NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
7759 | 1kz5 | 5291 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H ARG 1 1HT ARG 1 2.032 6.232 -5.096 2 2H ARG 1 2HT ARG 1 2.804 7.162 -6.289 3 3H ARG 1 3HT ARG 1 1.289 7.637 -5.683 4 HA ARG 1 HA ARG 1 3.919 7.730 -4.316 5 1HB ARG 1 2HB ARG 1 2.952 9.528 -5.886 6 2HB ARG 1 1HB ARG 1 1.734 9.789 -4.644 7 1HG ARG 1 2HG ARG 1 3.448 11.368 -4.176 8 2HG ARG 1 1HG ARG 1 3.663 10.069 -3.005 9 1HD ARG 1 2HD ARG 1 5.851 10.451 -3.850 10 2HD ARG 1 1HD ARG 1 5.267 9.040 -4.750 11 HE ARG 1 HE ARG 1 4.394 11.219 -6.244 12 1HH1 ARG 1 1HH2 ARG 1 6.843 9.094 -6.418 13 2HH1 ARG 1 2HH2 ARG 1 8.023 10.158 -7.107 14 1HH2 ARG 1 1HH1 ARG 1 6.154 13.024 -6.547 15 2HH2 ARG 1 2HH1 ARG 1 7.633 12.383 -7.179 16 H GLN 2 H GLN 2 0.430 7.450 -3.902 17 HA GLN 2 HA GLN 2 0.228 8.162 -1.144 18 1HB GLN 2 2HB GLN 2 -1.291 6.474 -3.105 19 2HB GLN 2 1HB GLN 2 -1.766 6.452 -1.403 20 1HG GLN 2 2HG GLN 2 -3.048 8.174 -2.498 21 2HG GLN 2 1HG GLN 2 -1.851 8.966 -1.472 22 1HE2 GLN 2 1HE2 GLN 2 -1.129 10.785 -2.585 23 2HE2 GLN 2 2HE2 GLN 2 -0.682 10.805 -4.231 24 H ILE 3 H ILE 3 0.886 5.043 -2.711 25 HA ILE 3 HA ILE 3 1.462 2.969 -1.815 26 HB ILE 3 HB ILE 3 3.332 4.807 -1.898 27 1HG1 ILE 3 2HG1 ILE 3 3.546 2.430 -2.313 28 2HG1 ILE 3 1HG1 ILE 3 4.925 3.005 -1.357 29 1HG2 ILE 3 1HG2 ILE 3 4.024 3.982 0.842 30 2HG2 ILE 3 2HG2 ILE 3 2.671 5.106 0.760 31 3HG2 ILE 3 3HG2 ILE 3 4.224 5.546 0.057 32 1HD1 ILE 3 1HD1 ILE 3 4.112 0.937 -0.358 33 2HD1 ILE 3 2HD1 ILE 3 2.464 1.559 -0.324 34 3HD1 ILE 3 3HD1 ILE 3 3.699 2.274 0.713 35 H LYS 4 H LYS 4 -0.817 3.922 -0.335 36 HA LYS 4 HA LYS 4 -0.114 2.994 2.417 37 1HB LYS 4 2HB LYS 4 -2.294 4.834 1.381 38 2HB LYS 4 1HB LYS 4 -2.101 4.342 3.055 39 1HG LYS 4 2HG LYS 4 0.429 5.164 2.337 40 2HG LYS 4 1HG LYS 4 -0.629 6.352 1.573 41 1HD LYS 4 2HD LYS 4 -1.004 7.340 3.560 42 2HD LYS 4 1HD LYS 4 -1.606 5.822 4.224 43 1HE LYS 4 2HE LYS 4 0.403 5.315 5.231 44 2HE LYS 4 1HE LYS 4 1.357 6.082 3.946 45 1HZ LYS 4 1HZ LYS 4 -0.250 7.458 6.032 46 2HZ LYS 4 2HZ LYS 4 0.476 8.245 4.713 47 3HZ LYS 4 3HZ LYS 4 1.439 7.475 5.882 48 H ILE 5 H ILE 5 -2.608 2.941 -0.122 49 HA ILE 5 HA ILE 5 -4.097 0.721 1.054 50 HB ILE 5 HB ILE 5 -3.960 1.797 -1.788 51 1HG1 ILE 5 2HG1 ILE 5 -6.074 2.530 0.213 52 2HG1 ILE 5 1HG1 ILE 5 -4.538 3.395 0.190 53 1HG2 ILE 5 1HG2 ILE 5 -5.853 0.571 -2.261 54 2HG2 ILE 5 2HG2 ILE 5 -6.424 0.615 -0.593 55 3HG2 ILE 5 3HG2 ILE 5 -5.133 -0.495 -1.054 56 1HD1 ILE 5 1HD1 ILE 5 -6.603 3.203 -1.991 57 2HD1 ILE 5 2HD1 ILE 5 -4.932 3.636 -2.352 58 3HD1 ILE 5 3HD1 ILE 5 -5.893 4.649 -1.275 59 H TRP 6 H TRP 6 -1.518 1.236 -1.244 60 HA TRP 6 HA TRP 6 -1.218 -1.386 -2.336 61 1HB TRP 6 2HB TRP 6 0.671 0.916 -1.765 62 2HB TRP 6 1HB TRP 6 1.145 -0.487 -2.710 63 HD1 TRP 6 HD TRP 6 0.237 -0.721 -5.040 64 HE1 TRP 6 1HE TRP 6 -1.008 0.840 -6.669 65 HE3 TRP 6 3HE TRP 6 -1.090 2.900 -1.791 66 HZ2 TRP 6 2HZ TRP 6 -2.397 3.338 -6.568 67 HZ3 TRP 6 3HZ TRP 6 -2.384 4.883 -2.557 68 HH2 TRP 6 HH TRP 6 -3.035 5.106 -4.942 69 H PHE 7 H PHE 7 0.579 0.295 0.138 70 HA PHE 7 HA PHE 7 2.178 -1.774 1.182 71 1HB PHE 7 2HB PHE 7 2.399 0.551 1.849 72 2HB PHE 7 1HB PHE 7 0.753 0.574 2.476 73 HD1 PHE 7 1HD PHE 7 4.173 -0.712 3.035 74 HD2 PHE 7 2HD PHE 7 0.199 -0.368 4.627 75 HE1 PHE 7 1HE PHE 7 4.998 -1.464 5.251 76 HE2 PHE 7 2HE PHE 7 1.023 -1.120 6.843 77 HZ PHE 7 HZ PHE 7 3.422 -1.667 7.155 78 H ARG 8 H ARG 8 -1.246 -1.310 1.378 79 HA ARG 8 HA ARG 8 -1.643 -3.084 3.675 80 1HB ARG 8 2HB ARG 8 -2.775 -0.877 2.870 81 2HB ARG 8 1HB ARG 8 -3.720 -1.953 1.846 82 1HG ARG 8 2HG ARG 8 -4.914 -1.643 3.942 83 2HG ARG 8 1HG ARG 8 -4.260 -3.285 3.929 84 1HD ARG 8 2HD ARG 8 -3.056 -2.833 5.791 85 2HD ARG 8 1HD ARG 8 -2.250 -1.495 4.940 86 HE ARG 8 HE ARG 8 -4.510 -0.244 5.499 87 1HH1 ARG 8 1HH2 ARG 8 -2.219 -0.332 7.551 88 2HH1 ARG 8 2HH2 ARG 8 -3.097 -0.713 8.994 89 1HH2 ARG 8 1HH1 ARG 8 -5.953 -1.719 7.306 90 2HH2 ARG 8 2HH1 ARG 8 -5.212 -1.498 8.856 91 H LYS 9 H LYS 9 -1.461 -3.352 0.223 92 HA LYS 9 HA LYS 9 -3.147 -5.790 0.128 93 1HB LYS 9 2HB LYS 9 -1.800 -3.928 -1.807 94 2HB LYS 9 1HB LYS 9 -2.299 -5.530 -2.360 95 1HG LYS 9 2HG LYS 9 -4.155 -3.618 -0.925 96 2HG LYS 9 1HG LYS 9 -4.026 -3.700 -2.682 97 1HD LYS 9 2HD LYS 9 -4.569 -6.145 -2.553 98 2HD LYS 9 1HD LYS 9 -4.850 -5.948 -0.823 99 1HE LYS 9 2HE LYS 9 -6.841 -4.841 -1.139 100 2HE LYS 9 1HE LYS 9 -6.275 -4.039 -2.618 101 1HZ LYS 9 1HZ LYS 9 -7.046 -6.892 -2.311 102 2HZ LYS 9 2HZ LYS 9 -6.288 -6.260 -3.695 103 3HZ LYS 9 3HZ LYS 9 -7.834 -5.718 -3.248 104 H TRP 10 H TRP 10 0.052 -5.074 -1.318 105 HA TRP 10 HA TRP 10 0.870 -7.870 -0.948 106 1HB TRP 10 2HB TRP 10 2.460 -5.527 -2.018 107 2HB TRP 10 1HB TRP 10 2.617 -7.224 -2.456 108 HD1 TRP 10 HD TRP 10 1.894 -4.543 -4.289 109 HE1 TRP 10 1HE TRP 10 -0.120 -4.778 -5.880 110 HE3 TRP 10 3HE TRP 10 -0.504 -8.470 -2.158 111 HZ2 TRP 10 2HZ TRP 10 -2.440 -6.398 -6.215 112 HZ3 TRP 10 3HZ TRP 10 -2.614 -9.358 -3.109 113 HH2 TRP 10 HH TRP 10 -3.587 -8.320 -5.141 114 H LYS 11 H LYS 11 3.538 -5.837 -0.736 115 HA LYS 11 HA LYS 11 3.582 -5.430 2.152 116 1HB LYS 11 2HB LYS 11 5.687 -6.897 2.301 117 2HB LYS 11 1HB LYS 11 4.159 -7.762 2.143 118 1HG LYS 11 2HG LYS 11 5.459 -7.014 -0.406 119 2HG LYS 11 1HG LYS 11 6.313 -8.227 0.551 120 1HD LYS 11 2HD LYS 11 4.661 -9.789 0.295 121 2HD LYS 11 1HD LYS 11 3.379 -8.576 0.331 122 1HE LYS 11 2HE LYS 11 3.296 -9.196 -1.919 123 2HE LYS 11 1HE LYS 11 4.484 -7.880 -2.011 124 1HZ LYS 11 1HZ LYS 11 5.193 -10.720 -1.507 125 2HZ LYS 11 2HZ LYS 11 6.262 -9.432 -1.795 126 3HZ LYS 11 3HZ LYS 11 5.253 -9.995 -3.040 127 H LYS 12 H LYS 12 3.693 -3.827 -0.177 128 HA LYS 12 HA LYS 12 5.893 -3.085 -1.481 129 1HB LYS 12 2HB LYS 12 3.978 -1.394 0.124 130 2HB LYS 12 1HB LYS 12 5.143 -0.692 -0.994 131 1HG LYS 12 2HG LYS 12 3.132 -2.820 -1.766 132 2HG LYS 12 1HG LYS 12 2.898 -1.093 -2.035 133 1HD LYS 12 2HD LYS 12 5.352 -1.380 -3.127 134 2HD LYS 12 1HD LYS 12 4.709 -2.996 -3.424 135 1HE LYS 12 2HE LYS 12 2.634 -1.868 -4.396 136 2HE LYS 12 1HE LYS 12 3.551 -0.349 -4.346 137 1HZ LYS 12 1HZ LYS 12 4.349 -2.861 -5.716 138 2HZ LYS 12 2HZ LYS 12 5.357 -1.505 -5.543 139 3HZ LYS 12 3HZ LYS 12 3.929 -1.395 -6.458 Start of MODEL 2 1 1H ARG 1 1HT ARG 1 2.220 10.632 -4.512 2 2H ARG 1 2HT ARG 1 1.562 9.347 -5.407 3 3H ARG 1 3HT ARG 1 3.088 9.975 -5.812 4 HA ARG 1 HA ARG 1 3.354 7.883 -4.635 5 1HB ARG 1 2HB ARG 1 5.014 9.673 -4.434 6 2HB ARG 1 1HB ARG 1 4.075 10.428 -3.153 7 1HG ARG 1 2HG ARG 1 5.850 9.188 -2.097 8 2HG ARG 1 1HG ARG 1 4.348 8.309 -1.816 9 1HD ARG 1 2HD ARG 1 5.858 6.625 -2.523 10 2HD ARG 1 1HD ARG 1 4.946 7.031 -3.987 11 HE ARG 1 HE ARG 1 7.337 8.676 -3.576 12 1HH1 ARG 1 1HH1 ARG 1 7.118 5.417 -4.087 13 2HH1 ARG 1 2HH1 ARG 1 7.821 5.413 -5.669 14 1HH2 ARG 1 1HH2 ARG 1 7.753 8.865 -5.997 15 2HH2 ARG 1 2HH2 ARG 1 8.181 7.365 -6.751 16 H GLN 2 H GLN 2 1.297 6.968 -3.941 17 HA GLN 2 HA GLN 2 0.261 7.917 -1.310 18 1HB GLN 2 2HB GLN 2 -0.793 6.597 -3.737 19 2HB GLN 2 1HB GLN 2 -1.461 5.998 -2.214 20 1HG GLN 2 2HG GLN 2 -2.834 7.849 -3.001 21 2HG GLN 2 1HG GLN 2 -1.956 8.361 -1.556 22 1HE2 GLN 2 1HE2 GLN 2 -1.301 10.490 -1.853 23 2HE2 GLN 2 2HE2 GLN 2 -0.631 11.116 -3.291 24 H ILE 3 H ILE 3 0.896 4.804 -2.949 25 HA ILE 3 HA ILE 3 1.386 2.710 -2.065 26 HB ILE 3 HB ILE 3 3.336 4.461 -2.085 27 1HG1 ILE 3 2HG1 ILE 3 3.443 2.077 -2.508 28 2HG1 ILE 3 1HG1 ILE 3 4.829 2.587 -1.527 29 1HG2 ILE 3 1HG2 ILE 3 4.134 5.209 -0.106 30 2HG2 ILE 3 2HG2 ILE 3 4.001 3.614 0.631 31 3HG2 ILE 3 3HG2 ILE 3 2.608 4.689 0.600 32 1HD1 ILE 3 1HD1 ILE 3 2.291 1.239 -0.555 33 2HD1 ILE 3 2HD1 ILE 3 3.516 1.915 0.520 34 3HD1 ILE 3 3HD1 ILE 3 3.919 0.563 -0.537 35 H LYS 4 H LYS 4 -0.869 3.837 -0.615 36 HA LYS 4 HA LYS 4 -0.295 2.872 2.149 37 1HB LYS 4 2HB LYS 4 -2.484 4.674 1.070 38 2HB LYS 4 1HB LYS 4 -2.152 4.323 2.759 39 1HG LYS 4 2HG LYS 4 0.306 5.078 1.835 40 2HG LYS 4 1HG LYS 4 -0.781 6.166 0.967 41 1HD LYS 4 2HD LYS 4 -1.022 5.722 3.946 42 2HD LYS 4 1HD LYS 4 0.047 6.950 3.271 43 1HE LYS 4 2HE LYS 4 -1.765 8.325 3.237 44 2HE LYS 4 1HE LYS 4 -2.380 7.321 1.909 45 1HZ LYS 4 1HZ LYS 4 -3.194 5.755 3.666 46 2HZ LYS 4 2HZ LYS 4 -4.002 7.249 3.618 47 3HZ LYS 4 3HZ LYS 4 -2.837 6.948 4.817 48 H ILE 5 H ILE 5 -2.776 2.878 -0.410 49 HA ILE 5 HA ILE 5 -4.315 0.695 0.753 50 HB ILE 5 HB ILE 5 -4.186 1.655 -2.126 51 1HG1 ILE 5 2HG1 ILE 5 -4.510 3.668 -0.941 52 2HG1 ILE 5 1HG1 ILE 5 -6.144 3.142 -1.332 53 1HG2 ILE 5 1HG2 ILE 5 -5.954 -0.089 -0.549 54 2HG2 ILE 5 2HG2 ILE 5 -5.727 0.001 -2.295 55 3HG2 ILE 5 3HG2 ILE 5 -6.808 1.135 -1.487 56 1HD1 ILE 5 1HD1 ILE 5 -6.356 3.637 0.938 57 2HD1 ILE 5 2HD1 ILE 5 -4.720 3.093 1.308 58 3HD1 ILE 5 3HD1 ILE 5 -5.992 1.913 0.992 59 H TRP 6 H TRP 6 -1.426 1.039 -0.999 60 HA TRP 6 HA TRP 6 -1.356 -1.637 -2.204 61 1HB TRP 6 2HB TRP 6 0.579 0.673 -1.878 62 2HB TRP 6 1HB TRP 6 0.982 -0.789 -2.764 63 HD1 TRP 6 HD TRP 6 0.023 -1.096 -5.048 64 HE1 TRP 6 1HE TRP 6 -1.333 0.367 -6.678 65 HE3 TRP 6 3HE TRP 6 -1.300 2.601 -1.877 66 HZ2 TRP 6 2HZ TRP 6 -2.800 2.822 -6.610 67 HZ3 TRP 6 3HZ TRP 6 -2.684 4.513 -2.659 68 HH2 TRP 6 HH TRP 6 -3.432 4.626 -5.023 69 H PHE 7 H PHE 7 0.533 0.193 0.083 70 HA PHE 7 HA PHE 7 2.183 -1.794 1.199 71 1HB PHE 7 2HB PHE 7 2.381 0.582 1.706 72 2HB PHE 7 1HB PHE 7 0.769 0.603 2.417 73 HD1 PHE 7 1HD PHE 7 3.804 -1.578 2.772 74 HD2 PHE 7 2HD PHE 7 0.790 0.771 4.731 75 HE1 PHE 7 1HE PHE 7 4.764 -2.189 4.977 76 HE2 PHE 7 2HE PHE 7 1.749 0.162 6.937 77 HZ PHE 7 HZ PHE 7 3.736 -1.318 7.060 78 H ARG 8 H ARG 8 -1.238 -1.329 1.501 79 HA ARG 8 HA ARG 8 -1.535 -2.971 3.908 80 1HB ARG 8 2HB ARG 8 -2.703 -0.815 3.023 81 2HB ARG 8 1HB ARG 8 -3.689 -1.950 2.107 82 1HG ARG 8 2HG ARG 8 -4.812 -1.558 4.207 83 2HG ARG 8 1HG ARG 8 -4.081 -3.165 4.311 84 1HD ARG 8 2HD ARG 8 -2.903 -2.481 6.119 85 2HD ARG 8 1HD ARG 8 -2.091 -1.278 5.091 86 HE ARG 8 HE ARG 8 -4.780 -0.452 5.845 87 1HH1 ARG 8 1HH2 ARG 8 -2.274 -1.224 7.872 88 2HH1 ARG 8 2HH2 ARG 8 -2.020 0.376 8.487 89 1HH2 ARG 8 1HH1 ARG 8 -4.120 1.884 6.176 90 2HH2 ARG 8 2HH1 ARG 8 -3.066 2.136 7.527 91 H LYS 9 H LYS 9 -1.404 -3.482 0.501 92 HA LYS 9 HA LYS 9 -3.131 -5.895 0.599 93 1HB LYS 9 2HB LYS 9 -1.756 -4.251 -1.529 94 2HB LYS 9 1HB LYS 9 -2.494 -5.810 -1.909 95 1HG LYS 9 2HG LYS 9 -3.966 -3.556 -0.525 96 2HG LYS 9 1HG LYS 9 -4.011 -3.819 -2.268 97 1HD LYS 9 2HD LYS 9 -4.828 -6.154 -1.832 98 2HD LYS 9 1HD LYS 9 -4.938 -5.744 -0.119 99 1HE LYS 9 2HE LYS 9 -6.435 -3.788 -0.809 100 2HE LYS 9 1HE LYS 9 -6.512 -4.545 -2.414 101 1HZ LYS 9 1HZ LYS 9 -7.361 -6.531 -1.492 102 2HZ LYS 9 2HZ LYS 9 -8.277 -5.279 -0.802 103 3HZ LYS 9 3HZ LYS 9 -7.046 -6.030 0.098 104 H TRP 10 H TRP 10 -0.032 -5.341 -1.084 105 HA TRP 10 HA TRP 10 0.814 -8.089 -0.495 106 1HB TRP 10 2HB TRP 10 2.329 -5.860 -1.873 107 2HB TRP 10 1HB TRP 10 2.474 -7.592 -2.153 108 HD1 TRP 10 HD TRP 10 1.635 -5.114 -4.200 109 HE1 TRP 10 1HE TRP 10 -0.468 -5.501 -5.640 110 HE3 TRP 10 3HE TRP 10 -0.631 -8.796 -1.547 111 HZ2 TRP 10 2HZ TRP 10 -2.801 -7.137 -5.674 112 HZ3 TRP 10 3HZ TRP 10 -2.791 -9.765 -2.279 113 HH2 TRP 10 HH TRP 10 -3.881 -8.935 -4.346 114 H LYS 11 H LYS 11 3.483 -6.035 -0.628 115 HA LYS 11 HA LYS 11 3.704 -5.378 2.201 116 1HB LYS 11 2HB LYS 11 5.816 -6.847 2.349 117 2HB LYS 11 1HB LYS 11 4.272 -7.695 2.390 118 1HG LYS 11 2HG LYS 11 5.368 -7.238 -0.314 119 2HG LYS 11 1HG LYS 11 6.309 -8.339 0.695 120 1HD LYS 11 2HD LYS 11 4.657 -9.919 0.745 121 2HD LYS 11 1HD LYS 11 3.372 -8.710 0.765 122 1HE LYS 11 2HE LYS 11 3.049 -9.358 -1.411 123 2HE LYS 11 1HE LYS 11 4.463 -8.340 -1.745 124 1HZ LYS 11 1HZ LYS 11 4.832 -10.581 -2.565 125 2HZ LYS 11 2HZ LYS 11 4.522 -11.223 -1.022 126 3HZ LYS 11 3HZ LYS 11 5.890 -10.248 -1.282 127 H LYS 12 H LYS 12 3.701 -4.016 -0.295 128 HA LYS 12 HA LYS 12 5.788 -3.395 -1.791 129 1HB LYS 12 2HB LYS 12 4.059 -1.548 -0.148 130 2HB LYS 12 1HB LYS 12 5.134 -0.955 -1.410 131 1HG LYS 12 2HG LYS 12 2.993 -3.055 -1.835 132 2HG LYS 12 1HG LYS 12 2.816 -1.349 -2.242 133 1HD LYS 12 2HD LYS 12 5.264 -2.145 -3.392 134 2HD LYS 12 1HD LYS 12 4.127 -3.449 -3.742 135 1HE LYS 12 2HE LYS 12 3.700 -2.005 -5.534 136 2HE LYS 12 1HE LYS 12 2.517 -1.408 -4.354 137 1HZ LYS 12 1HZ LYS 12 4.250 0.122 -3.526 138 2HZ LYS 12 2HZ LYS 12 3.812 0.439 -5.136 139 3HZ LYS 12 3HZ LYS 12 5.267 -0.370 -4.791 Start of MODEL 3 1 1H ARG 1 1HT ARG 1 3.168 9.956 -4.343 2 2H ARG 1 2HT ARG 1 4.039 9.058 -5.494 3 3H ARG 1 3HT ARG 1 4.234 8.737 -3.837 4 HA ARG 1 HA ARG 1 1.683 8.352 -5.323 5 1HB ARG 1 2HB ARG 1 4.167 6.869 -5.211 6 2HB ARG 1 1HB ARG 1 2.873 5.927 -4.479 7 1HG ARG 1 2HG ARG 1 2.921 5.439 -6.856 8 2HG ARG 1 1HG ARG 1 1.472 6.380 -6.503 9 1HD ARG 1 2HD ARG 1 2.394 7.439 -8.418 10 2HD ARG 1 1HD ARG 1 2.928 8.441 -7.055 11 HE ARG 1 HE ARG 1 4.930 6.592 -7.202 12 1HH1 ARG 1 1HH2 ARG 1 4.221 9.444 -8.716 13 2HH1 ARG 1 2HH2 ARG 1 5.214 9.183 -10.111 14 1HH2 ARG 1 1HH1 ARG 1 5.854 5.857 -9.362 15 2HH2 ARG 1 2HH1 ARG 1 6.137 7.152 -10.478 16 H GLN 2 H GLN 2 0.054 7.427 -3.992 17 HA GLN 2 HA GLN 2 0.016 8.151 -1.230 18 1HB GLN 2 2HB GLN 2 -1.624 6.735 -3.207 19 2HB GLN 2 1HB GLN 2 -1.841 6.116 -1.566 20 1HG GLN 2 2HG GLN 2 -3.418 7.931 -1.991 21 2HG GLN 2 1HG GLN 2 -2.249 8.427 -0.765 22 1HE2 GLN 2 1HE2 GLN 2 -1.335 10.443 -1.132 23 2HE2 GLN 2 2HE2 GLN 2 -1.194 11.194 -2.657 24 H ILE 3 H ILE 3 0.684 5.059 -2.837 25 HA ILE 3 HA ILE 3 1.401 3.005 -1.989 26 HB ILE 3 HB ILE 3 3.180 4.938 -2.103 27 1HG1 ILE 3 2HG1 ILE 3 3.483 2.577 -2.568 28 2HG1 ILE 3 1HG1 ILE 3 4.870 3.206 -1.662 29 1HG2 ILE 3 1HG2 ILE 3 4.105 5.679 -0.163 30 2HG2 ILE 3 2HG2 ILE 3 4.003 4.093 0.596 31 3HG2 ILE 3 3HG2 ILE 3 2.600 5.155 0.585 32 1HD1 ILE 3 1HD1 ILE 3 4.202 1.088 -0.660 33 2HD1 ILE 3 2HD1 ILE 3 2.528 1.629 -0.548 34 3HD1 ILE 3 3HD1 ILE 3 3.769 2.390 0.448 35 H LYS 4 H LYS 4 -0.862 3.904 -0.435 36 HA LYS 4 HA LYS 4 -0.067 2.967 2.286 37 1HB LYS 4 2HB LYS 4 -2.294 4.777 1.307 38 2HB LYS 4 1HB LYS 4 -2.079 4.263 2.972 39 1HG LYS 4 2HG LYS 4 0.434 5.130 2.189 40 2HG LYS 4 1HG LYS 4 -0.678 6.338 1.540 41 1HD LYS 4 2HD LYS 4 -1.229 7.112 3.606 42 2HD LYS 4 1HD LYS 4 -1.303 5.489 4.292 43 1HE LYS 4 2HE LYS 4 0.546 6.691 5.346 44 2HE LYS 4 1HE LYS 4 1.230 5.453 4.273 45 1HZ LYS 4 1HZ LYS 4 1.470 7.066 2.538 46 2HZ LYS 4 2HZ LYS 4 2.215 7.686 3.934 47 3HZ LYS 4 3HZ LYS 4 0.689 8.259 3.457 48 H ILE 5 H ILE 5 -2.617 2.850 -0.197 49 HA ILE 5 HA ILE 5 -4.049 0.618 1.018 50 HB ILE 5 HB ILE 5 -3.929 1.645 -1.845 51 1HG1 ILE 5 2HG1 ILE 5 -6.069 2.347 0.142 52 2HG1 ILE 5 1HG1 ILE 5 -4.556 3.254 0.108 53 1HG2 ILE 5 1HG2 ILE 5 -5.941 -0.057 -0.351 54 2HG2 ILE 5 2HG2 ILE 5 -4.990 -0.523 -1.761 55 3HG2 ILE 5 3HG2 ILE 5 -6.265 0.685 -1.918 56 1HD1 ILE 5 1HD1 ILE 5 -6.170 2.761 -2.392 57 2HD1 ILE 5 2HD1 ILE 5 -4.889 3.946 -2.137 58 3HD1 ILE 5 3HD1 ILE 5 -6.455 4.161 -1.357 59 H TRP 6 H TRP 6 -1.491 1.138 -1.303 60 HA TRP 6 HA TRP 6 -1.116 -1.492 -2.338 61 1HB TRP 6 2HB TRP 6 0.693 0.876 -1.788 62 2HB TRP 6 1HB TRP 6 1.244 -0.537 -2.671 63 HD1 TRP 6 HD TRP 6 0.372 -0.898 -5.015 64 HE1 TRP 6 1HE TRP 6 -0.872 0.576 -6.722 65 HE3 TRP 6 3HE TRP 6 -1.086 2.808 -1.925 66 HZ2 TRP 6 2HZ TRP 6 -2.310 3.049 -6.738 67 HZ3 TRP 6 3HZ TRP 6 -2.402 4.738 -2.787 68 HH2 TRP 6 HH TRP 6 -3.011 4.862 -5.190 69 H PHE 7 H PHE 7 0.630 0.268 0.118 70 HA PHE 7 HA PHE 7 2.225 -1.792 1.220 71 1HB PHE 7 2HB PHE 7 2.470 0.558 1.798 72 2HB PHE 7 1HB PHE 7 0.831 0.615 2.443 73 HD1 PHE 7 1HD PHE 7 0.734 0.700 4.757 74 HD2 PHE 7 2HD PHE 7 3.815 -1.628 2.877 75 HE1 PHE 7 1HE PHE 7 1.583 0.023 6.988 76 HE2 PHE 7 2HE PHE 7 4.666 -2.304 5.108 77 HZ PHE 7 HZ PHE 7 3.550 -1.479 7.163 78 H ARG 8 H ARG 8 -1.192 -1.294 1.371 79 HA ARG 8 HA ARG 8 -1.609 -2.990 3.730 80 1HB ARG 8 2HB ARG 8 -2.697 -0.776 2.873 81 2HB ARG 8 1HB ARG 8 -3.686 -1.861 1.902 82 1HG ARG 8 2HG ARG 8 -4.831 -1.456 4.008 83 2HG ARG 8 1HG ARG 8 -4.213 -3.112 4.039 84 1HD ARG 8 2HD ARG 8 -2.975 -2.621 5.869 85 2HD ARG 8 1HD ARG 8 -2.139 -1.348 4.951 86 HE ARG 8 HE ARG 8 -4.603 -0.221 5.545 87 1HH1 ARG 8 1HH2 ARG 8 -2.072 0.831 6.733 88 2HH1 ARG 8 2HH2 ARG 8 -2.353 0.635 8.430 89 1HH2 ARG 8 1HH1 ARG 8 -4.984 -1.583 8.012 90 2HH2 ARG 8 2HH1 ARG 8 -4.000 -0.731 9.155 91 H LYS 9 H LYS 9 -1.404 -3.365 0.297 92 HA LYS 9 HA LYS 9 -3.186 -5.732 0.231 93 1HB LYS 9 2HB LYS 9 -1.579 -4.125 -1.769 94 2HB LYS 9 1HB LYS 9 -2.409 -5.618 -2.223 95 1HG LYS 9 2HG LYS 9 -3.787 -3.281 -0.879 96 2HG LYS 9 1HG LYS 9 -3.745 -3.508 -2.627 97 1HD LYS 9 2HD LYS 9 -4.773 -5.771 -2.305 98 2HD LYS 9 1HD LYS 9 -4.936 -5.407 -0.587 99 1HE LYS 9 2HE LYS 9 -6.254 -3.335 -1.251 100 2HE LYS 9 1HE LYS 9 -6.274 -3.980 -2.905 101 1HZ LYS 9 1HZ LYS 9 -7.215 -5.400 -0.468 102 2HZ LYS 9 2HZ LYS 9 -7.179 -6.057 -2.034 103 3HZ LYS 9 3HZ LYS 9 -8.207 -4.752 -1.682 104 H TRP 10 H TRP 10 0.021 -5.275 -1.250 105 HA TRP 10 HA TRP 10 0.762 -8.042 -0.609 106 1HB TRP 10 2HB TRP 10 2.394 -5.844 -1.907 107 2HB TRP 10 1HB TRP 10 2.535 -7.581 -2.165 108 HD1 TRP 10 HD TRP 10 1.840 -5.097 -4.268 109 HE1 TRP 10 1HE TRP 10 -0.180 -5.478 -5.828 110 HE3 TRP 10 3HE TRP 10 -0.597 -8.752 -1.738 111 HZ2 TRP 10 2HZ TRP 10 -2.516 -7.104 -5.991 112 HZ3 TRP 10 3HZ TRP 10 -2.715 -9.716 -2.589 113 HH2 TRP 10 HH TRP 10 -3.681 -8.891 -4.720 114 H LYS 11 H LYS 11 3.481 -6.060 -0.607 115 HA LYS 11 HA LYS 11 3.543 -5.368 2.224 116 1HB LYS 11 2HB LYS 11 5.544 -6.869 2.605 117 2HB LYS 11 1HB LYS 11 4.037 -7.752 2.354 118 1HG LYS 11 2HG LYS 11 5.613 -7.106 -0.080 119 2HG LYS 11 1HG LYS 11 6.297 -8.327 0.998 120 1HD LYS 11 2HD LYS 11 4.624 -9.827 0.580 121 2HD LYS 11 1HD LYS 11 3.397 -8.564 0.456 122 1HE LYS 11 2HE LYS 11 3.594 -9.382 -1.770 123 2HE LYS 11 1HE LYS 11 4.615 -7.930 -1.773 124 1HZ LYS 11 1HZ LYS 11 5.485 -10.743 -1.393 125 2HZ LYS 11 2HZ LYS 11 6.486 -9.407 -1.078 126 3HZ LYS 11 3HZ LYS 11 5.919 -9.694 -2.654 127 H LYS 12 H LYS 12 3.724 -4.095 -0.363 128 HA LYS 12 HA LYS 12 5.975 -3.542 -1.655 129 1HB LYS 12 2HB LYS 12 3.763 -1.926 -0.614 130 2HB LYS 12 1HB LYS 12 5.188 -1.010 -1.096 131 1HG LYS 12 2HG LYS 12 4.050 -1.153 -3.122 132 2HG LYS 12 1HG LYS 12 5.128 -2.545 -3.217 133 1HD LYS 12 2HD LYS 12 3.429 -4.064 -2.918 134 2HD LYS 12 1HD LYS 12 2.476 -2.959 -1.927 135 1HE LYS 12 2HE LYS 12 2.343 -1.585 -4.219 136 2HE LYS 12 1HE LYS 12 2.597 -3.199 -4.909 137 1HZ LYS 12 1HZ LYS 12 0.836 -3.677 -2.915 138 2HZ LYS 12 2HZ LYS 12 0.415 -3.467 -4.548 139 3HZ LYS 12 3HZ LYS 12 0.322 -2.160 -3.472 Start of MODEL 4 1 1H ARG 1 1HT ARG 1 3.206 8.871 -6.001 2 2H ARG 1 2HT ARG 1 2.546 9.721 -4.687 3 3H ARG 1 3HT ARG 1 1.712 8.399 -5.353 4 HA ARG 1 HA ARG 1 3.519 6.908 -4.645 5 1HB ARG 1 2HB ARG 1 4.682 9.548 -4.299 6 2HB ARG 1 1HB ARG 1 4.841 8.611 -2.822 7 1HG ARG 1 2HG ARG 1 5.459 7.167 -5.332 8 2HG ARG 1 1HG ARG 1 6.576 8.436 -4.851 9 1HD ARG 1 2HD ARG 1 7.423 6.490 -3.785 10 2HD ARG 1 1HD ARG 1 6.531 7.344 -2.513 11 HE ARG 1 HE ARG 1 4.557 5.819 -3.519 12 1HH1 ARG 1 1HH2 ARG 1 7.314 5.213 -1.717 13 2HH1 ARG 1 2HH2 ARG 1 7.251 3.488 -1.869 14 1HH2 ARG 1 1HH1 ARG 1 4.691 3.522 -4.206 15 2HH2 ARG 1 2HH1 ARG 1 5.766 2.531 -3.278 16 H GLN 2 H GLN 2 1.009 6.898 -3.895 17 HA GLN 2 HA GLN 2 0.486 7.876 -1.199 18 1HB GLN 2 2HB GLN 2 -0.857 6.417 -3.384 19 2HB GLN 2 1HB GLN 2 -1.408 5.973 -1.765 20 1HG GLN 2 2HG GLN 2 -2.755 7.824 -2.579 21 2HG GLN 2 1HG GLN 2 -1.734 8.399 -1.259 22 1HE2 GLN 2 1HE2 GLN 2 -1.123 10.499 -1.806 23 2HE2 GLN 2 2HE2 GLN 2 -0.510 10.965 -3.327 24 H ILE 3 H ILE 3 1.250 4.720 -2.636 25 HA ILE 3 HA ILE 3 1.698 2.654 -1.650 26 HB ILE 3 HB ILE 3 3.590 4.473 -1.535 27 1HG1 ILE 3 2HG1 ILE 3 3.814 2.089 -1.904 28 2HG1 ILE 3 1HG1 ILE 3 5.084 2.656 -0.805 29 1HG2 ILE 3 1HG2 ILE 3 2.644 4.867 0.993 30 2HG2 ILE 3 2HG2 ILE 3 4.312 5.165 0.519 31 3HG2 ILE 3 3HG2 ILE 3 3.875 3.644 1.293 32 1HD1 ILE 3 1HD1 ILE 3 3.622 1.961 1.121 33 2HD1 ILE 3 2HD1 ILE 3 4.139 0.608 0.114 34 3HD1 ILE 3 3HD1 ILE 3 2.504 1.250 -0.044 35 H LYS 4 H LYS 4 -0.711 3.722 -0.463 36 HA LYS 4 HA LYS 4 -0.383 2.804 2.360 37 1HB LYS 4 2HB LYS 4 -2.333 4.719 1.044 38 2HB LYS 4 1HB LYS 4 -2.388 4.229 2.729 39 1HG LYS 4 2HG LYS 4 0.257 4.942 2.305 40 2HG LYS 4 1HG LYS 4 -0.680 6.192 1.485 41 1HD LYS 4 2HD LYS 4 -1.047 7.146 3.494 42 2HD LYS 4 1HD LYS 4 -2.011 5.735 3.930 43 1HE LYS 4 2HE LYS 4 -0.026 4.602 4.815 44 2HE LYS 4 1HE LYS 4 0.999 5.958 4.302 45 1HZ LYS 4 1HZ LYS 4 0.370 6.259 6.599 46 2HZ LYS 4 2HZ LYS 4 -1.276 6.092 6.211 47 3HZ LYS 4 3HZ LYS 4 -0.400 7.435 5.652 48 H ILE 5 H ILE 5 -2.535 2.795 -0.473 49 HA ILE 5 HA ILE 5 -4.271 0.676 0.526 50 HB ILE 5 HB ILE 5 -3.654 1.627 -2.298 51 1HG1 ILE 5 2HG1 ILE 5 -6.017 2.535 -0.689 52 2HG1 ILE 5 1HG1 ILE 5 -4.454 3.320 -0.474 53 1HG2 ILE 5 1HG2 ILE 5 -5.483 0.437 -3.016 54 2HG2 ILE 5 2HG2 ILE 5 -6.336 0.625 -1.484 55 3HG2 ILE 5 3HG2 ILE 5 -5.054 -0.576 -1.638 56 1HD1 ILE 5 1HD1 ILE 5 -4.426 4.190 -2.607 57 2HD1 ILE 5 2HD1 ILE 5 -6.167 4.169 -2.325 58 3HD1 ILE 5 3HD1 ILE 5 -5.410 2.882 -3.263 59 H TRP 6 H TRP 6 -1.336 0.999 -1.326 60 HA TRP 6 HA TRP 6 -1.002 -1.687 -2.265 61 1HB TRP 6 2HB TRP 6 0.859 0.595 -1.551 62 2HB TRP 6 1HB TRP 6 1.430 -0.874 -2.324 63 HD1 TRP 6 HD TRP 6 0.869 -1.242 -4.752 64 HE1 TRP 6 1HE TRP 6 -0.065 0.244 -6.638 65 HE3 TRP 6 3HE TRP 6 -0.805 2.608 -1.959 66 HZ2 TRP 6 2HZ TRP 6 -1.368 2.778 -6.896 67 HZ3 TRP 6 3HZ TRP 6 -1.901 4.571 -3.026 68 HH2 TRP 6 HH TRP 6 -2.180 4.658 -5.492 69 H PHE 7 H PHE 7 0.498 0.075 0.343 70 HA PHE 7 HA PHE 7 1.834 -1.987 1.721 71 1HB PHE 7 2HB PHE 7 2.123 0.324 2.298 72 2HB PHE 7 1HB PHE 7 0.398 0.539 2.576 73 HD1 PHE 7 1HD PHE 7 3.215 -1.626 3.785 74 HD2 PHE 7 2HD PHE 7 -0.364 0.532 4.771 75 HE1 PHE 7 1HE PHE 7 3.518 -2.221 6.174 76 HE2 PHE 7 2HE PHE 7 -0.063 -0.061 7.161 77 HZ PHE 7 HZ PHE 7 1.878 -1.437 7.863 78 H ARG 8 H ARG 8 -1.557 -1.369 1.403 79 HA ARG 8 HA ARG 8 -2.393 -2.878 3.755 80 1HB ARG 8 2HB ARG 8 -3.328 -0.815 2.480 81 2HB ARG 8 1HB ARG 8 -4.069 -2.018 1.429 82 1HG ARG 8 2HG ARG 8 -5.656 -1.490 3.181 83 2HG ARG 8 1HG ARG 8 -5.005 -3.096 3.527 84 1HD ARG 8 2HD ARG 8 -4.237 -2.350 5.523 85 2HD ARG 8 1HD ARG 8 -3.241 -1.146 4.674 86 HE ARG 8 HE ARG 8 -5.775 -0.056 4.556 87 1HH1 ARG 8 1HH2 ARG 8 -6.357 -1.584 7.080 88 2HH1 ARG 8 2HH2 ARG 8 -5.890 -0.447 8.301 89 1HH2 ARG 8 1HH1 ARG 8 -4.057 1.538 6.127 90 2HH2 ARG 8 2HH1 ARG 8 -4.586 1.319 7.762 91 H LYS 9 H LYS 9 -1.502 -3.641 0.510 92 HA LYS 9 HA LYS 9 -3.074 -6.185 0.577 93 1HB LYS 9 2HB LYS 9 -2.062 -4.300 -1.487 94 2HB LYS 9 1HB LYS 9 -2.038 -6.011 -1.926 95 1HG LYS 9 2HG LYS 9 -4.471 -4.610 -0.793 96 2HG LYS 9 1HG LYS 9 -4.181 -4.807 -2.521 97 1HD LYS 9 2HD LYS 9 -4.047 -7.275 -2.181 98 2HD LYS 9 1HD LYS 9 -4.456 -7.036 -0.483 99 1HE LYS 9 2HE LYS 9 -6.544 -7.521 -1.526 100 2HE LYS 9 1HE LYS 9 -6.536 -5.752 -1.385 101 1HZ LYS 9 1HZ LYS 9 -7.065 -6.617 -3.661 102 2HZ LYS 9 2HZ LYS 9 -5.472 -7.200 -3.746 103 3HZ LYS 9 3HZ LYS 9 -5.763 -5.533 -3.598 104 H TRP 10 H TRP 10 -0.007 -5.364 -1.053 105 HA TRP 10 HA TRP 10 1.167 -7.904 -0.125 106 1HB TRP 10 2HB TRP 10 2.377 -5.755 -1.874 107 2HB TRP 10 1HB TRP 10 2.695 -7.486 -1.914 108 HD1 TRP 10 HD TRP 10 1.544 -5.407 -4.245 109 HE1 TRP 10 1HE TRP 10 -0.540 -6.210 -5.535 110 HE3 TRP 10 3HE TRP 10 -0.228 -8.906 -1.034 111 HZ2 TRP 10 2HZ TRP 10 -2.677 -8.076 -5.255 112 HZ3 TRP 10 3HZ TRP 10 -2.284 -10.195 -1.540 113 HH2 TRP 10 HH TRP 10 -3.514 -9.779 -3.655 114 H LYS 11 H LYS 11 3.590 -5.683 -0.678 115 HA LYS 11 HA LYS 11 3.753 -4.454 1.963 116 1HB LYS 11 2HB LYS 11 6.006 -5.634 2.340 117 2HB LYS 11 1HB LYS 11 4.571 -6.635 2.560 118 1HG LYS 11 2HG LYS 11 5.650 -6.536 -0.196 119 2HG LYS 11 1HG LYS 11 6.664 -7.361 0.991 120 1HD LYS 11 2HD LYS 11 5.190 -9.077 1.247 121 2HD LYS 11 1HD LYS 11 3.791 -8.002 1.162 122 1HE LYS 11 2HE LYS 11 3.489 -9.007 -0.886 123 2HE LYS 11 1HE LYS 11 4.723 -7.844 -1.411 124 1HZ LYS 11 1HZ LYS 11 5.333 -10.516 -0.268 125 2HZ LYS 11 2HZ LYS 11 6.438 -9.418 -0.948 126 3HZ LYS 11 3HZ LYS 11 5.289 -10.191 -1.932 127 H LYS 12 H LYS 12 3.581 -3.662 -0.785 128 HA LYS 12 HA LYS 12 5.714 -3.151 -2.338 129 1HB LYS 12 2HB LYS 12 3.511 -1.312 -1.407 130 2HB LYS 12 1HB LYS 12 4.602 -0.885 -2.723 131 1HG LYS 12 2HG LYS 12 2.917 -3.402 -2.638 132 2HG LYS 12 1HG LYS 12 2.505 -1.949 -3.547 133 1HD LYS 12 2HD LYS 12 4.895 -2.229 -4.580 134 2HD LYS 12 1HD LYS 12 4.749 -3.893 -4.016 135 1HE LYS 12 2HE LYS 12 2.287 -3.430 -5.228 136 2HE LYS 12 1HE LYS 12 3.439 -2.603 -6.294 137 1HZ LYS 12 1HZ LYS 12 3.773 -5.364 -5.245 138 2HZ LYS 12 2HZ LYS 12 4.819 -4.563 -6.319 139 3HZ LYS 12 3HZ LYS 12 3.248 -4.984 -6.814 Start of MODEL 5 1 1H ARG 1 1HT ARG 1 3.297 8.833 -5.916 2 2H ARG 1 2HT ARG 1 1.613 8.814 -5.695 3 3H ARG 1 3HT ARG 1 2.565 7.541 -5.098 4 HA ARG 1 HA ARG 1 3.650 9.073 -3.539 5 1HB ARG 1 2HB ARG 1 2.763 10.889 -5.409 6 2HB ARG 1 1HB ARG 1 1.641 11.163 -4.081 7 1HG ARG 1 2HG ARG 1 4.570 10.951 -3.490 8 2HG ARG 1 1HG ARG 1 3.913 12.449 -4.142 9 1HD ARG 1 2HD ARG 1 3.790 12.710 -1.773 10 2HD ARG 1 1HD ARG 1 2.144 12.291 -2.279 11 HE ARG 1 HE ARG 1 3.639 9.890 -1.768 12 1HH1 ARG 1 1HH2 ARG 1 0.835 10.471 -0.802 13 2HH1 ARG 1 2HH2 ARG 1 1.065 10.542 0.914 14 1HH2 ARG 1 1HH1 ARG 1 4.509 10.886 0.705 15 2HH2 ARG 1 2HH1 ARG 1 3.144 10.777 1.766 16 H GLN 2 H GLN 2 1.826 6.973 -3.345 17 HA GLN 2 HA GLN 2 -0.057 8.009 -1.273 18 1HB GLN 2 2HB GLN 2 -0.644 6.877 -3.872 19 2HB GLN 2 1HB GLN 2 -1.309 5.851 -2.596 20 1HG GLN 2 2HG GLN 2 -2.973 7.518 -3.169 21 2HG GLN 2 1HG GLN 2 -2.333 7.901 -1.568 22 1HE2 GLN 2 1HE2 GLN 2 -1.944 10.098 -1.357 23 2HE2 GLN 2 2HE2 GLN 2 -1.396 11.123 -2.605 24 H ILE 3 H ILE 3 1.136 4.984 -2.755 25 HA ILE 3 HA ILE 3 1.544 2.900 -1.763 26 HB ILE 3 HB ILE 3 3.395 4.752 -1.571 27 1HG1 ILE 3 2HG1 ILE 3 3.694 2.376 -1.912 28 2HG1 ILE 3 1HG1 ILE 3 4.891 2.973 -0.750 29 1HG2 ILE 3 1HG2 ILE 3 3.538 3.955 1.281 30 2HG2 ILE 3 2HG2 ILE 3 2.325 5.169 0.890 31 3HG2 ILE 3 3HG2 ILE 3 4.018 5.464 0.508 32 1HD1 ILE 3 1HD1 ILE 3 3.938 0.904 0.116 33 2HD1 ILE 3 2HD1 ILE 3 2.304 1.516 -0.121 34 3HD1 ILE 3 3HD1 ILE 3 3.351 2.244 1.098 35 H LYS 4 H LYS 4 -0.936 3.896 -0.654 36 HA LYS 4 HA LYS 4 -0.671 2.985 2.178 37 1HB LYS 4 2HB LYS 4 -2.604 4.860 0.784 38 2HB LYS 4 1HB LYS 4 -2.767 4.331 2.451 39 1HG LYS 4 2HG LYS 4 -0.112 5.115 2.214 40 2HG LYS 4 1HG LYS 4 -1.038 6.371 1.385 41 1HD LYS 4 2HD LYS 4 -2.059 7.072 3.309 42 2HD LYS 4 1HD LYS 4 -2.149 5.440 3.973 43 1HE LYS 4 2HE LYS 4 -0.506 6.273 5.370 44 2HE LYS 4 1HE LYS 4 0.542 5.801 4.017 45 1HZ LYS 4 1HZ LYS 4 0.155 8.017 3.048 46 2HZ LYS 4 2HZ LYS 4 0.942 8.100 4.552 47 3HZ LYS 4 3HZ LYS 4 -0.713 8.463 4.436 48 H ILE 5 H ILE 5 -2.700 2.877 -0.742 49 HA ILE 5 HA ILE 5 -4.373 0.689 0.246 50 HB ILE 5 HB ILE 5 -3.869 1.595 -2.607 51 1HG1 ILE 5 2HG1 ILE 5 -4.348 3.636 -1.507 52 2HG1 ILE 5 1HG1 ILE 5 -5.902 3.101 -2.141 53 1HG2 ILE 5 1HG2 ILE 5 -6.069 0.766 -3.038 54 2HG2 ILE 5 2HG2 ILE 5 -6.419 0.608 -1.317 55 3HG2 ILE 5 3HG2 ILE 5 -5.260 -0.479 -2.084 56 1HD1 ILE 5 1HD1 ILE 5 -4.911 3.105 0.691 57 2HD1 ILE 5 2HD1 ILE 5 -6.116 1.914 0.201 58 3HD1 ILE 5 3HD1 ILE 5 -6.469 3.636 0.056 59 H TRP 6 H TRP 6 -1.260 1.079 -1.009 60 HA TRP 6 HA TRP 6 -0.939 -1.604 -2.183 61 1HB TRP 6 2HB TRP 6 0.828 0.796 -1.630 62 2HB TRP 6 1HB TRP 6 1.435 -0.665 -2.391 63 HD1 TRP 6 HD TRP 6 0.902 -1.053 -4.798 64 HE1 TRP 6 1HE TRP 6 -0.266 0.290 -6.660 65 HE3 TRP 6 3HE TRP 6 -1.155 2.583 -1.969 66 HZ2 TRP 6 2HZ TRP 6 -1.883 2.640 -6.887 67 HZ3 TRP 6 3HZ TRP 6 -2.519 4.384 -3.011 68 HH2 TRP 6 HH TRP 6 -2.880 4.416 -5.467 69 H PHE 7 H PHE 7 0.572 0.323 0.304 70 HA PHE 7 HA PHE 7 2.086 -1.624 1.671 71 1HB PHE 7 2HB PHE 7 2.138 0.809 2.089 72 2HB PHE 7 1HB PHE 7 0.495 0.745 2.719 73 HD1 PHE 7 1HD PHE 7 0.409 0.943 5.030 74 HD2 PHE 7 2HD PHE 7 3.604 -1.294 3.233 75 HE1 PHE 7 1HE PHE 7 1.286 0.385 7.283 76 HE2 PHE 7 2HE PHE 7 4.483 -1.852 5.485 77 HZ PHE 7 HZ PHE 7 3.322 -1.013 7.511 78 H ARG 8 H ARG 8 -1.345 -1.207 1.499 79 HA ARG 8 HA ARG 8 -1.895 -2.854 3.877 80 1HB ARG 8 2HB ARG 8 -2.903 -0.620 2.971 81 2HB ARG 8 1HB ARG 8 -3.867 -1.691 1.962 82 1HG ARG 8 2HG ARG 8 -5.099 -1.269 4.011 83 2HG ARG 8 1HG ARG 8 -4.496 -2.930 4.081 84 1HD ARG 8 2HD ARG 8 -3.318 -2.438 5.949 85 2HD ARG 8 1HD ARG 8 -2.453 -1.161 5.061 86 HE ARG 8 HE ARG 8 -5.085 -0.223 5.669 87 1HH1 ARG 8 1HH1 ARG 8 -1.903 0.202 6.485 88 2HH1 ARG 8 2HH1 ARG 8 -2.185 0.746 8.106 89 1HH2 ARG 8 1HH2 ARG 8 -5.557 -0.064 8.070 90 2HH2 ARG 8 2HH2 ARG 8 -4.254 0.595 9.003 91 H LYS 9 H LYS 9 -1.154 -3.505 0.685 92 HA LYS 9 HA LYS 9 -3.129 -5.746 0.488 93 1HB LYS 9 2HB LYS 9 -1.623 -4.001 -1.438 94 2HB LYS 9 1HB LYS 9 -2.173 -5.593 -1.969 95 1HG LYS 9 2HG LYS 9 -4.006 -3.592 -0.639 96 2HG LYS 9 1HG LYS 9 -3.787 -3.660 -2.387 97 1HD LYS 9 2HD LYS 9 -4.536 -5.987 -2.426 98 2HD LYS 9 1HD LYS 9 -4.682 -5.993 -0.668 99 1HE LYS 9 2HE LYS 9 -6.639 -4.781 -0.694 100 2HE LYS 9 1HE LYS 9 -6.156 -3.842 -2.120 101 1HZ LYS 9 1HZ LYS 9 -7.005 -6.689 -2.065 102 2HZ LYS 9 2HZ LYS 9 -6.355 -5.915 -3.431 103 3HZ LYS 9 3HZ LYS 9 -7.837 -5.396 -2.782 104 H TRP 10 H TRP 10 0.061 -5.335 -1.044 105 HA TRP 10 HA TRP 10 0.772 -8.094 -0.317 106 1HB TRP 10 2HB TRP 10 2.362 -6.028 -1.854 107 2HB TRP 10 1HB TRP 10 2.425 -7.780 -2.020 108 HD1 TRP 10 HD TRP 10 1.617 -5.406 -4.226 109 HE1 TRP 10 1HE TRP 10 -0.535 -5.817 -5.578 110 HE3 TRP 10 3HE TRP 10 -0.692 -8.811 -1.262 111 HZ2 TRP 10 2HZ TRP 10 -2.920 -7.368 -5.436 112 HZ3 TRP 10 3HZ TRP 10 -2.902 -9.752 -1.867 113 HH2 TRP 10 HH TRP 10 -4.023 -9.029 -3.960 114 H LYS 11 H LYS 11 3.542 -6.169 -0.584 115 HA LYS 11 HA LYS 11 3.786 -5.283 2.158 116 1HB LYS 11 2HB LYS 11 5.386 -6.952 2.896 117 2HB LYS 11 1HB LYS 11 3.944 -7.788 2.325 118 1HG LYS 11 2HG LYS 11 6.243 -7.257 0.458 119 2HG LYS 11 1HG LYS 11 6.266 -8.653 1.535 120 1HD LYS 11 2HD LYS 11 4.817 -9.771 0.226 121 2HD LYS 11 1HD LYS 11 3.693 -8.413 0.241 122 1HE LYS 11 2HE LYS 11 4.356 -7.715 -1.824 123 2HE LYS 11 1HE LYS 11 6.072 -7.933 -1.429 124 1HZ LYS 11 1HZ LYS 11 5.746 -10.340 -1.614 125 2HZ LYS 11 2HZ LYS 11 5.404 -9.551 -3.078 126 3HZ LYS 11 3HZ LYS 11 4.136 -10.092 -2.084 127 H LYS 12 H LYS 12 4.117 -4.379 -0.590 128 HA LYS 12 HA LYS 12 5.898 -3.780 -2.124 129 1HB LYS 12 2HB LYS 12 6.586 -1.493 -0.818 130 2HB LYS 12 1HB LYS 12 5.046 -1.727 -1.637 131 1HG LYS 12 2HG LYS 12 4.628 -0.874 0.602 132 2HG LYS 12 1HG LYS 12 4.076 -2.545 0.526 133 1HD LYS 12 2HD LYS 12 5.301 -2.668 2.472 134 2HD LYS 12 1HD LYS 12 6.591 -2.993 1.317 135 1HE LYS 12 2HE LYS 12 7.455 -0.801 1.467 136 2HE LYS 12 1HE LYS 12 5.948 -0.163 2.153 137 1HZ LYS 12 1HZ LYS 12 6.285 -1.576 4.095 138 2HZ LYS 12 2HZ LYS 12 7.590 -0.507 3.891 139 3HZ LYS 12 3HZ LYS 12 7.749 -2.140 3.451 Start of MODEL 6 1 1H ARG 1 1HT ARG 1 1.583 6.634 -5.241 2 2H ARG 1 2HT ARG 1 3.127 6.092 -4.784 3 3H ARG 1 3HT ARG 1 2.935 7.033 -6.184 4 HA ARG 1 HA ARG 1 3.840 8.348 -4.330 5 1HB ARG 1 2HB ARG 1 1.932 8.896 -6.211 6 2HB ARG 1 1HB ARG 1 1.101 9.395 -4.742 7 1HG ARG 1 2HG ARG 1 3.936 10.262 -5.190 8 2HG ARG 1 1HG ARG 1 2.618 11.102 -6.002 9 1HD ARG 1 2HD ARG 1 2.916 12.298 -3.967 10 2HD ARG 1 1HD ARG 1 1.517 11.250 -3.672 11 HE ARG 1 HE ARG 1 3.891 9.806 -3.006 12 1HH1 ARG 1 1HH2 ARG 1 1.307 11.545 -1.728 13 2HH1 ARG 1 2HH2 ARG 1 2.023 11.794 -0.171 14 1HH2 ARG 1 1HH1 ARG 1 5.114 10.521 -1.090 15 2HH2 ARG 1 2HH1 ARG 1 4.176 11.215 0.190 16 H GLN 2 H GLN 2 0.420 7.405 -3.780 17 HA GLN 2 HA GLN 2 0.434 8.228 -0.998 18 1HB GLN 2 2HB GLN 2 -1.436 7.702 -2.893 19 2HB GLN 2 1HB GLN 2 -1.490 6.195 -1.972 20 1HG GLN 2 2HG GLN 2 -3.076 7.700 -0.969 21 2HG GLN 2 1HG GLN 2 -1.695 7.584 0.124 22 1HE2 GLN 2 1HE2 GLN 2 -0.987 9.579 0.863 23 2HE2 GLN 2 2HE2 GLN 2 -1.137 11.050 0.012 24 H ILE 3 H ILE 3 0.902 5.153 -2.689 25 HA ILE 3 HA ILE 3 1.361 3.005 -1.885 26 HB ILE 3 HB ILE 3 3.329 4.739 -1.937 27 1HG1 ILE 3 2HG1 ILE 3 3.419 2.373 -2.435 28 2HG1 ILE 3 1HG1 ILE 3 4.830 2.838 -1.469 29 1HG2 ILE 3 1HG2 ILE 3 3.938 3.771 0.795 30 2HG2 ILE 3 2HG2 ILE 3 2.740 5.058 0.704 31 3HG2 ILE 3 3HG2 ILE 3 4.347 5.303 0.029 32 1HD1 ILE 3 1HD1 ILE 3 3.590 2.091 0.583 33 2HD1 ILE 3 2HD1 ILE 3 3.902 0.775 -0.548 34 3HD1 ILE 3 3HD1 ILE 3 2.298 1.500 -0.461 35 H LYS 4 H LYS 4 -0.862 3.879 -0.364 36 HA LYS 4 HA LYS 4 -0.139 2.908 2.367 37 1HB LYS 4 2HB LYS 4 -2.303 4.786 1.373 38 2HB LYS 4 1HB LYS 4 -2.134 4.240 3.035 39 1HG LYS 4 2HG LYS 4 0.413 5.053 2.354 40 2HG LYS 4 1HG LYS 4 -0.632 6.285 1.641 41 1HD LYS 4 2HD LYS 4 -0.759 7.212 3.700 42 2HD LYS 4 1HD LYS 4 -1.748 5.828 4.161 43 1HE LYS 4 2HE LYS 4 -0.115 5.397 5.695 44 2HE LYS 4 1HE LYS 4 0.850 4.830 4.317 45 1HZ LYS 4 1HZ LYS 4 1.559 7.133 3.945 46 2HZ LYS 4 2HZ LYS 4 2.034 6.573 5.478 47 3HZ LYS 4 3HZ LYS 4 0.706 7.624 5.327 48 H ILE 5 H ILE 5 -2.674 2.913 -0.139 49 HA ILE 5 HA ILE 5 -4.151 0.673 1.005 50 HB ILE 5 HB ILE 5 -4.011 1.787 -1.824 51 1HG1 ILE 5 2HG1 ILE 5 -6.142 2.484 0.167 52 2HG1 ILE 5 1HG1 ILE 5 -4.602 3.339 0.196 53 1HG2 ILE 5 1HG2 ILE 5 -6.124 0.737 -2.192 54 2HG2 ILE 5 2HG2 ILE 5 -6.320 0.372 -0.478 55 3HG2 ILE 5 3HG2 ILE 5 -5.111 -0.489 -1.431 56 1HD1 ILE 5 1HD1 ILE 5 -6.390 4.410 -1.251 57 2HD1 ILE 5 2HD1 ILE 5 -6.239 3.015 -2.320 58 3HD1 ILE 5 3HD1 ILE 5 -4.859 4.082 -2.063 59 H TRP 6 H TRP 6 -1.551 1.214 -1.253 60 HA TRP 6 HA TRP 6 -1.253 -1.404 -2.372 61 1HB TRP 6 2HB TRP 6 0.599 0.932 -1.819 62 2HB TRP 6 1HB TRP 6 1.113 -0.476 -2.735 63 HD1 TRP 6 HD TRP 6 0.250 -0.754 -5.076 64 HE1 TRP 6 1HE TRP 6 -1.032 0.745 -6.734 65 HE3 TRP 6 3HE TRP 6 -1.234 2.853 -1.879 66 HZ2 TRP 6 2HZ TRP 6 -2.508 3.195 -6.673 67 HZ3 TRP 6 3HZ TRP 6 -2.587 4.784 -2.680 68 HH2 TRP 6 HH TRP 6 -3.221 4.957 -5.074 69 H PHE 7 H PHE 7 0.544 0.298 0.087 70 HA PHE 7 HA PHE 7 2.142 -1.781 1.136 71 1HB PHE 7 2HB PHE 7 2.407 0.538 1.777 72 2HB PHE 7 1HB PHE 7 0.759 0.610 2.395 73 HD1 PHE 7 1HD PHE 7 0.265 0.028 4.631 74 HD2 PHE 7 2HD PHE 7 4.057 -1.048 2.926 75 HE1 PHE 7 1HE PHE 7 1.066 -0.699 6.865 76 HE2 PHE 7 2HE PHE 7 4.858 -1.774 5.159 77 HZ PHE 7 HZ PHE 7 3.361 -1.600 7.129 78 H ARG 8 H ARG 8 -1.276 -1.284 1.343 79 HA ARG 8 HA ARG 8 -1.683 -3.009 3.675 80 1HB ARG 8 2HB ARG 8 -2.815 -0.824 2.820 81 2HB ARG 8 1HB ARG 8 -3.751 -1.921 1.808 82 1HG ARG 8 2HG ARG 8 -4.967 -1.585 3.881 83 2HG ARG 8 1HG ARG 8 -4.292 -3.218 3.918 84 1HD ARG 8 2HD ARG 8 -3.119 -2.700 5.783 85 2HD ARG 8 1HD ARG 8 -2.315 -1.378 4.904 86 HE ARG 8 HE ARG 8 -4.485 -0.056 5.412 87 1HH1 ARG 8 1HH2 ARG 8 -2.420 -0.691 7.701 88 2HH1 ARG 8 2HH2 ARG 8 -3.523 -0.973 9.006 89 1HH2 ARG 8 1HH1 ARG 8 -6.300 -1.255 6.948 90 2HH2 ARG 8 2HH1 ARG 8 -5.720 -1.292 8.579 91 H LYS 9 H LYS 9 -1.431 -3.390 0.251 92 HA LYS 9 HA LYS 9 -3.141 -5.815 0.199 93 1HB LYS 9 2HB LYS 9 -1.679 -4.097 -1.811 94 2HB LYS 9 1HB LYS 9 -2.383 -5.649 -2.275 95 1HG LYS 9 2HG LYS 9 -3.954 -3.480 -0.872 96 2HG LYS 9 1HG LYS 9 -3.885 -3.630 -2.627 97 1HD LYS 9 2HD LYS 9 -4.742 -5.956 -2.439 98 2HD LYS 9 1HD LYS 9 -4.879 -5.745 -0.694 99 1HE LYS 9 2HE LYS 9 -6.466 -3.877 -1.036 100 2HE LYS 9 1HE LYS 9 -6.339 -4.098 -2.792 101 1HZ LYS 9 1HZ LYS 9 -7.098 -6.351 -2.571 102 2HZ LYS 9 2HZ LYS 9 -8.224 -5.330 -1.813 103 3HZ LYS 9 3HZ LYS 9 -7.128 -6.231 -0.879 104 H TRP 10 H TRP 10 0.066 -5.156 -1.245 105 HA TRP 10 HA TRP 10 0.890 -7.930 -0.717 106 1HB TRP 10 2HB TRP 10 2.461 -5.665 -1.963 107 2HB TRP 10 1HB TRP 10 2.602 -7.388 -2.297 108 HD1 TRP 10 HD TRP 10 1.864 -4.822 -4.281 109 HE1 TRP 10 1HE TRP 10 -0.179 -5.139 -5.821 110 HE3 TRP 10 3HE TRP 10 -0.523 -8.591 -1.871 111 HZ2 TRP 10 2HZ TRP 10 -2.514 -6.761 -6.016 112 HZ3 TRP 10 3HZ TRP 10 -2.654 -9.520 -2.730 113 HH2 TRP 10 HH TRP 10 -3.655 -8.603 -4.806 114 H LYS 11 H LYS 11 3.561 -5.901 -0.689 115 HA LYS 11 HA LYS 11 3.641 -5.275 2.161 116 1HB LYS 11 2HB LYS 11 5.776 -6.716 2.355 117 2HB LYS 11 1HB LYS 11 4.243 -7.584 2.337 118 1HG LYS 11 2HG LYS 11 5.421 -7.070 -0.324 119 2HG LYS 11 1HG LYS 11 6.332 -8.186 0.698 120 1HD LYS 11 2HD LYS 11 4.683 -9.772 0.668 121 2HD LYS 11 1HD LYS 11 3.393 -8.566 0.650 122 1HE LYS 11 2HE LYS 11 3.175 -9.259 -1.539 123 2HE LYS 11 1HE LYS 11 4.521 -8.131 -1.804 124 1HZ LYS 11 1HZ LYS 11 4.805 -11.005 -1.098 125 2HZ LYS 11 2HZ LYS 11 6.078 -9.915 -1.380 126 3HZ LYS 11 3HZ LYS 11 5.037 -10.358 -2.648 127 H LYS 12 H LYS 12 3.704 -3.850 -0.285 128 HA LYS 12 HA LYS 12 5.920 -3.214 -1.650 129 1HB LYS 12 2HB LYS 12 3.942 -1.406 -0.259 130 2HB LYS 12 1HB LYS 12 5.104 -0.806 -1.439 131 1HG LYS 12 2HG LYS 12 3.128 -3.039 -1.977 132 2HG LYS 12 1HG LYS 12 2.890 -1.359 -2.460 133 1HD LYS 12 2HD LYS 12 5.281 -1.663 -3.548 134 2HD LYS 12 1HD LYS 12 4.850 -3.373 -3.506 135 1HE LYS 12 2HE LYS 12 3.924 -2.818 -5.560 136 2HE LYS 12 1HE LYS 12 2.551 -2.385 -4.524 137 1HZ LYS 12 1HZ LYS 12 3.401 -0.144 -4.353 138 2HZ LYS 12 2HZ LYS 12 3.195 -0.546 -5.991 139 3HZ LYS 12 3HZ LYS 12 4.748 -0.541 -5.304 Start of MODEL 7 1 1H ARG 1 1HT ARG 1 1.687 10.506 -4.908 2 2H ARG 1 2HT ARG 1 1.112 9.019 -5.494 3 3H ARG 1 3HT ARG 1 2.520 9.705 -6.150 4 HA ARG 1 HA ARG 1 3.143 7.922 -4.667 5 1HB ARG 1 2HB ARG 1 4.555 9.911 -4.877 6 2HB ARG 1 1HB ARG 1 3.594 10.748 -3.666 7 1HG ARG 1 2HG ARG 1 5.587 9.926 -2.576 8 2HG ARG 1 1HG ARG 1 4.225 8.953 -2.025 9 1HD ARG 1 2HD ARG 1 5.903 7.357 -2.560 10 2HD ARG 1 1HD ARG 1 4.829 7.368 -3.969 11 HE ARG 1 HE ARG 1 6.698 9.376 -4.481 12 1HH1 ARG 1 1HH1 ARG 1 8.203 7.111 -2.858 13 2HH1 ARG 1 2HH1 ARG 1 8.990 6.309 -4.177 14 1HH2 ARG 1 1HH2 ARG 1 7.072 7.864 -6.613 15 2HH2 ARG 1 2HH2 ARG 1 8.349 6.735 -6.302 16 H GLN 2 H GLN 2 1.296 6.871 -3.671 17 HA GLN 2 HA GLN 2 0.499 8.030 -1.022 18 1HB GLN 2 2HB GLN 2 -0.951 6.731 -3.270 19 2HB GLN 2 1HB GLN 2 -1.491 6.307 -1.641 20 1HG GLN 2 2HG GLN 2 -2.758 8.231 -2.342 21 2HG GLN 2 1HG GLN 2 -1.600 8.773 -1.126 22 1HE2 GLN 2 1HE2 GLN 2 -0.618 10.696 -1.729 23 2HE2 GLN 2 2HE2 GLN 2 -0.237 11.144 -3.331 24 H ILE 3 H ILE 3 1.066 4.994 -2.796 25 HA ILE 3 HA ILE 3 1.465 2.825 -2.006 26 HB ILE 3 HB ILE 3 3.463 4.525 -2.016 27 1HG1 ILE 3 2HG1 ILE 3 3.503 2.148 -2.510 28 2HG1 ILE 3 1HG1 ILE 3 4.927 2.606 -1.559 29 1HG2 ILE 3 1HG2 ILE 3 2.825 4.819 0.627 30 2HG2 ILE 3 2HG2 ILE 3 4.432 5.094 -0.034 31 3HG2 ILE 3 3HG2 ILE 3 4.041 3.547 0.713 32 1HD1 ILE 3 1HD1 ILE 3 3.674 1.896 0.508 33 2HD1 ILE 3 2HD1 ILE 3 4.006 0.568 -0.604 34 3HD1 ILE 3 3HD1 ILE 3 2.395 1.281 -0.539 35 H LYS 4 H LYS 4 -0.742 3.850 -0.470 36 HA LYS 4 HA LYS 4 -0.082 2.803 2.246 37 1HB LYS 4 2HB LYS 4 -2.147 4.776 1.235 38 2HB LYS 4 1HB LYS 4 -2.059 4.192 2.890 39 1HG LYS 4 2HG LYS 4 0.548 4.907 2.249 40 2HG LYS 4 1HG LYS 4 -0.457 6.221 1.625 41 1HD LYS 4 2HD LYS 4 -1.323 6.736 3.739 42 2HD LYS 4 1HD LYS 4 -0.958 5.134 4.382 43 1HE LYS 4 2HE LYS 4 1.306 5.637 4.714 44 2HE LYS 4 1HE LYS 4 1.292 6.938 3.505 45 1HZ LYS 4 1HZ LYS 4 -0.336 8.103 4.963 46 2HZ LYS 4 2HZ LYS 4 1.213 7.956 5.643 47 3HZ LYS 4 3HZ LYS 4 -0.044 6.935 6.157 48 H ILE 5 H ILE 5 -2.583 2.877 -0.294 49 HA ILE 5 HA ILE 5 -4.149 0.697 0.846 50 HB ILE 5 HB ILE 5 -3.920 1.768 -1.993 51 1HG1 ILE 5 2HG1 ILE 5 -6.057 2.536 -0.023 52 2HG1 ILE 5 1HG1 ILE 5 -4.509 3.380 -0.040 53 1HG2 ILE 5 1HG2 ILE 5 -5.142 -0.216 -2.185 54 2HG2 ILE 5 2HG2 ILE 5 -6.419 0.968 -1.911 55 3HG2 ILE 5 3HG2 ILE 5 -5.857 -0.045 -0.582 56 1HD1 ILE 5 1HD1 ILE 5 -4.858 3.664 -2.560 57 2HD1 ILE 5 2HD1 ILE 5 -5.898 4.627 -1.511 58 3HD1 ILE 5 3HD1 ILE 5 -6.526 3.166 -2.273 59 H TRP 6 H TRP 6 -1.527 1.137 -1.416 60 HA TRP 6 HA TRP 6 -1.269 -1.509 -2.469 61 1HB TRP 6 2HB TRP 6 0.656 0.770 -1.930 62 2HB TRP 6 1HB TRP 6 1.099 -0.646 -2.867 63 HD1 TRP 6 HD TRP 6 0.136 -0.898 -5.183 64 HE1 TRP 6 1HE TRP 6 -1.067 0.685 -6.821 65 HE3 TRP 6 3HE TRP 6 -1.013 2.826 -1.978 66 HZ2 TRP 6 2HZ TRP 6 -2.354 3.237 -6.746 67 HZ3 TRP 6 3HZ TRP 6 -2.231 4.848 -2.763 68 HH2 TRP 6 HH TRP 6 -2.900 5.055 -5.145 69 H PHE 7 H PHE 7 0.573 0.183 -0.036 70 HA PHE 7 HA PHE 7 2.118 -1.915 1.040 71 1HB PHE 7 2HB PHE 7 2.443 0.403 1.645 72 2HB PHE 7 1HB PHE 7 0.798 0.531 2.259 73 HD1 PHE 7 1HD PHE 7 0.218 -0.195 4.464 74 HD2 PHE 7 2HD PHE 7 4.118 -1.006 2.860 75 HE1 PHE 7 1HE PHE 7 0.995 -0.902 6.712 76 HE2 PHE 7 2HE PHE 7 4.898 -1.715 5.107 77 HZ PHE 7 HZ PHE 7 3.335 -1.663 7.033 78 H ARG 8 H ARG 8 -1.287 -1.340 1.246 79 HA ARG 8 HA ARG 8 -1.731 -2.989 3.621 80 1HB ARG 8 2HB ARG 8 -2.820 -0.820 2.681 81 2HB ARG 8 1HB ARG 8 -3.772 -1.935 1.707 82 1HG ARG 8 2HG ARG 8 -5.009 -1.538 3.736 83 2HG ARG 8 1HG ARG 8 -4.302 -3.152 3.883 84 1HD ARG 8 2HD ARG 8 -3.201 -2.486 5.747 85 2HD ARG 8 1HD ARG 8 -2.356 -1.254 4.781 86 HE ARG 8 HE ARG 8 -5.066 -0.422 5.347 87 1HH1 ARG 8 1HH1 ARG 8 -3.953 -1.290 8.042 88 2HH1 ARG 8 2HH1 ARG 8 -3.269 0.193 8.618 89 1HH2 ARG 8 1HH2 ARG 8 -3.310 1.727 5.509 90 2HH2 ARG 8 2HH2 ARG 8 -2.905 1.901 7.184 91 H LYS 9 H LYS 9 -1.200 -3.660 0.335 92 HA LYS 9 HA LYS 9 -3.084 -5.977 0.321 93 1HB LYS 9 2HB LYS 9 -1.648 -4.288 -1.694 94 2HB LYS 9 1HB LYS 9 -2.094 -5.935 -2.151 95 1HG LYS 9 2HG LYS 9 -4.059 -3.985 -0.936 96 2HG LYS 9 1HG LYS 9 -3.823 -4.136 -2.677 97 1HD LYS 9 2HD LYS 9 -4.429 -6.502 -2.592 98 2HD LYS 9 1HD LYS 9 -4.578 -6.425 -0.836 99 1HE LYS 9 2HE LYS 9 -6.781 -5.977 -1.237 100 2HE LYS 9 1HE LYS 9 -6.222 -4.351 -1.679 101 1HZ LYS 9 1HZ LYS 9 -7.430 -5.264 -3.522 102 2HZ LYS 9 2HZ LYS 9 -6.506 -6.690 -3.491 103 3HZ LYS 9 3HZ LYS 9 -5.786 -5.217 -3.937 104 H TRP 10 H TRP 10 0.246 -5.398 -0.892 105 HA TRP 10 HA TRP 10 0.929 -8.209 -0.292 106 1HB TRP 10 2HB TRP 10 2.742 -6.175 -1.539 107 2HB TRP 10 1HB TRP 10 2.564 -7.876 -1.934 108 HD1 TRP 10 HD TRP 10 2.170 -4.946 -3.671 109 HE1 TRP 10 1HE TRP 10 0.128 -4.923 -5.246 110 HE3 TRP 10 3HE TRP 10 -0.539 -8.763 -1.720 111 HZ2 TRP 10 2HZ TRP 10 -2.329 -6.319 -5.635 112 HZ3 TRP 10 3HZ TRP 10 -2.728 -9.416 -2.685 113 HH2 TRP 10 HH TRP 10 -3.627 -8.190 -4.647 114 H LYS 11 H LYS 11 3.076 -5.389 -0.100 115 HA LYS 11 HA LYS 11 3.269 -5.266 2.740 116 1HB LYS 11 2HB LYS 11 5.711 -6.182 2.675 117 2HB LYS 11 1HB LYS 11 4.375 -7.325 2.726 118 1HG LYS 11 2HG LYS 11 5.047 -6.582 -0.008 119 2HG LYS 11 1HG LYS 11 6.417 -7.301 0.841 120 1HD LYS 11 2HD LYS 11 5.363 -9.323 1.116 121 2HD LYS 11 1HD LYS 11 3.762 -8.581 1.210 122 1HE LYS 11 2HE LYS 11 3.571 -9.467 -0.915 123 2HE LYS 11 1HE LYS 11 4.417 -7.970 -1.359 124 1HZ LYS 11 1HZ LYS 11 6.532 -9.195 -0.890 125 2HZ LYS 11 2HZ LYS 11 5.679 -9.757 -2.249 126 3HZ LYS 11 3HZ LYS 11 5.622 -10.623 -0.789 127 H LYS 12 H LYS 12 5.000 -4.994 -0.324 128 HA LYS 12 HA LYS 12 5.049 -2.226 -0.464 129 1HB LYS 12 2HB LYS 12 7.505 -1.879 0.207 130 2HB LYS 12 1HB LYS 12 6.375 -2.173 1.522 131 1HG LYS 12 2HG LYS 12 8.209 -3.594 1.998 132 2HG LYS 12 1HG LYS 12 7.004 -4.662 1.282 133 1HD LYS 12 2HD LYS 12 8.719 -5.280 -0.081 134 2HD LYS 12 1HD LYS 12 8.301 -3.802 -0.945 135 1HE LYS 12 2HE LYS 12 10.512 -3.280 -0.593 136 2HE LYS 12 1HE LYS 12 9.940 -2.813 1.021 137 1HZ LYS 12 1HZ LYS 12 11.637 -4.378 1.398 138 2HZ LYS 12 2HZ LYS 12 11.083 -5.412 0.170 139 3HZ LYS 12 3HZ LYS 12 10.194 -5.245 1.608 Start of MODEL 8 1 1H ARG 1 1HT ARG 1 3.654 7.468 -4.137 2 2H ARG 1 2HT ARG 1 3.528 7.952 -5.761 3 3H ARG 1 3HT ARG 1 2.307 7.002 -5.056 4 HA ARG 1 HA ARG 1 2.978 9.811 -4.328 5 1HB ARG 1 2HB ARG 1 1.840 9.214 -6.553 6 2HB ARG 1 1HB ARG 1 0.493 8.633 -5.582 7 1HG ARG 1 2HG ARG 1 -0.049 10.888 -6.118 8 2HG ARG 1 1HG ARG 1 0.508 10.913 -4.445 9 1HD ARG 1 2HD ARG 1 1.697 12.700 -5.431 10 2HD ARG 1 1HD ARG 1 2.850 11.355 -5.479 11 HE ARG 1 HE ARG 1 1.274 11.213 -7.837 12 1HH1 ARG 1 1HH2 ARG 1 4.292 11.267 -7.755 13 2HH1 ARG 1 2HH2 ARG 1 4.639 12.738 -8.599 14 1HH2 ARG 1 1HH1 ARG 1 1.414 13.977 -8.307 15 2HH2 ARG 1 2HH1 ARG 1 3.010 14.274 -8.911 16 H GLN 2 H GLN 2 0.535 7.200 -3.962 17 HA GLN 2 HA GLN 2 -0.137 8.298 -1.269 18 1HB GLN 2 2HB GLN 2 -1.516 6.870 -3.459 19 2HB GLN 2 1HB GLN 2 -1.964 6.338 -1.835 20 1HG GLN 2 2HG GLN 2 -3.446 8.145 -2.460 21 2HG GLN 2 1HG GLN 2 -2.337 8.751 -1.226 22 1HE2 GLN 2 1HE2 GLN 2 -1.414 10.727 -1.742 23 2HE2 GLN 2 2HE2 GLN 2 -1.154 11.306 -3.326 24 H ILE 3 H ILE 3 0.575 5.209 -2.896 25 HA ILE 3 HA ILE 3 1.186 3.137 -2.020 26 HB ILE 3 HB ILE 3 3.034 4.998 -2.110 27 1HG1 ILE 3 2HG1 ILE 3 3.269 2.629 -2.552 28 2HG1 ILE 3 1HG1 ILE 3 4.651 3.207 -1.605 29 1HG2 ILE 3 1HG2 ILE 3 3.935 5.730 -0.157 30 2HG2 ILE 3 2HG2 ILE 3 3.767 4.155 0.613 31 3HG2 ILE 3 3HG2 ILE 3 2.398 5.259 0.560 32 1HD1 ILE 3 1HD1 ILE 3 3.870 1.120 -0.621 33 2HD1 ILE 3 2HD1 ILE 3 2.215 1.725 -0.565 34 3HD1 ILE 3 3HD1 ILE 3 3.451 2.440 0.470 35 H LYS 4 H LYS 4 -1.079 4.095 -0.491 36 HA LYS 4 HA LYS 4 -0.335 3.169 2.245 37 1HB LYS 4 2HB LYS 4 -2.604 4.912 1.239 38 2HB LYS 4 1HB LYS 4 -2.300 4.490 2.916 39 1HG LYS 4 2HG LYS 4 0.153 5.370 2.005 40 2HG LYS 4 1HG LYS 4 -1.003 6.502 1.297 41 1HD LYS 4 2HD LYS 4 -2.041 6.626 3.656 42 2HD LYS 4 1HD LYS 4 -0.550 5.865 4.209 43 1HE LYS 4 2HE LYS 4 -0.076 8.178 4.410 44 2HE LYS 4 1HE LYS 4 0.627 7.770 2.831 45 1HZ LYS 4 1HZ LYS 4 -2.076 8.896 3.342 46 2HZ LYS 4 2HZ LYS 4 -1.546 8.336 1.827 47 3HZ LYS 4 3HZ LYS 4 -0.788 9.670 2.556 48 H ILE 5 H ILE 5 -2.895 3.047 -0.233 49 HA ILE 5 HA ILE 5 -4.252 0.767 0.999 50 HB ILE 5 HB ILE 5 -4.390 1.784 -1.858 51 1HG1 ILE 5 2HG1 ILE 5 -4.698 3.765 -0.606 52 2HG1 ILE 5 1HG1 ILE 5 -6.333 3.181 -0.903 53 1HG2 ILE 5 1HG2 ILE 5 -6.116 0.126 -0.059 54 2HG2 ILE 5 2HG2 ILE 5 -5.739 -0.101 -1.767 55 3HG2 ILE 5 3HG2 ILE 5 -6.893 1.138 -1.277 56 1HD1 ILE 5 1HD1 ILE 5 -6.370 3.670 1.394 57 2HD1 ILE 5 2HD1 ILE 5 -4.727 3.077 1.640 58 3HD1 ILE 5 3HD1 ILE 5 -6.045 1.937 1.372 59 H TRP 6 H TRP 6 -1.497 1.304 -0.902 60 HA TRP 6 HA TRP 6 -1.372 -1.316 -2.228 61 1HB TRP 6 2HB TRP 6 0.468 1.067 -1.883 62 2HB TRP 6 1HB TRP 6 0.911 -0.343 -2.833 63 HD1 TRP 6 HD TRP 6 -0.114 -0.624 -5.090 64 HE1 TRP 6 1HE TRP 6 -1.605 0.819 -6.619 65 HE3 TRP 6 3HE TRP 6 -1.495 2.890 -1.747 66 HZ2 TRP 6 2HZ TRP 6 -3.190 3.192 -6.410 67 HZ3 TRP 6 3HZ TRP 6 -3.003 4.755 -2.409 68 HH2 TRP 6 HH TRP 6 -3.848 4.908 -4.740 69 H PHE 7 H PHE 7 0.514 0.489 0.082 70 HA PHE 7 HA PHE 7 2.318 -1.458 1.019 71 1HB PHE 7 2HB PHE 7 2.345 0.916 1.653 72 2HB PHE 7 1HB PHE 7 0.804 0.735 2.484 73 HD1 PHE 7 1HD PHE 7 4.400 0.317 2.717 74 HD2 PHE 7 2HD PHE 7 0.647 -0.746 4.516 75 HE1 PHE 7 1HE PHE 7 5.584 -0.352 4.793 76 HE2 PHE 7 2HE PHE 7 1.832 -1.416 6.590 77 HZ PHE 7 HZ PHE 7 4.299 -1.219 6.729 78 H ARG 8 H ARG 8 -1.113 -1.226 1.465 79 HA ARG 8 HA ARG 8 -1.189 -3.103 3.727 80 1HB ARG 8 2HB ARG 8 -2.456 -0.881 3.187 81 2HB ARG 8 1HB ARG 8 -3.498 -1.933 2.238 82 1HG ARG 8 2HG ARG 8 -4.421 -1.762 4.482 83 2HG ARG 8 1HG ARG 8 -3.732 -3.379 4.302 84 1HD ARG 8 2HD ARG 8 -2.295 -2.980 6.004 85 2HD ARG 8 1HD ARG 8 -1.662 -1.560 5.136 86 HE ARG 8 HE ARG 8 -3.736 -0.351 6.076 87 1HH1 ARG 8 1HH2 ARG 8 -1.596 -0.624 8.137 88 2HH1 ARG 8 2HH2 ARG 8 -2.455 -1.314 9.473 89 1HH2 ARG 8 1HH1 ARG 8 -5.164 -2.318 7.556 90 2HH2 ARG 8 2HH1 ARG 8 -4.475 -2.274 9.144 91 H LYS 9 H LYS 9 -1.364 -3.196 0.277 92 HA LYS 9 HA LYS 9 -3.135 -5.547 0.153 93 1HB LYS 9 2HB LYS 9 -1.877 -3.572 -1.641 94 2HB LYS 9 1HB LYS 9 -2.014 -5.191 -2.332 95 1HG LYS 9 2HG LYS 9 -4.321 -3.768 -0.990 96 2HG LYS 9 1HG LYS 9 -4.016 -3.676 -2.724 97 1HD LYS 9 2HD LYS 9 -4.228 -6.093 -2.937 98 2HD LYS 9 1HD LYS 9 -4.398 -6.262 -1.190 99 1HE LYS 9 2HE LYS 9 -6.387 -4.478 -1.662 100 2HE LYS 9 1HE LYS 9 -6.400 -5.370 -3.196 101 1HZ LYS 9 1HZ LYS 9 -6.340 -6.658 -0.519 102 2HZ LYS 9 2HZ LYS 9 -6.516 -7.433 -2.021 103 3HZ LYS 9 3HZ LYS 9 -7.755 -6.433 -1.427 104 H TRP 10 H TRP 10 0.167 -4.975 -1.153 105 HA TRP 10 HA TRP 10 0.736 -7.850 -1.008 106 1HB TRP 10 2HB TRP 10 2.540 -5.556 -1.812 107 2HB TRP 10 1HB TRP 10 2.604 -7.223 -2.375 108 HD1 TRP 10 HD TRP 10 2.126 -4.391 -4.059 109 HE1 TRP 10 1HE TRP 10 0.158 -4.381 -5.718 110 HE3 TRP 10 3HE TRP 10 -0.618 -8.253 -2.250 111 HZ2 TRP 10 2HZ TRP 10 -2.258 -5.801 -6.222 112 HZ3 TRP 10 3HZ TRP 10 -2.752 -8.922 -3.316 113 HH2 TRP 10 HH TRP 10 -3.576 -7.693 -5.307 114 H LYS 11 H LYS 11 3.573 -6.143 -0.521 115 HA LYS 11 HA LYS 11 3.557 -5.838 2.354 116 1HB LYS 11 2HB LYS 11 5.138 -7.772 2.733 117 2HB LYS 11 1HB LYS 11 3.502 -8.259 2.293 118 1HG LYS 11 2HG LYS 11 5.342 -7.810 0.020 119 2HG LYS 11 1HG LYS 11 5.728 -9.196 1.045 120 1HD LYS 11 2HD LYS 11 3.907 -10.357 0.357 121 2HD LYS 11 1HD LYS 11 2.869 -8.934 0.458 122 1HE LYS 11 2HE LYS 11 2.883 -9.293 -1.855 123 2HE LYS 11 1HE LYS 11 4.272 -8.199 -1.697 124 1HZ LYS 11 1HZ LYS 11 4.812 -10.258 -2.927 125 2HZ LYS 11 2HZ LYS 11 4.438 -11.162 -1.538 126 3HZ LYS 11 3HZ LYS 11 5.740 -10.071 -1.520 127 H LYS 12 H LYS 12 4.316 -4.461 -0.092 128 HA LYS 12 HA LYS 12 6.287 -3.766 -1.294 129 1HB LYS 12 2HB LYS 12 7.174 -1.992 0.557 130 2HB LYS 12 1HB LYS 12 5.676 -1.787 -0.345 131 1HG LYS 12 2HG LYS 12 5.219 -1.434 2.013 132 2HG LYS 12 1HG LYS 12 4.460 -2.947 1.523 133 1HD LYS 12 2HD LYS 12 5.527 -3.699 3.417 134 2HD LYS 12 1HD LYS 12 6.844 -3.912 2.266 135 1HE LYS 12 2HE LYS 12 8.097 -2.275 3.231 136 2HE LYS 12 1HE LYS 12 6.701 -1.191 3.389 137 1HZ LYS 12 1HZ LYS 12 7.473 -1.970 5.562 138 2HZ LYS 12 2HZ LYS 12 7.223 -3.581 5.081 139 3HZ LYS 12 3HZ LYS 12 5.902 -2.521 