN A 7 0.611 -2.412 -0.328 1.00 0.00 A ATOM 84 CA GLN A 7 1.602 -1.793 0.643 1.00 0.00 A ATOM 85 CB GLN A 7 2.920 -1.454 -0.052 1.00 0.00 A ATOM 86 CD GLN A 7 4.214 -0.041 -1.686 1.00 0.00 A ATOM 87 CG GLN A 7 2.835 -0.395 -1.146 1.00 0.00 A ATOM 88 HN GLN A 7 2.704 -3.169 1.790 1.00 0.00 A ATOM 89 HA GLN A 7 1.172 -0.891 1.055 1.00 0.00 A ATOM 90 HB2 GLN A 7 3.625 -1.103 0.686 1.00 0.00 A ATOM 91 HB1 GLN A 7 3.299 -2.361 -0.505 1.00 0.00 A ATOM 92 HE21 GLN A 7 3.673 1.840 -2.153 1.00 0.00 A ATOM 93 HE22 GLN A 7 5.278 1.386 -2.506 1.00 0.00 A ATOM 94 HG2 GLN A 7 2.235 -0.788 -1.954 1.00 0.00 A ATOM 95 HG1 GLN A 7 2.368 0.496 -0.752 1.00 0.00 A ATOM 96 N GLN A 7 1.836 -2.713 1.734 1.00 0.00 A ATOM 97 NE2 GLN A 7 4.388 1.170 -2.149 1.00 0.00 A ATOM 98 O GLN A 7 0.775 -3.549 -0.740 1.00 0.00 A ATOM 99 OE1 GLN A 7 5.124 -0.868 -1.680 1.00 0.00 A ATOM 100 C CYS A 8 -1.346 -1.593 -2.913 1.00 0.00 A ATOM 101 CA CYS A 8 -1.449 -2.185 -1.530 1.00 0.00 A ATOM 102 CB CYS A 8 -2.827 -1.913 -0.963 1.00 0.00 A ATOM 103 HN CYS A 8 -0.513 -0.800 -0.223 1.00 0.00 A ATOM 104 HA CYS A 8 -1.329 -3.255 -1.608 1.00 0.00 A ATOM 105 HB2 CYS A 8 -3.560 -2.222 -1.695 1.00 0.00 A ATOM 106 HB1 CYS A 8 -2.951 -2.492 -0.062 1.00 0.00 A ATOM 107 N CYS A 8 -0.426 -1.686 -0.638 1.00 0.00 A ATOM 108 O CYS A 8 -1.528 -2.280 -3.883 1.00 0.00 A ATOM 109 SG CYS A 8 -3.129 -0.153 -0.561 1.00 0.00 A ATOM 110 C GLY A 9 -0.430 1.631 -4.345 1.00 0.00 A ATOM 111 CA GLY A 9 -1.040 0.278 -4.313 1.00 0.00 A ATOM 112 HN GLY A 9 -0.810 0.196 -2.217 1.00 0.00 A ATOM 113 HA2 GLY A 9 -0.515 -0.355 -5.010 1.00 0.00 A ATOM 114 HA1 GLY A 9 -2.071 0.363 -4.619 1.00 0.00 A ATOM 115 N GLY A 9 -1.032 -0.324 -3.014 1.00 0.00 A ATOM 116 O GLY A 9 -1.133 2.634 -4.375 1.00 0.00 A ATOM 117 C GLY A 10 2.166 3.040 -5.768 1.00 0.00 A ATOM 118 CA GLY A 10 1.548 2.919 -4.408 1.00 0.00 A ATOM 119 HN GLY A 10 1.364 0.837 -4.237 1.00 0.00 A ATOM 120 HA2 GLY A 10 0.849 3.729 -4.252 1.00 0.00 A ATOM 121 HA1 GLY A 10 2.330 2.967 -3.664 1.00 0.00 A ATOM 122 N GLY A 10 0.860 1.672 -4.303 1.00 0.00 A ATOM 123 O GLY A 10 2.172 2.056 -6.531 1.00 0.00 A ATOM 124 C ILE A 11 4.617 3.617 -7.396 1.00 0.00 A ATOM 125 CA ILE A 11 3.320 4.417 -7.371 1.00 0.00 A ATOM 126 CB ILE A 11 3.633 5.916 -7.612 1.00 0.00 A ATOM 127 CD1 ILE A 11 2.574 8.241 -7.570 1.00 0.00 A ATOM 128 CG1 ILE A 11 2.349 6.749 -7.500 1.00 0.00 A ATOM 129 CG2 ILE A 11 4.268 6.108 -8.993 1.00 0.00 A ATOM 130 HN ILE A 11 2.562 4.964 -5.482 1.00 0.00 A ATOM 131 HA ILE A 11 2.667 4.058 -8.152 1.00 0.00 A ATOM 132 HB ILE A 11 4.336 6.250 -6.863 1.00 0.00 A ATOM 133 HD11 ILE A 11 1.628 8.754 -7.484 1.00 0.00 A ATOM 134 HD12 ILE A 11 3.037 8.490 -8.513 1.00 0.00 A ATOM 135 HD13 ILE A 11 3.223 8.543 -6.760 1.00 0.00 A ATOM 136 HG12 ILE A 11 1.684 6.484 -8.308 1.00 0.00 A ATOM 137 HG11 ILE A 11 1.867 6.527 -6.559 