NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
5005 | 1g8c | 4552 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H ILE 1 1H ILE 1 -19.794 -6.072 4.025 2 2H ILE 1 2H ILE 1 -19.164 -7.292 5.024 3 3H ILE 1 3H ILE 1 -20.499 -7.614 4.026 4 HA ILE 1 HA ILE 1 -18.548 -8.583 3.022 5 HB ILE 1 HB ILE 1 -18.832 -7.470 0.869 6 1HG1 ILE 1 2HG1 ILE 1 -20.478 -5.245 1.636 7 2HG1 ILE 1 1HG1 ILE 1 -18.947 -5.141 2.507 8 1HG2 ILE 1 1HG2 ILE 1 -21.415 -7.123 2.411 9 2HG2 ILE 1 2HG2 ILE 1 -20.777 -8.704 1.961 10 3HG2 ILE 1 3HG2 ILE 1 -21.222 -7.545 0.709 11 1HD1 ILE 1 1HD1 ILE 1 -17.955 -5.766 0.114 12 2HD1 ILE 1 2HD1 ILE 1 -18.338 -4.097 0.536 13 3HD1 ILE 1 3HD1 ILE 1 -19.466 -5.042 -0.436 14 H LEU 2 H LEU 2 -16.511 -7.914 1.729 15 HA LEU 2 HA LEU 2 -14.681 -6.527 3.487 16 1HB LEU 2 2HB LEU 2 -13.069 -7.145 1.820 17 2HB LEU 2 1HB LEU 2 -14.256 -8.449 1.857 18 HG LEU 2 HG LEU 2 -15.418 -6.857 0.014 19 1HD1 LEU 2 1HD1 LEU 2 -12.463 -6.515 -0.536 20 2HD1 LEU 2 2HD1 LEU 2 -13.424 -5.269 0.259 21 3HD1 LEU 2 3HD1 LEU 2 -13.819 -5.770 -1.385 22 1HD2 LEU 2 1HD2 LEU 2 -14.926 -8.575 -1.413 23 2HD2 LEU 2 2HD2 LEU 2 -14.262 -9.323 0.039 24 3HD2 LEU 2 3HD2 LEU 2 -13.196 -8.483 -1.086 25 HA PRO 3 HA PRO 3 -15.271 -2.451 1.922 26 1HB PRO 3 2HB PRO 3 -12.950 -1.332 2.834 27 2HB PRO 3 1HB PRO 3 -14.328 -1.698 3.889 28 1HG PRO 3 2HG PRO 3 -11.775 -3.166 3.540 29 2HG PRO 3 1HG PRO 3 -12.775 -2.961 4.982 30 1HD PRO 3 2HD PRO 3 -12.705 -5.240 3.422 31 2HD PRO 3 1HD PRO 3 -14.032 -4.796 4.516 32 H TRP 4 H TRP 4 -11.755 -3.028 1.716 33 HA TRP 4 HA TRP 4 -11.690 -3.433 -1.130 34 1HB TRP 4 2HB TRP 4 -12.455 -0.925 -0.430 35 2HB TRP 4 1HB TRP 4 -10.712 -0.710 -0.501 36 HD1 TRP 4 HD1 TRP 4 -9.580 -1.842 -2.875 37 HE1 TRP 4 1HE TRP 4 -10.489 -1.575 -5.277 38 HE3 TRP 4 3HE TRP 4 -14.367 -0.510 -1.828 39 HZ2 TRP 4 2HZ TRP 4 -12.950 -0.883 -6.577 40 HZ3 TRP 4 3HZ TRP 4 -15.991 -0.047 -3.655 41 HH2 TRP 4 HH2 TRP 4 -15.284 -0.232 -6.028 42 H LYS 5 H LYS 5 -10.065 -4.973 -0.304 43 HA LYS 5 HA LYS 5 -7.788 -4.326 1.245 44 1HB LYS 5 2HB LYS 5 -6.818 -6.307 -0.075 45 2HB LYS 5 1HB LYS 5 -8.345 -6.603 0.753 46 1HG LYS 5 2HG LYS 5 -9.576 -6.598 -1.220 47 2HG LYS 5 1HG LYS 5 -8.400 -5.594 -2.070 48 1HD LYS 5 2HD LYS 5 -6.837 -7.720 -1.605 49 2HD LYS 5 1HD LYS 5 -8.398 -8.543 -1.612 50 1HE LYS 5 2HE LYS 5 -8.743 -8.147 -3.858 51 2HE LYS 5 1HE LYS 5 -7.903 -6.584 -3.814 52 1HZ LYS 5 1HZ LYS 5 -5.870 -8.055 -3.222 53 2HZ LYS 5 2HZ LYS 5 -6.348 -7.909 -4.846 54 3HZ LYS 5 3HZ LYS 5 -6.764 -9.295 -3.956 55 H TRP 6 H TRP 6 -6.109 -2.942 0.787 56 HA TRP 6 HA TRP 6 -5.621 -2.235 -2.088 57 1HB TRP 6 2HB TRP 6 -6.219 -0.703 0.212 58 2HB TRP 6 1HB TRP 6 -4.546 -0.372 -0.178 59 HD1 TRP 6 HD1 TRP 6 -8.053 -0.142 -1.653 60 HE1 TRP 6 1HE TRP 6 -7.985 1.490 -3.657 61 HE3 TRP 6 3HE TRP 6 -3.074 0.627 -1.899 62 HZ2 TRP 6 2HZ TRP 6 -6.010 2.943 -5.172 63 HZ3 TRP 6 3HZ TRP 6 -2.082 2.132 -3.619 64 HH2 TRP 6 HH2 TRP 6 -3.549 3.290 -5.255 65 HA PRO 7 HA PRO 7 -1.578 -3.918 -1.512 66 1HB PRO 7 2HB PRO 7 -0.426 -2.848 -3.750 67 2HB PRO 7 1HB PRO 7 -1.560 -4.212 -3.811 68 1HG PRO 7 2HG PRO 7 -2.021 -1.338 -4.402 69 2HG PRO 7 1HG PRO 7 -2.698 -2.773 -5.183 70 1HD PRO 7 2HD PRO 7 -4.045 -1.228 -3.357 71 2HD PRO 7 1HD PRO 7 -4.407 -2.936 -3.682 72 H TRP 8 H TRP 8 -0.612 -2.851 0.251 73 HA TRP 8 HA TRP 8 0.819 -0.301 -0.370 74 1HB TRP 8 2HB TRP 8 -1.330 0.196 0.757 75 2HB TRP 8 1HB TRP 8 -0.895 -0.913 2.048 76 HD1 TRP 8 HD1 TRP 8 1.564 1.593 0.451 77 HE1 TRP 8 1HE TRP 8 2.329 3.215 2.315 78 HE3 TRP 8 3HE TRP 8 -1.463 0.043 4.170 79 HZ2 TRP 8 2HZ TRP 8 1.703 3.762 5.078 80 HZ3 TRP 8 3HZ TRP 8 -1.386 1.092 6.428 81 HH2 TRP 8 HH2 TRP 8 0.192 2.957 6.882 82 H TRP 9 H TRP 9 1.896 -2.960 -0.213 83 HA TRP 9 HA TRP 9 2.923 -3.867 2.210 84 1HB TRP 9 2HB TRP 9 3.691 -3.838 -0.646 85 2HB TRP 9 1HB TRP 9 4.990 -4.183 0.477 86 HD1 TRP 9 HD1 TRP 9 5.029 -6.746 -0.382 87 HE1 TRP 9 1HE TRP 9 3.522 -8.743 0.255 88 HE3 TRP 9 3HE TRP 9 1.163 -4.245 1.744 89 HZ2 TRP 9 2HZ TRP 9 0.982 -9.204 1.514 90 HZ3 TRP 9 3HZ TRP 9 -0.799 -5.464 2.662 91 HH2 TRP 9 HH2 TRP 9 -0.891 -7.942 2.547 92 HA PRO 10 HA PRO 10 5.240 -0.087 3.190 93 1HB PRO 10 2HB PRO 10 5.423 -0.610 5.869 94 2HB PRO 10 1HB PRO 10 3.986 0.123 5.130 95 1HG PRO 10 2HG PRO 10 4.452 -2.688 5.981 96 2HG PRO 10 1HG PRO 10 2.984 -1.706 6.082 97 1HD PRO 10 2HD PRO 10 3.415 -3.620 4.172 98 2HD PRO 10 1HD PRO 10 2.336 -2.222 3.960 99 H TRP 11 H TRP 11 6.785 -1.748 1.901 100 HA TRP 11 HA TRP 11 8.480 -3.615 2.785 101 1HB TRP 11 2HB TRP 11 10.273 -1.701 1.757 102 2HB TRP 11 1HB TRP 11 9.520 -3.031 0.908 103 HD1 TRP 11 HD1 TRP 11 8.550 0.554 1.955 104 HE1 TRP 11 1HE TRP 11 7.166 1.576 0.013 105 HE3 TRP 11 3HE TRP 11 8.412 -3.434 -1.070 106 HZ2 TRP 11 2HZ TRP 11 6.126 0.723 -2.549 107 HZ3 TRP 11 3HZ TRP 11 7.230 -3.374 -3.273 108 HH2 TRP 11 HH2 TRP 11 6.084 -1.294 -4.007 109 H ARG 12 H ARG 12 9.376 -0.248 3.390 110 HA ARG 12 HA ARG 12 11.412 -0.807 5.299 111 1HB ARG 12 2HB ARG 12 11.082 1.639 5.760 112 2HB ARG 12 1HB ARG 12 11.225 1.267 4.048 113 1HG ARG 12 2HG ARG 12 9.145 2.033 3.629 114 2HG ARG 12 1HG ARG 12 8.465 1.080 4.947 115 1HD ARG 12 2HD ARG 12 9.980 3.664 5.429 116 2HD ARG 12 1HD ARG 12 8.218 3.601 5.225 117 HE ARG 12 HE ARG 12 8.642 1.644 7.090 118 1HH1 ARG 12 2HH1 ARG 12 8.170 4.898 7.175 119 2HH1 ARG 12 1HH1 ARG 12 8.939 5.180 8.702 120 1HH2 ARG 12 1HH2 ARG 12 10.306 2.000 8.904 121 2HH2 ARG 12 2HH2 ARG 12 10.148 3.541 9.680 122 H ARG 13 H ARG 13 10.887 -1.977 7.149 123 HA ARG 13 HA ARG 13 8.318 -1.747 8.494 124 1HB ARG 13 2HB ARG 13 10.594 -3.435 8.452 125 2HB ARG 13 1HB ARG 13 10.447 -2.847 10.109 126 1HG ARG 13 2HG ARG 13 8.095 -3.961 8.565 127 2HG ARG 13 1HG ARG 13 9.138 -4.973 9.565 128 1HD ARG 13 2HD ARG 13 7.498 -4.399 11.125 129 2HD ARG 13 1HD ARG 13 8.636 -3.059 11.373 130 HE ARG 13 HE ARG 13 6.670 -2.609 9.238 131 1HH1 ARG 13 1HH1 ARG 13 7.168 -2.564 12.639 132 2HH1 ARG 13 2HH1 ARG 13 6.246 -1.120 12.893 133 1HH2 ARG 13 1HH2 ARG 13 5.613 -0.609 9.523 134 2HH2 ARG 13 2HH2 ARG 13 5.367 -0.013 11.130 135 1HN NH2 14 1HT ARG 13 7.810 0.053 9.773 136 2HN NH2 14 2HT ARG 13 8.916 0.935 10.710 Start of MODEL 2 1 1H ILE 1 1H ILE 1 -11.954 -7.600 -9.164 2 2H ILE 1 2H ILE 1 -12.543 -7.953 -7.610 3 3H ILE 1 3H ILE 1 -11.561 -9.074 -8.424 4 HA ILE 1 HA ILE 1 -9.661 -7.624 -8.276 5 HB ILE 1 HB ILE 1 -9.974 -5.440 -7.127 6 1HG1 ILE 1 2HG1 ILE 1 -12.144 -6.419 -5.979 7 2HG1 ILE 1 1HG1 ILE 1 -12.026 -4.696 -6.325 8 1HG2 ILE 1 1HG2 ILE 1 -11.886 -5.772 -9.456 9 2HG2 ILE 1 2HG2 ILE 1 -10.133 -5.680 -9.620 10 3HG2 ILE 1 3HG2 ILE 1 -11.030 -4.305 -8.979 11 1HD1 ILE 1 1HD1 ILE 1 -13.095 -6.265 -8.571 12 2HD1 ILE 1 2HD1 ILE 1 -13.707 -4.779 -7.845 13 3HD1 ILE 1 3HD1 ILE 1 -14.097 -6.340 -7.124 14 H LEU 2 H LEU 2 -8.396 -7.408 -6.248 15 HA LEU 2 HA LEU 2 -8.831 -9.446 -4.362 16 1HB LEU 2 2HB LEU 2 -6.896 -8.575 -3.410 17 2HB LEU 2 1HB LEU 2 -6.839 -7.781 -4.976 18 HG LEU 2 HG LEU 2 -8.392 -6.030 -3.539 19 1HD1 LEU 2 1HD1 LEU 2 -6.409 -7.374 -1.694 20 2HD1 LEU 2 2HD1 LEU 2 -8.118 -7.055 -1.408 21 3HD1 LEU 2 3HD1 LEU 2 -6.963 -5.724 -1.419 22 1HD2 LEU 2 1HD2 LEU 2 -6.212 -4.732 -3.317 23 2HD2 LEU 2 2HD2 LEU 2 -6.579 -5.313 -4.939 24 3HD2 LEU 2 3HD2 LEU 2 -5.395 -6.162 -3.946 25 HA PRO 3 HA PRO 3 -11.740 -7.959 -1.438 26 1HB PRO 3 2HB PRO 3 -10.520 -8.254 1.003 27 2HB PRO 3 1HB PRO 3 -11.117 -9.621 0.039 28 1HG PRO 3 2HG PRO 3 -8.343 -8.571 0.324 29 2HG PRO 3 1HG PRO 3 -8.916 -10.246 0.244 30 1HD PRO 3 2HD PRO 3 -7.796 -8.966 -1.868 31 2HD PRO 3 1HD PRO 3 -9.017 -10.246 -2.048 32 H TRP 4 H TRP 4 -11.687 -6.461 0.826 33 HA TRP 4 HA TRP 4 -11.341 -3.830 0.066 34 1HB TRP 4 2HB TRP 4 -11.381 -3.454 2.527 35 2HB TRP 4 1HB TRP 4 -12.612 -4.574 1.969 36 HD1 TRP 4 HD1 TRP 4 -9.107 -4.575 3.497 37 HE1 TRP 4 1HE TRP 4 -8.808 -6.803 4.799 38 HE3 TRP 4 3HE TRP 4 -13.429 -6.796 2.237 39 HZ2 TRP 4 2HZ TRP 4 -10.287 -9.249 5.212 40 HZ3 TRP 4 3HZ TRP 4 -14.014 -9.081 3.065 41 HH2 TRP 4 HH2 TRP 4 -12.440 -10.305 4.551 42 H LYS 5 H LYS 5 -8.922 -6.063 0.989 43 HA LYS 5 HA LYS 5 -6.863 -4.609 2.123 44 1HB LYS 5 2HB LYS 5 -7.205 -6.958 0.483 45 2HB LYS 5 1HB LYS 5 -5.722 -6.126 0.017 46 1HG LYS 5 2HG LYS 5 -4.745 -6.401 2.100 47 2HG LYS 5 1HG LYS 5 -6.299 -6.473 2.933 48 1HD LYS 5 2HD LYS 5 -5.582 -8.704 3.008 49 2HD LYS 5 1HD LYS 5 -6.638 -8.689 1.596 50 1HE LYS 5 2HE LYS 5 -4.545 -8.221 0.196 51 2HE LYS 5 1HE LYS 5 -3.608 -8.635 1.644 52 1HZ LYS 5 1HZ LYS 5 -5.669 -10.334 0.339 53 2HZ LYS 5 2HZ LYS 5 -4.874 -10.714 1.790 54 3HZ LYS 5 3HZ LYS 5 -3.997 -10.616 0.338 55 H TRP 6 H TRP 6 -5.201 -3.223 1.318 56 HA TRP 6 HA TRP 6 -5.843 -1.903 -1.299 57 1HB TRP 6 2HB TRP 6 -5.397 -0.979 1.376 58 2HB TRP 6 1HB TRP 6 -4.123 -0.352 0.354 59 HD1 TRP 6 HD1 TRP 6 -7.938 -0.420 0.624 60 HE1 TRP 6 1HE TRP 6 -8.874 1.596 -0.697 61 HE3 TRP 6 3HE TRP 6 -3.647 1.282 -1.408 62 HZ2 TRP 6 2HZ TRP 6 -7.879 3.681 -2.417 63 HZ3 TRP 6 3HZ TRP 6 -3.622 3.284 -2.890 64 HH2 TRP 6 HH2 TRP 6 -5.739 4.483 -3.396 65 HA PRO 7 HA PRO 7 -1.916 -3.270 -2.735 66 1HB PRO 7 2HB PRO 7 -1.548 -1.444 -4.740 67 2HB PRO 7 1HB PRO 7 -2.697 -2.792 -4.860 68 1HG PRO 7 2HG PRO 7 -3.200 0.076 -4.265 69 2HG PRO 7 1HG PRO 7 -4.167 -1.070 -5.207 70 1HD PRO 7 2HD PRO 7 -4.747 -0.320 -2.633 71 2HD PRO 7 1HD PRO 7 -5.256 -1.858 -3.361 72 H TRP 8 H TRP 8 -0.486 -2.749 -1.017 73 HA TRP 8 HA TRP 8 1.373 -0.598 -1.425 74 1HB TRP 8 2HB TRP 8 -0.536 0.763 -0.740 75 2HB TRP 8 1HB TRP 8 -0.761 -0.240 0.687 76 HD1 TRP 8 HD1 TRP 8 2.756 0.754 -0.422 77 HE1 TRP 8 1HE TRP 8 3.749 2.325 1.372 78 HE3 TRP 8 3HE TRP 8 -1.355 1.459 2.421 79 HZ2 TRP 8 2HZ TRP 8 2.873 3.709 3.741 80 HZ3 TRP 8 3HZ TRP 8 -1.287 2.898 4.454 81 HH2 TRP 8 HH2 TRP 8 0.824 4.025 5.112 82 H TRP 9 H TRP 9 2.968 -2.148 -0.885 83 HA TRP 9 HA TRP 9 2.776 -3.506 1.752 84 1HB TRP 9 2HB TRP 9 3.786 -4.092 -0.883 85 2HB TRP 9 1HB TRP 9 5.087 -4.223 0.284 86 HD1 TRP 9 HD1 TRP 9 5.206 -6.853 0.346 87 HE1 TRP 9 1HE TRP 9 3.593 -8.652 1.253 88 HE3 TRP 9 3HE TRP 9 1.095 -4.004 1.055 89 HZ2 TRP 9 2HZ TRP 9 0.871 -8.836 2.168 90 HZ3 TRP 9 3HZ TRP 9 -1.016 -4.981 1.944 91 HH2 TRP 9 HH2 TRP 9 -1.127 -7.396 2.501 92 HA PRO 10 HA PRO 10 5.607 -0.034 2.765 93 1HB PRO 10 2HB PRO 10 5.024 -0.052 5.443 94 2HB PRO 10 1HB PRO 10 4.042 0.817 4.245 95 1HG PRO 10 2HG PRO 10 3.570 -1.852 5.495 96 2HG PRO 10 1HG PRO 10 2.422 -0.546 5.159 97 1HD PRO 10 2HD PRO 10 2.625 -2.728 3.582 98 2HD PRO 10 1HD PRO 10 2.203 -1.122 2.944 99 H TRP 11 H TRP 11 7.150 -1.899 2.193 100 HA TRP 11 HA TRP 11 8.057 -3.982 3.658 101 1HB TRP 11 2HB TRP 11 10.429 -2.589 3.087 102 2HB TRP 11 1HB TRP 11 9.662 -3.830 2.123 103 HD1 TRP 11 HD1 TRP 11 9.264 -0.030 2.655 104 HE1 TRP 11 1HE TRP 11 8.729 1.022 0.347 105 HE3 TRP 11 3HE TRP 11 9.081 -4.224 -0.070 106 HZ2 TRP 11 2HZ TRP 11 8.270 0.114 -2.360 107 HZ3 TRP 11 3HZ TRP 11 8.592 -4.177 -2.523 108 HH2 TRP 11 HH2 TRP 11 8.184 -2.003 -3.663 109 H ARG 12 H ARG 12 9.675 -0.901 4.215 110 HA ARG 12 HA ARG 12 10.707 -1.621 6.774 111 1HB ARG 12 2HB ARG 12 11.687 0.452 6.621 112 2HB ARG 12 1HB ARG 12 11.206 0.278 4.947 113 1HG ARG 12 2HG ARG 12 9.489 1.646 7.034 114 2HG ARG 12 1HG ARG 12 10.640 2.506 6.014 115 1HD ARG 12 2HD ARG 12 9.029 2.628 4.428 116 2HD ARG 12 1HD ARG 12 9.115 0.862 4.275 117 HE ARG 12 HE ARG 12 7.635 1.212 6.560 118 1HH1 ARG 12 1HH2 ARG 12 7.252 1.442 3.209 119 2HH1 ARG 12 2HH2 ARG 12 5.630 2.048 3.269 120 1HH2 ARG 12 2HH1 ARG 12 5.618 2.427 6.717 121 2HH2 ARG 12 1HH1 ARG 12 4.704 2.607 5.256 122 H ARG 13 H ARG 13 10.135 -0.366 8.828 123 HA ARG 13 HA ARG 13 7.269 -0.665 9.367 124 1HB ARG 13 2HB ARG 13 9.722 -0.747 10.762 125 2HB ARG 13 1HB ARG 13 8.839 0.621 11.440 126 1HG ARG 13 2HG ARG 13 6.814 -0.995 11.526 127 2HG ARG 13 1HG ARG 13 8.009 -2.274 11.323 128 1HD ARG 13 2HD ARG 13 8.085 -2.162 13.623 129 2HD ARG 13 1HD ARG 13 9.194 -0.815 13.300 130 HE ARG 13 HE ARG 13 7.144 0.680 13.375 131 1HH1 ARG 13 1HH2 ARG 13 7.932 -1.234 15.875 132 2HH1 ARG 13 2HH2 ARG 13 6.346 -1.403 16.547 133 1HH2 ARG 13 1HH1 ARG 13 4.742 -0.050 13.785 134 2HH2 ARG 13 2HH1 ARG 13 4.540 -0.732 15.365 135 