NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
15307 | 1xxz | 6421 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H CYS 1 1H CYS 1 5.528 -7.262 -3.522 2 2H CYS 1 2H CYS 1 4.777 -8.001 -4.833 3 HA CYS 1 HA CYS 1 2.796 -6.991 -4.477 4 1HB CYS 1 1HB CYS 1 3.971 -8.608 -2.525 5 2HB CYS 1 2HB CYS 1 3.198 -7.324 -1.618 6 H LYS 2 H LYS 2 1.996 -5.821 -1.874 7 HA LYS 2 HA LYS 2 3.474 -3.308 -1.841 8 1HB LYS 2 1HB LYS 2 0.583 -3.647 -2.595 9 2HB LYS 2 2HB LYS 2 1.102 -2.197 -1.759 10 1HG LYS 2 1HG LYS 2 2.656 -3.157 -4.177 11 2HG LYS 2 2HG LYS 2 1.152 -2.290 -4.409 12 1HD LYS 2 1HD LYS 2 2.331 -0.643 -2.576 13 2HD LYS 2 2HD LYS 2 3.769 -1.301 -3.331 14 1HE LYS 2 1HE LYS 2 1.918 -0.662 -5.442 15 2HE LYS 2 2HE LYS 2 1.962 0.714 -4.357 16 1HZ LYS 2 1HZ LYS 2 3.765 1.096 -5.756 17 2HZ LYS 2 2HZ LYS 2 4.520 0.371 -4.508 18 H PHE 3 H PHE 3 4.222 -4.599 0.123 19 HA PHE 3 HA PHE 3 2.685 -5.418 2.172 20 1HB PHE 3 1HB PHE 3 4.691 -4.927 3.528 21 2HB PHE 3 2HB PHE 3 5.237 -5.370 1.922 22 HD1 PHE 3 HD1 PHE 3 4.872 -2.627 4.313 23 HD2 PHE 3 HD2 PHE 3 6.227 -3.718 0.443 24 HE1 PHE 3 HE1 PHE 3 6.146 -0.470 4.151 25 HE2 PHE 3 HE2 PHE 3 7.503 -1.562 0.281 26 HZ PHE 3 HZ PHE 3 7.445 0.037 2.137 27 H PHE 4 H PHE 4 3.723 -2.007 1.520 28 HA PHE 4 HA PHE 4 1.419 -0.827 2.358 29 1HB PHE 4 1HB PHE 4 3.002 -1.934 4.532 30 2HB PHE 4 2HB PHE 4 3.140 -0.190 4.635 31 HD1 PHE 4 HD1 PHE 4 0.515 0.764 3.839 32 HD2 PHE 4 HD2 PHE 4 1.546 -2.616 6.191 33 HE1 PHE 4 HE1 PHE 4 -1.720 0.873 4.978 34 HE2 PHE 4 HE2 PHE 4 -0.689 -2.507 7.328 35 HZ PHE 4 HZ PHE 4 -2.295 -0.762 6.708 36 H DTR 5 H DTR 5 2.449 1.468 3.781 37 HA DTR 5 HA DTR 5 4.728 2.351 2.266 38 1HB DTR 5 1HB DTR 5 4.086 4.473 3.743 39 2HB DTR 5 2HB DTR 5 2.923 3.399 4.495 40 HD1 DTR 5 HD1 DTR 5 4.155 1.049 5.632 41 HE1 DTR 5 HE1 DTR 5 6.380 0.812 7.029 42 HZ2 DTR 5 HZ2 DTR 5 8.710 2.436 7.307 43 HH2 DTR 5 HH2 DTR 5 9.721 4.602 6.502 44 HZ3 DTR 5 HZ3 DTR 5 8.491 6.007 4.925 45 HE3 DTR 5 HE3 DTR 5 6.236 5.405 4.040 46 H IAM 6 H IAM 6 4.264 4.963 1.624 47 HA IAM 6 HA IAM 6 3.322 6.303 0.153 48 HB IAM 6 HB IAM 6 2.510 3.520 -0.818 49 HD1 IAM 6 HD1 IAM 6 1.704 7.033 -1.294 50 HE1 IAM 6 HE1 IAM 6 0.066 7.869 -3.003 51 HE2 IAM 6 HE2 IAM 6 -0.029 4.020 -4.791 52 HD2 IAM 6 HD2 IAM 6 1.610 3.186 -3.081 53 1HT IAM 6 1HT IAM 6 -1.726 7.220 -4.584 54 2HT IAM 6 2HT IAM 6 -1.652 5.680 -5.410 55 HH IAM 6 HH IAM 6 -0.322 8.158 -6.244 56 HI IAM 6 HI IAM 6 0.611 5.346 -6.695 57 1HB IAM 6 1HB IAM 6 3.743 4.565 -1.492 58 1HK1 IAM 6 1HK1 IAM 6 1.437 7.939 -8.015 59 2HK1 IAM 6 2HK1 IAM 6 2.298 7.148 -6.716 60 3HK1 IAM 6 3HK1 IAM 6 2.189 6.385 -8.285 61 1HK2 IAM 6 1HK2 IAM 6 -1.428 5.581 -8.067 62 2HK2 IAM 6 2HK2 IAM 6 -0.763 7.014 -8.812 63 3HK2 IAM 6 3HK2 IAM 6 -0.011 5.461 -9.083 64 H THR 7 H THR 7 0.690 3.835 -0.004 65 HA THR 7 HA THR 7 -1.020 5.423 1.690 66 HB THR 7 HB THR 7 -1.099 6.597 -0.548 67 HG1 THR 7 HG1 THR 7 -3.377 4.942 0.286 68 1HG2 THR 7 1HG2 THR 7 -2.642 5.203 -2.207 69 2HG2 THR 7 2HG2 THR 7 -0.877 4.979 -2.264 70 3HG2 THR 7 3HG2 THR 7 -1.897 3.797 -1.408 71 H IYR 8 H IYR 8 -3.430 4.201 0.389 72 HA IYR 8 HA IYR 8 -3.841 1.969 1.978 73 1HB IYR 8 1HB IYR 8 -4.810 3.064 -0.712 74 2HB IYR 8 2HB IYR 8 -5.212 1.404 -0.380 75 HD IYR 8 HD IYR 8 -6.316 4.725 0.003 76 HF IYR 8 HF IYR 8 -9.773 4.850 2.845 77 HG IYR 8 HG IYR 8 -8.329 1.635 3.331 78 HH IYR 8 HH IYR 8 -6.337 0.925 2.031 79 H THR 9 H THR 9 -3.387 -0.179 1.925 80 HA THR 9 HA THR 9 -2.312 -1.374 -0.474 81 HB THR 9 HB THR 9 -0.282 -2.174 1.026 82 HG1 THR 9 HG1 THR 9 -1.273 0.332 2.192 83 1HG2 THR 9 1HG2 THR 9 0.843 0.209 0.663 84 2HG2 THR 9 2HG2 THR 9 0.413 -0.776 -0.756 85 3HG2 THR 9 3HG2 THR 9 -0.648 0.558 -0.245 86 H SER 10 H SER 10 -2.379 -3.666 -0.451 87 HA SER 10 HA SER 10 -4.141 -4.688 1.701 88 1HB SER 10 1HB SER 10 -4.214 -6.610 -0.244 89 2HB SER 10 2HB SER 10 -5.344 -5.266 -0.212 90 HG SER 10 HG SER 10 -3.917 -4.150 -1.659 91 H CYS 11 H CYS 11 -2.035 -6.548 -0.532 92 HA CYS 11 HA CYS 11 -1.168 -8.173 1.575 93 1HB CYS 11 1HB CYS 11 0.347 -9.161 -0.081 94 2HB CYS 11 2HB CYS 11 -1.305 -9.042 -0.652 Start of MODEL 2 1 1H CYS 1 1H CYS 1 0.947 -4.528 -4.582 2 2H CYS 1 2H CYS 1 2.030 -5.558 -5.354 3 HA CYS 1 HA CYS 1 1.283 -6.492 -2.819 4 1HB CYS 1 1HB CYS 1 3.304 -6.992 -4.471 5 2HB CYS 1 2HB CYS 1 4.079 -5.730 -3.533 6 H LYS 2 H LYS 2 3.649 -5.255 -1.450 7 HA LYS 2 HA LYS 2 4.246 -3.444 -0.316 8 1HB LYS 2 1HB LYS 2 3.135 -2.302 -2.693 9 2HB LYS 2 2HB LYS 2 2.613 -1.333 -1.330 10 1HG LYS 2 1HG LYS 2 4.690 -0.358 -1.790 11 2HG LYS 2 2HG LYS 2 5.137 -1.517 -0.554 12 1HD LYS 2 1HD LYS 2 6.620 -2.410 -2.017 13 2HD LYS 2 2HD LYS 2 5.263 -2.994 -2.958 14 1HE LYS 2 1HE LYS 2 5.490 -1.356 -4.561 15 2HE LYS 2 2HE LYS 2 5.890 -0.116 -3.390 16 1HZ LYS 2 1HZ LYS 2 7.898 -0.462 -4.489 17 2HZ LYS 2 2HZ LYS 2 8.106 -1.434 -3.199 18 H PHE 3 H PHE 3 3.298 -4.482 1.520 19 HA PHE 3 HA PHE 3 0.532 -4.006 2.090 20 1HB PHE 3 1HB PHE 3 2.565 -5.826 2.789 21 2HB PHE 3 2HB PHE 3 2.438 -4.852 4.242 22 HD1 PHE 3 HD1 PHE 