1.00 0.00 A ATOM 138 HG21 ILE A 11 3.581 5.772 -9.755 1.00 0.00 A ATOM 139 HG22 ILE A 11 5.176 5.526 -9.056 1.00 0.00 A ATOM 140 HG23 ILE A 11 4.494 7.152 -9.146 1.00 0.00 A ATOM 141 N ILE A 11 2.657 4.207 -6.098 1.00 0.00 A ATOM 142 O ILE A 11 5.495 3.816 -6.548 1.00 0.00 A ATOM 143 C GLY A 12 5.595 0.474 -7.957 1.00 0.00 A ATOM 144 CA GLY A 12 5.884 1.870 -8.435 1.00 0.00 A ATOM 145 HN GLY A 12 3.988 2.603 -8.982 1.00 0.00 A ATOM 146 HA2 GLY A 12 6.207 1.833 -9.465 1.00 0.00 A ATOM 147 HA1 GLY A 12 6.673 2.289 -7.828 1.00 0.00 A ATOM 148 N GLY A 12 4.718 2.707 -8.332 1.00 0.00 A ATOM 149 O GLY A 12 6.326 -0.470 -8.265 1.00 0.00 A ATOM 150 C TYR A 13 3.351 -1.701 -7.771 1.00 0.00 A ATOM 151 CA TYR A 13 4.145 -0.960 -6.712 1.00 0.00 A ATOM 152 CB TYR A 13 3.352 -0.804 -5.406 1.00 0.00 A ATOM 153 CD1 TYR A 13 3.918 -2.859 -4.050 1.00 0.00 A ATOM 154 CD2 TYR A 13 1.663 -2.554 -4.727 1.00 0.00 A ATOM 155 CE1 TYR A 13 3.574 -4.026 -3.404 1.00 0.00 A ATOM 156 CE2 TYR A 13 1.311 -3.723 -4.088 1.00 0.00 A ATOM 157 CG TYR A 13 2.970 -2.104 -4.723 1.00 0.00 A ATOM 158 CZ TYR A 13 2.268 -4.455 -3.428 1.00 0.00 A ATOM 159 HN TYR A 13 3.954 1.109 -7.046 1.00 0.00 A ATOM 160 HA TYR A 13 5.051 -1.512 -6.517 1.00 0.00 A ATOM 161 HB2 TYR A 13 3.948 -0.239 -4.705 1.00 0.00 A ATOM 162 HB1 TYR A 13 2.445 -0.252 -5.608 1.00 0.00 A ATOM 163 HD1 TYR A 13 4.942 -2.520 -4.035 1.00 0.00 A ATOM 164 HD2 TYR A 13 0.911 -1.979 -5.248 1.00 0.00 A ATOM 165 HE1 TYR A 13 4.329 -4.599 -2.885 1.00 0.00 A ATOM 166 HE2 TYR A 13 0.285 -4.058 -4.107 1.00 0.00 A ATOM 167 HH TYR A 13 1.135 -5.958 -3.225 1.00 0.00 A ATOM 168 N TYR A 13 4.516 0.325 -7.226 1.00 0.00 A ATOM 169 O TYR A 13 2.199 -1.370 -8.054 1.00 0.00 A ATOM 170 OH TYR A 13 1.911 -5.609 -2.773 1.00 0.00 A ATOM 171 C SER A 14 2.786 -4.754 -8.867 1.00 0.00 A ATOM 172 CA SER A 14 3.413 -3.470 -9.420 1.00 0.00 A ATOM 173 CB SER A 14 4.527 -3.778 -10.407 1.00 0.00 A ATOM 174 HN SER A 14 4.922 -2.882 -8.147 1.00 0.00 A ATOM 175 HA SER A 14 2.661 -2.886 -9.928 1.00 0.00 A ATOM 176 HB2 SER A 14 4.242 -4.622 -11.018 1.00 0.00 A ATOM 177 HB1 SER A 14 4.708 -2.915 -11.030 1.00 0.00 A ATOM 178 HG SER A 14 6.478 -3.984 -10.292 1.00 0.00 A ATOM 179 N SER A 14 3.988 -2.672 -8.366 1.00 0.00 A ATOM 180 O SER A 14 2.294 -5.608 -9.629 1.00 0.00 A ATOM 181 OG SER A 14 5.728 -4.097 -9.696 1.00 0.00 A ATOM 182 C GLY A 15 0.754 -6.052 -6.847 1.00 0.00 A ATOM 183 CA GLY A 15 2.260 -6.033 -6.887 1.00 0.00 A ATOM 184 HN GLY A 15 3.132 -4.120 -7.021 1.00 0.00 A ATOM 185 HA2 GLY A 15 2.600 -6.929 -7.383 1.00 0.00 A ATOM 186 HA1 GLY A 15 2.593 -6.053 -5.856 1.00 0.00 A ATOM 187 N GLY A 15 2.783 -4.866 -7.546 1.00 0.00 A ATOM 188 O GLY A 15 0.087 -5.240 -7.517 1.00 0.00 A ATOM 189 C PRO A 16 -1.839 -5.832 -5.268 1.00 0.00 A ATOM 190 CA PRO A 16 -1.244 -7.100 -5.876 1.00 0.00 A ATOM 191 CB PRO A 16 -1.353 -8.257 -4.878 1.00 0.00 A ATOM 192 CD PRO A 16 0.926 -8.027 -5.356 1.00 0.00 A ATOM 193 CG PRO A 16 -0.002 -8.324 -4.258 1.00 0.00 A ATOM 194 HA PRO A 16 -1.748 -7.357 -6.794 1.00 0.00 A ATOM 195 HB2 PRO A 16 -2.118 -8.038 -4.147 1.00 0.00 A ATOM 196 HB1 PRO A 16 -1.594 -9.172 -5.399 1.00 0.00 A ATOM 197 HD2 PRO A 16 1.866 -7.672 -4.962 1.00 0.00 A ATOM 198 HD1 PRO A 16 1.074 -8.895 -5.979 1.00 0.00 A ATOM 199 HG2 PRO A 16 0.111 -7.532 -3.533 1.00 0.00 A ATOM 200 HG1 PRO A 16 0.211 -9.294 -3.836 1.00 0.00 A ATOM 201 N PRO A 16 0.197 -6.979 -6.080 1.00 0.00 A ATOM 202 O PRO A 16 -1.515 -5.460 -4.133 1.00 0.00 A ATOM 203 C THR A 17 -4.659 -4.209 -4.968 1.00 0.00 A ATOM 204 CA THR A 17 -3.295 -3.952 -5.593 1.00 0.00 A ATOM 205 CB THR A 17 -3.409 -2.976 -6.772 1.00 0.00 A ATOM 206 CG2 THR A 17 -2.092 -2.251 -7.020 1.00 0.00 A ATOM 207 HN THR A 17 -2.895 -5.498 -6.921 1.00 0.00 A ATOM 208 HA THR A 17 -2.664 -3.500 -4.841 1.00 0.00 A ATOM 209 HB THR A 17 -4.179 -2.255 -6.543 1.00 0.00 A ATOM 210 HG1 THR A 17 -4.435 -3.162 -8.433 1.00 0.00 A ATOM 211 HG21 THR A 17 -2.201 -1.585 -7.864 1.00 0.00 A ATOM 212 HG22 THR A 17 -1.314 -2.971 -7.221 1.00 0.00 A ATOM 213 HG23 THR A 17 -1.830 -1.678 -6.143 1.00 0.00 A ATOM 214 N THR A 17 -2.673 -5.174 -6.023 1.00 0.00 A ATOM 215 O THR A 17 -5.210 -3.354 -4.264 1.00 0.00 A ATOM 216 OG1 THR A 17 -3.795 -3.706 -7.957 1.00 0.00 A ATOM 217 C VAL A 18 -6.257 -6.416 -3.316 1.00 0.00 A ATOM 218 CA VAL A 18 -6.478 -5.759 -4.673 1.00 0.00 A ATOM 219 CB VAL A 18 -7.252 -6.721 -5.614 1.00 0.00 A ATOM 220 CG1 VAL A 18 -8.610 -7.074 -5.028 1.00 0.00 A ATOM 221 CG2 VAL A 18 -7.420 -6.102 -6.996 1.00 0.00 A ATOM 222 HN VAL A 18 -4.715 -6.012 -5.798 1.00 0.00 A ATOM 223 HA VAL A 18 -7.055 -4.856 -4.536 1.00 0.00 A ATOM 224 HB VAL A 18 -6.679 -7.631 -5.716 1.00 0.00 A ATOM 225 HG11 VAL A 18 -8.467 -7.554 -4.071 1.00 0.00 A ATOM 226 HG12 VAL A 18 -9.134 -7.742 -5.695 1.00 0.00 A ATOM 227 HG13 VAL A 18 -9.188 -6.172 -4.893 1.00 0.00 A ATOM 228 HG21 VAL A 18 -6.448 -5.898 -7.418 1.00 0.00 A ATOM 229 HG22 VAL A 18 -7.979 -5.182 -6.912 1.00 0.00 A ATOM 230 HG23 VAL A 18 -7.954 -6.790 -7.634 1.00 0.00 A ATOM 231 N VAL A 18 -5.201 -5.381 -5.223 1.00 0.00 A ATOM 232 O VAL A 18 -5.539 -7.411 -3.207 1.00 0.00 A ATOM 233 C CYS A 19 -7.457 -7.605 -0.658 1.00 0.00 A ATOM 234 CA CYS A 19 -6.694 -6.320 -0.940 1.00 0.00 A ATOM 235 CB CYS A 19 -7.114 -5.248 0.054 1.00 0.00 A ATOM 236 HN CYS A 19 -7.389 -5.049 -2.457 1.00 0.00 A ATOM 237 HA CYS A 19 -5.647 -6.519 -0.772 1.00 0.00 A ATOM 238 HB2 CYS A 19 -8.074 -4.839 -0.222 1.00 0.00 A ATOM 239 HB1 CYS A 19 -7.188 -5.698 1.034 1.00 0.00 A ATOM 240 N CYS A 19 -6.834 -5.842 -2.300 1.00 0.00 A ATOM 241 O CYS A 19 -8.295 -8.063 -1.460 1.00 0.00 A ATOM 242 SG CYS A 19 -5.959 -3.867 0.217 1.00 0.00 A ATOM 243 C ALA A 20 -9.138 -8.962 1.560 