1HN NH2 14 1HT ARG 13 6.140 1.248 10.599 136 2HN NH2 14 2HT ARG 13 6.393 2.810 9.982 Start of MODEL 3 1 1H ILE 1 1H ILE 1 -13.097 -12.823 -2.576 2 2H ILE 1 2H ILE 1 -13.624 -11.295 -3.104 3 3H ILE 1 3H ILE 1 -14.743 -12.554 -2.887 4 HA ILE 1 HA ILE 1 -15.116 -11.546 -0.909 5 HB ILE 1 HB ILE 1 -13.842 -12.731 0.761 6 1HG1 ILE 1 2HG1 ILE 1 -11.722 -13.158 -1.370 7 2HG1 ILE 1 1HG1 ILE 1 -11.606 -11.962 -0.078 8 1HG2 ILE 1 1HG2 ILE 1 -13.327 -14.825 -1.123 9 2HG2 ILE 1 2HG2 ILE 1 -14.786 -13.972 -1.628 10 3HG2 ILE 1 3HG2 ILE 1 -14.686 -14.668 -0.009 11 1HD1 ILE 1 1HD1 ILE 1 -10.494 -13.728 0.921 12 2HD1 ILE 1 2HD1 ILE 1 -11.455 -14.945 0.082 13 3HD1 ILE 1 3HD1 ILE 1 -12.140 -14.070 1.450 14 H LEU 2 H LEU 2 -14.773 -9.632 0.207 15 HA LEU 2 HA LEU 2 -13.802 -7.523 0.665 16 1HB LEU 2 2HB LEU 2 -11.738 -9.656 0.985 17 2HB LEU 2 1HB LEU 2 -11.184 -7.983 1.054 18 HG LEU 2 HG LEU 2 -13.504 -7.995 2.605 19 1HD1 LEU 2 1HD1 LEU 2 -13.133 -9.836 4.206 20 2HD1 LEU 2 2HD1 LEU 2 -11.813 -10.441 3.207 21 3HD1 LEU 2 3HD1 LEU 2 -13.464 -10.464 2.592 22 1HD2 LEU 2 1HD2 LEU 2 -11.536 -6.710 3.151 23 2HD2 LEU 2 2HD2 LEU 2 -10.564 -8.170 3.329 24 3HD2 LEU 2 3HD2 LEU 2 -11.831 -7.806 4.502 25 HA PRO 3 HA PRO 3 -12.217 -7.189 -3.695 26 1HB PRO 3 2HB PRO 3 -14.269 -5.671 -4.671 27 2HB PRO 3 1HB PRO 3 -14.300 -7.446 -4.664 28 1HG PRO 3 2HG PRO 3 -15.665 -5.525 -2.868 29 2HG PRO 3 1HG PRO 3 -16.197 -7.110 -3.444 30 1HD PRO 3 2HD PRO 3 -15.158 -6.598 -0.933 31 2HD PRO 3 1HD PRO 3 -15.220 -8.195 -1.709 32 H TRP 4 H TRP 4 -12.541 -5.310 -1.027 33 HA TRP 4 HA TRP 4 -11.765 -2.804 -2.417 34 1HB TRP 4 2HB TRP 4 -12.319 -2.047 0.108 35 2HB TRP 4 1HB TRP 4 -13.520 -2.101 -1.169 36 HD1 TRP 4 HD1 TRP 4 -12.015 -4.548 1.382 37 HE1 TRP 4 1HE TRP 4 -13.940 -6.031 2.294 38 HE3 TRP 4 3HE TRP 4 -15.818 -2.721 -1.384 39 HZ2 TRP 4 2HZ TRP 4 -16.768 -6.373 1.854 40 HZ3 TRP 4 3HZ TRP 4 -18.132 -3.619 -1.156 41 HH2 TRP 4 HH2 TRP 4 -18.606 -5.445 0.461 42 H LYS 5 H LYS 5 -10.218 -5.333 -1.216 43 HA LYS 5 HA LYS 5 -8.518 -4.437 0.868 44 1HB LYS 5 2HB LYS 5 -8.714 -6.570 -1.081 45 2HB LYS 5 1HB LYS 5 -7.031 -6.081 -0.886 46 1HG LYS 5 2HG LYS 5 -8.888 -6.714 1.424 47 2HG LYS 5 1HG LYS 5 -7.740 -7.862 0.733 48 1HD LYS 5 2HD LYS 5 -6.552 -5.251 1.377 49 2HD LYS 5 1HD LYS 5 -7.170 -6.115 2.785 50 1HE LYS 5 2HE LYS 5 -5.870 -8.126 2.113 51 2HE LYS 5 1HE LYS 5 -5.209 -7.220 0.738 52 1HZ LYS 5 1HZ LYS 5 -4.605 -6.979 3.560 53 2HZ LYS 5 2HZ LYS 5 -4.850 -5.497 2.765 54 3HZ LYS 5 3HZ LYS 5 -3.658 -6.575 2.211 55 H TRP 6 H TRP 6 -6.840 -2.970 0.880 56 HA TRP 6 HA TRP 6 -6.076 -1.708 -1.712 57 1HB TRP 6 2HB TRP 6 -6.547 -0.884 1.025 58 2HB TRP 6 1HB TRP 6 -4.975 -0.344 0.479 59 HD1 TRP 6 HD1 TRP 6 -8.664 -0.177 -0.534 60 HE1 TRP 6 1HE TRP 6 -9.008 1.938 -1.980 61 HE3 TRP 6 3HE TRP 6 -3.867 1.348 -0.894 62 HZ2 TRP 6 2HZ TRP 6 -7.399 4.023 -3.141 63 HZ3 TRP 6 3HZ TRP 6 -3.258 3.399 -2.169 64 HH2 TRP 6 HH2 TRP 6 -5.022 4.735 -3.291 65 HA PRO 7 HA PRO 7 -2.188 -3.802 -1.302 66 1HB PRO 7 2HB PRO 7 -1.029 -2.747 -3.538 67 2HB PRO 7 1HB PRO 7 -2.264 -4.019 -3.599 68 1HG PRO 7 2HG PRO 7 -2.490 -1.140 -4.203 69 2HG PRO 7 1HG PRO 7 -3.404 -2.508 -4.848 70 1HD PRO 7 2HD PRO 7 -4.269 -0.705 -2.879 71 2HD PRO 7 1HD PRO 7 -5.039 -2.245 -3.312 72 H TRP 8 H TRP 8 -0.284 -3.240 -0.268 73 HA TRP 8 HA TRP 8 1.164 -0.810 -0.607 74 1HB TRP 8 2HB TRP 8 -1.169 -0.256 0.615 75 2HB TRP 8 1HB TRP 8 -0.261 -0.773 2.021 76 HD1 TRP 8 HD1 TRP 8 1.288 1.228 -0.917 77 HE1 TRP 8 1HE TRP 8 2.127 3.469 0.041 78 HE3 TRP 8 3HE TRP 8 -0.524 0.858 3.799 79 HZ2 TRP 8 2HZ TRP 8 2.029 4.923 2.518 80 HZ3 TRP 8 3HZ TRP 8 -0.152 2.675 5.461 81 HH2 TRP 8 HH2 TRP 8 1.120 4.708 4.821 82 H TRP 9 H TRP 9 2.973 -2.208 -0.406 83 HA TRP 9 HA TRP 9 3.333 -3.464 2.280 84 1HB TRP 9 2HB TRP 9 3.198 -4.648 -0.163 85 2HB TRP 9 1HB TRP 9 4.932 -4.413 -0.021 86 HD1 TRP 9 HD1 TRP 9 3.589 -7.309 0.106 87 HE1 TRP 9 1HE TRP 9 3.896 -8.738 2.233 88 HE3 TRP 9 3HE TRP 9 4.759 -3.656 3.429 89 HZ2 TRP 9 2HZ TRP 9 4.557 -8.363 5.000 90 HZ3 TRP 9 3HZ TRP 9 5.227 -4.196 5.811 91 HH2 TRP 9 HH2 TRP 9 5.127 -6.548 6.597 92 HA PRO 10 HA PRO 10 6.589 -0.236 1.639 93 1HB PRO 10 2HB PRO 10 6.306 0.948 4.085 94 2HB PRO 10 1HB PRO 10 5.337 1.409 2.673 95 1HG PRO 10 2HG PRO 10 4.608 -0.299 4.992 96 2HG PRO 10 1HG PRO 10 3.621 0.856 4.084 97 1HD PRO 10 2HD PRO 10 3.506 -1.868 3.758 98 2HD PRO 10 1HD PRO 10 3.038 -0.691 2.513 99 H TRP 11 H TRP 11 8.696 -0.645 2.286 100 HA TRP 11 HA TRP 11 9.722 -2.856 3.400 101 1HB TRP 11 2HB TRP 11 11.224 -0.830 4.662 102 2HB TRP 11 1HB TRP 11 11.583 -1.651 3.161 103 HD1 TRP 11 HD1 TRP 11 9.355 1.278 4.323 104 HE1 TRP 11 1HE TRP 11 9.415 3.081 2.460 105 HE3 TRP 11 3HE TRP 11 12.201 -1.151 0.992 106 HZ2 TRP 11 2HZ TRP 11 10.571 3.399 -0.170 107 HZ3 TRP 11 3HZ TRP 11 12.800 -0.131 -1.214 108 HH2 TRP 11 HH2 TRP 11 11.980 2.142 -1.790 109 H ARG 12 H ARG 12 9.228 -0.083 5.540 110 HA ARG 12 HA ARG 12 9.409 -1.599 7.964 111 1HB ARG 12 2HB ARG 12 8.576 0.565 8.889 112 2HB ARG 12 1HB ARG 12 9.902 0.786 7.756 113 1HG ARG 12 2HG ARG 12 8.594 1.894 6.273 114 2HG ARG 12 1HG ARG 12 7.255 0.766 6.482 115 1HD ARG 12 2HD ARG 12 7.952 2.817 8.601 116 2HD ARG 12 1HD ARG 12 6.819 3.167 7.282 117 HE ARG 12 HE ARG 12 5.989 0.702 8.284 118 1HH1 ARG 12 2HH1 ARG 12 7.073 1.942 10.866 119 2HH1 ARG 12 1HH1 ARG 12 5.637 2.666 11.509 120 1HH2 ARG 12 1HH2 ARG 12 3.881 2.471 8.525 121 2HH2 ARG 12 2HH2 ARG 12 3.829 2.966 10.184 122 H ARG 13 H ARG 13 7.653 -2.129 9.427 123 HA ARG 13 HA ARG 13 5.128 -2.804 8.039 124 1HB ARG 13 2HB ARG 13 5.932 -4.604 9.282 125 2HB ARG 13 1HB ARG 13 6.610 -3.567 10.535 126 1HG ARG 13 2HG ARG 13 4.558 -3.289 11.604 127 2HG ARG 13 1HG ARG 13 3.635 -3.666 10.150 128 1HD ARG 13 2HD ARG 13 5.391 -5.840 11.188 129 2HD ARG 13 1HD ARG 13 3.943 -5.461 12.142 130 HE ARG 13 HE ARG 13 3.643 -5.798 9.200 131 1HH1 ARG 13 1HH1 ARG 13 3.708 -7.535 12.109 132 2HH1 ARG 13 2HH1 ARG 13 2.203 -8.352 11.841 133 1HH2 ARG 13 1HH2 ARG 13 1.428 -6.549 8.983 134 2HH2 ARG 13 2HH2 ARG 13 0.913 -7.794 10.072 135 1HN NH2 14 1HT ARG 13 3.615 -1.094 8.059 136 2HN NH2 14 2HT ARG 13 3.278 -0.114 9.403 Start of MODEL 4 1 1H ILE 1 1H ILE 1 -15.897 -13.206 4.547 2 2H ILE 1 2H ILE 1 -15.825 -12.369 6.024 3 3H ILE 1 3H ILE 1 -14.450 -12.464 5.028 4 HA ILE 1 HA ILE 1 -16.329 -11.358 3.381 5 HB ILE 1 HB ILE 1 -17.341 -9.604 4.781 6 1HG1 ILE 1 2HG1 ILE 1 -16.999 -10.400 7.394 7 2HG1 ILE 1 1HG1 ILE 1 -15.396 -10.683 6.713 8 1HG2 ILE 1 1HG2 ILE 1 -18.421 -11.892 4.524 9 2HG2 ILE 1 2HG2 ILE 1 -18.927 -10.982 5.950 10 3HG2 ILE 1 3HG2 ILE 1 -17.759 -12.295 6.109 11 1HD1 ILE 1 1HD1 ILE 1 -16.233 -8.206 5.666 12 2HD1 ILE 1 2HD1 ILE 1 -14.998 -8.476 6.895 13 3HD1 ILE 1 3HD1 ILE 1 -16.667 -8.170 7.375 14 H LEU 2 H LEU 2 -15.745 -8.910 3.096 15 HA LEU 2 HA LEU 2 -13.132 -8.106 4.198 16 1HB LEU 2 2HB LEU 2 -11.960 -8.238 2.103 17 2HB LEU 2 1HB LEU 2 -12.771 -9.791 2.309 18 HG LEU 2 HG LEU 2 -14.735 -8.528 1.021 19 1HD1 LEU 2 1HD1 LEU 2 -14.125 -6.507 0.229 20 2HD1 LEU 2 2HD1 LEU 2 -12.937 -7.320 -0.791 21 3HD1 LEU 2 3HD1 LEU 2 -12.474 -6.737 0.808 22 1HD2 LEU 2 1HD2 LEU 2 -13.314 -10.587 0.376 23 2HD2 LEU 2 2HD2 LEU 2 -12.334 -9.457 -0.562 24 3HD2 LEU 2 3HD2 LEU 2 -14.044 -9.669 -0.943 25 HA PRO 3 HA PRO 3 -15.191 -4.284 3.317 26 1HB PRO 3 2HB PRO 3 -13.167 -2.621 4.100 27 2HB PRO 3 1HB PRO 3 -14.222 -3.465 5.251 28 1HG PRO 3 2HG PRO 3 -11.446 -4.102 4.413 29 2HG PRO 3 1HG PRO 3 -12.226 -4.298 5.990 30 1HD PRO 3 2HD PRO 3 -11.784 -6.347 4.207 31 2HD PRO 3 1HD PRO 3 -13.031 -6.364 5.474 32 H TRP 4 H TRP 4 -11.698 -4.205 2.577 33 HA TRP 4 HA TRP 4 -12.001 -4.130 -0.263 34 1HB TRP 4 2HB TRP 4 -13.021 -1.912 0.871 35 2HB TRP 4 1HB TRP 4 -11.345 -1.402 0.717 36 HD1 TRP 4 HD1 TRP 4 -10.278 -1.957 -1.874 37 HE1 TRP 4 1HE TRP 4 -11.433 -1.507 -4.139 38 HE3 TRP 4 3HE TRP 4 -15.105 -1.618 -0.319 39 HZ2 TRP 4 2HZ TRP 4 -14.078 -1.067 -5.147 40 HZ3 TRP 4 3HZ TRP 4 -16.937 -1.182 -1.942 41 HH2 TRP 4 HH2 TRP 4 -16.425 -0.905 -4.354 42 H LYS 5 H LYS 5 -10.099 -5.426 -0.128 43 HA LYS 5 HA LYS 5 -7.733 -4.916 1.304 44 1HB LYS 5 2HB LYS 5 -6.714 -6.229 -0.638 45 2HB LYS 5 1HB LYS 5 -8.112 -6.981 0.133 46 1HG LYS 5 2HG LYS 5 -9.473 -6.640 -1.683 47 2HG LYS 5 1HG LYS 5 -8.681 -5.127 -2.122 48 1HD LYS 5 2HD LYS 5 -6.813 -7.309 -2.382 49 2HD LYS 5 1HD LYS 5 -8.280 -7.666 -3.296 50 1HE LYS 5 2HE LYS 5 -8.062 -5.223 -4.181 51 2HE LYS 5 1HE LYS 5 -6.382 -5.342 -3.622 52 1HZ LYS 5 1HZ LYS 5 -5.987 -7.192 -4.966 53 2HZ LYS 5 2HZ LYS 5 -6.880 -6.155 -5.972 54 3HZ LYS 5 3HZ LYS 5 -7.637 -7.484 -5.230 55 H TRP 6 H TRP 6 -5.729 -3.879 0.639 56 HA TRP 6 HA TRP 6 -5.939 -1.975 -1.649 57 1HB TRP 6 2HB TRP 6 -6.336 -1.277 1.001 58 2HB TRP 6 1HB TRP 6 -4.655 -0.877 0.735 59 HD1 TRP 6 HD1 TRP 6 -8.157 0.053 -0.381 60 HE1 TRP 6 1HE TRP 6 -8.029 2.247 -1.744 61 HE3 TRP 6 3HE TRP 6 -3.148 0.488 -0.744 62 HZ2 TRP 6 2HZ TRP 6 -6.000 3.968 -2.848 63 HZ3 TRP 6 3HZ TRP 6 -2.098 2.400 -1.950 64 HH2 TRP 6 HH2 TRP 6 -3.525 4.140 -3.002 65 HA PRO 7 HA PRO 7 -1.846 -3.531 -2.241 66 1HB PRO 7 2HB PRO 7 -1.084 -1.769 -4.194 67 2HB PRO 7 1HB PRO 7 -2.182 -3.130 -4.495 68 1HG PRO 7 2HG PRO 7 -2.802 -0.249 -4.103 69 2HG PRO 7 1HG PRO 7 -3.551 -1.428 -5.189 70 1HD PRO 7 2HD PRO 7 -4.659 -0.618 -2.823 71 2HD PRO 7 1HD PRO 7 -4.986 -2.192 -3.579 72 H TRP 8 H TRP 8 -0.215 -3.078 -0.808 73 HA TRP 8 HA TRP 8 1.213 -0.593 -0.763 74 1HB TRP 8 2HB TRP 8 -1.264 -0.514 0.525 75 2HB TRP 8 1HB TRP 8 -0.125 -0.784 1.831 76 HD1 TRP 8 HD1 TRP 8 0.739 1.345 -1.279 77 HE1 TRP 8 1HE TRP 8 1.171 3.754 -0.472 78 HE3 TRP 8 3HE TRP 8 -0.632 0.865 3.578 79 HZ2 TRP 8 2HZ TRP 8 0.952 5.285 1.950 80 HZ3 TRP 8 3HZ TRP 8 -0.521 2.801 5.137 81 HH2 TRP 8 HH2 TRP 8 0.266 5.012 4.322 82 H TRP 9 H TRP 9 3.062 -1.904 -0.628 83 HA TRP 9 HA TRP 9 3.314 -3.651 1.774 84 1HB TRP 9 2HB TRP 9 3.505 -4.669 -0.486 85 2HB TRP 9 1HB TRP 9 4.822 -3.567 -0.848 86 HD1 TRP 9 HD1 TRP 9 5.968 -6.139 -1.235 87 HE1 TRP 9 1HE TRP 9 7.427 -7.436 0.446 88 HE3 TRP 9 3HE TRP 9 4.595 -3.834 3.092 89 HZ2 TRP 9 2HZ TRP 9 7.944 -7.486 3.257 90 HZ3 TRP 9 3HZ TRP 9 5.579 -4.514 5.260 91 HH2 TRP 9 HH2 TRP 9 7.252 -6.341 5.348 92 HA PRO 10 HA PRO 10 6.026 0.058 2.422 93 1HB PRO 10 2HB PRO 10 5.342 0.407 5.055 94 2HB PRO 10 1HB PRO 10 4.437 1.130 3.712 95 1HG PRO 10 2HG PRO 10 3.822 -1.305 5.312 96 2HG PRO 10 1HG PRO 10 2.731 -0.051 4.700 97 1HD PRO 10 2HD PRO 10 3.007 -2.483 3.524 98 2HD PRO 10 1HD PRO 10 2.572 -1.016 2.625 99 H TRP 11 H TRP 11 7.488 -1.934 2.134 100 HA TRP 11 HA TRP 11 8.337 -3.822 3.899 101 1HB TRP 11 2HB TRP 11 9.347 -2.856 1.667 102 2HB TRP 11 1HB TRP 11 10.405 -1.995 2.761 103 HD1 TRP 11 HD1 TRP 11 11.684 -3.692 4.656 104 HE1 TRP 11 1HE TRP 11 12.686 -6.032 4.186 105 HE3 TRP 11 3HE TRP 11 9.246 -4.768 0.382 106 HZ2 TRP 11 2HZ TRP 11 12.451 -8.108 2.194 107 HZ3 TRP 11 3HZ TRP 11 9.619 -6.923 -0.822 108 HH2 TRP 11 HH2 TRP 11 11.221 -8.592 0.087 109 H ARG 12 H ARG 12 8.879 -0.370 4.277 110 HA ARG 12 HA ARG 12 10.284 -0.862 6.863 111 1HB ARG 12 2HB ARG 12 10.811 0.759 4.703 112 2HB ARG 12 1HB ARG 12 10.049 1.868 5.839 113 1HG ARG 12 2HG ARG 12 11.926 0.125 7.199 114 2HG ARG 12 1HG ARG 12 12.715 1.007 5.892 115 1HD ARG 12 2HD ARG 12 12.880 2.473 7.764 116 2HD ARG 12 1HD ARG 12 11.489 3.100 6.855 117 HE ARG 12 HE ARG 12 10.033 1.761 8.410 118 1HH1 ARG 12 2HH1 ARG 12 11.274 3.936 10.019 119 2HH1 ARG 12 1HH1 ARG 12 11.922 3.075 11.376 120 1HH2 ARG 12 1HH2 ARG 12 11.745 -0.023 9.828 121 2HH2 ARG 12 2HH2 ARG 12 12.188 0.833 11.267 122 H ARG 13 H ARG 13 9.251 -0.394 8.764 123 HA ARG 13 HA ARG 13 6.497 0.677 8.657 124 1HB ARG 13 2HB ARG 13 8.050 -1.161 10.208 125 2HB ARG 13 1HB ARG 13 7.444 0.090 11.290 126 1HG ARG 13 2HG ARG 13 5.171 -0.313 10.617 127 2HG ARG 13 1HG ARG 13 5.689 -1.355 9.293 128 1HD ARG 13 2HD ARG 13 5.052 -2.899 10.974 129 2HD ARG 13 1HD ARG 13 6.808 -2.780 11.199 130 HE ARG 13 HE ARG 13 5.051 -0.922 12.721 131 1HH1 ARG 13 1HH1 ARG 13 6.124 -4.067 13.009 132 2HH1 ARG 13 2HH1 ARG 13 6.974 -3.838 14.499 133 1HH2 ARG 13 1HH2 ARG 13 6.645 -0.387 14.463 134 2HH2 ARG 13 2HH2 ARG 