3 -0.309 -5.808 1.931 23 HD2 PHE 3 HD2 PHE 3 1.456 -6.344 5.753 24 HE1 PHE 3 HE1 PHE 3 -2.297 -7.157 2.661 25 HE2 PHE 3 HE2 PHE 3 -0.531 -7.693 6.482 26 HZ PHE 3 HZ PHE 3 -2.385 -8.081 4.927 27 H PHE 4 H PHE 4 3.030 -1.896 2.035 28 HA PHE 4 HA PHE 4 1.776 -0.169 3.915 29 1HB PHE 4 1HB PHE 4 4.170 0.066 5.083 30 2HB PHE 4 2HB PHE 4 3.099 -1.223 5.600 31 HD1 PHE 4 HD1 PHE 4 3.753 -3.472 5.418 32 HD2 PHE 4 HD2 PHE 4 5.974 -0.488 3.374 33 HE1 PHE 4 HE1 PHE 4 5.527 -5.165 4.872 34 HE2 PHE 4 HE2 PHE 4 7.745 -2.181 2.826 35 HZ PHE 4 HZ PHE 4 7.500 -4.497 3.583 36 H DTR 5 H DTR 5 3.019 1.997 4.026 37 HA DTR 5 HA DTR 5 5.000 2.468 2.085 38 1HB DTR 5 1HB DTR 5 4.282 4.913 2.745 39 2HB DTR 5 2HB DTR 5 3.104 4.154 3.797 40 HD1 DTR 5 HD1 DTR 5 4.683 1.994 5.336 41 HE1 DTR 5 HE1 DTR 5 6.725 2.467 6.939 42 HZ2 DTR 5 HZ2 DTR 5 8.581 4.622 7.175 43 HH2 DTR 5 HH2 DTR 5 9.166 6.851 6.152 44 HZ3 DTR 5 HZ3 DTR 5 7.846 7.718 4.286 45 HE3 DTR 5 HE3 DTR 5 5.904 6.492 3.310 46 H IAM 6 H IAM 6 4.390 4.571 0.521 47 HA IAM 6 HA IAM 6 3.349 5.224 -1.307 48 HB IAM 6 HB IAM 6 2.560 2.268 -1.124 49 HD1 IAM 6 HD1 IAM 6 1.810 5.343 -2.911 50 HE1 IAM 6 HE1 IAM 6 0.197 5.482 -4.832 51 HE2 IAM 6 HE2 IAM 6 0.065 1.244 -5.026 52 HD2 IAM 6 HD2 IAM 6 1.677 1.107 -3.106 53 1HT IAM 6 1HT IAM 6 -1.300 4.461 -6.303 54 2HT IAM 6 2HT IAM 6 -1.773 2.799 -6.029 55 HH IAM 6 HH IAM 6 -0.006 2.064 -7.606 56 HI IAM 6 HI IAM 6 0.579 3.595 -9.295 57 1HB IAM 6 1HB IAM 6 3.814 2.963 -2.129 58 1HK1 IAM 6 1HK1 IAM 6 0.466 5.618 -7.048 59 2HK1 IAM 6 2HK1 IAM 6 1.878 4.697 -7.507 60 3HK1 IAM 6 3HK1 IAM 6 1.213 5.880 -8.606 61 1HK2 IAM 6 1HK2 IAM 6 -1.858 3.961 -9.421 62 2HK2 IAM 6 2HK2 IAM 6 -1.740 5.184 -8.179 63 3HK2 IAM 6 3HK2 IAM 6 -0.994 5.446 -9.736 64 H THR 7 H THR 7 0.827 2.808 -0.377 65 HA THR 7 HA THR 7 -0.908 4.920 0.583 66 HB THR 7 HB THR 7 -1.134 4.947 -1.939 67 HG1 THR 7 HG1 THR 7 -3.278 3.778 -0.309 68 1HG2 THR 7 1HG2 THR 7 -2.657 2.900 -2.691 69 2HG2 THR 7 2HG2 THR 7 -0.887 2.734 -2.748 70 3HG2 THR 7 3HG2 THR 7 -1.803 2.037 -1.389 71 H IYR 8 H IYR 8 -3.288 3.176 0.152 72 HA IYR 8 HA IYR 8 -3.405 1.833 2.600 73 1HB IYR 8 1HB IYR 8 -4.738 1.696 -0.162 74 2HB IYR 8 2HB IYR 8 -5.049 0.371 0.923 75 HD IYR 8 HD IYR 8 -6.189 3.544 -0.080 76 HF IYR 8 HF IYR 8 -9.258 5.036 2.818 77 HG IYR 8 HG IYR 8 -7.672 2.336 4.503 78 HH IYR 8 HH IYR 8 -5.842 1.057 3.418 79 H THR 9 H THR 9 -3.633 -0.530 2.958 80 HA THR 9 HA THR 9 -1.261 -1.851 2.044 81 HB THR 9 HB THR 9 -1.855 -3.450 3.737 82 HG1 THR 9 HG1 THR 9 -4.511 -2.260 3.343 83 1HG2 THR 9 1HG2 THR 9 -3.134 -1.978 5.547 84 2HG2 THR 9 2HG2 THR 9 -1.475 -1.537 5.079 85 3HG2 THR 9 3HG2 THR 9 -2.858 -0.659 4.383 86 H SER 10 H SER 10 -1.042 -3.678 0.745 87 HA SER 10 HA SER 10 -3.477 -4.415 -0.784 88 1HB SER 10 1HB SER 10 -2.109 -2.895 -2.192 89 2HB SER 10 2HB SER 10 -0.638 -3.792 -1.854 90 HG SER 10 HG SER 10 -1.607 -5.607 -2.924 91 H CYS 11 H CYS 11 -0.046 -5.526 -0.954 92 HA CYS 11 HA CYS 11 -0.553 -8.132 -1.242 93 1HB CYS 11 1HB CYS 11 1.688 -6.551 -0.580 94 2HB CYS 11 2HB CYS 11 1.664 -7.864 0.582 Start of MODEL 3 1 1H CYS 1 1H CYS 1 5.258 -9.357 -0.932 2 2H CYS 1 2H CYS 1 5.387 -8.062 0.133 3 HA CYS 1 HA CYS 1 5.048 -7.904 -2.476 4 1HB CYS 1 1HB CYS 1 2.428 -6.873 -1.680 5 2HB CYS 1 2HB CYS 1 2.917 -7.731 -3.128 6 H LYS 2 H LYS 2 3.417 -5.398 -2.483 7 HA LYS 2 HA LYS 2 5.088 -3.805 -0.666 8 1HB LYS 2 1HB LYS 2 4.310 -3.356 -3.543 9 2HB LYS 2 2HB LYS 2 4.728 -2.008 -2.507 10 1HG LYS 2 1HG LYS 2 6.645 -4.239 -2.260 11 2HG LYS 2 2HG LYS 2 6.533 -3.639 -3.903 12 1HD LYS 2 1HD LYS 2 6.614 -1.264 -2.518 13 2HD LYS 2 2HD LYS 2 7.564 -2.278 -1.452 14 1HE LYS 2 1HE LYS 2 8.699 -3.016 -3.799 15 2HE LYS 2 2HE LYS 2 8.143 -1.425 -4.279 16 1HZ LYS 2 1HZ LYS 2 10.220 -0.994 -3.353 17 2HZ LYS 2 2HZ LYS 2 9.265 -0.695 -2.067 18 H PHE 3 H PHE 3 2.983 -4.659 0.621 19 HA PHE 3 HA PHE 3 0.572 -3.316 0.063 20 1HB PHE 3 1HB PHE 3 -0.057 -4.291 2.218 21 2HB PHE 3 2HB PHE 3 1.038 -5.438 1.473 22 HD1 PHE 3 HD1 PHE 3 3.029 -6.072 2.548 23 HD2 PHE 3 HD2 PHE 3 0.882 -2.696 3.964 24 HE1 PHE 3 HE1 PHE 3 4.504 -5.987 4.578 25 HE2 PHE 3 HE2 PHE 3 2.357 -2.609 5.993 26 HZ PHE 3 HZ PHE 3 4.149 -4.257 6.277 27 H PHE 4 H PHE 4 3.378 -2.632 2.228 28 HA PHE 4 HA PHE 4 2.152 -0.399 3.452 29 1HB PHE 4 1HB PHE 4 4.615 -0.010 4.117 30 2HB PHE 4 2HB PHE 4 4.009 -1.608 4.509 31 HD1 PHE 4 HD1 PHE 4 5.100 -3.515 3.710 32 HD2 PHE 4 HD2 PHE 4 5.940 0.245 1.930 33 HE1 PHE 4 HE1 PHE 4 6.984 -4.550 2.413 34 HE2 PHE 4 HE2 PHE 4 7.822 -0.790 0.631 35 HZ PHE 4 HZ PHE 4 8.323 -3.174 0.890 36 H DTR 5 H DTR 5 4.030 1.655 3.347 37 HA DTR 5 HA DTR 5 4.963 2.350 0.868 38 1HB DTR 5 1HB DTR 5 4.755 4.711 1.926 39 2HB DTR 5 2HB DTR 5 3.861 3.963 3.235 40 HD1 DTR 5 HD1 DTR 5 5.382 1.984 4.653 41 HE1 DTR 5 HE1 DTR 5 7.915 1.979 5.392 42 HZ2 DTR 5 HZ2 DTR 5 10.221 3.413 4.514 43 HH2 DTR 5 HH2 DTR 5 10.952 5.156 2.844 44 HZ3 DTR 5 HZ3 DTR 5 9.317 6.136 1.315 45 HE3 DTR 5 HE3 DTR 5 6.905 5.493 1.308 46 H IAM 6 H IAM 6 3.953 4.556 -0.236 47 HA