1.00 0.00 A ATOM 244 CA ALA A 20 -7.785 -9.363 0.973 1.00 0.00 A ATOM 245 CB ALA A 20 -6.898 -10.008 2.038 1.00 0.00 A ATOM 246 HN ALA A 20 -6.441 -7.788 1.042 1.00 0.00 A ATOM 247 HA ALA A 20 -7.923 -10.058 0.158 1.00 0.00 A ATOM 248 HB1 ALA A 20 -5.946 -10.279 1.604 1.00 0.00 A ATOM 249 HB2 ALA A 20 -7.376 -10.888 2.439 1.00 0.00 A ATOM 250 HB3 ALA A 20 -6.722 -9.301 2.837 1.00 0.00 A ATOM 251 N ALA A 20 -7.139 -8.184 0.478 1.00 0.00 A ATOM 252 O ALA A 20 -9.386 -7.765 1.804 1.00 0.00 A ATOM 253 C SER A 21 -11.190 -9.093 3.741 1.00 0.00 A ATOM 254 CA SER A 21 -11.302 -9.652 2.322 1.00 0.00 A ATOM 255 CB SER A 21 -12.107 -10.932 2.315 1.00 0.00 A ATOM 256 HN SER A 21 -9.761 -10.853 1.590 1.00 0.00 A ATOM 257 HA SER A 21 -11.789 -8.927 1.688 1.00 0.00 A ATOM 258 HB2 SER A 21 -11.705 -11.604 3.057 1.00 0.00 A ATOM 259 HB1 SER A 21 -13.139 -10.716 2.547 1.00 0.00 A ATOM 260 HG SER A 21 -12.050 -12.497 1.157 1.00 0.00 A ATOM 261 N SER A 21 -9.993 -9.920 1.784 1.00 0.00 A ATOM 262 O SER A 21 -10.535 -9.691 4.605 1.00 0.00 A ATOM 263 OG SER A 21 -12.045 -11.541 1.029 1.00 0.00 A ATOM 264 C GLY A 22 -10.757 -6.212 5.350 1.00 0.00 A ATOM 265 CA GLY A 22 -11.759 -7.330 5.248 1.00 0.00 A ATOM 266 HN GLY A 22 -12.213 -7.477 3.204 1.00 0.00 A ATOM 267 HA2 GLY A 22 -12.743 -6.944 5.466 1.00 0.00 A ATOM 268 HA1 GLY A 22 -11.511 -8.086 5.976 1.00 0.00 A ATOM 269 N GLY A 22 -11.769 -7.935 3.950 1.00 0.00 A ATOM 270 O GLY A 22 -10.631 -5.579 6.407 1.00 0.00 A ATOM 271 C THR A 23 -9.261 -3.972 3.081 1.00 0.00 A ATOM 272 CA THR A 23 -9.041 -4.921 4.262 1.00 0.00 A ATOM 273 CB THR A 23 -7.609 -5.543 4.237 1.00 0.00 A ATOM 274 CG2 THR A 23 -7.321 -6.295 5.522 1.00 0.00 A ATOM 275 HN THR A 23 -10.227 -6.447 3.442 1.00 0.00 A ATOM 276 HA THR A 23 -9.157 -4.356 5.175 1.00 0.00 A ATOM 277 HB THR A 23 -6.880 -4.753 4.126 1.00 0.00 A ATOM 278 HG1 THR A 23 -8.329 -6.689 2.779 1.00 0.00 A ATOM 279 HG21 THR A 23 -6.336 -6.730 5.464 1.00 0.00 A ATOM 280 HG22 THR A 23 -8.055 -7.077 5.653 1.00 0.00 A ATOM 281 HG23 THR A 23 -7.365 -5.614 6.360 1.00 0.00 A ATOM 282 N THR A 23 -10.052 -5.952 4.272 1.00 0.00 A ATOM 283 O THR A 23 -9.825 -4.379 2.054 1.00 0.00 A ATOM 284 OG1 THR A 23 -7.460 -6.458 3.136 1.00 0.00 A ATOM 285 C THR A 24 -7.766 -0.990 1.849 1.00 0.00 A ATOM 286 CA THR A 24 -9.050 -1.743 2.160 1.00 0.00 A ATOM 287 CB THR A 24 -10.186 -0.735 2.485 1.00 0.00 A ATOM 288 CG2 THR A 24 -11.551 -1.389 2.383 1.00 0.00 A ATOM 289 HN THR A 24 -8.396 -2.439 4.042 1.00 0.00 A ATOM 290 HA THR A 24 -9.332 -2.296 1.277 1.00 0.00 A ATOM 291 HB THR A 24 -10.125 0.060 1.757 1.00 0.00 A ATOM 292 HG1 THR A 24 -9.359 -0.647 4.312 1.00 0.00 A ATOM 293 HG21 THR A 24 -11.602 -2.226 3.062 1.00 0.00 A ATOM 294 HG22 THR A 24 -11.718 -1.733 1.373 1.00 0.00 A ATOM 295 HG23 THR A 24 -12.310 -0.668 2.646 1.00 0.00 A ATOM 296 N THR A 24 -8.858 -2.715 3.220 1.00 0.00 A ATOM 297 O THR A 24 -7.029 -0.596 2.758 1.00 0.00 A ATOM 298 OG1 THR A 24 -10.015 -0.150 3.799 1.00 0.00 A ATOM 299 C CYS A 25 -6.496 1.391 0.409 1.00 0.00 A ATOM 300 CA CYS A 25 -6.318 -0.090 0.149 1.00 0.00 A ATOM 301 CB CYS A 25 -6.042 -0.336 -1.338 1.00 0.00 A ATOM 302 HN CYS A 25 -8.124 -1.120 -0.103 1.00 0.00 A ATOM 303 HA CYS A 25 -5.482 -0.449 0.730 1.00 0.00 A ATOM 304 HB2 CYS A 25 -5.969 -1.399 -1.516 1.00 0.00 A ATOM 305 HB1 CYS A 25 -6.861 0.071 -1.912 1.00 0.00 A ATOM 306 N CYS A 25 -7.499 -0.794 0.579 1.00 0.00 A ATOM 307 O CYS A 25 -7.404 2.033 -0.152 1.00 0.00 A ATOM 308 SG CYS A 25 -4.499 0.434 -1.937 1.00 0.00 A ATOM 309 C GLN A 26 -4.449 3.996 1.378 1.00 0.00 A ATOM 310 CA GLN A 26 -5.767 3.297 1.637 1.00 0.00 A ATOM 311 CB GLN A 26 -6.235 3.445 3.076 1.00 0.00 A ATOM 312 CD GLN A 26 -8.191 3.199 4.664 1.00 0.00 A ATOM 313 CG GLN A 26 -7.702 3.071 3.253 1.00 0.00 A ATOM 314 HN GLN A 26 -5.009 1.396 1.764 1.00 0.00 A ATOM 315 HA GLN A 26 -6.516 3.735 0.994 1.00 0.00 A ATOM 316 HB2 GLN A 26 -5.637 2.790 3.694 1.00 0.00 A ATOM 317 HB1 GLN A 26 -6.085 4.461 3.398 1.00 0.00 A ATOM 318 HE21 GLN A 26 -7.861 1.286 4.977 1.00 0.00 A ATOM 319 HE22 GLN A 26 -8.486 2.161 6.317 1.00 0.00 A ATOM 320 HG2 GLN A 26 -8.302 3.721 2.636 1.00 0.00 A ATOM 321 HG1 GLN A 26 -7.835 2.050 2.927 1.00 0.00 A ATOM 322 N GLN A 26 -5.693 1.925 1.293 1.00 0.00 A ATOM 323 NE2 GLN A 26 -8.179 2.120 5.388 1.00 0.00 A ATOM 324 O GLN A 26 -3.413 3.641 1.942 1.00 0.00 A ATOM 325 OE1 GLN A 26 -8.640 4.263 5.079 1.00 0.00 A ATOM 326 C VAL A 27 -2.941 6.658 1.255 1.00 0.00 A ATOM 327 CA VAL A 27 -3.330 5.732 0.107 1.00 0.00 A ATOM 328 CB VAL A 27 -3.612 6.567 -1.181 1.00 0.00 A ATOM 329 CG1 VAL A 27 -2.407 7.385 -1.600 1.00 0.00 A ATOM 330 CG2 VAL A 27 -4.057 5.668 -2.321 1.00 0.00 A ATOM 331 HN VAL A 27 -5.351 5.160 0.062 1.00 0.00 A ATOM 332 HA VAL A 27 -2.517 5.048 -0.089 1.00 0.00 A ATOM 333 HB VAL A 27 -4.412 7.259 -0.970 1.00 0.00 A ATOM 334 HG11 VAL A 27 -2.643 7.948 -2.490 1.00 0.00 A ATOM 335 HG12 VAL A 27 -1.576 6.725 -1.801 1.00 0.00 A ATOM 336 HG13 VAL A 27 -2.139 8.064 -0.804 1.00 0.00 A ATOM 337 HG21 VAL A 27 -4.958 5.146 -2.037 1.00 0.00 A ATOM 338 HG22 VAL A 27 -3.276 4.955 -2.541 1.00 0.00 A ATOM 339 HG23 VAL A 27 -4.248 6.272 -3.195 1.00 0.00 A ATOM 340 N VAL A 27 -4.492 4.955 0.487 1.00 0.00 A ATOM 341 O VAL A 27 -3.733 7.529 1.666 1.00 0.00 A ATOM 342 C LEU A 28 -0.368 8.338 2.361 1.00 0.00 A ATOM 343 CA LEU A 28 -1.266 7.251 2.901 1.00 0.00 A ATOM 344 CB LEU A 28 -0.467 6.397 3.889 1.00 0.00 A ATOM 345 CD1 LEU A 28 -0.285 4.561 5.551 1.00 0.00 A ATOM 346 CD2 LEU A 28 -2.506 5.550 5.090 1.00 0.00 A ATOM 347 CG LEU A 28 -1.167 5.183 4.497 1.00 0.00 A ATOM 348 HN LEU A 28 -1.189 5.741 1.413 1.00 0.00 A ATOM 349 HA LEU A 28 -2.110 7.693 3.407 1.00 0.00 A ATOM 350 HB2 LEU