13 7.270 -1.754 15.324 135 1HN NH2 14 1HT ARG 13 6.370 2.951 8.741 136 2HN NH2 14 2HT ARG 13 7.320 3.940 9.741 Start of MODEL 5 1 1H ILE 1 1H ILE 1 -13.107 -0.188 -0.363 2 2H ILE 1 2H ILE 1 -13.871 0.953 -1.360 3 3H ILE 1 3H ILE 1 -14.211 0.913 0.304 4 HA ILE 1 HA ILE 1 -11.585 1.614 -0.891 5 HB ILE 1 HB ILE 1 -13.772 3.228 0.438 6 1HG1 ILE 1 2HG1 ILE 1 -12.807 3.102 -2.439 7 2HG1 ILE 1 1HG1 ILE 1 -14.396 2.628 -1.839 8 1HG2 ILE 1 1HG2 ILE 1 -10.962 3.729 0.102 9 2HG2 ILE 1 2HG2 ILE 1 -12.182 4.774 0.831 10 3HG2 ILE 1 3HG2 ILE 1 -11.866 4.860 -0.904 11 1HD1 ILE 1 1HD1 ILE 1 -15.145 4.768 -1.762 12 2HD1 ILE 1 2HD1 ILE 1 -13.807 5.103 -2.860 13 3HD1 ILE 1 3HD1 ILE 1 -13.617 5.381 -1.129 14 H LEU 2 H LEU 2 -12.809 -0.106 1.449 15 HA LEU 2 HA LEU 2 -11.889 1.075 3.900 16 1HB LEU 2 2HB LEU 2 -12.370 -1.095 4.810 17 2HB LEU 2 1HB LEU 2 -13.546 -0.825 3.528 18 HG LEU 2 HG LEU 2 -10.962 -2.218 2.879 19 1HD1 LEU 2 1HD1 LEU 2 -12.641 -4.305 3.297 20 2HD1 LEU 2 2HD1 LEU 2 -13.158 -3.224 4.593 21 3HD1 LEU 2 3HD1 LEU 2 -11.475 -3.744 4.497 22 1HD2 LEU 2 1HD2 LEU 2 -13.629 -1.787 1.694 23 2HD2 LEU 2 2HD2 LEU 2 -13.033 -3.442 1.557 24 3HD2 LEU 2 3HD2 LEU 2 -12.086 -2.106 0.902 25 HA PRO 3 HA PRO 3 -7.561 0.392 3.491 26 1HB PRO 3 2HB PRO 3 -6.869 0.509 6.135 27 2HB PRO 3 1HB PRO 3 -7.313 1.945 5.189 28 1HG PRO 3 2HG PRO 3 -8.925 0.393 7.145 29 2HG PRO 3 1HG PRO 3 -8.891 2.136 6.837 30 1HD PRO 3 2HD PRO 3 -10.848 0.443 5.921 31 2HD PRO 3 1HD PRO 3 -10.432 1.998 5.166 32 H TRP 4 H TRP 4 -7.779 -1.885 2.788 33 HA TRP 4 HA TRP 4 -6.633 -3.764 4.683 34 1HB TRP 4 2HB TRP 4 -9.297 -3.395 4.939 35 2HB TRP 4 1HB TRP 4 -9.281 -4.670 3.727 36 HD1 TRP 4 HD1 TRP 4 -7.521 -6.811 4.437 37 HE1 TRP 4 1HE TRP 4 -7.361 -7.953 6.747 38 HE3 TRP 4 3HE TRP 4 -9.617 -3.195 7.326 39 HZ2 TRP 4 2HZ TRP 4 -8.042 -7.388 9.475 40 HZ3 TRP 4 3HZ TRP 4 -9.858 -3.505 9.779 41 HH2 TRP 4 HH2 TRP 4 -9.072 -5.599 10.856 42 H LYS 5 H LYS 5 -8.715 -3.822 1.850 43 HA LYS 5 HA LYS 5 -6.985 -5.846 0.553 44 1HB LYS 5 2HB LYS 5 -9.730 -4.708 0.229 45 2HB LYS 5 1HB LYS 5 -8.969 -5.408 -1.199 46 1HG LYS 5 2HG LYS 5 -9.296 -7.503 -0.438 47 2HG LYS 5 1HG LYS 5 -8.580 -7.105 1.124 48 1HD LYS 5 2HD LYS 5 -10.814 -7.681 1.651 49 2HD LYS 5 1HD LYS 5 -10.818 -5.919 1.635 50 1HE LYS 5 2HE LYS 5 -12.742 -6.596 0.357 51 2HE LYS 5 1HE LYS 5 -11.526 -6.098 -0.836 52 1HZ LYS 5 1HZ LYS 5 -11.154 -8.807 -0.032 53 2HZ LYS 5 2HZ LYS 5 -11.357 -8.170 -1.594 54 3HZ LYS 5 3HZ LYS 5 -12.714 -8.576 -0.655 55 H TRP 6 H TRP 6 -5.934 -3.103 0.888 56 HA TRP 6 HA TRP 6 -5.917 -2.132 -1.943 57 1HB TRP 6 2HB TRP 6 -6.067 -0.923 0.663 58 2HB TRP 6 1HB TRP 6 -4.643 -0.336 -0.169 59 HD1 TRP 6 HD1 TRP 6 -8.430 -0.626 -0.636 60 HE1 TRP 6 1HE TRP 6 -9.172 1.180 -2.333 61 HE3 TRP 6 3HE TRP 6 -3.899 1.160 -1.960 62 HZ2 TRP 6 2HZ TRP 6 -7.948 3.143 -4.046 63 HZ3 TRP 6 3HZ TRP 6 -3.670 2.998 -3.627 64 HH2 TRP 6 HH2 TRP 6 -5.694 3.990 -4.667 65 HA PRO 7 HA PRO 7 -1.755 -3.508 -2.297 66 1HB PRO 7 2HB PRO 7 -0.986 -1.933 -4.395 67 2HB PRO 7 1HB PRO 7 -2.065 -3.330 -4.581 68 1HG PRO 7 2HG PRO 7 -2.715 -0.434 -4.501 69 2HG PRO 7 1HG PRO 7 -3.451 -1.734 -5.449 70 1HD PRO 7 2HD PRO 7 -4.552 -0.661 -3.172 71 2HD PRO 7 1HD PRO 7 -4.910 -2.287 -3.789 72 H TRP 8 H TRP 8 -0.584 -2.777 -0.495 73 HA TRP 8 HA TRP 8 1.073 -0.413 -0.836 74 1HB TRP 8 2HB TRP 8 -1.221 0.445 -0.119 75 2HB TRP 8 1HB TRP 8 -0.961 -0.398 1.397 76 HD1 TRP 8 HD1 TRP 8 1.827 1.518 -0.476 77 HE1 TRP 8 1HE TRP 8 2.619 3.426 1.068 78 HE3 TRP 8 3HE TRP 8 -1.577 1.052 3.227 79 HZ2 TRP 8 2HZ TRP 8 1.880 4.603 3.586 80 HZ3 TRP 8 3HZ TRP 8 -1.537 2.559 5.209 81 HH2 TRP 8 HH2 TRP 8 0.187 4.338 5.388 82 H TRP 9 H TRP 9 2.601 -2.239 -0.459 83 HA TRP 9 HA TRP 9 2.670 -3.243 2.341 84 1HB TRP 9 2HB TRP 9 3.088 -4.349 -0.226 85 2HB TRP 9 1HB TRP 9 4.657 -4.304 0.555 86 HD1 TRP 9 HD1 TRP 9 4.899 -6.821 1.209 87 HE1 TRP 9 1HE TRP 9 3.585 -8.364 2.810 88 HE3 TRP 9 3HE TRP 9 0.918 -3.848 2.145 89 HZ2 TRP 9 2HZ TRP 9 1.128 -8.318 4.305 90 HZ3 TRP 9 3HZ TRP 9 -0.918 -4.589 3.661 91 HH2 TRP 9 HH2 TRP 9 -0.810 -6.824 4.739 92 HA PRO 10 HA PRO 10 5.882 -0.005 2.501 93 1HB PRO 10 2HB PRO 10 5.701 0.350 5.212 94 2HB PRO 10 1HB PRO 10 4.623 1.158 4.056 95 1HG PRO 10 2HG PRO 10 4.135 -1.259 5.726 96 2HG PRO 10 1HG PRO 10 3.045 0.081 5.335 97 1HD PRO 10 2HD PRO 10 2.920 -2.338 4.105 98 2HD PRO 10 1HD PRO 10 2.446 -0.816 3.314 99 H TRP 11 H TRP 11 7.453 -1.671 1.991 100 HA TRP 11 HA TRP 11 8.443 -3.843 3.153 101 1HB TRP 11 2HB TRP 11 10.749 -2.212 3.016 102 2HB TRP 11 1HB TRP 11 10.160 -3.345 1.823 103 HD1 TRP 11 HD1 TRP 11 9.407 0.283 2.887 104 HE1 TRP 11 1HE TRP 11 8.909 1.636 0.728 105 HE3 TRP 11 3HE TRP 11 9.736 -3.440 -0.446 106 HZ2 TRP 11 2HZ TRP 11 8.682 1.122 -2.109 107 HZ3 TRP 11 3HZ TRP 11 9.381 -3.052 -2.891 108 HH2 TRP 11 HH2 TRP 11 8.850 -0.769 -3.718 109 H ARG 12 H ARG 12 9.545 -0.741 4.427 110 HA ARG 12 HA ARG 12 10.926 -1.453 6.686 111 1HB ARG 12 2HB ARG 12 9.608 0.825 5.712 112 2HB ARG 12 1HB ARG 12 9.002 0.606 7.347 113 1HG ARG 12 2HG ARG 12 11.897 0.821 6.491 114 2HG ARG 12 1HG ARG 12 10.993 1.966 7.483 115 1HD ARG 12 2HD ARG 12 11.755 -0.877 8.245 116 2HD ARG 12 1HD ARG 12 12.343 0.622 8.986 117 HE ARG 12 HE ARG 12 9.741 -0.604 9.470 118 1HH1 ARG 12 1HH2 ARG 12 11.566 2.327 9.309 119 2HH1 ARG 12 2HH2 ARG 12 10.528 3.183 10.397 120 1HH2 ARG 12 2HH1 ARG 12 8.379 0.509 10.885 121 2HH2 ARG 12 1HH1 ARG 12 8.725 2.158 11.288 122 H ARG 13 H ARG 13 10.484 -2.751 8.416 123 HA ARG 13 HA ARG 13 7.721 -3.629 8.929 124 1HB ARG 13 2HB ARG 13 9.273 -5.368 9.044 125 2HB ARG 13 1HB ARG 13 10.518 -4.343 9.756 126 1HG ARG 13 2HG ARG 13 9.813 -4.747 11.871 127 2HG ARG 13 1HG ARG 13 8.111 -4.633 11.423 128 1HD ARG 13 2HD ARG 13 8.343 -6.914 11.996 129 2HD ARG 13 1HD ARG 13 8.551 -6.943 10.233 130 HE ARG 13 HE ARG 13 11.001 -6.959 10.603 131 1HH1 ARG 13 1HH1 ARG 13 9.764 -9.348 12.074 132 2HH1 ARG 13 2HH1 ARG 13 10.624 -9.284 13.576 133 1HH2 ARG 13 1HH2 ARG 13 11.768 -6.047 13.085 134 2HH2 ARG 13 2HH2 ARG 13 11.760 -7.414 14.149 135 1HN NH2 14 1HT ARG 13 6.533 -2.035 10.093 136 2HN NH2 14 2HT ARG 13 7.071 -1.303 11.527 Start of MODEL 6 1 1H ILE 1 1H ILE 1 -12.068 5.747 2.660 2 2H ILE 1 2H ILE 1 -13.056 5.123 3.892 3 3H ILE 1 3H ILE 1 -13.729 5.535 2.387 4 HA ILE 1 HA ILE 1 -13.511 3.369 1.880 5 HB ILE 1 HB ILE 1 -10.593 4.199 1.893 6 1HG1 ILE 1 2HG1 ILE 1 -12.549 4.518 -0.390 7 2HG1 ILE 1 1HG1 ILE 1 -12.306 5.797 0.799 8 1HG2 ILE 1 1HG2 ILE 1 -12.177 2.163 0.305 9 2HG2 ILE 1 2HG2 ILE 1 -10.831 1.853 1.400 10 3HG2 ILE 1 3HG2 ILE 1 -10.548 2.683 -0.130 11 1HD1 ILE 1 1HD1 ILE 1 -10.851 6.073 -1.210 12 2HD1 ILE 1 2HD1 ILE 1 -10.090 4.527 -0.833 13 3HD1 ILE 1 3HD1 ILE 1 -9.923 5.885 0.278 14 H LEU 2 H LEU 2 -12.410 1.221 2.428 15 HA LEU 2 HA LEU 2 -11.775 1.147 5.355 16 1HB LEU 2 2HB LEU 2 -13.385 -0.450 3.457 17 2HB LEU 2 1HB LEU 2 -12.451 -1.400 4.611 18 HG LEU 2 HG LEU 2 -14.290 0.889 5.366 19 1HD1 LEU 2 1HD1 LEU 2 -14.946 -1.742 4.568 20 2HD1 LEU 2 2HD1 LEU 2 -16.004 -0.573 5.358 21 3HD1 LEU 2 3HD1 LEU 2 -15.079 -1.720 6.327 22 1HD2 LEU 2 1HD2 LEU 2 -12.341 -0.810 6.796 23 2HD2 LEU 2 2HD2 LEU 2 -13.916 -0.688 7.579 24 3HD2 LEU 2 3HD2 LEU 2 -12.987 0.770 7.233 25 HA PRO 3 HA PRO 3 -7.749 -0.213 4.044 26 1HB PRO 3 2HB PRO 3 -6.819 -0.894 6.526 27 2HB PRO 3 1HB PRO 3 -6.941 0.789 5.970 28 1HG PRO 3 2HG PRO 3 -8.746 -0.751 7.764 29 2HG PRO 3 1HG PRO 3 -8.250 0.946 7.846 30 1HD PRO 3 2HD PRO 3 -10.673 0.125 6.892 31 2HD PRO 3 1HD PRO 3 -9.872 1.628 6.387 32 H TRP 4 H TRP 4 -8.681 -2.138 2.946 33 HA TRP 4 HA TRP 4 -8.141 -4.628 4.464 34 1HB TRP 4 2HB TRP 4 -10.692 -3.525 3.923 35 2HB TRP 4 1HB TRP 4 -10.512 -4.936 2.894 36 HD1 TRP 4 HD1 TRP 4 -9.765 -7.271 4.207 37 HE1 TRP 4 1HE TRP 4 -10.447 -8.067 6.566 38 HE3 TRP 4 3HE TRP 4 -11.315 -2.861 6.173 39 HZ2 TRP 4 2HZ TRP 4 -11.519 -6.951 8.987 40 HZ3 TRP 4 3HZ TRP 4 -12.165 -2.728 8.506 41 HH2 TRP 4 HH2 TRP 4 -12.269 -4.770 9.913 42 H LYS 5 H LYS 5 -9.621 -3.808 1.388 43 HA LYS 5 HA LYS 5 -7.807 -5.695 -0.008 44 1HB LYS 5 2HB LYS 5 -10.380 -4.242 -0.605 45 2HB LYS 5 1HB LYS 5 -9.462 -4.998 -1.907 46 1HG LYS 5 2HG LYS 5 -10.180 -6.514 0.603 47 2HG LYS 5 1HG LYS 5 -11.276 -6.435 -0.776 48 1HD LYS 5 2HD LYS 5 -9.668 -7.471 -2.224 49 2HD LYS 5 1HD LYS 5 -8.392 -7.314 -1.018 50 1HE LYS 5 2HE LYS 5 -10.863 -8.834 -0.255 51 2HE LYS 5 1HE LYS 5 -9.672 -9.626 -1.308 52 1HZ LYS 5 1HZ LYS 5 -8.607 -10.029 0.617 53 2HZ LYS 5 2HZ LYS 5 -9.422 -8.798 1.461 54 3HZ LYS 5 3HZ LYS 5 -8.089 -8.419 0.479 55 H TRP 6 H TRP 6 -6.280 -3.579 0.790 56 HA TRP 6 HA TRP 6 -6.043 -1.880 -1.664 57 1HB TRP 6 2HB TRP 6 -6.742 -0.630 0.297 58 2HB TRP 6 1HB TRP 6 -5.390 -1.274 1.209 59 HD1 TRP 6 HD1 TRP 6 -2.933 -0.813 -0.085 60 HE1 TRP 6 1HE TRP 6 -2.105 1.426 -1.083 61 HE3 TRP 6 3HE TRP 6 -7.382 1.503 -0.683 62 HZ2 TRP 6 2HZ TRP 6 -3.238 3.896 -2.023 63 HZ3 TRP 6 3HZ TRP 6 -7.519 3.797 -1.634 64 HH2 TRP 6 HH2 TRP 6 -5.450 4.993 -2.307 65 HA PRO 7 HA PRO 7 -2.007 -3.618 -1.894 66 1HB PRO 7 2HB PRO 7 -1.153 -2.158 -4.041 67 2HB PRO 7 1HB PRO 7 -2.330 -3.477 -4.175 68 1HG PRO 7 2HG PRO 7 -2.737 -0.594 -4.419 69 2HG PRO 7 1HG PRO 7 -3.761 -1.928 -4.964 70 1HD PRO 7 2HD PRO 7 -4.065 -0.287 -2.624 71 2HD PRO 7 1HD PRO 7 -5.128 -1.586 -3.205 72 H TRP 8 H TRP 8 -0.211 -3.118 -0.692 73 HA TRP 8 HA TRP 8 1.273 -0.691 -0.906 74 1HB TRP 8 2HB TRP 8 -1.028 -0.141 0.312 75 2HB TRP 8 1HB TRP 8 -0.197 -0.814 1.702 76 HD1 TRP 8 HD1 TRP 8 1.678 1.292 -0.942 77 HE1 TRP 8 1HE TRP 8 2.504 3.437 0.218 78 HE3 TRP 8 3HE TRP 8 -0.643 0.782 3.537 79 HZ2 TRP 8 2HZ TRP 8 2.210 4.773 2.741 80 HZ3 TRP 8 3HZ TRP 8 -0.372 2.498 5.321 81 HH2 TRP 8 HH2 TRP 8 1.051 4.493 4.923 82 H TRP 9 H TRP 9 3.113 -2.016 -0.755 83 HA TRP 9 HA TRP 9 3.423 -3.665 1.708 84 1HB TRP 9 2HB TRP 9 3.558 -4.757 -0.514 85 2HB TRP 9 1HB TRP 9 4.861 -3.666 -0.951 86 HD1 TRP 9 HD1 TRP 9 6.010 -6.237 -1.291 87 HE1 TRP 9 1HE TRP 9 7.524 -7.474 0.385 88 HE3 TRP 9 3HE TRP 9 4.742 -3.813 3.004 89 HZ2 TRP 9 2HZ TRP 9 8.119 -7.439 3.182 90 HZ3 TRP 9 3HZ TRP 9 5.790 -4.423 5.163 91 HH2 TRP 9 HH2 TRP 9 7.481 -6.235 5.256 92 HA PRO 10 HA PRO 10 6.202 0.013 2.208 93 1HB PRO 10 2HB PRO 10 5.546 0.479 4.826 94 2HB PRO 10 1HB PRO 10 4.640 1.164 3.461 95 1HG PRO 10 2HG PRO 10 3.996 -1.184 5.173 96 2HG PRO 10 1HG PRO 10 2.922 0.054 4.502 97 1HD PRO 10 2HD PRO 10 3.176 -2.446 3.452 98 2HD PRO 10 1HD PRO 10 2.720 -1.024 2.493 99 H TRP 11 H TRP 11 8.302 -0.554 2.668 100 HA TRP 11 HA TRP 11 9.388 -2.853 3.539 101 1HB TRP 11 2HB TRP 11 10.906 -0.945 4.941 102 2HB TRP 11 1HB TRP 11 11.212 -1.588 3.343 103 HD1 TRP 11 HD1 TRP 11 8.982 1.161 4.890 104 HE1 TRP 11 1HE TRP 11 8.971 3.160 3.240 105 HE3 TRP 11 3HE TRP 11 11.774 -0.837 1.239 106 HZ2 TRP 11 2HZ TRP 11 10.054 3.787 0.633 107 HZ3 TRP 11 3HZ TRP 11 12.301 0.430 -0.851 108 HH2 TRP 11 HH2 TRP 11 11.436 2.741 -1.152 109 H ARG 12 H ARG 12 8.984 -0.305 5.941 110 HA ARG 12 HA ARG 12 9.408 -1.601 8.307 111 1HB ARG 12 2HB ARG 12 8.141 0.732 7.463 112 2HB ARG 12 1HB ARG 12 6.920 -0.105 8.416 113 1HG ARG 12 2HG ARG 12 9.493 -0.289 9.714 114 2HG ARG 12 1HG ARG 12 9.084 1.399 9.399 115 1HD ARG 12 2HD ARG 12 8.066 0.969 11.499 116 2HD ARG 12 1HD ARG 12 6.729 0.747 10.352 117 HE ARG 12 HE ARG 12 7.247 -1.716 10.422 118 1HH1 ARG 12 1HH2 ARG 12 9.589 -0.313 12.304 119 2HH1 ARG 12 2HH2 ARG 12 9.285 -1.250 13.729 120 1HH2 ARG 12 2HH1 ARG 12 6.352 -2.641 12.508 121 2HH2 ARG 12 1HH1 ARG 12 7.451 -2.567 13.844 122 H ARG 13 H ARG 13 8.444 -3.201 9.525 123 HA ARG 13 HA ARG 13 6.106 -4.598 8.326 124 1HB ARG 13 2HB ARG 13 8.557 -5.329 9.547 125 2HB ARG 13 1HB ARG 13 7.280 -5.853 10.644 126 1HG ARG 13 2HG ARG 13 6.509 -6.440 7.932 127 2HG ARG 13 1HG ARG 13 8.111 -7.109 8.246 128 1HD ARG 13 2HD ARG 13 6.425 -7.579 10.541 129 2HD ARG 13 1HD ARG 13 5.630 -8.194 9.078 130 HE ARG 13 HE ARG 13 8.320 -9.025 10.047 131 1HH1 ARG 13 1HH2 ARG 13 8.289 -8.979 7.084 132 2HH1 ARG 13 2HH2 ARG 13 7.696 -10.556 6.684 133 1HH2 ARG 13 1HH1 ARG 13 6.438 -11.178 9.855 134 2HH2 ARG 13 2HH1 ARG 13 6.648 -11.803 8.253 135 1HN NH2 14 1HT ARG 13 4.801 -2.576 