NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
5641 | 1hr1 | 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 -12.099 1.815 9.606 2 2H ILE 1 2H ILE 1 -13.289 0.712 10.108 3 3H ILE 1 3H ILE 1 -13.488 1.581 8.663 4 HA ILE 1 HA ILE 1 -11.241 -0.315 9.082 5 HB ILE 1 HB ILE 1 -13.512 -1.331 9.421 6 1HG1 ILE 1 2HG1 ILE 1 -13.037 -2.659 6.965 7 2HG1 ILE 1 1HG1 ILE 1 -11.464 -2.102 7.536 8 1HG2 ILE 1 1HG2 ILE 1 -15.099 -1.368 7.610 9 2HG2 ILE 1 2HG2 ILE 1 -13.956 -0.587 6.518 10 3HG2 ILE 1 3HG2 ILE 1 -14.645 0.317 7.866 11 1HD1 ILE 1 1HD1 ILE 1 -13.457 -3.655 9.213 12 2HD1 ILE 1 2HD1 ILE 1 -11.835 -3.168 9.704 13 3HD1 ILE 1 3HD1 ILE 1 -12.048 -4.359 8.420 14 H LEU 2 H LEU 2 -11.619 2.403 7.748 15 HA LEU 2 HA LEU 2 -11.607 1.784 4.866 16 1HB LEU 2 2HB LEU 2 -11.845 4.078 6.664 17 2HB LEU 2 1HB LEU 2 -10.806 4.423 5.281 18 HG LEU 2 HG LEU 2 -13.629 3.320 5.164 19 1HD1 LEU 2 1HD1 LEU 2 -12.633 5.917 4.002 20 2HD1 LEU 2 2HD1 LEU 2 -13.163 5.827 5.682 21 3HD1 LEU 2 3HD1 LEU 2 -14.288 5.442 4.381 22 1HD2 LEU 2 1HD2 LEU 2 -11.528 2.930 3.364 23 2HD2 LEU 2 2HD2 LEU 2 -12.437 4.277 2.679 24 3HD2 LEU 2 3HD2 LEU 2 -13.246 2.746 3.011 25 H ALA 3 H ALA 3 -9.694 0.508 4.565 26 HA ALA 3 HA ALA 3 -7.291 1.800 3.944 27 1HB ALA 3 1HB ALA 3 -7.686 1.134 6.824 28 2HB ALA 3 2HB ALA 3 -6.773 2.455 6.093 29 3HB ALA 3 3HB ALA 3 -6.086 0.832 6.146 30 H TRP 4 H TRP 4 -5.930 0.309 2.971 31 HA TRP 4 HA TRP 4 -5.491 -2.392 3.658 32 1HB TRP 4 2HB TRP 4 -8.117 -1.915 2.753 33 2HB TRP 4 1HB TRP 4 -7.289 -2.686 1.399 34 HD1 TRP 4 HD1 TRP 4 -9.149 -3.572 4.361 35 HE1 TRP 4 1HE TRP 4 -8.646 -5.984 5.123 36 HE3 TRP 4 3HE TRP 4 -4.924 -4.489 1.644 37 HZ2 TRP 4 2HZ TRP 4 -6.705 -8.030 4.641 38 HZ3 TRP 4 3HZ TRP 4 -3.769 -6.675 1.815 39 HH2 TRP 4 HH2 TRP 4 -4.653 -8.444 3.310 40 H LYS 5 H LYS 5 -6.433 -0.761 0.625 41 HA LYS 5 HA LYS 5 -4.251 -1.875 -0.910 42 1HB LYS 5 2HB LYS 5 -6.531 -0.939 -1.652 43 2HB LYS 5 1HB LYS 5 -5.807 0.660 -1.472 44 1HG LYS 5 2HG LYS 5 -5.130 0.373 -3.621 45 2HG LYS 5 1HG LYS 5 -3.885 -0.662 -2.922 46 1HD LYS 5 2HD LYS 5 -6.336 -2.155 -3.177 47 2HD LYS 5 1HD LYS 5 -5.931 -1.418 -4.728 48 1HE LYS 5 2HE LYS 5 -3.496 -2.410 -3.634 49 2HE LYS 5 1HE LYS 5 -4.706 -3.701 -3.488 50 1HZ LYS 5 1HZ LYS 5 -5.194 -3.614 -5.744 51 2HZ LYS 5 2HZ LYS 5 -3.505 -3.437 -5.723 52 3HZ LYS 5 3HZ LYS 5 -4.502 -2.080 -5.948 53 H TRP 6 H TRP 6 -4.276 0.453 1.508 54 HA TRP 6 HA TRP 6 -2.219 2.232 0.369 55 1HB TRP 6 2HB TRP 6 -4.144 2.334 2.450 56 2HB TRP 6 1HB TRP 6 -2.573 2.409 3.241 57 HD1 TRP 6 HD1 TRP 6 -4.980 4.716 2.166 58 HE1 TRP 6 1HE TRP 6 -3.969 6.934 1.325 59 HE3 TRP 6 3HE TRP 6 -0.140 3.258 1.426 60 HZ2 TRP 6 2HZ TRP 6 -1.443 7.954 0.453 61 HZ3 TRP 6 3HZ TRP 6 1.545 4.871 0.590 62 HH2 TRP 6 HH2 TRP 6 0.900 7.215 0.103 63 H ALA 7 H ALA 7 -2.409 -0.167 3.018 64 HA ALA 7 HA ALA 7 0.248 -0.114 3.915 65 1HB ALA 7 1HB ALA 7 -2.008 -2.039 3.781 66 2HB ALA 7 2HB ALA 7 -1.067 -1.509 5.176 67 3HB ALA 7 3HB ALA 7 -0.423 -2.747 4.097 68 H TRP 8 H TRP 8 -1.052 -1.421 0.932 69 HA TRP 8 HA TRP 8 0.887 -3.280 0.136 70 1HB TRP 8 2HB TRP 8 -0.976 -2.938 -1.268 71 2HB TRP 8 1HB TRP 8 -0.763 -1.191 -1.278 72 HD1 TRP 8 HD1 TRP 8 0.244 -0.304 -3.452 73 HE1 TRP 8 1HE TRP 8 1.731 -1.242 -5.327 74 HE3 TRP 8 3HE TRP 8 1.200 -4.918 -1.563 75 HZ2 TRP 8 2HZ TRP 8 3.148 -3.648 -5.945 76 HZ3 TRP 8 3HZ TRP 8 2.618 -6.531 -2.806 77 HH2 TRP 8 HH2 TRP 8 3.600 -5.897 -4.994 78 H TRP 9 H TRP 9 0.985 -0.167 -1.469 79 HA TRP 9 HA TRP 9 3.620 -0.117 -2.171 80 1HB TRP 9 2HB TRP 9 1.787 1.518 -2.715 81 2HB TRP 9 1HB TRP 9 2.071 2.271 -1.145 82 HD1 TRP 9 HD1 TRP 9 3.527 1.966 -4.625 83 HE1 TRP 9 1HE TRP 9 5.567 3.538 -4.823 84 HE3 TRP 9 3HE TRP 9 4.020 3.331 0.232 85 HZ2 TRP 9 2HZ TRP 9 7.200 5.167 -3.109 86 HZ3 TRP 9 3HZ TRP 9 5.814 4.883 0.953 87 HH2 TRP 9 HH2 TRP 9 7.407 5.806 -0.716 88 H ALA 10 H ALA 10 2.377 0.360 1.069 89 HA ALA 10 HA ALA 10 4.695 1.633 2.225 90 1HB ALA 10 1HB ALA 10 3.560 1.234 4.243 91 2HB ALA 10 2HB ALA 10 2.870 -0.281 3.661 92 3HB ALA 10 3HB ALA 10 2.246 1.259 3.067 93 H TRP 11 H TRP 11 3.851 -1.716 1.517 94 HA TRP 11 HA TRP 11 5.979 -2.925 3.070 95 1HB TRP 11 2HB TRP 11 4.915 -4.827 2.367 96 2HB TRP 11 1HB TRP 11 3.695 -3.725 1.737 97 HD1 TRP 11 HD1 TRP 11 3.401 -3.609 -0.834 98 HE1 TRP 11 1HE TRP 11 4.567 -4.723 -2.840 99 HE3 TRP 11 3HE TRP 11 7.372 -5.743 1.531 100 HZ2 TRP 11 2HZ TRP 11 6.876 -6.319 -3.375 101 HZ3 TRP 11 3HZ TRP 11 9.045 -7.057 0.258 102 HH2 TRP 11 HH2 TRP 11 8.803 -7.346 -2.193 103 H ARG 12 H ARG 12 5.575 -2.117 -0.367 104 HA ARG 12 HA ARG 12 7.900 -3.121 -1.489 105 1HB ARG 12 2HB ARG 12 6.542 -0.446 -1.940 106 2HB ARG 12 1HB ARG 12 7.688 -1.177 -3.059 107 1HG ARG 12 2HG ARG 12 6.126 -3.240 -3.039 108 2HG ARG 12 1HG ARG 12 4.934 -2.175 -2.295 109 1HD ARG 12 2HD ARG 12 6.180 -1.953 -5.045 110 2HD ARG 12 1HD ARG 12 4.460 -1.982 -4.607 111 HE ARG 12 HE ARG 12 4.786 0.264 -3.576 112 1HH1 ARG 12 1HH2 ARG 12 6.040 -0.308 -6.544 113 2HH1 ARG 12 2HH2 ARG 12 7.252 0.928 -6.509 114 1HH2 ARG 12 2HH1 ARG 12 6.872 1.577 -3.123 115 2HH2 ARG 12 1HH1 ARG 12 7.723 1.996 -4.572 116 H ARG 13 H ARG 13 7.554 -0.141 0.421 117 HA ARG 13 HA ARG 13 10.166 0.923 0.041 118 1HB ARG 13 2HB ARG 13 8.443 2.239 1.042 119 2HB ARG 13 1HB ARG 13 8.126 1.017 2.274 120 1HG ARG 13 2HG ARG 13 9.638 1.973 3.633 121 2HG ARG 13 1HG ARG 13 10.893 1.736 2.416 122 1HD ARG 13 2HD ARG 13 8.941 4.032 2.166 123 2HD ARG 13 1HD ARG 13 10.403 4.183 3.162 124 HE ARG 13 HE ARG 13 10.357 3.759 0.220 125 1HH1 ARG 13 1HH1 ARG 13 11.859 6.002 1.500 126 2HH1 ARG 13 2HH1 ARG 13 13.485 5.404 1.499 127 1HH2 ARG 13 1HH2 ARG 13 12.555 2.111 0.946 128 2HH2 ARG 13 2HH2 ARG 13 13.879 3.201 1.186 129 1HN NH2 14 1HN NH2 14 9.082 -0.798 3.033 130 2HN NH2 14 2HN NH2 14 10.576 -1.550 3.328 Start of MODEL 2 1 1H ILE 1 1H ILE 1 -10.896 7.692 4.492 2 2H ILE 1 2H ILE 1 -12.518 7.490 4.029 3 3H ILE 1 3H ILE 1 -11.296 6.588 3.269 4 HA ILE 1 HA ILE 1 -11.819 6.359 6.180 5 HB ILE 1 HB ILE 1 -13.081 4.958 3.803 6 1HG1 ILE 1 2HG1 ILE 1 -14.852 5.852 5.911 7 2HG1 ILE 1 1HG1 ILE 1 -13.849 7.191 5.355 8 1HG2 ILE 1 1HG2 ILE 1 -12.812 3.156 5.233 9 2HG2 ILE 1 2HG2 ILE 1 -14.319 3.819 5.866 10 3HG2 ILE 1 3HG2 ILE 1 -12.792 4.170 6.675 11 1HD1 ILE 1 1HD1 ILE 1 -15.353 5.353 3.477 12 2HD1 ILE 1 2HD1 ILE 1 -14.541 6.865 3.071 13 3HD1 ILE 1 3HD1 ILE 1 -16.002 6.886 4.059 14 H LEU 2 H LEU 2 -9.295 6.292 5.718 15 HA LEU 2 HA LEU 2 -8.227 3.930 4.409 16 1HB LEU 2 2HB LEU 2 -7.344 6.366 5.665 17 2HB LEU 2 1HB LEU 2 -6.412 5.014 6.310 18 HG LEU 2 HG LEU 2 -5.389 5.997 4.253 19 1HD1 LEU 2 1HD1 LEU 2 -5.313 3.764 2.982 20 2HD1 LEU 2 2HD1 LEU 2 -6.425 3.157 4.209 21 3HD1 LEU 2 3HD1 LEU 2 -4.821 3.726 4.674 22 1HD2 LEU 2 1HD2 LEU 2 -7.947 6.232 3.356 23 2HD2 LEU 2 2HD2 LEU 2 -7.463 4.746 2.540 24 3HD2 LEU 2 3HD2 LEU 2 -6.543 6.229 2.290 25 H ALA 3 H ALA 3 -7.448 2.015 5.418 26 HA ALA 3 HA ALA 3 -7.150 1.478 8.157 27 1HB ALA 3 1HB ALA 3 -9.964 1.433 7.109 28 2HB ALA 3 2HB ALA 3 -9.365 2.012 8.664 29 3HB ALA 3 3HB ALA 3 -9.505 0.280 8.362 30 H TRP 4 H TRP 4 -6.327 -0.605 8.314 31 HA TRP 4 HA TRP 4 -5.886 -2.870 7.753 32 1HB TRP 4 2HB TRP 4 -8.451 -2.379 6.837 33 2HB TRP 4 1HB TRP 4 -7.617 -2.921 5.380 34 HD1 TRP 4 HD1 TRP 4 -9.499 -4.304 8.096 35 HE1 TRP 4 1HE TRP 4 -8.921 -6.781 8.523 36 HE3 TRP 4 3HE TRP 4 -5.135 -4.654 5.470 37 HZ2 TRP 4 2HZ TRP 4 -6.874 -8.661 7.842 38 HZ3 TRP 4 3HZ TRP 4 -3.893 -6.797 5.376 39 HH2 TRP 4 HH2 TRP 4 -4.755 -8.798 6.558 40 H LYS 5 H LYS 5 -6.453 -0.841 4.870 41 HA LYS 5 HA LYS 5 -4.271 -2.066 3.372 42 1HB LYS 5 2HB LYS 5 -6.065 0.353 3.056 43 2HB LYS 5 1HB LYS 5 -4.809 -0.031 1.880 44 1HG LYS 5 2HG LYS 5 -6.717 -2.189 2.708 45 2HG LYS 5 1HG LYS 5 -7.262 -0.967 1.559 46 1HD LYS 5 2HD LYS 5 -5.823 -1.674 -0.090 47 2HD LYS 5 1HD LYS 5 -4.591 -2.191 1.062 48 1HE LYS 5 2HE LYS 5 -7.159 -3.705 1.118 49 2HE LYS 5 1HE LYS 5 -6.108 -3.967 -0.288 50 1HZ LYS 5 1HZ LYS 5 -5.629 -5.358 1.773 51 2HZ LYS 5 2HZ LYS 5 -5.037 -3.925 2.470 52 3HZ LYS 5 3HZ LYS 5 -4.314 -4.554 1.066 53 H TRP 6 H TRP 6 -4.270 -0.068 6.004 54 HA TRP 6 HA TRP 6 -2.079 1.733 5.160 55 1HB TRP 6 2HB TRP 6 -4.131 1.719 7.133 56 2HB TRP 6 1HB TRP 6 -2.603 1.670 8.004 57 HD1 TRP 6 HD1 TRP 6 -4.894 4.135 6.946 58 HE1 TRP 6 1HE TRP 6 -3.763 6.386 6.391 59 HE3 TRP 6 3HE TRP 6 -0.037 2.605 6.507 60 HZ2 TRP 6 2HZ TRP 6 -1.148 7.403 5.835 61 HZ3 TRP 6 3HZ TRP 6 1.750 4.236 5.964 62 HH2 TRP 6 HH2 TRP 6 1.201 6.631 5.628 63 H ALA 7 H ALA 7 -2.565 -0.854 7.591 64 HA ALA 7 HA ALA 7 0.035 -1.047 8.616 65 1HB ALA 7 1HB ALA 7 -2.375 -2.686 8.337 66 2HB ALA 7 2HB ALA 7 -1.275 -2.547 9.708 67 3HB ALA 7 3HB ALA 7 -0.908 -3.665 8.394 68 H TRP 8 H TRP 8 -1.143 -1.960 5.450 69 HA TRP 8 HA TRP 8 0.826 -3.866 4.677 70 1HB TRP 8 2HB TRP 8 -1.058 -3.547 3.281 71 2HB TRP 8 1HB TRP 8 -0.857 -1.798 3.266 72 HD1 TRP 8 HD1 TRP 8 0.119 -0.935 1.065 73 HE1 TRP 8 1HE TRP 8 1.649 -1.868 -0.779 74 HE3 TRP 8 3HE TRP 8 1.200 -5.472 3.063 75 HZ2 TRP 8 2HZ TRP 8 3.143 -4.246 -1.333 76 HZ3 TRP 8 3HZ TRP 8 2.676 -7.071 1.870 77 HH2 TRP 8 HH2 TRP 8 3.656 -6.456 -0.326 78 H TRP 9 H TRP 9 0.846 -0.757 3.073 79 HA TRP 9 HA TRP 9 3.484 -0.591 2.426 80 1HB TRP 9 2HB TRP 9 1.592 0.976 1.876 81 2HB TRP 9 1HB TRP 9 1.830 1.724 3.456 82 HD1 TRP 9 HD1 TRP 9 3.332 1.509 -0.012 83 HE1 TRP 9 1HE TRP 9 5.304 3.168 -0.176 84 HE3 TRP 9 3HE TRP 9 3.719 2.856 4.861 85 HZ2 TRP 9 2HZ TRP 9 6.847 4.854 1.566 86 HZ3 TRP 9 3HZ TRP 9 5.435 4.480 5.611 87 HH2 TRP 9 HH2 TRP 9 7.002 5.484 3.965 88 H ALA 10 H ALA 10 2.166 -0.166 5.650 89 HA ALA 10 HA ALA 10 4.428 1.163 6.851 90 1HB ALA 10 1HB ALA 10 2.737 1.227 8.357 91 2HB ALA 10 2HB ALA 10 3.200 -0.419 8.789 92 3HB ALA 10 3HB ALA 10 1.924 -0.144 7.602 93 H TRP 11 H TRP 11 3.647 -2.227 6.203 94 HA TRP 11 HA TRP 11 5.788 -3.374 7.768 95 1HB TRP 11 2HB TRP 11 4.803 -5.306 7.022 96 2HB TRP 11 1HB TRP 11 3.562 -4.236 6.379 97 HD1 TRP 11 HD1 TRP 11 3.307 -4.115 3.805 98 HE1 TRP 11 1HE TRP 11 4.552 -5.165 1.811 99 HE3 TRP 11 3HE TRP 11 7.316 -6.115 6.225 100 HZ2 TRP 11 2HZ TRP 11 6.934 -6.663 1.307 101 HZ3 TRP 11 3HZ TRP 11 9.063 -7.348 4.973 102 HH2 TRP 11 HH2 TRP 11 8.878 -7.623 2.515 103 H ARG 12 H ARG 12 5.433 -2.533 4.341 104 HA ARG 12 HA ARG 12 7.795 -3.455 3.234 105 1HB ARG 12 2HB ARG 12 6.413 -0.784 2.827 106 2HB ARG 12 1HB ARG 12 7.550 -1.507 1.693 107 1HG ARG 12 2HG ARG 12 6.058 -3.474 1.450 108 2HG ARG 12 1HG ARG 12 4.910 -2.735 2.565 109 1HD ARG 12 2HD ARG 12 4.074 -2.148 0.420 110 2HD ARG 12 1HD ARG 12 4.974 -0.702 0.920 111 HE ARG 12 HE ARG 12 6.131 -2.822 -0.853 112 1HH1 ARG 12 2HH1 ARG 12 5.100 0.364 -0.706 113 2HH1 ARG 12 1HH1 ARG 12 6.529 1.046 -1.406 114 1HH2 ARG 12 1HH2 ARG 12 