IAM 6 HA IAM 6 2.353 5.405 -1.490 48 HB IAM 6 HB IAM 6 1.500 2.472 -1.224 49 HD1 IAM 6 HD1 IAM 6 -0.065 1.518 -2.899 50 HE1 IAM 6 HE1 IAM 6 -2.249 1.874 -4.084 51 HE2 IAM 6 HE2 IAM 6 -1.870 6.064 -3.520 52 HD2 IAM 6 HD2 IAM 6 0.314 5.706 -2.335 53 1HT IAM 6 1HT IAM 6 -3.423 3.897 -5.614 54 2HT IAM 6 2HT IAM 6 -3.777 5.246 -4.557 55 HH IAM 6 HH IAM 6 -4.502 3.207 -2.920 56 HI IAM 6 HI IAM 6 -5.362 2.315 -5.527 57 1HB IAM 6 1HB IAM 6 2.351 3.201 -2.570 58 1HK1 IAM 6 1HK1 IAM 6 -6.888 4.688 -4.438 59 2HK1 IAM 6 2HK1 IAM 6 -5.907 4.696 -5.884 60 3HK1 IAM 6 3HK1 IAM 6 -7.363 3.731 -5.821 61 1HK2 IAM 6 1HK2 IAM 6 -6.050 1.217 -3.426 62 2HK2 IAM 6 2HK2 IAM 6 -6.973 2.634 -2.988 63 3HK2 IAM 6 3HK2 IAM 6 -7.448 1.677 -4.369 64 H THR 7 H THR 7 0.157 3.008 0.071 65 HA THR 7 HA THR 7 -0.910 4.985 1.869 66 HB THR 7 HB THR 7 -1.921 5.535 -0.417 67 HG1 THR 7 HG1 THR 7 -3.560 4.359 1.718 68 1HG2 THR 7 1HG2 THR 7 -3.957 3.870 -0.818 69 2HG2 THR 7 2HG2 THR 7 -2.373 3.498 -1.539 70 3HG2 THR 7 3HG2 THR 7 -2.884 2.680 -0.043 71 H IYR 8 H IYR 8 -3.524 3.521 1.944 72 HA IYR 8 HA IYR 8 -3.102 1.739 4.023 73 1HB IYR 8 1HB IYR 8 -5.109 1.354 1.701 74 2HB IYR 8 2HB IYR 8 -5.336 0.899 3.365 75 HD IYR 8 HD IYR 8 -5.999 3.417 0.940 76 HF IYR 8 HF IYR 8 -7.925 6.926 2.945 77 HG IYR 8 HG IYR 8 -6.632 4.965 5.616 78 HH IYR 8 HH IYR 8 -5.423 2.844 5.170 79 H THR 9 H THR 9 -3.641 -0.685 3.904 80 HA THR 9 HA THR 9 -1.571 -1.915 2.358 81 HB THR 9 HB THR 9 -2.071 -3.811 3.734 82 HG1 THR 9 HG1 THR 9 -4.650 -2.432 3.994 83 1HG2 THR 9 1HG2 THR 9 -2.988 -2.736 5.988 84 2HG2 THR 9 2HG2 THR 9 -1.371 -2.280 5.401 85 3HG2 THR 9 3HG2 THR 9 -2.757 -1.197 5.120 86 H SER 10 H SER 10 -1.657 -3.036 0.486 87 HA SER 10 HA SER 10 -4.344 -3.237 -0.762 88 1HB SER 10 1HB SER 10 -2.464 -1.718 -1.800 89 2HB SER 10 2HB SER 10 -1.609 -3.199 -2.200 90 HG SER 10 HG SER 10 -3.488 -3.854 -3.391 91 H CYS 11 H CYS 11 -1.094 -4.868 -0.997 92 HA CYS 11 HA CYS 11 -2.214 -7.261 -1.865 93 1HB CYS 11 1HB CYS 11 0.174 -6.491 -2.105 94 2HB CYS 11 2HB CYS 11 0.421 -6.927 -0.425 Start of MODEL 4 1 1H CYS 1 1H CYS 1 2.169 -3.592 -5.309 2 2H CYS 1 2H CYS 1 0.693 -4.398 -5.311 3 HA CYS 1 HA CYS 1 0.815 -5.040 -3.214 4 1HB CYS 1 1HB CYS 1 3.006 -5.563 -4.825 5 2HB CYS 1 2HB CYS 1 3.739 -5.068 -3.312 6 H LYS 2 H LYS 2 3.224 -4.763 -1.462 7 HA LYS 2 HA LYS 2 4.256 -3.297 -0.103 8 1HB LYS 2 1HB LYS 2 3.640 -1.571 -2.105 9 2HB LYS 2 2HB LYS 2 2.655 -0.903 -0.820 10 1HG LYS 2 1HG LYS 2 4.700 0.197 -0.467 11 2HG LYS 2 2HG LYS 2 4.820 -1.139 0.660 12 1HD LYS 2 1HD LYS 2 5.942 -2.420 -1.367 13 2HD LYS 2 2HD LYS 2 6.178 -0.817 -2.033 14 1HE LYS 2 1HE LYS 2 8.130 -0.900 -0.814 15 2HE LYS 2 2HE LYS 2 7.092 -0.355 0.490 16 1HZ LYS 2 1HZ LYS 2 8.104 -2.236 1.380 17 2HZ LYS 2 2HZ LYS 2 6.713 -2.888 0.842 18 H PHE 3 H PHE 3 3.506 -4.250 1.754 19 HA PHE 3 HA PHE 3 0.778 -4.079 2.504 20 1HB PHE 3 1HB PHE 3 3.011 -5.632 3.087 21 2HB PHE 3 2HB PHE 3 2.975 -4.604 4.505 22 HD1 PHE 3 HD1 PHE 3 0.143 -6.039 2.555 23 HD2 PHE 3 HD2 PHE 3 2.254 -5.972 6.235 24 HE1 PHE 3 HE1 PHE 3 -1.606 -7.518 3.584 25 HE2 PHE 3 HE2 PHE 3 0.508 -7.452 7.265 26 HZ PHE 3 HZ PHE 3 -1.403 -8.205 5.927 27 H PHE 4 H PHE 4 3.141 -1.715 2.442 28 HA PHE 4 HA PHE 4 1.649 -0.028 4.154 29 1HB PHE 4 1HB PHE 4 3.919 0.336 5.554 30 2HB PHE 4 2HB PHE 4 2.806 -0.936 6.020 31 HD1 PHE 4 HD1 PHE 4 5.903 -0.280 4.093 32 HD2 PHE 4 HD2 PHE 4 3.481 -3.189 6.010 33 HE1 PHE 4 HE1 PHE 4 7.732 -1.979 3.825 34 HE2 PHE 4 HE2 PHE 4 5.311 -4.888 5.745 35 HZ PHE 4 HZ PHE 4 7.413 -4.262 4.653 36 H DTR 5 H DTR 5 2.524 2.215 4.158 37 HA DTR 5 HA DTR 5 4.820 2.832 2.676 38 1HB DTR 5 1HB DTR 5 3.686 5.173 2.848 39 2HB DTR 5 2HB DTR 5 2.323 4.359 3.592 40 HD1 DTR 5 HD1 DTR 5 3.536 2.581 5.791 41 HE1 DTR 5 HE1 DTR 5 4.939 3.453 7.849 42 HZ2 DTR 5 HZ2 DTR 5 6.438 5.831 8.341 43 HH2 DTR 5 HH2 DTR 5 7.114 8.004 7.256 44 HZ3 DTR 5 HZ3 DTR 5 6.360 8.519 4.989 45 HE3 DTR 5 HE3 DTR 5 4.926 6.976 3.651 46 H IAM 6 H IAM 6 4.424 4.580 0.720 47 HA IAM 6 HA IAM 6 3.832 4.862 -1.383 48 HB IAM 6 HB IAM 6 3.324 1.883 -0.910 49 HD1 IAM 6 HD1 IAM 6 3.259 4.426 -3.632 50 HE1 IAM 6 HE1 IAM 6 2.050 4.065 -5.803 51 HE2 IAM 6 HE2 IAM 6 1.103 0.102 -4.615 52 HD2 IAM 6 HD2 IAM 6 2.312 0.465 -2.444 53 1HT IAM 6 1HT IAM 6 0.313 0.874 -6.651 54 2HT IAM 6 2HT IAM 6 1.466 1.907 -7.467 55 HH IAM 6 HH IAM 6 -0.969 3.030 -6.075 56 HI IAM 6 HI IAM 6 0.516 4.387 -8.042 57 1HB IAM 6 1HB IAM 6 4.660 2.611 -1.778 58 1HK1 IAM 6 1HK1 IAM 6 -2.454 3.815 -8.095 59 2HK1 IAM 6 2HK1 IAM 6 -1.694 5.132 -7.233 60 3HK1 IAM 6 3HK1 IAM 6 -1.656 5.093 -8.980 61 1HK2 IAM 6 1HK2 IAM 6 0.704 2.240 -9.247 62 2HK2 IAM 6 2HK2 IAM 6 -1.037 2.107 -9.283 63 3HK2 IAM 6 3HK2 IAM 6 -0.240 3.385 -10.169 64 H THR 7 H THR 7 1.358 2.321 -0.653 65 HA THR 7 HA THR 7 -0.716 4.366 -0.601 66 HB THR 7 HB THR 7 -0.326 3.729 -3.028 67 HG1 THR 7 HG1 THR 7 -2.720 2.761 -1.629 68 1HG2 THR 7 1HG2 THR 7 -1.503 1.390 -3.491 69 2HG2 THR 7 2HG2 THR 7 0.238 1.431 -3.124 70 3HG2 THR 7 3HG2 THR 7 -0.929 0.996 -1.852 71 H IYR 8 H IYR 8 -2.789 2.275 -1.023 72 HA IYR 8 HA IYR 8 -3.408 1.577 1.596 73 1HB IYR 8 1HB IYR 8 -3.858 -0.181 -0.909 74 2HB IYR 8 2HB IYR 8 -4.895 -0.060 0.483 75 HD IYR 8 HD IYR 8 -4.266 1.204 -2.813 76 HF IYR 8 HF IYR 8 -7.257 4.408 -3.728 77 HG IYR 8 HG IYR 8 -7.559 3.874 -0.224 78 HH IYR 8 HH IYR 8 -6.149 2.191 0.933 79 H THR 9 H THR 9 -3.675 -0.842 2.276 80 HA THR 9 HA THR 9 -0.999 -2.056 2.074 81 HB THR 9 HB THR 9 -1.451 -2.901 4.341 82 HG1 THR 9 HG1 THR 9 -4.023 -1.602 3.773 83 1HG2 THR 9 1HG2 THR 9 -2.290 -0.649 5.480 84 2HG2 THR 9 2HG2 THR 9 -0.696 -0.683 4.690 85 3HG2 THR 9 3HG2 THR 9 -2.093 0.025 3.844 86 H SER 10 H SER 10 -1.112 -4.540 2.559 87 HA SER 10 HA SER 10 -1.693 -6.575 1.803 88 1HB SER 10 1HB SER 10 -3.746 -6.525 3.009 89 2HB SER 10 2HB SER 10 -4.428 -5.207 2.069 90 HG SER 10 HG SER 10 -4.589 -6.681 0.286 91 H CYS 11 H CYS 11 -0.918 -7.252 -0.077 92 HA CYS 11 HA CYS 11 -0.833 -5.781 -2.359 93 1HB CYS 11 1HB CYS 11 0.223 -8.117 -1.597 94 2HB CYS 11 2HB CYS 11 -1.033 -8.737 -2.652 Start of MODEL 5 1 1H CYS 1 1H CYS 1 4.229 -8.690 -2.584 2 2H CYS 1 2H CYS 1 5.628 -7.794 -2.325 3 HA CYS 1 HA CYS 1 4.315 -6.525 -3.662 4 1HB CYS 1 1HB CYS 1 1.961 -6.082 -2.114 5 2HB CYS 1 2HB CYS 1 2.116 -6.700 -3.747 6 H LYS 2 H LYS 2 2.767 -4.369 -2.488 7 HA LYS 2 HA LYS 2 4.785 -3.322 -0.637 8 1HB LYS 2 1HB LYS 2 3.330 -2.193 -2.938 9 2HB LYS 2 2HB LYS 2 3.361 -1.149 -1.532 10 1HG LYS 2 1HG LYS 2 5.883 -2.505 -2.569 11 2HG LYS 2 2HG LYS 2 5.341 -0.966 -3.204 12 1HD LYS 2 1HD LYS 2 5.187 -0.481 -0.492 13 2HD LYS 2 2HD LYS 2 6.531 -1.603 -0.545 14 1HE LYS 2 1HE LYS 2 6.353 0.866 -2.332 15 2HE LYS 2 2HE LYS 2 7.162 0.866 -0.777 16 1HZ LYS 2 1HZ LYS 2 8.866 0.336 -2.249 17 2HZ LYS 2 2HZ LYS 2 8.427 -1.156 -1.770 18 H PHE 3 H PHE 3 3.208 -4.995 0.688 19 HA PHE 3 HA PHE 3 0.729 -4.469 1.459 20 1HB PHE 3 1HB PHE 3 1.884 -6.229 2.583 21 2HB PHE 3 2HB PHE 3 3.301 -5.239 2.873 22 HD1 PHE 3 HD1 PHE 3 3.705 -5.158 5.138 23 HD2 PHE 3 HD2 PHE 3 -0.295 -4.772 3.774 24 HE1 PHE 3 HE1 PHE 3 2.941 -4.751 7.494 25 HE2 PHE 3 HE2 PHE 3 -1.059 -4.362 6.129 26 HZ PHE 3 HZ PHE 3 0.568 -4.359 7.961 27 H PHE 4 H PHE 4 3.558 -2.415 2.107 28 HA PHE 4 HA PHE 4 1.736 -0.528 3.417 29 1HB PHE 4 1HB PHE 4 3.937 0.098 4.705 30 2HB PHE 4 2HB PHE 4 3.153 -1.398 5.177 31 HD1 PHE 4 HD1 PHE 4 5.640 -0.299 2.606 32 HD2 PHE 4 HD2 PHE 4 4.553 -3.184 5.522 33 HE1 PHE 4 HE1 PHE 4 7.766 -1.556 2.155 34 HE2 PHE 4 HE2 PHE 4 6.679 -4.440 5.073 35 HZ PHE 4 HZ PHE 4 8.259 -3.612 3.392 36 H DTR 5 H DTR 5 3.400 1.657 3.666 37 HA DTR 5 HA DTR 5 4.995 2.113 1.413 38 1HB DTR 5 1HB DTR 5 4.624 4.553 2.290 39 2HB DTR 5 2HB DTR 5 3.544 3.850 3.478 40 HD1 DTR 5 HD1 DTR 5 4.896 1.795 5.060 41 HE1 DTR 5 HE1 DTR 5 7.265 1.886 6.217 42 HZ2 DTR 5 HZ2 DTR 5 9.601 3.470 5.793 43 HH2 DTR 5 HH2 DTR 5 10.502 5.316 4.331 44 HZ3 DTR 5 HZ3 DTR 5 9.094 6.277 2.578 45 HE3 DTR 5 HE3 DTR 5 6.759 5.514 2.141 46 H IAM 6 H IAM 6 4.300 4.308 0.046 47 HA IAM 6 HA IAM 6 3.012 5.129 -1.542 48 HB IAM 6 HB IAM 6 2.075 2.226 -1.319 49 HD1 IAM 6 HD1 IAM 6 1.180 5.415 -2.854 50 HE1 IAM 6 HE1 IAM 6 -0.802 5.720 -4.365 51 HE2 IAM 6 HE2 IAM 6 -1.323 1.512 -4.530 52 HD2 IAM 6 HD2 IAM 6 0.660 1.207 -3.019 53 1HT IAM 6 1HT IAM 6 -2.419 4.833 -5.795 54 2HT IAM 6 2HT IAM 6 -3.283 3.591 -4.916 55 HH IAM 6 HH IAM 6 -2.897 2.104 -6.704 56 HI IAM 6 HI IAM 6 -1.619 2.917 -8.606 57 1HB IAM 6 1HB IAM 6 3.116 2.915 -2.547 58 1HK1 IAM 6 1HK1 IAM 6 0.395 2.506 -6.388 59 2HK1 IAM 6 2HK1 IAM 6 -0.288 1.239 -7.379 60 3HK1 IAM 6 3HK1 IAM 6 0.751 2.446 -8.097 61 1HK2 IAM 6 1HK2 IAM 6 -1.663 5.251 -7.803 62 2HK2 IAM 6 2HK2 IAM 6 -0.416 4.875 -6.639 63 3HK2 IAM 6 3HK2 IAM 6 -0.061 4.816 -8.348 64 H THR 7 H THR 7 0.475 2.878 -0.314 65 HA THR 7 HA THR 7 -0.861 5.019 1.090 66 HB THR 7 HB THR 7 -1.462 5.367 -1.346 67 HG1 THR 7 HG1 THR 7 -3.454 4.228 0.488 68 1HG2 THR 7 1HG2 THR 7 -3.307 3.581 -2.041 69 2HG2 THR 7 2HG2 THR 7 -1.597 3.252 -2.403 70 3HG2 THR 7 3HG2 THR 7 -2.369 2.491 -0.990 71 H IYR 8 H IYR 8 -3.461 3.557 0.852 72 HA IYR 8 HA IYR 8 -3.455 2.013 3.145 73 1HB IYR 8 1HB IYR 8 -5.002 2.155 0.506 74 2HB IYR 8 2HB IYR 8 -5.272 0.730 1.469 75 HD IYR 8 HD IYR 8 -6.382 4.019 0.895 76 HF IYR 8 HF IYR 8 -9.164 5.271 4.172 77 HG IYR 8 HG IYR 8 -7.540 2.370 5.434 78 HH IYR 8 HH IYR 8 -5.845 1.167 4.078 79 H THR 9 H THR 9 -3.624 -0.309 3.472 80 HA THR 9 HA THR 9 -1.613 -1.706 1.881 81 HB THR 9 HB THR 9 -1.427 -3.129 3.823 82 HG1 THR 9 HG1 THR 9 -3.948 -1.787 4.512 83 1HG2 THR 9 1HG2 THR 9 -1.719 -1.400 5.824 84 2HG2 THR 9 2HG2 THR 9 -0.438 -1.130 4.620 85 3HG2 THR 9 3HG2 THR 9 -1.965 -0.221 4.511 86 H SER 10 H SER 10 -1.964 -3.921 1.158 87 HA SER 10 HA SER 10 -4.453 -5.189 1.143 88 1HB SER 10 1HB SER 10 -4.859 -2.934 -0.289 89 2HB SER 10 2HB SER 10 -4.035 -3.812 -1.568 90 HG SER 10 HG SER 10 -5.606 -5.496 -1.302 91 H CYS 11 H CYS 11 -1.519 -4.364 -0.812 92 HA CYS 11 HA CYS 11 0.109 -5.727 -1.458 93 1HB CYS 11 1HB CYS 11 -1.111 -7.354 0.427 94 2HB CYS 11 2HB CYS 11 -1.118 -8.343 -1.020 Start of MODEL 6 1 1H CYS 1 1H CYS 1 4.866 -7.184 -3.040 2 2H CYS 1 2H CYS 1 4.470 -6.919 -4.654 3 HA CYS 1 HA CYS 1 2.454 -6.420 -4.235 4 1HB CYS 1 1HB CYS 1 3.330 -8.114 -2.211 5 2HB CYS 1 2HB CYS 1 2.424 -6.881 -1.357 6 H LYS 2 H LYS 2 1.217 -5.399 -1.730 7 HA LYS 2 HA LYS 2 2.382 -2.702 -1.762 8 1HB LYS 2 1HB LYS 2 -0.489 -3.634 -1.649 9 2HB LYS 2 2HB LYS 2 -0.019 -2.025 -1.140 10 1HG LYS 2 1HG LYS 2 0.614 -3.211 -3.882 11 2HG LYS 2 2HG LYS 2 -0.740 -2.150 -3.557 12 1HD LYS 2 1HD LYS 2 0.691 -0.450 -4.073 13 2HD LYS 2 2HD LYS 2 1.348 -0.695 -2.468 14 1HE LYS 2 1HE LYS 2 2.513 -2.650 -4.281 15 2HE LYS 2 2HE LYS 2 2.682 -1.048 -4.976 16 1HZ LYS 2 1HZ LYS 2 4.521 -1.206 -3.580 17 2HZ LYS 2 2HZ LYS 2 3.482 -0.428 -2.597 18 H PHE 3 H PHE 3 3.741 -4.196 -0.089 19 HA PHE 3 HA PHE 3 2.881 -5.023 2.283 20 1HB PHE 3 1HB PHE 3 5.224 -5.082 2.011 21 2HB PHE 3 2HB PHE 3 5.262 -3.520 1.217 22 HD1 PHE 3 HD1 PHE 3 5.508 -1.480 2.493 23 HD2 PHE 3 HD2 PHE 3 5.301 -5.238 4.452 24 HE1 PHE 3 HE1 PHE 3 6.347 -0.422 4.610 25 HE2 PHE 3 HE2 PHE 3 6.137 -4.181 6.570 26 HZ PHE 3 HZ PHE 3 6.652 -1.786 6.622 27 H PHE 4 H PHE 4 3.762 -1.551 1.630 28 HA PHE 4 HA PHE 4 1.581 -0.474 2.914 29 1HB PHE 4 1HB PHE 4 3.613 -1.602 4.671 30 2HB PHE 4 2HB PHE 4 3.701 0.142 4.825 31 HD1 PHE 4 HD1 PHE 4 1.099 1.166 4.828 32 HD2 PHE 4 HD2 PHE 4 2.387 -2.582 6.343 33 HE1 PHE 4 HE1 PHE 4 -0.862 1.126 6.395 34 HE2 PHE 4 HE2 PHE 4 0.426 -2.623 7.910 35 HZ PHE 4 HZ PHE 4 -1.173 -0.767 7.918 36 H DTR 5 H DTR 5 2.826 1.796 4.197 37 HA DTR 5 HA DTR 5 4.902 2.850 2.677 38 1HB DTR 5 1HB DTR 5 3.872 5.030 3.736 39 2HB DTR 5 2HB DTR 5 2.637 3.980 4.401 40 HD1 DTR 5 HD1 DTR 5 3.782 1.856 6.027 41 HE1 DTR 5 HE1 DTR 5 5.679 1.987 7.856 42 HZ2 DTR 5 HZ2 DTR 5 7.767 3.858 8.392 43 HH2 DTR 5 HH2 DTR 5 8.751 6.021 7.549 44 HZ3 DTR 5 HZ3 DTR 5 7.771 7.127 5.602 45 HE3 DTR 5 HE3 DTR 5 5.803 6.214 4.368 46 H IAM 6 H IAM 6 4.300 5.221 1.543 47 HA IAM 6 HA IAM 6 3.472 6.201 -0.246 48 HB IAM 6 HB IAM 6 3.118 3.228 -0.773 49 HD1 IAM 6 HD1 IAM 6 1.889 6.445 -2.036 50 HE1 IAM 6 HE1 IAM 6 0.231 6.651 -3.911 51 HE2 IAM 6 HE2 IAM 6 0.605 2.497 -4.697 52 HD2 IAM 6 HD2 IAM 6 2.263 2.293 -2.822 53 1HT IAM 6 1HT IAM 6 -1.188 5.655 -5.484 54 2HT IAM 6 2HT IAM 6 -1.407 3.920 -5.483 55 HH IAM 6 HH IAM 6 0.880 5.167 -7.002 56 HI IAM 6 HI IAM 6 -0.449 2.721 -7.597 57 1HB IAM 6 1HB IAM 6 4.182 4.351 -1.593 58 1HK1 IAM 6 1HK1 IAM 6 0.293 4.944 -9.509 59 2HK1 IAM 6 2HK1 IAM 6 1.363 3.667 -8.982 60 3HK1 IAM 6 3HK1 IAM 6 -0.032 3.288 -9.963 61 1HK2 IAM 6 1HK2 IAM 6 -2.553 3.983 -7.328 62 2HK2 IAM 6 2HK2 IAM 6 -2.019 5.131 -8.532 63 3HK2 IAM 6 3HK2 IAM 6 -2.345 3.476 -8.986 64 H THR 7 H THR 7 1.073 3.489 -0.143 65 HA THR 7 HA THR 7 -0.954 5.319 0.857 66 HB THR 7 HB THR 7 -0.858 5.601 -1.668 67 HG1 THR 7 HG1 THR 7 -3.091 4.144 -0.435 68 1HG2 THR 7 1HG2 THR 7 -2.129 3.552 -2.791 69 2HG2 THR 7 2HG2 THR 7 -0.357 3.500 -2.641 70 3HG2 THR 7 3HG2 THR 7 -1.374 2.615 -1.480 71 H IYR 8 H IYR 8 -3.092 3.457 -0.041 72 HA IYR 8 HA IYR 8 -3.326 1.816 2.222 73 1HB IYR 8 1HB IYR 8 -4.929 0.568 0.611 74 2HB IYR 8 2HB IYR 8 -5.258 2.265 0.814 75 HD IYR 8 HD IYR 8 -5.900 3.422 -1.057 76 HF IYR 8 HF IYR 8 -5.062 3.130 -5.445 77 HG IYR 8 HG IYR 8 -3.062 0.580 -3.977 78 HH IYR 8 HH IYR 8 -3.070 0.210 -1.523 79 H THR 9 H THR 9 -3.545 -0.639 2.084 80 HA THR 9 HA THR 9 -1.290 -1.761 0.559 81 HB THR 9 HB THR 9 -0.561 -2.934 2.529 82 HG1 THR 9 HG1 THR 9 -3.117 -1.925 3.566 83 1HG2 THR 9 1HG2 THR 9 -0.797 -1.099 4.441 84 2HG2 THR 9 2HG2 THR 9 0.210 -0.748 3.017 85 3HG2 THR 9 3HG2 THR 9 -1.441 -0.089 3.123 86 H SER 10 H SER 10 -1.473 -4.020 0.008 87 HA SER 10 HA SER 10 -4.310 -4.908 -0.021 88 1HB SER 10 1HB SER 10 -2.943 -4.165 -2.251 89 2HB SER 10 2HB SER 10 -2.261 -5.778 -2.125 90 HG SER 10 HG SER 10 -4.430 -6.597 -2.117 91 H CYS 11 H CYS 11 -0.999 -6.326 -0.566 92 HA CYS 11 HA CYS 11 -1.697 -8.836 0.283 93 1HB CYS 11 1HB CYS 11 0.827 -7.344 -0.101 94 2HB CYS 11 2HB CYS 11 0.931 -8.729 0.969 Start of MODEL 7 1 1H CYS 1 1H CYS 1 5.144 -9.464 -2.494 2 2H CYS 1 2H CYS 1 6.169 -8.231 -1.986 3 HA CYS 1 HA CYS 1 4.282 -7.645 -3.452 4 1HB CYS 1 1HB CYS 1 2.844 -8.982 -1.481 5 2HB CYS 1 2HB CYS 1 2.506 -7.291 -1.170 6 H LYS 2 H LYS 2 2.758 -5.546 -1.998 7 HA LYS 2 HA LYS 2 4.928 -4.047 -0.733 8 1HB LYS 2 1HB LYS 2 3.428 -3.335 -3.219 9 2HB LYS 2 2HB LYS 2 3.800 -2.047 -2.091 10 1HG LYS 2 1HG LYS 2 5.940 -4.014 -2.988 11 2HG LYS 2 2HG LYS 2 5.552 -2.598 -3.946 12 1HD LYS 2 1HD LYS 2 5.804 -1.497 -1.412 13 2HD LYS 2 2HD LYS 2 6.988 -2.786 -1.349 14 1HE LYS 2 1HE LYS 2 8.332 -1.837 -2.995 15 2HE LYS 2 2HE LYS 2 6.978 -1.118 -3.845 16 1HZ LYS 2 1HZ LYS 2 7.982 0.703 -2.829 17 2HZ LYS 2 2HZ LYS 2 6.828 0.365 -1.733 18 H PHE 3 H PHE 3 3.326 -5.273 0.930 19 HA PHE 3 HA PHE 3 0.821 -4.590 1.463 20 1HB PHE 3 1HB PHE 3 1.937 -5.971 3.053 21 2HB PHE 3 2HB PHE 3 3.352 -4.936 3.094 22 HD1 PHE 3 HD1 PHE 3 3.710 -4.234 5.256 23 HD2 PHE 3 HD2 PHE 3 -0.263 -4.262 3.764 24 HE1 PHE 3 HE1 PHE 