NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
640104 | 6rro | 34402 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 1.811 -0.001 0.854 2 HA2 GLY 1 HA2 GLY 1 1.374 0.081 -2.068 3 HA3 GLY 1 HA3 GLY 1 2.728 0.859 -1.261 4 H PHE 2 H PHE 2 1.260 -2.329 -1.810 5 HA PHE 2 HA PHE 2 3.979 -3.465 -1.802 6 HB2 PHE 2 HB2 PHE 2 2.690 -5.650 -1.223 7 HB3 PHE 2 HB3 PHE 2 2.992 -4.473 0.051 8 HD1 PHE 2 HD1 PHE 2 0.481 -6.116 -1.989 9 HD2 PHE 2 HD2 PHE 2 1.174 -3.058 0.889 10 HE1 PHE 2 HE1 PHE 2 -1.932 -6.019 -1.516 11 HE2 PHE 2 HE2 PHE 2 -1.238 -2.957 1.367 12 HZ PHE 2 HZ PHE 2 -2.794 -4.439 0.165 13 H ILE 3 H ILE 3 0.814 -3.423 -3.308 14 HA ILE 3 HA ILE 3 1.020 -5.477 -5.133 15 HB ILE 3 HB ILE 3 -0.180 -2.766 -5.709 16 HG12 ILE 3 HG12 ILE 3 -1.097 -3.587 -3.635 17 HG13 ILE 3 HG13 ILE 3 -2.300 -3.819 -4.899 18 HG21 ILE 3 HG21 ILE 3 -1.677 -4.842 -6.861 19 HG22 ILE 3 HG22 ILE 3 -0.691 -3.636 -7.686 20 HG23 ILE 3 HG23 ILE 3 0.013 -5.187 -7.230 21 HD11 ILE 3 HD11 ILE 3 -2.235 -5.746 -3.468 22 HD12 ILE 3 HD12 ILE 3 -1.621 -6.180 -5.063 23 HD13 ILE 3 HD13 ILE 3 -0.499 -5.923 -3.726 24 H VAL 4 H VAL 4 1.863 -2.068 -5.786 25 HA VAL 4 HA VAL 4 2.987 -2.405 -8.286 26 HB VAL 4 HB VAL 4 3.893 -0.457 -6.161 27 HG11 VAL 4 HG11 VAL 4 5.537 -0.282 -7.761 28 HG12 VAL 4 HG12 VAL 4 4.451 -0.715 -9.081 29 HG13 VAL 4 HG13 VAL 4 4.361 0.890 -8.355 30 HG21 VAL 4 HG21 VAL 4 1.576 -0.127 -6.453 31 HG22 VAL 4 HG22 VAL 4 2.355 1.098 -7.455 32 HG23 VAL 4 HG23 VAL 4 1.683 -0.353 -8.198 33 H LYS 5 H LYS 5 4.530 -2.712 -5.113 34 HA LYS 5 HA LYS 5 7.164 -3.068 -5.965 35 HB2 LYS 5 HB2 LYS 5 5.654 -3.439 -3.523 36 HB3 LYS 5 HB3 LYS 5 6.848 -4.714 -3.722 37 HG2 LYS 5 HG2 LYS 5 8.630 -3.151 -3.817 38 HG3 LYS 5 HG3 LYS 5 7.512 -1.791 -3.944 39 HD2 LYS 5 HD2 LYS 5 6.655 -2.360 -1.679 40 HD3 LYS 5 HD3 LYS 5 7.906 -3.600 -1.562 41 HE2 LYS 5 HE2 LYS 5 8.974 -1.018 -2.356 42 HE3 LYS 5 HE3 LYS 5 8.137 -0.947 -0.806 43 HZ1 LYS 5 HZ1 LYS 5 10.642 -1.585 -0.923 44 HZ2 LYS 5 HZ2 LYS 5 9.615 -2.378 0.163 45 HZ3 LYS 5 HZ3 LYS 5 10.045 -3.124 -1.294 46 H ARG 6 H ARG 6 4.706 -5.542 -5.228 47 HA ARG 6 HA ARG 6 6.188 -7.798 -5.826 48 HB2 ARG 6 HB2 ARG 6 3.239 -7.263 -6.195 49 HB3 ARG 6 HB3 ARG 6 3.965 -8.854 -6.385 50 HG2 ARG 6 HG2 ARG 6 4.257 -7.264 -3.858 51 HG3 ARG 6 HG3 ARG 6 2.879 -8.327 -4.152 52 HD2 ARG 6 HD2 ARG 6 4.227 -9.835 -3.131 53 HD3 ARG 6 HD3 ARG 6 4.854 -10.016 -4.769 54 HE ARG 6 HE ARG 6 6.411 -8.067 -3.761 55 HH11 ARG 6 HH11 ARG 6 5.498 -11.207 -2.566 56 HH12 ARG 6 HH12 ARG 6 6.973 -11.446 -1.689 57 HH21 ARG 6 HH21 ARG 6 8.357 -8.370 -2.610 58 HH22 ARG 6 HH22 ARG 6 8.598 -9.831 -1.714 59 H PHE 7 H PHE 7 4.090 -5.940 -8.025 60 HA PHE 7 HA PHE 7 4.452 -7.409 -10.331 61 HB2 PHE 7 HB2 PHE 7 3.046 -5.225 -9.800 62 HB3 PHE 7 HB3 PHE 7 4.427 -4.432 -10.552 63 HD1 PHE 7 HD1 PHE 7 2.190 -7.353 -11.186 64 HD2 PHE 7 HD2 PHE 7 4.285 -4.017 -12.798 65 HE1 PHE 7 HE1 PHE 7 1.253 -7.843 -13.408 66 HE2 PHE 7 HE2 PHE 7 3.351 -4.501 -15.022 67 HZ PHE 7 HZ PHE 7 1.833 -6.416 -15.330 68 H LYS 8 H LYS 8 6.323 -4.524 -9.379 69 HA LYS 8 HA LYS 8 8.176 -4.535 -11.422 70 HB2 LYS 8 HB2 LYS 8 8.335 -3.649 -8.557 71 HB3 LYS 8 HB3 LYS 8 9.735 -3.518 -9.612 72 HG2 LYS 8 HG2 LYS 8 8.571 -2.045 -11.089 73 HG3 LYS 8 HG3 LYS 8 7.052 -2.304 -10.228 74 HD2 LYS 8 HD2 LYS 8 7.539 -0.684 -8.782 75 HD3 LYS 8 HD3 LYS 8 9.089 -1.436 -8.398 76 HE2 LYS 8 HE2 LYS 8 9.793 0.581 -9.231 77 HE3 LYS 8 HE3 LYS 8 9.803 -0.396 -10.699 78 HZ1 LYS 8 HZ1 LYS 8 7.262 0.827 -10.213 79 HZ2 LYS 8 HZ2 LYS 8 8.500 1.971 -10.359 80 HZ3 LYS 8 HZ3 LYS 8 8.225 0.858 -11.604 81 H ILE 9 H ILE 9 8.095 -6.485 -8.504 82 HA ILE 9 HA ILE 9 10.724 -7.566 -8.845 83 HB ILE 9 HB ILE 9 8.419 -8.565 -7.168 84 HG12 ILE 9 HG12 ILE 9 10.867 -7.198 -6.109 85 HG13 ILE 9 HG13 ILE 9 9.553 -6.231 -6.770 86 HG21 ILE 9 HG21 ILE 9 9.995 -10.350 -7.638 87 HG22 ILE 9 HG22 ILE 9 11.336 -9.326 -7.124 88 HG23 ILE 9 HG23 ILE 9 10.126 -9.847 -5.952 89 HD11 ILE 9 HD11 ILE 9 8.939 -6.275 -4.588 90 HD12 ILE 9 HD12 ILE 9 8.116 -7.733 -5.144 91 HD13 ILE 9 HD13 ILE 9 9.659 -7.859 -4.300 92 H LEU 10 H LEU 10 7.478 -8.510 -9.785 93 HA LEU 10 HA LEU 10 8.176 -11.150 -10.616 94 HB2 LEU 10 HB2 LEU 10 5.973 -11.354 -10.657 95 HB3 LEU 10 HB3 LEU 10 5.820 -9.632 -10.317 96 HG LEU 10 HG LEU 10 6.012 -9.321 -12.863 97 HD11 LEU 10 HD11 LEU 10 6.329 -11.137 -14.092 98 HD12 LEU 10 HD12 LEU 10 6.204 -12.169 -12.667 99 HD13 LEU 10 HD13 LEU 10 4.753 -11.732 -13.569 100 HD21 LEU 10 HD21 LEU 10 3.492 -10.745 -12.247 101 HD22 LEU 10 HD22 LEU 10 3.918 -9.387 -11.205 102 HD23 LEU 10 HD23 LEU 10 3.754 -9.146 -12.945 103 H VAL 11 H VAL 11 8.087 -8.007 -12.150 104 HA VAL 11 HA VAL 11 8.620 -9.154 -14.777 105 HB VAL 11 HB VAL 11 8.422 -6.916 -15.649 106 HG11 VAL 11 HG11 VAL 11 6.265 -7.287 -13.579 107 HG12 VAL 11 HG12 VAL 11 6.134 -6.459 -15.130 108 HG13 VAL 11 HG13 VAL 11 6.359 -8.207 -15.080 109 HG21 VAL 11 HG21 VAL 11 9.039 -5.156 -14.443 110 HG22 VAL 11 HG22 VAL 11 7.637 -5.393 -13.400 111 HG23 VAL 11 HG23 VAL 11 9.172 -6.165 -13.003 Start of MODEL 2 1 H1 GLY 1 H GLY 1 4.172 -0.307 -3.522 2 HA2 GLY 1 HA2 GLY 1 4.824 -0.269 -1.166 3 HA3 GLY 1 HA3 GLY 1 3.128 -0.030 -0.773 4 H PHE 2 H PHE 2 1.886 -1.929 -2.291 5 HA PHE 2 HA PHE 2 3.059 -4.444 -1.301 6 HB2 PHE 2 HB2 PHE 2 0.695 -3.299 -0.446 7 HB3 PHE 2 HB3 PHE 2 0.155 -4.470 -1.644 8 HD1 PHE 2 HD1 PHE 2 1.443 -3.977 1.677 9 HD2 PHE 2 HD2 PHE 2 0.787 -6.872 -1.373 10 HE1 PHE 2 HE1 PHE 2 1.676 -5.776 3.339 11 HE2 PHE 2 HE2 PHE 2 1.017 -8.676 0.284 12 HZ PHE 2 HZ PHE 2 1.462 -8.129 2.644 13 H ILE 3 H ILE 3 0.441 -3.422 -3.500 14 HA ILE 3 HA ILE 3 0.789 -5.646 -5.231 15 HB ILE 3 HB ILE 3 -0.557 -3.052 -5.966 16 HG12 ILE 3 HG12 ILE 3 -1.459 -3.707 -3.823 17 HG13 ILE 3 HG13 ILE 3 -2.640 -4.097 -5.068 18 HG21 ILE 3 HG21 ILE 3 -1.891 -5.397 -6.874 19 HG22 ILE 3 HG22 ILE 3 -1.125 -4.122 -7.823 20 HG23 ILE 3 HG23 ILE 3 -0.184 -5.518 -7.298 21 HD11 ILE 3 HD11 ILE 3 -1.955 -6.431 -4.994 22 HD12 ILE 3 HD12 ILE 3 -0.756 -6.043 -3.760 23 HD13 ILE 3 HD13 ILE 3 -2.475 -5.862 -3.408 24 H VAL 4 H VAL 4 1.390 -2.172 -5.801 25 HA VAL 4 HA VAL 4 2.656 -2.369 -8.243 26 HB VAL 4 HB VAL 4 3.399 -0.416 -6.062 27 HG11 VAL 4 HG11 VAL 4 3.635 0.992 -8.302 28 HG12 VAL 4 HG12 VAL 4 4.961 0.023 -7.660 29 HG13 VAL 4 HG13 VAL 4 3.962 -0.608 -8.969 30 HG21 VAL 4 HG21 VAL 4 1.052 -0.269 -6.283 31 HG22 VAL 4 HG22 VAL 4 1.707 1.051 -7.252 32 HG23 VAL 4 HG23 VAL 4 1.132 -0.419 -8.039 33 H LYS 5 H LYS 5 3.979 -2.872 -5.025 34 HA LYS 5 HA LYS 5 6.705 -2.946 -5.736 35 HB2 LYS 5 HB2 LYS 5 5.082 -3.883 -3.421 36 HB3 LYS 5 HB3 