8.307 -1.930 -1.334 115 2HH2 ARG 12 2HH2 ARG 12 8.345 -0.251 -1.760 116 H ARG 13 H ARG 13 7.389 -0.772 5.473 117 HA ARG 13 HA ARG 13 10.195 0.120 5.111 118 1HB ARG 13 2HB ARG 13 7.950 1.485 5.501 119 2HB ARG 13 1HB ARG 13 8.303 1.152 7.197 120 1HG ARG 13 2HG ARG 13 9.847 2.784 7.213 121 2HG ARG 13 1HG ARG 13 10.731 1.970 5.921 122 1HD ARG 13 2HD ARG 13 8.279 3.627 5.289 123 2HD ARG 13 1HD ARG 13 9.878 4.384 5.440 124 HE ARG 13 HE ARG 13 10.430 3.395 3.356 125 1HH1 ARG 13 1HH1 ARG 13 7.300 2.664 3.539 126 2HH1 ARG 13 2HH1 ARG 13 7.387 1.054 2.907 127 1HH2 ARG 13 1HH2 ARG 13 10.839 0.856 3.163 128 2HH2 ARG 13 2HH2 ARG 13 9.391 0.030 2.695 129 1HN NH2 14 1HN NH2 14 8.218 -0.657 8.042 130 2HN NH2 14 2HN NH2 14 9.474 -1.443 8.869 Start of MODEL 3 1 1H ILE 1 1H ILE 1 -12.126 1.136 9.176 2 2H ILE 1 2H ILE 1 -13.306 1.195 7.955 3 3H ILE 1 3H ILE 1 -11.913 2.162 7.843 4 HA ILE 1 HA ILE 1 -10.611 -0.030 7.853 5 HB ILE 1 HB ILE 1 -13.425 -0.919 7.136 6 1HG1 ILE 1 2HG1 ILE 1 -11.730 -1.523 9.583 7 2HG1 ILE 1 1HG1 ILE 1 -13.139 -0.461 9.558 8 1HG2 ILE 1 1HG2 ILE 1 -11.823 -2.222 5.914 9 2HG2 ILE 1 2HG2 ILE 1 -12.310 -3.201 7.297 10 3HG2 ILE 1 3HG2 ILE 1 -10.764 -2.352 7.319 11 1HD1 ILE 1 1HD1 ILE 1 -14.518 -2.388 8.753 12 2HD1 ILE 1 2HD1 ILE 1 -13.826 -2.659 10.352 13 3HD1 ILE 1 3HD1 ILE 1 -13.106 -3.429 8.938 14 H LEU 2 H LEU 2 -10.194 1.976 6.317 15 HA LEU 2 HA LEU 2 -11.050 1.198 3.547 16 1HB LEU 2 2HB LEU 2 -11.786 3.442 4.925 17 2HB LEU 2 1HB LEU 2 -10.331 4.016 4.108 18 HG LEU 2 HG LEU 2 -11.653 2.579 2.132 19 1HD1 LEU 2 1HD1 LEU 2 -13.951 3.590 2.172 20 2HD1 LEU 2 2HD1 LEU 2 -13.632 4.138 3.817 21 3HD1 LEU 2 3HD1 LEU 2 -13.681 2.412 3.456 22 1HD2 LEU 2 1HD2 LEU 2 -11.084 5.390 2.815 23 2HD2 LEU 2 2HD2 LEU 2 -12.430 5.180 1.695 24 3HD2 LEU 2 3HD2 LEU 2 -10.839 4.532 1.293 25 H ALA 3 H ALA 3 -9.124 0.133 2.934 26 HA ALA 3 HA ALA 3 -6.914 1.582 2.003 27 1HB ALA 3 1HB ALA 3 -6.846 0.819 4.903 28 2HB ALA 3 2HB ALA 3 -6.254 2.285 4.122 29 3HB ALA 3 3HB ALA 3 -5.340 0.783 3.986 30 H TRP 4 H TRP 4 -5.571 0.175 0.881 31 HA TRP 4 HA TRP 4 -4.917 -2.502 1.510 32 1HB TRP 4 2HB TRP 4 -7.632 -2.179 0.895 33 2HB TRP 4 1HB TRP 4 -6.922 -2.841 -0.578 34 HD1 TRP 4 HD1 TRP 4 -8.391 -3.967 2.513 35 HE1 TRP 4 1HE TRP 4 -7.661 -6.367 3.109 36 HE3 TRP 4 3HE TRP 4 -4.424 -4.491 -0.658 37 HZ2 TRP 4 2HZ TRP 4 -5.656 -8.258 2.340 38 HZ3 TRP 4 3HZ TRP 4 -3.123 -6.599 -0.706 39 HH2 TRP 4 HH2 TRP 4 -3.733 -8.482 0.788 40 H LYS 5 H LYS 5 -6.222 -0.922 -1.416 41 HA LYS 5 HA LYS 5 -4.120 -1.907 -3.143 42 1HB LYS 5 2HB LYS 5 -6.470 -1.183 -3.757 43 2HB LYS 5 1HB LYS 5 -5.956 0.484 -3.494 44 1HG LYS 5 2HG LYS 5 -5.718 0.058 -5.845 45 2HG LYS 5 1HG LYS 5 -4.089 0.054 -5.164 46 1HD LYS 5 2HD LYS 5 -4.061 -1.889 -6.458 47 2HD LYS 5 1HD LYS 5 -4.517 -2.522 -4.876 48 1HE LYS 5 2HE LYS 5 -6.445 -3.314 -5.756 49 2HE LYS 5 1HE LYS 5 -6.904 -1.667 -6.234 50 1HZ LYS 5 1HZ LYS 5 -5.823 -1.860 -8.262 51 2HZ LYS 5 2HZ LYS 5 -6.533 -3.393 -8.079 52 3HZ LYS 5 3HZ LYS 5 -4.878 -3.178 -7.760 53 H TRP 6 H TRP 6 -4.087 0.431 -0.733 54 HA TRP 6 HA TRP 6 -2.256 2.331 -2.048 55 1HB TRP 6 2HB TRP 6 -3.981 2.313 0.204 56 2HB TRP 6 1HB TRP 6 -2.352 2.489 0.848 57 HD1 TRP 6 HD1 TRP 6 -5.001 4.631 -0.023 58 HE1 TRP 6 1HE TRP 6 -4.206 6.911 -0.927 59 HE3 TRP 6 3HE TRP 6 -0.139 3.505 -1.128 60 HZ2 TRP 6 2HZ TRP 6 -1.827 8.102 -1.979 61 HZ3 TRP 6 3HZ TRP 6 1.365 5.230 -2.077 62 HH2 TRP 6 HH2 TRP 6 0.529 7.524 -2.504 63 H ALA 7 H ALA 7 -2.047 -0.109 0.562 64 HA ALA 7 HA ALA 7 0.674 0.122 1.223 65 1HB ALA 7 1HB ALA 7 -0.640 -2.562 0.934 66 2HB ALA 7 2HB ALA 7 -1.351 -1.386 2.038 67 3HB ALA 7 3HB ALA 7 0.309 -1.929 2.278 68 H TRP 8 H TRP 8 -0.801 -1.190 -1.667 69 HA TRP 8 HA TRP 8 1.129 -2.934 -2.685 70 1HB TRP 8 2HB TRP 8 -0.816 -2.637 -3.953 71 2HB TRP 8 1HB TRP 8 -0.735 -0.882 -3.847 72 HD1 TRP 8 HD1 TRP 8 0.015 0.234 -6.008 73 HE1 TRP 8 1HE TRP 8 1.400 -0.438 -8.067 74 HE3 TRP 8 3HE TRP 8 1.451 -4.436 -4.597 75 HZ2 TRP 8 2HZ TRP 8 2.924 -2.670 -8.996 76 HZ3 TRP 8 3HZ TRP 8 2.870 -5.825 -6.083 77 HH2 TRP 8 HH2 TRP 8 3.612 -4.946 -8.280 78 H TRP 9 H TRP 9 1.030 0.281 -4.120 79 HA TRP 9 HA TRP 9 3.647 0.423 -4.985 80 1HB TRP 9 2HB TRP 9 1.696 1.993 -5.373 81 2HB TRP 9 1HB TRP 9 2.089 2.740 -3.824 82 HD1 TRP 9 HD1 TRP 9 3.241 2.514 -7.412 83 HE1 TRP 9 1HE TRP 9 5.228 4.125 -7.768 84 HE3 TRP 9 3HE TRP 9 4.161 3.819 -2.591 85 HZ2 TRP 9 2HZ TRP 9 6.983 5.756 -6.187 86 HZ3 TRP 9 3HZ TRP 9 5.988 5.393 -2.020 87 HH2 TRP 9 HH2 TRP 9 7.402 6.366 -3.815 88 H ALA 10 H ALA 10 2.524 0.739 -1.688 89 HA ALA 10 HA ALA 10 4.922 2.048 -0.659 90 1HB ALA 10 1HB ALA 10 3.869 1.488 1.507 91 2HB ALA 10 2HB ALA 10 2.727 0.432 0.675 92 3HB ALA 10 3HB ALA 10 2.685 2.172 0.393 93 H TRP 11 H TRP 11 3.639 -1.278 -0.225 94 HA TRP 11 HA TRP 11 5.859 -2.459 0.996 95 1HB TRP 11 2HB TRP 11 4.613 -4.340 0.619 96 2HB TRP 11 1HB TRP 11 3.434 -3.238 -0.083 97 HD1 TRP 11 HD1 TRP 11 2.778 -3.756 -2.485 98 HE1 TRP 11 1HE TRP 11 3.777 -5.108 -4.432 99 HE3 TRP 11 3HE TRP 11 7.228 -5.080 -0.424 100 HZ2 TRP 11 2HZ TRP 11 6.165 -6.556 -5.041 101 HZ3 TRP 11 3HZ TRP 11 8.860 -6.442 -1.698 102 HH2 TRP 11 HH2 TRP 11 8.335 -7.179 -4.007 103 H ARG 12 H ARG 12 5.234 -2.029 -2.462 104 HA ARG 12 HA ARG 12 7.230 -3.319 -3.758 105 1HB ARG 12 2HB ARG 12 6.342 -0.441 -4.069 106 2HB ARG 12 1HB ARG 12 7.283 -1.304 -5.285 107 1HG ARG 12 2HG ARG 12 5.485 -3.050 -5.367 108 2HG ARG 12 1HG ARG 12 4.526 -2.060 -4.267 109 1HD ARG 12 2HD ARG 12 3.703 -1.285 -6.299 110 2HD ARG 12 1HD ARG 12 5.075 -0.178 -6.109 111 HE ARG 12 HE ARG 12 5.187 -2.703 -7.715 112 1HH1 ARG 12 2HH1 ARG 12 5.007 -0.082 -9.138 113 2HH1 ARG 12 1HH1 ARG 12 6.672 0.280 -9.455 114 1HH2 ARG 12 1HH2 ARG 12 7.883 -2.009 -7.150 115 2HH2 ARG 12 2HH2 ARG 12 8.298 -0.811 -8.330 116 H ARG 13 H ARG 13 7.678 -0.357 -1.841 117 HA ARG 13 HA ARG 13 10.501 -0.065 -2.483 118 1HB ARG 13 2HB ARG 13 8.784 1.688 -1.740 119 2HB ARG 13 1HB ARG 13 8.974 1.035 -0.113 120 1HG ARG 13 2HG ARG 13 11.295 1.608 -0.051 121 2HG ARG 13 1HG ARG 13 11.323 1.956 -1.781 122 1HD ARG 13 2HD ARG 13 11.156 4.122 -0.880 123 2HD ARG 13 1HD ARG 13 9.445 3.725 -1.133 124 HE ARG 13 HE ARG 13 10.666 4.091 1.451 125 1HH1 ARG 13 1HH1 ARG 13 7.686 4.000 0.730 126 2HH1 ARG 13 2HH1 ARG 13 7.169 2.632 1.657 127 1HH2 ARG 13 1HH2 ARG 13 10.383 1.452 2.201 128 2HH2 ARG 13 2HH2 ARG 13 8.696 1.188 2.489 129 1HN NH2 14 1HN NH2 14 10.232 -2.746 -1.674 130 2HN NH2 14 2HN NH2 14 10.931 -2.966 -0.142 Start of MODEL 4 1 1H ILE 1 1H ILE 1 -14.260 2.989 8.679 2 2H ILE 1 2H ILE 1 -13.117 3.360 9.881 3 3H ILE 1 3H ILE 1 -13.089 1.843 9.117 4 HA ILE 1 HA ILE 1 -12.806 4.242 7.444 5 HB ILE 1 HB ILE 1 -11.413 4.422 9.577 6 1HG1 ILE 1 2HG1 ILE 1 -9.420 5.129 8.375 7 2HG1 ILE 1 1HG1 ILE 1 -9.846 4.114 6.997 8 1HG2 ILE 1 1HG2 ILE 1 -10.082 2.713 10.213 9 2HG2 ILE 1 2HG2 ILE 1 -9.401 2.559 8.593 10 3HG2 ILE 1 3HG2 ILE 1 -10.905 1.732 9.000 11 1HD1 ILE 1 1HD1 ILE 1 -11.378 5.604 6.214 12 2HD1 ILE 1 2HD1 ILE 1 -10.495 6.764 7.207 13 3HD1 ILE 1 3HD1 ILE 1 -11.959 6.001 7.831 14 H LEU 2 H LEU 2 -11.118 3.607 5.717 15 HA LEU 2 HA LEU 2 -11.355 0.674 5.117 16 1HB LEU 2 2HB LEU 2 -12.537 2.678 3.783 17 2HB LEU 2 1HB LEU 2 -10.966 2.730 2.984 18 HG LEU 2 HG LEU 2 -11.448 0.041 3.011 19 1HD1 LEU 2 1HD1 LEU 2 -13.632 -0.403 3.316 20 2HD1 LEU 2 2HD1 LEU 2 -14.027 0.632 1.944 21 3HD1 LEU 2 3HD1 LEU 2 -13.953 1.313 3.569 22 1HD2 LEU 2 1HD2 LEU 2 -10.742 1.508 1.100 23 2HD2 LEU 2 2HD2 LEU 2 -12.429 1.977 0.888 24 3HD2 LEU 2 3HD2 LEU 2 -11.941 0.300 0.639 25 H ALA 3 H ALA 3 -9.543 -0.085 3.618 26 HA ALA 3 HA ALA 3 -7.145 1.275 3.118 27 1HB ALA 3 1HB ALA 3 -7.617 0.557 5.927 28 2HB ALA 3 2HB ALA 3 -6.463 1.701 5.242 29 3HB ALA 3 3HB ALA 3 -6.066 -0.016 5.313 30 H TRP 4 H TRP 4 -5.782 -0.115 2.014 31 HA TRP 4 HA TRP 4 -5.283 -2.846 2.460 32 1HB TRP 4 2HB TRP 4 -7.944 -2.338 1.618 33 2HB TRP 4 1HB TRP 4 -7.114 -3.058 0.238 34 HD1 TRP 4 HD1 TRP 4 -8.920 -4.033 3.224 35 HE1 TRP 4 1HE TRP 4 -8.407 -6.470 3.889 36 HE3 TRP 4 3HE TRP 4 -4.784 -4.877 0.352 37 HZ2 TRP 4 2HZ TRP 4 -6.493 -8.509 3.284 38 HZ3 TRP 4 3HZ TRP 4 -3.636 -7.072 0.417 39 HH2 TRP 4 HH2 TRP 4 -4.483 -8.887 1.878 40 H LYS 5 H LYS 5 -6.338 -0.983 -0.400 41 HA LYS 5 HA LYS 5 -4.180 -1.928 -2.080 42 1HB LYS 5 2HB LYS 5 -6.216 0.306 -2.167 43 2HB LYS 5 1HB LYS 5 -5.027 0.104 -3.454 44 1HG LYS 5 2HG LYS 5 -6.455 -2.362 -2.642 45 2HG LYS 5 1HG LYS 5 -7.442 -1.141 -3.447 46 1HD LYS 5 2HD LYS 5 -6.101 -1.170 -5.394 47 2HD LYS 5 1HD LYS 5 -4.770 -1.981 -4.568 48 1HE LYS 5 2HE LYS 5 -5.919 -4.064 -4.522 49 2HE LYS 5 1HE LYS 5 -7.475 -3.302 -4.906 50 1HZ LYS 5 1HZ LYS 5 -5.113 -3.153 -6.694 51 2HZ LYS 5 2HZ LYS 5 -6.714 -2.712 -7.051 52 3HZ LYS 5 3HZ LYS 5 -6.306 -4.348 -6.847 53 H TRP 6 H TRP 6 -4.176 0.181 0.529 54 HA TRP 6 HA TRP 6 -2.188 2.097 -0.507 55 1HB TRP 6 2HB TRP 6 -4.054 1.984 1.618 56 2HB TRP 6 1HB TRP 6 -2.468 1.998 2.382 57 HD1 TRP 6 HD1 TRP 6 -4.909 4.377 1.605 58 HE1 TRP 6 1HE TRP 6 -3.938 6.675 0.958 59 HE3 TRP 6 3HE TRP 6 -0.084 3.043 0.580 60 HZ2 TRP 6 2HZ TRP 6 -1.447 7.801 0.116 61 HZ3 TRP 6 3HZ TRP 6 1.564 4.747 -0.142 62 HH2 TRP 6 HH2 TRP 6 0.889 7.122 -0.375 63 H ALA 7 H ALA 7 -2.251 -0.516 1.939 64 HA ALA 7 HA ALA 7 0.408 -0.505 2.783 65 1HB ALA 7 1HB ALA 7 -1.866 -2.275 2.707 66 2HB ALA 7 2HB ALA 7 -0.545 -2.239 3.875 67 3HB ALA 7 3HB ALA 7 -0.397 -3.204 2.407 68 H TRP 8 H TRP 8 -0.900 -1.607 -0.294 69 HA TRP 8 HA TRP 8 1.131 -3.243 -1.303 70 1HB TRP 8 2HB TRP 8 -0.775 -2.917 -2.634 71 2HB TRP 8 1HB TRP 8 -0.713 -1.167 -2.462 72 HD1 TRP 8 HD1 TRP 8 0.090 0.012 -4.569 73 HE1 TRP 8 1HE TRP 8 1.600 -0.568 -6.566 74 HE3 TRP 8 3HE TRP 8 1.600 -4.646 -3.190 75 HZ2 TRP 8 2HZ TRP 8 3.240 -2.729 -7.465 76 HZ3 TRP 8 3HZ TRP 8 3.136 -5.954 -4.631 77 HH2 TRP 8 HH2 TRP 8 3.962 -4.997 -6.765 78 H TRP 9 H TRP 9 1.013 0.009 -2.622 79 HA TRP 9 HA TRP 9 3.660 0.285 -3.322 80 1HB TRP 9 2HB TRP 9 1.676 1.807 -3.734 81 2HB TRP 9 1HB TRP 9 1.965 2.491 -2.134 82 HD1 TRP 9 HD1 TRP 9 3.299 2.476 -5.667 83 HE1 TRP 9 1HE TRP 9 5.236 4.172 -5.849 84 HE3 TRP 9 3HE TRP 9 3.933 3.584 -0.752 85 HZ2 TRP 9 2HZ TRP 9 6.850 5.790 -4.110 86 HZ3 TRP 9 3HZ TRP 9 5.667 5.194 -0.019 87 HH2 TRP 9 HH2 TRP 9 7.129 6.301 -1.695 88 H ALA 10 H ALA 10 2.357 0.415 -0.075 89 HA ALA 10 HA ALA 10 4.657 1.745 1.135 90 1HB ALA 10 1HB ALA 10 2.061 0.644 1.862 91 2HB ALA 10 2HB ALA 10 2.985 1.924 2.648 92 3HB ALA 10 3HB ALA 10 3.291 0.237 3.060 93 H TRP 11 H TRP 11 3.455 -1.623 1.462 94 HA TRP 11 HA TRP 11 5.661 -2.789 2.696 95 1HB TRP 11 2HB TRP 11 4.493 -4.689 2.196 96 2HB TRP 11 1HB TRP 11 3.310 -3.597 1.481 97 HD1 TRP 11 HD1 TRP 11 2.778 -4.047 -0.964 98 HE1 TRP 11 1HE TRP 11 3.903 -5.295 -2.911 99 HE3 TRP 11 3HE TRP 11 7.177 -5.307 1.244 100 HZ2 TRP 11 2HZ TRP 11 6.362 -6.646 -3.465 101 HZ3 TRP 11 3HZ TRP 11 8.906 -6.570 -0.005 102 HH2 TRP 11 HH2 TRP 11 8.504 -7.238 -2.359 103 H ARG 12 H ARG 12 5.176 -2.234 -0.769 104 HA ARG 12 HA ARG 12 7.273 -3.418 -2.013 105 1HB ARG 12 2HB ARG 12 6.308 -0.557 -2.269 106 2HB ARG 12 1HB ARG 12 7.334 -1.350 -3.465 107 1HG ARG 12 2HG ARG 12 5.592 -3.149 -3.682 108 2HG ARG 12 1HG ARG 12 4.551 -2.208 -2.615 109 1HD ARG 12 2HD ARG 12 3.814 -1.386 -4.657 110 2HD ARG 12 1HD ARG 12 5.172 -0.276 -4.396 111 HE ARG 12 HE ARG 12 5.265 -2.710 -6.122 112 1HH1 ARG 12 1HH2 ARG 12 5.915 0.557 -5.939 113 2HH1 ARG 12 2HH2 ARG 12 7.502 0.470 -6.626 114 1HH2 ARG 12 2HH1 ARG 12 7.632 -2.995 -6.557 115 2HH2 ARG 12 1HH1 ARG 12 8.474 -1.540 -6.977 116 H ARG 13 H ARG 13 7.519 -0.545 0.061 117 HA ARG 13 HA ARG 13 10.363 -0.127 -0.437 118 1HB ARG 13 2HB ARG 13 8.528 1.535 0.269 119 2HB ARG 13 1HB ARG 13 8.698 0.857 1.889 120 1HG ARG 13 2HG ARG 13 10.666 1.918 2.248 121 2HG ARG 13 1HG ARG 13 11.267 1.528 0.636 122 1HD ARG 13 2HD ARG 13 9.083 3.580 0.883 123 2HD ARG 13 1HD ARG 13 10.752 4.053 1.261 124 HE ARG 13 HE ARG 13 9.777 3.137 -1.388 125 1HH1 ARG 13 1HH1 ARG 13 11.589 5.534 -0.380 126 2HH1 ARG 13 2HH1 ARG 13 13.073 5.099 -1.161 127 1HH2 ARG 13 1HH2 ARG 13 12.034 1.881 -1.928 128 2HH2 ARG 13 2HH2 ARG 13 13.325 3.030 -2.037 129 1HN NH2 14 1HN NH2 14 8.444 -1.698 2.166 130 2HN NH2 14 2HN NH2 14 9.773 -2.419 2.938 Start of MODEL 5 1 1H ILE 1 1H ILE 1 -13.106 3.387 5.932 2 2H ILE 1 2H ILE 1 -12.397 4.888 6.291 3 3H ILE 1 3H ILE 1 -13.016 3.917 7.539 4 HA ILE 1 HA ILE 1 -10.449 3.974 7.032 5 HB ILE 1 HB ILE 1 -11.893 2.712 8.722 6 1HG1 ILE 1 2HG1 ILE 1 -9.926 0.685 8.166 7 2HG1 ILE 1 1HG1 ILE 1 -9.236 2.272 7.822 8 1HG2 ILE 1 1HG2 ILE 1 -11.747 0.637 6.514 9 2HG2 ILE 1 2HG2 ILE 1 -13.208 1.385 7.160 10 3HG2 ILE 1 3HG2 ILE 1 -12.255 0.298 8.168 11 1HD1 ILE 1 1HD1 ILE 1 -10.696 2.576 10.215 12 2HD1 ILE 1 2HD1 ILE 1 -8.941 2.556 10.035 13 3HD1 ILE 1 3HD1 ILE 1 -9.808 1.061 10.384 14 H LEU 2 H LEU 2 -12.023 3.701 4.390 15 HA LEU 2 HA LEU 2 -11.540 1.345 2.984 16 1HB LEU 2 2HB LEU 2 -12.055 4.110 2.471 17 2HB LEU 2 1HB LEU 2 -10.791 3.584 1.358 18 HG LEU 2 HG LEU 2 -12.463 1.461 1.191 19 1HD1 LEU 2 1HD1 LEU 2 -14.753 2.142 1.252 20 2HD1 LEU 2 2HD1 LEU 2 -14.315 3.841 1.433 21 3HD1 LEU 2 3HD1 LEU 2 -14.044 2.715 2.763 22 1HD2 LEU 2 1HD2 LEU 2 -12.617 2.154 -0.968 23 2HD2 LEU 2 2HD2 LEU 2 -11.599 3.500 -0.455 24 3HD2 LEU 2 3HD2 LEU 2 -13.351 3.691 -0.511 25 H ALA 3 H ALA 3 -9.729 0.483 1.857 26 HA ALA 3 HA ALA 3 -7.229 1.658 1.403 27 1HB ALA 3 1HB ALA 3 -6.660 2.068 3.584 28 2HB ALA 3 2HB ALA 3 -6.204 0.365 3.566 29 3HB ALA 3 3HB ALA 3 -7.774 0.850 4.205 30 H TRP 4 H TRP 4 -5.922 0.159 0.361 31 HA TRP 4 HA TRP 4 -5.716 -2.618 0.814 32 1HB TRP 4 2HB TRP 4 -8.250 -1.852 -0.159 33 2HB TRP 4 1HB TRP 4 -7.417 -2.575 -1.534 34 HD1 TRP 4 HD1 TRP 4 -9.499 -3.547 1.238 35 HE1 TRP 4 1HE TRP 4 -9.223 -6.042 1.823 36 HE3 TRP 4 3HE TRP 4 -5.200 -4.573 -1.312 37 HZ2 TRP 4 2HZ TRP 4 -7.412 -8.190 1.281 38 HZ3 TRP 4 3HZ TRP 4 -4.219 -6.849 -1.261 39 HH2 TRP 4 HH2 TRP 4 -5.319 -8.657 0.032 40 H LYS 5 H LYS 5 -6.389 -0.661 -2.098 41 HA LYS 5 HA LYS 5 -4.204 -1.795 -3.621 42 1HB LYS 5 2HB LYS 5 -6.018 0.615 -3.853 43 2HB LYS 5 1HB LYS 5 -4.777 0.277 -5.060 44 1HG LYS 5 2HG LYS 5 -6.409 -2.067 -4.359 45 2HG LYS 5 1HG LYS 5 -7.329 -0.758 -5.102 46 1HD LYS 5 2HD LYS 5 -5.744 -0.686 -6.978 47 2HD LYS 5 1HD LYS 5 -4.786 -1.965 -6.231 48 1HE LYS 5 2HE LYS 5 -6.910 -3.402 -6.288 49 2HE LYS 5 1HE LYS 5 -7.585 -2.166 -7.368 50 1HZ LYS 5 1HZ LYS 5 -5.149 -3.804 -7.763 51 2HZ LYS 5 2HZ LYS 5 -5.426 -2.376 -8.642 52 3HZ LYS 5 3HZ LYS 5 -6.502 -3.683 -8.778 53 H TRP 6 H TRP 6 -4.219 0.321 -1.018 54 HA TRP 6 HA TRP 6 -1.997 2.050 -1.899 55 1HB TRP 6 2HB TRP 6 -4.032 2.115 0.074 56 2HB TRP 6 1HB TRP 6 -2.512 2.020 0.957 57 HD1 TRP 6 HD1 TRP 6 -4.700 4.563 -0.059 58 HE1 TRP 6 1HE TRP 6 -3.504 6.768 -0.647 59 HE3 TRP 6 3HE TRP 6 0.080 2.852 -0.628 60 HZ2 TRP 6 2HZ TRP 6 -0.869 7.687 -1.274 61 HZ3 TRP 6 3HZ TRP 6 1.912 4.414 -1.220 62 HH2 TRP 6 HH2 TRP 6 1.443 6.827 -1.543 63 H ALA 7 H ALA 7 -2.488 -0.541 0.521 64 HA ALA 7 HA ALA 7 0.104 -0.730 1.573 65 1HB ALA 7 1HB ALA 7 -1.490 -3.181 0.884 66 2HB ALA 7 2HB ALA 7 -2.188 -1.988 1.980 67 3HB ALA 7 3HB ALA 7 -0.667 -2.779 2.392 68 H TRP 8 H TRP 8 -1.072 -1.717 -1.583 69 HA TRP 8 HA TRP 8 0.928 -3.589 -2.338 70 1HB TRP 8 2HB TRP 8 -0.952 -3.318 -3.743 71 2HB TRP 8 1HB TRP 8 -0.789 -1.564 -3.769 72 HD1 TRP 8 HD1 TRP 8 0.178 -0.684 -5.964 73 HE1 TRP 8 1HE TRP 8 1.718 -1.592 -7.811 74 HE3 TRP 8 3HE TRP 8 1.327 -5.210 -3.974 75 HZ2 TRP 8 2HZ TRP 8 3.245 -3.945 -8.371 76 HZ3 TRP 8 3HZ TRP 8 2.824 -6.784 -5.174 77 HH2 TRP 8 HH2 TRP 8 3.790 -6.151 -7.369 78 H TRP 9 H TRP 9 0.907 -0.490 -3.966 79 HA TRP 9 HA TRP 9 3.539 -0.307 -4.631 80 1HB TRP 9 2HB TRP 9 1.636 1.240 -5.185 81 2HB TRP 9 1HB TRP 9 1.870 2.001 -3.610 82 HD1 TRP 9 HD1 TRP 9 3.365 1.776 -7.081 83 HE1 TRP 9 1HE TRP 9 5.328 3.446 -7.259 84 HE3 TRP 9 3HE TRP 9 3.755 3.151 -2.218 85 HZ2 TRP 9 2HZ TRP 9 6.868 5.149 -5.528 86 HZ3 TRP 9 3HZ TRP 9 5.465 4.786 -1.477 87 HH2 TRP 9 HH2 TRP 9 7.025 5.790 -3.131 88 H ALA 10 H ALA 10 2.242 0.127 -1.401 89 HA ALA 10 HA ALA 10 4.479 1.500 -0.215 90 1HB ALA 10 1HB ALA 10 2.683 1.514 1.198 91 2HB ALA 10 2HB ALA 10 3.384 0.007 1.787 92 3HB ALA 10 3HB ALA 10 2.081 -0.032 0.598 93 H TRP 11 H TRP 11 3.808 -1.906 -0.884 94 HA TRP 11 HA TRP 11 6.010 -2.980 0.658 95 1HB TRP 11 2HB TRP 11 5.061 -4.945 -0.039 96 2HB TRP 11 1HB TRP 11 3.774 -3.917 -0.662 97 HD1 TRP 11 HD1 TRP 11 3.468 -3.803 -3.234 98 HE1 TRP 11 1HE TRP 11 4.681 -4.856 -5.244 99 HE3 TRP 11 3HE TRP 11 7.549 -5.737 -0.883 100 HZ2 TRP 11 2HZ TRP 11 7.067 -6.332 -5.788 101 HZ3 TRP 11 3HZ TRP 11 9.282 -6.963 -2.163 102 HH2 TRP 11 HH2 TRP 11 9.047 -7.261 -4.614 103 H ARG 12 H ARG 12 5.556 -2.197 -2.776 104 HA ARG 12 HA ARG 12 7.933 -3.071 -3.904 105 1HB ARG 12 2HB ARG 12 6.467 -0.453 -4.359 106 2HB ARG 12 1HB ARG 12 7.599 -1.184 -5.494 107 1HG ARG 12 2HG ARG 12 6.144 -3.202 -5.624 108 2HG ARG 12 1HG ARG 12 4.989 -2.420 -4.544 109 1HD ARG 12 2HD ARG 12 4.082 -1.835 -6.609 110 2HD ARG 12 1HD ARG 12 5.180 -0.462 -6.364 111 HE ARG 12 HE ARG 12 5.909 -2.894 -7.957 112 1HH1 ARG 12 1HH2 ARG 12 5.200 0.310 -8.341 113 2HH1 ARG 12 2HH2 ARG 12 6.687 0.755 -9.110 114 1HH2 ARG 12 2HH1 ARG 12 8.244 -2.271 -8.447 115 2HH2 ARG 12 1HH1 ARG 12 8.410 -0.705 -9.170 116 H ARG 13 H ARG 13 7.473 -0.376 -1.701 117 HA ARG 13 HA ARG 13 10.169 0.721 -2.173 118 1HB ARG 13 2HB ARG 13 8.142 2.096 -1.672 119 2HB ARG 13 1HB ARG 13 8.056 1.337 -0.082 120 1HG ARG 13 2HG ARG 13 9.565 2.797 0.720 121 2HG ARG 13 1HG ARG 13 10.731 2.280 -0.498 122 1HD ARG 13 2HD ARG 13 8.512 4.197 -1.234 123 2HD ARG 13 1HD ARG 13 10.023 4.787 -0.513 124 HE ARG 13 HE ARG 13 9.787 3.418 -3.142 125 1HH1 ARG 13 1HH2 ARG 13 11.133 6.115 -2.440 126 2HH1 ARG 13 2HH2 ARG 13 12.801 5.682 -2.608 127 1HH2 ARG 13 1HH1 ARG 13 12.191 2.268 -2.576 128 2HH2 ARG 13 2HH1 ARG 13 13.401 3.503 -2.686 129 1HN NH2 14 1HN NH2 14 8.939 -1.894 -0.375 130 2HN NH2 14 2HN NH2 14 10.158 -1.992 0.802 Start of MODEL 6 1 1H ILE 1 1H ILE 1 -13.401 -3.400 6.996 2 2H ILE 1 2H ILE 1 -12.655 -2.018 7.647 3 3H ILE 1 3H ILE 1 -11.725 -3.192 6.843 4 HA ILE 1 HA ILE 1 -12.395 -2.527 4.760 5 HB ILE 1 HB ILE 1 -14.785 -2.906 5.589 6 1HG1 ILE 1 2HG1 ILE 1 -15.122 -0.534 3.941 7 2HG1 ILE 1 1HG1 ILE 1 -13.782 -1.523 3.360 8 1HG2 ILE 1 1HG2 ILE 1 -15.383 -0.085 5.791 9 2HG2 ILE 1 2HG2 ILE 1 -14.196 -0.543 7.014 10 3HG2 ILE 1 3HG2 ILE 1 -15.747 -1.379 6.932 11 1HD1 ILE 1 1HD1 ILE 1 -15.997 -3.217 4.108 12 2HD1 ILE 1 2HD1 ILE 1 -15.206 -3.060 2.539 13 3HD1 ILE 1 3HD1 ILE 1 -16.540 -1.988 2.966 14 H LEU 2 H LEU 2 -10.973 -1.106 7.065 15 HA LEU 2 HA LEU 2 -11.174 1.685 5.979 16 1HB LEU 2 2HB LEU 2 -11.848 0.913 8.452 17 2HB LEU 2 1HB LEU 2 -10.112 1.088 8.710 18 HG LEU 2 HG LEU 2 -11.029 3.339 7.196 19 1HD1 LEU 2 1HD1 LEU 2 -12.821 2.423 9.386 20 2HD1 LEU 2 2HD1 LEU 2 -13.188 3.407 7.969 21 3HD1 LEU 2 3HD1 LEU 2 -12.411 4.139 9.373 22 1HD2 LEU 2 1HD2 LEU 2 -10.082 4.569 9.082 23 2HD2 LEU 2 2HD2 LEU 2 -9.051 3.185 8.721 24 3HD2 LEU 2 3HD2 LEU 2 -10.155 3.127 10.094 25 H ALA 3 H ALA 3 -9.407 1.717 4.555 26 HA ALA 3 HA ALA 3 -7.102 1.948 4.006 27 1HB ALA 3 1HB ALA 3 -5.919 2.662 5.786 28 2HB ALA 3 2HB ALA 3 -5.995 1.066 6.535 29 3HB ALA 3 3HB ALA 3 -7.294 2.229 6.803 30 H TRP 4 H TRP 4 -5.776 0.447 3.055 31 HA TRP 4 HA TRP 4 -5.076 -2.126 4.062 32 1HB TRP 4 2HB TRP 4 -7.732 -2.009 3.461 33 2HB TRP 4 1HB TRP 4 -7.074 -2.551 1.917 34 HD1 TRP 4 HD1 TRP 4 -8.417 -3.989 4.885 35 HE1 TRP 4 1HE TRP 4 -7.497 -6.354 5.340 36 HE3 TRP 4 3HE TRP 4 -4.372 -3.968 1.776 37 HZ2 TRP 4 2HZ TRP 4 -5.326 -8.017 4.496 38 HZ3 TRP 4 3HZ TRP 4 -2.893 -5.952 1.619 39 HH2 TRP 4 HH2 TRP 4 -3.365 -7.975 2.974 40 H LYS 5 H LYS 5 -6.236 -0.927 0.902 41 HA LYS 5 HA LYS 5 -4.024 -2.073 -0.572 42 1HB LYS 5 2HB LYS 5 -4.991 -0.617 -2.388 43 2HB LYS 5 1HB LYS 5 -6.198 -1.618 -1.579 44 1HG LYS 5 2HG LYS 5 -5.883 0.873 -0.155 45 2HG LYS 5 1HG LYS 5 -6.221 1.194 -1.856 46 1HD LYS 5 2HD LYS 5 -7.856 -0.515 0.038 47 2HD LYS 5 1HD LYS 5 -8.343 1.002 -0.718 48 1HE LYS 5 2HE LYS 5 -7.564 -0.645 -2.862 49 2HE LYS 5 1HE LYS 5 -8.520 -1.688 -1.790 50 1HZ LYS 5 1HZ LYS 5 -10.142 -0.595 -3.006 51 2HZ LYS 5 2HZ LYS 5 -9.285 0.871 -3.046 52 3HZ LYS 5 3HZ LYS 5 -10.040 0.363 -1.611 53 H TRP 6 H TRP 6 -4.144 0.530 1.538 54 HA TRP 6 HA TRP 6 -2.273 2.294 0.096 55 1HB TRP 6 2HB TRP 6 -4.111 2.513 2.249 56 2HB TRP 6 1HB TRP 6 -2.518 2.804 2.940 57 HD1 TRP 6 HD1 TRP 6 -5.160 4.757 1.677 58 HE1 TRP 6 1HE TRP 6 -4.361 6.926 0.536 59 HE3 TRP 6 3HE TRP 6 -0.229 3.623 0.971 60 HZ2 TRP 6 2HZ TRP 6 -1.951 8.035 -0.534 61 HZ3 TRP 6 3HZ TRP 6 1.293 5.252 -0.109 62 HH2 TRP 6 HH2 TRP 6 0.440 7.455 -0.862 63 H ALA 7 H ALA 7 -2.167 0.173 2.978 64 HA ALA 7 HA ALA 7 0.521 0.539 3.728 65 1HB ALA 7 1HB ALA 7 -1.651 -1.358 4.094 66 2HB ALA 7 2HB ALA 7 -0.382 -0.897 5.229 67 3HB ALA 7 3HB ALA 7 -0.094 -2.187 4.060 68 H TRP 8 H TRP 8 -0.836 -1.263 1.030 69 HA TRP 8 HA TRP 8 1.128 -3.052 0.270 70 1HB TRP 8 2HB TRP 8 -0.749 -2.839 -1.129 71 2HB TRP 8 1HB TRP 8 -0.601 -1.088 -1.222 72 HD1 TRP 8 HD1 TRP 8 0.369 -0.248 -3.433 73 HE1 TRP 8 1HE TRP 8 1.834 -1.226 -5.307 74 HE3 TRP 8 3HE TRP 8 1.431 -4.781 -1.414 75 HZ2 TRP 8 2HZ TRP 8 3.274 -3.632 -5.875 76 HZ3 TRP 8 3HZ TRP 8 2.847 -6.416 -2.630 77 HH2 TRP 8 HH2 TRP 8 3.777 -5.841 -4.858 78 H TRP 9 H TRP 9 1.145 -0.010 -1.483 79 HA TRP 9 HA TRP 9 3.762 0.040 -2.269 80 1HB TRP 9 2HB TRP 9 1.887 1.636 -2.807 81 2HB TRP 