9.283 136 2HN NH2 14 2HT ARG 13 4.236 -2.758 10.875 Start of MODEL 7 1 1H ILE 1 1H ILE 1 -10.065 -4.006 -6.191 2 2H ILE 1 2H ILE 1 -11.154 -4.468 -4.971 3 3H ILE 1 3H ILE 1 -10.048 -3.207 -4.696 4 HA ILE 1 HA ILE 1 -11.152 -1.822 -6.316 5 HB ILE 1 HB ILE 1 -12.761 -4.358 -6.625 6 1HG1 ILE 1 2HG1 ILE 1 -10.986 -2.760 -8.497 7 2HG1 ILE 1 1HG1 ILE 1 -10.698 -4.395 -7.900 8 1HG2 ILE 1 1HG2 ILE 1 -13.948 -2.957 -8.434 9 2HG2 ILE 1 2HG2 ILE 1 -13.264 -1.550 -7.622 10 3HG2 ILE 1 3HG2 ILE 1 -14.371 -2.617 -6.758 11 1HD1 ILE 1 1HD1 ILE 1 -12.573 -3.455 -10.016 12 2HD1 ILE 1 2HD1 ILE 1 -13.113 -4.790 -8.998 13 3HD1 ILE 1 3HD1 ILE 1 -11.624 -4.940 -9.932 14 H LEU 2 H LEU 2 -11.456 -3.111 -3.472 15 HA LEU 2 HA LEU 2 -13.872 -1.507 -2.742 16 1HB LEU 2 2HB LEU 2 -14.593 -3.363 -1.304 17 2HB LEU 2 1HB LEU 2 -14.397 -3.937 -2.963 18 HG LEU 2 HG LEU 2 -11.912 -4.111 -1.439 19 1HD1 LEU 2 1HD1 LEU 2 -14.259 -5.795 -0.517 20 2HD1 LEU 2 2HD1 LEU 2 -13.559 -4.468 0.409 21 3HD1 LEU 2 3HD1 LEU 2 -12.598 -5.905 0.063 22 1HD2 LEU 2 1HD2 LEU 2 -11.672 -5.683 -3.034 23 2HD2 LEU 2 2HD2 LEU 2 -13.354 -5.463 -3.518 24 3HD2 LEU 2 3HD2 LEU 2 -12.943 -6.639 -2.269 25 HA PRO 3 HA PRO 3 -11.370 -0.025 0.545 26 1HB PRO 3 2HB PRO 3 -13.217 0.329 2.533 27 2HB PRO 3 1HB PRO 3 -13.121 1.380 1.105 28 1HG PRO 3 2HG PRO 3 -14.996 -0.854 1.687 29 2HG PRO 3 1HG PRO 3 -15.295 0.691 0.876 30 1HD PRO 3 2HD PRO 3 -14.978 -1.684 -0.443 31 2HD PRO 3 1HD PRO 3 -14.614 -0.096 -1.157 32 H TRP 4 H TRP 4 -10.269 -2.180 0.769 33 HA TRP 4 HA TRP 4 -10.336 -3.166 3.455 34 1HB TRP 4 2HB TRP 4 -12.510 -4.006 2.316 35 2HB TRP 4 1HB TRP 4 -11.449 -5.123 1.466 36 HD1 TRP 4 HD1 TRP 4 -9.626 -6.399 3.332 37 HE1 TRP 4 1HE TRP 4 -10.323 -7.582 5.517 38 HE3 TRP 4 3HE TRP 4 -14.168 -4.231 4.073 39 HZ2 TRP 4 2HZ TRP 4 -12.534 -7.599 7.343 40 HZ3 TRP 4 3HZ TRP 4 -15.559 -4.840 6.038 41 HH2 TRP 4 HH2 TRP 4 -14.747 -6.520 7.672 42 H LYS 5 H LYS 5 -9.771 -4.211 0.153 43 HA LYS 5 HA LYS 5 -7.184 -5.452 0.982 44 1HB LYS 5 2HB LYS 5 -9.179 -5.809 -1.228 45 2HB LYS 5 1HB LYS 5 -7.508 -6.298 -1.514 46 1HG LYS 5 2HG LYS 5 -9.152 -7.202 0.864 47 2HG LYS 5 1HG LYS 5 -8.947 -8.148 -0.611 48 1HD LYS 5 2HD LYS 5 -6.393 -7.790 -0.192 49 2HD LYS 5 1HD LYS 5 -6.890 -7.414 1.458 50 1HE LYS 5 2HE LYS 5 -7.791 -9.940 0.046 51 2HE LYS 5 1HE LYS 5 -6.316 -9.869 1.031 52 1HZ LYS 5 1HZ LYS 5 -8.880 -8.813 2.047 53 2HZ LYS 5 2HZ LYS 5 -7.507 -9.291 2.924 54 3HZ LYS 5 3HZ LYS 5 -8.504 -10.461 2.202 55 H TRP 6 H TRP 6 -6.622 -2.922 1.078 56 HA TRP 6 HA TRP 6 -6.120 -1.652 -1.504 57 1HB TRP 6 2HB TRP 6 -6.693 -0.350 0.439 58 2HB TRP 6 1HB TRP 6 -5.349 -1.030 1.336 59 HD1 TRP 6 HD1 TRP 6 -2.903 -0.646 -0.028 60 HE1 TRP 6 1HE TRP 6 -2.025 1.581 -1.008 61 HE3 TRP 6 3HE TRP 6 -7.284 1.827 -0.473 62 HZ2 TRP 6 2HZ TRP 6 -3.097 4.104 -1.876 63 HZ3 TRP 6 3HZ TRP 6 -7.367 4.141 -1.379 64 HH2 TRP 6 HH2 TRP 6 -5.276 5.279 -2.081 65 HA PRO 7 HA PRO 7 -2.108 -3.345 -2.042 66 1HB PRO 7 2HB PRO 7 -1.308 -1.715 -4.084 67 2HB PRO 7 1HB PRO 7 -2.503 -3.008 -4.291 68 1HG PRO 7 2HG PRO 7 -2.885 -0.100 -4.223 69 2HG PRO 7 1HG PRO 7 -3.907 -1.358 -4.927 70 1HD PRO 7 2HD PRO 7 -4.275 0.007 -2.455 71 2HD PRO 7 1HD PRO 7 -5.258 -1.312 -3.119 72 H TRP 8 H TRP 8 -0.309 -2.953 -0.793 73 HA TRP 8 HA TRP 8 1.233 -0.556 -0.858 74 1HB TRP 8 2HB TRP 8 -1.176 -0.416 0.658 75 2HB TRP 8 1HB TRP 8 0.149 -0.478 1.805 76 HD1 TRP 8 HD1 TRP 8 0.419 1.234 -1.646 77 HE1 TRP 8 1HE TRP 8 0.868 3.742 -1.228 78 HE3 TRP 8 3HE TRP 8 -0.119 1.357 3.387 79 HZ2 TRP 8 2HZ TRP 8 0.977 5.570 0.990 80 HZ3 TRP 8 3HZ TRP 8 0.158 3.477 4.657 81 HH2 TRP 8 HH2 TRP 8 0.702 5.584 3.460 82 H TRP 9 H TRP 9 3.055 -1.882 -0.701 83 HA TRP 9 HA TRP 9 3.272 -3.594 1.729 84 1HB TRP 9 2HB TRP 9 3.335 -4.590 -0.599 85 2HB TRP 9 1HB TRP 9 4.839 -3.718 -0.851 86 HD1 TRP 9 HD1 TRP 9 5.377 -6.565 -1.160 87 HE1 TRP 9 1HE TRP 9 6.534 -8.045 0.602 88 HE3 TRP 9 3HE TRP 9 4.536 -3.785 3.031 89 HZ2 TRP 9 2HZ TRP 9 7.039 -8.051 3.413 90 HZ3 TRP 9 3HZ TRP 9 5.363 -4.544 5.238 91 HH2 TRP 9 HH2 TRP 9 6.614 -6.676 5.435 92 HA PRO 10 HA PRO 10 6.284 -0.072 2.112 93 1HB PRO 10 2HB PRO 10 5.574 0.638 4.657 94 2HB PRO 10 1HB PRO 10 4.768 1.285 3.215 95 1HG PRO 10 2HG PRO 10 3.879 -0.848 5.081 96 2HG PRO 10 1HG PRO 10 2.931 0.392 4.247 97 1HD PRO 10 2HD PRO 10 3.076 -2.229 3.453 98 2HD PRO 10 1HD PRO 10 2.694 -0.877 2.368 99 H TRP 11 H TRP 11 7.336 -2.456 2.165 100 HA TRP 11 HA TRP 11 7.941 -4.043 4.243 101 1HB TRP 11 2HB TRP 11 10.502 -3.354 3.281 102 2HB TRP 11 1HB TRP 11 9.502 -4.703 2.798 103 HD1 TRP 11 HD1 TRP 11 9.765 -0.945 1.975 104 HE1 TRP 11 1HE TRP 11 9.294 -0.674 -0.561 105 HE3 TRP 11 3HE TRP 11 8.747 -5.720 0.869 106 HZ2 TRP 11 2HZ TRP 11 8.552 -2.362 -2.789 107 HZ3 TRP 11 3HZ TRP 11 8.146 -6.435 -1.451 108 HH2 TRP 11 HH2 TRP 11 8.046 -4.750 -3.278 109 H ARG 12 H ARG 12 9.960 -1.165 3.804 110 HA ARG 12 HA ARG 12 11.082 -1.247 6.427 111 1HB ARG 12 2HB ARG 12 12.209 0.631 5.674 112 2HB ARG 12 1HB ARG 12 11.709 -0.060 4.145 113 1HG ARG 12 2HG ARG 12 10.009 1.995 5.570 114 2HG ARG 12 1HG ARG 12 11.320 2.466 4.496 115 1HD ARG 12 2HD ARG 12 9.691 2.340 2.885 116 2HD ARG 12 1HD ARG 12 10.042 0.602 2.954 117 HE ARG 12 HE ARG 12 8.236 0.484 4.738 118 1HH1 ARG 12 1HH2 ARG 12 7.573 1.548 1.769 119 2HH1 ARG 12 2HH2 ARG 12 6.254 2.595 2.174 120 1HH2 ARG 12 2HH1 ARG 12 6.876 2.490 5.583 121 2HH2 ARG 12 1HH1 ARG 12 5.858 3.128 4.336 122 H ARG 13 H ARG 13 10.757 0.603 8.050 123 HA ARG 13 HA ARG 13 7.829 1.067 8.397 124 1HB ARG 13 2HB ARG 13 8.662 -0.090 10.249 125 2HB ARG 13 1HB ARG 13 10.234 0.705 10.163 126 1HG ARG 13 2HG ARG 13 9.532 2.529 11.353 127 2HG ARG 13 1HG ARG 13 7.893 2.454 10.704 128 1HD ARG 13 2HD ARG 13 8.918 0.350 12.625 129 2HD ARG 13 1HD ARG 13 8.152 1.846 13.196 130 HE ARG 13 HE ARG 13 6.425 0.929 11.232 131 1HH1 ARG 13 1HH2 ARG 13 7.497 0.101 14.371 132 2HH1 ARG 13 2HH2 ARG 13 6.340 -1.168 14.591 133 1HH2 ARG 13 1HH1 ARG 13 5.067 -0.924 11.374 134 2HH2 ARG 13 2HH1 ARG 13 4.962 -1.749 12.894 135 1HN NH2 14 1HT ARG 13 10.972 2.733 8.183 136 2HN NH2 14 2HT ARG 13 10.344 4.310 8.223 Start of MODEL 8 1 1H ILE 1 1H ILE 1 -13.857 -8.882 7.212 2 2H ILE 1 2H ILE 1 -14.038 -7.198 7.343 3 3H ILE 1 3H ILE 1 -13.166 -8.056 8.522 4 HA ILE 1 HA ILE 1 -11.875 -6.759 6.700 5 HB ILE 1 HB ILE 1 -10.187 -8.672 6.865 6 1HG1 ILE 1 2HG1 ILE 1 -11.888 -10.063 8.819 7 2HG1 ILE 1 1HG1 ILE 1 -12.470 -10.201 7.159 8 1HG2 ILE 1 1HG2 ILE 1 -11.306 -8.332 9.592 9 2HG2 ILE 1 2HG2 ILE 1 -10.985 -6.842 8.703 10 3HG2 ILE 1 3HG2 ILE 1 -9.683 -7.996 8.991 11 1HD1 ILE 1 1HD1 ILE 1 -10.918 -12.029 7.622 12 2HD1 ILE 1 2HD1 ILE 1 -9.686 -10.881 8.146 13 3HD1 ILE 1 3HD1 ILE 1 -10.188 -10.925 6.457 14 H LEU 2 H LEU 2 -10.556 -7.634 4.730 15 HA LEU 2 HA LEU 2 -12.094 -9.508 3.017 16 1HB LEU 2 2HB LEU 2 -12.121 -7.730 1.220 17 2HB LEU 2 1HB LEU 2 -13.136 -7.356 2.613 18 HG LEU 2 HG LEU 2 -10.313 -6.441 2.759 19 1HD1 LEU 2 1HD1 LEU 2 -12.327 -5.428 0.762 20 2HD1 LEU 2 2HD1 LEU 2 -10.603 -5.722 0.542 21 3HD1 LEU 2 3HD1 LEU 2 -11.148 -4.326 1.472 22 1HD2 LEU 2 1HD2 LEU 2 -12.951 -5.822 3.864 23 2HD2 LEU 2 2HD2 LEU 2 -12.084 -4.375 3.349 24 3HD2 LEU 2 3HD2 LEU 2 -11.351 -5.470 4.521 25 HA PRO 3 HA PRO 3 -7.964 -10.473 1.822 26 1HB PRO 3 2HB PRO 3 -8.527 -11.927 -0.426 27 2HB PRO 3 1HB PRO 3 -8.787 -12.547 1.216 28 1HG PRO 3 2HG PRO 3 -10.751 -11.440 -0.720 29 2HG PRO 3 1HG PRO 3 -10.925 -12.773 0.428 30 1HD PRO 3 2HD PRO 3 -11.929 -10.259 0.839 31 2HD PRO 3 1HD PRO 3 -11.508 -11.387 2.145 32 H TRP 4 H TRP 4 -10.100 -8.542 -0.045 33 HA TRP 4 HA TRP 4 -7.929 -7.857 -1.949 34 1HB TRP 4 2HB TRP 4 -10.145 -6.779 -3.029 35 2HB TRP 4 1HB TRP 4 -9.601 -8.411 -3.368 36 HD1 TRP 4 HD1 TRP 4 -11.732 -6.671 -0.689 37 HE1 TRP 4 1HE TRP 4 -13.761 -8.202 -0.169 38 HE3 TRP 4 3HE TRP 4 -10.616 -10.537 -3.728 39 HZ2 TRP 4 2HZ TRP 4 -14.753 -10.787 -0.977 40 HZ3 TRP 4 3HZ TRP 4 -12.089 -12.544 -3.862 41 HH2 TRP 4 HH2 TRP 4 -14.154 -12.669 -2.487 42 H LYS 5 H LYS 5 -7.325 -6.589 0.233 43 HA LYS 5 HA LYS 5 -8.844 -4.082 0.577 44 1HB LYS 5 2HB LYS 5 -6.454 -5.426 1.838 45 2HB LYS 5 1HB LYS 5 -6.866 -3.757 2.238 46 1HG LYS 5 2HG LYS 5 -9.268 -4.706 2.632 47 2HG LYS 5 1HG LYS 5 -8.450 -6.264 2.744 48 1HD LYS 5 2HD LYS 5 -8.301 -5.638 4.955 49 2HD LYS 5 1HD LYS 5 -6.838 -4.854 4.357 50 1HE LYS 5 2HE LYS 5 -8.111 -2.744 4.029 51 2HE LYS 5 1HE LYS 5 -9.557 -3.533 4.690 52 1HZ LYS 5 1HZ LYS 5 -6.980 -3.004 6.047 53 2HZ LYS 5 2HZ LYS 5 -8.074 -4.166 6.630 54 3HZ LYS 5 3HZ LYS 5 -8.535 -2.533 6.531 55 H TRP 6 H TRP 6 -6.931 -2.190 0.983 56 HA TRP 6 HA TRP 6 -6.141 -1.410 -1.667 57 1HB TRP 6 2HB TRP 6 -6.670 0.184 0.058 58 2HB TRP 6 1HB TRP 6 -5.399 -0.447 1.085 59 HD1 TRP 6 HD1 TRP 6 -2.899 -0.414 -0.231 60 HE1 TRP 6 1HE TRP 6 -1.847 1.596 -1.479 61 HE3 TRP 6 3HE TRP 6 -7.090 2.246 -1.169 62 HZ2 TRP 6 2HZ TRP 6 -2.722 4.034 -2.724 63 HZ3 TRP 6 3HZ TRP 6 -6.993 4.411 -2.388 64 HH2 TRP 6 HH2 TRP 6 -4.812 5.303 -3.167 65 HA PRO 7 HA PRO 7 -2.241 -3.406 -1.846 66 1HB PRO 7 2HB PRO 7 -1.276 -2.108 -4.049 67 2HB PRO 7 1HB PRO 7 -2.551 -3.337 -4.133 68 1HG PRO 7 2HG PRO 7 -2.737 -0.426 -4.441 69 2HG PRO 7 1HG PRO 7 -3.816 -1.697 -5.028 70 1HD PRO 7 2HD PRO 7 -4.180 -0.011 -2.766 71 2HD PRO 7 1HD PRO 7 -5.217 -1.351 -3.290 72 H TRP 8 H TRP 8 -0.480 -2.972 -0.568 73 HA TRP 8 HA TRP 8 1.217 -0.685 -0.891 74 1HB TRP 8 2HB TRP 8 -1.189 -0.254 0.575 75 2HB TRP 8 1HB TRP 8 0.124 -0.273 1.738 76 HD1 TRP 8 HD1 TRP 8 0.502 1.051 -1.869 77 HE1 TRP 8 1HE TRP 8 1.106 3.556 -1.715 78 HE3 TRP 8 3HE TRP 8 -0.029 1.730 3.118 79 HZ2 TRP 8 2HZ TRP 8 1.327 5.594 0.304 80 HZ3 TRP 8 3HZ TRP 8 0.381 3.949 4.163 81 HH2 TRP 8 HH2 TRP 8 1.054 5.884 2.758 82 H TRP 9 H TRP 9 2.938 -2.128 -0.602 83 HA TRP 9 HA TRP 9 3.079 -3.533 2.024 84 1HB TRP 9 2HB TRP 9 2.988 -4.838 -0.141 85 2HB TRP 9 1HB TRP 9 4.539 -4.127 -0.554 86 HD1 TRP 9 HD1 TRP 9 4.876 -7.010 -0.494 87 HE1 TRP 9 1HE TRP 9 5.985 -8.334 1.419 88 HE3 TRP 9 3HE TRP 9 4.364 -3.663 3.315 89 HZ2 TRP 9 2HZ TRP 9 6.576 -8.013 4.198 90 HZ3 TRP 9 3HZ TRP 9 5.203 -4.188 5.584 91 HH2 TRP 9 HH2 TRP 9 6.311 -6.362 6.030 92 HA PRO 10 HA PRO 10 6.354 -0.239 1.862 93 1HB PRO 10 2HB PRO 10 5.817 0.809 4.335 94 2HB PRO 10 1HB PRO 10 4.996 1.349 2.856 95 1HG PRO 10 2HG PRO 10 4.042 -0.495 4.983 96 2HG PRO 10 1HG PRO 10 3.149 0.725 4.061 97 1HD PRO 10 2HD PRO 10 3.042 -1.959 3.542 98 2HD PRO 10 1HD PRO 10 2.746 -0.704 2.323 99 H TRP 11 H TRP 11 7.345 -2.571 2.099 100 HA TRP 11 HA TRP 11 7.925 -4.060 4.248 101 1HB TRP 11 2HB TRP 11 10.498 -3.461 3.255 102 2HB TRP 11 1HB TRP 11 9.474 -4.816 2.836 103 HD1 TRP 11 HD1 TRP 11 9.779 -1.104 1.838 104 HE1 TRP 11 1HE TRP 11 9.312 -0.944 -0.707 105 HE3 TRP 11 3HE TRP 11 8.715 -5.912 0.956 106 HZ2 TRP 11 2HZ TRP 11 8.553 -2.727 -2.856 107 HZ3 TRP 11 3HZ TRP 11 8.109 -6.729 -1.330 108 HH2 TRP 11 HH2 TRP 11 8.024 -5.130 -3.233 109 H ARG 12 H ARG 12 9.995 -1.242 3.675 110 HA ARG 12 HA ARG 12 11.031 -1.223 6.359 111 1HB ARG 12 2HB ARG 12 12.353 0.475 5.507 112 2HB ARG 12 1HB ARG 12 11.863 -0.300 4.015 113 1HG ARG 12 2HG ARG 12 10.243 1.981 5.148 114 2HG ARG 12 1HG ARG 12 11.684 2.291 4.191 115 1HD ARG 12 2HD ARG 12 10.214 2.180 2.434 116 2HD ARG 12 1HD ARG 12 10.434 0.430 2.627 117 HE ARG 12 HE ARG 12 8.475 0.669 4.337 118 1HH1 ARG 12 2HH1 ARG 12 8.275 1.002 1.116 119 2HH1 ARG 12 1HH1 ARG 12 6.900 2.054 1.077 120 1HH2 ARG 12 1HH2 ARG 12 6.982 2.725 4.478 121 2HH2 ARG 12 2HH2 ARG 12 6.168 3.030 2.980 122 H ARG 13 H ARG 13 10.852 1.100 7.542 123 HA ARG 13 HA ARG 13 7.927 1.584 7.901 124 1HB ARG 13 2HB ARG 13 8.858 0.843 9.920 125 2HB ARG 13 1HB ARG 13 10.395 1.648 9.620 126 1HG ARG 13 2HG ARG 13 9.708 3.553 10.610 127 2HG ARG 13 1HG ARG 13 8.159 3.525 9.764 128 1HD ARG 13 2HD ARG 13 7.462 3.212 11.981 129 2HD ARG 13 1HD ARG 13 7.654 1.527 11.454 130 HE ARG 13 HE ARG 13 9.721 3.053 12.990 131 1HH1 ARG 13 1HH1 ARG 13 7.970 0.763 14.087 132 2HH1 ARG 13 2HH1 ARG 13 9.099 -0.549 14.044 133 1HH2 ARG 13 1HH2 ARG 13 11.330 1.095 11.958 134 2HH2 ARG 13 2HH2 ARG 13 11.002 -0.362 12.838 135 1HN NH2 14 1HT ARG 13 11.069 3.244 7.414 136 2HN NH2 14 