LYS 5 6.705 -4.538 -3.598 37 HG2 LYS 5 HG2 LYS 5 6.680 -1.668 -3.931 38 HG3 LYS 5 HG3 LYS 5 5.993 -2.155 -2.380 39 HD2 LYS 5 HD2 LYS 5 7.978 -2.860 -1.588 40 HD3 LYS 5 HD3 LYS 5 8.446 -3.581 -3.129 41 HE2 LYS 5 HE2 LYS 5 9.974 -1.867 -2.941 42 HE3 LYS 5 HE3 LYS 5 8.702 -1.099 -3.889 43 HZ1 LYS 5 HZ1 LYS 5 7.813 -0.312 -1.657 44 HZ2 LYS 5 HZ2 LYS 5 9.320 -0.743 -1.021 45 HZ3 LYS 5 HZ3 LYS 5 9.219 0.434 -2.232 46 H ARG 6 H ARG 6 4.435 -5.634 -5.137 47 HA ARG 6 HA ARG 6 6.093 -7.736 -5.803 48 HB2 ARG 6 HB2 ARG 6 3.219 -7.305 -5.579 49 HB3 ARG 6 HB3 ARG 6 3.621 -8.520 -6.785 50 HG2 ARG 6 HG2 ARG 6 3.205 -9.447 -4.529 51 HG3 ARG 6 HG3 ARG 6 4.806 -9.827 -5.167 52 HD2 ARG 6 HD2 ARG 6 5.804 -8.808 -3.459 53 HD3 ARG 6 HD3 ARG 6 4.845 -7.348 -3.697 54 HE ARG 6 HE ARG 6 3.555 -7.983 -1.931 55 HH11 ARG 6 HH11 ARG 6 5.184 -10.795 -3.179 56 HH12 ARG 6 HH12 ARG 6 4.606 -11.846 -1.928 57 HH21 ARG 6 HH21 ARG 6 2.788 -9.355 -0.278 58 HH22 ARG 6 HH22 ARG 6 3.243 -11.026 -0.279 59 H PHE 7 H PHE 7 3.941 -5.904 -7.964 60 HA PHE 7 HA PHE 7 4.391 -7.257 -10.323 61 HB2 PHE 7 HB2 PHE 7 2.910 -5.140 -9.725 62 HB3 PHE 7 HB3 PHE 7 4.278 -4.275 -10.419 63 HD1 PHE 7 HD1 PHE 7 2.355 -7.362 -11.273 64 HD2 PHE 7 HD2 PHE 7 3.946 -3.640 -12.588 65 HE1 PHE 7 HE1 PHE 7 1.471 -7.785 -13.530 66 HE2 PHE 7 HE2 PHE 7 3.064 -4.056 -14.847 67 HZ PHE 7 HZ PHE 7 1.824 -6.131 -15.320 68 H LYS 8 H LYS 8 6.182 -4.401 -9.161 69 HA LYS 8 HA LYS 8 8.063 -4.257 -11.189 70 HB2 LYS 8 HB2 LYS 8 8.105 -3.463 -8.298 71 HB3 LYS 8 HB3 LYS 8 9.555 -3.289 -9.278 72 HG2 LYS 8 HG2 LYS 8 6.955 -2.144 -10.206 73 HG3 LYS 8 HG3 LYS 8 7.950 -1.286 -9.027 74 HD2 LYS 8 HD2 LYS 8 9.866 -1.514 -10.648 75 HD3 LYS 8 HD3 LYS 8 8.694 -2.096 -11.832 76 HE2 LYS 8 HE2 LYS 8 7.411 0.089 -11.213 77 HE3 LYS 8 HE3 LYS 8 8.984 0.621 -10.621 78 HZ1 LYS 8 HZ1 LYS 8 8.969 1.340 -12.800 79 HZ2 LYS 8 HZ2 LYS 8 9.801 -0.128 -12.924 80 HZ3 LYS 8 HZ3 LYS 8 8.173 -0.038 -13.376 81 H ILE 9 H ILE 9 7.996 -6.307 -8.336 82 HA ILE 9 HA ILE 9 10.654 -7.283 -8.589 83 HB ILE 9 HB ILE 9 8.276 -8.525 -7.201 84 HG12 ILE 9 HG12 ILE 9 10.564 -7.081 -5.889 85 HG13 ILE 9 HG13 ILE 9 9.167 -6.197 -6.491 86 HG21 ILE 9 HG21 ILE 9 10.459 -9.445 -5.888 87 HG22 ILE 9 HG22 ILE 9 9.619 -10.328 -7.163 88 HG23 ILE 9 HG23 ILE 9 11.062 -9.389 -7.545 89 HD11 ILE 9 HD11 ILE 9 7.916 -8.071 -5.051 90 HD12 ILE 9 HD12 ILE 9 9.430 -7.965 -4.153 91 HD13 ILE 9 HD13 ILE 9 8.443 -6.523 -4.388 92 H LEU 10 H LEU 10 7.502 -8.760 -9.371 93 HA LEU 10 HA LEU 10 8.397 -11.120 -10.482 94 HB2 LEU 10 HB2 LEU 10 5.996 -9.414 -10.912 95 HB3 LEU 10 HB3 LEU 10 6.281 -10.761 -12.013 96 HG LEU 10 HG LEU 10 6.352 -12.252 -9.976 97 HD11 LEU 10 HD11 LEU 10 5.377 -11.446 -7.929 98 HD12 LEU 10 HD12 LEU 10 6.762 -10.437 -8.347 99 HD13 LEU 10 HD13 LEU 10 5.124 -9.849 -8.634 100 HD21 LEU 10 HD21 LEU 10 3.695 -11.593 -9.651 101 HD22 LEU 10 HD22 LEU 10 4.075 -10.982 -11.262 102 HD23 LEU 10 HD23 LEU 10 4.356 -12.679 -10.874 103 H VAL 11 H VAL 11 7.838 -8.021 -12.135 104 HA VAL 11 HA VAL 11 8.686 -8.933 -14.684 105 HB VAL 11 HB VAL 11 8.699 -6.612 -15.357 106 HG11 VAL 11 HG11 VAL 11 6.484 -6.718 -15.427 107 HG12 VAL 11 HG12 VAL 11 6.502 -7.920 -14.136 108 HG13 VAL 11 HG13 VAL 11 6.394 -6.204 -13.742 109 HG21 VAL 11 HG21 VAL 11 8.470 -5.974 -12.416 110 HG22 VAL 11 HG22 VAL 11 9.860 -5.652 -13.453 111 HG23 VAL 11 HG23 VAL 11 8.340 -4.802 -13.728 Start of MODEL 3 1 H1 GLY 1 H GLY 1 3.158 0.980 -0.150 2 HA2 GLY 1 HA2 GLY 1 0.797 -0.093 -0.299 3 HA3 GLY 1 HA3 GLY 1 1.108 0.020 -2.025 4 H PHE 2 H PHE 2 1.205 -2.117 -2.523 5 HA PHE 2 HA PHE 2 3.588 -3.529 -1.661 6 HB2 PHE 2 HB2 PHE 2 2.134 -5.618 -1.237 7 HB3 PHE 2 HB3 PHE 2 2.207 -4.392 0.025 8 HD1 PHE 2 HD1 PHE 2 0.111 -6.071 -2.417 9 HD2 PHE 2 HD2 PHE 2 0.298 -2.910 0.428 10 HE1 PHE 2 HE1 PHE 2 -2.344 -5.906 -2.444 11 HE2 PHE 2 HE2 PHE 2 -2.156 -2.741 0.406 12 HZ PHE 2 HZ PHE 2 -3.481 -4.241 -1.030 13 H ILE 3 H ILE 3 0.617 -3.582 -3.579 14 HA ILE 3 HA ILE 3 1.186 -5.623 -5.344 15 HB ILE 3 HB ILE 3 -0.177 -3.010 -6.008 16 HG12 ILE 3 HG12 ILE 3 -1.299 -5.640 -5.016 17 HG13 ILE 3 HG13 ILE 3 -1.211 -4.141 -4.098 18 HG21 ILE 3 HG21 ILE 3 -0.448 -3.783 -8.069 19 HG22 ILE 3 HG22 ILE 3 0.542 -5.185 -7.662 20 HG23 ILE 3 HG23 ILE 3 -1.206 -5.246 -7.441 21 HD11 ILE 3 HD11 ILE 3 -2.897 -4.706 -6.519 22 HD12 ILE 3 HD12 ILE 3 -3.441 -4.407 -4.868 23 HD13 ILE 3 HD13 ILE 3 -2.704 -3.105 -5.803 24 H VAL 4 H VAL 4 1.938 -2.165 -5.802 25 HA VAL 4 HA VAL 4 3.286 -2.332 -8.204 26 HB VAL 4 HB VAL 4 3.938 -0.499 -5.893 27 HG11 VAL 4 HG11 VAL 4 5.147 -0.825 -8.480 28 HG12 VAL 4 HG12 VAL 4 4.416 0.774 -8.339 29 HG13 VAL 4 HG13 VAL 4 5.610 0.242 -7.155 30 HG21 VAL 4 HG21 VAL 4 2.131 0.715 -6.398 31 HG22 VAL 4 HG22 VAL 4 2.435 0.596 -8.131 32 HG23 VAL 4 HG23 VAL 4 1.576 -0.697 -7.296 33 H LYS 5 H LYS 5 4.452 -3.025 -4.961 34 HA LYS 5 HA LYS 5 7.198 -3.213 -5.579 35 HB2 LYS 5 HB2 LYS 5 5.477 -3.769 -3.317 36 HB3 LYS 5 HB3 LYS 5 6.708 -5.013 -3.492 37 HG2 LYS 5 HG2 LYS 5 8.201 -2.780 -3.809 38 HG3 LYS 5 HG3 LYS 5 6.960 -2.200 -2.695 39 HD2 LYS 5 HD2 LYS 5 7.788 -4.770 -1.820 40 HD3 LYS 5 HD3 LYS 5 9.237 -3.814 -2.140 41 HE2 LYS 5 HE2 LYS 5 7.019 -2.523 -0.643 42 HE3 LYS 5 HE3 LYS 5 7.979 -3.740 0.197 43 HZ1 LYS 5 HZ1 LYS 5 9.524 -1.787 -1.268 44 HZ2 LYS 5 HZ2 LYS 5 8.632 -1.145 0.019 45 HZ3 LYS 5 HZ3 LYS 5 9.744 -2.390 0.298 46 H ARG 6 H ARG 6 4.844 -5.841 -5.027 47 HA ARG 6 HA ARG 6 6.470 -7.941 -5.839 48 HB2 ARG 6 HB2 ARG 6 3.482 -7.583 -5.850 49 HB3 ARG 6 HB3 ARG 6 4.230 -9.079 -6.394 50 HG2 ARG 6 HG2 ARG 6 4.339 -9.780 -4.302 51 HG3 ARG 6 HG3 ARG 6 5.376 -8.411 -3.895 52 HD2 ARG 6 HD2 ARG 6 3.195 -7.070 -3.722 53 HD3 ARG 6 HD3 ARG 6 2.390 -8.638 -3.690 54 HE ARG 6 HE ARG 6 4.517 -8.354 -1.766 55 HH11 ARG 6 HH11 ARG 6 1.124 -7.909 -2.404 56 HH12 ARG 6 HH12 ARG 6 0.671 -7.947 -0.732 57 HH21 ARG 6 HH21 ARG 6 3.934 -8.406 0.438 58 HH22 ARG 6 HH22 ARG 6 2.271 -8.229 0.884 59 H PHE 7 H PHE 7 4.127 -6.076 -7.761 60 HA PHE 7 HA PHE 7 4.368 -7.379 -10.177 61 HB2 PHE 7 HB2 PHE 7 2.938 -5.284 -9.406 62 HB3 PHE 7 HB3 PHE 7 4.235 -4.397 -10.201 63 HD1 PHE 7 HD1 PHE 7 2.159 -7.423 -10.905 64 HD2 PHE 7 HD2 PHE 7 3.804 -3.775 -12.357 65 HE1 PHE 7 HE1 PHE 7 1.078 -7.805 -13.082 66 HE2 PHE 7 HE2 PHE 7 2.725 -4.152 -14.536 67 HZ PHE 7 HZ PHE 7 1.359 -6.168 -14.901 68 H LYS 8 H LYS 8 6.282 -4.590 -9.060 69 HA LYS 8 HA LYS 8 7.963 -4.369 -11.265 70 HB2 LYS 8 HB2 LYS 8 8.257 -3.654 -8.368 71 HB3 LYS 8 HB3 LYS 8 9.622 -3.460 -9.460 72 HG2 LYS 8 HG2 LYS 8 6.980 -2.291 -10.198 73 HG3 LYS 8 HG3 LYS 8 7.997 -1.475 -9.008 74 HD2 LYS 8 HD2 