5.233 Start of MODEL 9 1 1H ARG 1 1HT ARG 1 3.010 9.498 -4.438 2 2H ARG 1 2HT ARG 1 4.562 9.035 -4.951 3 3H ARG 1 3HT ARG 1 4.265 9.348 -3.308 4 HA ARG 1 HA ARG 1 3.099 7.105 -4.882 5 1HB ARG 1 2HB ARG 1 5.617 7.562 -3.589 6 2HB ARG 1 1HB ARG 1 4.727 6.371 -2.647 7 1HG ARG 1 2HG ARG 1 5.945 5.138 -4.297 8 2HG ARG 1 1HG ARG 1 4.264 5.162 -4.826 9 1HD ARG 1 2HD ARG 1 5.441 5.752 -6.784 10 2HD ARG 1 1HD ARG 1 4.947 7.316 -6.109 11 HE ARG 1 HE ARG 1 7.332 6.917 -4.855 12 1HH1 ARG 1 1HH2 ARG 1 6.490 8.291 -7.684 13 2HH1 ARG 1 2HH2 ARG 1 7.961 7.967 -8.540 14 1HH2 ARG 1 1HH1 ARG 1 9.180 5.769 -6.151 15 2HH2 ARG 1 2HH1 ARG 1 9.482 6.541 -7.672 16 H GLN 2 H GLN 2 1.026 6.916 -4.078 17 HA GLN 2 HA GLN 2 0.121 7.850 -1.535 18 1HB GLN 2 2HB GLN 2 -0.820 5.994 -3.683 19 2HB GLN 2 1HB GLN 2 -1.688 5.994 -2.144 20 1HG GLN 2 2HG GLN 2 -2.740 7.606 -3.609 21 2HG GLN 2 1HG GLN 2 -1.897 8.487 -2.333 22 1HE2 GLN 2 1HE2 GLN 2 -0.844 10.272 -3.189 23 2HE2 GLN 2 2HE2 GLN 2 -0.058 10.316 -4.701 24 H ILE 3 H ILE 3 1.231 4.654 -2.601 25 HA ILE 3 HA ILE 3 1.607 2.684 -1.411 26 HB ILE 3 HB ILE 3 3.378 4.607 -1.142 27 1HG1 ILE 3 2HG1 ILE 3 3.748 2.215 -1.311 28 2HG1 ILE 3 1HG1 ILE 3 4.821 2.915 -0.086 29 1HG2 ILE 3 1HG2 ILE 3 3.239 3.961 1.750 30 2HG2 ILE 3 2HG2 ILE 3 2.042 5.116 1.173 31 3HG2 ILE 3 3HG2 ILE 3 3.757 5.446 0.955 32 1HD1 ILE 3 1HD1 ILE 3 2.226 1.415 0.387 33 2HD1 ILE 3 2HD1 ILE 3 3.107 2.273 1.651 34 3HD1 ILE 3 3HD1 ILE 3 3.846 0.892 0.842 35 H LYS 4 H LYS 4 -0.992 3.802 -0.629 36 HA LYS 4 HA LYS 4 -1.035 3.028 2.252 37 1HB LYS 4 2HB LYS 4 -2.865 4.758 0.559 38 2HB LYS 4 1HB LYS 4 -3.110 4.389 2.259 39 1HG LYS 4 2HG LYS 4 -0.459 5.194 2.089 40 2HG LYS 4 1HG LYS 4 -1.352 6.344 1.090 41 1HD LYS 4 2HD LYS 4 -2.993 6.553 3.031 42 2HD LYS 4 1HD LYS 4 -1.814 5.665 3.998 43 1HE LYS 4 2HE LYS 4 -0.366 7.446 4.101 44 2HE LYS 4 1HE LYS 4 -0.753 7.981 2.454 45 1HZ LYS 4 1HZ LYS 4 -1.747 9.537 3.921 46 2HZ LYS 4 2HZ LYS 4 -2.405 8.312 4.897 47 3HZ LYS 4 3HZ LYS 4 -3.006 8.569 3.329 48 H ILE 5 H ILE 5 -2.785 2.762 -0.837 49 HA ILE 5 HA ILE 5 -4.528 0.605 0.080 50 HB ILE 5 HB ILE 5 -3.736 1.385 -2.747 51 1HG1 ILE 5 2HG1 ILE 5 -4.357 3.463 -1.799 52 2HG1 ILE 5 1HG1 ILE 5 -5.830 2.872 -2.561 53 1HG2 ILE 5 1HG2 ILE 5 -5.960 -0.141 -1.466 54 2HG2 ILE 5 2HG2 ILE 5 -5.112 -0.454 -2.980 55 3HG2 ILE 5 3HG2 ILE 5 -6.335 0.815 -2.899 56 1HD1 ILE 5 1HD1 ILE 5 -6.323 1.805 -0.232 57 2HD1 ILE 5 2HD1 ILE 5 -6.580 3.538 -0.435 58 3HD1 ILE 5 3HD1 ILE 5 -5.121 2.950 0.363 59 H TRP 6 H TRP 6 -1.330 0.982 -1.058 60 HA TRP 6 HA TRP 6 -0.881 -1.751 -2.008 61 1HB TRP 6 2HB TRP 6 0.857 0.640 -1.332 62 2HB TRP 6 1HB TRP 6 1.501 -0.848 -2.008 63 HD1 TRP 6 HD TRP 6 1.143 -1.304 -4.438 64 HE1 TRP 6 1HE TRP 6 0.224 0.038 -6.436 65 HE3 TRP 6 3HE TRP 6 -0.965 2.521 -1.913 66 HZ2 TRP 6 2HZ TRP 6 -1.236 2.457 -6.875 67 HZ3 TRP 6 3HZ TRP 6 -2.128 4.356 -3.124 68 HH2 TRP 6 HH TRP 6 -2.261 4.328 -5.603 69 H PHE 7 H PHE 7 0.351 0.251 0.569 70 HA PHE 7 HA PHE 7 1.710 -1.625 2.165 71 1HB PHE 7 2HB PHE 7 1.724 0.781 2.574 72 2HB PHE 7 1HB PHE 7 -0.012 0.779 2.872 73 HD1 PHE 7 1HD PHE 7 2.875 -1.308 4.065 74 HD2 PHE 7 2HD PHE 7 -0.539 1.079 5.113 75 HE1 PHE 7 1HE PHE 7 3.275 -1.791 6.465 76 HE2 PHE 7 2HE PHE 7 -0.138 0.599 7.513 77 HZ PHE 7 HZ PHE 7 1.769 -0.838 8.189 78 H ARG 8 H ARG 8 -1.686 -1.270 1.583 79 HA ARG 8 HA ARG 8 -2.530 -2.801 3.935 80 1HB ARG 8 2HB ARG 8 -3.481 -0.717 2.690 81 2HB ARG 8 1HB ARG 8 -4.202 -1.916 1.622 82 1HG ARG 8 2HG ARG 8 -5.793 -1.425 3.388 83 2HG ARG 8 1HG ARG 8 -5.131 -3.034 3.698 84 1HD ARG 8 2HD ARG 8 -4.357 -2.328 5.703 85 2HD ARG 8 1HD ARG 8 -3.370 -1.104 4.874 86 HE ARG 8 HE ARG 8 -6.087 -0.214 4.901 87 1HH1 ARG 8 1HH2 ARG 8 -4.573 -1.457 7.579 88 2HH1 ARG 8 2HH2 ARG 8 -4.528 0.021 8.482 89 1HH2 ARG 8 1HH1 ARG 8 -5.540 1.992 5.815 90 2HH2 ARG 8 2HH1 ARG 8 -5.077 1.973 7.484 91 H LYS 9 H LYS 9 -1.336 -3.616 0.875 92 HA LYS 9 HA LYS 9 -2.989 -6.115 0.804 93 1HB LYS 9 2HB LYS 9 -1.932 -4.216 -1.253 94 2HB LYS 9 1HB LYS 9 -2.095 -5.915 -1.702 95 1HG LYS 9 2HG LYS 9 -4.333 -4.332 -0.426 96 2HG LYS 9 1HG LYS 9 -4.127 -4.451 -2.174 97 1HD LYS 9 2HD LYS 9 -4.305 -6.891 -2.059 98 2HD LYS 9 1HD LYS 9 -4.432 -6.819 -0.301 99 1HE LYS 9 2HE LYS 9 -6.437 -5.114 -0.967 100 2HE LYS 9 1HE LYS 9 -6.486 -6.214 -2.359 101 1HZ LYS 9 1HZ LYS 9 -7.795 -7.029 -0.441 102 2HZ LYS 9 2HZ LYS 9 -6.366 -7.099 0.475 103 3HZ LYS 9 3HZ LYS 9 -6.551 -8.090 -0.893 104 H TRP 10 H TRP 10 0.012 -5.289 -0.924 105 HA TRP 10 HA TRP 10 1.238 -7.790 0.049 106 1HB TRP 10 2HB TRP 10 2.278 -5.754 -1.930 107 2HB TRP 10 1HB TRP 10 2.632 -7.479 -1.871 108 HD1 TRP 10 HD TRP 10 1.223 -5.651 -4.269 109 HE1 TRP 10 1HE TRP 10 -0.952 -6.592 -5.277 110 HE3 TRP 10 3HE TRP 10 -0.183 -8.836 -0.589 111 HZ2 TRP 10 2HZ TRP 10 -3.020 -8.442 -4.623 112 HZ3 TRP 10 3HZ TRP 10 -2.252 -10.188 -0.777 113 HH2 TRP 10 HH TRP 10 -3.677 -9.990 -2.798 114 H LYS 11 H LYS 11 3.638 -5.634 -0.809 115 HA LYS 11 HA LYS 11 3.979 -4.179 1.672 116 1HB LYS 11 2HB LYS 11 5.956 -5.469 2.432 117 2HB LYS 11 1HB LYS 11 4.507 -6.474 2.410 118 1HG LYS 11 2HG LYS 11 6.197 -6.375 -0.054 119 2HG LYS 11 1HG LYS 11 6.768 -7.331 1.314 120 1HD LYS 11 2HD LYS 11 5.254 -8.947 0.911 121 2HD LYS 11 1HD LYS 11 3.943 -7.765 0.860 122 1HE LYS 11 2HE LYS 11 4.036 -8.824 -1.321 123 2HE LYS 11 1HE LYS 11 4.711 -7.193 -1.511 124 1HZ LYS 11 1HZ LYS 11 6.926 -8.180 -1.030 125 2HZ LYS 11 2HZ LYS 11 6.239 -8.725 -2.485 126 3HZ LYS 11 3HZ LYS 11 6.220 -9.720 -1.109 127 H LYS 12 H LYS 12 3.977 -3.829 -1.227 128 HA LYS 12 HA LYS 12 5.546 -3.377 -3.021 129 1HB LYS 12 2HB LYS 12 6.039 -0.812 -2.325 130 2HB LYS 12 1HB LYS 12 4.455 -1.381 -2.843 131 1HG LYS 12 2HG LYS 12 4.191 -0.091 -0.803 132 2HG LYS 12 1HG LYS 12 3.873 -1.784 -0.434 133 1HD LYS 12 2HD LYS 12 5.311 -1.210 1.305 134 2HD LYS 12 1HD LYS 12 6.447 -1.836 0.112 135 1HE LYS 12 2HE LYS 12 7.107 0.356 -0.571 136 2HE LYS 12 1HE LYS 12 5.735 1.104 0.270 137 1HZ LYS 12 1HZ LYS 12 7.655 1.300 1.663 138 2HZ LYS 12 2HZ LYS 12 8.005 -0.355 1.510 139 3HZ LYS 12 3HZ LYS 12 6.622 0.148 2.358 Start of MODEL 10 1 1H ARG 1 1HT ARG 1 3.272 10.672 -3.991 2 2H ARG 1 2HT ARG 1 1.686 10.926 -4.541 3 3H ARG 1 3HT ARG 1 2.929 10.587 -5.649 4 HA ARG 1 HA ARG 1 1.676 8.593 -5.393 5 1HB ARG 1 2HB ARG 1 3.506 7.168 -4.637 6 2HB ARG 1 1HB ARG 1 4.190 8.544 -5.474 7 1HG ARG 1 2HG ARG 1 3.926 9.304 -2.762 8 2HG ARG 1 1HG ARG 1 4.633 7.702 -2.813 9 1HD ARG 1 2HD ARG 1 6.395 9.445 -2.897 10 2HD ARG 1 1HD ARG 1 6.367 8.485 -4.390 11 HE ARG 1 HE ARG 1 4.794 10.361 -5.243 12 1HH1 ARG 1 1HH2 ARG 1 7.943 10.677 -4.431 13 2HH1 ARG 1 2HH2 ARG 1 7.921 12.381 -4.122 14 1HH2 ARG 1 1HH1 ARG 1 4.462 12.617 -4.189 15 2HH2 ARG 1 2HH1 ARG 1 5.949 13.480 -3.984 16 H GLN 2 H GLN 2 0.768 6.970 -3.938 17 HA GLN 2 HA GLN 2 0.190 8.050 -1.203 18 1HB GLN 2 2HB GLN 2 -1.398 6.955 -3.390 19 2HB GLN 2 1HB GLN 2 -1.699 6.097 -1.875 20 1HG GLN 2 2HG GLN 2 -3.230 7.976 -2.019 21 2HG GLN 2 1HG GLN 2 -2.043 8.310 -0.753 22 1HE2 GLN 2 1HE2 GLN 2 -1.642 10.530 -0.866 23 2HE2 GLN 2 2HE2 GLN 2 -1.278 11.374 -2.302 24 H ILE 3 H ILE 3 0.714 5.038 -3.028 25 HA ILE 3 HA ILE 3 1.254 2.887 -2.272 26 HB ILE 3 HB ILE 3 3.185 4.661 -2.439 27 1HG1 ILE 3 2HG1 ILE 3 3.270 2.306 -2.983 28 2HG1 ILE 3 1HG1 ILE 3 4.744 2.777 -2.116 29 1HG2 ILE 3 1HG2 ILE 3 4.344 5.189 -0.536 30 2HG2 ILE 3 2HG2 ILE 3 3.962 3.657 0.246 31 3HG2 ILE 3 3HG2 ILE 3 2.774 4.956 0.225 32 1HD1 ILE 3 1HD1 ILE 3 3.665 1.975 0.007 33 2HD1 ILE 3 2HD1 ILE 3 3.925 0.686 -1.167 34 3HD1 ILE 3 3HD1 ILE 3 2.315 1.373 -0.957 35 H LYS 4 H LYS 4 -0.828 3.914 -0.535 36 HA LYS 4 HA LYS 4 0.074 2.805 2.088 37 1HB LYS 4 2HB LYS 4 -2.040 4.841 1.327 38 2HB LYS 4 1HB LYS 4 -1.809 4.212 2.950 39 1HG LYS 4 2HG LYS 4 0.740 4.907 2.091 40 2HG LYS 4 1HG LYS 4 -0.292 6.246 1.588 41 1HD LYS 4 2HD LYS 4 -0.169 7.000 3.714 42 2HD LYS 4 1HD LYS 4 -1.179 5.627 4.166 43 1HE LYS 4 2HE LYS 4 1.111 4.312 4.180 44 2HE LYS 4 1HE LYS 4 1.802 5.933 4.390 45 1HZ LYS 4 1HZ LYS 4 0.421 6.326 6.260 46 2HZ LYS 4 2HZ LYS 4 1.135 4.805 6.507 47 3HZ LYS 4 3HZ LYS 4 -0.479 4.914 5.991 48 H ILE 5 H ILE 5 -2.616 2.972 -0.235 49 HA ILE 5 HA ILE 5 -4.109 0.785 1.013 50 HB ILE 5 HB ILE 5 -4.264 1.862 -1.823 51 1HG1 ILE 5 2HG1 ILE 5 -4.365 3.836 -0.520 52 2HG1 ILE 5 1HG1 ILE 5 -6.049 3.397 -0.786 53 1HG2 ILE 5 1HG2 ILE 5 -6.332 0.675 0.050 54 2HG2 ILE 5 2HG2 ILE 5 -5.613 -0.137 -1.341 55 3HG2 ILE 5 3HG2 ILE 5 -6.653 1.267 -1.579 56 1HD1 ILE 5 1HD1 ILE 5 -5.729 2.047 1.464 57 2HD1 ILE 5 2HD1 ILE 5 -6.060 3.780 1.509 58 3HD1 ILE 5 3HD1 ILE 5 -4.411 3.191 1.715 59 H TRP 6 H TRP 6 -1.389 1.150 -0.963 60 HA TRP 6 HA TRP 6 -1.492 -1.468 -2.310 61 1HB TRP 6 2HB TRP 6 0.479 0.825 -2.090 62 2HB TRP 6 1HB TRP 6 0.791 -0.604 -3.063 63 HD1 TRP 6 HD TRP 6 -0.360 -0.810 -5.265 64 HE1 TRP 6 1HE TRP 6 -1.881 0.701 -6.693 65 HE3 TRP 6 3HE TRP 6 -1.421 2.720 -1.818 66 HZ2 TRP 6 2HZ TRP 6 -3.362 3.128 -6.376 67 HZ3 TRP 6 3HZ TRP 6 -2.895 4.643 -2.380 68 HH2 TRP 6 HH TRP 6 -3.863 4.850 -4.658 69 H PHE 7 H PHE 7 0.656 0.255 -0.169 70 HA PHE 7 HA PHE 7 2.375 -1.802 0.693 71 1HB PHE 7 2HB PHE 7 2.683 0.550 1.247 72 2HB PHE 7 1HB PHE 7 1.163 0.579 2.136 73 HD1 PHE 7 1HD PHE 7 4.652 -0.608 2.161 74 HD2 PHE 7 2HD PHE 7 0.964 -0.396 4.351 75 HE1 PHE 7 1HE PHE 7 5.839 -1.311 4.224 76 HE2 PHE 7 2HE PHE 7 2.149 -1.099 6.414 77 HZ PHE 7 HZ PHE 7 4.586 -1.557 6.350 78 H ARG 8 H ARG 8 -0.981 -1.293 1.368 79 HA ARG 8 HA ARG 8 -1.052 -3.022 3.737 80 1HB ARG 8 2HB ARG 8 -2.248 -0.798 3.075 81 2HB ARG 8 1HB ARG 8 -3.366 -1.870 2.239 82 1HG ARG 8 2HG ARG 8 -4.216 -1.513 4.479 83 2HG ARG 8 1HG ARG 8 -3.564 -3.156 4.419 84 1HD ARG 8 2HD ARG 8 -2.112 -2.634 6.076 85 2HD ARG 8 1HD ARG 8 -1.415 -1.365 5.042 86 HE ARG 8 HE ARG 8 -3.703 -0.159 5.894 87 1HH1 ARG 8 1HH2 ARG 8 -2.690 -2.486 7.988 88 2HH1 ARG 8 2HH2 ARG 8 -2.262 -1.425 9.289 89 1HH2 ARG 8 1HH1 ARG 8 -2.544 1.458 7.382 90 2HH2 ARG 8 2HH1 ARG 8 -2.179 0.807 8.946 91 H LYS 9 H LYS 9 -1.416 -3.319 0.304 92 HA LYS 9 HA LYS 9 -3.229 -5.635 0.407 93 1HB LYS 9 2HB LYS 9 -1.769 -4.014 -1.664 94 2HB LYS 9 1HB LYS 9 -2.477 -5.569 -2.117 95 1HG LYS 9 2HG LYS 9 -4.042 -3.420 -0.682 96 2HG LYS 9 1HG LYS 9 -3.973 -3.528 -2.439 97 1HD LYS 9 2HD LYS 9 -4.878 -5.805 -2.363 98 2HD LYS 9 1HD LYS 9 -4.901 -5.752 -0.600 99 1HE LYS 9 2HE LYS 9 -6.565 -3.992 -0.600 100 2HE LYS 9 1HE LYS 9 -6.435 -3.809 -2.361 101 1HZ LYS 9 1HZ LYS 9 -7.247 -6.292 -0.943 102 2HZ LYS 9 2HZ LYS 9 -7.121 -6.104 -2.627 103 3HZ LYS 9 3HZ LYS 9 -8.301 -5.244 -1.759 104 H TRP 10 H TRP 10 0.063 -5.186 -0.954 105 HA TRP 10 HA TRP 10 0.603 -8.067 -0.648 106 1HB TRP 10 2HB TRP 10 2.412 -5.880 -1.691 107 2HB TRP 10 1HB TRP 10 2.376 -7.574 -2.170 108 HD1 TRP 10 HD TRP 10 1.927 -4.765 -3.921 109 HE1 TRP 10 1HE TRP 10 -0.116 -4.744 -5.494 110 HE3 TRP 10 3HE TRP 10 -0.841 -8.491 -1.881 111 HZ2 TRP 10 2HZ TRP 10 -2.592 -6.108 -5.850 112 HZ3 TRP 10 3HZ TRP 10 -3.039 -9.130 -2.832 113 HH2 TRP 10 HH TRP 10 -3.920 -7.935 -4.820 114 H LYS 11 H LYS 11 3.459 -6.352 -0.432 115 HA LYS 11 HA LYS 11 3.532 -5.904 2.453 116 1HB LYS 11 2HB LYS 11 5.475 -7.580 2.625 117 2HB LYS 11 1HB LYS 11 3.866 -8.284 2.473 118 1HG LYS 11 2HG LYS 11 5.250 -7.702 -0.078 119 2HG LYS 11 1HG LYS 11 5.956 -8.996 0.895 120 1HD LYS 11 2HD LYS 11 4.157 -10.371 0.609 121 2HD LYS 11 1HD LYS 11 3.008 -9.033 0.684 122 1HE LYS 11 2HE LYS 11 2.802 -9.428 -1.571 123 2HE LYS 11 1HE LYS 11 4.306 -8.490 -1.677 124 1HZ LYS 11 1HZ LYS 11 4.126 -11.433 -1.293 125 2HZ LYS 11 2HZ LYS 11 5.564 -10.532 -1.375 126 3HZ LYS 11 3HZ LYS 11 4.557 -10.657 -2.738 127 H LYS 12 H LYS 12 3.812 -4.367 0.082 128 HA LYS 12 HA LYS 12 6.144 -3.913 -1.172 129 1HB LYS 12 2HB LYS 12 4.289 -1.968 0.202 130 2HB LYS 12 1HB LYS 12 5.552 -1.449 -0.912 131 1HG LYS 12 2HG LYS 12 3.416 -3.477 -1.614 132 2HG LYS 12 1HG LYS 12 3.319 -1.763 -2.017 133 1HD LYS 12 2HD LYS 12 5.564 -2.027 -3.182 134 2HD LYS 12 1HD LYS 12 5.371 -3.769 -2.979 135 1HE LYS 12 2HE LYS 12 3.618 -3.891 -4.499 136 2HE LYS 12 1HE LYS 12 3.107 -2.218 -4.198 137 1HZ LYS 12 1HZ LYS 12 4.233 -2.253 -6.283 138 2HZ LYS 12 2HZ LYS 12 5.544 -3.119 -5.636 139 3HZ LYS 12 3HZ LYS 12 5.271 -1.510 -5.165 Start of MODEL 11 1 1H ARG 