A 28 0.400 6.032 3.357 1.00 0.00 A ATOM 351 HB1 LEU A 28 -0.130 7.036 4.692 1.00 0.00 A ATOM 352 HD11 LEU A 28 0.663 4.300 5.108 1.00 0.00 A ATOM 353 HD12 LEU A 28 -0.759 3.672 5.941 1.00 0.00 A ATOM 354 HD13 LEU A 28 -0.127 5.265 6.354 1.00 0.00 A ATOM 355 HD21 LEU A 28 -2.355 6.304 5.847 1.00 0.00 A ATOM 356 HD22 LEU A 28 -2.928 4.662 5.538 1.00 0.00 A ATOM 357 HD23 LEU A 28 -3.156 5.922 4.314 1.00 0.00 A ATOM 358 HG LEU A 28 -1.322 4.445 3.723 1.00 0.00 A ATOM 359 N LEU A 28 -1.756 6.447 1.790 1.00 0.00 A ATOM 360 O LEU A 28 -0.376 9.474 2.823 1.00 0.00 A ATOM 361 C ASN A 29 1.183 8.475 -0.756 1.00 0.00 A ATOM 362 CA ASN A 29 1.318 8.846 0.696 1.00 0.00 A ATOM 363 CB ASN A 29 2.781 8.635 1.150 1.00 0.00 A ATOM 364 CG ASN A 29 3.047 8.938 2.617 1.00 0.00 A ATOM 365 HN ASN A 29 0.382 7.035 1.064 1.00 0.00 A ATOM 366 HA ASN A 29 1.005 9.866 0.863 1.00 0.00 A ATOM 367 HB2 ASN A 29 3.065 7.611 0.958 1.00 0.00 A ATOM 368 HB1 ASN A 29 3.393 9.291 0.548 1.00 0.00 A ATOM 369 HD21 ASN A 29 2.797 7.034 3.100 1.00 0.00 A ATOM 370 HD22 ASN A 29 3.179 8.096 4.407 1.00 0.00 A ATOM 371 N ASN A 29 0.414 7.964 1.391 1.00 0.00 A ATOM 372 ND2 ASN A 29 3.000 7.924 3.456 1.00 0.00 A ATOM 373 O ASN A 29 0.673 7.400 -1.028 1.00 0.00 A ATOM 374 OD1 ASN A 29 3.331 10.077 2.981 1.00 0.00 A ATOM 375 C PRO A 30 2.174 7.672 -3.516 1.00 0.00 A ATOM 376 CA PRO A 30 1.457 8.963 -3.133 1.00 0.00 A ATOM 377 CB PRO A 30 2.031 10.142 -3.911 1.00 0.00 A ATOM 378 CD PRO A 30 2.366 10.561 -1.530 1.00 0.00 A ATOM 379 CG PRO A 30 2.524 11.142 -2.910 1.00 0.00 A ATOM 380 HA PRO A 30 0.412 8.840 -3.372 1.00 0.00 A ATOM 381 HB2 PRO A 30 2.826 9.763 -4.531 1.00 0.00 A ATOM 382 HB1 PRO A 30 1.263 10.557 -4.547 1.00 0.00 A ATOM 383 HD2 PRO A 30 3.344 10.369 -1.119 1.00 0.00 A ATOM 384 HD1 PRO A 30 1.828 11.224 -0.870 1.00 0.00 A ATOM 385 HG2 PRO A 30 3.571 11.319 -3.101 1.00 0.00 A ATOM 386 HG1 PRO A 30 1.968 12.063 -3.004 1.00 0.00 A ATOM 387 N PRO A 30 1.641 9.293 -1.724 1.00 0.00 A ATOM 388 O PRO A 30 1.707 6.910 -4.364 1.00 0.00 A ATOM 389 C TYR A 31 3.687 5.089 -2.192 1.00 0.00 A ATOM 390 CA TYR A 31 4.000 6.200 -3.195 1.00 0.00 A ATOM 391 CB TYR A 31 5.510 6.461 -3.271 1.00 0.00 A ATOM 392 CD1 TYR A 31 6.608 6.839 -5.516 1.00 0.00 A ATOM 393 CD2 TYR A 31 5.652 8.723 -4.428 1.00 0.00 A ATOM 394 CE1 TYR A 31 6.987 7.644 -6.571 1.00 0.00 A ATOM 395 CE2 TYR A 31 6.028 9.531 -5.478 1.00 0.00 A ATOM 396 CG TYR A 31 5.934 7.360 -4.426 1.00 0.00 A ATOM 397 CZ TYR A 31 6.697 8.986 -6.544 1.00 0.00 A ATOM 398 HN TYR A 31 3.636 8.041 -2.220 1.00 0.00 A ATOM 399 HA TYR A 31 3.661 5.894 -4.174 1.00 0.00 A ATOM 400 HB2 TYR A 31 5.826 6.932 -2.353 1.00 0.00 A ATOM 401 HB1 TYR A 31 6.027 5.519 -3.373 1.00 0.00 A ATOM 402 HD1 TYR A 31 6.837 5.785 -5.536 1.00 0.00 A ATOM 403 HD2 TYR A 31 5.124 9.150 -3.589 1.00 0.00 A ATOM 404 HE1 TYR A 31 