LYS 8 9.738 -2.129 -11.072 75 HD3 LYS 8 HD3 LYS 8 8.262 -1.612 -11.891 76 HE2 LYS 8 HE2 LYS 8 9.714 0.289 -11.540 77 HE3 LYS 8 HE3 LYS 8 8.269 0.451 -10.543 78 HZ1 LYS 8 HZ1 LYS 8 10.707 0.814 -9.600 79 HZ2 LYS 8 HZ2 LYS 8 9.442 0.222 -8.644 80 HZ3 LYS 8 HZ3 LYS 8 10.568 -0.848 -9.314 81 H ILE 9 H ILE 9 8.147 -6.500 -8.476 82 HA ILE 9 HA ILE 9 10.770 -7.466 -8.991 83 HB ILE 9 HB ILE 9 8.521 -8.750 -7.437 84 HG12 ILE 9 HG12 ILE 9 10.913 -7.398 -6.236 85 HG13 ILE 9 HG13 ILE 9 9.543 -6.430 -6.771 86 HG21 ILE 9 HG21 ILE 9 11.470 -9.379 -7.487 87 HG22 ILE 9 HG22 ILE 9 10.294 -10.082 -6.376 88 HG23 ILE 9 HG23 ILE 9 10.171 -10.398 -8.106 89 HD11 ILE 9 HD11 ILE 9 8.741 -6.770 -4.726 90 HD12 ILE 9 HD12 ILE 9 8.341 -8.391 -5.292 91 HD13 ILE 9 HD13 ILE 9 9.846 -8.110 -4.417 92 H LEU 10 H LEU 10 7.554 -8.894 -9.563 93 HA LEU 10 HA LEU 10 8.328 -11.234 -10.799 94 HB2 LEU 10 HB2 LEU 10 5.928 -9.484 -11.008 95 HB3 LEU 10 HB3 LEU 10 6.111 -10.806 -12.160 96 HG LEU 10 HG LEU 10 6.305 -12.352 -10.175 97 HD11 LEU 10 HD11 LEU 10 5.527 -11.596 -8.037 98 HD12 LEU 10 HD12 LEU 10 6.868 -10.569 -8.542 99 HD13 LEU 10 HD13 LEU 10 5.211 -9.981 -8.672 100 HD21 LEU 10 HD21 LEU 10 4.240 -12.718 -10.935 101 HD22 LEU 10 HD22 LEU 10 3.695 -11.666 -9.629 102 HD23 LEU 10 HD23 LEU 10 3.959 -11.004 -11.242 103 H VAL 11 H VAL 11 7.697 -8.083 -12.324 104 HA VAL 11 HA VAL 11 8.371 -8.953 -14.948 105 HB VAL 11 HB VAL 11 8.334 -6.607 -15.571 106 HG11 VAL 11 HG11 VAL 11 6.205 -7.916 -14.100 107 HG12 VAL 11 HG12 VAL 11 6.068 -6.158 -14.045 108 HG13 VAL 11 HG13 VAL 11 6.138 -6.989 -15.599 109 HG21 VAL 11 HG21 VAL 11 8.288 -6.102 -12.600 110 HG22 VAL 11 HG22 VAL 11 9.522 -5.601 -13.756 111 HG23 VAL 11 HG23 VAL 11 7.914 -4.879 -13.814 Start of MODEL 4 1 H1 GLY 1 H GLY 1 5.049 -3.568 1.566 2 HA2 GLY 1 HA2 GLY 1 4.949 -4.557 -0.742 3 HA3 GLY 1 HA3 GLY 1 3.691 -5.164 0.325 4 H PHE 2 H PHE 2 4.221 -2.278 -1.706 5 HA PHE 2 HA PHE 2 1.451 -1.965 -2.268 6 HB2 PHE 2 HB2 PHE 2 3.079 -0.094 -2.323 7 HB3 PHE 2 HB3 PHE 2 3.824 -0.811 -3.748 8 HD1 PHE 2 HD1 PHE 2 0.232 -0.411 -2.867 9 HD2 PHE 2 HD2 PHE 2 3.415 0.662 -5.482 10 HE1 PHE 2 HE1 PHE 2 -1.359 0.800 -4.300 11 HE2 PHE 2 HE2 PHE 2 1.829 1.875 -6.919 12 HZ PHE 2 HZ PHE 2 -0.561 1.946 -6.329 13 H ILE 3 H ILE 3 0.298 -2.411 -4.138 14 HA ILE 3 HA ILE 3 0.732 -4.816 -5.416 15 HB ILE 3 HB ILE 3 -0.771 -2.439 -6.518 16 HG12 ILE 3 HG12 ILE 3 -1.707 -4.781 -4.845 17 HG13 ILE 3 HG13 ILE 3 -1.559 -3.116 -4.296 18 HG21 ILE 3 HG21 ILE 3 -1.205 -3.667 -8.312 19 HG22 ILE 3 HG22 ILE 3 -0.167 -4.949 -7.687 20 HG23 ILE 3 HG23 ILE 3 -1.886 -4.935 -7.292 21 HD11 ILE 3 HD11 ILE 3 -3.764 -4.390 -5.532 22 HD12 ILE 3 HD12 ILE 3 -3.632 -2.732 -4.945 23 HD13 ILE 3 HD13 ILE 3 -3.186 -3.117 -6.608 24 H VAL 4 H VAL 4 1.223 -1.593 -6.873 25 HA VAL 4 HA VAL 4 2.407 -2.425 -9.237 26 HB VAL 4 HB VAL 4 3.015 0.101 -7.693 27 HG11 VAL 4 HG11 VAL 4 3.517 0.979 -10.011 28 HG12 VAL 4 HG12 VAL 4 4.693 -0.152 -9.341 29 HG13 VAL 4 HG13 VAL 4 3.530 -0.702 -10.547 30 HG21 VAL 4 HG21 VAL 4 0.626 -0.190 -8.135 31 HG22 VAL 4 HG22 VAL 4 1.299 1.132 -9.089 32 HG23 VAL 4 HG23 VAL 4 0.970 -0.425 -9.849 33 H LYS 5 H LYS 5 3.843 -1.917 -6.065 34 HA LYS 5 HA LYS 5 6.547 -2.083 -6.839 35 HB2 LYS 5 HB2 LYS 5 5.032 -2.310 -4.299 36 HB3 LYS 5 HB3 LYS 5 6.641 -3.018 -4.318 37 HG2 LYS 5 HG2 LYS 5 6.042 -0.177 -5.110 38 HG3 LYS 5 HG3 LYS 5 6.556 -0.675 -3.496 39 HD2 LYS 5 HD2 LYS 5 8.401 -1.864 -5.189 40 HD3 LYS 5 HD3 LYS 5 8.124 -0.276 -5.907 41 HE2 LYS 5 HE2 LYS 5 8.348 0.436 -3.334 42 HE3 LYS 5 HE3 LYS 5 9.355 -1.010 -3.318 43 HZ1 LYS 5 HZ1 LYS 5 9.940 1.562 -4.359 44 HZ2 LYS 5 HZ2 LYS 5 10.973 0.240 -4.136 45 HZ3 LYS 5 HZ3 LYS 5 10.092 0.393 -5.573 46 H ARG 6 H ARG 6 4.395 -4.569 -5.458 47 HA ARG 6 HA ARG 6 6.146 -6.709 -5.522 48 HB2 ARG 6 HB2 ARG 6 3.153 -6.644 -5.921 49 HB3 ARG 6 HB3 ARG 6 4.073 -8.130 -5.725 50 HG2 ARG 6 HG2 ARG 6 3.867 -5.897 -3.715 51 HG3 ARG 6 HG3 ARG 6 3.043 -7.456 -3.634 52 HD2 ARG 6 HD2 ARG 6 5.314 -8.536 -3.664 53 HD3 ARG 6 HD3 ARG 6 6.003 -6.924 -3.475 54 HE ARG 6 HE ARG 6 4.064 -7.423 -1.472 55 HH11 ARG 6 HH11 ARG 6 7.319 -8.227 -2.409 56 HH12 ARG 6 HH12 ARG 6 7.850 -8.532 -0.788 57 HH21 ARG 6 HH21 ARG 6 4.750 -7.821 0.667 58 HH22 ARG 6 HH22 ARG 6 6.388 -8.301 0.961 59 H PHE 7 H PHE 7 3.870 -5.674 -8.055 60 HA PHE 7 HA PHE 7 4.361 -7.628 -9.937 61 HB2 PHE 7 HB2 PHE 7 2.769 -5.507 -9.927 62 HB3 PHE 7 HB3 PHE 7 4.073 -4.813 -10.885 63 HD1 PHE 7 HD1 PHE 7 1.705 -7.657 -10.721 64 HD2 PHE 7 HD2 PHE 7 4.282 -5.304 -13.159 65 HE1 PHE 7 HE1 PHE 7 0.808 -8.761 -12.728 66 HE2 PHE 7 HE2 PHE 7 3.388 -6.404 -15.170 67 HZ PHE 7 HZ PHE 7 1.649 -8.135 -14.957 68 H LYS 8 H LYS 8 5.962 -4.444 -9.781 69 HA LYS 8 HA LYS 8 7.807 -4.796 -11.796 70 HB2 LYS 8 HB2 LYS 8 7.831 -3.204 -9.259 71 HB3 LYS 8 HB3 LYS 8 9.280 -3.265 -10.253 72 HG2 LYS 8 HG2 LYS 8 6.740 -2.626 -11.627 73 HG3 LYS 8 HG3 LYS 8 7.404 -1.401 -10.543 74 HD2 LYS 8 HD2 LYS 8 9.491 -2.502 -12.179 75 HD3 LYS 8 HD3 LYS 8 8.160 -1.944 -13.194 76 HE2 LYS 8 HE2 LYS 8 8.322 0.249 -12.401 77 HE3 LYS 8 HE3 LYS 8 9.253 -0.236 -10.985 78 HZ1 LYS 8 HZ1 LYS 8 10.881 -1.021 -12.931 79 HZ2 LYS 8 HZ2 LYS 8 10.145 0.296 -13.697 80 HZ3 LYS 8 HZ3 LYS 8 10.954 0.516 -12.227 81 H ILE 9 H ILE 9 7.913 -5.969 -8.487 82 HA ILE 9 HA ILE 9 10.624 -6.872 -8.614 83 HB ILE 9 HB ILE 9 8.413 -7.640 -6.705 84 HG12 ILE 9 HG12 ILE 9 10.733 -5.833 -6.093 85 HG13 ILE 9 HG13 ILE 9 9.290 -5.193 -6.872 86 HG21 ILE 9 HG21 ILE 9 10.137 -9.344 -6.762 87 HG22 ILE 9 HG22 ILE 9 11.386 -8.118 -6.542 88 HG23 ILE 9 HG23 ILE 9 10.228 -8.439 -5.251 89 HD11 ILE 9 HD11 ILE 9 8.990 -4.796 -4.591 90 HD12 ILE 9 HD12 ILE 9 7.994 -6.209 -4.938 91 HD13 ILE 9 HD13 ILE 9 9.558 -6.405 -4.146 92 H LEU 10 H LEU 10 7.466 -8.340 -9.142 93 HA LEU 10 HA LEU 10 8.341 -11.018 -9.318 94 HB2 LEU 10 HB2 LEU 10 6.183 -11.476 -9.662 95 HB3 LEU 10 HB3 LEU 10 5.925 -9.768 -9.314 96 HG LEU 10 HG LEU 10 6.248 -9.506 -11.903 97 HD11 LEU 10 HD11 LEU 10 4.912 -12.112 -12.128 98 HD12 LEU 10 HD12 LEU 10 6.057 -11.321 -13.211 99 HD13 LEU 10 HD13 LEU 10 6.641 -12.180 -11.786 100 HD21 LEU 10 HD21 LEU 10 4.088 -9.593 -10.188 101 HD22 LEU 10 HD22 LEU 10 4.067 -9.042 -11.864 102 HD23 LEU 10 HD23 LEU 10 3.637 -10.708 -11.478 103 H VAL 11 H VAL 11 8.334 -8.373 -11.580 104 HA VAL 11 HA VAL 11 9.019 -10.133 -13.809 105 HB VAL 11 HB VAL 11 8.914 -8.119 -15.202 106 HG11 VAL 11 HG11 VAL 11 6.633 -8.070 -15.313 107 HG12 VAL 11 HG12 VAL 11 6.848 -9.497 -14.299 108 HG13 VAL 11 HG13 VAL 11 6.439 -7.947 -13.565 109 HG21 VAL 11 HG21 VAL 11 8.106 -6.637 -12.704 110 