2HT ARG 13 10.404 4.765 7.060 Start of MODEL 9 1 1H ILE 1 1H ILE 1 -16.806 -1.137 -0.913 2 2H ILE 1 2H ILE 1 -16.642 0.248 -1.884 3 3H ILE 1 3H ILE 1 -16.888 0.404 -0.211 4 HA ILE 1 HA ILE 1 -14.527 -1.071 -1.175 5 HB ILE 1 HB ILE 1 -13.427 1.263 -1.125 6 1HG1 ILE 1 2HG1 ILE 1 -16.256 2.182 -1.662 7 2HG1 ILE 1 1HG1 ILE 1 -15.551 2.248 -0.048 8 1HG2 ILE 1 1HG2 ILE 1 -15.152 0.042 -3.198 9 2HG2 ILE 1 2HG2 ILE 1 -13.463 0.545 -3.290 10 3HG2 ILE 1 3HG2 ILE 1 -14.748 1.738 -3.461 11 1HD1 ILE 1 1HD1 ILE 1 -15.302 4.205 -1.997 12 2HD1 ILE 1 2HD1 ILE 1 -13.769 3.338 -2.101 13 3HD1 ILE 1 3HD1 ILE 1 -14.281 4.046 -0.568 14 H LEU 2 H LEU 2 -13.044 -1.277 0.547 15 HA LEU 2 HA LEU 2 -13.662 0.114 3.111 16 1HB LEU 2 2HB LEU 2 -13.690 -2.018 4.289 17 2HB LEU 2 1HB LEU 2 -14.854 -2.099 2.965 18 HG LEU 2 HG LEU 2 -12.182 -2.911 2.114 19 1HD1 LEU 2 1HD1 LEU 2 -13.529 -4.745 4.102 20 2HD1 LEU 2 2HD1 LEU 2 -12.279 -3.606 4.602 21 3HD1 LEU 2 3HD1 LEU 2 -11.904 -4.866 3.427 22 1HD2 LEU 2 1HD2 LEU 2 -14.725 -4.545 2.230 23 2HD2 LEU 2 2HD2 LEU 2 -13.406 -4.663 1.065 24 3HD2 LEU 2 3HD2 LEU 2 -14.489 -3.273 1.031 25 HA PRO 3 HA PRO 3 -9.272 0.302 3.295 26 1HB PRO 3 2HB PRO 3 -8.913 0.574 5.993 27 2HB PRO 3 1HB PRO 3 -9.546 1.878 4.970 28 1HG PRO 3 2HG PRO 3 -10.993 0.018 6.781 29 2HG PRO 3 1HG PRO 3 -11.297 1.728 6.440 30 1HD PRO 3 2HD PRO 3 -12.742 -0.339 5.359 31 2HD PRO 3 1HD PRO 3 -12.582 1.265 4.613 32 H TRP 4 H TRP 4 -8.756 -1.895 2.658 33 HA TRP 4 HA TRP 4 -7.466 -3.489 4.663 34 1HB TRP 4 2HB TRP 4 -10.082 -3.694 4.943 35 2HB TRP 4 1HB TRP 4 -9.916 -4.829 3.609 36 HD1 TRP 4 HD1 TRP 4 -7.722 -6.656 4.083 37 HE1 TRP 4 1HE TRP 4 -7.353 -8.016 6.246 38 HE3 TRP 4 3HE TRP 4 -10.483 -3.880 7.325 39 HZ2 TRP 4 2HZ TRP 4 -8.137 -7.927 9.002 40 HZ3 TRP 4 3HZ TRP 4 -10.666 -4.525 9.717 41 HH2 TRP 4 HH2 TRP 4 -9.495 -6.545 10.558 42 H LYS 5 H LYS 5 -9.242 -3.763 1.649 43 HA LYS 5 HA LYS 5 -7.250 -5.657 0.550 44 1HB LYS 5 2HB LYS 5 -10.023 -4.832 0.083 45 2HB LYS 5 1HB LYS 5 -9.113 -5.049 -1.413 46 1HG LYS 5 2HG LYS 5 -8.660 -7.302 -0.968 47 2HG LYS 5 1HG LYS 5 -8.934 -7.114 0.765 48 1HD LYS 5 2HD LYS 5 -10.906 -8.165 0.147 49 2HD LYS 5 1HD LYS 5 -11.381 -6.474 -0.022 50 1HE LYS 5 2HE LYS 5 -11.187 -6.528 -2.380 51 2HE LYS 5 1HE LYS 5 -10.194 -7.999 -2.349 52 1HZ LYS 5 1HZ LYS 5 -11.984 -9.303 -2.115 53 2HZ LYS 5 2HZ LYS 5 -12.875 -7.970 -2.675 54 3HZ LYS 5 3HZ LYS 5 -12.736 -8.259 -1.007 55 H TRP 6 H TRP 6 -5.970 -3.262 0.972 56 HA TRP 6 HA TRP 6 -5.940 -1.910 -1.696 57 1HB TRP 6 2HB TRP 6 -6.471 -0.463 0.161 58 2HB TRP 6 1HB TRP 6 -5.075 -1.037 1.053 59 HD1 TRP 6 HD1 TRP 6 -2.694 -0.719 -0.422 60 HE1 TRP 6 1HE TRP 6 -1.908 1.427 -1.637 61 HE3 TRP 6 3HE TRP 6 -7.151 1.604 -0.936 62 HZ2 TRP 6 2HZ TRP 6 -3.073 3.831 -2.698 63 HZ3 TRP 6 3HZ TRP 6 -7.323 3.820 -2.052 64 HH2 TRP 6 HH2 TRP 6 -5.287 4.932 -2.935 65 HA PRO 7 HA PRO 7 -1.928 -3.576 -2.257 66 1HB PRO 7 2HB PRO 7 -1.223 -2.074 -4.430 67 2HB PRO 7 1HB PRO 7 -2.400 -3.396 -4.510 68 1HG PRO 7 2HG PRO 7 -2.833 -0.493 -4.608 69 2HG PRO 7 1HG PRO 7 -3.845 -1.810 -5.216 70 1HD PRO 7 2HD PRO 7 -4.206 -0.312 -2.832 71 2HD PRO 7 1HD PRO 7 -5.148 -1.714 -3.374 72 H TRP 8 H TRP 8 -0.477 -2.967 -0.650 73 HA TRP 8 HA TRP 8 1.249 -0.690 -1.084 74 1HB TRP 8 2HB TRP 8 -0.916 0.316 -0.219 75 2HB TRP 8 1HB TRP 8 -0.629 -0.560 1.277 76 HD1 TRP 8 HD1 TRP 8 2.276 1.070 -0.653 77 HE1 TRP 8 1HE TRP 8 3.233 2.958 0.815 78 HE3 TRP 8 3HE TRP 8 -1.176 1.085 3.044 79 HZ2 TRP 8 2HZ TRP 8 2.597 4.309 3.271 80 HZ3 TRP 8 3HZ TRP 8 -1.004 2.672 4.958 81 HH2 TRP 8 HH2 TRP 8 0.882 4.285 5.070 82 H TRP 9 H TRP 9 2.957 -2.163 -0.702 83 HA TRP 9 HA TRP 9 3.003 -3.604 1.897 84 1HB TRP 9 2HB TRP 9 3.661 -4.245 -0.712 85 2HB TRP 9 1HB TRP 9 5.230 -3.975 0.026 86 HD1 TRP 9 HD1 TRP 9 3.590 -6.847 -0.779 87 HE1 TRP 9 1HE TRP 9 3.627 -8.671 1.050 88 HE3 TRP 9 3HE TRP 9 4.779 -3.991 3.212 89 HZ2 TRP 9 2HZ TRP 9 4.110 -8.867 3.879 90 HZ3 TRP 9 3HZ TRP 9 5.028 -4.984 5.485 91 HH2 TRP 9 HH2 TRP 9 4.694 -7.423 5.818 92 HA PRO 10 HA PRO 10 5.612 0.013 2.914 93 1HB PRO 10 2HB PRO 10 5.258 -0.247 5.622 94 2HB PRO 10 1HB PRO 10 4.111 0.606 4.570 95 1HG PRO 10 2HG PRO 10 3.984 -2.181 5.633 96 2HG PRO 10 1HG PRO 10 2.701 -0.965 5.504 97 1HD PRO 10 2HD PRO 10 2.933 -2.981 3.735 98 2HD PRO 10 1HD PRO 10 2.359 -1.366 3.258 99 H TRP 11 H TRP 11 7.599 -0.959 2.356 100 HA TRP 11 HA TRP 11 8.844 -3.244 3.132 101 1HB TRP 11 2HB TRP 11 10.894 -1.375 3.406 102 2HB TRP 11 1HB TRP 11 10.422 -2.210 1.944 103 HD1 TRP 11 HD1 TRP 11 9.235 0.938 3.872 104 HE1 TRP 11 1HE TRP 11 8.654 2.734 2.092 105 HE3 TRP 11 3HE TRP 11 10.118 -1.753 -0.268 106 HZ2 TRP 11 2HZ TRP 11 8.581 2.947 -0.790 107 HZ3 TRP 11 3HZ TRP 11 9.800 -0.786 -2.554 108 HH2 TRP 11 HH2 TRP 11 9.026 1.564 -2.809 109 H ARG 12 H ARG 12 9.836 -0.376 4.856 110 HA ARG 12 HA ARG 12 10.658 -1.765 7.221 111 1HB ARG 12 2HB ARG 12 11.736 0.245 6.784 112 2HB ARG 12 1HB ARG 12 10.247 1.035 6.301 113 1HG ARG 12 2HG ARG 12 10.842 1.992 8.393 114 2HG ARG 12 1HG ARG 12 9.511 0.888 8.728 115 1HD ARG 12 2HD ARG 12 12.156 -0.404 8.846 116 2HD ARG 12 1HD ARG 12 11.918 0.859 10.070 117 HE ARG 12 HE ARG 12 9.544 -0.725 9.891 118 1HH1 ARG 12 2HH1 ARG 12 11.933 0.031 12.001 119 2HH1 ARG 12 1HH1 ARG 12 12.036 -1.514 12.776 120 1HH2 ARG 12 1HH2 ARG 12 10.053 -3.120 10.430 121 2HH2 ARG 12 2HH2 ARG 12 10.975 -3.298 11.885 122 H ARG 13 H ARG 13 9.123 -2.823 8.455 123 HA ARG 13 HA ARG 13 6.363 -2.048 8.670 124 1HB ARG 13 2HB ARG 13 7.918 -4.221 9.248 125 2HB ARG 13 1HB ARG 13 7.620 -3.582 10.865 126 1HG ARG 13 2HG ARG 13 5.129 -3.386 9.919 127 2HG ARG 13 1HG ARG 13 5.689 -4.701 8.885 128 1HD ARG 13 2HD ARG 13 6.619 -5.301 11.498 129 2HD ARG 13 1HD ARG 13 4.914 -4.833 11.655 130 HE ARG 13 HE ARG 13 5.929 -7.146 10.152 131 1HH1 ARG 13 1HH1 ARG 13 3.441 -4.780 10.471 132 2HH1 ARG 13 2HH1 ARG 13 2.193 -5.821 9.875 133 1HH2 ARG 13 1HH2 ARG 13 4.292 -8.548 9.463 134 2HH2 ARG 13 2HH2 ARG 13 2.673 -7.952 9.307 135 1HN NH2 14 1HT ARG 13 5.574 -0.290 9.866 136 2HN NH2 14 2HT ARG 13 6.317 0.378 11.239 Start of MODEL 10 1 1H ILE 1 1H ILE 1 -19.567 1.382 1.693 2 2H ILE 1 2H ILE 1 -18.949 0.478 2.993 3 3H ILE 1 3H ILE 1 -18.278 0.305 1.441 4 HA ILE 1 HA ILE 1 -17.426 2.548 1.506 5 HB ILE 1 HB ILE 1 -18.925 2.489 4.127 6 1HG1 ILE 1 2HG1 ILE 1 -20.403 2.991 2.309 7 2HG1 ILE 1 1HG1 ILE 1 -20.010 4.544 3.049 8 1HG2 ILE 1 1HG2 ILE 1 -16.968 3.699 4.652 9 2HG2 ILE 1 2HG2 ILE 1 -18.113 4.956 4.184 10 3HG2 ILE 1 3HG2 ILE 1 -16.877 4.421 3.045 11 1HD1 ILE 1 1HD1 ILE 1 -19.681 4.994 0.776 12 2HD1 ILE 1 2HD1 ILE 1 -19.030 3.388 0.452 13 3HD1 ILE 1 3HD1 ILE 1 -18.052 4.579 1.307 14 H LEU 2 H LEU 2 -17.085 -0.316 2.741 15 HA LEU 2 HA LEU 2 -14.746 0.299 4.504 16 1HB LEU 2 2HB LEU 2 -16.336 -2.258 4.111 17 2HB LEU 2 1HB LEU 2 -15.114 -1.974 5.349 18 HG LEU 2 HG LEU 2 -17.520 -0.176 5.107 19 1HD1 LEU 2 1HD1 LEU 2 -17.336 -2.943 6.198 20 2HD1 LEU 2 2HD1 LEU 2 -18.724 -2.093 5.520 21 3HD1 LEU 2 3HD1 LEU 2 -18.204 -1.758 7.173 22 1HD2 LEU 2 1HD2 LEU 2 -15.191 -0.349 6.772 23 2HD2 LEU 2 2HD2 LEU 2 -16.615 -0.655 7.769 24 3HD2 LEU 2 3HD2 LEU 2 -16.494 0.838 6.837 25 HA PRO 3 HA PRO 3 -12.418 -1.044 0.924 26 1HB PRO 3 2HB PRO 3 -9.954 -0.582 2.012 27 2HB PRO 3 1HB PRO 3 -10.973 0.711 1.351 28 1HG PRO 3 2HG PRO 3 -10.530 -0.086 4.183 29 2HG PRO 3 1HG PRO 3 -10.717 1.526 3.478 30 1HD PRO 3 2HD PRO 3 -12.710 0.215 4.807 31 2HD PRO 3 1HD PRO 3 -13.000 1.434 3.547 32 H TRP 4 H TRP 4 -10.901 -2.846 0.520 33 HA TRP 4 HA TRP 4 -11.086 -4.952 2.604 34 1HB TRP 4 2HB TRP 4 -10.957 -4.765 -0.360 35 2HB TRP 4 1HB TRP 4 -10.303 -6.206 0.383 36 HD1 TRP 4 HD1 TRP 4 -11.983 -7.849 1.635 37 HE1 TRP 4 1HE TRP 4 -14.563 -8.020 1.590 38 HE3 TRP 4 3HE TRP 4 -13.066 -3.416 -0.535 39 HZ2 TRP 4 2HZ TRP 4 -16.806 -6.438 0.725 40 HZ3 TRP 4 3HZ TRP 4 -15.424 -2.738 -0.975 41 HH2 TRP 4 HH2 TRP 4 -17.292 -4.247 -0.346 42 H LYS 5 H LYS 5 -8.754 -4.939 0.047 43 HA LYS 5 HA LYS 5 -6.550 -4.590 2.036 44 1HB LYS 5 2HB LYS 5 -5.462 -6.335 0.345 45 2HB LYS 5 1HB LYS 5 -6.496 -6.882 1.659 46 1HG LYS 5 2HG LYS 5 -8.341 -7.218 0.220 47 2HG LYS 5 1HG LYS 5 -7.646 -6.211 -1.049 48 1HD LYS 5 2HD LYS 5 -7.018 -8.205 -1.958 49 2HD LYS 5 1HD LYS 5 -5.707 -8.116 -0.783 50 1HE LYS 5 2HE LYS 5 -6.541 -9.863 0.410 51 2HE LYS 5 1HE LYS 5 -8.186 -9.199 0.365 52 1HZ LYS 5 1HZ LYS 5 -8.077 -11.223 -0.937 53 2HZ LYS 5 2HZ LYS 5 -6.803 -10.595 -1.865 54 3HZ LYS 5 3HZ LYS 5 -8.349 -9.896 -1.956 55 H TRP 6 H TRP 6 -5.643 -2.642 1.432 56 HA TRP 6 HA TRP 6 -5.608 -1.748 -1.358 57 1HB TRP 6 2HB TRP 6 -5.155 -0.724 1.332 58 2HB TRP 6 1HB TRP 6 -3.987 -0.111 0.184 59 HD1 TRP 6 HD1 TRP 6 -7.787 -0.444 0.586 60 HE1 TRP 6 1HE TRP 6 -8.905 1.497 -0.707 61 HE3 TRP 6 3HE TRP 6 -3.678 1.619 -1.500 62 HZ2 TRP 6 2HZ TRP 6 -8.112 3.662 -2.425 63 HZ3 TRP 6 3HZ TRP 6 -3.848 3.623 -2.970 64 HH2 TRP 6 HH2 TRP 6 -6.063 4.644 -3.433 65 HA PRO 7 HA PRO 7 -1.683 -3.530 -2.258 66 1HB PRO 7 2HB PRO 7 -1.173 -2.138 -4.557 67 2HB PRO 7 1HB PRO 7 -2.355 -3.459 -4.470 68 1HG PRO 7 2HG PRO 7 -2.794 -0.531 -4.533 69 2HG PRO 7 1HG PRO 7 -3.787 -1.840 -5.191 70 1HD PRO 7 2HD PRO 7 -4.299 -0.463 -2.838 71 2HD PRO 7 1HD PRO 7 -4.978 -2.046 -3.268 72 H TRP 8 H TRP 8 -0.868 -2.271 -0.265 73 HA TRP 8 HA TRP 8 1.086 -0.188 -1.160 74 1HB TRP 8 2HB TRP 8 -0.961 0.825 -0.134 75 2HB TRP 8 1HB TRP 8 -0.657 -0.120 1.313 76 HD1 TRP 8 HD1 TRP 8 2.074 1.694 -0.731 77 HE1 TRP 8 1HE TRP 8 3.189 3.417 0.839 78 HE3 TRP 8 3HE TRP 8 -0.927 1.192 3.287 79 HZ2 TRP 8 2HZ TRP 8 2.822 4.445 3.505 80 HZ3 TRP 8 3HZ TRP 8 -0.555 2.529 5.357 81 HH2 TRP 8 HH2 TRP 8 1.317 4.162 5.465 82 H TRP 9 H TRP 9 1.832 -2.856 -0.772 83 HA TRP 9 HA TRP 9 2.518 -3.878 1.687 84 1HB TRP 9 2HB TRP 9 3.573 -3.864 -1.038 85 2HB TRP 9 1HB TRP 9 4.819 -4.131 0.164 86 HD1 TRP 9 HD1 TRP 9 5.073 -6.717 -0.440 87 HE1 TRP 9 1HE TRP 9 3.574 -8.751 0.101 88 HE3 TRP 9 3HE TRP 9 0.854 -4.298 0.968 89 HZ2 TRP 9 2HZ TRP 9 0.900 -9.265 1.023 90 HZ3 TRP 9 3HZ TRP 9 -1.173 -5.556 1.681 91 HH2 TRP 9 HH2 TRP 9 -1.149 -8.039 1.708 92 HA PRO 10 HA PRO 10 4.763 -0.217 3.178 93 1HB PRO 10 2HB PRO 10 4.519 -0.884 5.823 94 2HB PRO 10 1HB PRO 10 3.239 -0.055 4.913 95 1HG PRO 10 2HG PRO 10 3.494 -2.941 5.615 96 2HG PRO 10 1HG PRO 10 2.060 -1.900 5.628 97 1HD PRO 10 2HD PRO 10 2.580 -3.661 3.632 98 2HD PRO 10 1HD PRO 10 1.707 -2.132 3.373 99 H TRP 11 H TRP 11 6.453 -1.813 2.050 100 HA TRP 11 HA TRP 11 7.994 -3.770 2.989 101 1HB TRP 11 2HB TRP 11 9.932 -1.784 2.513 102 2HB TRP 11 1HB TRP 11 9.325 -2.975 1.389 103 HD1 TRP 11 HD1 TRP 11 8.240 0.483 2.714 104 HE1 TRP 11 1HE TRP 11 7.171 1.768 0.732 105 HE3 TRP 11 3HE TRP 11 8.522 -3.107 -0.776 106 HZ2 TRP 11 2HZ TRP 11 6.519 1.263 -2.039 107 HZ3 TRP 11 3HZ TRP 11 7.681 -2.741 -3.102 108 HH2 TRP 11 HH2 TRP 11 6.678 -0.557 -3.729 109 H ARG 12 H ARG 12 8.671 -0.512 4.137 110 HA ARG 12 HA ARG 12 10.443 -1.191 6.240 111 1HB ARG 12 2HB ARG 12 9.286 1.100 5.129 112 2HB ARG 12 1HB ARG 12 8.755 1.104 6.805 113 1HG ARG 12 2HG ARG 12 11.587 0.390 6.435 114 2HG ARG 12 1HG ARG 12 11.179 2.039 5.955 115 1HD ARG 12 2HD ARG 12 11.766 2.089 8.315 116 2HD ARG 12 1HD ARG 12 10.005 2.286 8.207 117 HE ARG 12 HE ARG 12 9.737 -0.020 8.905 118 1HH1 ARG 12 1HH2 ARG 12 11.803 0.985 10.883 119 2HH1 ARG 12 2HH2 ARG 12 12.973 -0.290 10.834 120 1HH2 ARG 12 2HH1 ARG 12 11.766 -1.648 7.881 121 2HH2 ARG 12 1HH1 ARG 12 12.954 -1.778 9.135 122 H ARG 13 H ARG 13 9.982 -2.457 7.993 123 HA ARG 13 HA ARG 13 7.188 -2.687 8.955 124 1HB ARG 13 2HB ARG 13 9.423 -4.369 8.682 125 2HB ARG 13 1HB ARG 13 9.235 -4.142 10.423 126 1HG ARG 13 2HG ARG 13 6.632 -4.495 9.602 127 2HG ARG 13 1HG ARG 13 7.512 -5.584 8.528 128 1HD ARG 13 2HD ARG 13 7.946 -5.547 11.532 129 2HD ARG 13 1HD ARG 13 6.803 -6.642 10.727 130 HE ARG 13 HE ARG 13 8.711 -7.571 9.453 131 1HH1 ARG 13 1HH2 ARG 13 9.441 -8.122 12.276 132 2HH1 ARG 13 2HH2 ARG 13 11.051 -7.490 12.382 133 1HH2 ARG 13 1HH1 ARG 13 10.783 -5.591 9.492 134 2HH2 ARG 13 2HH1 ARG 13 11.810 -6.058 10.808 135 1HN NH2 14 1HT ARG 13 6.566 -1.988 11.091 136 2HN NH2 14 2HT ARG 13 7.569 -1.049 12.089 Start