3 2.899 -3.204 7.397 25 HE2 PHE 3 HE2 PHE 3 -1.074 -3.231 5.904 26 HZ PHE 3 HZ PHE 3 0.516 -2.717 7.695 27 H PHE 4 H PHE 4 3.372 -2.747 3.252 28 HA PHE 4 HA PHE 4 1.613 -0.551 3.585 29 1HB PHE 4 1HB PHE 4 4.105 -1.604 4.573 30 2HB PHE 4 2HB PHE 4 4.492 -0.018 3.937 31 HD1 PHE 4 HD1 PHE 4 4.276 -1.277 6.881 32 HD2 PHE 4 HD2 PHE 4 1.947 1.423 4.579 33 HE1 PHE 4 HE1 PHE 4 3.416 -0.220 8.990 34 HE2 PHE 4 HE2 PHE 4 1.089 2.481 6.688 35 HZ PHE 4 HZ PHE 4 1.833 1.645 8.867 36 H DTR 5 H DTR 5 3.539 1.617 3.280 37 HA DTR 5 HA DTR 5 4.497 1.673 0.642 38 1HB DTR 5 1HB DTR 5 4.535 4.237 1.330 39 2HB DTR 5 2HB DTR 5 3.902 3.681 2.868 40 HD1 DTR 5 HD1 DTR 5 5.644 1.473 3.887 41 HE1 DTR 5 HE1 DTR 5 8.262 1.526 4.212 42 HZ2 DTR 5 HZ2 DTR 5 10.351 3.110 3.085 43 HH2 DTR 5 HH2 DTR 5 10.749 4.991 1.454 44 HZ3 DTR 5 HZ3 DTR 5 8.860 6.002 0.279 45 HE3 DTR 5 HE3 DTR 5 6.499 5.261 0.609 46 H IAM 6 H IAM 6 3.629 3.926 -0.630 47 HA IAM 6 HA IAM 6 2.017 4.789 -1.861 48 HB IAM 6 HB IAM 6 0.965 1.971 -1.268 49 HD1 IAM 6 HD1 IAM 6 -0.785 1.002 -2.730 50 HE1 IAM 6 HE1 IAM 6 -3.014 1.426 -3.807 51 HE2 IAM 6 HE2 IAM 6 -2.270 5.604 -3.695 52 HD2 IAM 6 HD2 IAM 6 -0.042 5.178 -2.619 53 1HT IAM 6 1HT IAM 6 -4.193 3.242 -5.382 54 2HT IAM 6 2HT IAM 6 -4.229 4.844 -4.680 55 HH IAM 6 HH IAM 6 -5.154 3.620 -2.551 56 HI IAM 6 HI IAM 6 -5.993 1.813 -4.702 57 1HB IAM 6 1HB IAM 6 1.774 2.507 -2.726 58 1HK1 IAM 6 1HK1 IAM 6 -7.643 4.305 -4.227 59 2HK1 IAM 6 2HK1 IAM 6 -6.746 3.948 -5.685 60 3HK1 IAM 6 3HK1 IAM 6 -8.114 2.957 -5.237 61 1HK2 IAM 6 1HK2 IAM 6 -6.474 1.337 -2.328 62 2HK2 IAM 6 2HK2 IAM 6 -7.481 2.761 -2.245 63 3HK2 IAM 6 3HK2 IAM 6 -7.954 1.415 -3.254 64 H THR 7 H THR 7 -0.265 2.735 0.021 65 HA THR 7 HA THR 7 -1.017 4.840 1.787 66 HB THR 7 HB THR 7 -2.001 5.626 -0.413 67 HG1 THR 7 HG1 THR 7 -3.771 4.534 1.660 68 1HG2 THR 7 1HG2 THR 7 -4.227 4.250 -0.896 69 2HG2 THR 7 2HG2 THR 7 -2.701 3.731 -1.651 70 3HG2 THR 7 3HG2 THR 7 -3.307 2.893 -0.201 71 H IYR 8 H IYR 8 -3.811 3.838 1.978 72 HA IYR 8 HA IYR 8 -3.670 2.004 4.012 73 1HB IYR 8 1HB IYR 8 -5.676 1.867 1.660 74 2HB IYR 8 2HB IYR 8 -5.984 1.444 3.319 75 HD IYR 8 HD IYR 8 -6.394 3.979 0.899 76 HF IYR 8 HF IYR 8 -7.823 7.732 2.879 77 HG IYR 8 HG IYR 8 -6.674 5.688 5.553 78 HH IYR 8 HH IYR 8 -5.739 3.430 5.120 79 H THR 9 H THR 9 -2.112 0.371 3.893 80 HA THR 9 HA THR 9 -1.132 -1.518 3.197 81 HB THR 9 HB THR 9 -3.317 -2.279 4.183 82 HG1 THR 9 HG1 THR 9 -2.352 -3.589 1.738 83 1HG2 THR 9 1HG2 THR 9 -4.888 -3.232 2.258 84 2HG2 THR 9 2HG2 THR 9 -5.086 -1.545 2.788 85 3HG2 THR 9 3HG2 THR 9 -4.184 -1.909 1.297 86 H SER 10 H SER 10 -2.426 -3.299 1.044 87 HA SER 10 HA SER 10 -2.471 -1.977 -1.413 88 1HB SER 10 1HB SER 10 0.098 -1.718 -0.399 89 2HB SER 10 2HB SER 10 0.272 -3.266 -1.211 90 HG SER 10 HG SER 10 -0.526 -2.245 -3.134 91 H CYS 11 H CYS 11 -0.552 -4.868 -0.322 92 HA CYS 11 HA CYS 11 -1.860 -6.463 -2.258 93 1HB CYS 11 1HB CYS 11 0.513 -6.626 -0.994 94 2HB CYS 11 2HB CYS 11 -0.406 -7.753 -0.016 Start of MODEL 8 1 1H CYS 1 1H CYS 1 3.739 -8.592 -0.454 2 2H CYS 1 2H CYS 1 3.063 -9.333 -1.804 3 HA CYS 1 HA CYS 1 4.485 -7.552 -3.007 4 1HB CYS 1 1HB CYS 1 1.965 -6.376 -2.088 5 2HB CYS 1 2HB CYS 1 2.525 -6.731 -3.710 6 H LYS 2 H LYS 2 3.265 -4.933 -2.214 7 HA LYS 2 HA LYS 2 4.878 -4.426 0.191 8 1HB LYS 2 1HB LYS 2 4.552 -2.738 -2.303 9 2HB LYS 2 2HB LYS 2 5.248 -2.138 -0.812 10 1HG LYS 2 1HG LYS 2 6.414 -4.725 -1.648 11 2HG LYS 2 2HG LYS 2 6.632 -3.468 -2.849 12 1HD LYS 2 1HD LYS 2 7.156 -2.369 -0.206 13 2HD LYS 2 2HD LYS 2 8.095 -3.833 -0.419 14 1HE LYS 2 1HE LYS 2 8.684 -2.801 -2.789 15 2HE LYS 2 2HE LYS 2 8.162 -1.290 -2.071 16 1HZ LYS 2 1HZ LYS 2 10.411 -1.374 -1.530 17 2HZ LYS 2 2HZ LYS 2 9.766 -1.988 -0.167 18 H PHE 3 H PHE 3 2.531 -5.204 0.943 19 HA PHE 3 HA PHE 3 0.268 -3.848 0.697 20 1HB PHE 3 1HB PHE 3 -0.167 -4.574 3.010 21 2HB PHE 3 2HB PHE 3 0.902 -5.763 2.293 22 HD1 PHE 3 HD1 PHE 3 0.584 -3.147 4.799 23 HD2 PHE 3 HD2 PHE 3 3.270 -5.863 2.951 24 HE1 PHE 3 HE1 PHE 3 2.216 -2.811 6.677 25 HE2 PHE 3 HE2 PHE 3 4.902 -5.529 4.828 26 HZ PHE 3 HZ PHE 3 4.356 -4.005 6.669 27 H PHE 4 H PHE 4 3.056 -2.790 2.757 28 HA PHE 4 HA PHE 4 1.694 -0.432 3.590 29 1HB PHE 4 1HB PHE 4 4.134 -1.963 4.084 30 2HB PHE 4 2HB PHE 4 4.596 -0.298 3.790 31 HD1 PHE 4 HD1 PHE 4 4.697 -2.050 6.387 32 HD2 PHE 4 HD2 PHE 4 2.055 0.957 4.979 33 HE1 PHE 4 HE1 PHE 4 4.099 -1.467 8.755 34 HE2 PHE 4 HE2 PHE 4 1.458 1.543 7.346 35 HZ PHE 4 HZ PHE 4 2.486 0.322 9.206 36 H DTR 5 H DTR 5 3.818 1.492 3.385 37 HA DTR 5 HA DTR 5 4.856 1.819 0.874 38 1HB DTR 5 1HB DTR 5 4.715 4.332 1.671 39 2HB DTR 5 2HB DTR 5 3.889 3.704 3.083 40 HD1 DTR 5 HD1 DTR 5 5.626 1.326 4.022 41 HE1 DTR 5 HE1 DTR 5 8.136 1.513 4.815 42 HZ2 DTR 5 HZ2 DTR 5 10.205 3.424 4.358 43 HH2 DTR 5 HH2 DTR 5 10.668 5.592 3.156 44 HZ3 DTR 5 HZ3 DTR 5 8.901 6.656 1.843 45 HE3 DTR 5 HE3 DTR 5 6.609 5.695 1.618 46 H IAM 6 H IAM 6 4.028 4.059 -0.413 47 HA IAM 6 HA IAM 6 2.526 4.894 -1.792 48 HB IAM 6 HB IAM 6 1.545 2.020 -1.384 49 HD1 IAM 