7.512 7.222 -7.415 1.00 0.00 A ATOM 405 HE2 TYR A 31 5.800 10.586 -5.457 1.00 0.00 A ATOM 406 HH TYR A 31 7.394 10.622 -7.240 1.00 0.00 A ATOM 407 N TYR A 31 3.295 7.405 -2.883 1.00 0.00 A ATOM 408 O TYR A 31 3.771 3.908 -2.528 1.00 0.00 A ATOM 409 OH TYR A 31 7.067 9.787 -7.602 1.00 0.00 A ATOM 410 C TYR A 32 1.444 4.361 0.223 1.00 0.00 A ATOM 411 CA TYR A 32 2.953 4.428 -0.012 1.00 0.00 A ATOM 412 CB TYR A 32 3.707 4.574 1.314 1.00 0.00 A ATOM 413 CD1 TYR A 32 2.626 3.554 3.369 1.00 0.00 A ATOM 414 CD2 TYR A 32 4.039 2.179 2.029 1.00 0.00 A ATOM 415 CE1 TYR A 32 2.388 2.485 4.209 1.00 0.00 A ATOM 416 CE2 TYR A 32 3.806 1.111 2.865 1.00 0.00 A ATOM 417 CG TYR A 32 3.457 3.419 2.262 1.00 0.00 A ATOM 418 CZ TYR A 32 2.982 1.267 3.952 1.00 0.00 A ATOM 419 HN TYR A 32 3.277 6.387 -0.729 1.00 0.00 A ATOM 420 HA TYR A 32 3.237 3.486 -0.456 1.00 0.00 A ATOM 421 HB2 TYR A 32 4.768 4.619 1.116 1.00 0.00 A ATOM 422 HB1 TYR A 32 3.394 5.484 1.804 1.00 0.00 A ATOM 423 HD1 TYR A 32 2.157 4.507 3.571 1.00 0.00 A ATOM 424 HD2 TYR A 32 4.689 2.056 1.175 1.00 0.00 A ATOM 425 HE1 TYR A 32 1.737 2.607 5.063 1.00 0.00 A ATOM 426 HE2 TYR A 32 4.270 0.156 2.666 1.00 0.00 A ATOM 427 HH TYR A 32 3.544 -0.303 4.929 1.00 0.00 A ATOM 428 N TYR A 32 3.323 5.443 -0.976 1.00 0.00 A ATOM 429 O TYR A 32 0.854 5.271 0.812 1.00 0.00 A ATOM 430 OH TYR A 32 2.737 0.203 4.777 1.00 0.00 A ATOM 431 C SER A 33 -0.607 1.784 0.941 1.00 0.00 A ATOM 432 CA SER A 33 -0.542 3.051 0.129 1.00 0.00 A ATOM 433 CB SER A 33 -1.327 2.916 -1.172 1.00 0.00 A ATOM 434 HN SER A 33 1.342 2.589 -0.638 1.00 0.00 A ATOM 435 HA SER A 33 -0.913 3.878 0.717 1.00 0.00 A ATOM 436 HB2 SER A 33 -1.034 2.021 -1.703 1.00 0.00 A ATOM 437 HB1 SER A 33 -2.384 2.870 -0.956 1.00 0.00 A ATOM 438 HG SER A 33 -1.247 3.775 -2.926 1.00 0.00 A ATOM 439 N SER A 33 0.850 3.279 -0.152 1.00 0.00 A ATOM 440 O SER A 33 0.012 0.790 0.558 1.00 0.00 A ATOM 441 OG SER A 33 -1.087 4.031 -2.007 1.00 0.00 A ATOM 442 C GLN A 34 -2.685 0.070 2.993 1.00 0.00 A ATOM 443 CA GLN A 34 -1.307 0.685 2.947 1.00 0.00 A ATOM 444 CB GLN A 34 -0.890 1.169 4.336 1.00 0.00 A ATOM 445 CD GLN A 34 -0.067 0.592 6.663 1.00 0.00 A ATOM 446 CG GLN A 34 -0.531 0.067 5.312 1.00 0.00 A ATOM 447 HN GLN A 34 -1.910 2.563 2.236 1.00 0.00 A ATOM 448 HA GLN A 34 -0.591 -0.044 2.598 1.00 0.00 A ATOM 449 HB2 GLN A 34 -0.029 1.811 4.226 1.00 0.00 A ATOM 450 HB1 GLN A 34 -1.702 1.745 4.754 1.00 0.00 A ATOM 451 HE21 GLN A 34 1.243 -0.880 6.804 1.00 0.00 A ATOM 452 HE22 GLN A 34 1.214 0.208 8.131 1.00 0.00 A ATOM 453 HG2 GLN A 34 -1.402 -0.551 5.464 1.00 0.00 A ATOM 454 HG1 GLN A 34 0.262 -0.529 4.882 1.00 0.00 A ATOM 455 N GLN A 34 -1.313 1.805 2.037 1.00 0.00 A ATOM 456 NE2 GLN A 34 0.878 -0.085 7.261 1.00 0.00 A ATOM 457 O GLN A 34 -3.689 0.784 2.938 1.00 0.00 A ATOM 458 OE1 GLN A 34 -0.518 1.639 7.140 1.00 0.00 A