1 1HT ARG 1 2.378 9.932 -4.591 2 2H ARG 1 2HT ARG 1 1.589 8.828 -5.614 3 3H ARG 1 3HT ARG 1 3.190 9.294 -5.938 4 HA ARG 1 HA ARG 1 2.943 7.032 -4.897 5 1HB ARG 1 2HB ARG 1 4.888 8.827 -4.886 6 2HB ARG 1 1HB ARG 1 4.504 8.922 -3.172 7 1HG ARG 1 2HG ARG 1 6.202 7.259 -3.352 8 2HG ARG 1 1HG ARG 1 4.688 6.387 -3.120 9 1HD ARG 1 2HD ARG 1 5.716 5.255 -4.932 10 2HD ARG 1 1HD ARG 1 4.559 6.355 -5.705 11 HE ARG 1 HE ARG 1 7.298 7.386 -5.244 12 1HH1 ARG 1 1HH2 ARG 1 6.029 5.248 -7.426 13 2HH1 ARG 1 2HH2 ARG 1 6.274 6.228 -8.833 14 1HH2 ARG 1 1HH1 ARG 1 7.121 9.068 -7.032 15 2HH2 ARG 1 2HH1 ARG 1 6.893 8.390 -8.609 16 H GLN 2 H GLN 2 0.618 7.108 -4.009 17 HA GLN 2 HA GLN 2 0.154 8.184 -1.350 18 1HB GLN 2 2HB GLN 2 -1.347 7.296 -3.474 19 2HB GLN 2 1HB GLN 2 -1.524 5.968 -2.324 20 1HG GLN 2 2HG GLN 2 -3.280 7.486 -1.813 21 2HG GLN 2 1HG GLN 2 -2.054 7.741 -0.570 22 1HE2 GLN 2 1HE2 GLN 2 -1.750 9.929 -0.182 23 2HE2 GLN 2 2HE2 GLN 2 -1.821 11.154 -1.365 24 H ILE 3 H ILE 3 1.017 5.010 -2.657 25 HA ILE 3 HA ILE 3 1.494 2.983 -1.611 26 HB ILE 3 HB ILE 3 3.311 4.873 -1.447 27 1HG1 ILE 3 2HG1 ILE 3 3.642 2.496 -1.766 28 2HG1 ILE 3 1HG1 ILE 3 4.833 3.120 -0.612 29 1HG2 ILE 3 1HG2 ILE 3 3.550 4.110 1.394 30 2HG2 ILE 3 2HG2 ILE 3 2.230 5.225 1.057 31 3HG2 ILE 3 3HG2 ILE 3 3.878 5.656 0.614 32 1HD1 ILE 3 1HD1 ILE 3 2.268 1.632 0.034 33 2HD1 ILE 3 2HD1 ILE 3 3.295 2.401 1.246 34 3HD1 ILE 3 3HD1 ILE 3 3.913 1.056 0.291 35 H LYS 4 H LYS 4 -1.007 3.964 -0.537 36 HA LYS 4 HA LYS 4 -0.746 3.113 2.311 37 1HB LYS 4 2HB LYS 4 -2.778 4.856 0.882 38 2HB LYS 4 1HB LYS 4 -2.808 4.447 2.590 39 1HG LYS 4 2HG LYS 4 -0.214 5.304 2.138 40 2HG LYS 4 1HG LYS 4 -1.223 6.450 1.251 41 1HD LYS 4 2HD LYS 4 -2.651 6.608 3.365 42 2HD LYS 4 1HD LYS 4 -1.350 5.746 4.185 43 1HE LYS 4 2HE LYS 4 -0.661 7.938 4.563 44 2HE LYS 4 1HE LYS 4 0.131 7.652 3.000 45 1HZ LYS 4 1HZ LYS 4 -1.236 9.680 2.984 46 2HZ LYS 4 2HZ LYS 4 -2.611 8.750 3.343 47 3HZ LYS 4 3HZ LYS 4 -1.794 8.529 1.870 48 H ILE 5 H ILE 5 -2.805 2.935 -0.589 49 HA ILE 5 HA ILE 5 -4.408 0.708 0.425 50 HB ILE 5 HB ILE 5 -3.974 1.632 -2.434 51 1HG1 ILE 5 2HG1 ILE 5 -4.486 3.654 -1.314 52 2HG1 ILE 5 1HG1 ILE 5 -6.035 3.083 -1.929 53 1HG2 ILE 5 1HG2 ILE 5 -6.048 0.644 -2.894 54 2HG2 ILE 5 2HG2 ILE 5 -6.548 0.681 -1.204 55 3HG2 ILE 5 3HG2 ILE 5 -5.339 -0.485 -1.740 56 1HD1 ILE 5 1HD1 ILE 5 -6.665 3.494 0.246 57 2HD1 ILE 5 2HD1 ILE 5 -5.040 3.218 0.877 58 3HD1 ILE 5 3HD1 ILE 5 -6.067 1.848 0.453 59 H TRP 6 H TRP 6 -1.328 1.156 -0.896 60 HA TRP 6 HA TRP 6 -0.987 -1.503 -2.105 61 1HB TRP 6 2HB TRP 6 0.766 0.894 -1.501 62 2HB TRP 6 1HB TRP 6 1.387 -0.553 -2.282 63 HD1 TRP 6 HD TRP 6 0.850 -0.922 -4.688 64 HE1 TRP 6 1HE TRP 6 -0.325 0.435 -6.537 65 HE3 TRP 6 3HE TRP 6 -1.215 2.675 -1.821 66 HZ2 TRP 6 2HZ TRP 6 -1.955 2.779 -6.737 67 HZ3 TRP 6 3HZ TRP 6 -2.593 4.480 -2.841 68 HH2 TRP 6 HH TRP 6 -2.958 4.536 -5.296 69 H PHE 7 H PHE 7 0.452 0.371 0.459 70 HA PHE 7 HA PHE 7 1.995 -1.588 1.781 71 1HB PHE 7 2HB PHE 7 1.989 0.822 2.305 72 2HB PHE 7 1HB PHE 7 0.329 0.707 2.877 73 HD1 PHE 7 1HD PHE 7 0.643 1.360 5.154 74 HD2 PHE 7 2HD PHE 7 2.983 -1.829 3.478 75 HE1 PHE 7 1HE PHE 7 1.450 0.759 7.421 76 HE2 PHE 7 2HE PHE 7 3.789 -2.430 5.745 77 HZ PHE 7 HZ PHE 7 3.023 -1.135 7.716 78 H ARG 8 H ARG 8 -1.442 -1.218 1.572 79 HA ARG 8 HA ARG 8 -2.003 -3.010 3.841 80 1HB ARG 8 2HB ARG 8 -3.039 -0.740 3.040 81 2HB ARG 8 1HB ARG 8 -3.970 -1.778 1.966 82 1HG ARG 8 2HG ARG 8 -5.231 -1.481 4.023 83 2HG ARG 8 1HG ARG 8 -4.605 -3.135 4.007 84 1HD ARG 8 2HD ARG 8 -3.451 -2.733 5.912 85 2HD ARG 8 1HD ARG 8 -2.602 -1.390 5.110 86 HE ARG 8 HE ARG 8 -4.779 -0.062 5.635 87 1HH1 ARG 8 1HH1 ARG 8 -5.644 -2.710 7.124 88 2HH1 ARG 8 2HH1 ARG 8 -5.463 -2.177 8.762 89 1HH2 ARG 8 1HH2 ARG 8 -3.646 0.653 7.921 90 2HH2 ARG 8 2HH2 ARG 8 -4.333 -0.273 9.214 91 H LYS 9 H LYS 9 -1.176 -3.455 0.645 92 HA LYS 9 HA LYS 9 -3.115 -5.700 0.238 93 1HB LYS 9 2HB LYS 9 -1.635 -3.759 -1.486 94 2HB LYS 9 1HB LYS 9 -1.961 -5.360 -2.161 95 1HG LYS 9 2HG LYS 9 -4.080 -3.601 -0.897 96 2HG LYS 9 1HG LYS 9 -3.765 -3.663 -2.631 97 1HD LYS 9 2HD LYS 9 -4.069 -6.220 -2.401 98 2HD LYS 9 1HD LYS 9 -4.802 -5.855 -0.838 99 1HE LYS 9 2HE LYS 9 -6.372 -4.266 -2.033 100 2HE LYS 9 1HE LYS 9 -5.734 -4.899 -3.564 101 1HZ LYS 9 1HZ LYS 9 -7.713 -6.124 -2.735 102 2HZ LYS 9 2HZ LYS 9 -6.808 -6.601 -1.379 103 3HZ LYS 9 3HZ LYS 9 -6.343 -7.105 -2.934 104 H TRP 10 H TRP 10 0.153 -5.132 -1.086 105 HA TRP 10 HA TRP 10 0.859 -7.935 -0.499 106 1HB TRP 10 2HB TRP 10 2.475 -5.805 -1.904 107 2HB TRP 10 1HB TRP 10 2.507 -7.543 -2.179 108 HD1 TRP 10 HD TRP 10 1.821 -5.019 -4.228 109 HE1 TRP 10 1HE TRP 10 -0.308 -5.276 -5.661 110 HE3 TRP 10 3HE TRP 10 -0.655 -8.548 -1.562 111 HZ2 TRP 10 2HZ TRP 10 -2.737 -6.766 -5.684 112 HZ3 TRP 10 3HZ TRP 10 -2.874 -9.387 -2.286 113 HH2 TRP 10 HH TRP 10 -3.919 -8.494 -4.351 114 H LYS 11 H LYS 11 3.644 -6.191 -0.694 115 HA LYS 11 HA LYS 11 3.950 -5.210 2.015 116 1HB LYS 11 2HB LYS 11 5.755 -6.978 2.487 117 2HB LYS 11 1HB LYS 11 4.085 -7.539 2.562 118 1HG LYS 11 2HG LYS 11 5.349 -7.680 -0.108 119 2HG LYS 11 1HG LYS 11 6.013 -8.781 1.103 120 1HD LYS 11 2HD LYS 11 4.156 -10.071 1.096 121 2HD LYS 11 1HD LYS 11 3.096 -8.662 1.181 122 1HE LYS 11 2HE LYS 11 2.529 -9.219 -0.965 123 2HE LYS 11 1HE LYS 11 4.095 -8.509 -1.404 124 1HZ LYS 11 1HZ LYS 11 5.136 -10.659 -0.993 125 2HZ LYS 11 2HZ LYS 11 3.944 -10.788 -2.196 126 3HZ LYS 11 3HZ LYS 11 3.627 -11.339 -0.620 127 H LYS 12 H LYS 12 4.224 -4.071 -0.473 128 HA LYS 12 HA LYS 12 6.353 -4.113 -2.059 129 1HB LYS 12 2HB LYS 12 6.091 -1.730 -2.312 130 2HB LYS 12 1HB LYS 12 4.521 -2.414 -1.925 131 1HG LYS 12 2HG LYS 12 6.331 -0.741 -0.190 132 2HG LYS 12 1HG LYS 12 4.629 -0.517 -0.559 133 1HD LYS 12 2HD LYS 12 4.040 -2.461 0.813 134 2HD LYS 12 1HD LYS 12 5.744 -2.749 1.160 135 1HE LYS 12 2HE LYS 12 5.633 -0.187 1.945 136 2HE LYS 12 1HE LYS 12 3.936 -0.626 2.227 137 1HZ LYS 12 1HZ LYS 12 6.348 -2.021 3.254 138 2HZ LYS 12 2HZ LYS 12 4.782 -2.673 3.340 139 3HZ LYS 12 3HZ LYS 12 5.153 -1.235 4.166 Start of MODEL 12 1 1H ARG 1 1HT ARG 1 3.194 8.490 -5.762 2 2H ARG 1 2HT ARG 1 1.764 7.661 -5.372 3 3H ARG 1 3HT ARG 1 3.097 7.601 -4.321 4 HA ARG 1 HA ARG 1 2.870 10.073 -4.038 5 1HB ARG 1 2HB ARG 1 0.840 9.371 -6.041 6 2HB ARG 1 1HB ARG 1 0.208 10.387 -4.751 7 1HG ARG 1 2HG ARG 1 2.824 11.105 -6.030 8 2HG ARG 1 1HG ARG 1 1.308 11.497 -6.839 9 1HD ARG 1 2HD ARG 1 1.733 13.423 -5.541 10 2HD ARG 1 1HD ARG 1 0.599 12.495 -4.544 11 HE ARG 1 HE ARG 1 3.474 11.942 -4.126 12 1HH1 ARG 1 1HH2 ARG 1 1.047 11.409 -2.274 13 2HH1 ARG 1 2HH2 ARG 1 1.351 12.569 -1.026 14 1HH2 ARG 1 1HH1 ARG 1 3.674 14.351 -2.884 15 2HH2 ARG 1 2HH1 ARG 1 2.840 14.235 -1.371 16 H GLN 2 H GLN 2 0.397 7.498 -3.931 17 HA GLN 2 HA GLN 2 -0.293 8.302 -1.143 18 1HB GLN 2 2HB GLN 2 -1.864 7.802 -3.260 19 2HB GLN 2 1HB GLN 2 -1.719 6.156 -2.635 20 1HG GLN 2 2HG GLN 2 -3.656 7.221 -1.614 21 2HG GLN 2 1HG GLN 2 -2.410 7.000 -0.383 22 1HE2 GLN 2 1HE2 GLN 2 -2.296 8.818 0.924 23 2HE2 GLN 2 2HE2 GLN 2 -2.453 10.427 0.382 24 H ILE 3 H ILE 3 0.395 5.343 -3.020 25 HA ILE 3 HA ILE 3 1.065 3.226 -2.289 26 HB ILE 3 HB ILE 3 2.898 5.096 -2.471 27 1HG1 ILE 3 2HG1 ILE 3 3.097 2.751 -3.027 28 2HG1 ILE 3 1HG1 ILE 3 4.556 3.294 -2.179 29 1HG2 ILE 3 1HG2 ILE 3 3.833 4.141 0.162 30 2HG2 ILE 3 2HG2 ILE 3 2.503 5.294 0.232 31 3HG2 ILE 3 3HG2 ILE 3 4.002 5.728 -0.583 32 1HD1 ILE 3 1HD1 ILE 3 3.554 2.427 -0.046 33 2HD1 ILE 3 2HD1 ILE 3 3.851 1.158 -1.232 34 3HD1 ILE 3 3HD1 ILE 3 2.217 1.769 -0.989 35 H LYS 4 H LYS 4 -1.045 4.132 -0.520 36 HA LYS 4 HA LYS 4 -0.060 3.065 2.089 37 1HB LYS 4 2HB LYS 4 -2.320 4.954 1.361 38 2HB LYS 4 1HB LYS 4 -1.984 4.371 2.982 39 1HG LYS 4 2HG LYS 4 0.475 5.228 2.031 40 2HG LYS 4 1HG LYS 4 -0.664 6.479 1.526 41 1HD LYS 4 2HD LYS 4 -1.442 6.783 3.791 42 2HD LYS 4 1HD LYS 4 -0.527 5.380 4.342 43 1HE LYS 4 2HE LYS 4 1.536 6.494 4.175 44 2HE LYS 4 1HE LYS 4 0.899 7.694 3.032 45 1HZ LYS 4 1HZ LYS 4 0.985 8.741 5.145 46 2HZ LYS 4 2HZ LYS 4 0.242 7.420 5.913 47 3HZ LYS 4 3HZ LYS 4 -0.649 8.397 4.844 48 H ILE 5 H ILE 5 -2.795 3.100 -0.189 49 HA ILE 5 HA ILE 5 -4.150 0.833 1.062 50 HB ILE 5 HB ILE 5 -4.400 1.909 -1.767 51 1HG1 ILE 5 2HG1 ILE 5 -4.579 3.878 -0.471 52 2HG1 ILE 5 1HG1 ILE 5 -6.244 3.352 -0.691 53 1HG2 ILE 5 1HG2 ILE 5 -6.246 0.464 0.142 54 2HG2 ILE 5 2HG2 ILE 5 -5.705 -0.067 -1.451 55 3HG2 ILE 5 3HG2 ILE 5 -6.831 1.282 -1.306 56 1HD1 ILE 5 1HD1 ILE 5 -5.784 2.029 1.557 57 2HD1 ILE 5 2HD1 ILE 5 -6.226 3.735 1.599 58 3HD1 ILE 5 3HD1 ILE 5 -4.537 3.259 1.767 59 H TRP 6 H TRP 6 -1.488 1.341 -0.971 60 HA TRP 6 HA TRP 6 -1.486 -1.259 -2.341 61 1HB TRP 6 2HB TRP 6 0.388 1.106 -2.069 62 2HB TRP 6 1HB TRP 6 0.791 -0.301 -3.038 63 HD1 TRP 6 HD TRP 6 -0.317 -0.565 -5.262 64 HE1 TRP 6 1HE TRP 6 -1.877 0.881 -6.714 65 HE3 TRP 6 3HE TRP 6 -1.582 2.909 -1.831 66 HZ2 TRP 6 2HZ TRP 6 -3.466 3.243 -6.419 67 HZ3 TRP 6 3HZ TRP 6 -3.128 4.770 -2.414 68 HH2 TRP 6 HH TRP 6 -4.069 4.939 -4.707 69 H PHE 7 H PHE 7 0.569 0.493 -0.137 70 HA PHE 7 HA PHE 7 2.351 -1.536 0.692 71 1HB PHE 7 2HB PHE 7 2.583 0.824 1.285 72 2HB PHE 7 1HB PHE 7 1.069 0.782 2.181 73 HD1 PHE 7 1HD PHE 7 1.674 1.197 4.416 74 HD2 PHE 7 2HD PHE 7 3.849 -1.722 2.136 75 HE1 PHE 7 1HE PHE 7 2.890 0.505 6.463 76 HE2 PHE 7 2HE PHE 7 5.066 -2.414 4.183 77 HZ PHE 7 HZ PHE 7 4.586 -1.300 6.347 78 H ARG 8 H ARG 8 -1.024 -1.133 1.340 79 HA ARG 8 HA ARG 8 -1.049 -2.944 3.657 80 1HB ARG 8 2HB ARG 8 -2.250 -0.679 3.111 81 2HB ARG 8 1HB ARG 8 -3.398 -1.722 2.281 82 1HG ARG 8 2HG ARG 8 -4.155 -1.425 4.571 83 2HG ARG 8 1HG ARG 8 -3.538 -3.075 4.418 84 1HD ARG 8 2HD ARG 8 -2.003 -2.653 6.024 85 2HD ARG 8 1HD ARG 8 -1.336 -1.340 5.026 86 HE ARG 8 HE ARG 8 -3.358 0.013 5.991 87 1HH1 ARG 8 1HH1 ARG 8 -4.240 -2.171 7.838 88 2HH1 ARG 8 2HH1 ARG 8 -3.453 -1.735 9.319 89 1HH2 ARG 8 1HH2 ARG 8 -1.222 0.443 7.800 90 2HH2 ARG 8 2HH2 ARG 8 -1.744 -0.256 9.297 91 H LYS 9 H LYS 9 -1.128 -3.280 0.294 92 HA LYS 9 HA LYS 9 -3.105 -5.503 0.310 93 1HB LYS 9 2HB LYS 9 -1.817 -3.678 -1.662 94 2HB LYS 9 1HB LYS 9 -2.291 -5.276 -2.248 95 1HG LYS 9 2HG LYS 9 -4.162 -3.480 -0.695 96 2HG LYS 9 1HG LYS 9 -4.062 -3.454 -2.455 97 1HD LYS 9 2HD LYS 9 -4.659 -5.817 -2.566 98 2HD LYS 9 1HD LYS 9 -4.657 -5.928 -0.807 99 1HE LYS 9 2HE LYS 9 -6.381 -3.848 -1.143 100 2HE LYS 9 1HE LYS 9 -6.713 -4.788 -2.613 101 1HZ LYS 9 1HZ LYS 9 -6.904 -6.780 -1.253 102 2HZ LYS 9 2HZ LYS 9 -8.026 -5.608 -0.747 103 3HZ LYS 9 3HZ LYS 9 -6.610 -5.877 0.153 104 H TRP 10 H TRP 10 0.230 -4.970 -0.958 105 HA TRP 10 HA TRP 10 0.689 -7.874 -1.003 106 1HB TRP 10 2HB TRP 10 2.596 -5.613 -1.638 107 2HB TRP 10 1HB TRP 10 2.583 -7.238 -2.316 108 HD1 TRP 10 HD TRP 10 2.254 -4.260 -3.785 109 HE1 TRP 10 1HE TRP 10 0.310 -4.041 -5.458 110 HE3 TRP 10 3HE TRP 10 -0.668 -8.131 -2.307 111 HZ2 TRP 10 2HZ TRP 10 -2.154 -5.319 -6.097 112 HZ3 TRP 10 3HZ TRP 10 -2.812 -8.629 -3.445 113 HH2 TRP 10 HH TRP 10 -3.561 -7.220 -5.344 114 H LYS 11 H LYS 11 3.582 -6.344 -0.386 115 HA LYS 11 HA LYS 11 3.532 -6.146 2.498 116 1HB LYS 11 2HB LYS 11 5.014 -8.181 2.811 117 2HB LYS 11 1HB LYS 11 3.347 -8.549 2.368 118 1HG LYS 11 2HG LYS 11 5.199 -8.149 0.098 119 2HG LYS 11 1HG LYS 11 5.499 -9.589 1.075 120 1HD LYS 11 2HD LYS 11 3.623 -10.612 0.335 121 2HD LYS 11 1HD LYS 11 2.659 -9.148 0.543 122 1HE LYS 11 2HE LYS 11 2.600 -9.305 -1.776 123 2HE LYS 11 1HE LYS 11 4.111 -8.390 -1.603 124 1HZ LYS 11 1HZ LYS 11 4.489 -10.346 -2.956 125 2HZ LYS 11 2HZ LYS 11 3.859 -11.349 -1.739 126 3HZ LYS 11 3HZ LYS 11 5.310 -10.505 -1.480 127 H LYS 12 H LYS 12 4.432 -4.746 0.084 128 HA LYS 12 HA LYS 12 6.501 -4.185 -1.046 129 1HB LYS 12 2HB LYS 12 6.144 -2.881 1.661 130 2HB LYS 12 1HB LYS 12 7.154 -2.233 0.377 131 1HG LYS 12 2HG LYS 12 4.232 -2.869 -0.026 132 2HG LYS 12 1HG LYS 12 4.805 -1.279 0.475 133 1HD LYS 12 2HD LYS 12 6.198 -2.451 -1.863 134 2HD LYS 12 1HD LYS 12 4.510 -2.011 -2.126 135 1HE LYS 12 2HE LYS 12 5.350 0.088 -2.500 136 2HE LYS 12 1HE LYS 12 5.470 0.176 -0.731 137 1HZ LYS 12 1HZ LYS 12 7.567 -1.050 -2.431 138 2HZ LYS 12 2HZ LYS 12 7.670 -0.640 -0.786 139 3HZ LYS 12 3HZ LYS 12 7.605 0.580 -1.966 Start of MODEL 13 1 1H ARG 1 1HT ARG 1 3.521 10.919 -5.036 