9 1HB TRP 9 2.217 2.445 -1.274 82 HD1 TRP 9 HD1 TRP 9 3.550 2.038 -4.790 83 HE1 TRP 9 1HE TRP 9 5.563 3.624 -5.115 84 HE3 TRP 9 3HE TRP 9 4.206 3.571 -0.003 85 HZ2 TRP 9 2HZ TRP 9 7.239 5.327 -3.518 86 HZ3 TRP 9 3HZ TRP 9 6.006 5.165 0.600 87 HH2 TRP 9 HH2 TRP 9 7.526 6.049 -1.157 88 H ALA 10 H ALA 10 2.592 0.639 0.981 89 HA ALA 10 HA ALA 10 4.935 1.957 2.034 90 1HB ALA 10 1HB ALA 10 2.436 1.447 2.895 91 2HB ALA 10 2HB ALA 10 3.757 1.805 4.008 92 3HB ALA 10 3HB ALA 10 3.283 0.133 3.713 93 H TRP 11 H TRP 11 4.049 -1.427 1.538 94 HA TRP 11 HA TRP 11 6.209 -2.576 3.078 95 1HB TRP 11 2HB TRP 11 5.132 -4.500 2.450 96 2HB TRP 11 1HB TRP 11 3.910 -3.420 1.786 97 HD1 TRP 11 HD1 TRP 11 3.590 -3.422 -0.782 98 HE1 TRP 11 1HE TRP 11 4.764 -4.591 -2.753 99 HE3 TRP 11 3HE TRP 11 7.609 -5.407 1.634 100 HZ2 TRP 11 2HZ TRP 11 7.094 -6.169 -3.243 101 HZ3 TRP 11 3HZ TRP 11 9.295 -6.740 0.400 102 HH2 TRP 11 HH2 TRP 11 9.043 -7.122 -2.037 103 H ARG 12 H ARG 12 5.752 -1.866 -0.368 104 HA ARG 12 HA ARG 12 8.056 -2.894 -1.512 105 1HB ARG 12 2HB ARG 12 6.706 -0.221 -2.000 106 2HB ARG 12 1HB ARG 12 7.789 -1.019 -3.137 107 1HG ARG 12 2HG ARG 12 6.251 -2.981 -3.194 108 2HG ARG 12 1HG ARG 12 5.144 -2.120 -2.122 109 1HD ARG 12 2HD ARG 12 4.280 -1.653 -4.276 110 2HD ARG 12 1HD ARG 12 5.275 -0.223 -3.936 111 HE ARG 12 HE ARG 12 6.292 -2.566 -5.506 112 1HH1 ARG 12 2HH1 ARG 12 7.148 0.413 -4.244 113 2HH1 ARG 12 1HH1 ARG 12 7.746 1.075 -5.729 114 1HH2 ARG 12 1HH2 ARG 12 6.596 -1.557 -7.673 115 2HH2 ARG 12 2HH2 ARG 12 7.433 -0.041 -7.670 116 H ARG 13 H ARG 13 7.792 -0.134 0.640 117 HA ARG 13 HA ARG 13 10.290 1.143 0.079 118 1HB ARG 13 2HB ARG 13 8.362 2.023 1.419 119 2HB ARG 13 1HB ARG 13 8.785 0.889 2.703 120 1HG ARG 13 2HG ARG 13 10.876 1.953 3.100 121 2HG ARG 13 1HG ARG 13 10.782 2.868 1.594 122 1HD ARG 13 2HD ARG 13 10.127 4.492 3.163 123 2HD ARG 13 1HD ARG 13 8.553 3.824 2.686 124 HE ARG 13 HE ARG 13 8.464 2.614 4.763 125 1HH1 ARG 13 1HH1 ARG 13 9.931 5.284 5.497 126 2HH1 ARG 13 2HH1 ARG 13 11.136 4.665 6.575 127 1HH2 ARG 13 1HH2 ARG 13 10.674 1.364 5.619 128 2HH2 ARG 13 2HH2 ARG 13 11.557 2.444 6.644 129 1HN NH2 14 1HN NH2 14 9.472 -1.515 2.370 130 2HN NH2 14 2HN NH2 14 11.081 -1.949 2.694 Start of MODEL 7 1 1H ILE 1 1H ILE 1 -13.819 2.027 5.662 2 2H ILE 1 2H ILE 1 -13.590 3.330 4.596 3 3H ILE 1 3H ILE 1 -14.188 3.605 6.162 4 HA ILE 1 HA ILE 1 -11.716 4.106 5.710 5 HB ILE 1 HB ILE 1 -13.061 3.985 7.865 6 1HG1 ILE 1 2HG1 ILE 1 -10.532 2.939 8.809 7 2HG1 ILE 1 1HG1 ILE 1 -10.270 4.002 7.426 8 1HG2 ILE 1 1HG2 ILE 1 -13.304 1.395 7.478 9 2HG2 ILE 1 2HG2 ILE 1 -13.146 2.018 9.120 10 3HG2 ILE 1 3HG2 ILE 1 -11.747 1.319 8.305 11 1HD1 ILE 1 1HD1 ILE 1 -12.256 5.096 9.254 12 2HD1 ILE 1 2HD1 ILE 1 -10.782 5.838 8.633 13 3HD1 ILE 1 3HD1 ILE 1 -10.715 4.809 10.063 14 H LEU 2 H LEU 2 -12.421 1.617 4.103 15 HA LEU 2 HA LEU 2 -10.680 -0.523 5.009 16 1HB LEU 2 2HB LEU 2 -12.452 0.160 2.761 17 2HB LEU 2 1HB LEU 2 -11.081 -0.847 2.295 18 HG LEU 2 HG LEU 2 -11.958 -1.971 4.691 19 1HD1 LEU 2 1HD1 LEU 2 -14.457 -2.187 3.316 20 2HD1 LEU 2 2HD1 LEU 2 -14.105 -0.474 3.546 21 3HD1 LEU 2 3HD1 LEU 2 -14.156 -1.557 4.936 22 1HD2 LEU 2 1HD2 LEU 2 -12.610 -2.730 1.824 23 2HD2 LEU 2 2HD2 LEU 2 -12.721 -3.815 3.210 24 3HD2 LEU 2 3HD2 LEU 2 -11.152 -3.183 2.708 25 H ALA 3 H ALA 3 -8.648 0.672 5.371 26 HA ALA 3 HA ALA 3 -7.319 1.838 2.993 27 1HB ALA 3 1HB ALA 3 -7.294 2.152 5.830 28 2HB ALA 3 2HB ALA 3 -6.423 3.108 4.631 29 3HB ALA 3 3HB ALA 3 -5.670 1.676 5.334 30 H TRP 4 H TRP 4 -7.842 -1.034 2.970 31 HA TRP 4 HA TRP 4 -5.516 -2.548 3.737 32 1HB TRP 4 2HB TRP 4 -8.090 -2.942 2.662 33 2HB TRP 4 1HB TRP 4 -6.971 -3.630 1.484 34 HD1 TRP 4 HD1 TRP 4 -8.723 -4.514 4.545 35 HE1 TRP 4 1HE TRP 4 -7.662 -6.579 5.669 36 HE3 TRP 4 3HE TRP 4 -4.304 -4.717 2.005 37 HZ2 TRP 4 2HZ TRP 4 -5.250 -8.114 5.510 38 HZ3 TRP 4 3HZ TRP 4 -2.641 -6.487 2.510 39 HH2 TRP 4 HH2 TRP 4 -3.108 -8.183 4.259 40 H LYS 5 H LYS 5 -6.415 -0.882 0.730 41 HA LYS 5 HA LYS 5 -4.148 -1.948 -0.770 42 1HB LYS 5 2HB LYS 5 -5.886 0.473 -1.333 43 2HB LYS 5 1HB LYS 5 -5.011 -0.509 -2.509 44 1HG LYS 5 2HG LYS 5 -6.811 -1.841 -2.705 45 2HG LYS 5 1HG LYS 5 -6.651 -2.277 -1.002 46 1HD LYS 5 2HD LYS 5 -7.833 0.039 -0.595 47 2HD LYS 5 1HD LYS 5 -8.376 -0.165 -2.261 48 1HE LYS 5 2HE LYS 5 -8.671 -2.500 -0.404 49 2HE LYS 5 1HE LYS 5 -9.818 -1.153 -0.253 50 1HZ LYS 5 1HZ LYS 5 -10.776 -2.394 -1.925 51 2HZ LYS 5 2HZ LYS 5 -9.285 -2.882 -2.579 52 3HZ LYS 5 3HZ LYS 5 -9.847 -1.297 -2.824 53 H TRP 6 H TRP 6 -4.188 0.114 1.770 54 HA TRP 6 HA TRP 6 -2.300 2.127 0.685 55 1HB TRP 6 2HB TRP 6 -4.292 2.214 2.541 56 2HB TRP 6 1HB TRP 6 -2.899 1.953 3.588 57 HD1 TRP 6 HD1 TRP 6 -4.771 4.674 2.119 58 HE1 TRP 6 1HE TRP 6 -3.378 6.838 1.999 59 HE3 TRP 6 3HE TRP 6 -0.101 2.771 2.940 60 HZ2 TRP 6 2HZ TRP 6 -0.648 7.657 2.220 61 HZ3 TRP 6 3HZ TRP 6 1.874 4.266 2.980 62 HH2 TRP 6 HH2 TRP 6 1.607 6.704 2.621 63 H ALA 7 H ALA 7 -2.325 -0.353 3.282 64 HA ALA 7 HA ALA 7 0.336 -0.153 4.147 65 1HB ALA 7 1HB ALA 7 -1.381 -2.623 3.725 66 2HB ALA 7 2HB ALA 7 -1.446 -1.560 5.131 67 3HB ALA 7 3HB ALA 7 0.002 -2.515 4.813 68 H TRP 8 H TRP 8 -0.900 -1.371 1.119 69 HA TRP 8 HA TRP 8 1.112 -3.131 0.258 70 1HB TRP 8 2HB TRP 8 -0.755 -2.856 -1.133 71 2HB TRP 8 1HB TRP 8 -0.677 -1.100 -1.049 72 HD1 TRP 8 HD1 TRP 8 0.217 -0.025 -3.177 73 HE1 TRP 8 1HE TRP 8 1.754 -0.732 -5.115 74 HE3 TRP 8 3HE TRP 8 1.574 -4.651 -1.561 75 HZ2 TRP 8 2HZ TRP 8 3.357 -2.974 -5.879 76 HZ3 TRP 8 3HZ TRP 8 3.106 -6.063 -2.905 77 HH2 TRP 8 HH2 TRP 8 4.004 -5.226 -5.060 78 H TRP 9 H TRP 9 1.056 0.065 -1.203 79 HA TRP 9 HA TRP 9 3.729 0.244 -1.876 80 1HB TRP 9 2HB TRP 9 1.778 1.751 -2.457 81 2HB TRP 9 1HB TRP 9 2.028 2.546 -0.901 82 HD1 TRP 9 HD1 TRP 9 3.461 2.270 -4.382 83 HE1 TRP 9 1HE TRP 9 5.425 3.929 -4.626 84 HE3 TRP 9 3HE TRP 9 3.974 3.707 0.462 85 HZ2 TRP 9 2HZ TRP 9 7.009 5.644 -2.957 86 HZ3 TRP 9 3HZ TRP 9 5.709 5.345 1.131 87 HH2 TRP 9 HH2 TRP 9 7.229 6.318 -0.575 88 H ALA 10 H ALA 10 2.364 0.557 1.318 89 HA ALA 10 HA ALA 10 4.636 1.982 2.485 90 1HB ALA 10 1HB ALA 10 2.843 0.322 4.162 91 2HB ALA 10 2HB ALA 10 2.037 1.526 3.158 92 3HB ALA 10 3HB ALA 10 3.266 2.027 4.319 93 H TRP 11 H TRP 11 3.400 -1.348 3.023 94 HA TRP 11 HA TRP 11 5.547 -2.441 4.411 95 1HB TRP 11 2HB TRP 11 4.433 -4.396 3.947 96 2HB TRP 11 1HB TRP 11 3.241 -3.328 3.215 97 HD1 TRP 11 HD1 TRP 11 2.828 -3.601 0.688 98 HE1 TRP 11 1HE TRP 11 3.900 -4.974 -1.201 99 HE3 TRP 11 3HE TRP 11 6.928 -5.360 3.118 100 HZ2 TRP 11 2HZ TRP 11 6.208 -6.606 -1.630 101 HZ3 TRP 11 3HZ TRP 11 8.560 -6.821 1.957 102 HH2 TRP 11 HH2 TRP 11 8.205 -7.443 -0.417 103 H ARG 12 H ARG 12 5.212 -2.081 0.909 104 HA ARG 12 HA ARG 12 7.369 -3.375 -0.144 105 1HB ARG 12 2HB ARG 12 6.344 -0.579 -0.700 106 2HB ARG 12 1HB ARG 12 7.467 -1.427 -1.764 107 1HG ARG 12 2HG ARG 12 5.635 -3.365 -1.553 108 2HG ARG 12 1HG ARG 12 4.575 -1.999 -1.213 109 1HD ARG 12 2HD ARG 12 6.136 -2.589 -3.732 110 2HD ARG 12 1HD ARG 12 4.424 -2.164 -3.554 111 HE ARG 12 HE ARG 12 5.075 0.144 -3.135 112 1HH1 ARG 12 1HH2 ARG 12 7.030 -1.400 -5.248 113 2HH1 ARG 12 2HH2 ARG 12 8.444 -0.432 -4.989 114 1HH2 ARG 12 2HH1 ARG 12 7.173 1.138 -2.171 115 2HH2 ARG 12 1HH1 ARG 12 8.524 1.004 -3.246 116 H ARG 13 H ARG 13 7.497 -0.361 1.723 117 HA ARG 13 HA ARG 13 10.253 0.276 1.250 118 1HB ARG 13 2HB ARG 13 8.487 1.768 2.194 119 2HB ARG 13 1HB ARG 13 8.492 0.799 3.668 120 1HG ARG 13 2HG ARG 13 10.348 1.824 4.440 121 2HG ARG 13 1HG ARG 13 11.186 1.608 2.902 122 1HD ARG 13 2HD ARG 13 9.023 3.701 3.142 123 2HD ARG 13 1HD ARG 13 10.674 4.054 3.690 124 HE ARG 13 HE ARG 13 9.881 3.443 0.893 125 1HH1 ARG 13 1HH2 ARG 13 11.417 5.884 1.479 126 2HH1 ARG 13 2HH2 ARG 13 13.047 5.421 1.118 127 1HH2 ARG 13 1HH1 ARG 13 12.376 2.019 1.196 128 2HH2 ARG 13 2HH1 ARG 13 13.589 3.233 0.957 129 1HN NH2 14 1HN NH2 14 8.828 -1.206 4.233 130 2HN NH2 14 2HN NH2 14 10.209 -2.112 4.627 Start of MODEL 8 1 1H ILE 1 1H ILE 1 -14.988 0.222 8.221 2 2H ILE 1 2H ILE 1 -15.030 0.501 6.546 3 3H ILE 1 3H ILE 1 -15.411 1.753 7.628 4 HA ILE 1 HA ILE 1 -13.237 2.173 8.160 5 HB ILE 1 HB ILE 1 -13.069 -0.183 8.997 6 1HG1 ILE 1 2HG1 ILE 1 -10.660 0.530 7.306 7 2HG1 ILE 1 1HG1 ILE 1 -11.086 1.425 8.766 8 1HG2 ILE 1 1HG2 ILE 1 -11.852 -1.064 6.435 9 2HG2 ILE 1 2HG2 ILE 1 -13.609 -0.911 6.441 10 3HG2 ILE 1 3HG2 ILE 1 -12.812 -1.977 7.598 11 1HD1 ILE 1 1HD1 ILE 1 -9.455 -0.714 8.819 12 2HD1 ILE 1 2HD1 ILE 1 -11.001 -1.542 8.991 13 3HD1 ILE 1 3HD1 ILE 1 -10.526 -0.312 10.161 14 H LEU 2 H LEU 2 -11.130 2.292 6.764 15 HA LEU 2 HA LEU 2 -11.612 1.877 3.863 16 1HB LEU 2 2HB LEU 2 -12.226 4.269 5.182 17 2HB LEU 2 1HB LEU 2 -10.662 4.576 4.425 18 HG LEU 2 HG LEU 2 -12.058 3.218 2.452 19 1HD1 LEU 2 1HD1 LEU 2 -14.236 4.254 2.288 20 2HD1 LEU 2 2HD1 LEU 2 -13.917 5.260 3.701 21 3HD1 LEU 2 3HD1 LEU 2 -14.114 3.517 3.885 22 1HD2 LEU 2 1HD2 LEU 2 -11.808 5.212 1.249 23 2HD2 LEU 2 2HD2 LEU 2 -10.599 5.400 2.520 24 3HD2 LEU 2 3HD2 LEU 2 -12.155 6.217 2.656 25 H ALA 3 H ALA 3 -9.740 0.594 3.651 26 HA ALA 3 HA ALA 3 -7.215 1.782 3.316 27 1HB ALA 3 1HB ALA 3 -6.251 0.721 5.546 28 2HB ALA 3 2HB ALA 3 -7.914 0.912 6.099 29 3HB ALA 3 3HB ALA 3 -6.993 2.320 5.570 30 H TRP 4 H TRP 4 -5.871 0.258 2.379 31 HA TRP 4 HA TRP 4 -5.641 -2.492 2.974 32 1HB TRP 4 2HB TRP 4 -8.146 -1.840 1.885 33 2HB TRP 4 1HB TRP 4 -7.246 -2.546 0.545 34 HD1 TRP 4 HD1 TRP 4 -9.368 -3.558 3.287 35 HE1 TRP 4 1HE TRP 4 -9.031 -6.043 3.888 36 HE3 TRP 4 3HE TRP 4 -5.000 -4.478 0.810 37 HZ2 TRP 4 2HZ TRP 4 -7.154 -8.144 3.383 38 HZ3 TRP 4 3HZ TRP 4 -3.959 -6.726 0.887 39 HH2 TRP 4 HH2 TRP 4 -5.030 -8.558 2.169 40 H LYS 5 H LYS 5 -6.201 -0.666 -0.045 41 HA LYS 5 HA LYS 5 -3.961 -1.847 -1.437 42 1HB LYS 5 2HB LYS 5 -6.121 -0.676 -2.284 43 2HB LYS 5 1HB LYS 5 -5.236 0.828 -2.025 44 1HG LYS 5 2HG LYS 5 -3.870 0.479 -3.809 45 2HG LYS 5 1HG LYS 5 -3.721 -1.247 -3.476 46 1HD LYS 5 2HD LYS 5 -6.300 -0.097 -4.527 47 2HD LYS 5 1HD LYS 5 -4.989 -0.529 -5.625 48 1HE LYS 5 2HE LYS 5 -5.016 -2.802 -4.244 49 2HE LYS 5 1HE LYS 5 -6.692 -2.314 -3.922 50 1HZ LYS 5 1HZ LYS 5 -6.560 -3.548 -5.995 51 2HZ LYS 5 2HZ LYS 5 -5.404 -2.459 -6.598 52 3HZ LYS 5 3HZ LYS 5 -6.993 -1.935 -6.299 53 H TRP 6 H TRP 6 -4.060 0.365 1.091 54 HA TRP 6 HA TRP 6 -1.804 2.054 0.237 55 1HB TRP 6 2HB TRP 6 -3.880 2.166 2.166 56 2HB TRP 6 1HB TRP 6 -2.376 2.087 3.079 57 HD1 TRP 6 HD1 TRP 6 -4.538 4.611 1.958 58 HE1 TRP 6 1HE TRP 6 -3.321 6.800 1.346 59 HE3 TRP 6 3HE TRP 6 0.247 2.874 1.529 60 HZ2 TRP 6 2HZ TRP 6 -0.670 7.696 0.751 61 HZ3 TRP 6 3HZ TRP 6 2.096 4.415 0.940 62 HH2 TRP 6 HH2 TRP 6 1.644 6.822 0.550 63 H ALA 7 H ALA 7 -2.358 -0.499 2.684 64 HA ALA 7 HA ALA 7 0.228 -0.674 3.779 65 1HB ALA 7 1HB ALA 7 -0.983 -3.274 3.344 66 2HB ALA 7 2HB ALA 7 -2.213 -2.088 3.781 67 3HB ALA 7 3HB ALA 7 -0.835 -2.363 4.847 68 H TRP 8 H TRP 8 -0.919 -1.645 0.624 69 HA TRP 8 HA TRP 8 1.057 -3.573 -0.090 70 1HB TRP 8 2HB TRP 8 -0.811 -3.316 -1.507 71 2HB TRP 8 1HB TRP 8 -0.657 -1.562 -1.540 72 HD1 TRP 8 HD1 TRP 8 0.321 -0.677 -3.728 73 HE1 TRP 8 1HE TRP 8 1.852 -1.588 -5.580 74 HE3 TRP 8 3HE TRP 8 1.451 -5.212 -1.750 75 HZ2 TRP 8 2HZ TRP 8 3.367 -3.947 -6.148 76 HZ3 TRP 8 3HZ TRP 8 2.938 -6.790 -2.957 77 HH2 TRP 8 HH2 TRP 8 3.905 -6.157 -5.152 78 H TRP 9 H TRP 9 1.049 -0.479 -1.735 79 HA TRP 9 HA TRP 9 3.685 -0.321 -2.410 80 1HB TRP 9 2HB TRP 9 1.792 1.234 -2.978 81 2HB TRP 9 1HB TRP 9 2.026 2.003 -1.408 82 HD1 TRP 9 HD1 TRP 9 3.530 1.750 -4.873 83 HE1 TRP 9 1HE TRP 9 5.495 3.416 -5.059 84 HE3 TRP 9 3HE TRP 9 3.911 3.159 -0.018 85 HZ2 TRP 9 2HZ TRP 9 7.031 5.130 -3.339 86 HZ3 TRP 9 3HZ TRP 9 5.622 4.800 0.711 87 HH2 TRP 9 HH2 TRP 9 7.185 5.790 -0.947 88 H ALA 10 H ALA 10 2.384 0.144 0.812 89 HA ALA 10 HA ALA 10 4.640 1.503 1.988 90 1HB ALA 10 1HB ALA 10 3.316 -0.252 3.827 91 2HB ALA 10 2HB ALA 10 2.110 0.406 2.721 92 3HB ALA 10 3HB ALA 10 3.130 1.495 3.664 93 H TRP 11 H TRP 11 3.923 -1.875 1.295 94 HA TRP 11 HA TRP 11 6.073 -3.001 2.879 95 1HB TRP 11 2HB TRP 11 5.070 -4.938 2.185 96 2HB TRP 11 1HB TRP 11 3.832 -3.879 1.518 97 HD1 TRP 11 HD1 TRP 11 3.586 -3.800 -1.061 98 HE1 TRP 11 1HE TRP 11 4.822 -4.911 -3.028 99 HE3 TRP 11 3HE TRP 11 7.564 -5.794 1.411 100 HZ2 TRP 11 2HZ TRP 11 7.185 -6.452 -3.493 101 HZ3 TRP 11 3HZ TRP 11 9.298 -7.080 0.193 102 HH2 TRP 11 HH2 TRP 11 9.114 -7.409 -2.258 103 H ARG 12 H ARG 12 5.685 -2.217 -0.564 104 HA ARG 12 HA ARG 12 8.068 -3.153 -1.643 105 1HB ARG 12 2HB ARG 12 6.612 -0.542 -2.160 106 2HB ARG 12 1HB ARG 12 7.790 -1.261 -3.254 107 1HG ARG 12 2HG ARG 12 6.305 -3.366 -3.223 108 2HG ARG 12 1HG ARG 12 5.073 -2.352 -2.471 109 1HD ARG 12 2HD ARG 12 6.299 -2.061 -5.226 110 2HD ARG 12 1HD ARG 12 4.584 -2.202 -4.792 111 HE ARG 12 HE ARG 12 4.640 0.075 -3.962 112 1HH1 ARG 12 2HH1 ARG 12 6.719 -0.407 -6.442 113 2HH1 ARG 12 1HH1 ARG 12 7.832 0.860 -6.042 114 1HH2 ARG 12 1HH2 ARG 12 6.465 1.432 -2.907 115 2HH2 ARG 12 2HH2 ARG 12 7.687 1.900 -4.040 116 H ARG 13 H ARG 13 7.600 -0.400 0.491 117 HA ARG 13 HA ARG 13 10.347 0.606 0.062 118 1HB ARG 13 2HB ARG 13 7.981 1.779 0.632 119 2HB ARG 13 1HB ARG 13 8.595 1.564 2.272 120 1HG ARG 13 2HG ARG 13 9.951 3.335 1.998 121 2HG ARG 13 1HG ARG 13 10.749 2.510 0.656 122 1HD ARG 13 2HD ARG 13 8.092 3.701 0.035 123 2HD ARG 13 1HD ARG 13 9.415 4.848 0.330 124 HE ARG 13 HE ARG 13 9.287 2.903 -1.888 125 1HH1 ARG 13 1HH2 ARG 13 10.431 5.873 -1.172 126 2HH1 ARG 13 2HH2 ARG 13 12.046 5.636 -1.753 127 1HH2 ARG 13 1HH1 ARG 13 11.704 2.203 -2.094 128 2HH2 ARG 13 2HH1 ARG 13 12.766 3.558 -2.274 129 1HN NH2 14 1HN NH2 14 10.998 -1.803 0.913 130 2HN NH2 14 2HN NH2 14 11.296 -1.897 2.581 Start of MODEL 9 1 1H ILE 1 1H ILE 1 -12.188 2.268 9.712 2 2H ILE 1 2H ILE 1 -13.808 2.581 9.308 3 3H ILE 1 3H ILE 1 -12.825 3.827 9.912 4 HA ILE 1 HA ILE 1 -13.269 3.715 7.376 5 HB ILE 1 HB ILE 1 -11.782 5.252 8.602 6 1HG1 ILE 1 2HG1 ILE 1 -10.196 4.058 6.320 7 2HG1 ILE 1 1HG1 ILE 1 -11.691 4.952 6.045 8 1HG2 ILE 1 1HG2 ILE 1 -9.312 4.436 8.736 9 2HG2 ILE 1 2HG2 ILE 1 -10.004 2.818 8.618 10 3HG2 ILE 1 3HG2 ILE 1 -10.446 3.870 9.962 11 1HD1 ILE 1 1HD1 ILE 1 -9.917 6.547 5.844 12 2HD1 ILE 1 2HD1 ILE 1 -9.143 5.969 7.319 13 3HD1 ILE 1 3HD1 ILE 1 -10.671 6.843 7.409 14 H LEU 2 H LEU 2 -11.841 3.007 5.463 15 HA LEU 2 HA LEU 2 -11.008 0.150 5.850 16 1HB LEU 2 2HB LEU 2 -12.956 1.323 4.229 17 2HB LEU 2 1HB LEU 2 -11.612 1.020 3.127 18 HG LEU 2 HG LEU 2 -11.910 -1.249 4.857 19 1HD1 LEU 2 1HD1 LEU 2 -14.272 -1.687 3.526 20 2HD1 LEU 2 2HD1 LEU 2 -14.419 0.016 3.962 21 3HD1 LEU 2 3HD1 LEU 2 -14.154 -1.196 5.216 22 1HD2 LEU 2 1HD2 LEU 2 -10.987 -1.793 2.826 23 2HD2 LEU 2 2HD2 LEU 2 -11.927 -0.579 1.958 24 3HD2 LEU 2 3HD2 LEU 2 -12.670 -2.114 2.408 25 H ALA 3 H ALA 3 -8.822 1.114 6.410 26 HA ALA 3 HA ALA 3 -7.365 2.252 4.070 27 1HB ALA 3 1HB ALA 3 -5.619 2.568 5.948 28 2HB ALA 3 2HB ALA 3 -6.896 2.050 7.049 29 3HB ALA 3 3HB ALA 3 -7.107 3.505 6.076 30 H TRP 4 H TRP 4 -8.092 -0.570 4.057 31 HA TRP 4 HA TRP 4 -5.898 -2.223 4.932 32 1HB TRP 4 2HB TRP 4 -8.468 -2.474 3.813 33 2HB TRP 4 1HB TRP 4 -7.377 -3.264 2.675 34 HD1 TRP 4 HD1 TRP 4 -9.249 -3.963 5.708 35 HE1 TRP 4 1HE TRP 4 -8.345 -6.060 6.910 36 HE3 TRP 4 3HE TRP 4 -4.787 -4.502 3.292 37 HZ2 TRP 4 2HZ TRP 4 -6.029 -7.742 6.851 38 HZ3 TRP 4 3HZ TRP 4 -3.250 -6.356 3.883 39 HH2 TRP 4 HH2 TRP 4 -3.865 -7.974 5.657 40 H LYS 5 H LYS 5 -6.610 -0.582 1.862 41 HA LYS 5 HA LYS 5 -4.402 -1.845 0.437 42 1HB LYS 5 2HB LYS 5 -6.325 0.436 -0.035 43 2HB LYS 5 1HB LYS 5 -5.030 0.090 -1.182 44 1HG LYS 5 2HG LYS 5 -6.326 -2.375 -0.482 45 2HG LYS 5 1HG LYS 5 -7.553 -1.204 -0.968 46 1HD LYS 5 2HD LYS 5 -6.972 -1.997 -3.053 47 2HD LYS 5 1HD LYS 5 -5.771 -0.714 -2.902 48 1HE LYS 5 2HE LYS 5 -4.339 -2.614 -1.731 49 2HE LYS 5 1HE LYS 5 -5.402 -3.683 -2.669 50 1HZ LYS 5 1HZ LYS 5 -4.923 -1.978 -4.546 51 2HZ LYS 5 2HZ LYS 5 -3.781 -3.189 -4.207 52 3HZ LYS 5 3HZ LYS 5 -3.545 -1.610 -3.628 53 H TRP 6 H TRP 6 -4.339 0.286 2.930 54 HA TRP 6 HA TRP 6 -2.259 2.095 1.833 55 1HB TRP 6 2HB TRP 6 -4.293 2.422 3.616 56 2HB TRP 6 1HB TRP 6 -2.956 2.096 4.717 57 HD1 TRP 6 HD1 TRP 6 -4.553 4.890 3.065 58 HE1 TRP 6 1HE TRP 6 -2.984 6.927 2.904 59 HE3 TRP 6 3HE TRP 6 -0.084 2.658 4.146 60 HZ2 TRP 6 2HZ TRP 6 -0.205 7.534 3.195 61 HZ3 TRP 6 3HZ TRP 6 2.004 3.990 4.197 62 HH2 TRP 6 HH2 TRP 6 1.950 6.423 3.724 63 H ALA 7 H ALA 7 -2.568 -0.285 4.506 64 HA ALA 7 HA ALA 7 0.076 -0.250 5.456 65 1HB ALA 7 1HB ALA 7 -1.529 -1.509 6.637 66 2HB ALA 7 2HB ALA 7 -0.516 -2.756 5.910 67 3HB ALA 7 3HB ALA 7 -2.072 -2.348 5.184 68 H TRP 8 H TRP 8 -1.152 -1.481 2.433 69 HA TRP 8 HA TRP 8 0.765 -3.427 1.729 70 1HB TRP 8 2HB TRP 8 -1.069 -3.097 0.285 71 2HB TRP 8 1HB TRP 8 -0.839 -1.353 0.244 72 HD1 TRP 8 HD1 TRP 8 0.215 -0.520 -1.929 73 HE1 TRP 8 1HE TRP 8 1.726 -1.508 -3.760 74 HE3 TRP 8 3HE TRP 8 1.094 -5.102 0.068 75 HZ2 TRP 8 2HZ TRP 8 3.130 -3.940 -4.304 76 HZ3 TRP 8 3HZ TRP 8 2.518 -6.753 -1.116 77 HH2 TRP 8 HH2 TRP 8 3.543 -6.172 -3.300 78 H TRP 9 H TRP 9 0.925 -0.349 0.064 79 HA TRP 9 HA TRP 9 3.566 -0.331 -0.601 80 1HB TRP 9 2HB TRP 9 1.752 1.326 -1.166 81 2HB TRP 9 1HB TRP 9 2.049 2.091 0.396 82 HD1 TRP 9 HD1 TRP 9 3.493 1.725 -3.082 83 HE1 TRP 9 1HE TRP 9 5.563 3.254 -3.299 84 HE3 TRP 9 3HE TRP 9 4.026 3.127 1.761 85 HZ2 TRP 9 2HZ TRP 9 7.231 4.868 -1.604 86 HZ3 TRP 9 3HZ TRP 9 5.851 4.649 2.464 87 HH2 TRP 9 HH2 TRP 9 7.458 5.525 0.782 88 H ALA 10 H ALA 10 2.289 0.216 2.620 89 HA ALA 10 HA ALA 10 4.624 1.450 3.786 90 1HB ALA 10 1HB ALA 10 2.031 0.482 4.533 91 2HB ALA 10 2HB ALA 10 3.084 1.578 5.427 92 3HB ALA 10 3HB ALA 10 3.217 -0.164 5.666 93 H TRP 11 H TRP 11 3.667 -1.901 3.194 94 HA TRP 11 HA TRP 11 5.739 -3.138 4.778 95 1HB TRP 11 2HB TRP 11 4.641 -5.019 4.068 96 2HB TRP 11 1HB TRP 11 3.474 -3.893 3.380 97 HD1 TRP 11 HD1 TRP 11 3.281 -3.795 0.797 98 HE1 TRP 11 1HE TRP 11 4.485 -4.973 -1.150 99 HE3 TRP 11 3HE TRP 11 7.088 -6.025 3.335 100 HZ2 TRP 11 2HZ TRP 11 6.759 -6.650 -1.577 101 HZ3 TRP 11 3HZ TRP 11 8.763 -7.411 2.144 102 HH2 TRP 11 HH2 TRP 11 8.603 -7.724 -0.311 103 H ARG 12 H ARG 12 5.456 -2.270 1.352 104 HA ARG 12 HA ARG 12 7.804 -3.362 0.307 105 1HB ARG 12 2HB ARG 12 6.475 -0.691 -0.245 106 2HB ARG 12 1HB ARG 12 7.639 -1.464 -1.318 107 1HG ARG 12 2HG ARG 12 6.050 -3.511 -1.265 108 2HG ARG 12 1HG ARG 12 4.854 -2.403 -0.595 109 1HD ARG 12 2HD ARG 12 6.178 -2.306 -3.315 110 2HD ARG 12 1HD ARG 12 4.447 -2.283 -2.925 111 HE ARG 12 HE ARG 12 4.789 -0.006 -1.972 112 1HH1 ARG 12 2HH1 ARG 12 6.306 -0.894 -4.792 113 2HH1 ARG 12 1HH1 ARG 12 7.462 0.397 -4.803 114 1HH2 ARG 12 1HH2 ARG 12 6.702 1.460 -1.591 115 2HH2 ARG 12 2HH2 ARG 12 7.686 1.730 -2.991 116 H ARG 13 H ARG 13 7.407 -0.333 2.133 117 HA ARG 13 HA ARG 13 9.884 0.894 1.840 118 1HB ARG 13 2HB ARG 13 7.905 1.620 3.209 119 2HB ARG 13 1HB ARG 13 8.383 0.448 4.440 120 1HG ARG 13 2HG ARG 13 9.969 1.829 5.249 121 2HG ARG 13 1HG ARG 13 10.635 2.100 3.637 122 1HD ARG 13 2HD ARG 13 8.072 3.459 4.507 123 2HD ARG 13 1HD ARG 13 9.661 4.173 4.848 124 HE ARG 13 HE ARG 13 8.530 3.702 2.137 125 1HH1 ARG 13 1HH2 ARG 13 9.867 6.154 3.699 126 2HH1 ARG 13 2HH2 ARG 13 11.256 6.374 2.688 127 1HH2 ARG 13 1HH1 ARG 13 10.858 3.354 1.031 128 2HH2 ARG 13 2HH1 ARG 13 11.816 4.788 1.177 129 1HN NH2 14 1HN NH2 14 9.195 -2.118 3.597 130 2HN NH2 14 2HN NH2 14 10.796 -2.424 4.070 Start of MODEL 10 1 1H ILE 1 1H ILE 1 -13.814 -0.402 8.222 2 2H ILE 1 2H ILE 1 -13.104 1.121 7.971 3 3H ILE 1 3H ILE 1 -12.869 0.303 9.442 4 HA ILE 1 HA ILE 1 -10.907 -0.271 8.475 5 HB ILE 1 HB ILE 1 -12.877 -2.167 7.158 6 1HG1 ILE 1 2HG1 ILE 1 -11.680 -2.341 9.938 7 2HG1 ILE 1 1HG1 ILE 1 -13.294 -1.705 9.618 8 1HG2 ILE 1 1HG2 ILE 1 -10.123 -2.094 7.000 9 2HG2 ILE 1 2HG2 ILE 1 -11.109 -3.539 6.777 10 3HG2 ILE 1 3HG2 ILE 1 -10.393 -3.194 8.351 11 1HD1 ILE 1 1HD1 ILE 1 -12.434 -4.427 8.632 12 2HD1 ILE 1 2HD1 ILE 1 -14.072 -3.792 8.793 13 3HD1 ILE 1 3HD1 ILE 1 -13.137 -4.197 10.233 14 H LEU 2 H LEU 2 -10.995 1.828 7.047 15 HA LEU 2 HA LEU 2 -11.362 1.181 4.156 16 1HB LEU 2 2HB LEU 2 -11.570 3.525 5.926 17 2HB LEU 2 1HB LEU 2 -10.760 3.866 4.395 18 HG LEU 2 HG LEU 2 -13.384 2.371 4.539 19 1HD1 LEU 2 1HD1 LEU 2 -14.268 4.345 5.239 20 2HD1 LEU 2 2HD1 LEU 2 -13.993 4.868 3.577 21 3HD1 LEU 2 3HD1 LEU 2 -12.810 5.248 4.828 22 1HD2 LEU 2 1HD2 LEU 2 -12.850 2.078 2.357 23 2HD2 LEU 2 2HD2 LEU 2 -11.519 3.230 2.455 24 3HD2 LEU 2 3HD2 LEU 2 -13.161 3.802 2.160 25 H ALA 3 H ALA 3 -9.399 0.067 3.687 26 HA ALA 3 HA ALA 3 -7.131 1.527 2.929 27 1HB ALA 3 1HB ALA 3 -7.352 0.935 5.810 28 2HB ALA 3 2HB ALA 3 -6.377 2.151 4.986 29 3HB ALA 3 3HB ALA 3 -5.801 0.488 5.098 30 H TRP 4 H TRP 4 -5.743 0.142 1.843 31 HA TRP 4 HA TRP 4 -5.092 -2.537 2.447 32 1HB TRP 4 2HB TRP 4 -7.792 -2.218 1.720 33 2HB TRP 4 1HB TRP 4 -7.008 -2.898 0.296 34 HD1 TRP 4 HD1 TRP 4 -8.608 -3.977 3.345 35 HE1 TRP 4 1HE TRP 4 -7.904 -6.369 4.002 36 HE3 TRP 4 3HE TRP 4 -4.524 -4.550 0.335 37 HZ2 TRP 4 2HZ TRP 4 -5.873 -8.272 3.338 38 HZ3 TRP 4 3HZ TRP 4 -3.224 -6.658 0.367 39 HH2 TRP 4 HH2 TRP 4 -3.892 -8.519 1.864 40 H LYS 5 H LYS 5 -6.321 -0.922 -0.491 41 HA LYS 5 HA LYS 5 -4.158 -1.863 -2.167 42 1HB LYS 5 2HB LYS 5 -6.379 0.166 -2.331 43 2HB LYS 5 1HB LYS 5 -5.171 0.080 -3.615 44 1HG LYS 5 2HG LYS 5 -5.858 -2.583 -3.170 45 2HG LYS 5 1HG LYS 5 -7.394 -1.723 -3.048 46 1HD LYS 5 2HD LYS 5 -7.312 -2.030 -5.337 47 2HD LYS 5 1HD LYS 5 -6.460 -0.490 -5.219 48 1HE LYS 