HG22 VAL 11 HG22 VAL 11 9.715 -6.558 -13.423 111 HG23 VAL 11 HG23 VAL 11 8.317 -5.974 -14.325 Start of MODEL 5 1 H1 GLY 1 H GLY 1 1.440 0.071 0.048 2 HA2 GLY 1 HA2 GLY 1 3.286 0.102 -2.232 3 HA3 GLY 1 HA3 GLY 1 3.957 0.303 -0.620 4 H PHE 2 H PHE 2 2.123 -1.895 -2.687 5 HA PHE 2 HA PHE 2 3.475 -4.152 -1.487 6 HB2 PHE 2 HB2 PHE 2 1.045 -3.446 -0.395 7 HB3 PHE 2 HB3 PHE 2 0.593 -4.666 -1.581 8 HD1 PHE 2 HD1 PHE 2 3.135 -4.108 1.092 9 HD2 PHE 2 HD2 PHE 2 0.585 -6.861 -0.916 10 HE1 PHE 2 HE1 PHE 2 3.814 -5.876 2.662 11 HE2 PHE 2 HE2 PHE 2 1.259 -8.634 0.651 12 HZ PHE 2 HZ PHE 2 2.875 -8.143 2.443 13 H ILE 3 H ILE 3 0.616 -3.443 -3.502 14 HA ILE 3 HA ILE 3 0.971 -5.628 -5.239 15 HB ILE 3 HB ILE 3 -0.444 -3.015 -5.780 16 HG12 ILE 3 HG12 ILE 3 -1.483 -5.659 -4.737 17 HG13 ILE 3 HG13 ILE 3 -1.318 -4.176 -3.805 18 HG21 ILE 3 HG21 ILE 3 -1.585 -5.226 -7.155 19 HG22 ILE 3 HG22 ILE 3 -0.852 -3.769 -7.825 20 HG23 ILE 3 HG23 ILE 3 0.144 -5.187 -7.499 21 HD11 ILE 3 HD11 ILE 3 -2.863 -3.506 -6.037 22 HD12 ILE 3 HD12 ILE 3 -3.481 -5.054 -5.458 23 HD13 ILE 3 HD13 ILE 3 -3.394 -3.674 -4.363 24 H VAL 4 H VAL 4 1.616 -2.167 -5.829 25 HA VAL 4 HA VAL 4 2.816 -2.393 -8.307 26 HB VAL 4 HB VAL 4 3.597 -0.436 -6.143 27 HG11 VAL 4 HG11 VAL 4 4.101 -0.586 -9.083 28 HG12 VAL 4 HG12 VAL 4 3.953 0.987 -8.300 29 HG13 VAL 4 HG13 VAL 4 5.200 -0.145 -7.776 30 HG21 VAL 4 HG21 VAL 4 1.907 0.858 -7.890 31 HG22 VAL 4 HG22 VAL 4 1.167 -0.734 -7.720 32 HG23 VAL 4 HG23 VAL 4 1.476 0.252 -6.290 33 H LYS 5 H LYS 5 4.222 -2.843 -5.110 34 HA LYS 5 HA LYS 5 6.922 -2.986 -5.906 35 HB2 LYS 5 HB2 LYS 5 5.355 -3.733 -3.505 36 HB3 LYS 5 HB3 LYS 5 6.899 -4.551 -3.709 37 HG2 LYS 5 HG2 LYS 5 7.592 -1.967 -4.189 38 HG3 LYS 5 HG3 LYS 5 6.314 -1.776 -2.986 39 HD2 LYS 5 HD2 LYS 5 7.994 -2.105 -1.519 40 HD3 LYS 5 HD3 LYS 5 7.728 -3.809 -1.895 41 HE2 LYS 5 HE2 LYS 5 9.411 -3.318 -3.844 42 HE3 LYS 5 HE3 LYS 5 9.892 -1.971 -2.814 43 HZ1 LYS 5 HZ1 LYS 5 10.746 -3.352 -1.245 44 HZ2 LYS 5 HZ2 LYS 5 9.679 -4.619 -1.590 45 HZ3 LYS 5 HZ3 LYS 5 11.002 -4.327 -2.604 46 H ARG 6 H ARG 6 4.625 -5.610 -5.145 47 HA ARG 6 HA ARG 6 6.225 -7.764 -5.789 48 HB2 ARG 6 HB2 ARG 6 3.490 -7.332 -5.219 49 HB3 ARG 6 HB3 ARG 6 3.551 -8.280 -6.699 50 HG2 ARG 6 HG2 ARG 6 4.867 -8.982 -4.083 51 HG3 ARG 6 HG3 ARG 6 3.412 -9.720 -4.757 52 HD2 ARG 6 HD2 ARG 6 6.168 -9.787 -5.980 53 HD3 ARG 6 HD3 ARG 6 5.375 -11.120 -5.141 54 HE ARG 6 HE ARG 6 3.880 -10.098 -7.375 55 HH11 ARG 6 HH11 ARG 6 6.362 -12.318 -6.358 56 HH12 ARG 6 HH12 ARG 6 6.154 -13.375 -7.714 57 HH21 ARG 6 HH21 ARG 6 3.597 -11.482 -9.165 58 HH22 ARG 6 HH22 ARG 6 4.581 -12.899 -9.311 59 H PHE 7 H PHE 7 4.030 -5.974 -7.944 60 HA PHE 7 HA PHE 7 4.392 -7.415 -10.266 61 HB2 PHE 7 HB2 PHE 7 2.946 -5.266 -9.695 62 HB3 PHE 7 HB3 PHE 7 4.295 -4.439 -10.466 63 HD1 PHE 7 HD1 PHE 7 1.756 -7.086 -10.995 64 HD2 PHE 7 HD2 PHE 7 4.461 -4.334 -12.790 65 HE1 PHE 7 HE1 PHE 7 0.792 -7.584 -13.203 66 HE2 PHE 7 HE2 PHE 7 3.501 -4.827 -15.001 67 HZ PHE 7 HZ PHE 7 1.663 -6.453 -15.210 68 H LYS 8 H LYS 8 6.202 -4.485 -9.334 69 HA LYS 8 HA LYS 8 8.025 -4.438 -11.400 70 HB2 LYS 8 HB2 LYS 8 8.135 -3.533 -8.549 71 HB3 LYS 8 HB3 LYS 8 9.591 -3.448 -9.533 72 HG2 LYS 8 HG2 LYS 8 7.081 -2.295 -10.628 73 HG3 LYS 8 HG3 LYS 8 7.929 -1.419 -9.352 74 HD2 LYS 8 HD2 LYS 8 10.016 -1.637 -10.758 75 HD3 LYS 8 HD3 LYS 8 8.977 -2.221 -12.060 76 HE2 LYS 8 HE2 LYS 8 7.997 0.234 -10.839 77 HE3 LYS 8 HE3 LYS 8 9.608 0.412 -11.532 78 HZ1 LYS 8 HZ1 LYS 8 7.410 -0.840 -13.058 79 HZ2 LYS 8 HZ2 LYS 8 7.620 0.839 -13.037 80 HZ3 LYS 8 HZ3 LYS 8 8.846 -0.159 -13.640 81 H ILE 9 H ILE 9 8.048 -6.404 -8.488 82 HA ILE 9 HA ILE 9 10.693 -7.420 -8.874 83 HB ILE 9 HB ILE 9 8.428 -8.497 -7.191 84 HG12 ILE 9 HG12 ILE 9 10.864 -7.048 -6.192 85 HG13 ILE 9 HG13 ILE 9 9.450 -6.154 -6.739 86 HG21 ILE 9 HG21 ILE 9 11.337 -9.248 -7.341 87 HG22 ILE 9 HG22 ILE 9 10.300 -9.664 -5.977 88 HG23 ILE 9 HG23 ILE 9 9.933 -10.287 -7.585 89 HD11 ILE 9 HD11 ILE 9 9.163 -6.328 -4.444 90 HD12 ILE 9 HD12 ILE 9 8.142 -7.612 -5.090 91 HD13 ILE 9 HD13 ILE 9 9.719 -8.001 -4.403 92 H LEU 10 H LEU 10 7.450 -8.495 -9.726 93 HA LEU 10 HA LEU 10 8.150 -11.095 -10.578 94 HB2 LEU 10 HB2 LEU 10 5.968 -11.315 -10.997 95 HB3 LEU 10 HB3 LEU 10 5.820 -9.737 -10.226 96 HG LEU 10 HG LEU 10 6.166 -8.852 -12.671 97 HD11 LEU 10 HD11 LEU 10 5.918 -11.706 -13.046 98 HD12 LEU 10 HD12 LEU 10 4.648 -10.828 -13.898 99 HD13 LEU 10 HD13 LEU 10 6.343 -10.448 -14.206 100 HD21 LEU 10 HD21 LEU 10 3.999 -9.233 -11.003 101 HD22 LEU 10 HD22 LEU 10 4.022 -8.273 -12.483 102 HD23 LEU 10 HD23 LEU 10 3.481 -9.951 -12.529 103 H VAL 11 H VAL 11 8.320 -7.970 -12.099 104 HA VAL 11 HA VAL 11 8.896 -9.149 -14.709 105 HB VAL 11 HB VAL 11 8.922 -6.846 -15.549 106 HG11 VAL 11 HG11 VAL 11 6.657 -6.657 -15.632 107 HG12 VAL 11 HG12 VAL 11 6.764 -8.278 -14.947 108 HG13 VAL 11 HG13 VAL 11 6.460 -6.895 -13.896 109 HG21 VAL 11 HG21 VAL 11 8.334 -6.062 -12.694 110 HG22 VAL 11 HG22 VAL 11 9.835 -5.750 -13.565 111 HG23 VAL 11 HG23 VAL 11 8.337 -4.977 -14.085 Start of MODEL 6 1 H1 GLY 1 H GLY 1 1.473 1.058 -0.421 2 HA2 GLY 1 HA2 GLY 1 0.896 -0.218 -2.453 3 HA3 GLY 1 HA3 GLY 1 2.431 0.611 -2.662 4 H PHE 2 H PHE 2 1.509 -2.346 -0.904 5 HA PHE 2 HA PHE 2 3.854 -3.739 -1.513 6 HB2 PHE 2 HB2 PHE 2 2.781 -5.676 -0.626 7 HB3 PHE 2 HB3 PHE 2 2.174 -4.300 0.290 8 HD1 PHE 2 HD1 PHE 2 1.355 -6.845 -2.214 9 HD2 PHE 2 HD2 PHE 2 -0.121 -3.614 0.132 10 HE1 PHE 2 HE1 PHE 2 -0.951 -7.512 -2.752 11 HE2 PHE 2 HE2 PHE 2 -2.429 -4.277 -0.402 12 HZ PHE 2 HZ PHE 2 -2.847 -6.228 -1.845 13 H ILE 3 H ILE 3 0.826 -3.447 -3.248 14 HA ILE 3 HA ILE 3 1.121 -5.563 -5.053 15 HB ILE 3 HB ILE 3 -0.207 -2.893 -5.537 16 HG12 ILE 3 HG12 ILE 3 -1.326 -5.512 -4.515 17 HG13 ILE 3 HG13 ILE 3 -1.106 -4.044 -3.570 18 HG21 ILE 3 HG21 ILE 3 -0.675 -3.603 -7.585 19 HG22 ILE 3 HG22 ILE 3 0.292 -5.049 -7.296 20 HG23 ILE 3 HG23 ILE 3 -1.432 -5.053 -6.927 21 HD11 ILE 3 HD11 ILE 3 -3.017 -4.485 -5.845 22 HD12 ILE 3 HD12 ILE 3 -3.402 -4.213 -4.146 23 HD13 ILE 3 HD13 ILE 3 -2.705 -2.912 -5.112 24 H VAL 4 H VAL 4 1.930 -2.119 -5.523 25 HA VAL 4 HA VAL 4 3.068 -2.290 -8.032 26 HB VAL 4 HB VAL 4 3.946 -0.496 -5.764 27 HG11 VAL 4 HG11 VAL 4 4.619 1.006 -7.699 28 HG12 VAL 4 HG12 VAL 4 5.642 -0.398 -7.395 29 HG13 VAL 4 HG13 VAL 4 4.480 -0.424 -8.721 30 HG21 VAL 4 HG21 VAL 4 1.493 -0.487 -6.499 31 HG22 VAL 4 HG22 VAL 4 2.343 1.058 -6.471 32 HG23 VAL 4 HG23 VAL 4 2.079 0.224 -8.003 33 H LYS 5 H LYS 5 4.634 -2.742 -4.879 34 HA LYS 5 HA LYS 5 7.251 -3.097 -5.773 35 HB2 LYS 5 HB2 LYS 5 5.924 -4.443 -3.413 36 HB3 LYS 