6 HD1 IAM 6 0.629 5.207 -2.941 50 HE1 IAM 6 HE1 IAM 6 -1.515 5.567 -4.197 51 HE2 IAM 6 HE2 IAM 6 -2.299 1.399 -4.051 52 HD2 IAM 6 HD2 IAM 6 -0.155 1.040 -2.795 53 1HT IAM 6 1HT IAM 6 -3.382 4.736 -5.306 54 2HT IAM 6 2HT IAM 6 -4.169 3.529 -4.313 55 HH IAM 6 HH IAM 6 -3.978 1.957 -6.074 56 HI IAM 6 HI IAM 6 -2.537 4.150 -7.473 57 1HB IAM 6 1HB IAM 6 2.448 2.645 -2.750 58 1HK1 IAM 6 1HK1 IAM 6 -3.326 1.383 -8.408 59 2HK1 IAM 6 2HK1 IAM 6 -4.255 2.841 -8.668 60 3HK1 IAM 6 3HK1 IAM 6 -2.694 2.652 -9.430 61 1HK2 IAM 6 1HK2 IAM 6 -0.706 2.969 -6.311 62 2HK2 IAM 6 2HK2 IAM 6 -1.231 1.459 -7.017 63 3HK2 IAM 6 3HK2 IAM 6 -0.598 2.728 -8.038 64 H THR 7 H THR 7 0.175 2.705 -0.145 65 HA THR 7 HA THR 7 -0.887 4.876 1.425 66 HB THR 7 HB THR 7 -1.839 5.254 -0.891 67 HG1 THR 7 HG1 THR 7 -3.562 4.159 1.220 68 1HG2 THR 7 1HG2 THR 7 -3.816 3.522 -1.302 69 2HG2 THR 7 2HG2 THR 7 -2.190 3.149 -1.919 70 3HG2 THR 7 3HG2 THR 7 -2.761 2.402 -0.407 71 H IYR 8 H IYR 8 -3.534 3.485 1.580 72 HA IYR 8 HA IYR 8 -3.213 1.922 3.841 73 1HB IYR 8 1HB IYR 8 -5.388 0.831 2.916 74 2HB IYR 8 2HB IYR 8 -5.436 2.560 3.112 75 HD IYR 8 HD IYR 8 -6.438 3.805 1.464 76 HF IYR 8 HF IYR 8 -7.169 3.295 -2.923 77 HG IYR 8 HG IYR 8 -5.220 0.466 -2.003 78 HH IYR 8 HH IYR 8 -4.467 0.145 0.340 79 H THR 9 H THR 9 -3.764 -0.484 3.986 80 HA THR 9 HA THR 9 -1.680 -1.909 2.657 81 HB THR 9 HB THR 9 -2.315 -3.661 4.175 82 HG1 THR 9 HG1 THR 9 -4.834 -2.150 4.206 83 1HG2 THR 9 1HG2 THR 9 -3.252 -2.329 6.279 84 2HG2 THR 9 2HG2 THR 9 -1.598 -2.006 5.710 85 3HG2 THR 9 3HG2 THR 9 -2.920 -0.896 5.276 86 H SER 10 H SER 10 -1.701 -3.207 0.901 87 HA SER 10 HA SER 10 -4.186 -4.269 -0.124 88 1HB SER 10 1HB SER 10 -3.948 -1.732 -0.919 89 2HB SER 10 2HB SER 10 -2.681 -2.325 -1.979 90 HG SER 10 HG SER 10 -4.233 -3.809 -2.856 91 H CYS 11 H CYS 11 -0.897 -3.322 -1.380 92 HA CYS 11 HA CYS 11 0.331 -5.697 -1.119 93 1HB CYS 11 1HB CYS 11 -1.796 -6.003 -3.007 94 2HB CYS 11 2HB CYS 11 -0.274 -6.130 -3.867 Start of MODEL 9 1 1H CYS 1 1H CYS 1 2.976 -7.042 -5.031 2 2H CYS 1 2H CYS 1 4.121 -6.406 -3.976 3 HA CYS 1 HA CYS 1 1.324 -6.605 -3.768 4 1HB CYS 1 1HB CYS 1 2.809 -7.225 -1.226 5 2HB CYS 1 2HB CYS 1 1.084 -7.274 -1.528 6 H LYS 2 H LYS 2 1.501 -5.345 -1.022 7 HA LYS 2 HA LYS 2 3.247 -3.078 -1.452 8 1HB LYS 2 1HB LYS 2 0.703 -2.908 -2.476 9 2HB LYS 2 2HB LYS 2 0.482 -2.235 -0.874 10 1HG LYS 2 1HG LYS 2 1.113 -0.367 -2.208 11 2HG LYS 2 2HG LYS 2 2.575 -0.787 -1.339 12 1HD LYS 2 1HD LYS 2 3.682 -1.176 -3.278 13 2HD LYS 2 2HD LYS 2 2.481 -2.350 -3.777 14 1HE LYS 2 1HE LYS 2 1.013 -0.427 -4.560 15 2HE LYS 2 2HE LYS 2 2.322 0.675 -4.183 16 1HZ LYS 2 1HZ LYS 2 2.689 0.174 -6.413 17 2HZ LYS 2 2HZ LYS 2 3.688 -0.903 -5.710 18 H PHE 3 H PHE 3 4.215 -4.273 0.401 19 HA PHE 3 HA PHE 3 3.133 -4.981 2.708 20 1HB PHE 3 1HB PHE 3 5.462 -5.088 2.812 21 2HB PHE 3 2HB PHE 3 5.646 -3.700 1.757 22 HD1 PHE 3 HD1 PHE 3 5.553 -1.400 2.727 23 HD2 PHE 3 HD2 PHE 3 5.636 -4.867 5.173 24 HE1 PHE 3 HE1 PHE 3 6.252 0.002 4.690 25 HE2 PHE 3 HE2 PHE 3 6.333 -3.466 7.136 26 HZ PHE 3 HZ PHE 3 6.635 -1.049 6.870 27 H PHE 4 H PHE 4 3.856 -1.552 1.787 28 HA PHE 4 HA PHE 4 1.674 -0.454 2.981 29 1HB PHE 4 1HB PHE 4 3.665 -1.399 4.877 30 2HB PHE 4 2HB PHE 4 3.729 0.352 4.901 31 HD1 PHE 4 HD1 PHE 4 2.663 -1.916 6.920 32 HD2 PHE 4 HD2 PHE 4 0.854 0.991 4.414 33 HE1 PHE 4 HE1 PHE 4 0.657 -1.863 8.430 34 HE2 PHE 4 HE2 PHE 4 -1.152 1.046 5.923 35 HZ PHE 4 HZ PHE 4 -1.226 -0.384 7.912 36 H DTR 5 H DTR 5 2.818 1.939 4.139 37 HA DTR 5 HA DTR 5 4.884 2.927 2.526 38 1HB DTR 5 1HB DTR 5 3.894 5.140 3.545 39 2HB DTR 5 2HB DTR 5 2.686 4.115 4.295 40 HD1 DTR 5 HD1 DTR 5 3.828 2.117 6.023 41 HE1 DTR 5 HE1 DTR 5 5.817 2.293 7.749 42 HZ2 DTR 5 HZ2 DTR 5 8.002 4.104 8.051 43 HH2 DTR 5 HH2 DTR 5 9.031 6.157 7.010 44 HZ3 DTR 5 HZ3 DTR 5 8.001 7.165 5.035 45 HE3 DTR 5 HE3 DTR 5 5.940 6.255 3.963 46 H IAM 6 H IAM 6 4.229 5.244 1.323 47 HA IAM 6 HA IAM 6 3.321 6.152 -0.466 48 HB IAM 6 HB IAM 6 2.947 3.160 -0.860 49 HD1 IAM 6 HD1 IAM 6 1.665 6.327 -2.187 50 HE1 IAM 6 HE1 IAM 6 -0.064 6.466 -4.004 51 HE2 IAM 6 HE2 IAM 6 0.297 2.290 -4.665 52 HD2 IAM 6 HD2 IAM 6 2.026 2.152 -2.849 53 1HT IAM 6 1HT IAM 6 -1.085 5.474 -5.913 54 2HT IAM 6 2HT IAM 6 -1.992 4.187 -5.151 55 HH IAM 6 HH IAM 6 0.328 3.378 -6.855 56 HI IAM 6 HI IAM 6 -2.482 2.523 -6.790 57 1HB IAM 6 1HB IAM 6 3.981 4.247 -1.763 58 1HK1 IAM 6 1HK1 IAM 6 -0.344 2.090 -8.886 59 2HK1 IAM 6 2HK1 IAM 6 -0.681 1.016 -7.551 60 3HK1 IAM 6 3HK1 IAM 6 -1.870 1.242 -8.810 61 1HK2 IAM 6 1HK2 IAM 6 -2.757 4.723 -7.875 62 2HK2 IAM 6 2HK2 IAM 6 -1.571 4.280 -9.077 63 3HK2 IAM 6 3HK2 IAM 6 -3.096 3.432 -9.003 64 H THR 7 H THR 7 0.935 3.445 -0.179 65 HA THR 7 HA THR 7 -1.052 5.288 0.870 66 HB THR 7 HB THR 7 -1.048 5.545 -1.663 67 HG1 THR 7 HG1 THR 7 -3.244 4.132 -0.321 68 1HG2 THR 7 1HG2 THR 7 -2.390 3.500 -2.708 69 2HG2 THR 7 2HG2 THR 7 -0.614 3.426 -2.632 70 3HG2 THR 7 3HG2 THR 7 -1.592 2.567 -1.418 71 H IYR 8 H IYR 8 -3.225 3.422 0.066 72 HA IYR 8 HA IYR 8 -3.386 1.803 