5 2HE LYS 5 -4.376 -1.458 -5.613 49 2HE LYS 5 1HE LYS 5 -4.882 -3.041 -4.991 50 1HZ LYS 5 1HZ LYS 5 -4.828 -3.142 -7.376 51 2HZ LYS 5 2HZ LYS 5 -5.790 -1.748 -7.508 52 3HZ LYS 5 3HZ LYS 5 -6.448 -3.181 -6.876 53 H TRP 6 H TRP 6 -4.210 0.421 0.285 54 HA TRP 6 HA TRP 6 -2.369 2.372 -0.942 55 1HB TRP 6 2HB TRP 6 -4.166 2.304 1.240 56 2HB TRP 6 1HB TRP 6 -2.565 2.445 1.959 57 HD1 TRP 6 HD1 TRP 6 -5.145 4.645 1.090 58 HE1 TRP 6 1HE TRP 6 -4.305 6.942 0.275 59 HE3 TRP 6 3HE TRP 6 -0.280 3.489 0.045 60 HZ2 TRP 6 2HZ TRP 6 -1.890 8.133 -0.693 61 HZ3 TRP 6 3HZ TRP 6 1.266 5.221 -0.821 62 HH2 TRP 6 HH2 TRP 6 0.468 7.539 -1.191 63 H ALA 7 H ALA 7 -2.213 -0.056 1.684 64 HA ALA 7 HA ALA 7 0.474 0.145 2.418 65 1HB ALA 7 1HB ALA 7 -1.593 -2.005 2.254 66 2HB ALA 7 2HB ALA 7 -0.752 -1.369 3.668 67 3HB ALA 7 3HB ALA 7 0.064 -2.504 2.594 68 H TRP 8 H TRP 8 -0.905 -1.247 -0.505 69 HA TRP 8 HA TRP 8 1.075 -2.888 -1.524 70 1HB TRP 8 2HB TRP 8 -0.820 -2.554 -2.856 71 2HB TRP 8 1HB TRP 8 -0.747 -0.803 -2.693 72 HD1 TRP 8 HD1 TRP 8 0.081 0.381 -4.788 73 HE1 TRP 8 1HE TRP 8 1.544 -0.224 -6.814 74 HE3 TRP 8 3HE TRP 8 1.476 -4.329 -3.471 75 HZ2 TRP 8 2HZ TRP 8 3.107 -2.424 -7.754 76 HZ3 TRP 8 3HZ TRP 8 2.952 -5.669 -4.947 77 HH2 TRP 8 HH2 TRP 8 3.774 -4.718 -7.085 78 H TRP 9 H TRP 9 1.028 0.367 -2.865 79 HA TRP 9 HA TRP 9 3.672 0.544 -3.629 80 1HB TRP 9 2HB TRP 9 1.735 2.128 -4.025 81 2HB TRP 9 1HB TRP 9 2.066 2.813 -2.433 82 HD1 TRP 9 HD1 TRP 9 3.355 2.730 -5.983 83 HE1 TRP 9 1HE TRP 9 5.341 4.366 -6.200 84 HE3 TRP 9 3HE TRP 9 4.081 3.854 -1.083 85 HZ2 TRP 9 2HZ TRP 9 7.022 5.947 -4.492 86 HZ3 TRP 9 3HZ TRP 9 5.872 5.419 -0.383 87 HH2 TRP 9 HH2 TRP 9 7.345 6.469 -2.084 88 H ALA 10 H ALA 10 2.442 0.722 -0.362 89 HA ALA 10 HA ALA 10 4.801 1.996 0.796 90 1HB ALA 10 1HB ALA 10 2.743 0.247 2.158 91 2HB ALA 10 2HB ALA 10 2.386 1.903 1.665 92 3HB ALA 10 3HB ALA 10 3.652 1.589 2.852 93 H TRP 11 H TRP 11 3.509 -1.333 1.178 94 HA TRP 11 HA TRP 11 5.698 -2.560 2.370 95 1HB TRP 11 2HB TRP 11 4.478 -4.434 1.883 96 2HB TRP 11 1HB TRP 11 3.309 -3.307 1.203 97 HD1 TRP 11 HD1 TRP 11 2.717 -3.705 -1.240 98 HE1 TRP 11 1HE TRP 11 3.761 -4.977 -3.218 99 HE3 TRP 11 3HE TRP 11 7.106 -5.145 0.875 100 HZ2 TRP 11 2HZ TRP 11 6.157 -6.411 -3.827 101 HZ3 TRP 11 3HZ TRP 11 8.765 -6.458 -0.415 102 HH2 TRP 11 HH2 TRP 11 8.297 -7.090 -2.767 103 H ARG 12 H ARG 12 5.175 -1.997 -1.089 104 HA ARG 12 HA ARG 12 7.212 -3.234 -2.371 105 1HB ARG 12 2HB ARG 12 6.316 -0.351 -2.588 106 2HB ARG 12 1HB ARG 12 7.316 -1.145 -3.804 107 1HG ARG 12 2HG ARG 12 5.539 -2.913 -4.020 108 2HG ARG 12 1HG ARG 12 4.524 -1.956 -2.942 109 1HD ARG 12 2HD ARG 12 3.807 -1.157 -5.016 110 2HD ARG 12 1HD ARG 12 5.121 -0.015 -4.682 111 HE ARG 12 HE ARG 12 5.484 -2.486 -6.338 112 1HH1 ARG 12 2HH1 ARG 12 5.194 0.687 -6.934 113 2HH1 ARG 12 1HH1 ARG 12 6.795 0.959 -7.534 114 1HH2 ARG 12 1HH2 ARG 12 8.001 -2.114 -6.474 115 2HH2 ARG 12 2HH2 ARG 12 8.384 -0.626 -7.273 116 H ARG 13 H ARG 13 7.588 -0.336 -0.344 117 HA ARG 13 HA ARG 13 10.329 0.221 -0.869 118 1HB ARG 13 2HB ARG 13 8.742 1.695 0.310 119 2HB ARG 13 1HB ARG 13 8.659 0.547 1.646 120 1HG ARG 13 2HG ARG 13 10.679 1.186 2.488 121 2HG ARG 13 1HG ARG 13 11.392 1.380 0.886 122 1HD ARG 13 2HD ARG 13 9.310 3.336 1.883 123 2HD ARG 13 1HD ARG 13 11.027 3.542 2.285 124 HE ARG 13 HE ARG 13 9.875 3.644 -0.453 125 1HH1 ARG 13 1HH2 ARG 13 11.753 5.610 1.101 126 2HH1 ARG 13 2HH2 ARG 13 13.210 5.403 0.189 127 1HH2 ARG 13 1HH1 ARG 13 12.118 2.521 -1.401 128 2HH2 ARG 13 2HH1 ARG 13 13.416 3.653 -1.229 129 1HN NH2 14 1HN NH2 14 8.835 -2.049 1.481 130 2HN NH2 14 2HN NH2 14 10.287 -2.806 1.927 Start of MODEL 11 1 1H ILE 1 1H ILE 1 -9.488 6.217 3.134 2 2H ILE 1 2H ILE 1 -10.789 5.341 3.788 3 3H ILE 1 3H ILE 1 -10.697 5.608 2.113 4 HA ILE 1 HA ILE 1 -10.020 3.308 2.935 5 HB ILE 1 HB ILE 1 -9.631 4.437 0.703 6 1HG1 ILE 1 2HG1 ILE 1 -7.144 2.907 1.098 7 2HG1 ILE 1 1HG1 ILE 1 -8.586 2.100 1.719 8 1HG2 ILE 1 1HG2 ILE 1 -7.596 5.549 0.251 9 2HG2 ILE 1 2HG2 ILE 1 -6.825 4.915 1.705 10 3HG2 ILE 1 3HG2 ILE 1 -8.064 6.164 1.836 11 1HD1 ILE 1 1HD1 ILE 1 -7.761 2.096 -0.925 12 2HD1 ILE 1 2HD1 ILE 1 -9.013 3.338 -0.903 13 3HD1 ILE 1 3HD1 ILE 1 -9.385 1.702 -0.360 14 H LEU 2 H LEU 2 -9.146 5.381 5.048 15 HA LEU 2 HA LEU 2 -6.310 4.610 5.474 16 1HB LEU 2 2HB LEU 2 -8.198 6.722 6.301 17 2HB LEU 2 1HB LEU 2 -7.101 6.195 7.578 18 HG LEU 2 HG LEU 2 -5.383 6.370 5.461 19 1HD1 LEU 2 1HD1 LEU 2 -7.565 8.437 5.109 20 2HD1 LEU 2 2HD1 LEU 2 -6.940 7.308 3.907 21 3HD1 LEU 2 3HD1 LEU 2 -5.940 8.652 4.458 22 1HD2 LEU 2 1HD2 LEU 2 -6.229 8.419 7.520 23 2HD2 LEU 2 2HD2 LEU 2 -4.851 8.680 6.451 24 3HD2 LEU 2 3HD2 LEU 2 -4.847 7.326 7.579 25 H ALA 3 H ALA 3 -7.044 2.283 5.864 26 HA ALA 3 HA ALA 3 -7.036 1.640 8.639 27 1HB ALA 3 1HB ALA 3 -9.614 2.301 7.391 28 2HB ALA 3 2HB ALA 3 -9.184 2.223 9.099 29 3HB ALA 3 3HB ALA 3 -9.621 0.752 8.231 30 H TRP 4 H TRP 4 -6.262 -0.452 8.662 31 HA TRP 4 HA TRP 4 -6.013 -2.737 8.073 32 1HB TRP 4 2HB TRP 4 -8.570 -2.045 7.289 33 2HB TRP 4 1HB TRP 4 -7.855 -2.634 5.787 34 HD1 TRP 4 HD1 TRP 4 -9.727 -3.906 8.542 35 HE1 TRP 4 1HE TRP 4 -9.315 -6.420 8.937 36 HE3 TRP 4 3HE TRP 4 -5.472 -4.542 5.796 37 HZ2 TRP 4 2HZ TRP 4 -7.427 -8.434 8.189 38 HZ3 TRP 4 3HZ TRP 4 -4.387 -6.766 5.655 39 HH2 TRP 4 HH2 TRP 4 -5.357 -8.711 6.847 40 H LYS 5 H LYS 5 -6.599 -0.709 5.197 41 HA LYS 5 HA LYS 5 -4.566 -2.084 3.617 42 1HB LYS 5 2HB LYS 5 -6.276 0.397 3.332 43 2HB LYS 5 1HB LYS 5 -5.088 -0.048 2.106 44 1HG LYS 5 2HG LYS 5 -6.644 -2.366 2.831 45 2HG LYS 5 1HG LYS 5 -7.721 -1.044 2.378 46 1HD LYS 5 2HD LYS 5 -7.236 -1.386 0.211 47 2HD LYS 5 1HD LYS 5 -5.534 -1.059 0.542 48 1HE LYS 5 2HE LYS 5 -5.676 -3.580 1.505 49 2HE LYS 5 1HE LYS 5 -6.927 -3.672 0.251 50 1HZ LYS 5 1HZ LYS 5 -5.403 -2.762 -1.347 51 2HZ LYS 5 2HZ LYS 5 -4.676 -4.117 -0.622 52 3HZ LYS 5 3HZ LYS 5 -4.207 -2.550 -0.162 53 H TRP 6 H TRP 6 -4.340 0.018 6.169 54 HA TRP 6 HA TRP 6 -2.080 1.628 5.129 55 1HB TRP 6 2HB TRP 6 -4.056 1.884 7.164 56 2HB TRP 6 1HB TRP 6 -2.498 1.808 7.982 57 HD1 TRP 6 HD1 TRP 6 -4.708 4.278 6.612 58 HE1 TRP 6 1HE TRP 6 -3.456 6.421 5.918 59 HE3 TRP 6 3HE TRP 6 0.097 2.538 6.603 60 HZ2 TRP 6 2HZ TRP 6 -0.775 7.285 5.424 61 HZ3 TRP 6 3HZ TRP 6 1.977 4.041 6.017 62 HH2 TRP 6 HH2 TRP 6 1.547 6.411 5.429 63 H ALA 7 H ALA 7 -2.640 -0.786 7.722 64 HA ALA 7 HA ALA 7 -0.035 -1.089 8.694 65 1HB ALA 7 1HB ALA 7 -1.595 -3.564 8.197 66 2HB ALA 7 2HB ALA 7 -2.468 -2.276 9.028 67 3HB ALA 7 3HB ALA 7 -0.976 -2.917 9.716 68 H TRP 8 H TRP 8 -1.362 -2.064 5.608 69 HA TRP 8 HA TRP 8 0.575 -4.042 4.859 70 1HB TRP 8 2HB TRP 8 -1.423 -3.875 3.594 71 2HB TRP 8 1HB TRP 8 -1.264 -2.130 3.420 72 HD1 TRP 8 HD1 TRP 8 -0.481 -1.438 1.088 73 HE1 TRP 8 1HE TRP 8 0.938 -2.488 -0.781 74 HE3 TRP 8 3HE TRP 8 0.865 -5.767 3.366 75 HZ2 TRP 8 2HZ TRP 8 2.455 -4.870 -1.246 76 HZ3 TRP 8 3HZ TRP 8 2.295 -7.427 2.202 77 HH2 TRP 8 HH2 TRP 8 3.099 -6.977 -0.102 78 H TRP 9 H TRP 9 0.385 -1.077 3.011 79 HA TRP 9 HA TRP 9 2.967 -0.914 2.160 80 1HB TRP 9 2HB TRP 9 1.001 0.552 1.601 81 2HB TRP 9 1HB TRP 9 1.315 1.444 3.091 82 HD1 TRP 9 HD1 TRP 9 2.604 0.955 -0.435 83 HE1 TRP 9 1HE TRP 9 4.510 2.642 -0.874 84 HE3 TRP 9 3HE TRP 9 3.250 2.748 4.263 85 HZ2 TRP 9 2HZ TRP 9 6.105 4.517 0.607 86 HZ3 TRP 9 3HZ TRP 9 4.960 4.477 4.752 87 HH2 TRP 9 HH2 TRP 9 6.390 5.365 2.926 88 H ALA 10 H ALA 10 1.860 -0.231 5.416 89 HA ALA 10 HA ALA 10 4.156 1.257 6.333 90 1HB ALA 10 1HB ALA 10 1.944 -0.379 7.548 91 2HB ALA 10 2HB ALA 10 2.236 1.355 7.676 92 3HB ALA 10 3HB ALA 10 3.250 0.222 8.570 93 H TRP 11 H TRP 11 3.460 -2.183 5.980 94 HA TRP 11 HA TRP 11 5.727 -3.137 7.513 95 1HB TRP 11 2HB TRP 11 4.731 -5.146 7.040 96 2HB TRP 11 1HB TRP 11 3.425 -4.165 6.381 97 HD1 TRP 11 HD1 TRP 11 2.990 -4.314 3.833 98 HE1 TRP 11 1HE TRP 11 4.123 -5.544 1.873 99 HE3 TRP 11 3HE TRP 11 7.200 -5.988 6.155 100 HZ2 TRP 11 2HZ TRP 11 6.498 -7.047 1.358 101 HZ3 TRP 11 3HZ TRP 11 8.886 -7.317 4.916 102 HH2 TRP 11 HH2 TRP 11 8.541 -7.845 2.518 103 H ARG 12 H ARG 12 5.109 -2.668 4.048 104 HA ARG 12 HA ARG 12 7.409 -3.665 2.879 105 1HB ARG 12 2HB ARG 12 5.910 -1.094 2.297 106 2HB ARG 12 1HB ARG 12 7.030 -1.861 1.175 107 1HG ARG 12 2HG ARG 12 5.576 -3.983 1.445 108 2HG ARG 12 1HG ARG 12 4.373 -2.918 2.173 109 1HD ARG 12 2HD ARG 12 5.454 -2.864 -0.654 110 2HD ARG 12 1HD ARG 12 3.764 -2.930 -0.115 111 HE ARG 12 HE ARG 12 3.939 -0.593 0.573 112 1HH1 ARG 12 2HH1 ARG 12 5.369 -1.049 -2.235 113 2HH1 ARG 12 1HH1 ARG 12 6.654 0.100 -2.065 114 1HH2 ARG 12 1HH2 ARG 12 6.179 0.527 1.343 115 2HH2 ARG 12 2HH2 ARG 12 7.113 0.992 -0.040 116 H ARG 13 H ARG 13 7.049 -0.325 4.144 117 HA ARG 13 HA ARG 13 9.564 0.727 3.672 118 1HB ARG 13 2HB ARG 13 7.584 1.761 4.848 119 2HB ARG 13 1HB ARG 13 8.059 0.880 6.301 120 1HG ARG 13 2HG ARG 13 10.053 2.099 6.543 121 2HG ARG 13 1HG ARG 13 10.046 2.624 4.859 122 1HD ARG 13 2HD ARG 13 9.355 4.557 6.093 123 2HD ARG 13 1HD ARG 13 7.842 3.872 5.465 124 HE ARG 13 HE ARG 13 8.590 3.962 8.271 125 1HH1 ARG 13 1HH1 ARG 13 5.834 3.651 6.848 126 2HH1 ARG 13 2HH1 ARG 13 5.335 2.124 7.496 127 1HH2 ARG 13 1HH2 ARG 13 8.489 1.294 8.673 128 2HH2 ARG 13 2HH2 ARG 13 6.838 0.789 8.528 129 1HN NH2 14 1HN NH2 14 8.724 -1.623 6.255 130 2HN NH2 14 2HN NH2 14 10.328 -1.963 6.698 Start of MODEL 12 1 1H ILE 1 1H ILE 1 -8.575 2.720 0.042 2 2H ILE 1 2H ILE 1 -10.117 2.079 0.351 3 3H ILE 1 3H ILE 1 -8.797 1.630 1.322 4 HA ILE 1 HA ILE 1 -9.570 4.472 1.155 5 HB ILE 1 HB ILE 1 -11.580 2.972 1.523 6 1HG1 ILE 1 2HG1 ILE 1 -10.960 4.465 4.064 7 2HG1 ILE 1 1HG1 ILE 1 -11.138 5.345 2.545 8 1HG2 ILE 1 1HG2 ILE 1 -9.774 1.600 3.165 9 2HG2 ILE 1 2HG2 ILE 1 -11.507 1.303 3.038 10 3HG2 ILE 1 3HG2 ILE 1 -10.887 2.382 4.286 11 1HD1 ILE 1 1HD1 ILE 1 -13.379 4.582 2.250 12 2HD1 ILE 1 2HD1 ILE 1 -13.265 5.078 3.939 13 3HD1 ILE 1 3HD1 ILE 1 -13.207 3.366 3.516 14 H LEU 2 H LEU 2 -9.209 5.317 3.519 15 HA LEU 2 HA LEU 2 -6.497 4.630 4.314 16 1HB LEU 2 2HB LEU 2 -8.638 6.570 4.983 17 2HB LEU 2 1HB LEU 2 -7.489 6.237 6.278 18 HG LEU 2 HG LEU 2 -5.617 6.739 4.738 19 1HD1 LEU 2 1HD1 LEU 2 -7.634 7.802 2.772 20 2HD1 LEU 2 2HD1 LEU 2 -7.133 6.112 2.700 21 3HD1 LEU 2 3HD1 LEU 2 -5.938 7.394 2.508 22 1HD2 LEU 2 1HD2 LEU 2 -6.709 8.527 6.138 23 2HD2 LEU 2 2HD2 LEU 2 -7.692 8.953 4.736 24 3HD2 LEU 2 3HD2 LEU 2 -5.940 9.144 4.675 25 H ALA 3 H ALA 3 -7.051 2.263 4.777 26 HA ALA 3 HA ALA 3 -7.121 1.721 7.556 27 1HB ALA 3 1HB ALA 3 -9.595 0.739 7.388 28 2HB ALA 3 2HB ALA 3 -9.746 1.978 6.142 29 3HB ALA 3 3HB ALA 3 -9.316 2.433 7.792 30 H TRP 4 H TRP 4 -6.213 -0.313 7.649 31 HA TRP 4 HA TRP 4 -5.846 -2.604 7.164 32 1HB TRP 4 2HB TRP 4 -8.446 -2.047 6.325 33 2HB TRP 4 1HB TRP 4 -7.691 -2.777 4.907 34 HD1 TRP 4 HD1 TRP 4 -9.510 -3.767 7.842 35 HE1 TRP 4 1HE TRP 4 -9.034 -6.215 8.499 36 HE3 TRP 4 3HE TRP 4 -5.317 -4.625 5.059 37 HZ2 TRP 4 2HZ TRP 4 -7.124 -8.265 7.920 38 HZ3 TRP 4 3HZ TRP 4 -4.190 -6.830 5.131 39 HH2 TRP 4 HH2 TRP 4 -5.086 -8.650 6.557 40 H LYS 5 H LYS 5 -6.542 -0.725 4.209 41 HA LYS 5 HA LYS 5 -4.485 -2.095 2.659 42 1HB LYS 5 2HB LYS 5 -6.233 0.351 2.295 43 2HB LYS 5 1HB LYS 5 -5.074 -0.159 1.067 44 1HG LYS 5 2HG LYS 5 -7.012 -2.162 2.186 45 2HG LYS 5 1HG LYS 5 -7.554 -1.027 0.950 46 1HD LYS 5 2HD LYS 5 -6.141 -1.903 -0.672 47 2HD LYS 5 1HD LYS 5 -4.984 -2.502 0.515 48 1HE LYS 5 2HE LYS 5 -6.072 -4.498 0.734 49 2HE LYS 5 1HE LYS 5 -7.671 -3.727 0.711 50 1HZ LYS 5 1HZ LYS 5 -7.303 -5.001 -1.315 51 2HZ LYS 5 2HZ LYS 5 -5.895 -4.109 -1.644 52 3HZ LYS 5 3HZ LYS 5 -7.413 -3.344 -1.664 53 H TRP 6 H TRP 6 -4.269 0.072 5.148 54 HA TRP 6 HA TRP 6 -2.080 1.728 4.033 55 1HB TRP 6 2HB TRP 6 -4.012 1.943 6.125 56 2HB TRP 6 1HB TRP 6 -2.425 1.957 6.885 57 HD1 TRP 6 HD1 TRP 6 -4.798 4.283 5.514 58 HE1 TRP 6 1HE TRP 6 -3.668 6.465 4.736 59 HE3 TRP 6 3HE TRP 6 0.086 2.777 5.437 60 HZ2 TRP 6 2HZ TRP 6 -1.045 7.446 4.157 61 HZ3 TRP 6 3HZ TRP 6 1.877 4.355 4.769 62 HH2 TRP 6 HH2 TRP 6 1.318 6.686 4.130 63 H ALA 7 H ALA 7 -2.509 -0.646 6.685 64 HA ALA 7 HA ALA 7 0.128 -0.841 7.598 65 1HB ALA 7 1HB ALA 7 -1.138 -3.440 7.359 66 2HB ALA 7 2HB ALA 7 -2.330 -2.219 7.802 67 3HB ALA 7 3HB ALA 7 -0.900 -2.458 8.805 68 H TRP 8 H TRP 8 -1.262 -2.017 4.599 69 HA TRP 8 HA TRP 8 0.679 -3.959 3.845 70 1HB TRP 8 2HB TRP 8 -1.300 -3.801 2.567 71 2HB TRP 8 1HB TRP 8 -1.168 -2.052 2.415 72 HD1 TRP 8 HD1 TRP 8 -0.375 -1.296 0.109 73 HE1 TRP 8 1HE TRP 8 1.020 -2.308 -1.799 74 HE3 TRP 8 3HE TRP 8 0.960 -5.695 2.261 75 HZ2 TRP 8 2HZ TRP 8 2.514 -4.686 -2.341 76 HZ3 TRP 8 3HZ TRP 8 2.368 -7.332 1.041 77 HH2 TRP 8 HH2 TRP 8 3.153 -6.827 -1.258 78 H TRP 9 H TRP 9 0.502 -0.974 2.020 79 HA TRP 9 HA TRP 9 3.073 -0.835 1.125 80 1HB TRP 9 2HB TRP 9 1.110 0.665 0.629 81 2HB TRP 9 1HB TRP 9 1.475 1.535 2.120 82 HD1 TRP 9 HD1 TRP 9 2.668 1.064 -1.442 83 HE1 TRP 9 1HE TRP 9 4.590 2.726 -1.909 84 HE3 TRP 9 3HE TRP 9 3.462 2.791 3.258 85 HZ2 TRP 9 2HZ TRP 9 6.254 4.556 -0.447 86 HZ3 TRP 9 3HZ TRP 9 5.211 4.485 3.725 87 HH2 TRP 9 HH2 TRP 9 6.610 5.372 1.874 88 H ALA 10 H ALA 10 2.034 -0.184 4.412 89 HA ALA 10 HA ALA 10 4.370 1.262 5.300 90 1HB ALA 10 1HB ALA 10 1.970 -0.027 6.377 91 2HB ALA 10 2HB ALA 10 2.794 1.434 6.923 92 3HB ALA 10 3HB ALA 10 3.352 -0.150 7.464 93 H TRP 11 H TRP 11 3.608 -2.165 4.936 94 HA TRP 11 HA TRP 11 5.880 -3.177 6.417 95 1HB TRP 11 2HB TRP 11 4.862 -5.167 5.902 96 2HB TRP 11 1HB TRP 11 3.560 -4.157 5.279 97 HD1 TRP 11 HD1 TRP 11 3.099 -4.247 2.734 98 HE1 TRP 11 1HE TRP 11 4.202 -5.433 0.733 99 HE3 TRP 11 3HE TRP 11 7.324 -6.000 4.969 100 HZ2 TRP 11 2HZ TRP 11 6.563 -6.934 0.154 101 HZ3 TRP 11 3HZ TRP 11 8.990 -7.305 3.677 102 HH2 TRP 11 HH2 TRP 11 8.614 -7.772 1.271 103 H ARG 12 H ARG 12 5.240 -2.607 2.972 104 HA ARG 12 HA ARG 12 7.524 -3.595 1.762 105 1HB ARG 12 2HB ARG 12 6.027 -1.007 1.258 106 2HB ARG 12 1HB ARG 12 7.143 -1.741 0.109 107 1HG ARG 12 2HG ARG 12 5.687 -3.873 0.334 108 2HG ARG 12 1HG ARG 12 4.487 -2.820 1.081 109 1HD ARG 12 2HD ARG 12 5.574 -2.703 -1.742 110 2HD ARG 12 1HD ARG 12 3.883 -2.783 -1.208 111 HE ARG 12 HE ARG 12 4.090 -0.466 -0.405 112 1HH1 ARG 12 1HH2 ARG 12 5.142 -0.679 -3.343 113 2HH1 ARG 12 2HH2 ARG 12 6.494 0.399 -3.248 114 1HH2 ARG 12 2HH1 ARG 12 6.528 0.477 0.218 115 2HH2 ARG 12 1HH1 ARG 12 7.279 1.053 -1.232 116 H ARG 13 H ARG 13 7.216 -0.609 3.643 117 HA ARG 13 HA ARG 13 9.765 0.535 2.987 118 1HB ARG 13 2HB ARG 13 7.997 1.821 4.016 119 2HB ARG 13 1HB ARG 13 7.921 0.714 5.388 120 1HG ARG 13 2HG ARG 13 9.961 1.466 6.273 121 2HG ARG 13 1HG ARG 13 10.487 2.145 4.732 122 1HD ARG 13 2HD ARG 13 9.850 4.085 5.901 123 2HD ARG 13 1HD ARG 13 8.345 3.691 5.044 124 HE ARG 13 HE ARG 13 7.430 2.829 7.101 125 1HH1 ARG 13 1HH1 ARG 13 9.139 5.280 8.002 126 2HH1 ARG 13 2HH1 ARG 13 9.861 4.628 9.434 127 1HH2 ARG 13 1HH2 ARG 13 9.040 1.345 8.672 128 2HH2 ARG 13 2HH2 ARG 13 9.806 2.399 9.813 129 1HN NH2 14 1HN NH2 14 9.260 -0.344 6.374 130 2HN NH2 14 2HN NH2 14 10.638 -1.325 6.526 Start of MODEL 13 1 1H ILE 1 1H ILE 1 -14.521 3.563 8.195 2 2H ILE 1 2H ILE 1 -13.521 3.805 9.548 3 3H ILE 1 3H ILE 1 -13.457 2.339 8.691 4 HA ILE 1 HA ILE 1 -12.845 4.873 7.304 5 HB ILE 1 HB ILE 1 -11.620 4.735 9.493 6 1HG1 ILE 1 2HG1 ILE 1 -9.561 4.162 7.407 7 2HG1 ILE 1 1HG1 ILE 1 -10.670 5.501 7.102 8 1HG2 ILE 1 1HG2 ILE 1 -9.812 2.621 8.686 9 2HG2 ILE 1 2HG2 ILE 1 -11.464 2.010 8.790 10 3HG2 ILE 1 3HG2 ILE 1 -10.721 2.789 10.187 11 1HD1 ILE 1 1HD1 ILE 1 -9.431 6.784 8.472 12 2HD1 ILE 1 2HD1 ILE 1 -8.409 5.408 8.888 13 3HD1 ILE 1 3HD1 ILE 1 -9.878 5.726 9.810 14 H LEU 2 H LEU 2 -11.064 4.277 5.657 15 HA LEU 2 HA LEU 2 -11.530 1.488 4.647 16 1HB LEU 2 2HB LEU 2 -12.034 4.052 3.530 17 2HB LEU 2 1HB LEU 2 -10.688 3.359 2.624 18 HG LEU 2 HG LEU 2 -12.334 1.193 2.831 19 1HD1 LEU 2 1HD1 LEU 2 -14.614 2.118 2.167 20 2HD1 LEU 2 2HD1 LEU 2 -14.044 3.689 2.734 21 3HD1 LEU 2 3HD1 LEU 2 -14.171 2.338 3.861 22 1HD2 LEU 2 1HD2 LEU 2 -11.205 2.449 0.822 23 2HD2 LEU 2 2HD2 LEU 2 -12.790 3.200 0.635 24 3HD2 LEU 2 3HD2 LEU 2 -12.624 1.448 0.518 25 H ALA 3 H ALA 3 -9.677 0.588 3.408 26 HA ALA 3 HA ALA 3 -7.126 1.705 3.115 27 1HB ALA 3 1HB ALA 3 -6.530 0.205 5.449 28 2HB ALA 3 2HB ALA 3 -7.896 1.245 5.855 29 3HB ALA 3 3HB ALA 3 -6.402 1.951 5.238 30 H TRP 4 H TRP 4 -5.797 0.176 2.145 31 HA TRP 4 HA TRP 4 -5.664 -2.599 2.608 32 1HB TRP 4 2HB TRP 4 -8.136 -1.777 1.491 33 2HB TRP 4 1HB TRP 4 -7.253 -2.593 0.201 34 HD1 TRP 4 HD1 TRP 4 -9.485 -3.348 2.943 35 HE1 TRP 4 1HE TRP 4 -9.333 -5.825 3.642 36 HE3 TRP 4 3HE TRP 4 -5.159 -4.664 0.575 37 HZ2 TRP 4 2HZ TRP 4 -7.601 -8.068 3.248 38 HZ3 TRP 4 3HZ TRP 4 -4.280 -6.974 0.754 39 HH2 TRP 4 HH2 TRP 4 -5.495 -8.676 2.086 40 H LYS 5 H LYS 5 -6.173 -0.633 -0.333 41 HA LYS 5 HA LYS 5 -3.973 -1.834 -1.775 42 1HB LYS 5 2HB LYS 5 -5.731 0.604 -2.056 43 2HB LYS 5 1HB LYS 5 -4.412 0.314 -3.191 44 1HG LYS 5 2HG LYS 5 -6.052 -2.069 -2.694 45 2HG LYS 5 1HG LYS 5 -6.958 -0.737 -3.414 46 1HD LYS 5 2HD LYS 5 -5.750 -0.787 -5.369 47 2HD LYS 5 1HD LYS 5 -4.271 -1.313 -4.563 48 1HE LYS 5 2HE LYS 5 -4.741 -3.505 -4.936 49 2HE LYS 5 1HE LYS 5 -6.423 -3.308 -4.401 50 1HZ LYS 5 1HZ LYS 5 -6.183 -3.792 -6.820 51 2HZ LYS 5 2HZ LYS 5 -5.388 -2.301 -6.996 52 3HZ LYS 5 3HZ LYS 5 -7.007 -2.349 -6.484 53 H TRP 6 H TRP 6 -4.007 0.281 0.831 54 HA TRP 6 HA TRP 6 -1.697 1.930 0.043 55 1HB TRP 6 2HB TRP 6 -3.783 2.036 1.965 56 2HB TRP 6 1HB TRP 6 -2.284 1.897 2.879 57 HD1 TRP 6 HD1 TRP 6 -4.386 4.500 1.820 58 HE1 TRP 6 1HE TRP 6 -3.118 6.677 1.274 59 HE3 TRP 6 3HE TRP 6 0.361 2.668 1.367 60 HZ2 TRP 6 2HZ TRP 6 -0.445 7.530 0.718 61 HZ3 TRP 6 3HZ TRP 6 2.247 4.184 0.829 62 HH2 TRP 6 HH2 TRP 6 1.850 6.610 0.504 63 H ALA 7 H ALA 7 -2.349 -0.681 2.398 64 HA ALA 7 HA ALA 7 0.227 -0.956 3.506 65 1HB ALA 7 1HB ALA 7 -2.165 -2.676 3.010 66 2HB ALA 7 2HB ALA 7 -1.401 -2.237 4.538 67 3HB ALA 7 3HB ALA 7 -0.683 -3.485 3.519 68 H TRP 8 H TRP 8 -0.915 -1.794 0.317 69 HA TRP 8 HA TRP 8 1.061 -3.781 -0.354 70 1HB TRP 8 2HB TRP 8 -0.853 -3.632 -1.729 71 2HB TRP 8 1HB TRP 8 -0.744 -1.878 -1.842 72 HD1 TRP 8 HD1 TRP 8 0.156 -1.072 -4.093 73 HE1 TRP 8 1HE TRP 8 1.684 -2.023 -5.931 74 HE3 TRP 8 3HE TRP 8 1.458 -5.475 -1.931 75 HZ2 TRP 8 2HZ TRP 8 3.260 -4.361 -6.416 76 HZ3 TRP 8 3HZ TRP 8 2.972 -7.062 -3.088 77 HH2 TRP 8 HH2 TRP 8 3.880 -6.505 -5.329 78 H TRP 9 H TRP 9 0.922 -0.763 -2.126 79 HA TRP 9 HA TRP 9 3.538 -0.567 -2.869 80 1HB TRP 9 2HB TRP 9 1.588 0.900 -3.475 81 2HB TRP 9 1HB TRP 9 1.834 1.758 -1.954 82 HD1 TRP 9 HD1 TRP 9 3.272 1.358 -5.432 83 HE1 TRP 9 1HE TRP 9 5.186 3.062 -5.751 84 HE3 TRP 9 3HE TRP 9 3.712 3.040 -0.670 85 HZ2 TRP 9 2HZ TRP 9 6.710 4.906 -4.158 86 HZ3 TRP 9 3HZ TRP 9 5.391 4.762 -0.068 87 HH2 TRP 9 HH2 TRP 9 6.893 5.700 -1.811 88 H ALA 10 H ALA 10 2.304 0.007 0.358 89 HA ALA 10 HA ALA 10 4.542 1.504 1.398 90 1HB ALA 10 1HB ALA 10 2.106 0.195 2.298 91 2HB ALA 10 2HB ALA 10 2.938 1.588 2.990 92 3HB ALA 10 3HB ALA 10 3.421 -0.045 3.449 93 H TRP 11 H TRP 11 3.910 -1.936 0.930 94 HA TRP 11 HA TRP 11 6.139 -2.900 2.511 95 1HB TRP 11 2HB TRP 11 5.193 -4.907 1.942 96 2HB TRP 11 1HB TRP 11 3.898 -3.929 1.257 97 HD1 TRP 11 HD1 TRP 11 3.567 -4.017 -1.306 98 HE1 TRP 11 1HE TRP 11 4.798 -5.166 -3.254 99 HE3 TRP 11 3HE TRP 11 7.719 -5.673 1.130 100 HZ2 TRP 11 2HZ TRP 11 7.224 -6.606 -3.720 101 HZ3 TRP 11 3HZ TRP 11 9.480 -6.929 -0.080 102 HH2 TRP 11 HH2 TRP 11 9.238 -7.396 -2.503 103 H ARG 12 H ARG 12 5.639 -2.323 -0.958 104 HA ARG 12 HA ARG 12 8.010 -3.243 -2.061 105 1HB ARG 12 2HB ARG 12 6.473 -0.694 -2.648 106 2HB ARG 12 1HB ARG 12 7.647 -1.420 -3.742 107 1HG ARG 12 2HG ARG 12 6.222 -3.573 -3.562 108 2HG ARG 12 1HG ARG 12 4.974 -2.540 -2.866 109 1HD ARG 12 2HD ARG 12 6.160 -2.425 -5.648 110 2HD ARG 12 1HD ARG 12 4.453 -2.520 -5.175 111 HE ARG 12 HE ARG 12 4.655 -0.195 -4.316 112 1HH1 ARG 12 2HH1 ARG 12 5.306 -0.159 -7.281 113 2HH1 ARG 12 1HH1 ARG 12 6.732 0.824 -7.305 114 1HH2 ARG 12 1HH2 ARG 12 7.316 0.525 -3.901 115 2HH2 ARG 12 2HH2 ARG 12 7.870 1.212 -5.391 116 H ARG 13 H ARG 13 7.542 -0.394 -0.053 117 HA ARG 13 HA ARG 13 9.952 1.016 -0.631 118 1HB ARG 13 2HB ARG 13 8.214 2.055 0.628 119 2HB ARG 13 1HB ARG 13 8.162 0.729 1.790 120 1HG ARG 13 2HG ARG 13 9.748 1.700 3.055 121 2HG ARG 13 1HG ARG 13 10.830 1.833 1.668 122 1HD ARG 13 2HD ARG 13 8.523 3.756 1.922 123 2HD ARG 13 1HD ARG 13 10.012 4.042 2.843 124 HE ARG 13 HE ARG 13 11.026 4.655 0.789 125 1HH1 ARG 13 1HH1 ARG 13 7.980 4.139 -0.174 126 2HH1 ARG 13 2HH1 ARG 13 8.336 3.361 -1.680 127 1HH2 ARG 13 1HH2 ARG 13 11.697 2.908 -0.954 128 2HH2 ARG 13 2HH2 ARG 13 10.441 2.663 -2.121 129 1HN NH2 14 1HN NH2 14 9.315 -1.599 1.767 130 2HN NH2 14 2HN NH2 14 10.950 -1.919 2.093 Start of MODEL 14 1 1H ILE 1 1H ILE 1 -9.368 1.379 -0.217 2 2H ILE 1 2H ILE 1 -7.959 1.247 0.724 3 3H ILE 1 3H ILE 1 -8.345 2.719 -0.031 4 HA ILE 1 HA ILE 1 -10.079 3.184 1.441 5 HB ILE 1 HB ILE 1 -10.924 0.809 1.042 6 1HG1 ILE 1 2HG1 ILE 1 -11.172 1.273 3.964 7 2HG1 ILE 1 1HG1 ILE 1 -11.602 2.638 2.933 8 1HG2 ILE 1 1HG2 ILE 1 -8.823 -0.289 1.849 9 2HG2 ILE 1 2HG2 ILE 1 -10.269 -0.896 2.657 10 3HG2 ILE 1 3HG2 ILE 1 -9.211 0.249 3.483 11 1HD1 ILE 1 1HD1 ILE 1 -13.634 1.522 3.002 12 2HD1 ILE 1 2HD1 ILE 1 -12.875 -0.065 3.129 13 3HD1 ILE 1 3HD1 ILE 1 -12.913 0.772 1.578 14 H LEU 2 H LEU 2 -10.001 3.291 3.947 15 HA LEU 2 HA LEU 2 -7.138 3.398 4.770 16 1HB LEU 2 2HB LEU 2 -9.602 4.913 5.220 17 2HB LEU 2 1HB LEU 2 -8.728 4.591 6.719 18 HG LEU 2 HG