of MODEL 11 1 1H ILE 1 1H ILE 1 -4.944 -13.098 7.173 2 2H ILE 1 2H ILE 1 -3.925 -14.148 6.310 3 3H ILE 1 3H ILE 1 -5.464 -13.765 5.702 4 HA ILE 1 HA ILE 1 -3.427 -11.658 6.143 5 HB ILE 1 HB ILE 1 -2.991 -12.088 3.639 6 1HG1 ILE 1 2HG1 ILE 1 -4.095 -14.819 4.340 7 2HG1 ILE 1 1HG1 ILE 1 -5.043 -13.603 3.481 8 1HG2 ILE 1 1HG2 ILE 1 -2.084 -13.663 5.984 9 2HG2 ILE 1 2HG2 ILE 1 -1.142 -12.726 4.826 10 3HG2 ILE 1 3HG2 ILE 1 -1.696 -14.348 4.404 11 1HD1 ILE 1 1HD1 ILE 1 -2.726 -13.556 2.042 12 2HD1 ILE 1 2HD1 ILE 1 -4.124 -14.546 1.621 13 3HD1 ILE 1 3HD1 ILE 1 -2.782 -15.252 2.525 14 H LEU 2 H LEU 2 -3.893 -9.974 4.323 15 HA LEU 2 HA LEU 2 -6.851 -9.806 3.841 16 1HB LEU 2 2HB LEU 2 -4.848 -7.687 4.685 17 2HB LEU 2 1HB LEU 2 -6.524 -7.344 4.249 18 HG LEU 2 HG LEU 2 -6.844 -9.377 6.057 19 1HD1 LEU 2 1HD1 LEU 2 -4.652 -7.620 7.182 20 2HD1 LEU 2 2HD1 LEU 2 -4.329 -9.203 6.475 21 3HD1 LEU 2 3HD1 LEU 2 -5.356 -9.068 7.903 22 1HD2 LEU 2 1HD2 LEU 2 -6.785 -6.374 6.362 23 2HD2 LEU 2 2HD2 LEU 2 -7.254 -7.418 7.702 24 3HD2 LEU 2 3HD2 LEU 2 -8.187 -7.433 6.207 25 HA PRO 3 HA PRO 3 -4.435 -9.306 -0.095 26 1HB PRO 3 2HB PRO 3 -5.758 -11.237 -1.505 27 2HB PRO 3 1HB PRO 3 -4.334 -11.578 -0.505 28 1HG PRO 3 2HG PRO 3 -7.206 -12.054 0.068 29 2HG PRO 3 1HG PRO 3 -5.789 -13.012 0.518 30 1HD PRO 3 2HD PRO 3 -7.134 -11.316 2.221 31 2HD PRO 3 1HD PRO 3 -5.445 -11.828 2.431 32 H TRP 4 H TRP 4 -7.445 -8.639 1.065 33 HA TRP 4 HA TRP 4 -8.520 -7.804 -1.570 34 1HB TRP 4 2HB TRP 4 -10.575 -7.483 0.136 35 2HB TRP 4 1HB TRP 4 -10.254 -8.985 -0.712 36 HD1 TRP 4 HD1 TRP 4 -9.083 -7.302 2.537 37 HE1 TRP 4 1HE TRP 4 -8.954 -9.127 4.376 38 HE3 TRP 4 3HE TRP 4 -10.396 -11.312 -0.225 39 HZ2 TRP 4 2HZ TRP 4 -9.367 -11.973 4.598 40 HZ3 TRP 4 3HZ TRP 4 -10.531 -13.588 0.785 41 HH2 TRP 4 HH2 TRP 4 -10.014 -13.918 3.190 42 H LYS 5 H LYS 5 -6.706 -6.536 0.800 43 HA LYS 5 HA LYS 5 -8.150 -3.962 1.067 44 1HB LYS 5 2HB LYS 5 -6.520 -3.560 2.791 45 2HB LYS 5 1HB LYS 5 -7.016 -5.241 2.952 46 1HG LYS 5 2HG LYS 5 -4.849 -5.827 2.771 47 2HG LYS 5 1HG LYS 5 -4.890 -5.253 1.103 48 1HD LYS 5 2HD LYS 5 -3.252 -3.840 1.850 49 2HD LYS 5 1HD LYS 5 -4.631 -2.888 2.400 50 1HE LYS 5 2HE LYS 5 -3.824 -5.006 4.292 51 2HE LYS 5 1HE LYS 5 -2.604 -3.738 4.050 52 1HZ LYS 5 1HZ LYS 5 -3.969 -2.134 4.837 53 2HZ LYS 5 2HZ LYS 5 -4.679 -3.430 5.675 54 3HZ LYS 5 3HZ LYS 5 -5.376 -2.864 4.234 55 H TRP 6 H TRP 6 -6.818 -1.941 0.686 56 HA TRP 6 HA TRP 6 -5.882 -1.650 -1.924 57 1HB TRP 6 2HB TRP 6 -6.420 0.201 -0.483 58 2HB TRP 6 1HB TRP 6 -5.115 -0.220 0.610 59 HD1 TRP 6 HD1 TRP 6 -2.638 -0.357 -0.756 60 HE1 TRP 6 1HE TRP 6 -1.661 1.434 -2.344 61 HE3 TRP 6 3HE TRP 6 -6.910 2.026 -2.019 62 HZ2 TRP 6 2HZ TRP 6 -2.618 3.614 -3.954 63 HZ3 TRP 6 3HZ TRP 6 -6.886 3.961 -3.581 64 HH2 TRP 6 HH2 TRP 6 -4.743 4.755 -4.550 65 HA PRO 7 HA PRO 7 -1.919 -3.536 -1.842 66 1HB PRO 7 2HB PRO 7 -1.046 -2.627 -4.268 67 2HB PRO 7 1HB PRO 7 -2.276 -3.891 -4.096 68 1HG PRO 7 2HG PRO 7 -2.575 -1.099 -4.934 69 2HG PRO 7 1HG PRO 7 -3.630 -2.485 -5.225 70 1HD PRO 7 2HD PRO 7 -3.963 -0.410 -3.299 71 2HD PRO 7 1HD PRO 7 -4.993 -1.834 -3.549 72 H TRP 8 H TRP 8 -0.496 -2.614 -0.369 73 HA TRP 8 HA TRP 8 1.283 -0.477 -1.252 74 1HB TRP 8 2HB TRP 8 -0.780 0.756 -0.602 75 2HB TRP 8 1HB TRP 8 -0.696 0.012 0.985 76 HD1 TRP 8 HD1 TRP 8 2.368 1.388 -0.913 77 HE1 TRP 8 1HE TRP 8 3.376 3.285 0.524 78 HE3 TRP 8 3HE TRP 8 -1.147 1.634 2.690 79 HZ2 TRP 8 2HZ TRP 8 2.737 4.723 2.940 80 HZ3 TRP 8 3HZ TRP 8 -0.962 3.253 4.574 81 HH2 TRP 8 HH2 TRP 8 0.976 4.802 4.696 82 H TRP 9 H TRP 9 1.738 -3.127 -0.322 83 HA TRP 9 HA TRP 9 2.259 -3.507 2.409 84 1HB TRP 9 2HB TRP 9 2.769 -4.755 -0.018 85 2HB TRP 9 1HB TRP 9 4.370 -4.507 0.649 86 HD1 TRP 9 HD1 TRP 9 2.053 -7.151 0.561 87 HE1 TRP 9 1HE TRP 9 2.086 -8.589 2.709 88 HE3 TRP 9 3HE TRP 9 4.468 -3.966 3.636 89 HZ2 TRP 9 2HZ TRP 9 3.042 -8.379 5.418 90 HZ3 TRP 9 3HZ TRP 9 4.952 -4.571 6.010 91 HH2 TRP 9 HH2 TRP 9 4.235 -6.777 6.898 92 HA PRO 10 HA PRO 10 5.267 -0.137 2.754 93 1HB PRO 10 2HB PRO 10 5.244 -0.103 5.494 94 2HB PRO 10 1HB PRO 10 4.011 0.708 4.507 95 1HG PRO 10 2HG PRO 10 3.888 -1.926 5.896 96 2HG PRO 10 1HG PRO 10 2.649 -0.667 5.756 97 1HD PRO 10 2HD PRO 10 2.635 -2.911 4.236 98 2HD PRO 10 1HD PRO 10 1.997 -1.351 3.663 99 H TRP 11 H TRP 11 7.014 -1.475 1.995 100 HA TRP 11 HA TRP 11 8.277 -3.670 2.813 101 1HB TRP 11 2HB TRP 11 10.394 -1.804 2.831 102 2HB TRP 11 1HB TRP 11 9.859 -2.810 1.505 103 HD1 TRP 11 HD1 TRP 11 8.792 0.534 3.110 104 HE1 TRP 11 1HE TRP 11 8.086 2.121 1.184 105 HE3 TRP 11 3HE TRP 11 9.367 -2.621 -0.735 106 HZ2 TRP 11 2HZ TRP 11 7.806 2.000 -1.692 107 HZ3 TRP 11 3HZ TRP 11 8.887 -1.928 -3.088 108 HH2 TRP 11 HH2 TRP 11 8.102 0.384 -3.563 109 H ARG 12 H ARG 12 9.089 -0.662 4.470 110 HA ARG 12 HA ARG 12 10.678 -1.402 6.541 111 1HB ARG 12 2HB ARG 12 8.880 0.680 5.992 112 2HB ARG 12 1HB ARG 12 8.454 0.111 7.602 113 1HG ARG 12 2HG ARG 12 11.344 0.286 7.218 114 2HG ARG 12 1HG ARG 12 10.537 1.841 7.007 115 1HD ARG 12 2HD ARG 12 11.020 1.684 9.354 116 2HD ARG 12 1HD ARG 12 9.294 1.295 9.209 117 HE ARG 12 HE ARG 12 9.851 -1.070 9.443 118 1HH1 ARG 12 2HH1 ARG 12 11.447 0.476 11.627 119 2HH1 ARG 12 1HH1 ARG 12 12.954 -0.372 11.554 120 1HH2 ARG 12 1HH2 ARG 12 12.253 -1.892 8.516 121 2HH2 ARG 12 2HH2 ARG 12 13.411 -1.714 9.791 122 H ARG 13 H ARG 13 10.621 -3.150 7.886 123 HA ARG 13 HA ARG 13 7.968 -4.207 8.756 124 1HB ARG 13 2HB ARG 13 9.152 -5.893 7.647 125 2HB ARG 13 1HB ARG 13 10.712 -5.311 8.224 126 1HG ARG 13 2HG ARG 13 10.511 -6.366 10.265 127 2HG ARG 13 1HG ARG 13 8.749 -6.293 10.249 128 1HD ARG 13 2HD ARG 13 8.978 -8.539 9.750 129 2HD ARG 13 1HD ARG 13 9.164 -7.911 8.100 130 HE ARG 13 HE ARG 13 11.710 -7.728 8.931 131 1HH1 ARG 13 1HH1 ARG 13 10.195 -9.798 10.934 132 2HH1 ARG 13 2HH1 ARG 13 10.992 -11.244 10.410 133 1HH2 ARG 13 1HH2 ARG 13 12.394 -9.769 7.603 134 2HH2 ARG 13 2HH2 ARG 13 12.235 -11.228 8.522 135 1HN NH2 14 1HT ARG 13 7.875 -2.503 10.528 136 2HN NH2 14 2HT ARG 13 8.812 -2.709 11.928 Start of MODEL 12 1 1H ILE 1 1H ILE 1 -17.431 -5.831 6.068 2 2H ILE 1 2H ILE 1 -17.562 -6.744 4.641 3 3H ILE 1 3H ILE 1 -18.344 -5.241 4.767 4 HA ILE 1 HA ILE 1 -15.858 -5.689 3.682 5 HB ILE 1 HB ILE 1 -15.918 -3.164 3.651 6 1HG1 ILE 1 2HG1 ILE 1 -18.560 -2.883 4.746 7 2HG1 ILE 1 1HG1 ILE 1 -17.516 -3.621 5.962 8 1HG2 ILE 1 1HG2 ILE 1 -18.356 -3.144 2.653 9 2HG2 ILE 1 2HG2 ILE 1 -18.263 -4.887 2.909 10 3HG2 ILE 1 3HG2 ILE 1 -17.094 -4.085 1.860 11 1HD1 ILE 1 1HD1 ILE 1 -17.515 -1.091 5.981 12 2HD1 ILE 1 2HD1 ILE 1 -16.750 -1.146 4.392 13 3HD1 ILE 1 3HD1 ILE 1 -15.919 -1.822 5.794 14 H LEU 2 H LEU 2 -13.734 -5.264 4.360 15 HA LEU 2 HA LEU 2 -13.323 -4.316 7.165 16 1HB LEU 2 2HB LEU 2 -11.780 -6.228 7.505 17 2HB LEU 2 1HB LEU 2 -13.410 -6.788 7.125 18 HG LEU 2 HG LEU 2 -11.725 -6.340 4.753 19 1HD1 LEU 2 1HD1 LEU 2 -10.800 -8.821 5.479 20 2HD1 LEU 2 2HD1 LEU 2 -10.759 -7.962 7.019 21 3HD1 LEU 2 3HD1 LEU 2 -9.874 -7.327 5.632 22 1HD2 LEU 2 1HD2 LEU 2 -13.179 -7.867 3.936 23 2HD2 LEU 2 2HD2 LEU 2 -14.019 -7.769 5.483 24 3HD2 LEU 2 3HD2 LEU 2 -12.794 -9.011 5.222 25 HA PRO 3 HA PRO 3 -9.944 -2.103 5.454 26 1HB PRO 3 2HB PRO 3 -8.039 -2.317 7.411 27 2HB PRO 3 1HB PRO 3 -9.479 -1.290 7.567 28 1HG PRO 3 2HG PRO 3 -8.952 -3.998 8.688 29 2HG PRO 3 1HG PRO 3 -9.774 -2.611 9.423 30 1HD PRO 3 2HD PRO 3 -11.101 -4.736 8.370 31 2HD PRO 3 1HD PRO 3 -11.776 -3.092 8.413 32 H TRP 4 H TRP 4 -9.623 -3.811 3.758 33 HA TRP 4 HA TRP 4 -6.901 -4.728 3.633 34 1HB TRP 4 2HB TRP 4 -8.067 -6.215 5.398 35 2HB TRP 4 1HB TRP 4 -8.918 -6.940 4.041 36 HD1 TRP 4 HD1 TRP 4 -7.084 -7.659 1.931 37 HE1 TRP 4 1HE TRP 4 -4.906 -9.008 2.233 38 HE3 TRP 4 3HE TRP 4 -6.285 -6.900 6.899 39 HZ2 TRP 4 2HZ TRP 4 -3.065 -9.676 4.324 40 HZ3 TRP 4 3HZ TRP 4 -4.314 -7.900 8.033 41 HH2 TRP 4 HH2 TRP 4 -2.705 -9.286 6.751 42 H LYS 5 H LYS 5 -7.930 -3.410 1.658 43 HA LYS 5 HA LYS 5 -8.590 -5.422 -0.428 44 1HB LYS 5 2HB LYS 5 -10.165 -3.066 0.558 45 2HB LYS 5 1HB LYS 5 -10.273 -3.514 -1.141 46 1HG LYS 5 2HG LYS 5 -11.099 -5.687 -0.626 47 2HG LYS 5 1HG LYS 5 -10.635 -5.538 1.068 48 1HD LYS 5 2HD LYS 5 -12.720 -4.797 1.497 49 2HD LYS 5 1HD LYS 5 -12.325 -3.346 0.578 50 1HE LYS 5 2HE LYS 5 -13.311 -5.888 -0.753 51 2HE LYS 5 1HE LYS 5 -14.400 -4.586 -0.232 52 1HZ LYS 5 1HZ LYS 5 -13.849 -3.923 -2.359 53 2HZ LYS 5 2HZ LYS 5 -12.259 -4.511 -2.256 54 3HZ LYS 5 3HZ LYS 5 -12.697 -3.086 -1.439 55 H TRP 6 H TRP 6 -6.313 -3.456 0.426 56 HA TRP 6 HA TRP 6 -5.893 -2.337 -2.308 57 1HB TRP 6 2HB TRP 6 -6.810 -0.582 -0.930 58 2HB TRP 6 1HB TRP 6 -5.644 -0.917 0.332 59 HD1 TRP 6 HD1 TRP 6 -2.996 -0.813 -0.653 60 HE1 TRP 6 1HE TRP 6 -1.961 1.094 -2.063 61 HE3 TRP 6 3HE TRP 6 -7.232 1.219 -2.508 62 HZ2 TRP 6 2HZ TRP 6 -2.866 3.219 -3.777 63 HZ3 TRP 6 3HZ TRP 6 -7.156 3.183 -4.031 64 HH2 TRP 6 HH2 TRP 6 -4.974 4.182 -4.668 65 HA PRO 7 HA PRO 7 -1.878 -3.963 -1.563 66 1HB PRO 7 2HB PRO 7 -0.696 -3.022 -3.840 67 2HB PRO 7 1HB PRO 7 -1.858 -4.361 -3.836 68 1HG PRO 7 2HG PRO 7 -2.191 -1.605 -4.769 69 2HG PRO 7 1HG PRO 7 -3.108 -3.057 -5.184 70 1HD PRO 7 2HD PRO 7 -3.835 -0.974 -3.366 71 2HD PRO 7 1HD PRO 7 -4.749 -2.444 -3.757 72 H TRP 8 H TRP 8 -0.233 -3.170 -0.294 73 HA TRP 8 HA TRP 8 1.192 -0.727 -0.842 74 1HB TRP 8 2HB TRP 8 -1.120 0.045 -0.037 75 2HB TRP 8 1HB TRP 8 -0.695 -0.641 1.518 76 HD1 TRP 8 HD1 TRP 8 1.712 1.341 -0.783 77 HE1 TRP 8 1HE TRP 8 2.523 3.394 0.553 78 HE3 TRP 8 3HE TRP 8 -1.157 0.819 3.336 79 HZ2 TRP 8 2HZ TRP 8 1.996 4.653 3.092 80 HZ3 TRP 8 3HZ TRP 8 -1.006 2.434 5.228 81 HH2 TRP 8 HH2 TRP 8 0.563 4.355 5.103 82 H TRP 9 H TRP 9 2.720 -2.647 -0.407 83 HA TRP 9 HA TRP 9 2.993 -3.468 2.412 84 1HB TRP 9 2HB TRP 9 3.866 -4.301 -0.253 85 2HB TRP 9 1HB TRP 9 5.153 -4.380 0.936 86 HD1 TRP 9 HD1 TRP 9 5.098 -7.049 0.971 87 HE1 TRP 9 1HE TRP 9 3.468 -8.701 2.101 88 HE3 TRP 9 3HE TRP 9 1.256 -3.901 1.975 89 HZ2 TRP 9 2HZ TRP 9 0.853 -8.672 3.286 90 HZ3 TRP 9 3HZ TRP 9 -0.803 -4.709 3.106 91 HH2 TRP 9 HH2 TRP 9 -1.007 -7.095 3.761 92 HA PRO 10 HA PRO 10 5.742 0.080 2.881 93 1HB PRO 10 2HB PRO 10 5.816 -0.033 5.615 94 2HB PRO 10 1HB PRO 10 4.483 0.720 4.717 95 1HG PRO 10 2HG PRO 10 4.630 -1.967 5.986 96 2HG PRO 10 1HG PRO 10 3.277 -0.826 5.908 97 1HD PRO 10 2HD PRO 10 3.492 -3.020 4.306 98 2HD PRO 10 1HD PRO 10 2.618 -1.543 3.841 99 H TRP 11 H TRP 11 7.969 0.175 3.412 100 HA TRP 11 HA TRP 11 9.755 -1.746 2.964 101 1HB TRP 11 2HB TRP 11 10.772 -0.618 5.340 102 2HB TRP 11 1HB TRP 11 11.122 -0.154 3.693 103 HD1 TRP 11 HD1 TRP 11 8.312 0.499 6.259 104 HE1 TRP 11 1HE TRP 11 7.604 2.981 6.006 105 HE3 TRP 11 3HE TRP 11 11.284 1.760 2.432 106 HZ2 TRP 11 2HZ TRP 11 8.268 5.232 4.315 107 HZ3 TRP 11 3HZ TRP 11 11.278 4.067 1.465 108 HH2 TRP 11 HH2 TRP 11 9.763 5.799 2.407 109 H ARG 12 H ARG 12 8.681 -1.304 6.297 110 HA ARG 12 HA ARG 12 9.778 -3.307 7.720 111 1HB ARG 12 2HB ARG 12 7.394 -1.818 7.810 112 2HB ARG 12 1HB ARG 12 6.922 -3.490 8.079 113 1HG ARG 12 2HG ARG 12 8.977 -1.902 9.629 114 2HG ARG 12 1HG ARG 12 7.451 -2.546 10.231 115 1HD ARG 12 2HD ARG 12 9.898 -4.127 9.374 116 2HD ARG 12 1HD ARG 12 9.150 -4.074 10.982 117 HE ARG 12 HE ARG 12 8.190 -5.638 8.719 118 1HH1 ARG 12 1HH2 ARG 12 7.957 -5.463 11.964 119 2HH1 ARG 12 2HH2 ARG 12 6.242 -5.676 12.080 120 1HH2 ARG 12 2HH1 ARG 12 5.695 -5.247 8.682 121 2HH2 ARG 12 1HH1 ARG 12 4.961 -5.553 10.220 122 H ARG 13 H ARG 13 10.189 -5.425 7.303 123 HA ARG 13 HA ARG 13 8.492 -6.909 5.376 124 1HB ARG 13 2HB ARG 13 11.235 -6.780 6.166 125 2HB ARG 13 1HB ARG 13 10.661 -8.416 6.486 126 1HG ARG 13 2HG ARG 13 9.720 -8.470 4.153 127 2HG ARG 13 1HG ARG 13 10.502 -6.916 3.858 128 1HD ARG 13 2HD ARG 13 12.211 -9.100 4.980 129 2HD ARG 13 1HD ARG 13 11.747 -9.216 3.271 130 HE ARG 13 HE ARG 13 12.736 -6.582 4.187 131 1HH1 ARG 13 1HH1 ARG 13 13.905 -9.645 3.325 132 2HH1 ARG 13 2HH1 ARG 13 15.013 -9.063 2.129 133 1HH2 ARG 13 1HH2 ARG 13 13.904 -5.783 2.315 134 2HH2 ARG 13 2HH2 ARG 13 15.013 -6.876 1.559 135 1HN NH2 14 1HT ARG 13 8.024 -9.310 6.068 136 2HN NH2 14 2HT ARG 13 7.520 -9.565 7.670 Start of MODEL 13 1 1H ILE 1 1H ILE 1 -11.501 