2.346 73 1HB IYR 8 1HB IYR 8 -4.451 1.121 -0.475 74 2HB IYR 8 2HB IYR 8 -5.190 0.724 1.051 75 HD IYR 8 HD IYR 8 -5.348 2.928 -1.679 76 HF IYR 8 HF IYR 8 -8.039 6.369 -0.701 77 HG IYR 8 HG IYR 8 -7.356 4.844 2.440 78 HH IYR 8 HH IYR 8 -5.895 2.844 2.592 79 H THR 9 H THR 9 -3.577 -0.647 2.275 80 HA THR 9 HA THR 9 -1.266 -1.738 0.805 81 HB THR 9 HB THR 9 -0.851 -3.127 2.782 82 HG1 THR 9 HG1 THR 9 -3.314 -1.780 3.646 83 1HG2 THR 9 1HG2 THR 9 -0.970 -1.266 4.679 84 2HG2 THR 9 2HG2 THR 9 0.169 -1.060 3.329 85 3HG2 THR 9 3HG2 THR 9 -1.382 -0.187 3.325 86 H SER 10 H SER 10 -1.422 -3.852 -0.049 87 HA SER 10 HA SER 10 -4.229 -4.806 -0.264 88 1HB SER 10 1HB SER 10 -2.980 -5.814 -2.503 89 2HB SER 10 2HB SER 10 -3.910 -4.325 -2.517 90 HG SER 10 HG SER 10 -1.923 -3.188 -2.144 91 H CYS 11 H CYS 11 -0.993 -6.175 -1.161 92 HA CYS 11 HA CYS 11 -1.724 -8.450 0.530 93 1HB CYS 11 1HB CYS 11 -1.633 -9.442 -1.502 94 2HB CYS 11 2HB CYS 11 -0.531 -8.255 -2.172 Start of MODEL 10 1 1H CYS 1 1H CYS 1 1.491 -8.120 -2.730 2 2H CYS 1 2H CYS 1 0.218 -8.465 -1.688 3 HA CYS 1 HA CYS 1 0.942 -6.805 -0.187 4 1HB CYS 1 1HB CYS 1 1.957 -9.325 -0.506 5 2HB CYS 1 2HB CYS 1 3.424 -8.366 -0.476 6 H LYS 2 H LYS 2 3.872 -6.473 0.189 7 HA LYS 2 HA LYS 2 5.237 -4.728 -0.130 8 1HB LYS 2 1HB LYS 2 5.196 -6.258 -2.715 9 2HB LYS 2 2HB LYS 2 6.200 -4.831 -2.572 10 1HG LYS 2 1HG LYS 2 7.658 -6.535 -1.854 11 2HG LYS 2 2HG LYS 2 7.053 -5.904 -0.336 12 1HD LYS 2 1HD LYS 2 6.067 -7.881 0.198 13 2HD LYS 2 2HD LYS 2 5.254 -7.971 -1.352 14 1HE LYS 2 1HE LYS 2 6.902 -9.291 -2.305 15 2HE LYS 2 2HE LYS 2 8.197 -8.503 -1.425 16 1HZ LYS 2 1HZ LYS 2 8.054 -10.574 -0.402 17 2HZ LYS 2 2HZ LYS 2 7.131 -9.692 0.608 18 H PHE 3 H PHE 3 2.809 -3.621 0.083 19 HA PHE 3 HA PHE 3 2.866 -1.601 -2.036 20 1HB PHE 3 1HB PHE 3 0.978 -3.429 -2.139 21 2HB PHE 3 2HB PHE 3 0.371 -2.735 -0.649 22 HD1 PHE 3 HD1 PHE 3 1.692 -0.044 -2.347 23 HD2 PHE 3 HD2 PHE 3 -1.594 -2.723 -2.529 24 HE1 PHE 3 HE1 PHE 3 0.386 1.647 -3.666 25 HE2 PHE 3 HE2 PHE 3 -2.899 -1.034 -3.849 26 HZ PHE 3 HZ PHE 3 -1.894 1.132 -4.401 27 H PHE 4 H PHE 4 3.486 -2.213 1.115 28 HA PHE 4 HA PHE 4 1.944 -0.485 2.597 29 1HB PHE 4 1HB PHE 4 4.232 -0.359 3.925 30 2HB PHE 4 2HB PHE 4 3.499 -1.937 3.718 31 HD1 PHE 4 HD1 PHE 4 4.784 -3.665 2.879 32 HD2 PHE 4 HD2 PHE 4 5.946 0.331 2.047 33 HE1 PHE 4 HE1 PHE 4 6.888 -4.503 1.792 34 HE2 PHE 4 HE2 PHE 4 8.048 -0.506 0.959 35 HZ PHE 4 HZ PHE 4 8.494 -2.913 0.846 36 H DTR 5 H DTR 5 3.501 1.436 3.819 37 HA DTR 5 HA DTR 5 5.006 3.036 2.166 38 1HB DTR 5 1HB DTR 5 4.205 4.796 3.947 39 2HB DTR 5 2HB DTR 5 3.201 3.513 4.594 40 HD1 DTR 5 HD1 DTR 5 5.093 1.072 4.807 41 HE1 DTR 5 HE1 DTR 5 7.256 0.972 6.317 42 HZ2 DTR 5 HZ2 DTR 5 8.960 2.964 7.445 43 HH2 DTR 5 HH2 DTR 5 9.264 5.463 7.581 44 HZ3 DTR 5 HZ3 DTR 5 7.689 6.944 6.440 45 HE3 DTR 5 HE3 DTR 5 5.749 6.103 5.112 46 H IAM 6 H IAM 6 4.046 5.544 1.850 47 HA IAM 6 HA IAM 6 2.745 6.839 0.632 48 HB IAM 6 HB IAM 6 2.261 4.072 -0.590 49 HD1 IAM 6 HD1 IAM 6 1.278 3.881 -2.845 50 HE1 IAM 6 HE1 IAM 6 -0.567 4.674 -4.354 51 HE2 IAM 6 HE2 IAM 6 -0.860 8.262 -2.107 52 HD2 IAM 6 HD2 IAM 6 0.985 7.469 -0.600 53 1HT IAM 6 1HT IAM 6 -2.560 7.694 -3.708 54 2HT IAM 6 2HT IAM 6 -2.534 6.160 -4.548 55 HH IAM 6 HH IAM 6 -0.673 7.150 -6.008 56 HI IAM 6 HI IAM 6 -2.708 9.024 -6.254 57 1HB IAM 6 1HB IAM 6 3.310 5.330 -1.210 58 1HK1 IAM 6 1HK1 IAM 6 0.250 9.655 -6.253 59 2HK1 IAM 6 2HK1 IAM 6 -0.653 9.050 -7.621 60 3HK1 IAM 6 3HK1 IAM 6 -0.993 10.642 -6.986 61 1HK2 IAM 6 1HK2 IAM 6 -2.554 9.467 -3.831 62 2HK2 IAM 6 2HK2 IAM 6 -0.874 9.901 -4.015 63 3HK2 IAM 6 3HK2 IAM 6 -2.115 10.888 -4.747 64 H THR 7 H THR 7 0.585 3.946 0.451 65 HA THR 7 HA THR 7 -1.219 5.126 2.386 66 HB THR 7 HB THR 7 -1.740 6.251 0.175 67 HG1 THR 7 HG1 THR 7 -3.559 4.195 1.219 68 1HG2 THR 7 1HG2 THR 7 -3.144 4.568 -1.334 69 2HG2 THR 7 2HG2 THR 7 -1.385 4.689 -1.572 70 3HG2 THR 7 3HG2 THR 7 -2.065 3.340 -0.629 71 H IYR 8 H IYR 8 -3.437 3.427 1.259 72 HA IYR 8 HA IYR 8 -3.250 1.165 2.850 73 1HB IYR 8 1HB IYR 8 -4.637 2.021 0.257 74 2HB IYR 8 2HB IYR 8 -4.664 0.317 0.608 75 HD IYR 8 HD IYR 8 -6.391 3.343 1.100 76 HF IYR 8 HF IYR 8 -9.556 2.792 4.218 77 HG IYR 8 HG IYR 8 -7.447 -0.051 4.568 78 HH IYR 8 HH IYR 8 -5.465 -0.355 3.106 79 H THR 9 H THR 9 -3.276 -1.158 1.934 80 HA THR 9 HA THR 9 -1.025 -1.483 0.063 81 HB THR 9 HB THR 9 -0.182 -3.274 1.531 82 HG1 THR 9 HG1 THR 9 -2.568 -2.467 3.041 83 1HG2 THR 9 1HG2 THR 9 -0.134 -1.939 3.832 84 2HG2 THR 9 2HG2 THR 9 0.748 -1.288 2.430 85 3HG2 THR 9 3HG2 THR 9 -0.848 -0.628 2.863 86 H SER 10 H SER 10 -0.974 -4.105 -0.392 87 HA SER 10 HA SER 10 -3.639 -4.569 -1.576 88 1HB SER 10 1HB SER 10 -1.939 -4.649 -3.262 89 2HB SER 10 2HB SER 10 -0.769 -5.457 -2.233 90 HG SER 10 HG SER 10 -2.122 -7.338 -2.322 91 H CYS 11 H CYS 11 -0.990 -6.581 -0.082 92 HA CYS 11 HA CYS 11 -2.745 -8.670 0.501 93 1HB CYS 11 1HB CYS 11 -0.949 -9.617 1.781 94 2HB CYS 11 2HB CYS 11 -0.324 -8.945 0.287
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