2 2H ARG 1 2HT ARG 1 4.070 10.218 -3.589 3 3H ARG 1 3HT ARG 1 2.622 11.106 -3.611 4 HA ARG 1 HA ARG 1 1.863 9.350 -5.351 5 1HB ARG 1 2HB ARG 1 4.140 8.030 -3.834 6 2HB ARG 1 1HB ARG 1 3.044 7.199 -4.934 7 1HG ARG 1 2HG ARG 1 4.694 9.574 -5.812 8 2HG ARG 1 1HG ARG 1 5.286 7.919 -5.908 9 1HD ARG 1 2HD ARG 1 4.336 8.127 -8.014 10 2HD ARG 1 1HD ARG 1 2.955 7.507 -7.095 11 HE ARG 1 HE ARG 1 2.847 10.269 -6.738 12 1HH1 ARG 1 1HH2 ARG 1 1.630 7.951 -8.779 13 2HH1 ARG 1 2HH2 ARG 1 1.264 9.021 -10.092 14 1HH2 ARG 1 1HH1 ARG 1 2.925 11.727 -8.696 15 2HH2 ARG 1 2HH1 ARG 1 1.997 11.159 -10.044 16 H GLN 2 H GLN 2 1.284 6.995 -3.997 17 HA GLN 2 HA GLN 2 0.159 7.944 -1.385 18 1HB GLN 2 2HB GLN 2 -1.209 7.419 -3.709 19 2HB GLN 2 1HB GLN 2 -1.306 5.866 -2.873 20 1HG GLN 2 2HG GLN 2 -3.206 7.218 -2.199 21 2HG GLN 2 1HG GLN 2 -2.101 7.085 -0.828 22 1HE2 GLN 2 1HE2 GLN 2 -1.366 9.022 0.077 23 2HE2 GLN 2 2HE2 GLN 2 -1.560 10.556 -0.642 24 H ILE 3 H ILE 3 0.591 4.901 -3.212 25 HA ILE 3 HA ILE 3 1.079 2.755 -2.419 26 HB ILE 3 HB ILE 3 3.071 4.405 -2.815 27 1HG1 ILE 3 2HG1 ILE 3 3.020 2.018 -3.208 28 2HG1 ILE 3 1HG1 ILE 3 4.571 2.480 -2.486 29 1HG2 ILE 3 1HG2 ILE 3 2.851 4.781 -0.094 30 2HG2 ILE 3 2HG2 ILE 3 4.303 5.091 -1.039 31 3HG2 ILE 3 3HG2 ILE 3 4.110 3.554 -0.199 32 1HD1 ILE 3 1HD1 ILE 3 3.754 0.494 -1.338 33 2HD1 ILE 3 2HD1 ILE 3 2.188 1.255 -1.060 34 3HD1 ILE 3 3HD1 ILE 3 3.624 1.866 -0.239 35 H LYS 4 H LYS 4 -0.862 3.800 -0.607 36 HA LYS 4 HA LYS 4 0.218 2.871 2.017 37 1HB LYS 4 2HB LYS 4 -1.999 4.806 1.285 38 2HB LYS 4 1HB LYS 4 -1.603 4.308 2.922 39 1HG LYS 4 2HG LYS 4 0.839 4.990 1.820 40 2HG LYS 4 1HG LYS 4 -0.262 6.252 1.258 41 1HD LYS 4 2HD LYS 4 0.226 7.175 3.302 42 2HD LYS 4 1HD LYS 4 -1.048 6.081 3.840 43 1HE LYS 4 2HE LYS 4 0.542 5.285 5.281 44 2HE LYS 4 1HE LYS 4 1.179 4.437 3.859 45 1HZ LYS 4 1HZ LYS 4 2.412 6.512 3.321 46 2HZ LYS 4 2HZ LYS 4 2.933 5.761 4.753 47 3HZ LYS 4 3HZ LYS 4 1.943 7.139 4.825 48 H ILE 5 H ILE 5 -2.649 2.886 -0.095 49 HA ILE 5 HA ILE 5 -4.021 0.751 1.349 50 HB ILE 5 HB ILE 5 -4.271 1.746 -1.516 51 1HG1 ILE 5 2HG1 ILE 5 -6.043 2.627 0.737 52 2HG1 ILE 5 1HG1 ILE 5 -4.484 3.412 0.490 53 1HG2 ILE 5 1HG2 ILE 5 -6.447 0.558 0.202 54 2HG2 ILE 5 2HG2 ILE 5 -5.386 -0.467 -0.766 55 3HG2 ILE 5 3HG2 ILE 5 -6.408 0.736 -1.552 56 1HD1 ILE 5 1HD1 ILE 5 -6.900 3.423 -1.257 57 2HD1 ILE 5 2HD1 ILE 5 -5.319 3.464 -2.039 58 3HD1 ILE 5 3HD1 ILE 5 -5.771 4.729 -0.895 59 H TRP 6 H TRP 6 -1.764 1.109 -1.280 60 HA TRP 6 HA TRP 6 -1.730 -1.558 -2.325 61 1HB TRP 6 2HB TRP 6 0.262 0.720 -2.165 62 2HB TRP 6 1HB TRP 6 0.563 -0.731 -3.108 63 HD1 TRP 6 HD TRP 6 -0.697 -1.041 -5.256 64 HE1 TRP 6 1HE TRP 6 -2.178 0.466 -6.729 65 HE3 TRP 6 3HE TRP 6 -1.475 2.725 -1.992 66 HZ2 TRP 6 2HZ TRP 6 -3.521 2.982 -6.514 67 HZ3 TRP 6 3HZ TRP 6 -2.863 4.690 -2.625 68 HH2 TRP 6 HH TRP 6 -3.884 4.822 -4.885 69 H PHE 7 H PHE 7 0.480 0.166 -0.247 70 HA PHE 7 HA PHE 7 2.175 -1.914 0.616 71 1HB PHE 7 2HB PHE 7 2.590 0.410 1.124 72 2HB PHE 7 1HB PHE 7 1.054 0.555 1.975 73 HD1 PHE 7 1HD PHE 7 4.512 -0.639 2.170 74 HD2 PHE 7 2HD PHE 7 0.727 -0.466 4.193 75 HE1 PHE 7 1HE PHE 7 5.617 -1.305 4.289 76 HE2 PHE 7 2HE PHE 7 1.832 -1.132 6.314 77 HZ PHE 7 HZ PHE 7 4.276 -1.551 6.361 78 H ARG 8 H ARG 8 -1.157 -1.332 1.335 79 HA ARG 8 HA ARG 8 -1.228 -2.949 3.773 80 1HB ARG 8 2HB ARG 8 -2.450 -0.787 2.987 81 2HB ARG 8 1HB ARG 8 -3.540 -1.912 2.185 82 1HG ARG 8 2HG ARG 8 -4.428 -1.456 4.395 83 2HG ARG 8 1HG ARG 8 -3.771 -3.096 4.414 84 1HD ARG 8 2HD ARG 8 -2.337 -2.507 6.063 85 2HD ARG 8 1HD ARG 8 -1.643 -1.262 4.999 86 HE ARG 8 HE ARG 8 -4.133 -0.273 5.931 87 1HH1 ARG 8 1HH2 ARG 8 -0.871 0.043 6.433 88 2HH1 ARG 8 2HH2 ARG 8 -0.978 0.595 8.071 89 1HH2 ARG 8 1HH1 ARG 8 -4.363 -0.095 8.366 90 2HH2 ARG 8 2HH1 ARG 8 -2.953 0.517 9.164 91 H LYS 9 H LYS 9 -1.354 -3.563 0.406 92 HA LYS 9 HA LYS 9 -3.138 -5.928 0.707 93 1HB LYS 9 2HB LYS 9 -2.237 -4.089 -1.418 94 2HB LYS 9 1HB LYS 9 -2.355 -5.778 -1.923 95 1HG LYS 9 2HG LYS 9 -4.565 -4.327 -0.452 96 2HG LYS 9 1HG LYS 9 -4.483 -4.430 -2.210 97 1HD LYS 9 2HD LYS 9 -4.603 -6.847 -2.137 98 2HD LYS 9 1HD LYS 9 -4.476 -6.843 -0.378 99 1HE LYS 9 2HE LYS 9 -6.766 -6.918 -0.452 100 2HE LYS 9 1HE LYS 9 -6.635 -5.179 -0.781 101 1HZ LYS 9 1HZ LYS 9 -7.918 -6.345 -2.503 102 2HZ LYS 9 2HZ LYS 9 -6.565 -7.313 -2.850 103 3HZ LYS 9 3HZ LYS 9 -6.511 -5.638 -3.131 104 H TRP 10 H TRP 10 -0.009 -5.273 -0.950 105 HA TRP 10 HA TRP 10 0.750 -8.101 -0.692 106 1HB TRP 10 2HB TRP 10 2.371 -5.770 -1.741 107 2HB TRP 10 1HB TRP 10 2.460 -7.455 -2.238 108 HD1 TRP 10 HD TRP 10 1.761 -4.690 -3.956 109 HE1 TRP 10 1HE TRP 10 -0.309 -4.812 -5.487 110 HE3 TRP 10 3HE TRP 10 -0.683 -8.621 -1.884 111 HZ2 TRP 10 2HZ TRP 10 -2.683 -6.354 -5.803 112 HZ3 TRP 10 3HZ TRP 10 -2.846 -9.415 -2.796 113 HH2 TRP 10 HH TRP 10 -3.852 -8.280 -4.760 114 H LYS 11 H LYS 11 3.477 -6.152 -0.504 115 HA LYS 11 HA LYS 11 3.617 -5.810 2.387 116 1HB LYS 11 2HB LYS 11 5.682 -7.356 2.432 117 2HB LYS 11 1HB LYS 11 4.111 -8.150 2.341 118 1HG LYS 11 2HG LYS 11 5.304 -7.443 -0.267 119 2HG LYS 11 1HG LYS 11 6.172 -8.685 0.641 120 1HD LYS 11 2HD LYS 11 4.472 -10.198 0.451 121 2HD LYS 11 1HD LYS 11 3.227 -8.956 0.604 122 1HE LYS 11 2HE LYS 11 2.923 -9.344 -1.640 123 2HE LYS 11 1HE LYS 11 4.348 -8.304 -1.822 124 1HZ LYS 11 1HZ LYS 11 5.738 -10.303 -1.529 125 2HZ LYS 11 2HZ LYS 11 4.768 -10.384 -2.921 126 3HZ LYS 11 3HZ LYS 11 4.339 -11.261 -1.530 127 H LYS 12 H LYS 12 3.743 -4.204 0.028 128 HA LYS 12 HA LYS 12 5.948 -3.518 -1.289 129 1HB LYS 12 2HB LYS 12 4.317 -1.608 0.409 130 2HB LYS 12 1HB LYS 12 5.261 -1.160 -1.006 131 1HG LYS 12 2HG LYS 12 2.831 -2.970 -0.935 132 2HG LYS 12 1HG LYS 12 2.959 -1.390 -1.700 133 1HD LYS 12 2HD LYS 12 4.587 -3.820 -2.506 134 2HD LYS 12 1HD LYS 12 3.133 -3.268 -3.332 135 1HE LYS 12 2HE LYS 12 4.305 -1.698 -4.471 136 2HE LYS 12 1HE LYS 12 5.014 -1.070 -2.971 137 1HZ LYS 12 1HZ LYS 12 5.884 -3.608 -4.235 138 2HZ LYS 12 2HZ LYS 12 6.647 -2.761 -2.975 139 3HZ LYS 12 3HZ LYS 12 6.637 -2.122 -4.550 Start of MODEL 14 1 1H ARG 1 1HT ARG 1 1.067 7.847 -5.606 2 2H ARG 1 2HT ARG 1 2.150 8.764 -6.541 3 3H ARG 1 3HT ARG 1 1.004 9.542 -5.557 4 HA ARG 1 HA ARG 1 3.352 7.955 -4.654 5 1HB ARG 1 2HB ARG 1 2.691 10.758 -5.195 6 2HB ARG 1 1HB ARG 1 3.304 10.515 -3.571 7 1HG ARG 1 2HG ARG 1 5.352 10.520 -4.423 8 2HG ARG 1 1HG ARG 1 4.964 8.967 -5.119 9 1HD ARG 1 2HD ARG 1 3.790 10.911 -6.807 10 2HD ARG 1 1HD ARG 1 5.448 11.398 -6.450 11 HE ARG 1 HE ARG 1 4.746 8.695 -7.501 12 1HH1 ARG 1 1HH2 ARG 1 7.321 10.388 -6.246 13 2HH1 ARG 1 2HH2 ARG 1 8.371 10.174 -7.606 14 1HH2 ARG 1 1HH1 ARG 1 5.901 8.837 -9.640 15 2HH2 ARG 1 2HH1 ARG 1 7.568 9.295 -9.527 16 H GLN 2 H GLN 2 0.953 6.889 -3.857 17 HA GLN 2 HA GLN 2 0.405 8.070 -1.160 18 1HB GLN 2 2HB GLN 2 -1.276 7.442 -3.229 19 2HB GLN 2 1HB GLN 2 -1.351 5.969 -2.259 20 1HG GLN 2 2HG GLN 2 -3.074 7.481 -1.471 21 2HG GLN 2 1HG GLN 2 -1.808 7.395 -0.243 22 1HE2 GLN 2 1HE2 GLN 2 -1.047 9.384 0.474 23 2HE2 GLN 2 2HE2 GLN 2 -1.183 10.850 -0.386 24 H ILE 3 H ILE 3 0.863 4.965 -2.846 25 HA ILE 3 HA ILE 3 1.413 2.855 -2.040 26 HB ILE 3 HB ILE 3 3.338 4.638 -2.090 27 1HG1 ILE 3 2HG1 ILE 3 3.452 2.273 -2.610 28 2HG1 ILE 3 1HG1 ILE 3 4.876 2.761 -1.674 29 1HG2 ILE 3 1HG2 ILE 3 4.247 5.299 -0.122 30 2HG2 ILE 3 2HG2 ILE 3 4.117 3.683 0.568 31 3HG2 ILE 3 3HG2 ILE 3 2.740 4.777 0.623 32 1HD1 ILE 3 1HD1 ILE 3 4.030 0.690 -0.724 33 2HD1 ILE 3 2HD1 ILE 3 2.397 1.348 -0.641 34 3HD1 ILE 3 3HD1 ILE 3 3.664 1.995 0.401 35 H LYS 4 H LYS 4 -0.784 3.912 -0.446 36 HA LYS 4 HA LYS 4 -0.063 2.863 2.251 37 1HB LYS 4 2HB LYS 4 -2.313 4.682 1.343 38 2HB LYS 4 1HB LYS 4 -1.908 4.266 3.001 39 1HG LYS 4 2HG LYS 4 0.502 5.077 1.978 40 2HG LYS 4 1HG LYS 4 -0.643 6.206 1.249 41 1HD LYS 4 2HD LYS 4 -1.056 5.656 4.130 42 2HD LYS 4 1HD LYS 4 0.415 6.539 3.727 43 1HE LYS 4 2HE LYS 4 -0.739 8.421 3.149 44 2HE LYS 4 1HE LYS 4 -1.989 7.493 2.296 45 1HZ LYS 4 1HZ LYS 4 -1.709 7.862 5.229 46 2HZ LYS 4 2HZ LYS 4 -2.757 6.726 4.525 47 3HZ LYS 4 3HZ LYS 4 -2.988 8.386 4.247 48 H ILE 5 H ILE 5 -2.680 2.928 -0.171 49 HA ILE 5 HA ILE 5 -4.125 0.685 1.007 50 HB ILE 5 HB ILE 5 -4.205 1.764 -1.832 51 1HG1 ILE 5 2HG1 ILE 5 -4.453 3.723 -0.534 52 2HG1 ILE 5 1HG1 ILE 5 -6.104 3.203 -0.849 53 1HG2 ILE 5 1HG2 ILE 5 -6.320 0.501 -0.065 54 2HG2 ILE 5 2HG2 ILE 5 -5.482 -0.305 -1.390 55 3HG2 ILE 5 3HG2 ILE 5 -6.558 1.052 -1.723 56 1HD1 ILE 5 1HD1 ILE 5 -5.848 1.884 1.395 57 2HD1 ILE 5 2HD1 ILE 5 -6.148 3.620 1.457 58 3HD1 ILE 5 3HD1 ILE 5 -4.515 2.998 1.695 59 H TRP 6 H TRP 6 -1.352 1.120 -0.894 60 HA TRP 6 HA TRP 6 -1.351 -1.491 -2.235 61 1HB TRP 6 2HB TRP 6 0.595 0.809 -1.901 62 2HB TRP 6 1HB TRP 6 0.957 -0.610 -2.873 63 HD1 TRP 6 HD TRP 6 -0.109 -0.816 -5.117 64 HE1 TRP 6 1HE TRP 6 -1.568 0.701 -6.603 65 HE3 TRP 6 3HE TRP 6 -1.300 2.708 -1.709 66 HZ2 TRP 6 2HZ TRP 6 -3.057 3.129 -6.340 67 HZ3 TRP 6 3HZ TRP 6 -2.750 4.633 -2.325 68 HH2 TRP 6 HH TRP 6 -3.626 4.847 -4.638 69 H PHE 7 H PHE 7 0.664 0.228 0.030 70 HA PHE 7 HA PHE 7 2.360 -1.814 0.964 71 1HB PHE 7 2HB PHE 7 2.563 0.555 1.558 72 2HB PHE 7 1HB PHE 7 1.019 0.504 2.401 73 HD1 PHE 7 1HD PHE 7 0.774 -0.684 4.541 74 HD2 PHE 7 2HD PHE 7 4.565 -0.409 2.541 75 HE1 PHE 7 1HE PHE 7 1.923 -1.397 6.620 76 HE2 PHE 7 2HE PHE 7 5.715 -1.123 4.622 77 HZ PHE 7 HZ PHE 7 4.393 -1.616 6.662 78 H ARG 8 H ARG 8 -1.036 -1.348 1.467 79 HA ARG 8 HA ARG 8 -1.206 -3.149 3.779 80 1HB ARG 8 2HB ARG 8 -2.366 -0.894 3.149 81 2HB ARG 8 1HB ARG 8 -3.455 -1.932 2.235 82 1HG ARG 8 2HG ARG 8 -4.384 -1.648 4.455 83 2HG ARG 8 1HG ARG 8 -3.744 -3.292 4.357 84 1HD ARG 8 2HD ARG 8 -2.349 -2.849 6.082 85 2HD ARG 8 1HD ARG 8 -1.603 -1.550 5.122 86 HE ARG 8 HE ARG 8 -4.160 -0.700 6.166 87 1HH1 ARG 8 1HH2 ARG 8 -1.161 0.414 6.112 88 2HH1 ARG 8 2HH2 ARG 8 -1.005 0.805 7.792 89 1HH2 ARG 8 1HH1 ARG 8 -3.847 -0.944 8.736 90 2HH2 ARG 8 2HH1 ARG 8 -2.525 0.036 9.278 91 H LYS 9 H LYS 9 -1.540 -3.261 0.311 92 HA LYS 9 HA LYS 9 -3.228 -5.692 0.358 93 1HB LYS 9 2HB LYS 9 -2.258 -3.663 -1.588 94 2HB LYS 9 1HB LYS 9 -2.569 -5.277 -2.235 95 1HG LYS 9 2HG LYS 9 -4.556 -3.789 -0.509 96 2HG LYS 9 1HG LYS 9 -4.554 -3.682 -2.269 97 1HD LYS 9 2HD LYS 9 -4.883 -6.087 -2.464 98 2HD LYS 9 1HD LYS 9 -4.752 -6.278 -0.716 99 1HE LYS 9 2HE LYS 9 -7.093 -6.246 -1.078 100 2HE LYS 9 1HE LYS 9 -6.740 -4.563 -0.635 101 1HZ LYS 9 1HZ LYS 9 -6.533 -3.994 -2.947 102 2HZ LYS 9 2HZ LYS 9 -8.040 -4.740 -2.707 103 3HZ LYS 9 3HZ LYS 9 -6.763 -5.607 -3.417 104 H TRP 10 H TRP 10 -0.017 -4.790 -1.007 105 HA TRP 10 HA TRP 10 0.695 -7.637 -1.261 106 1HB TRP 10 2HB TRP 10 2.379 -5.190 -1.825 107 2HB TRP 10 1HB TRP 10 2.445 -6.757 -2.625 108 HD1 TRP 10 HD TRP 10 1.858 -3.698 -3.808 109 HE1 TRP 10 1HE TRP 10 -0.165 -3.477 -5.391 110 HE3 TRP 10 3HE TRP 10 -0.725 -7.885 -2.581 111 HZ2 TRP 10 2HZ TRP 10 -2.559 -4.874 -6.055 112 HZ3 TRP 10 3HZ TRP 10 -2.875 -8.439 -3.684 113 HH2 TRP 10 HH TRP 10 -3.797 -6.930 -5.424 114 H LYS 11 H LYS 11 3.452 -5.860 -0.680 115 HA LYS 11 HA LYS 11 3.510 -5.945 2.232 116 1HB LYS 11 2HB LYS 11 5.402 -7.617 2.219 117 2HB LYS 11 1HB LYS 11 3.861 -8.308 1.715 118 1HG LYS 11 2HG LYS 11 5.570 -7.129 -0.416 119 2HG LYS 11 1HG LYS 11 6.109 -8.656 0.290 120 1HD LYS 11 2HD LYS 11 4.394 -9.829 -0.632 121 2HD LYS 11 1HD LYS 11 3.231 -8.540 -0.319 122 1HE LYS 11 2HE LYS 11 3.440 -8.694 -2.718 123 2HE LYS 11 1HE LYS 11 4.364 -7.256 -2.239 124 1HZ LYS 11 1HZ LYS 11 5.696 -8.671 -3.674 125 2HZ LYS 11 2HZ LYS 11 5.470 -9.989 -2.626 126 3HZ LYS 11 3HZ LYS 11 6.356 -8.635 -2.111 127 H LYS 12 H LYS 12 3.780 -4.004 0.178 128 HA LYS 12 HA LYS 12 6.082 -3.278 -0.973 129 1HB LYS 12 2HB LYS 12 4.255 -1.654 0.798 130 2HB LYS 12 1HB LYS 12 5.492 -0.921 -0.216 131 1HG LYS 12 2HG LYS 12 3.337 -2.776 -1.260 132 2HG LYS 12 1HG LYS 12 3.241 -1.015 -1.321 133 1HD LYS 12 2HD LYS 12 5.676 -1.340 -2.418 134 2HD LYS 12 1HD LYS 12 4.951 -2.875 -2.896 135 1HE LYS 12 2HE LYS 12 3.113 -1.738 -4.004 136 2HE LYS 12 1HE LYS 12 3.662 -0.166 -3.386 137 1HZ LYS 12 1HZ LYS 12 5.757 -0.469 -4.536 138 2HZ LYS 12 2HZ LYS 12 4.473 -0.572 -5.646 139 3HZ LYS 12 3HZ LYS 12 5.259 -1.983 -5.116 Start of MODEL 15 1 1H ARG 1 1HT ARG 1 0.398 9.955 -5.743 2 2H ARG 1 2HT