0.358 -7.665 2 2H ILE 1 2H ILE 1 -10.340 0.289 -6.427 3 3H ILE 1 3H ILE 1 -11.624 1.396 -6.330 4 HA ILE 1 HA ILE 1 -13.118 -0.707 -6.421 5 HB ILE 1 HB ILE 1 -10.535 -1.814 -5.300 6 1HG1 ILE 1 2HG1 ILE 1 -11.633 -2.046 -8.121 7 2HG1 ILE 1 1HG1 ILE 1 -10.138 -1.240 -7.651 8 1HG2 ILE 1 1HG2 ILE 1 -11.898 -3.938 -6.148 9 2HG2 ILE 1 2HG2 ILE 1 -13.267 -2.844 -5.952 10 3HG2 ILE 1 3HG2 ILE 1 -12.230 -3.214 -4.574 11 1HD1 ILE 1 1HD1 ILE 1 -10.216 -3.810 -8.491 12 2HD1 ILE 1 2HD1 ILE 1 -10.433 -4.055 -6.758 13 3HD1 ILE 1 3HD1 ILE 1 -9.007 -3.207 -7.356 14 H LEU 2 H LEU 2 -13.768 -1.549 -4.187 15 HA LEU 2 HA LEU 2 -14.140 0.426 -2.287 16 1HB LEU 2 2HB LEU 2 -13.986 -2.546 -2.307 17 2HB LEU 2 1HB LEU 2 -13.967 -1.777 -0.720 18 HG LEU 2 HG LEU 2 -16.029 -1.199 -2.865 19 1HD1 LEU 2 1HD1 LEU 2 -17.219 -2.975 -2.149 20 2HD1 LEU 2 2HD1 LEU 2 -17.001 -2.507 -0.463 21 3HD1 LEU 2 3HD1 LEU 2 -15.783 -3.496 -1.267 22 1HD2 LEU 2 1HD2 LEU 2 -17.232 -0.184 -0.896 23 2HD2 LEU 2 2HD2 LEU 2 -15.739 0.654 -1.325 24 3HD2 LEU 2 3HD2 LEU 2 -15.771 -0.438 0.061 25 HA PRO 3 HA PRO 3 -10.099 1.186 -0.673 26 1HB PRO 3 2HB PRO 3 -10.851 2.632 1.523 27 2HB PRO 3 1HB PRO 3 -10.885 3.289 -0.125 28 1HG PRO 3 2HG PRO 3 -13.115 2.260 1.549 29 2HG PRO 3 1HG PRO 3 -13.088 3.613 0.408 30 1HD PRO 3 2HD PRO 3 -14.155 1.150 -0.153 31 2HD PRO 3 1HD PRO 3 -13.544 2.277 -1.383 32 H TRP 4 H TRP 4 -10.654 -1.393 -0.153 33 HA TRP 4 HA TRP 4 -10.279 -1.679 2.796 34 1HB TRP 4 2HB TRP 4 -12.274 -2.705 1.002 35 2HB TRP 4 1HB TRP 4 -11.380 -4.039 1.712 36 HD1 TRP 4 HD1 TRP 4 -11.257 -4.077 4.466 37 HE1 TRP 4 1HE TRP 4 -13.012 -3.265 6.179 38 HE3 TRP 4 3HE TRP 4 -14.044 -1.100 1.464 39 HZ2 TRP 4 2HZ TRP 4 -15.321 -1.553 6.244 40 HZ3 TRP 4 3HZ TRP 4 -16.023 0.123 2.347 41 HH2 TRP 4 HH2 TRP 4 -16.662 -0.103 4.736 42 H LYS 5 H LYS 5 -10.111 -3.899 0.092 43 HA LYS 5 HA LYS 5 -7.591 -5.044 1.042 44 1HB LYS 5 2HB LYS 5 -9.268 -5.472 -1.454 45 2HB LYS 5 1HB LYS 5 -7.954 -6.519 -0.925 46 1HG LYS 5 2HG LYS 5 -9.270 -6.676 1.311 47 2HG LYS 5 1HG LYS 5 -10.635 -6.069 0.372 48 1HD LYS 5 2HD LYS 5 -10.792 -8.450 0.264 49 2HD LYS 5 1HD LYS 5 -10.142 -7.942 -1.296 50 1HE LYS 5 2HE LYS 5 -8.651 -9.658 -0.747 51 2HE LYS 5 1HE LYS 5 -7.810 -8.265 -0.038 52 1HZ LYS 5 1HZ LYS 5 -9.542 -8.860 1.899 53 2HZ LYS 5 2HZ LYS 5 -7.960 -9.473 1.844 54 3HZ LYS 5 3HZ LYS 5 -9.258 -10.412 1.279 55 H TRP 6 H TRP 6 -6.974 -2.440 0.612 56 HA TRP 6 HA TRP 6 -6.099 -1.921 -2.133 57 1HB TRP 6 2HB TRP 6 -6.399 -0.556 0.420 58 2HB TRP 6 1HB TRP 6 -4.905 -0.122 -0.377 59 HD1 TRP 6 HD1 TRP 6 -8.663 -0.295 -1.105 60 HE1 TRP 6 1HE TRP 6 -9.213 1.479 -2.904 61 HE3 TRP 6 3HE TRP 6 -3.990 1.332 -2.097 62 HZ2 TRP 6 2HZ TRP 6 -7.799 3.360 -4.561 63 HZ3 TRP 6 3HZ TRP 6 -3.576 3.116 -3.785 64 HH2 TRP 6 HH2 TRP 6 -5.479 4.129 -5.017 65 HA PRO 7 HA PRO 7 -2.147 -3.809 -1.669 66 1HB PRO 7 2HB PRO 7 -0.942 -2.680 -3.849 67 2HB PRO 7 1HB PRO 7 -2.154 -3.971 -3.975 68 1HG PRO 7 2HG PRO 7 -2.433 -1.062 -4.455 69 2HG PRO 7 1HG PRO 7 -3.245 -2.424 -5.241 70 1HD PRO 7 2HD PRO 7 -4.362 -0.799 -3.291 71 2HD PRO 7 1HD PRO 7 -4.948 -2.415 -3.740 72 H TRP 8 H TRP 8 -0.275 -3.241 -0.570 73 HA TRP 8 HA TRP 8 1.098 -0.741 -0.780 74 1HB TRP 8 2HB TRP 8 -0.964 0.136 0.210 75 2HB TRP 8 1HB TRP 8 -0.857 -1.047 1.508 76 HD1 TRP 8 HD1 TRP 8 2.274 0.763 0.258 77 HE1 TRP 8 1HE TRP 8 3.144 2.267 2.169 78 HE3 TRP 8 3HE TRP 8 -1.552 0.254 3.508 79 HZ2 TRP 8 2HZ TRP 8 2.289 3.138 4.777 80 HZ3 TRP 8 3HZ TRP 8 -1.534 1.411 5.715 81 HH2 TRP 8 HH2 TRP 8 0.384 2.857 6.346 82 H TRP 9 H TRP 9 3.008 -1.960 -0.527 83 HA TRP 9 HA TRP 9 3.283 -3.529 1.995 84 1HB TRP 9 2HB TRP 9 3.622 -4.328 -0.554 85 2HB TRP 9 1HB TRP 9 5.233 -3.718 -0.228 86 HD1 TRP 9 HD1 TRP 9 6.661 -5.802 0.287 87 HE1 TRP 9 1HE TRP 9 6.427 -7.794 1.917 88 HE3 TRP 9 3HE TRP 9 2.013 -4.892 2.037 89 HZ2 TRP 9 2HZ TRP 9 4.475 -8.855 3.744 90 HZ3 TRP 9 3HZ TRP 9 0.953 -6.387 3.727 91 HH2 TRP 9 HH2 TRP 9 2.184 -8.367 4.581 92 HA PRO 10 HA PRO 10 5.910 0.127 2.761 93 1HB PRO 10 2HB PRO 10 5.614 0.042 5.481 94 2HB PRO 10 1HB PRO 10 4.444 0.837 4.405 95 1HG PRO 10 2HG PRO 10 4.310 -1.844 5.696 96 2HG PRO 10 1HG PRO 10 3.029 -0.649 5.442 97 1HD PRO 10 2HD PRO 10 3.343 -2.862 3.885 98 2HD PRO 10 1HD PRO 10 2.624 -1.345 3.297 99 H TRP 11 H TRP 11 7.956 -0.737 2.348 100 HA TRP 11 HA TRP 11 9.268 -2.974 2.958 101 1HB TRP 11 2HB TRP 11 11.105 -1.017 3.831 102 2HB TRP 11 1HB TRP 11 10.972 -1.731 2.238 103 HD1 TRP 11 HD1 TRP 11 9.216 1.079 4.224 104 HE1 TRP 11 1HE TRP 11 8.725 3.007 2.558 105 HE3 TRP 11 3HE TRP 11 10.926 -1.071 0.037 106 HZ2 TRP 11 2HZ TRP 11 9.047 3.518 -0.270 107 HZ3 TRP 11 3HZ TRP 11 10.849 0.104 -2.170 108 HH2 TRP 11 HH2 TRP 11 9.905 2.399 -2.319 109 H ARG 12 H ARG 12 9.455 -0.365 5.330 110 HA ARG 12 HA ARG 12 10.526 -1.819 7.478 111 1HB ARG 12 2HB ARG 12 9.350 0.719 7.003 112 2HB ARG 12 1HB ARG 12 8.562 0.050 8.424 113 1HG ARG 12 2HG ARG 12 11.540 0.387 7.993 114 2HG ARG 12 1HG ARG 12 10.531 1.262 9.147 115 1HD ARG 12 2HD ARG 12 11.249 -1.685 9.192 116 2HD ARG 12 1HD ARG 12 11.595 -0.460 10.430 117 HE ARG 12 HE ARG 12 9.067 -1.835 10.094 118 1HH1 ARG 12 2HH1 ARG 12 10.667 1.059 11.077 119 2HH1 ARG 12 1HH1 ARG 12 9.326 1.641 12.005 120 1HH2 ARG 12 1HH2 ARG 12 7.277 -1.047 11.236 121 2HH2 ARG 12 2HH2 ARG 12 7.410 0.449 12.096 122 H ARG 13 H ARG 13 9.699 -3.801 8.098 123 HA ARG 13 HA ARG 13 6.745 -4.119 8.314 124 1HB ARG 13 2HB ARG 13 7.651 -5.860 7.056 125 2HB ARG 13 1HB ARG 13 9.162 -5.859 7.959 126 1HG ARG 13 2HG ARG 13 7.987 -7.858 8.564 127 2HG ARG 13 1HG ARG 13 7.866 -6.759 9.938 128 1HD ARG 13 2HD ARG 13 5.608 -6.868 9.808 129 2HD ARG 13 1HD ARG 13 5.677 -6.218 8.158 130 HE ARG 13 HE ARG 13 6.373 -8.763 7.660 131 1HH1 ARG 13 1HH1 ARG 13 3.471 -7.361 8.192 132 2HH1 ARG 13 2HH1 ARG 13 2.645 -8.772 8.763 133 1HH2 ARG 13 1HH2 ARG 13 5.539 -10.656 9.086 134 2HH2 ARG 13 2HH2 ARG 13 3.818 -10.638 9.270 135 1HN NH2 14 1HT ARG 13 6.064 -3.475 10.404 136 2HN NH2 14 2HT ARG 13 6.826 -3.934 11.849 Start of MODEL 14 1 1H ILE 1 1H ILE 1 -16.585 -6.020 5.888 2 2H ILE 1 2H ILE 1 -17.329 -7.543 5.766 3 3H ILE 1 3H ILE 1 -18.030 -6.189 5.018 4 HA ILE 1 HA ILE 1 -16.659 -7.865 3.604 5 HB ILE 1 HB ILE 1 -17.740 -5.508 3.233 6 1HG1 ILE 1 2HG1 ILE 1 -16.009 -5.504 1.066 7 2HG1 ILE 1 1HG1 ILE 1 -15.974 -7.181 1.612 8 1HG2 ILE 1 1HG2 ILE 1 -15.571 -4.554 4.388 9 2HG2 ILE 1 2HG2 ILE 1 -16.332 -3.689 3.052 10 3HG2 ILE 1 3HG2 ILE 1 -14.909 -4.690 2.761 11 1HD1 ILE 1 1HD1 ILE 1 -18.003 -7.535 0.709 12 2HD1 ILE 1 2HD1 ILE 1 -18.022 -5.870 0.127 13 3HD1 ILE 1 3HD1 ILE 1 -18.682 -6.256 1.715 14 H LEU 2 H LEU 2 -14.381 -6.455 2.482 15 HA LEU 2 HA LEU 2 -12.335 -7.151 4.558 16 1HB LEU 2 2HB LEU 2 -12.512 -7.321 1.558 17 2HB LEU 2 1HB LEU 2 -10.934 -7.308 2.348 18 HG LEU 2 HG LEU 2 -12.512 -9.117 3.824 19 1HD1 LEU 2 1HD1 LEU 2 -14.112 -9.294 2.024 20 2HD1 LEU 2 2HD1 LEU 2 -13.107 -10.743 1.984 21 3HD1 LEU 2 3HD1 LEU 2 -12.824 -9.443 0.828 22 1HD2 LEU 2 1HD2 LEU 2 -10.746 -10.311 1.808 23 2HD2 LEU 2 2HD2 LEU 2 -10.626 -10.350 3.568 24 3HD2 LEU 2 3HD2 LEU 2 -9.995 -8.968 2.672 25 HA PRO 3 HA PRO 3 -11.754 -2.671 4.182 26 1HB PRO 3 2HB PRO 3 -10.672 -2.373 6.673 27 2HB PRO 3 1HB PRO 3 -12.422 -2.452 6.384 28 1HG PRO 3 2HG PRO 3 -10.576 -4.536 7.412 29 2HG PRO 3 1HG PRO 3 -12.266 -4.215 7.830 30 1HD PRO 3 2HD PRO 3 -11.415 -6.233 6.150 31 2HD PRO 3 1HD PRO 3 -13.053 -5.546 6.164 32 H TRP 4 H TRP 4 -9.653 -5.292 4.269 33 HA TRP 4 HA TRP 4 -7.246 -3.550 4.189 34 1HB TRP 4 2HB TRP 4 -6.258 -6.029 4.420 35 2HB TRP 4 1HB TRP 4 -6.695 -5.044 5.805 36 HD1 TRP 4 HD1 TRP 4 -8.490 -7.449 3.405 37 HE1 TRP 4 1HE TRP 4 -10.116 -8.907 4.808 38 HE3 TRP 4 3HE TRP 4 -7.672 -5.411 7.941 39 HZ2 TRP 4 2HZ TRP 4 -10.947 -9.134 7.561 40 HZ3 TRP 4 3HZ TRP 4 -8.875 -6.232 9.965 41 HH2 TRP 4 HH2 TRP 4 -10.513 -8.090 9.772 42 H LYS 5 H LYS 5 -9.060 -3.950 1.902 43 HA LYS 5 HA LYS 5 -7.529 -5.750 0.101 44 1HB LYS 5 2HB LYS 5 -10.131 -4.208 -0.042 45 2HB LYS 5 1HB LYS 5 -9.472 -5.076 -1.429 46 1HG LYS 5 2HG LYS 5 -9.701 -6.522 1.183 47 2HG LYS 5 1HG LYS 5 -11.163 -6.270 0.228 48 1HD LYS 5 2HD LYS 5 -8.761 -7.259 -1.230 49 2HD LYS 5 1HD LYS 5 -9.563 -8.398 -0.148 50 1HE LYS 5 2HE LYS 5 -11.430 -8.535 -1.474 51 2HE LYS 5 1HE LYS 5 -11.363 -6.818 -1.912 52 1HZ LYS 5 1HZ LYS 5 -9.381 -8.822 -2.842 53 2HZ LYS 5 2HZ LYS 5 -9.558 -7.219 -3.378 54 3HZ LYS 5 3HZ LYS 5 -10.744 -8.379 -3.747 55 H TRP 6 H TRP 6 -5.905 -3.649 0.780 56 HA TRP 6 HA TRP 6 -6.037 -1.861 -1.625 57 1HB TRP 6 2HB TRP 6 -6.179 -1.266 1.148 58 2HB TRP 6 1HB TRP 6 -4.628 -0.690 0.578 59 HD1 TRP 6 HD1 TRP 6 -8.368 -0.295 -0.080 60 HE1 TRP 6 1HE TRP 6 -8.729 1.931 -1.348 61 HE3 TRP 6 3HE TRP 6 -3.555 0.992 -0.853 62 HZ2 TRP 6 2HZ TRP 6 -7.126 4.001 -2.543 63 HZ3 TRP 6 3HZ TRP 6 -2.952 3.089 -2.055 64 HH2 TRP 6 HH2 TRP 6 -4.739 4.594 -2.900 65 HA PRO 7 HA PRO 7 -1.982 -3.452 -2.351 66 1HB PRO 7 2HB PRO 7 -1.239 -1.661 -4.282 67 2HB PRO 7 1HB PRO 7 -2.379 -2.990 -4.584 68 1HG PRO 7 2HG PRO 7 -2.914 -0.104 -4.129 69 2HG PRO 7 1HG PRO 7 -3.735 -1.255 -5.193 70 1HD PRO 7 2HD PRO 7 -4.703 -0.430 -2.758 71 2HD PRO 7 1HD PRO 7 -5.147 -1.957 -3.547 72 H TRP 8 H TRP 8 -0.412 -3.055 -0.824 73 HA TRP 8 HA TRP 8 1.102 -0.593 -0.803 74 1HB TRP 8 2HB TRP 8 -1.336 -0.650 0.665 75 2HB TRP 8 1HB TRP 8 -0.035 -0.747 1.837 76 HD1 TRP 8 HD1 TRP 8 0.215 1.225 -1.477 77 HE1 TRP 8 1HE TRP 8 0.562 3.709 -0.867 78 HE3 TRP 8 3HE TRP 8 -0.365 0.941 3.541 79 HZ2 TRP 8 2HZ TRP 8 0.587 5.365 1.488 80 HZ3 TRP 8 3HZ TRP 8 -0.176 2.964 4.974 81 HH2 TRP 8 HH2 TRP 8 0.297 5.178 3.950 82 H TRP 9 H TRP 9 2.946 -1.937 -0.740 83 HA TRP 9 HA TRP 9 3.215 -3.675 1.670 84 1HB TRP 9 2HB TRP 9 3.178 -4.600 -0.731 85 2HB TRP 9 1HB TRP 9 4.771 -3.881 -0.906 86 HD1 TRP 9 HD1 TRP 9 4.869 -6.830 -1.229 87 HE1 TRP 9 1HE TRP 9 5.842 -8.434 0.535 88 HE3 TRP 9 3HE TRP 9 4.514 -3.898 2.926 89 HZ2 TRP 9 2HZ TRP 9 6.393 -8.471 3.339 90 HZ3 TRP 9 3HZ TRP 9 5.266 -4.735 5.131 91 HH2 TRP 9 HH2 TRP 9 6.208 -7.020 5.343 92 HA PRO 10 HA PRO 10 6.332 -0.236 1.912 93 1HB PRO 10 2HB PRO 10 5.762 0.501 4.485 94 2HB PRO 10 1HB PRO 10 4.919 1.176 3.075 95 1HG PRO 10 2HG PRO 10 4.031 -0.907 4.995 96 2HG PRO 10 1HG PRO 10 3.093 0.350 4.176 97 1HD PRO 10 2HD PRO 10 3.141 -2.293 3.421 98 2HD PRO 10 1HD PRO 10 2.730 -0.949 2.337 99 H TRP 11 H TRP 11 8.283 -0.269 3.259 100 HA TRP 11 HA TRP 11 9.170 -2.895 3.986 101 1HB TRP 11 2HB TRP 11 10.374 -0.570 3.380 102 2HB TRP 11 1HB TRP 11 10.506 -0.504 5.124 103 HD1 TRP 11 HD1 TRP 11 11.650 -2.816 6.279 104 HE1 TRP 11 1HE TRP 11 13.594 -4.232 5.324 105 HE3 TRP 11 3HE TRP 11 11.462 -1.301 1.485 106 HZ2 TRP 11 2HZ TRP 11 14.899 -4.647 2.783 107 HZ3 TRP 11 3HZ TRP 11 13.047 -2.193 -0.228 108 HH2 TRP 11 HH2 TRP 11 14.765 -3.866 0.425 109 H ARG 12 H ARG 12 7.618 -0.363 5.812 110 HA ARG 12 HA ARG 12 7.843 -2.060 8.273 111 1HB ARG 12 2HB ARG 12 8.687 0.601 7.740 112 2HB ARG 12 1HB ARG 12 7.350 0.681 8.878 113 1HG ARG 12 2HG ARG 12 9.837 -1.023 9.179 114 2HG ARG 12 1HG ARG 12 9.478 0.450 10.081 115 1HD ARG 12 2HD ARG 12 7.497 -1.822 10.112 116 2HD ARG 12 1HD ARG 12 8.911 -1.865 11.184 117 HE ARG 12 HE ARG 12 6.718 0.122 11.301 118 1HH1 ARG 12 1HH2 ARG 12 7.916 -1.477 13.615 119 2HH1 ARG 12 2HH2 ARG 12 8.811 -0.245 14.437 120 1HH2 ARG 12 2HH1 ARG 12 8.712 1.977 11.778 121 2HH2 ARG 12 1HH1 ARG 12 9.262 1.710 13.399 122 H ARG 13 H ARG 13 6.138 -0.439 9.776 123 HA ARG 13 HA ARG 13 3.653 -1.483 9.676 124 1HB ARG 13 2HB ARG 13 4.894 0.604 10.927 125 2HB ARG 13 1HB ARG 13 3.658 1.452 9.998 126 1HG ARG 13 2HG ARG 13 1.896 0.295 11.050 127 2HG ARG 13 1HG ARG 13 2.963 -0.991 11.616 128 1HD ARG 13 2HD ARG 13 2.752 0.216 13.591 129 2HD ARG 13 1HD ARG 13 4.128 1.084 12.882 130 HE ARG 13 HE ARG 13 1.418 2.027 12.140 131 1HH1 ARG 13 1HH1 ARG 13 4.406 3.205 12.232 132 2HH1 ARG 13 2HH1 ARG 13 4.120 4.519 13.324 133 1HH2 ARG 13 1HH2 ARG 13 0.996 3.377 14.298 134 2HH2 ARG 13 2HH2 ARG 13 2.189 4.614 14.494 135 1HN NH2 14 1HT ARG 13 4.667 1.302 7.620 136 2HN NH2 14 2HT ARG 13 3.367 1.181 6.534 Start of MODEL 15 1 1H ILE 1 1H ILE 1 -13.631 -8.914 -7.102 