ATOM 459 C CYS A 35 -4.461 -1.965 4.565 1.00 0.00 A ATOM 460 CA CYS A 35 -4.031 -1.864 3.125 1.00 0.00 A ATOM 461 CB CYS A 35 -4.045 -3.235 2.486 1.00 0.00 A ATOM 462 HN CYS A 35 -1.925 -1.762 3.034 1.00 0.00 A ATOM 463 HA CYS A 35 -4.735 -1.227 2.610 1.00 0.00 A ATOM 464 HB2 CYS A 35 -3.527 -3.262 1.546 1.00 0.00 A ATOM 465 HB1 CYS A 35 -3.586 -3.947 3.155 1.00 0.00 A ATOM 466 N CYS A 35 -2.753 -1.230 3.050 1.00 0.00 A ATOM 467 O CYS A 35 -3.846 -2.672 5.373 1.00 0.00 A ATOM 468 SG CYS A 35 -5.708 -3.851 2.224 1.00 0.00 A ATOM 469 C LEU A 36 -7.418 -1.726 6.115 1.00 0.00 A ATOM 470 CA LEU A 36 -6.006 -1.223 6.195 1.00 0.00 A ATOM 471 CB LEU A 36 -5.943 0.199 6.754 1.00 0.00 A ATOM 472 CD1 LEU A 36 -4.630 2.268 7.258 1.00 0.00 A ATOM 473 CD2 LEU A 36 -3.672 0.033 7.808 1.00 0.00 A ATOM 474 CG LEU A 36 -4.547 0.814 6.838 1.00 0.00 A ATOM 475 HN LEU A 36 -5.933 -0.738 4.184 1.00 0.00 A ATOM 476 HA LEU A 36 -5.423 -1.883 6.819 1.00 0.00 A ATOM 477 HB2 LEU A 36 -6.552 0.836 6.130 1.00 0.00 A ATOM 478 HB1 LEU A 36 -6.367 0.194 7.747 1.00 0.00 A ATOM 479 HD11 LEU A 36 -5.199 2.820 6.524 1.00 0.00 A ATOM 480 HD12 LEU A 36 -3.632 2.676 7.319 1.00 0.00 A ATOM 481 HD13 LEU A 36 -5.112 2.343 8.221 1.00 0.00 A ATOM 482 HD21 LEU A 36 -2.701 0.500 7.872 1.00 0.00 A ATOM 483 HD22 LEU A 36 -3.559 -0.979 7.451 1.00 0.00 A ATOM 484 HD23 LEU A 36 -4.133 0.021 8.783 1.00 0.00 A ATOM 485 HG LEU A 36 -4.092 0.759 5.860 1.00 0.00 A ATOM 486 N LEU A 36 -5.474 -1.255 4.885 1.00 0.00 A ATOM 487 OT1 LEU A 36 -8.323 -0.956 5.738 1.00 0.00 A ATOM 488 OT2 LEU A 36 -7.632 -2.899 6.358 1.00 0.00 A TER ATOM 489 C1 MAN B 101 1.761 -8.043 2.458 1.00 0.00 B ATOM 490 C2 MAN B 101 2.757 -7.067 1.782 1.00 0.00 B ATOM 491 C3 MAN B 101 2.367 -6.913 0.302 1.00 0.00 B ATOM 492 C4 MAN B 101 2.416 -8.279 -0.358 1.00 0.00 B ATOM 493 C5 MAN B 101 1.437 -9.219 0.345 1.00 0.00 B ATOM 494 C6 MAN B 101 1.448 -10.625 -0.216 1.00 0.00 B ATOM 495 H1 MAN B 101 2.077 -8.234 3.492 1.00 0.00 B ATOM 496 H2 MAN B 101 2.717 -6.075 2.256 1.00 0.00 B ATOM 497 H3 MAN B 101 1.342 -6.516 0.272 1.00 0.00 B ATOM 498 H4 MAN B 101 3.445 -8.636 -0.211 1.00 0.00 B ATOM 499 H5 MAN B 101 0.419 -8.809 0.288 1.00 0.00 B ATOM 500 H61 MAN B 101 2.489 -10.978 -0.222 1.00 0.00 B ATOM 501 H62 MAN B 101 1.085 -10.593 -1.253 1.00 0.00 B ATOM 502 HO2 MAN B 101 4.336 -7.602 2.787 1.00 0.00 B ATOM 503 HO3 MAN B 101 2.896 -5.877 -1.255 1.00 0.00 B ATOM 504 HO4 MAN B 101 2.669 -7.453 -2.084 1.00 0.00 B ATOM 505 HO6 MAN B 101 0.927 -11.402 1.481 1.00 0.00 B ATOM 506 O2 MAN B 101 4.079 -7.592 1.858 1.00 0.00 B ATOM 507 O3 MAN B 101 3.258 -6.023 -0.367 1.00 0.00 B ATOM 508 O4 MAN B 101 2.114 -8.161 -1.732 1.00 0.00 B ATOM 509 O5 MAN B 101 1.785 -9.313 1.754 1.00 0.00 B ATOM 510 O6 MAN B 101 0.624 -11.490 0.568 1.00 0.00 B END
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