ARG 1 1.921 10.559 -6.190 3 3H ARG 1 3HT ARG 1 1.216 11.029 -4.718 4 HA ARG 1 HA ARG 1 1.925 8.207 -5.321 5 1HB ARG 1 2HB ARG 1 3.560 10.556 -4.791 6 2HB ARG 1 1HB ARG 1 3.752 9.355 -3.519 7 1HG ARG 1 2HG ARG 1 5.378 8.905 -5.274 8 2HG ARG 1 1HG ARG 1 4.164 7.625 -5.270 9 1HD ARG 1 2HD ARG 1 4.391 8.220 -7.564 10 2HD ARG 1 1HD ARG 1 2.926 9.055 -7.018 11 HE ARG 1 HE ARG 1 5.190 10.729 -6.509 12 1HH1 ARG 1 1HH2 ARG 1 2.487 11.212 -8.024 13 2HH1 ARG 1 2HH2 ARG 1 3.103 11.771 -9.542 14 1HH2 ARG 1 1HH1 ARG 1 6.342 10.696 -8.926 15 2HH2 ARG 1 2HH1 ARG 1 5.286 11.480 -10.054 16 H GLN 2 H GLN 2 0.840 6.987 -3.829 17 HA GLN 2 HA GLN 2 0.269 8.206 -1.148 18 1HB GLN 2 2HB GLN 2 -1.491 7.364 -3.194 19 2HB GLN 2 1HB GLN 2 -1.584 6.126 -1.937 20 1HG GLN 2 2HG GLN 2 -3.220 7.840 -1.430 21 2HG GLN 2 1HG GLN 2 -1.913 7.956 -0.248 22 1HE2 GLN 2 1HE2 GLN 2 -1.833 10.189 0.173 23 2HE2 GLN 2 2HE2 GLN 2 -1.622 11.378 -1.031 24 H ILE 3 H ILE 3 0.727 5.161 -2.934 25 HA ILE 3 HA ILE 3 1.351 3.041 -2.200 26 HB ILE 3 HB ILE 3 3.237 4.864 -2.318 27 1HG1 ILE 3 2HG1 ILE 3 3.375 2.519 -2.902 28 2HG1 ILE 3 1HG1 ILE 3 4.831 3.006 -2.017 29 1HG2 ILE 3 1HG2 ILE 3 2.789 5.018 0.387 30 2HG2 ILE 3 2HG2 ILE 3 4.308 5.442 -0.394 31 3HG2 ILE 3 3HG2 ILE 3 4.097 3.841 0.313 32 1HD1 ILE 3 1HD1 ILE 3 2.422 1.534 -0.902 33 2HD1 ILE 3 2HD1 ILE 3 3.745 2.155 0.086 34 3HD1 ILE 3 3HD1 ILE 3 4.050 0.888 -1.101 35 H LYS 4 H LYS 4 -0.776 4.012 -0.472 36 HA LYS 4 HA LYS 4 0.109 2.915 2.156 37 1HB LYS 4 2HB LYS 4 -2.188 4.745 1.400 38 2HB LYS 4 1HB LYS 4 -1.746 4.257 3.027 39 1HG LYS 4 2HG LYS 4 0.631 5.129 1.932 40 2HG LYS 4 1HG LYS 4 -0.558 6.306 1.372 41 1HD LYS 4 2HD LYS 4 -1.132 5.760 4.110 42 2HD LYS 4 1HD LYS 4 0.603 6.045 3.979 43 1HE LYS 4 2HE LYS 4 0.042 8.259 4.048 44 2HE LYS 4 1HE LYS 4 -0.455 8.033 2.359 45 1HZ LYS 4 1HZ LYS 4 -2.637 7.307 3.155 46 2HZ LYS 4 2HZ LYS 4 -2.296 8.896 3.652 47 3HZ LYS 4 3HZ LYS 4 -2.163 7.611 4.755 48 H ILE 5 H ILE 5 -2.610 2.992 -0.146 49 HA ILE 5 HA ILE 5 -3.976 0.708 1.051 50 HB ILE 5 HB ILE 5 -4.201 1.839 -1.758 51 1HG1 ILE 5 2HG1 ILE 5 -4.400 3.776 -0.420 52 2HG1 ILE 5 1HG1 ILE 5 -6.062 3.248 -0.664 53 1HG2 ILE 5 1HG2 ILE 5 -6.182 0.488 0.095 54 2HG2 ILE 5 2HG2 ILE 5 -5.450 -0.228 -1.341 55 3HG2 ILE 5 3HG2 ILE 5 -6.564 1.129 -1.503 56 1HD1 ILE 5 1HD1 ILE 5 -5.993 3.636 1.648 57 2HD1 ILE 5 2HD1 ILE 5 -4.350 3.013 1.797 58 3HD1 ILE 5 3HD1 ILE 5 -5.696 1.900 1.545 59 H TRP 6 H TRP 6 -1.295 1.223 -0.957 60 HA TRP 6 HA TRP 6 -1.318 -1.359 -2.357 61 1HB TRP 6 2HB TRP 6 0.600 0.970 -2.064 62 2HB TRP 6 1HB TRP 6 0.954 -0.427 -3.069 63 HD1 TRP 6 HD TRP 6 -0.176 -0.609 -5.285 64 HE1 TRP 6 1HE TRP 6 -1.723 0.900 -6.687 65 HE3 TRP 6 3HE TRP 6 -1.343 2.812 -1.762 66 HZ2 TRP 6 2HZ TRP 6 -3.264 3.283 -6.322 67 HZ3 TRP 6 3HZ TRP 6 -2.861 4.711 -2.288 68 HH2 TRP 6 HH TRP 6 -3.818 4.950 -4.566 69 H PHE 7 H PHE 7 0.780 0.346 -0.156 70 HA PHE 7 HA PHE 7 2.538 -1.700 0.659 71 1HB PHE 7 2HB PHE 7 2.732 0.678 1.267 72 2HB PHE 7 1HB PHE 7 1.257 0.570 2.223 73 HD1 PHE 7 1HD PHE 7 1.197 -0.735 4.324 74 HD2 PHE 7 2HD PHE 7 4.827 -0.205 2.091 75 HE1 PHE 7 1HE PHE 7 2.517 -1.476 6.290 76 HE2 PHE 7 2HE PHE 7 6.147 -0.946 4.056 77 HZ PHE 7 HZ PHE 7 4.991 -1.582 6.156 78 H ARG 8 H ARG 8 -0.833 -1.271 1.326 79 HA ARG 8 HA ARG 8 -0.867 -3.122 3.611 80 1HB ARG 8 2HB ARG 8 -2.035 -0.832 3.123 81 2HB ARG 8 1HB ARG 8 -3.203 -1.834 2.269 82 1HG ARG 8 2HG ARG 8 -3.951 -1.582 4.567 83 2HG ARG 8 1HG ARG 8 -3.363 -3.238 4.373 84 1HD ARG 8 2HD ARG 8 -1.808 -2.881 5.980 85 2HD ARG 8 1HD ARG 8 -1.136 -1.542 5.019 86 HE ARG 8 HE ARG 8 -3.403 -0.421 6.098 87 1HH1 ARG 8 1HH1 ARG 8 -2.660 -2.701 8.160 88 2HH1 ARG 8 2HH1 ARG 8 -1.893 -1.733 9.374 89 1HH2 ARG 8 1HH2 ARG 8 -1.596 1.056 7.336 90 2HH2 ARG 8 2HH2 ARG 8 -1.290 0.395 8.908 91 H LYS 9 H LYS 9 -1.353 -3.171 0.175 92 HA LYS 9 HA LYS 9 -3.233 -5.419 0.147 93 1HB LYS 9 2HB LYS 9 -1.853 -3.591 -1.722 94 2HB LYS 9 1HB LYS 9 -2.151 -5.209 -2.368 95 1HG LYS 9 2HG LYS 9 -4.282 -3.530 -1.024 96 2HG LYS 9 1HG LYS 9 -4.024 -3.556 -2.768 97 1HD LYS 9 2HD LYS 9 -4.330 -6.049 -2.712 98 2HD LYS 9 1HD LYS 9 -4.765 -5.910 -1.008 99 1HE LYS 9 2HE LYS 9 -6.783 -4.832 -1.471 100 2HE LYS 9 1HE LYS 9 -6.205 -4.204 -3.027 101 1HZ LYS 9 1HZ LYS 9 -7.711 -6.108 -3.308 102 2HZ LYS 9 2HZ LYS 9 -6.645 -7.078 -2.408 103 3HZ LYS 9 3HZ LYS 9 -6.157 -6.436 -3.904 104 H TRP 10 H TRP 10 0.145 -5.058 -1.033 105 HA TRP 10 HA TRP 10 0.510 -7.978 -0.962 106 1HB TRP 10 2HB TRP 10 2.512 -5.812 -1.630 107 2HB TRP 10 1HB TRP 10 2.440 -7.450 -2.271 108 HD1 TRP 10 HD TRP 10 2.299 -4.482 -3.777 109 HE1 TRP 10 1HE TRP 10 0.418 -4.195 -5.516 110 HE3 TRP 10 3HE TRP 10 -0.842 -8.197 -2.350 111 HZ2 TRP 10 2HZ TRP 10 -2.084 -5.367 -6.216 112 HZ3 TRP 10 3HZ TRP 10 -2.973 -8.612 -3.548 113 HH2 TRP 10 HH TRP 10 -3.598 -7.194 -5.485 114 H LYS 11 H LYS 11 3.422 -6.461 -0.343 115 HA LYS 11 HA LYS 11 3.268 -6.286 2.564 116 1HB LYS 11 2HB LYS 11 5.119 -8.101 2.689 117 2HB LYS 11 1HB LYS 11 3.464 -8.655 2.441 118 1HG LYS 11 2HG LYS 11 4.947 -8.015 -0.032 119 2HG LYS 11 1HG LYS 11 5.561 -9.404 0.867 120 1HD LYS 11 2HD LYS 11 3.701 -10.657 0.457 121 2HD LYS 11 1HD LYS 11 2.621 -9.271 0.620 122 1HE LYS 11 2HE LYS 11 2.428 -9.349 -1.649 123 2HE LYS 11 1HE LYS 11 4.083 -8.709 -1.700 124 1HZ LYS 11 1HZ LYS 11 3.982 -10.793 -2.897 125 2HZ LYS 11 2HZ LYS 11 3.311 -11.577 -1.547 126 3HZ LYS 11 3HZ LYS 11 4.906 -10.994 -1.488 127 H LYS 12 H LYS 12 3.913 -4.649 0.245 128 HA LYS 12 HA LYS 12 6.381 -4.252 -0.666 129 1HB LYS 12 2HB LYS 12 4.530 -2.248 0.638 130 2HB LYS 12 1HB LYS 12 5.901 -1.784 -0.365 131 1HG LYS 12 2HG LYS 12 3.605 -3.554 -1.257 132 2HG LYS 12 1HG LYS 12 3.809 -1.857 -1.686 133 1HD LYS 12 2HD LYS 12 5.293 -2.356 -3.310 134 2HD LYS 12 1HD LYS 12 6.223 -3.384 -2.225 135 1HE LYS 12 2HE LYS 12 3.974 -4.919 -2.651 136 2HE LYS 12 1HE LYS 12 4.214 -4.148 -4.232 137 1HZ LYS 12 1HZ LYS 12 5.564 -6.159 -4.011 138 2HZ LYS 12 2HZ LYS 12 6.329 -5.503 -2.642 139 3HZ LYS 12 3HZ LYS 12 6.537 -4.778 -4.164 Start of MODEL 16 1 1H ARG 1 1HT ARG 1 1.781 7.633 -5.909 2 2H ARG 1 2HT ARG 1 2.382 9.153 -6.372 3 3H ARG 1 3HT ARG 1 0.995 9.043 -5.395 4 HA ARG 1 HA ARG 1 3.511 7.863 -4.427 5 1HB ARG 1 2HB ARG 1 4.120 10.095 -3.544 6 2HB ARG 1 1HB ARG 1 4.056 10.114 -5.296 7 1HG ARG 1 2HG ARG 1 1.485 10.757 -4.038 8 2HG ARG 1 1HG ARG 1 2.784 11.883 -3.673 9 1HD ARG 1 2HD ARG 1 2.122 12.841 -5.641 10 2HD ARG 1 1HD ARG 1 3.196 11.604 -6.309 11 HE ARG 1 HE ARG 1 0.370 10.839 -5.832 12 1HH1 ARG 1 1HH1 ARG 1 1.737 12.729 -8.143 13 2HH1 ARG 1 2HH1 ARG 1 1.479 11.654 -9.476 14 1HH2 ARG 1 1HH2 ARG 1 0.548 8.976 -7.480 15 2HH2 ARG 1 2HH2 ARG 1 0.806 9.529 -9.101 16 H GLN 2 H GLN 2 1.343 6.666 -3.650 17 HA GLN 2 HA GLN 2 0.419 8.033 -1.143 18 1HB GLN 2 2HB GLN 2 -0.999 7.086 -3.401 19 2HB GLN 2 1HB GLN 2 -1.328 5.936 -2.101 20 1HG GLN 2 2HG GLN 2 -2.984 7.667 -1.948 21 2HG GLN 2 1HG GLN 2 -1.852 7.909 -0.614 22 1HE2 GLN 2 1HE2 GLN 2 -1.296 10.069 -0.383 23 2HE2 GLN 2 2HE2 GLN 2 -1.145 11.187 -1.662 24 H ILE 3 H ILE 3 1.173 4.916 -2.665 25 HA ILE 3 HA ILE 3 1.600 2.818 -1.727 26 HB ILE 3 HB ILE 3 3.510 4.620 -1.591 27 1HG1 ILE 3 2HG1 ILE 3 3.718 2.250 -2.029 28 2HG1 ILE 3 1HG1 ILE 3 4.992 2.767 -0.910 29 1HG2 ILE 3 1HG2 ILE 3 4.263 5.248 0.473 30 2HG2 ILE 3 2HG2 ILE 3 3.810 3.715 1.213 31 3HG2 ILE 3 3HG2 ILE 3 2.593 4.961 0.954 32 1HD1 ILE 3 1HD1 ILE 3 3.532 2.017 0.991 33 2HD1 ILE 3 2HD1 ILE 3 4.012 0.695 -0.072 34 3HD1 ILE 3 3HD1 ILE 3 2.391 1.375 -0.193 35 H LYS 4 H LYS 4 -0.786 3.874 -0.478 36 HA LYS 4 HA LYS 4 -0.416 2.876 2.313 37 1HB LYS 4 2HB LYS 4 -2.354 4.855 1.075 38 2HB LYS 4 1HB LYS 4 -2.419 4.305 2.741 39 1HG LYS 4 2HG LYS 4 0.239 4.996 2.334 40 2HG LYS 4 1HG LYS 4 -0.691 6.296 1.580 41 1HD LYS 4 2HD LYS 4 -1.603 6.985 3.575 42 2HD LYS 4 1HD LYS 4 -1.619 5.355 4.248 43 1HE LYS 4 2HE LYS 4 0.702 5.443 4.800 44 2HE LYS 4 1HE LYS 4 0.960 6.879 3.789 45 1HZ LYS 4 1HZ LYS 4 0.701 7.436 6.162 46 2HZ LYS 4 2HZ LYS 4 -0.860 6.769 6.136 47 3HZ LYS 4 3HZ LYS 4 -0.503 8.139 5.198 48 H ILE 5 H ILE 5 -2.584 2.946 -0.502 49 HA ILE 5 HA ILE 5 -4.300 0.793 0.491 50 HB ILE 5 HB ILE 5 -3.897 1.794 -2.348 51 1HG1 ILE 5 2HG1 ILE 5 -4.240 3.805 -1.154 52 2HG1 ILE 5 1HG1 ILE 5 -5.848 3.352 -1.711 53 1HG2 ILE 5 1HG2 ILE 5 -6.394 0.809 -0.948 54 2HG2 ILE 5 2HG2 ILE 5 -5.337 -0.236 -1.898 55 3HG2 ILE 5 3HG2 ILE 5 -6.182 1.105 -2.673 56 1HD1 ILE 5 1HD1 ILE 5 -4.687 3.176 1.056 57 2HD1 ILE 5 2HD1 ILE 5 -6.000 2.097 0.586 58 3HD1 ILE 5 3HD1 ILE 5 -6.238 3.844 0.544 59 H TRP 6 H TRP 6 -1.237 1.103 -0.912 60 HA TRP 6 HA TRP 6 -1.090 -1.543 -2.196 61 1HB TRP 6 2HB TRP 6 0.804 0.753 -1.626 62 2HB TRP 6 1HB TRP 6 1.322 -0.708 -2.450 63 HD1 TRP 6 HD TRP 6 0.690 -1.001 -4.846 64 HE1 TRP 6 1HE TRP 6 -0.481 0.447 -6.627 65 HE3 TRP 6 3HE TRP 6 -1.111 2.628 -1.843 66 HZ2 TRP 6 2HZ TRP 6 -2.001 2.869 -6.728 67 HZ3 TRP 6 3HZ TRP 6 -2.432 4.517 -2.782 68 HH2 TRP 6 HH TRP 6 -2.874 4.640 -5.222 69 H PHE 7 H PHE 7 0.545 0.220 0.327 70 HA PHE 7 HA PHE 7 2.041 -1.824 1.571 71 1HB PHE 7 2HB PHE 7 2.240 0.532 2.147 72 2HB PHE 7 1HB PHE 7 0.558 0.590 2.666 73 HD1 PHE 7 1HD PHE 7 3.819 -1.070 3.416 74 HD2 PHE 7 2HD PHE 7 -0.033 0.117 4.894 75 HE1 PHE 7 1HE PHE 7 4.496 -1.735 5.708 76 HE2 PHE 7 2HE PHE 7 0.643 -0.547 7.188 77 HZ PHE 7 HZ PHE 7 2.907 -1.473 7.593 78 H ARG 8 H ARG 8 -1.381 -1.302 1.491 79 HA ARG 8 HA ARG 8 -1.969 -2.995 3.814 80 1HB ARG 8 2HB ARG 8 -2.987 -0.778 2.875 81 2HB ARG 8 1HB ARG 8 -3.904 -1.865 1.837 82 1HG ARG 8 2HG ARG 8 -5.205 -1.459 3.846 83 2HG ARG 8 1HG ARG 8 -4.583 -3.111 3.935 84 1HD ARG 8 2HD ARG 8 -3.487 -2.602 5.849 85 2HD ARG 8 1HD ARG 8 -2.596 -1.324 4.990 86 HE ARG 8 HE ARG 8 -4.984 -0.101 5.355 87 1HH1 ARG 8 1HH1 ARG 8 -2.377 -0.676 7.297 88 2HH1 ARG 8 2HH1 ARG 8 -3.197 -0.464 8.808 89 1HH2 ARG 8 1HH2 ARG 8 -6.358 -0.398 7.383 90 2HH2 ARG 8 2HH2 ARG 8 -5.451 -0.306 8.856 91 H LYS 9 H LYS 9 -1.333 -3.494 0.507 92 HA LYS 9 HA LYS 9 -3.133 -5.878 0.366 93 1HB LYS 9 2HB LYS 9 -2.048 -3.858 -1.497 94 2HB LYS 9 1HB LYS 9 -2.054 -5.509 -2.129 95 1HG LYS 9 2HG LYS 9 -4.458 -4.156 -0.873 96 2HG LYS 9 1HG LYS 9 -4.173 -4.258 -2.610 97 1HD LYS 9 2HD LYS 9 -3.972 -6.803 -2.248 98 2HD LYS 9 1HD LYS 9 -4.704 -6.508 -0.669 99 1HE LYS 9 2HE LYS 9 -6.641 -5.415 -1.777 100 2HE LYS 9 1HE LYS 9 -5.916 -5.770 -3.358 101 1HZ LYS 9 1HZ LYS 9 -7.506 -7.499 -2.550 102 2HZ LYS 9 2HZ LYS 9 -6.423 -7.833 -1.284 103 3HZ LYS 9 3HZ LYS 9 -5.953 -8.086 -2.897 104 H TRP 10 H TRP 10 0.015 -5.158 -1.181 105 HA TRP 10 HA TRP 10 0.882 -7.923 -0.728 106 1HB TRP 10 2HB TRP 10 2.385 -5.593 -1.950 107 2HB TRP 10 1HB TRP 10 2.588 -7.307 -2.301 108 HD1 TRP 10 HD TRP 10 1.697 -4.789 -4.289 109 HE1 TRP 10 1HE TRP 10 -0.370 -5.194 -5.767 110 HE3 TRP 10 3HE TRP 10 -0.487 -8.619 -1.782 111 HZ2 TRP 10 2HZ TRP 10 -2.647 -6.899 -5.888 112 HZ3 TRP 10 3HZ TRP 10 -2.604 -9.631 -2.575 113 HH2 TRP 10 HH TRP 10 -3.691 -8.769 -4.633 114 H LYS 11 H LYS 11 3.535 -5.825 -0.654 115 HA LYS 11 HA LYS 11 3.647 -5.312 2.204 116 1HB LYS 11 2HB LYS 11 5.557 -6.900 2.572 117 2HB LYS 11 1HB LYS 11 4.037 -7.720 2.218 118 1HG LYS 11 2HG LYS 11 5.723 -7.008 -0.121 119 2HG LYS 11 1HG LYS 11 6.335 -8.293 0.923 120 1HD LYS 11 2HD LYS 11 4.691 -9.739 0.316 121 2HD LYS 11 1HD LYS 11 3.460 -8.474 0.332 122 1HE LYS 11 2HE LYS 11 3.686 -9.184 -1.969 123 2HE LYS 11 1HE LYS 11 4.518 -7.620 -1.850 124 1HZ LYS 11 1HZ LYS 11 5.769 -10.309 -1.654 125 2HZ LYS 11 2HZ LYS 11 6.584 -8.846 -1.370 126 3HZ LYS 11 3HZ LYS 11 5.970 -9.194 -2.916 127 H LYS 12 H LYS 12 3.965 -4.000 -0.388 128 HA LYS 12 HA LYS 12 5.687 -3.028 -1.766 129 1HB LYS 12 2HB LYS 12 6.295 -0.973 -0.098 130 2HB LYS 12 1HB LYS 12 4.744 -1.138 -0.912 131 1HG LYS 12 2HG LYS 12 4.344 -0.701 1.443 132 2HG LYS 12 1HG LYS 12 3.880 -2.367 1.100 133 1HD LYS 12 2HD LYS 12 5.175 -2.777 2.948 134 2HD LYS 12 1HD LYS 12 6.461 -2.761 1.744 135 1HE LYS 12 2HE LYS 12 7.127 -0.557 2.303 136 2HE LYS 12 1HE LYS 12 5.599 -0.220 3.139 137 1HZ LYS 12 1HZ LYS 12 7.716 -2.131 3.968 138 2HZ LYS 12 2HZ LYS 12 6.172 -2.075 4.676 139 3HZ LYS 12 3HZ LYS 12 7.213 -0.738 4.795
Contact the webmaster for help, if required. Saturday, June 1, 2024 4:44:12 AM GMT (wattos1)