5 HB3 LYS 5 7.655 -4.241 -3.651 37 HG2 LYS 5 HG2 LYS 5 5.858 -1.855 -3.572 38 HG3 LYS 5 HG3 LYS 5 6.387 -2.631 -2.077 39 HD2 LYS 5 HD2 LYS 5 8.715 -2.412 -3.542 40 HD3 LYS 5 HD3 LYS 5 7.856 -0.915 -3.917 41 HE2 LYS 5 HE2 LYS 5 7.485 -0.778 -1.358 42 HE3 LYS 5 HE3 LYS 5 8.804 -1.944 -1.268 43 HZ1 LYS 5 HZ1 LYS 5 10.226 -0.404 -2.437 44 HZ2 LYS 5 HZ2 LYS 5 8.959 0.704 -2.604 45 HZ3 LYS 5 HZ3 LYS 5 9.578 0.351 -1.069 46 H ARG 6 H ARG 6 4.805 -5.592 -5.057 47 HA ARG 6 HA ARG 6 6.268 -7.822 -5.788 48 HB2 ARG 6 HB2 ARG 6 3.411 -7.164 -5.520 49 HB3 ARG 6 HB3 ARG 6 3.753 -8.515 -6.593 50 HG2 ARG 6 HG2 ARG 6 5.258 -8.703 -4.131 51 HG3 ARG 6 HG3 ARG 6 3.521 -8.598 -3.836 52 HD2 ARG 6 HD2 ARG 6 3.634 -10.834 -4.150 53 HD3 ARG 6 HD3 ARG 6 3.521 -10.368 -5.847 54 HE ARG 6 HE ARG 6 6.220 -10.394 -5.116 55 HH11 ARG 6 HH11 ARG 6 3.568 -12.607 -5.552 56 HH12 ARG 6 HH12 ARG 6 4.583 -13.942 -5.986 57 HH21 ARG 6 HH21 ARG 6 7.567 -12.144 -5.687 58 HH22 ARG 6 HH22 ARG 6 6.857 -13.678 -6.062 59 H PHE 7 H PHE 7 4.116 -5.862 -7.838 60 HA PHE 7 HA PHE 7 4.360 -7.248 -10.208 61 HB2 PHE 7 HB2 PHE 7 3.027 -5.054 -9.543 62 HB3 PHE 7 HB3 PHE 7 4.396 -4.266 -10.321 63 HD1 PHE 7 HD1 PHE 7 1.683 -6.725 -10.854 64 HD2 PHE 7 HD2 PHE 7 4.558 -4.155 -12.656 65 HE1 PHE 7 HE1 PHE 7 0.648 -7.113 -13.052 66 HE2 PHE 7 HE2 PHE 7 3.527 -4.538 -14.856 67 HZ PHE 7 HZ PHE 7 1.569 -6.018 -15.057 68 H LYS 8 H LYS 8 6.323 -4.432 -9.236 69 HA LYS 8 HA LYS 8 8.099 -4.404 -11.341 70 HB2 LYS 8 HB2 LYS 8 8.364 -3.627 -8.456 71 HB3 LYS 8 HB3 LYS 8 9.752 -3.516 -9.530 72 HG2 LYS 8 HG2 LYS 8 7.265 -2.291 -10.522 73 HG3 LYS 8 HG3 LYS 8 8.008 -1.515 -9.121 74 HD2 LYS 8 HD2 LYS 8 9.866 -2.248 -11.283 75 HD3 LYS 8 HD3 LYS 8 8.685 -1.002 -11.697 76 HE2 LYS 8 HE2 LYS 8 10.693 0.030 -10.835 77 HE3 LYS 8 HE3 LYS 8 9.368 0.268 -9.697 78 HZ1 LYS 8 HZ1 LYS 8 11.524 -1.761 -9.464 79 HZ2 LYS 8 HZ2 LYS 8 11.380 -0.350 -8.541 80 HZ3 LYS 8 HZ3 LYS 8 10.233 -1.584 -8.386 81 H ILE 9 H ILE 9 8.095 -6.464 -8.496 82 HA ILE 9 HA ILE 9 10.680 -7.588 -8.979 83 HB ILE 9 HB ILE 9 8.409 -8.615 -7.274 84 HG12 ILE 9 HG12 ILE 9 10.918 -7.358 -6.227 85 HG13 ILE 9 HG13 ILE 9 9.618 -6.326 -6.814 86 HG21 ILE 9 HG21 ILE 9 9.592 -10.472 -7.004 87 HG22 ILE 9 HG22 ILE 9 10.854 -9.852 -8.070 88 HG23 ILE 9 HG23 ILE 9 10.915 -9.512 -6.340 89 HD11 ILE 9 HD11 ILE 9 8.111 -7.172 -5.185 90 HD12 ILE 9 HD12 ILE 9 9.241 -8.440 -4.713 91 HD13 ILE 9 HD13 ILE 9 9.611 -6.753 -4.358 92 H LEU 10 H LEU 10 7.368 -8.490 -9.770 93 HA LEU 10 HA LEU 10 7.923 -11.090 -10.721 94 HB2 LEU 10 HB2 LEU 10 5.724 -11.192 -11.093 95 HB3 LEU 10 HB3 LEU 10 5.670 -9.634 -10.271 96 HG LEU 10 HG LEU 10 6.002 -8.689 -12.695 97 HD11 LEU 10 HD11 LEU 10 4.371 -10.970 -13.578 98 HD12 LEU 10 HD12 LEU 10 5.579 -10.027 -14.451 99 HD13 LEU 10 HD13 LEU 10 6.087 -11.309 -13.350 100 HD21 LEU 10 HD21 LEU 10 3.809 -9.146 -11.003 101 HD22 LEU 10 HD22 LEU 10 3.935 -7.975 -12.315 102 HD23 LEU 10 HD23 LEU 10 3.277 -9.581 -12.627 103 H VAL 11 H VAL 11 8.208 -7.931 -12.153 104 HA VAL 11 HA VAL 11 8.631 -9.035 -14.819 105 HB VAL 11 HB VAL 11 8.840 -6.697 -15.548 106 HG11 VAL 11 HG11 VAL 11 6.571 -6.175 -15.416 107 HG12 VAL 11 HG12 VAL 11 6.609 -7.924 -15.195 108 HG13 VAL 11 HG13 VAL 11 6.410 -6.863 -13.800 109 HG21 VAL 11 HG21 VAL 11 8.295 -5.980 -12.669 110 HG22 VAL 11 HG22 VAL 11 9.860 -5.831 -13.469 111 HG23 VAL 11 HG23 VAL 11 8.494 -4.860 -14.017 Start of MODEL 7 1 H1 GLY 1 H GLY 1 -0.476 -3.347 0.752 2 HA2 GLY 1 HA2 GLY 1 2.316 -3.180 1.709 3 HA3 GLY 1 HA3 GLY 1 1.767 -4.444 0.619 4 H PHE 2 H PHE 2 2.882 -4.053 -1.202 5 HA PHE 2 HA PHE 2 2.373 -1.504 -2.549 6 HB2 PHE 2 HB2 PHE 2 4.852 -1.710 -3.362 7 HB3 PHE 2 HB3 PHE 2 4.504 -0.982 -1.797 8 HD1 PHE 2 HD1 PHE 2 5.928 -3.855 -3.531 9 HD2 PHE 2 HD2 PHE 2 5.023 -2.153 0.264 10 HE1 PHE 2 HE1 PHE 2 7.413 -5.490 -2.447 11 HE2 PHE 2 HE2 PHE 2 6.507 -3.785 1.354 12 HZ PHE 2 HZ PHE 2 7.704 -5.456 -0.002 13 H ILE 3 H ILE 3 1.239 -2.151 -4.265 14 HA ILE 3 HA ILE 3 1.643 -4.695 -5.522 15 HB ILE 3 HB ILE 3 -0.029 -2.332 -6.379 16 HG12 ILE 3 HG12 ILE 3 -1.265 -4.854 -5.454 17 HG13 ILE 3 HG13 ILE 3 -0.425 -3.922 -4.219 18 HG21 ILE 3 HG21 ILE 3 0.268 -5.092 -7.515 19 HG22 ILE 3 HG22 ILE 3 -1.199 -4.144 -7.755 20 HG23 ILE 3 HG23 ILE 3 0.349 -3.539 -8.347 21 HD11 ILE 3 HD11 ILE 3 -2.578 -2.834 -6.014 22 HD12 ILE 3 HD12 ILE 3 -2.829 -3.414 -4.368 23 HD13 ILE 3 HD13 ILE 3 -1.806 -2.008 -4.660 24 H VAL 4 H VAL 4 2.201 -1.319 -6.492 25 HA VAL 4 HA VAL 4 3.180 -1.709 -9.038 26 HB VAL 4 HB VAL 4 4.196 0.309 -7.031 27 HG11 VAL 4 HG11 VAL 4 4.706 -0.140 -9.897 28 HG12 VAL 4 HG12 VAL 4 4.358 1.525 -9.433 29 HG13 VAL 4 HG13 VAL 4 5.697 0.660 -8.677 30 HG21 VAL 4 HG21 VAL 4 1.687 0.064 -8.511 31 HG22 VAL 4 HG22 VAL 4 2.081 1.046 -7.101 32 HG23 VAL 4 HG23 VAL 4 2.487 1.621 -8.717 33 H LYS 5 H LYS 5 5.054 -1.653 -6.010 34 HA LYS 5 HA LYS 5 7.535 -2.263 -7.219 35 HB2 LYS 5 HB2 LYS 5 6.463 -2.140 -4.462 36 HB3 LYS 5 HB3 LYS 5 7.882 -3.153 -4.691 37 HG2 LYS 5 HG2 LYS 5 7.688 -0.258 -5.497 38 HG3 LYS 5 HG3 LYS 5 8.431 -0.851 -4.009 39 HD2 LYS 5 HD2 LYS 5 9.500 -2.290 -6.239 40 HD3 LYS 5 HD3 LYS 5 9.617 -0.557 -6.555 41 HE2 LYS 5 HE2 LYS 5 10.521 -1.833 -3.982 42 HE3 LYS 5 HE3 LYS 5 11.586 -1.596 -5.367 43 HZ1 LYS 5 HZ1 LYS 5 11.997 0.353 -4.367 44 HZ2 LYS 5 HZ2 LYS 5 10.545 0.847 -5.081 45 HZ3 LYS 5 HZ3 LYS 5 10.564 0.337 -3.468 46 H ARG 6 H ARG 6 5.175 -4.300 -5.506 47 HA ARG 6 HA ARG 6 6.502 -6.718 -5.609 48 HB2 ARG 6 HB2 ARG 6 3.657 -5.894 -5.470 49 HB3 ARG 6 HB3 ARG 6 3.966 -7.559 -5.944 50 HG2 ARG 6 HG2 ARG 6 5.548 -7.504 -3.836 51 HG3 ARG 6 HG3 ARG 6 4.463 -6.198 -3.354 52 HD2 ARG 6 HD2 ARG 6 3.727 -9.042 -4.020 53 HD3 ARG 6 HD3 ARG 6 3.624 -8.250 -2.448 54 HE ARG 6 HE ARG 6 2.054 -6.888 -4.380 55 HH11 ARG 6 HH11 ARG 6 2.114 -9.734 -2.375 56 HH12 ARG 6 HH12 ARG 6 0.389 -9.867 -2.288 57 HH21 ARG 6 HH21 ARG 6 -0.218 -7.053 -4.273 58 HH22 ARG 6 HH22 ARG 6 -0.937 -8.343 -3.369 59 H PHE 7 H PHE 7 4.122 -5.518 -7.983 60 HA PHE 7 HA PHE 7 4.294 -7.570 -9.818 61 HB2 PHE 7 HB2 PHE 7 2.848 -5.348 -9.741 62 HB3 PHE 7 HB3 PHE 7 4.089 -4.778 -10.852 63 HD1 PHE 7 HD1 PHE 7 1.569 -7.442 -10.335 64 HD2 PHE 7 HD2 PHE 7 4.042 -5.370 -13.112 65 HE1 PHE 7 HE1 PHE 7 0.406 -8.555 -12.196 66 HE2 PHE 7 HE2 PHE 7 2.883 -6.479 -14.977 67 HZ PHE 7 HZ PHE 7 1.062 -8.073 -14.520 68 H LYS 8 H LYS 8 6.114 -4.504 -9.928 69 HA LYS 8 HA LYS 8 7.716 -5.042 -12.107 70 HB2 LYS 8 HB2 LYS 8 8.295 -3.461 -9.603 71 HB3 LYS 8 HB3 LYS 8 9.392 -3.501 -10.977 72 HG2 LYS 8 HG2 LYS 8 6.718 -2.885 -11.840 73 HG3 LYS 8 HG3 LYS 8 7.241 -1.775 -10.571 