2 2H ILE 1 2H ILE 1 -13.080 -10.302 -6.294 3 3H ILE 1 3H ILE 1 -12.243 -9.721 -7.652 4 HA ILE 1 HA ILE 1 -11.123 -9.174 -5.522 5 HB ILE 1 HB ILE 1 -10.788 -6.817 -6.205 6 1HG1 ILE 1 2HG1 ILE 1 -13.377 -6.625 -6.666 7 2HG1 ILE 1 1HG1 ILE 1 -12.244 -5.655 -7.602 8 1HG2 ILE 1 1HG2 ILE 1 -9.816 -8.736 -7.514 9 2HG2 ILE 1 2HG2 ILE 1 -10.031 -7.257 -8.449 10 3HG2 ILE 1 3HG2 ILE 1 -11.170 -8.590 -8.633 11 1HD1 ILE 1 1HD1 ILE 1 -12.714 -8.308 -8.766 12 2HD1 ILE 1 2HD1 ILE 1 -12.765 -6.721 -9.531 13 3HD1 ILE 1 3HD1 ILE 1 -14.175 -7.328 -8.663 14 H LEU 2 H LEU 2 -11.249 -8.021 -3.531 15 HA LEU 2 HA LEU 2 -14.018 -7.191 -2.745 16 1HB LEU 2 2HB LEU 2 -13.660 -8.852 -1.231 17 2HB LEU 2 1HB LEU 2 -11.945 -8.930 -1.620 18 HG LEU 2 HG LEU 2 -11.575 -6.917 -0.184 19 1HD1 LEU 2 1HD1 LEU 2 -13.662 -6.696 1.490 20 2HD1 LEU 2 2HD1 LEU 2 -14.538 -7.171 0.035 21 3HD1 LEU 2 3HD1 LEU 2 -13.532 -5.723 0.024 22 1HD2 LEU 2 1HD2 LEU 2 -11.035 -8.681 1.155 23 2HD2 LEU 2 2HD2 LEU 2 -12.499 -9.567 0.730 24 3HD2 LEU 2 3HD2 LEU 2 -12.557 -8.314 1.970 25 HA PRO 3 HA PRO 3 -12.128 -3.189 -2.323 26 1HB PRO 3 2HB PRO 3 -14.298 -1.928 -1.233 27 2HB PRO 3 1HB PRO 3 -14.172 -2.313 -2.962 28 1HG PRO 3 2HG PRO 3 -15.674 -3.718 -0.813 29 2HG PRO 3 1HG PRO 3 -16.121 -3.432 -2.502 30 1HD PRO 3 2HD PRO 3 -15.171 -5.817 -1.563 31 2HD PRO 3 1HD PRO 3 -14.995 -5.273 -3.246 32 H TRP 4 H TRP 4 -10.609 -3.672 -0.635 33 HA TRP 4 HA TRP 4 -11.145 -2.544 1.938 34 1HB TRP 4 2HB TRP 4 -12.453 -4.826 1.733 35 2HB TRP 4 1HB TRP 4 -10.877 -5.516 2.100 36 HD1 TRP 4 HD1 TRP 4 -9.646 -4.157 4.334 37 HE1 TRP 4 1HE TRP 4 -10.784 -3.666 6.599 38 HE3 TRP 4 3HE TRP 4 -14.526 -4.494 2.939 39 HZ2 TRP 4 2HZ TRP 4 -13.433 -3.447 7.672 40 HZ3 TRP 4 3HZ TRP 4 -16.347 -4.144 4.589 41 HH2 TRP 4 HH2 TRP 4 -15.805 -3.619 6.954 42 H LYS 5 H LYS 5 -9.331 -5.112 0.380 43 HA LYS 5 HA LYS 5 -6.882 -4.468 1.899 44 1HB LYS 5 2HB LYS 5 -7.781 -6.546 -0.091 45 2HB LYS 5 1HB LYS 5 -6.072 -6.390 0.322 46 1HG LYS 5 2HG LYS 5 -6.685 -7.880 1.963 47 2HG LYS 5 1HG LYS 5 -7.087 -6.382 2.805 48 1HD LYS 5 2HD LYS 5 -9.415 -6.626 1.692 49 2HD LYS 5 1HD LYS 5 -8.940 -8.298 1.397 50 1HE LYS 5 2HE LYS 5 -8.667 -8.727 3.754 51 2HE LYS 5 1HE LYS 5 -8.845 -7.003 4.141 52 1HZ LYS 5 1HZ LYS 5 -10.998 -7.638 4.399 53 2HZ LYS 5 2HZ LYS 5 -10.874 -8.939 3.312 54 3HZ LYS 5 3HZ LYS 5 -11.033 -7.351 2.729 55 H TRP 6 H TRP 6 -5.662 -2.770 1.165 56 HA TRP 6 HA TRP 6 -5.656 -2.137 -1.752 57 1HB TRP 6 2HB TRP 6 -5.643 -0.678 0.733 58 2HB TRP 6 1HB TRP 6 -4.246 -0.231 -0.222 59 HD1 TRP 6 HD1 TRP 6 -8.059 -0.435 -0.494 60 HE1 TRP 6 1HE TRP 6 -8.825 1.243 -2.308 61 HE3 TRP 6 3HE TRP 6 -3.544 1.086 -2.155 62 HZ2 TRP 6 2HZ TRP 6 -7.624 3.014 -4.233 63 HZ3 TRP 6 3HZ TRP 6 -3.338 2.767 -3.981 64 HH2 TRP 6 HH2 TRP 6 -5.378 3.731 -5.018 65 HA PRO 7 HA PRO 7 -1.564 -3.717 -2.094 66 1HB PRO 7 2HB PRO 7 -0.792 -2.377 -4.349 67 2HB PRO 7 1HB PRO 7 -1.931 -3.737 -4.377 68 1HG PRO 7 2HG PRO 7 -2.464 -0.821 -4.552 69 2HG PRO 7 1HG PRO 7 -3.278 -2.170 -5.357 70 1HD PRO 7 2HD PRO 7 -4.268 -0.845 -3.160 71 2HD PRO 7 1HD PRO 7 -4.710 -2.505 -3.615 72 H TRP 8 H TRP 8 -1.040 -2.392 -0.061 73 HA TRP 8 HA TRP 8 0.753 -0.087 -0.753 74 1HB TRP 8 2HB TRP 8 -1.324 0.579 0.411 75 2HB TRP 8 1HB TRP 8 -0.968 -0.575 1.686 76 HD1 TRP 8 HD1 TRP 8 1.675 1.718 0.072 77 HE1 TRP 8 1HE TRP 8 2.613 3.248 1.934 78 HE3 TRP 8 3HE TRP 8 -1.419 0.415 3.829 79 HZ2 TRP 8 2HZ TRP 8 2.084 3.825 4.708 80 HZ3 TRP 8 3HZ TRP 8 -1.213 1.435 6.094 81 HH2 TRP 8 HH2 TRP 8 0.534 3.145 6.533 82 H TRP 9 H TRP 9 1.786 -2.715 -0.699 83 HA TRP 9 HA TRP 9 2.704 -3.800 1.698 84 1HB TRP 9 2HB TRP 9 3.955 -3.420 -1.023 85 2HB TRP 9 1HB TRP 9 4.672 -4.425 0.219 86 HD1 TRP 9 HD1 TRP 9 4.125 -6.222 -1.949 87 HE1 TRP 9 1HE TRP 9 2.100 -7.805 -2.123 88 HE3 TRP 9 3HE TRP 9 0.925 -3.929 1.298 89 HZ2 TRP 9 2HZ TRP 9 -0.529 -8.066 -1.031 90 HZ3 TRP 9 3HZ TRP 9 -1.330 -4.862 1.715 91 HH2 TRP 9 HH2 TRP 9 -2.062 -6.928 0.556 92 HA PRO 10 HA PRO 10 4.960 -0.103 3.036 93 1HB PRO 10 2HB PRO 10 5.223 -0.942 5.633 94 2HB PRO 10 1HB PRO 10 3.755 -0.162 5.010 95 1HG PRO 10 2HG PRO 10 4.319 -3.057 5.446 96 2HG PRO 10 1HG PRO 10 2.845 -2.133 5.780 97 1HD PRO 10 2HD PRO 10 3.106 -3.716 3.600 98 2HD PRO 10 1HD PRO 10 2.122 -2.234 3.601 99 H TRP 11 H TRP 11 6.942 -0.520 5.035 100 HA TRP 11 HA TRP 11 8.965 -1.980 3.452 101 1HB TRP 11 2HB TRP 11 8.938 0.342 4.942 102 2HB TRP 11 1HB TRP 11 9.769 -0.780 5.996 103 HD1 TRP 11 HD1 TRP 11 11.955 -2.087 4.850 104 HE1 TRP 11 1HE TRP 11 13.616 -1.158 3.098 105 HE3 TRP 11 3HE TRP 11 9.223 1.766 3.125 106 HZ2 TRP 11 2HZ TRP 11 13.733 1.000 1.183 107 HZ3 TRP 11 3HZ TRP 11 10.087 3.280 1.331 108 HH2 TRP 11 HH2 TRP 11 12.343 2.893 0.363 109 H ARG 12 H ARG 12 8.292 -1.867 6.940 110 HA ARG 12 HA ARG 12 8.821 -4.794 7.059 111 1HB ARG 12 2HB ARG 12 9.617 -4.182 9.382 112 2HB ARG 12 1HB ARG 12 10.606 -3.565 8.077 113 1HG ARG 12 2HG ARG 12 10.304 -1.790 9.677 114 2HG ARG 12 1HG ARG 12 9.331 -1.392 8.268 115 1HD ARG 12 2HD ARG 12 7.898 -3.026 10.261 116 2HD ARG 12 1HD ARG 12 8.375 -1.423 10.848 117 HE ARG 12 HE ARG 12 6.978 -1.737 8.224 118 1HH1 ARG 12 1HH2 ARG 12 8.082 0.750 9.924 119 2HH1 ARG 12 2HH2 ARG 12 6.561 1.478 10.319 120 1HH2 ARG 12 2HH1 ARG 12 4.692 -1.273 9.337 121 2HH2 ARG 12 1HH1 ARG 12 4.640 0.331 9.986 122 H ARG 13 H ARG 13 7.910 -5.490 9.451 123 HA ARG 13 HA ARG 13 5.039 -4.662 9.436 124 1HB ARG 13 2HB ARG 13 5.204 -6.960 8.994 125 2HB ARG 13 1HB ARG 13 6.597 -7.161 10.056 126 1HG ARG 13 2HG ARG 13 5.290 -7.602 11.833 127 2HG ARG 13 1HG ARG 13 4.269 -6.199 11.513 128 1HD ARG 13 2HD ARG 13 4.053 -8.832 10.008 129 2HD ARG 13 1HD ARG 13 2.992 -8.351 11.347 130 HE ARG 13 HE ARG 13 2.922 -6.168 9.645 131 1HH1 ARG 13 1HH1 ARG 13 3.363 -8.961 8.029 132 2HH1 ARG 13 2HH1 ARG 13 1.783 -9.067 7.327 133 1HH2 ARG 13 1HH2 ARG 13 0.448 -6.548 9.299 134 2HH2 ARG 13 2HH2 ARG 13 0.133 -7.701 8.046 135 1HN NH2 14 1HT ARG 13 5.358 -2.796 10.913 136 2HN NH2 14 2HT ARG 13 5.747 -3.030 12.548 Start of MODEL 16 1 1H ILE 1 1H ILE 1 -17.717 -9.455 0.931 2 2H ILE 1 2H ILE 1 -16.245 -9.244 0.112 3 3H ILE 1 3H ILE 1 -17.113 -7.892 0.662 4 HA ILE 1 HA ILE 1 -16.669 -8.400 2.928 5 HB ILE 1 HB ILE 1 -15.198 -10.586 3.186 6 1HG1 ILE 1 2HG1 ILE 1 -16.803 -11.231 0.694 7 2HG1 ILE 1 1HG1 ILE 1 -15.073 -10.895 0.680 8 1HG2 ILE 1 1HG2 ILE 1 -17.925 -9.955 3.464 9 2HG2 ILE 1 2HG2 ILE 1 -17.069 -11.310 4.200 10 3HG2 ILE 1 3HG2 ILE 1 -17.885 -11.522 2.654 11 1HD1 ILE 1 1HD1 ILE 1 -14.613 -13.000 1.330 12 2HD1 ILE 1 2HD1 ILE 1 -16.332 -13.375 1.205 13 3HD1 ILE 1 3HD1 ILE 1 -15.660 -12.823 2.740 14 H LEU 2 H LEU 2 -14.330 -8.575 3.946 15 HA LEU 2 HA LEU 2 -12.161 -7.636 3.987 16 1HB LEU 2 2HB LEU 2 -12.506 -9.335 1.616 17 2HB LEU 2 1HB LEU 2 -11.205 -8.153 1.439 18 HG LEU 2 HG LEU 2 -11.040 -9.236 4.073 19 1HD1 LEU 2 1HD1 LEU 2 -12.325 -11.154 3.216 20 2HD1 LEU 2 2HD1 LEU 2 -10.654 -11.618 3.529 21 3HD1 LEU 2 3HD1 LEU 2 -11.193 -11.322 1.875 22 1HD2 LEU 2 1HD2 LEU 2 -8.959 -10.315 2.623 23 2HD2 LEU 2 2HD2 LEU 2 -8.964 -8.696 3.323 24 3HD2 LEU 2 3HD2 LEU 2 -9.420 -8.930 1.635 25 HA PRO 3 HA PRO 3 -13.685 -3.993 1.519 26 1HB PRO 3 2HB PRO 3 -13.981 -2.293 3.640 27 2HB PRO 3 1HB PRO 3 -15.271 -3.382 3.088 28 1HG PRO 3 2HG PRO 3 -13.414 -3.664 5.392 29 2HG PRO 3 1HG PRO 3 -15.120 -4.117 5.252 30 1HD PRO 3 2HD PRO 3 -13.034 -5.892 5.082 31 2HD PRO 3 1HD PRO 3 -14.633 -6.155 4.351 32 H TRP 4 H TRP 4 -11.029 -4.922 3.291 33 HA TRP 4 HA TRP 4 -9.634 -2.324 2.937 34 1HB TRP 4 2HB TRP 4 -7.947 -3.798 4.417 35 2HB TRP 4 1HB TRP 4 -9.214 -2.805 5.114 36 HD1 TRP 4 HD1 TRP 4 -8.906 -6.363 3.699 37 HE1 TRP 4 1HE TRP 4 -10.263 -7.951 5.238 38 HE3 TRP 4 3HE TRP 4 -10.721 -2.963 6.951 39 HZ2 TRP 4 2HZ TRP 4 -11.930 -7.746 7.582 40 HZ3 TRP 4 3HZ TRP 4 -12.199 -3.641 8.842 41 HH2 TRP 4 HH2 TRP 4 -12.805 -6.029 9.154 42 H LYS 5 H LYS 5 -10.083 -4.021 0.663 43 HA LYS 5 HA LYS 5 -7.651 -5.585 0.173 44 1HB LYS 5 2HB LYS 5 -10.150 -4.803 -1.304 45 2HB LYS 5 1HB LYS 5 -8.807 -5.520 -2.194 46 1HG LYS 5 2HG LYS 5 -8.830 -7.339 -0.341 47 2HG LYS 5 1HG LYS 5 -10.442 -6.727 0.032 48 1HD LYS 5 2HD LYS 5 -11.303 -7.863 -1.707 49 2HD LYS 5 1HD LYS 5 -10.206 -7.035 -2.812 50 1HE LYS 5 2HE LYS 5 -9.118 -9.000 -3.108 51 2HE LYS 5 1HE LYS 5 -8.640 -8.944 -1.398 52 1HZ LYS 5 1HZ LYS 5 -11.035 -9.722 -0.979 53 2HZ LYS 5 2HZ LYS 5 -9.906 -10.870 -1.524 54 3HZ LYS 5 3HZ LYS 5 -11.027 -10.195 -2.609 55 H TRP 6 H TRP 6 -6.359 -3.447 0.716 56 HA TRP 6 HA TRP 6 -6.038 -1.825 -1.789 57 1HB TRP 6 2HB TRP 6 -6.604 -1.076 0.824 58 2HB TRP 6 1HB TRP 6 -4.886 -0.777 0.679 59 HD1 TRP 6 HD1 TRP 6 -8.236 0.318 -0.739 60 HE1 TRP 6 1HE TRP 6 -7.878 2.489 -2.096 61 HE3 TRP 6 3HE TRP 6 -3.199 0.511 -0.640 62 HZ2 TRP 6 2HZ TRP 6 -5.675 4.105 -3.016 63 HZ3 TRP 6 3HZ TRP 6 -1.951 2.361 -1.750 64 HH2 TRP 6 HH2 TRP 6 -3.188 4.157 -2.937 65 HA PRO 7 HA PRO 7 -2.017 -3.670 -1.958 66 1HB PRO 7 2HB PRO 7 -1.000 -2.090 -3.945 67 2HB PRO 7 1HB PRO 7 -2.161 -3.396 -4.254 68 1HG PRO 7 2HG PRO 7 -2.605 -0.465 -4.106 69 2HG PRO 7 1HG PRO 7 -3.368 -1.672 -5.150 70 1HD PRO 7 2HD PRO 7 -4.539 -0.596 -2.906 71 2HD PRO 7 1HD PRO 7 -4.972 -2.167 -3.610 72 H TRP 8 H TRP 8 -0.207 -3.212 -0.715 73 HA TRP 8 HA TRP 8 1.138 -0.702 -0.613 74 1HB TRP 8 2HB TRP 8 -1.340 -0.725 0.723 75 2HB TRP 8 1HB TRP 8 -0.138 -0.872 1.989 76 HD1 TRP 8 HD1 TRP 8 0.435 1.151 -1.253 77 HE1 TRP 8 1HE TRP 8 0.795 3.611 -0.574 78 HE3 TRP 8 3HE TRP 8 -0.596 0.811 3.693 79 HZ2 TRP 8 2HZ TRP 8 0.656 5.232 1.799 80 HZ3 TRP 8 3HZ TRP 8 -0.482 2.814 5.167 81 HH2 TRP 8 HH2 TRP 8 0.140 5.023 4.220 82 H TRP 9 H TRP 9 3.041 -1.879 -0.428 83 HA TRP 9 HA TRP 9 3.357 -3.556 2.025 84 1HB TRP 9 2HB TRP 9 3.549 -4.309 -0.600 85 2HB TRP 9 1HB TRP 9 5.211 -3.889 -0.235 86 HD1 TRP 9 HD1 TRP 9 6.350 -6.178 0.153 87 HE1 TRP 9 1HE TRP 9 5.895 -8.162 1.749 88 HE3 TRP 9 3HE TRP 9 1.908 -4.710 2.057 89 HZ2 TRP 9 2HZ TRP 9 3.869 -9.000 3.611 90 HZ3 TRP 9 3HZ TRP 9 0.705 -6.090 3.746 91 HH2 TRP 9 HH2 TRP 9 1.685 -8.236 4.522 92 HA PRO 10 HA PRO 10 6.144 0.084 2.377 93 1HB PRO 10 2HB PRO 10 5.687 0.487 5.045 94 2HB PRO 10 1HB PRO 10 4.653 1.170 3.772 95 1HG PRO 10 2HG PRO 10 4.210 -1.211 5.496 96 2HG PRO 10 1HG PRO 10 3.052 -0.003 4.918 97 1HD PRO 10 2HD PRO 10 3.327 -2.501 3.831 98 2HD PRO 10 1HD PRO 10 2.712 -1.092 2.939 99 H TRP 11 H TRP 11 7.721 -1.743 2.027 100 HA TRP 11 HA TRP 11 8.745 -3.676 3.546 101 1HB TRP 11 2HB TRP 11 11.028 -2.080 3.118 102 2HB TRP 11 1HB TRP 11 10.435 -3.388 2.124 103 HD1 TRP 11 HD1 TRP 11 9.663 0.365 2.596 104 HE1 TRP 11 1HE TRP 11 9.163 1.350 0.254 105 HE3 TRP 11 3HE TRP 11 10.020 -3.843 -0.097 106 HZ2 TRP 11 2HZ TRP 11 8.944 0.393 -2.465 107 HZ3 TRP 11 3HZ TRP 11 9.668 -3.849 -2.573 108 HH2 TRP 11 HH2 TRP 11 9.126 -1.727 -3.752 109 H ARG 12 H ARG 12 9.778 -0.370 4.246 110 HA ARG 12 HA ARG 12 11.141 -0.697 6.618 111 1HB ARG 12 2HB ARG 12 10.200 1.624 7.076 112 2HB ARG 12 1HB ARG 12 10.942 1.419 5.498 113 1HG ARG 12 2HG ARG 12 9.004 1.899 4.463 114 2HG ARG 12 1HG ARG 12 8.157 0.661 5.391 115 1HD ARG 12 2HD ARG 12 8.845 3.215 6.799 116 2HD ARG 12 1HD ARG 12 7.492 3.229 5.651 117 HE ARG 12 HE ARG 12 7.630 1.100 7.739 118 1HH1 ARG 12 2HH1 ARG 12 6.536 4.082 8.093 119 2HH1 ARG 12 1HH1 ARG 12 4.839 3.737 8.079 120 1HH2 ARG 12 1HH2 ARG 12 5.236 0.502 6.899 121 2HH2 ARG 12 2HH2 ARG 12 4.104 1.710 7.406 122 H ARG 13 H ARG 13 10.513 -1.795 8.435 123 HA ARG 13 HA ARG 13 7.618 -1.876 9.143 124 1HB ARG 13 2HB ARG 13 8.482 -4.046 8.926 125 2HB ARG 13 1HB ARG 13 10.055 -3.586 9.580 126 1HG ARG 13 2HG ARG 13 9.414 -4.053 11.686 127 2HG ARG 13 1HG ARG 13 7.911 -3.146 11.502 128 1HD ARG 13 2HD ARG 13 8.140 -5.802 10.124 129 2HD ARG 13 1HD ARG 13 7.820 -5.770 11.870 130 HE ARG 13 HE ARG 13 6.153 -3.860 10.485 131 1HH1 ARG 13 1HH1 ARG 13 6.596 -7.237 10.373 132 2HH1 ARG 13 2HH1 ARG 13 4.919 -7.616 10.586 133 1HH2 ARG 13 1HH2 ARG 13 3.969 -4.320 11.105 134 2HH2 ARG 13 2HH2 ARG 13 3.431 -5.963 10.999 135 1HN NH2 14 1HT ARG 13 7.721 0.343 10.166 136 2HN NH2 14 2HT ARG 13 8.449 0.533 11.688
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