LEU 2 -6.666 5.501 5.721 19 1HD1 LEU 2 1HD1 LEU 2 -8.120 6.646 3.404 20 2HD1 LEU 2 2HD1 LEU 2 -7.797 4.915 3.320 21 3HD1 LEU 2 3HD1 LEU 2 -6.463 6.054 3.511 22 1HD2 LEU 2 1HD2 LEU 2 -7.292 7.806 5.812 23 2HD2 LEU 2 2HD2 LEU 2 -8.425 6.966 6.870 24 3HD2 LEU 2 3HD2 LEU 2 -8.928 7.458 5.253 25 H ALA 3 H ALA 3 -6.848 2.917 7.227 26 HA ALA 3 HA ALA 3 -6.998 1.352 9.023 27 1HB ALA 3 1HB ALA 3 -9.612 2.005 8.133 28 2HB ALA 3 2HB ALA 3 -9.151 1.345 9.701 29 3HB ALA 3 3HB ALA 3 -9.591 0.260 8.383 30 H TRP 4 H TRP 4 -5.899 -0.584 8.902 31 HA TRP 4 HA TRP 4 -5.417 -2.821 8.287 32 1HB TRP 4 2HB TRP 4 -8.127 -2.468 7.799 33 2HB TRP 4 1HB TRP 4 -7.506 -3.049 6.252 34 HD1 TRP 4 HD1 TRP 4 -8.870 -4.372 9.283 35 HE1 TRP 4 1HE TRP 4 -8.106 -6.796 9.723 36 HE3 TRP 4 3HE TRP 4 -4.947 -4.659 6.030 37 HZ2 TRP 4 2HZ TRP 4 -6.091 -8.614 8.814 38 HZ3 TRP 4 3HZ TRP 4 -3.622 -6.744 5.838 39 HH2 TRP 4 HH2 TRP 4 -4.189 -8.720 7.225 40 H LYS 5 H LYS 5 -6.619 -0.937 5.506 41 HA LYS 5 HA LYS 5 -4.644 -2.064 3.680 42 1HB LYS 5 2HB LYS 5 -6.994 -1.163 3.185 43 2HB LYS 5 1HB LYS 5 -6.303 0.451 3.367 44 1HG LYS 5 2HG LYS 5 -5.708 0.324 1.195 45 2HG LYS 5 1HG LYS 5 -4.513 -0.879 1.683 46 1HD LYS 5 2HD LYS 5 -6.866 -2.339 1.585 47 2HD LYS 5 1HD LYS 5 -7.020 -1.240 0.214 48 1HE LYS 5 2HE LYS 5 -4.369 -2.073 0.057 49 2HE LYS 5 1HE LYS 5 -5.243 -3.543 0.534 50 1HZ LYS 5 1HZ LYS 5 -6.826 -3.173 -1.218 51 2HZ LYS 5 2HZ LYS 5 -5.266 -3.176 -1.891 52 3HZ LYS 5 3HZ LYS 5 -6.088 -1.708 -1.646 53 H TRP 6 H TRP 6 -4.345 0.060 6.194 54 HA TRP 6 HA TRP 6 -2.463 1.936 4.878 55 1HB TRP 6 2HB TRP 6 -4.180 1.962 7.152 56 2HB TRP 6 1HB TRP 6 -2.533 2.103 7.759 57 HD1 TRP 6 HD1 TRP 6 -5.205 4.245 6.710 58 HE1 TRP 6 1HE TRP 6 -4.349 6.520 5.856 59 HE3 TRP 6 3HE TRP 6 -0.263 3.137 6.033 60 HZ2 TRP 6 2HZ TRP 6 -1.897 7.715 4.999 61 HZ3 TRP 6 3HZ TRP 6 1.308 4.863 5.198 62 HH2 TRP 6 HH2 TRP 6 0.498 7.148 4.681 63 H ALA 7 H ALA 7 -2.379 -0.494 7.517 64 HA ALA 7 HA ALA 7 0.341 -0.443 8.160 65 1HB ALA 7 1HB ALA 7 -0.990 -3.091 7.840 66 2HB ALA 7 2HB ALA 7 -1.829 -1.904 8.839 67 3HB ALA 7 3HB ALA 7 -0.190 -2.404 9.254 68 H TRP 8 H TRP 8 -1.184 -1.569 5.231 69 HA TRP 8 HA TRP 8 0.689 -3.402 4.205 70 1HB TRP 8 2HB TRP 8 -1.274 -3.078 2.973 71 2HB TRP 8 1HB TRP 8 -1.160 -1.325 3.066 72 HD1 TRP 8 HD1 TRP 8 -0.402 -0.229 0.896 73 HE1 TRP 8 1HE TRP 8 0.933 -0.946 -1.183 74 HE3 TRP 8 3HE TRP 8 0.929 -4.926 2.307 75 HZ2 TRP 8 2HZ TRP 8 2.383 -3.226 -2.124 76 HZ3 TRP 8 3HZ TRP 8 2.289 -6.362 0.810 77 HH2 TRP 8 HH2 TRP 8 3.022 -5.513 -1.403 78 H TRP 9 H TRP 9 0.604 -0.183 2.777 79 HA TRP 9 HA TRP 9 3.210 -0.091 1.864 80 1HB TRP 9 2HB TRP 9 1.282 1.503 1.477 81 2HB TRP 9 1HB TRP 9 1.689 2.255 3.020 82 HD1 TRP 9 HD1 TRP 9 2.822 1.995 -0.572 83 HE1 TRP 9 1HE TRP 9 4.820 3.586 -0.949 84 HE3 TRP 9 3HE TRP 9 3.779 3.321 4.235 85 HZ2 TRP 9 2HZ TRP 9 6.600 5.210 0.611 86 HZ3 TRP 9 3HZ TRP 9 5.624 4.882 4.786 87 HH2 TRP 9 HH2 TRP 9 7.037 5.831 2.978 88 H ALA 10 H ALA 10 2.140 0.238 5.167 89 HA ALA 10 HA ALA 10 4.552 1.548 6.165 90 1HB ALA 10 1HB ALA 10 3.355 0.324 8.301 91 2HB ALA 10 2HB ALA 10 2.013 0.415 7.161 92 3HB ALA 10 3HB ALA 10 2.854 1.885 7.651 93 H TRP 11 H TRP 11 3.266 -1.745 6.782 94 HA TRP 11 HA TRP 11 5.485 -2.943 7.929 95 1HB TRP 11 2HB TRP 11 4.269 -4.847 7.520 96 2HB TRP 11 1HB TRP 11 3.059 -3.726 6.904 97 HD1 TRP 11 HD1 TRP 11 2.434 -3.945 4.418 98 HE1 TRP 11 1HE TRP 11 3.315 -5.305 2.422 99 HE3 TRP 11 3HE TRP 11 6.671 -5.852 6.475 100 HZ2 TRP 11 2HZ TRP 11 5.539 -6.984 1.779 101 HZ3 TRP 11 3HZ TRP 11 8.166 -7.328 5.161 102 HH2 TRP 11 HH2 TRP 11 7.606 -7.894 2.812 103 H ARG 12 H ARG 12 4.865 -2.476 4.477 104 HA ARG 12 HA ARG 12 6.914 -3.802 3.237 105 1HB ARG 12 2HB ARG 12 5.886 -0.988 2.785 106 2HB ARG 12 1HB ARG 12 6.899 -1.848 1.626 107 1HG ARG 12 2HG ARG 12 5.050 -3.753 1.979 108 2HG ARG 12 1HG ARG 12 4.051 -2.366 2.408 109 1HD ARG 12 2HD ARG 12 5.400 -2.965 -0.230 110 2HD ARG 12 1HD ARG 12 3.712 -2.523 0.083 111 HE ARG 12 HE ARG 12 4.421 -0.227 0.469 112 1HH1 ARG 12 2HH1 ARG 12 6.077 -1.562 -1.933 113 2HH1 ARG 12 1HH1 ARG 12 7.566 -0.706 -1.717 114 1HH2 ARG 12 1HH2 ARG 12 6.715 0.519 1.414 115 2HH2 ARG 12 2HH2 ARG 12 7.928 0.472 0.179 116 H ARG 13 H ARG 13 7.199 -0.851 5.163 117 HA ARG 13 HA ARG 13 10.070 -0.546 4.533 118 1HB ARG 13 2HB ARG 13 8.190 1.248 4.926 119 2HB ARG 13 1HB ARG 13 8.525 0.956 6.633 120 1HG ARG 13 2HG ARG 13 10.713 1.758 6.483 121 2HG ARG 13 1HG ARG 13 10.803 1.472 4.744 122 1HD ARG 13 2HD ARG 13 10.543 3.816 4.845 123 2HD ARG 13 1HD ARG 13 8.864 3.273 4.642 124 HE ARG 13 HE ARG 13 8.469 3.707 6.978 125 1HH1 ARG 13 1HH1 ARG 13 10.899 5.587 5.841 126 2HH1 ARG 13 2HH1 ARG 13 11.729 5.803 7.346 127 1HH2 ARG 13 1HH2 ARG 13 9.898 3.373 9.008 128 2HH2 ARG 13 2HH2 ARG 13 11.161 4.551 9.139 129 1HN NH2 14 1HN NH2 14 8.177 -0.925 7.599 130 2HN NH2 14 2HN NH2 14 9.395 -1.767 8.428 Start of MODEL 15 1 1H ILE 1 1H ILE 1 -13.707 2.193 7.993 2 2H ILE 1 2H ILE 1 -12.173 1.792 8.603 3 3H ILE 1 3H ILE 1 -13.568 1.098 9.281 4 HA ILE 1 HA ILE 1 -12.328 -0.432 7.772 5 HB ILE 1 HB ILE 1 -15.161 0.472 7.178 6 1HG1 ILE 1 2HG1 ILE 1 -15.035 -1.968 8.611 7 2HG1 ILE 1 1HG1 ILE 1 -13.885 -0.878 9.386 8 1HG2 ILE 1 1HG2 ILE 1 -15.242 -2.118 6.576 9 2HG2 ILE 1 2HG2 ILE 1 -13.539 -1.848 6.208 10 3HG2 ILE 1 3HG2 ILE 1 -14.781 -0.921 5.366 11 1HD1 ILE 1 1HD1 ILE 1 -16.318 -0.771 10.216 12 2HD1 ILE 1 2HD1 ILE 1 -16.685 0.006 8.676 13 3HD1 ILE 1 3HD1 ILE 1 -15.554 0.763 9.797 14 H LEU 2 H LEU 2 -10.797 1.242 6.645 15 HA LEU 2 HA LEU 2 -11.425 1.209 3.766 16 1HB LEU 2 2HB LEU 2 -12.419 3.295 5.055 17 2HB LEU 2 1HB LEU 2 -10.754 3.874 4.979 18 HG LEU 2 HG LEU 2 -11.558 2.788 2.420 19 1HD1 LEU 2 1HD1 LEU 2 -13.459 3.978 1.893 20 2HD1 LEU 2 2HD1 LEU 2 -13.101 5.264 3.045 21 3HD1 LEU 2 3HD1 LEU 2 -13.766 3.733 3.613 22 1HD2 LEU 2 1HD2 LEU 2 -10.047 4.935 3.549 23 2HD2 LEU 2 2HD2 LEU 2 -11.199 5.628 2.408 24 3HD2 LEU 2 3HD2 LEU 2 -10.067 4.386 1.873 25 H ALA 3 H ALA 3 -9.479 0.071 3.392 26 HA ALA 3 HA ALA 3 -7.064 1.453 3.035 27 1HB ALA 3 1HB ALA 3 -7.690 0.750 5.794 28 2HB ALA 3 2HB ALA 3 -6.407 1.789 5.173 29 3HB ALA 3 3HB ALA 3 -6.158 0.046 5.277 30 H TRP 4 H TRP 4 -5.650 0.091 1.959 31 HA TRP 4 HA TRP 4 -5.177 -2.653 2.366 32 1HB TRP 4 2HB TRP 4 -7.790 -2.119 1.408 33 2HB TRP 4 1HB TRP 4 -6.896 -2.800 0.050 34 HD1 TRP 4 HD1 TRP 4 -8.847 -3.866 2.911 35 HE1 TRP 4 1HE TRP 4 -8.355 -6.319 3.533 36 HE3 TRP 4 3HE TRP 4 -4.567 -4.614 0.230 37 HZ2 TRP 4 2HZ TRP 4 -6.403 -8.334 2.966 38 HZ3 TRP 4 3HZ TRP 4 -3.413 -6.805 0.287 39 HH2 TRP 4 HH2 TRP 4 -4.324 -8.665 1.651 40 H LYS 5 H LYS 5 -6.074 -0.714 -0.501 41 HA LYS 5 HA LYS 5 -3.854 -1.640 -2.101 42 1HB LYS 5 2HB LYS 5 -6.056 -0.686 -2.883 43 2HB LYS 5 1HB LYS 5 -5.504 0.897 -2.335 44 1HG LYS 5 2HG LYS 5 -4.620 1.122 -4.409 45 2HG LYS 5 1HG LYS 5 -3.370 0.008 -3.850 46 1HD LYS 5 2HD LYS 5 -5.923 -1.181 -4.838 47 2HD LYS 5 1HD LYS 5 -4.827 -0.497 -6.039 48 1HE LYS 5 2HE LYS 5 -3.239 -2.009 -4.206 49 2HE LYS 5 1HE LYS 5 -4.605 -3.023 -4.709 50 1HZ LYS 5 1HZ LYS 5 -2.617 -2.975 -6.260 51 2HZ LYS 5 2HZ LYS 5 -3.066 -1.380 -6.633 52 3HZ LYS 5 3HZ LYS 5 -4.129 -2.663 -6.964 53 H TRP 6 H TRP 6 -3.939 0.398 0.569 54 HA TRP 6 HA TRP 6 -1.858 2.291 -0.306 55 1HB TRP 6 2HB TRP 6 -3.819 2.141 1.740 56 2HB TRP 6 1HB TRP 6 -2.260 2.130 2.557 57 HD1 TRP 6 HD1 TRP 6 -4.664 4.537 1.722 58 HE1 TRP 6 1HE TRP 6 -3.653 6.841 1.158 59 HE3 TRP 6 3HE TRP 6 0.193 3.192 0.889 60 HZ2 TRP 6 2HZ TRP 6 -1.120 7.965 0.449 61 HZ3 TRP 6 3HZ TRP 6 1.882 4.898 0.272 62 HH2 TRP 6 HH2 TRP 6 1.231 7.281 0.050 63 H ALA 7 H ALA 7 -2.096 -0.413 2.028 64 HA ALA 7 HA ALA 7 0.567 -0.456 2.944 65 1HB ALA 7 1HB ALA 7 -0.082 -2.490 3.843 66 2HB ALA 7 2HB ALA 7 -0.853 -3.017 2.348 67 3HB ALA 7 3HB ALA 7 -1.670 -1.864 3.402 68 H TRP 8 H TRP 8 -0.800 -1.634 -0.086 69 HA TRP 8 HA TRP 8 1.228 -3.329 -1.033 70 1HB TRP 8 2HB TRP 8 -0.682 -3.130 -2.367 71 2HB TRP 8 1HB TRP 8 -0.705 -1.376 -2.243 72 HD1 TRP 8 HD1 TRP 8 0.076 -0.175 -4.346 73 HE1 TRP 8 1HE TRP 8 1.539 -0.748 -6.382 74 HE3 TRP 8 3HE TRP 8 1.651 -4.815 -2.997 75 HZ2 TRP 8 2HZ TRP 8 3.170 -2.901 -7.316 76 HZ3 TRP 8 3HZ TRP 8 3.159 -6.119 -4.473 77 HH2 TRP 8 HH2 TRP 8 3.925 -5.164 -6.629 78 H TRP 9 H TRP 9 1.007 -0.107 -2.440 79 HA TRP 9 HA TRP 9 3.629 0.162 -3.260 80 1HB TRP 9 2HB TRP 9 1.621 1.634 -3.690 81 2HB TRP 9 1HB TRP 9 1.918 2.382 -2.120 82 HD1 TRP 9 HD1 TRP 9 3.204 2.266 -5.670 83 HE1 TRP 9 1HE TRP 9 5.098 4.002 -5.941 84 HE3 TRP 9 3HE TRP 9 3.872 3.568 -0.810 85 HZ2 TRP 9 2HZ TRP 9 6.690 5.722 -4.284 86 HZ3 TRP 9 3HZ TRP 9 5.574 5.249 -0.158 87 HH2 TRP 9 HH2 TRP 9 6.986 6.329 -1.893 88 H ALA 10 H ALA 10 2.448 0.358 0.017 89 HA ALA 10 HA ALA 10 4.726 1.819 1.108 90 1HB ALA 10 1HB ALA 10 3.084 -0.034 2.764 91 2HB ALA 10 2HB ALA 10 2.219 1.257 1.929 92 3HB ALA 10 3HB ALA 10 3.515 1.651 3.060 93 H TRP 11 H TRP 11 3.700 -1.588 1.593 94 HA TRP 11 HA TRP 11 6.011 -2.604 2.763 95 1HB TRP 11 2HB TRP 11 4.962 -4.605 2.344 96 2HB TRP 11 1HB TRP 11 3.651 -3.575 1.774 97 HD1 TRP 11 HD1 TRP 11 2.994 -3.786 -0.701 98 HE1 TRP 11 1HE TRP 11 3.925 -5.050 -2.736 99 HE3 TRP 11 3HE TRP 11 7.399 -5.423 1.234 100 HZ2 TRP 11 2HZ TRP 11 6.246 -6.556 -3.457 101 HZ3 TRP 11 3HZ TRP 11 8.964 -6.768 -0.138 102 HH2 TRP 11 HH2 TRP 11 8.393 -7.334 -2.485 103 H ARG 12 H ARG 12 5.351 -2.183 -0.695 104 HA ARG 12 HA ARG 12 7.438 -3.339 -1.990 105 1HB ARG 12 2HB ARG 12 6.344 -0.532 -2.299 106 2HB ARG 12 1HB ARG 12 7.354 -1.319 -3.511 107 1HG ARG 12 2HG ARG 12 5.688 -3.195 -3.605 108 2HG ARG 12 1HG ARG 12 4.651 -2.276 -2.516 109 1HD ARG 12 2HD ARG 12 3.782 -1.520 -4.522 110 2HD ARG 12 1HD ARG 12 5.128 -0.372 -4.388 111 HE ARG 12 HE ARG 12 5.264 -2.925 -5.948 112 1HH1 ARG 12 1HH2 ARG 12 5.018 -0.400 -7.474 113 2HH1 ARG 12 2HH2 ARG 12 6.669 0.013 -7.799 114 1HH2 ARG 12 2HH1 ARG 12 7.954 -2.111 -5.377 115 2HH2 ARG 12 1HH1 ARG 12 8.331 -0.956 -6.612 116 H ARG 13 H ARG 13 7.655 -0.238 -0.233 117 HA ARG 13 HA ARG 13 10.396 0.330 -0.809 118 1HB ARG 13 2HB ARG 13 8.588 1.827 0.151 119 2HB ARG 13 1HB ARG 13 8.811 0.996 1.691 120 1HG ARG 13 2HG ARG 13 10.809 2.018 2.103 121 2HG ARG 13 1HG ARG 13 11.298 1.966 0.409 122 1HD ARG 13 2HD ARG 13 9.104 3.830 1.363 123 2HD ARG 13 1HD ARG 13 10.813 4.311 1.366 124 HE ARG 13 HE ARG 13 9.214 3.651 -1.058 125 1HH1 ARG 13 1HH2 ARG 13 11.303 5.884 0.120 126 2HH1 ARG 13 2HH2 ARG 13 12.438 5.829 -1.188 127 1HH2 ARG 13 1HH1 ARG 13 11.056 2.989 -2.617 128 2HH2 ARG 13 2HH1 ARG 13 12.298 4.190 -2.737 129 1HN NH2 14 1HN NH2 14 8.912 -1.457 1.951 130 2HN NH2 14 2HN NH2 14 10.364 -2.152 2.490
Contact the webmaster for help, if required. Friday, July 5, 2024 12:25:15 AM GMT (wattos1)