74 HD2 LYS 8 HD2 LYS 8 9.182 -2.375 -12.730 75 HD3 LYS 8 HD3 LYS 8 7.789 -1.378 -13.155 76 HE2 LYS 8 HE2 LYS 8 9.011 0.334 -12.391 77 HE3 LYS 8 HE3 LYS 8 8.597 -0.270 -10.788 78 HZ1 LYS 8 HZ1 LYS 8 10.658 -1.126 -10.474 79 HZ2 LYS 8 HZ2 LYS 8 10.917 -1.449 -12.115 80 HZ3 LYS 8 HZ3 LYS 8 11.080 0.129 -11.527 81 H ILE 9 H ILE 9 8.078 -6.116 -8.783 82 HA ILE 9 HA ILE 9 10.697 -7.210 -9.145 83 HB ILE 9 HB ILE 9 8.639 -7.706 -6.992 84 HG12 ILE 9 HG12 ILE 9 11.198 -6.208 -6.605 85 HG13 ILE 9 HG13 ILE 9 9.850 -5.393 -7.391 86 HG21 ILE 9 HG21 ILE 9 9.908 -9.547 -6.649 87 HG22 ILE 9 HG22 ILE 9 11.304 -8.876 -7.493 88 HG23 ILE 9 HG23 ILE 9 10.957 -8.386 -5.835 89 HD11 ILE 9 HD11 ILE 9 8.897 -5.004 -5.439 90 HD12 ILE 9 HD12 ILE 9 8.934 -6.719 -5.028 91 HD13 ILE 9 HD13 ILE 9 10.317 -5.692 -4.651 92 H LEU 10 H LEU 10 7.411 -8.466 -9.297 93 HA LEU 10 HA LEU 10 8.080 -11.204 -9.450 94 HB2 LEU 10 HB2 LEU 10 5.873 -11.516 -9.554 95 HB3 LEU 10 HB3 LEU 10 5.767 -9.781 -9.262 96 HG LEU 10 HG LEU 10 5.841 -9.645 -11.879 97 HD11 LEU 10 HD11 LEU 10 4.302 -11.800 -12.470 98 HD12 LEU 10 HD12 LEU 10 6.031 -11.681 -12.798 99 HD13 LEU 10 HD13 LEU 10 5.464 -12.503 -11.344 100 HD21 LEU 10 HD21 LEU 10 3.863 -9.518 -9.959 101 HD22 LEU 10 HD22 LEU 10 3.712 -9.028 -11.646 102 HD23 LEU 10 HD23 LEU 10 3.214 -10.645 -11.149 103 H VAL 11 H VAL 11 8.023 -8.643 -11.805 104 HA VAL 11 HA VAL 11 8.338 -10.514 -14.024 105 HB VAL 11 HB VAL 11 8.257 -8.543 -15.472 106 HG11 VAL 11 HG11 VAL 11 6.029 -8.244 -13.486 107 HG12 VAL 11 HG12 VAL 11 5.974 -8.107 -15.243 108 HG13 VAL 11 HG13 VAL 11 6.180 -9.687 -14.488 109 HG21 VAL 11 HG21 VAL 11 9.396 -6.991 -13.919 110 HG22 VAL 11 HG22 VAL 11 7.909 -6.321 -14.590 111 HG23 VAL 11 HG23 VAL 11 7.932 -6.939 -12.938 Start of MODEL 8 1 H1 GLY 1 H GLY 1 0.896 -4.686 1.782 2 HA2 GLY 1 HA2 GLY 1 2.339 -2.891 1.742 3 HA3 GLY 1 HA3 GLY 1 3.346 -3.976 0.794 4 H PHE 2 H PHE 2 3.548 -3.672 -1.388 5 HA PHE 2 HA PHE 2 2.034 -1.438 -2.561 6 HB2 PHE 2 HB2 PHE 2 4.782 -1.433 -1.970 7 HB3 PHE 2 HB3 PHE 2 4.672 -1.657 -3.713 8 HD1 PHE 2 HD1 PHE 2 5.051 0.730 -1.294 9 HD2 PHE 2 HD2 PHE 2 2.711 -0.062 -4.761 10 HE1 PHE 2 HE1 PHE 2 4.653 3.142 -1.573 11 HE2 PHE 2 HE2 PHE 2 2.310 2.349 -5.045 12 HZ PHE 2 HZ PHE 2 3.282 3.954 -3.451 13 H ILE 3 H ILE 3 0.831 -2.223 -4.151 14 HA ILE 3 HA ILE 3 1.266 -4.718 -5.398 15 HB ILE 3 HB ILE 3 -0.460 -2.405 -6.288 16 HG12 ILE 3 HG12 ILE 3 -1.637 -4.875 -5.169 17 HG13 ILE 3 HG13 ILE 3 -0.737 -3.881 -4.029 18 HG21 ILE 3 HG21 ILE 3 -0.085 -3.779 -8.188 19 HG22 ILE 3 HG22 ILE 3 -0.308 -5.253 -7.247 20 HG23 ILE 3 HG23 ILE 3 -1.682 -4.194 -7.564 21 HD11 ILE 3 HD11 ILE 3 -2.985 -2.889 -5.763 22 HD12 ILE 3 HD12 ILE 3 -3.146 -3.381 -4.077 23 HD13 ILE 3 HD13 ILE 3 -2.144 -1.992 -4.499 24 H VAL 4 H VAL 4 2.172 -1.439 -6.246 25 HA VAL 4 HA VAL 4 2.921 -1.961 -8.931 26 HB VAL 4 HB VAL 4 3.892 0.212 -7.069 27 HG11 VAL 4 HG11 VAL 4 4.079 -0.059 -10.067 28 HG12 VAL 4 HG12 VAL 4 4.449 1.411 -9.165 29 HG13 VAL 4 HG13 VAL 4 5.417 -0.042 -8.917 30 HG21 VAL 4 HG21 VAL 4 1.909 1.175 -7.333 31 HG22 VAL 4 HG22 VAL 4 2.100 1.127 -9.086 32 HG23 VAL 4 HG23 VAL 4 1.355 -0.231 -8.243 33 H LYS 5 H LYS 5 4.952 -1.428 -6.043 34 HA LYS 5 HA LYS 5 7.393 -2.087 -7.182 35 HB2 LYS 5 HB2 LYS 5 8.254 -2.023 -5.053 36 HB3 LYS 5 HB3 LYS 5 6.738 -1.170 -4.797 37 HG2 LYS 5 HG2 LYS 5 5.733 -3.319 -4.044 38 HG3 LYS 5 HG3 LYS 5 7.336 -4.048 -4.153 39 HD2 LYS 5 HD2 LYS 5 7.040 -1.538 -2.585 40 HD3 LYS 5 HD3 LYS 5 6.415 -3.033 -1.886 41 HE2 LYS 5 HE2 LYS 5 9.200 -2.825 -2.994 42 HE3 LYS 5 HE3 LYS 5 8.821 -2.391 -1.328 43 HZ1 LYS 5 HZ1 LYS 5 8.569 -5.042 -2.620 44 HZ2 LYS 5 HZ2 LYS 5 9.511 -4.619 -1.280 45 HZ3 LYS 5 HZ3 LYS 5 7.826 -4.682 -1.143 46 H ARG 6 H ARG 6 4.869 -4.163 -5.920 47 HA ARG 6 HA ARG 6 6.375 -6.557 -5.828 48 HB2 ARG 6 HB2 ARG 6 3.569 -5.774 -5.567 49 HB3 ARG 6 HB3 ARG 6 3.778 -7.354 -6.309 50 HG2 ARG 6 HG2 ARG 6 3.503 -7.379 -3.829 51 HG3 ARG 6 HG3 ARG 6 4.962 -8.176 -4.420 52 HD2 ARG 6 HD2 ARG 6 6.301 -6.747 -3.344 53 HD3 ARG 6 HD3 ARG 6 5.367 -5.348 -3.875 54 HE ARG 6 HE ARG 6 4.388 -5.318 -1.821 55 HH11 ARG 6 HH11 ARG 6 5.583 -8.532 -2.419 56 HH12 ARG 6 HH12 ARG 6 5.152 -9.125 -0.849 57 HH21 ARG 6 HH21 ARG 6 3.816 -6.086 0.249 58 HH22 ARG 6 HH22 ARG 6 4.146 -7.733 0.667 59 H PHE 7 H PHE 7 4.006 -5.404 -8.234 60 HA PHE 7 HA PHE 7 4.263 -7.436 -10.082 61 HB2 PHE 7 HB2 PHE 7 2.760 -5.251 -10.016 62 HB3 PHE 7 HB3 PHE 7 4.009 -4.640 -11.096 63 HD1 PHE 7 HD1 PHE 7 1.962 -7.735 -10.679 64 HD2 PHE 7 HD2 PHE 7 3.607 -4.847 -13.338 65 HE1 PHE 7 HE1 PHE 7 0.866 -8.860 -12.573 66 HE2 PHE 7 HE2 PHE 7 2.513 -5.967 -15.236 67 HZ PHE 7 HZ PHE 7 1.140 -7.975 -14.855 68 H LYS 8 H LYS 8 6.257 -4.547 -9.688 69 HA LYS 8 HA LYS 8 7.852 -4.940 -11.992 70 HB2 LYS 8 HB2 LYS 8 8.170 -3.345 -9.469 71 HB3 LYS 8 HB3 LYS 8 9.500 -3.467 -10.615 72 HG2 LYS 8 HG2 LYS 8 7.815 -2.679 -12.371 73 HG3 LYS 8 HG3 LYS 8 6.804 -2.218 -10.999 74 HD2 LYS 8 HD2 LYS 8 8.866 -0.960 -10.145 75 HD3 LYS 8 HD3 LYS 8 9.510 -1.169 -11.776 76 HE2 LYS 8 HE2 LYS 8 6.829 0.073 -11.189 77 HE3 LYS 8 HE3 LYS 8 8.317 1.005 -11.353 78 HZ1 LYS 8 HZ1 LYS 8 8.435 0.601 -13.582 79 HZ2 LYS 8 HZ2 LYS 8 7.585 -0.860 -13.495 80 HZ3 LYS 8 HZ3 LYS 8 6.754 0.611 -13.389 81 H ILE 9 H ILE 9 8.116 -6.042 -8.661 82 HA ILE 9 HA ILE 9 10.747 -7.107 -8.917 83 HB ILE 9 HB ILE 9 8.560 -7.645 -6.911 84 HG12 ILE 9 HG12 ILE 9 11.175 -6.303 -6.338 85 HG13 ILE 9 HG13 ILE 9 9.897 -5.389 -7.131 86 HG21 ILE 9 HG21 ILE 9 9.896 -9.623 -6.990 87 HG22 ILE 9 HG22 ILE 9 11.387 -8.681 -6.995 88 HG23 ILE 9 HG23 ILE 9 10.369 -8.712 -5.556 89 HD11 ILE 9 HD11 ILE 9 9.849 -6.660 -4.414 90 HD12 ILE 9 HD12 ILE 9 9.713 -4.950 -4.826 91 HD13 ILE 9 HD13 ILE 9 8.401 -6.060 -5.222 92 H LEU 10 H LEU 10 7.520 -8.616 -8.882 93 HA LEU 10 HA LEU 10 8.254 -11.252 -9.226 94 HB2 LEU 10 HB2 LEU 10 5.867 -9.655 -10.013 95 HB3 LEU 10 HB3 LEU 10 6.020 -11.303 -10.619 96 HG LEU 10 HG LEU 10 6.228 -12.047 -8.219 97 HD11 LEU 10 HD11 LEU 10 5.186 -9.281 -7.634 98 HD12 LEU 10 HD12 LEU 10 5.510 -10.571 -6.476 99 HD13 LEU 10 HD13 LEU 10 6.844 -9.806 -7.338 100 HD21 LEU 10 HD21 LEU 10 4.147 -12.618 -8.799 101 HD22 LEU 10 HD22 LEU 10 3.642 -11.185 -7.903 102 HD23 LEU 10 HD23 LEU 10 3.871 -11.098 -9.649 103 H VAL 11 H VAL 11 7.626 -8.829 -11.753 104 HA VAL 11 HA VAL 11 8.255 -10.577 -13.910 105 HB VAL 11 HB VAL 11 8.183 -8.626 -15.328 106 HG11 VAL 11 HG11 VAL 11 6.111 -9.369 -13.526 107 HG12 VAL 11 HG12 VAL 11 6.018 -7.629 -13.799 108 HG13 VAL 11 HG13 VAL 11 5.973 -8.740 -15.168 109 HG21 VAL 11 HG21 VAL 11 9.485 -7.077 -14.022 110 HG22 VAL 11 HG22 VAL 11 7.907 -6.361 -14.352 111 HG23 VAL 11 HG23 VAL 11 8.251 -7.042 -12.762 Start of MODEL 9 1 H1 GLY 1 H GLY 1 0.996 1.348 0.298 2 HA2 GLY 1 HA2 GLY 1 -0.138 -0.491 -0.476 3 HA3 GLY 1 HA3 GLY 1 0.579 -0.141 -2.042 4 H PHE 2 H PHE 2 1.364 -1.997 -2.799 5 HA PHE 2 HA PHE 2 3.627 -3.217 -1.682 6 HB2 PHE 2 HB2 PHE 2 1.500 -3.996 -0.235 7 HB3 PHE 2 HB3 PHE 2 1.419 -5.194 -1.522 8 HD1 PHE 2 HD1 PHE 2 4.087 -3.627 0.571 9 HD2 PHE 2 HD2 PHE 2 2.406 -7.195 -1.030 10 HE1 PHE 2 HE1 PHE 2 5.827 -4.949 1.700 11 HE2 PHE 2 HE2 PHE 2 4.143 -8.523 0.098 12 HZ PHE 2 HZ PHE 2 5.857 -7.401 1.466 13 H ILE 3 H ILE 3 0.754 -3.663 -3.678 14 HA ILE 3 HA ILE 3 1.613 -5.678 -5.365 15 HB ILE 3 HB ILE 3 -0.068 -3.272 -6.074 16 HG12 ILE 3 HG12 ILE 3 -1.272 -5.947 -5.707 17 HG13 ILE 3 HG13 ILE 3 -0.643 -5.193 -4.246 18 HG21 ILE 3 HG21 ILE 3 0.691 -4.195 -8.115 19 HG22 ILE 3 HG22 ILE 3 0.446 -5.845 -7.543 20 HG23 ILE 3 HG23 ILE 3 -0.944 -4.812 -7.874 21 HD11 ILE 3 HD11 ILE 3 -3.041 -4.757 -4.654 22 HD12 ILE 3 HD12 ILE 3 -2.065 -3.292 -4.551 23 HD13 ILE 3 HD13 ILE 3 -2.597 -3.889 -6.123 24 H VAL 4 H VAL 4 2.212 -2.192 -5.595 25 HA VAL 4 HA VAL 4 3.461 -2.072 -8.057 26 HB VAL 4 HB VAL 4 4.178 -0.498 -5.579 27 HG11 VAL 4 HG11 VAL 4 5.924 -0.324 -7.247 28 HG12 VAL 4 HG12 VAL 4 4.733 0.055 -8.491 29 HG13 VAL 4 HG13 VAL 4 5.019 1.187 -7.170 30 HG21 VAL 4 HG21 VAL 4 2.579 1.102 -6.242 31 HG22 VAL 4 HG22 VAL 4 2.369 0.352 -7.824 32 HG23 VAL 4 HG23 VAL 4 1.768 -0.458 -6.378 33 H LYS 5 H LYS 5 4.852 -2.900 -4.908 34 HA LYS 5 HA LYS 5 7.527 -3.129 -5.827 35 HB2 LYS 5 HB2 LYS 5 6.044 -3.686 -3.356 36 HB3 LYS 5 HB3 LYS 5 7.400 -4.772 -3.630 37 HG2 LYS 5 HG2 LYS 5 8.737 -3.221 -2.796 38 HG3 LYS 5 HG3 LYS 5 8.362 -2.203 -4.188 39 HD2 LYS 5 HD2 LYS 5 6.171 -1.842 -2.577 40 HD3 LYS 5 HD3 LYS 5 7.486 -1.985 -1.407 41 HE2 LYS 5 HE2 LYS 5 8.563 -0.338 -3.314 42 HE3 LYS 5 HE3 LYS 5 6.872 0.158 -3.299 43 HZ1 LYS 5 HZ1 LYS 5 8.369 -0.139 -0.776 44 HZ2 LYS 5 HZ2 LYS 5 8.495 1.282 -1.687 45 HZ3 LYS 5 HZ3 LYS 5 6.990 0.790 -1.091 46 H ARG 6 H ARG 6 5.121 -5.627 -4.986 47 HA ARG 6 HA ARG 6 6.563 -7.860 -5.725 48 HB2 ARG 6 HB2 ARG 6 3.589 -7.403 -6.024 49 HB3 ARG 6 HB3 ARG 6 4.382 -8.973 -6.060 50 HG2 ARG 6 HG2 ARG 6 5.294 -8.112 -3.710 51 HG3 ARG 6 HG3 ARG 6 3.786 -7.196 -3.774 52 HD2 ARG 6 HD2 ARG 6 2.553 -9.016 -3.384 53 HD3 ARG 6 HD3 ARG 6 3.437 -9.965 -4.578 54 HE ARG 6 HE ARG 6 5.003 -9.628 -2.252 55 HH11 ARG 6 HH11 ARG 6 2.217 -11.345 -3.438 56 HH12 ARG 6 HH12 ARG 6 2.412 -12.678 -2.349 57 HH21 ARG 6 HH21 ARG 6 5.271 -11.376 -0.813 58 HH22 ARG 6 HH22 ARG 6 4.149 -12.694 -0.855 59 H PHE 7 H PHE 7 4.289 -6.019 -7.762 60 HA PHE 7 HA PHE 7 4.558 -7.442 -10.108 61 HB2 PHE 7 HB2 PHE 7 3.113 -5.317 -9.458 62 HB3 PHE 7 HB3 PHE 7 4.417 -4.465 -10.280 63 HD1 PHE 7 HD1 PHE 7 2.224 -7.438 -10.815 64 HD2 PHE 7 HD2 PHE 7 4.146 -4.041 -12.513 65 HE1 PHE 7 HE1 PHE 7 1.169 -7.930 -12.983 66 HE2 PHE 7 HE2 PHE 7 3.094 -4.527 -14.684 67 HZ PHE 7 HZ PHE 7 1.603 -6.473 -14.921 68 H LYS 8 H LYS 8 6.412 -4.543 -9.175 69 HA LYS 8 HA LYS 8 8.120 -4.405 -11.333 70 HB2 LYS 8 HB2 LYS 8 8.411 -3.642 -8.450 71 HB3 LYS 8 HB3 LYS 8 9.787 -3.486 -9.534 72 HG2 LYS 8 HG2 LYS 8 8.602 -1.951 -10.930 73 HG3 LYS 8 HG3 LYS 8 7.102 -2.226 -10.040 74 HD2 LYS 8 HD2 LYS 8 7.845 -0.235 -9.129 75 HD3 LYS 8 HD3 LYS 8 8.486 -1.420 -7.989 76 HE2 LYS 8 HE2 LYS 8 10.182 0.227 -8.527 77 HE3 LYS 8 HE3 LYS 8 10.646 -1.353 -9.158 78 HZ1 LYS 8 HZ1 LYS 8 10.961 0.614 -10.685 79 HZ2 LYS 8 HZ2 LYS 8 10.122 -0.704 -11.334 80 HZ3 LYS 8 HZ3 LYS 8 9.276 0.671 -10.828 81 H ILE 9 H ILE 9 8.232 -6.555 -8.575 82 HA ILE 9 HA ILE 9 10.859 -7.565 -9.217 83 HB ILE 9 HB ILE 9 8.788 -8.513 -7.236 84 HG12 ILE 9 HG12 ILE 9 11.468 -7.291 -6.627 85 HG13 ILE 9 HG13 ILE 9 10.063 -6.279 -6.942 86 HG21 ILE 9 HG21 ILE 9 11.238 -9.769 -8.204 87 HG22 ILE 9 HG22 ILE 9 11.181 -9.590 -6.450 88 HG23 ILE 9 HG23 ILE 9 9.894 -10.456 -7.290 89 HD11 ILE 9 HD11 ILE 9 8.975 -7.817 -5.106 90 HD12 ILE 9 HD12 ILE 9 10.660 -8.037 -4.632 91 HD13 ILE 9 HD13 ILE 9 9.960 -6.418 -4.677 92 H LEU 10 H LEU 10 7.533 -8.446 -9.820 93 HA LEU 10 HA LEU 10 8.082 -11.105 -10.709 94 HB2 LEU 10 HB2 LEU 10 5.893 -11.163 -10.338 95 HB3 LEU 10 HB3 LEU 10 5.780 -9.404 -10.356 96 HG LEU 10 HG LEU 10 5.683 -9.555 -12.874 97 HD11 LEU 10 HD11 LEU 10 4.701 -12.304 -12.766 98 HD12 LEU 10 HD12 LEU 10 5.721 -11.506 -13.963 99 HD13 LEU 10 HD13 LEU 10 6.436 -12.151 -12.486 100 HD21 LEU 10 HD21 LEU 10 3.275 -10.756 -12.609 101 HD22 LEU 10 HD22 LEU 10 3.624 -10.349 -10.930 102 HD23 LEU 10 HD23 LEU 10 3.603 -9.084 -12.158 103 H VAL 11 H VAL 11 7.684 -7.975 -12.289 104 HA VAL 11 HA VAL 11 7.647 -8.854 -14.948 105 HB VAL 11 HB VAL 11 8.273 -6.606 -15.579 106 HG11 VAL 11 HG11 VAL 11 6.667 -5.926 -13.214 107 HG12 VAL 11 HG12 VAL 11 6.325 -5.689 -14.928 108 HG13 VAL 11 HG13 VAL 11 6.046 -7.263 -14.182 109 HG21 VAL 11 HG21 VAL 11 9.726 -5.414 -14.397 110 HG22 VAL 11 HG22 VAL 11 8.588 -5.334 -13.053 111 HG23 VAL 11 HG23 VAL 11 9.739 -6.666 -13.155 Start of MODEL 10 1 H1 GLY 1 H GLY 1 5.327 -2.845 1.624 2 HA2 GLY 1 HA2 GLY 1 4.664 -1.400 -0.153 3 HA3 GLY 1 HA3 GLY 1 5.241 -2.856 -0.950 4 H PHE 2 H PHE 2 3.746 -1.837 -2.619 5 HA PHE 2 HA PHE 2 1.009 -2.847 -2.200 6 HB2 PHE 2 HB2 PHE 2 0.615 -1.097 -4.186 7 HB3 PHE 2 HB3 PHE 2 0.537 -0.631 -2.490 8 HD1 PHE 2 HD1 PHE 2 2.834 -0.780 -5.401 9 HD2 PHE 2 HD2 PHE 2 1.931 1.032 -1.657 10 HE1 PHE 2 HE1 PHE 2 4.606 0.884 -5.782 11 HE2 PHE 2 HE2 PHE 2 3.701 2.699 -2.033 12 HZ PHE 2 HZ PHE 2 5.041 2.627 -4.098 13 H ILE 3 H ILE 3 -0.063 -3.042 -4.547 14 HA ILE 3 HA ILE 3 0.963 -5.300 -5.741 15 HB ILE 3 HB ILE 3 -0.735 -3.163 -7.033 16 HG12 ILE 3 HG12 ILE 3 -1.887 -5.748 -6.177 17 HG13 ILE 3 HG13 ILE 3 -1.371 -4.681 -4.876 18 HG21 ILE 3 HG21 ILE 3 0.175 -4.462 -8.788 19 HG22 ILE 3 HG22 ILE 3 -0.062 -5.965 -7.895 20 HG23 ILE 3 HG23 ILE 3 -1.455 -5.078 -8.514 21 HD11 ILE 3 HD11 ILE 3 -3.755 -4.446 -5.516 22 HD12 ILE 3 HD12 ILE 3 -2.828 -2.950 -5.634 23 HD13 ILE 3 HD13 ILE 3 -3.227 -3.858 -7.093 24 H VAL 4 H VAL 4 1.299 -1.945 -6.897 25 HA VAL 4 HA VAL 4 2.808 -2.383 -9.158 26 HB VAL 4 HB VAL 4 3.233 -0.095 -7.232 27 HG11 VAL 4 HG11 VAL 4 3.578 1.019 -9.601 28 HG12 VAL 4 HG12 VAL 4 4.898 0.194 -8.772 29 HG13 VAL 4 HG13 VAL 4 4.008 -0.630 -10.053 30 HG21 VAL 4 HG21 VAL 4 1.085 -0.633 -9.246 31 HG22 VAL 4 HG22 VAL 4 0.944 -0.023 -7.597 32 HG23 VAL 4 HG23 VAL 4 1.568 1.022 -8.874 33 H LYS 5 H LYS 5 3.828 -2.399 -5.802 34 HA LYS 5 HA LYS 5 6.627 -2.404 -6.323 35 HB2 LYS 5 HB2 LYS 5 4.945 -2.330 -4.046 36 HB3 LYS 5 HB3 LYS 5 6.002 -3.722 -3.852 37 HG2 LYS 5 HG2 LYS 5 7.613 -2.374 -3.167 38 HG3 LYS 5 HG3 LYS 5 7.615 -1.594 -4.750 39 HD2 LYS 5 HD2 LYS 5 6.360 0.172 -4.032 40 HD3 LYS 5 HD3 LYS 5 5.505 -0.788 -2.822 41 HE2 LYS 5 HE2 LYS 5 7.145 -0.511 -1.247 42 HE3 LYS 5 HE3 LYS 5 8.419 -0.316 -2.451 43 HZ1 LYS 5 HZ1 LYS 5 7.832 1.741 -1.206 44 HZ2 LYS 5 HZ2 LYS 5 7.715 1.893 -2.887 45 HZ3 LYS 5 HZ3 LYS 5 6.315 1.715 -1.954 46 H ARG 6 H ARG 6 4.431 -5.006 -5.248 47 HA ARG 6 HA ARG 6 6.256 -7.100 -5.457 48 HB2 ARG 6 HB2 ARG 6 3.251 -7.034 -5.695 49 HB3 ARG 6 HB3 ARG 6 4.166 -8.535 -5.749 50 HG2 ARG 6 HG2 ARG 6 5.016 -7.037 -3.483 51 HG3 ARG 6 HG3 ARG 6 3.252 -7.117 -3.488 52 HD2 ARG 6 HD2 ARG 6 3.216 -9.378 -3.216 53 HD3 ARG 6 HD3 ARG 6 4.732 -9.615 -4.085 54 HE ARG 6 HE ARG 6 5.207 -8.276 -1.643 55 HH11 ARG 6 HH11 ARG 6 4.386 -11.406 -2.927 56 HH12 ARG 6 HH12 ARG 6 5.100 -12.278 -1.611 57 HH21 ARG 6 HH21 ARG 6 6.151 -9.412 0.095 58 HH22 ARG 6 HH22 ARG 6 6.103 -11.143 0.108 59 H PHE 7 H PHE 7 3.831 -6.024 -7.835 60 HA PHE 7 HA PHE 7 4.361 -7.829 -9.852 61 HB2 PHE 7 HB2 PHE 7 2.637 -5.823 -9.646 62 HB3 PHE 7 HB3 PHE 7 3.849 -4.989 -10.613 63 HD1 PHE 7 HD1 PHE 7 1.681 -7.992 -10.527 64 HD2 PHE 7 HD2 PHE 7 3.985 -5.329 -12.919 65 HE1 PHE 7 HE1 PHE 7 0.768 -9.034 -12.560 66 HE2 PHE 7 HE2 PHE 7 3.075 -6.367 -14.956 67 HZ PHE 7 HZ PHE 7 1.464 -8.221 -14.778 68 H LYS 8 H LYS 8 5.763 -4.562 -9.553 69 HA LYS 8 HA LYS 8 7.534 -4.665 -11.662 70 HB2 LYS 8 HB2 LYS 8 7.574 -3.238 -9.029 71 HB3 LYS 8 HB3 LYS 8 8.974 -3.137 -10.089 72 HG2 LYS 8 HG2 LYS 8 6.335 -2.587 -11.305 73 HG3 LYS 8 HG3 LYS 8 6.966 -1.392 -10.169 74 HD2 LYS 8 HD2 LYS 8 9.139 -2.028 -11.778 75 HD3 LYS 8 HD3 LYS 8 7.772 -1.969 -12.894 76 HE2 LYS 8 HE2 LYS 8 7.177 0.252 -11.875 77 HE3 LYS 8 HE3 LYS 8 8.715 0.189 -11.015 78 HZ1 LYS 8 HZ1 LYS 8 9.220 1.391 -12.902 79 HZ2 LYS 8 HZ2 LYS 8 9.691 -0.170 -13.353 80 HZ3 LYS 8 HZ3 LYS 8 8.223 0.464 -13.907 81 H ILE 9 H ILE 9 7.866 -6.026 -8.440 82 HA ILE 9 HA ILE 9 10.619 -6.741 -8.739 83 HB ILE 9 HB ILE 9 8.543 -7.742 -6.788 84 HG12 ILE 9 HG12 ILE 9 10.815 -5.924 -6.091 85 HG13 ILE 9 HG13 ILE 9 9.393 -5.245 -6.875 86 HG21 ILE 9 HG21 ILE 9 10.475 -8.535 -5.470 87 HG22 ILE 9 HG22 ILE 9 10.310 -9.373 -7.013 88 HG23 ILE 9 HG23 ILE 9 11.534 -8.118 -6.817 89 HD11 ILE 9 HD11 ILE 9 9.511 -6.694 -4.245 90 HD12 ILE 9 HD12 ILE 9 9.144 -4.991 -4.524 91 HD13 ILE 9 HD13 ILE 9 8.013 -6.236 -5.055 92 H LEU 10 H LEU 10 7.538 -8.380 -9.221 93 HA LEU 10 HA LEU 10 8.568 -10.979 -9.602 94 HB2 LEU 10 HB2 LEU 10 6.430 -11.553 -9.881 95 HB3 LEU 10 HB3 LEU 10 6.082 -9.886 -9.425 96 HG LEU 10 HG LEU 10 6.272 -9.461 -12.004 97 HD11 LEU 10 HD11 LEU 10 5.057 -11.727 -12.893 98 HD12 LEU 10 HD12 LEU 10 6.762 -11.341 -13.119 99 HD13 LEU 10 HD13 LEU 10 6.263 -12.381 -11.785 100 HD21 LEU 10 HD21 LEU 10 4.070 -9.146 -11.850 101 HD22 LEU 10 HD22 LEU 10 3.765 -10.856 -11.548 102 HD23 LEU 10 HD23 LEU 10 4.199 -9.789 -10.213 103 H VAL 11 H VAL 11 8.298 -8.210 -11.692 104 HA VAL 11 HA VAL 11 8.949 -9.773 -14.066 105 HB VAL 11 HB VAL 11 8.752 -7.644 -15.285 106 HG11 VAL 11 HG11 VAL 11 6.306 -7.625 -13.631 107 HG12 VAL 11 HG12 VAL 11 6.495 -7.761 -15.379 108 HG13 VAL 11 HG13 VAL 11 6.754 -9.171 -14.352 109 HG21 VAL 11 HG21 VAL 11 7.919 -6.399 -12.674 110 HG22 VAL 11 HG22 VAL 11 9.544 -6.245 -13.342 111 HG23 VAL 11 HG23 VAL 11 8.161 -5.603 -14.229 Start of MODEL 11 1 H1 GLY 1 H GLY 1 2.231 -4.310 0.794 2 HA2 GLY 1 HA2 GLY 1 -0.147 -3.422 0.124 3 HA3 GLY 1 HA3 GLY 1 0.306 -2.152 1.250 4 H PHE 2 H PHE 2 2.196 -3.893 -1.208 5 HA PHE 2 HA PHE 2 2.535 -1.369 -2.662 6 HB2 PHE 2 HB2 PHE 2 5.017 -2.504 -2.920 7 HB3 PHE 2 HB3 PHE 2 4.614 -1.203 -1.805 8 HD1 PHE 2 HD1 PHE 2 4.438 -4.928 -1.959 9 HD2 PHE 2 HD2 PHE 2 5.246 -1.465 0.380 10 HE1 PHE 2 HE1 PHE 2 5.079 -6.361 -0.064 11 HE2 PHE 2 HE2 PHE 2 5.889 -2.892 2.278 12 HZ PHE 2 HZ PHE 2 5.808 -5.344 2.057 13 H ILE 3 H ILE 3 1.251 -2.094 -4.338 14 HA ILE 3 HA ILE 3 1.651 -4.648 -5.575 15 HB ILE 3 HB ILE 3 0.120 -2.246 -6.580 16 HG12 ILE 3 HG12 ILE 3 -0.814 -4.717 -5.103 17 HG13 ILE 3 HG13 ILE 3 -0.733 -3.089 -4.439 18 HG21 ILE 3 HG21 ILE 3 0.847 -4.654 -7.881 19 HG22 ILE 3 HG22 ILE 3 -0.885 -4.718 -7.556 20 HG23 ILE 3 HG23 ILE 3 -0.208 -3.367 -8.465 21 HD11 ILE 3 HD11 ILE 3 -2.954 -3.277 -4.969 22 HD12 ILE 3 HD12 ILE 3 -2.313 -2.504 -6.419 23 HD13 ILE 3 HD13 ILE 3 -2.641 -4.237 -6.415 24 H VAL 4 H VAL 4 2.267 -1.292 -6.606 25 HA VAL 4 HA VAL 4 3.420 -1.764 -9.060 26 HB VAL 4 HB VAL 4 4.355 0.327 -7.090 27 HG11 VAL 4 HG11 VAL 4 4.511 1.487 -9.511 28 HG12 VAL 4 HG12 VAL 4 5.852 0.624 -8.756 29 HG13 VAL 4 HG13 VAL 4 4.844 -0.188 -9.954 30 HG21 VAL 4 HG21 VAL 4 2.687 1.779 -8.304 31 HG22 VAL 4 HG22 VAL 4 2.019 0.298 -8.990 32 HG23 VAL 4 HG23 VAL 4 1.998 0.550 -7.244 33 H LYS 5 H LYS 5 4.948 -1.878 -5.871 34 HA LYS 5 HA LYS 5 7.580 -2.339 -6.834 35 HB2 LYS 5 HB2 LYS 5 6.323 -1.961 -4.318 36 HB3 LYS 5 HB3 LYS 5 7.217 -3.473 -4.231 37 HG2 LYS 5 HG2 LYS 5 8.698 -1.266 -5.459 38 HG3 LYS 5 HG3 LYS 5 8.263 -1.011 -3.767 39 HD2 LYS 5 HD2 LYS 5 9.612 -2.683 -3.029 40 HD3 LYS 5 HD3 LYS 5 9.364 -3.666 -4.474 41 HE2 LYS 5 HE2 LYS 5 10.714 -1.428 -5.397 42 HE3 LYS 5 HE3 LYS 5 11.477 -1.778 -3.847 43 HZ1 LYS 5 HZ1 LYS 5 11.044 -4.124 -5.439 44 HZ2 LYS 5 HZ2 LYS 5 12.047 -2.997 -6.204 45 HZ3 LYS 5 HZ3 LYS 5 12.452 -3.586 -4.671 46 H ARG 6 H ARG 6 5.240 -4.546 -5.287 47 HA ARG 6 HA ARG 6 6.640 -6.904 -5.576 48 HB2 ARG 6 HB2 ARG 6 3.871 -6.140 -5.111 49 HB3 ARG 6 HB3 ARG 6 3.995 -7.639 -6.023 50 HG2 ARG 6 HG2 ARG 6 3.856 -7.969 -3.577 51 HG3 ARG 6 HG3 ARG 6 5.316 -8.650 -4.298 52 HD2 ARG 6 HD2 ARG 6 5.749 -5.916 -3.501 53 HD3 ARG 6 HD3 ARG 6 5.148 -6.871 -2.146 54 HE ARG 6 HE ARG 6 7.107 -8.423 -3.196 55 HH11 ARG 6 HH11 ARG 6 6.967 -5.113 -2.127 56 HH12 ARG 6 HH12 ARG 6 8.629 -5.062 -1.641 57 HH21 ARG 6 HH21 ARG 6 9.297 -8.369 -2.560 58 HH22 ARG 6 HH22 ARG 6 9.954 -6.915 -1.889 59 H PHE 7 H PHE 7 4.200 -5.605 -7.831 60 HA PHE 7 HA PHE 7 4.354 -7.532 -9.793 61 HB2 PHE 7 HB2 PHE 7 2.911 -5.320 -9.564 62 HB3 PHE 7 HB3 PHE 7 4.143 -4.680 -10.647 63 HD1 PHE 7 HD1 PHE 7 2.071 -7.773 -10.346 64 HD2 PHE 7 HD2 PHE 7 3.632 -4.725 -12.874 65 HE1 PHE 7 HE1 PHE 7 0.892 -8.765 -12.265 66 HE2 PHE 7 HE2 PHE 7 2.455 -5.711 -14.796 67 HZ PHE 7 HZ PHE 7 1.082 -7.733 -14.493 68 H LYS 8 H LYS 8 6.191 -4.476 -9.716 69 HA LYS 8 HA LYS 8 7.763 -4.871 -11.948 70 HB2 LYS 8 HB2 LYS 8 8.190 -3.386 -9.382 71 HB3 LYS 8 HB3 LYS 8 9.505 -3.501 -10.544 72 HG2 LYS 8 HG2 LYS 8 6.865 -2.637 -11.569 73 HG3 LYS 8 HG3 LYS 8 7.757 -1.504 -10.550 74 HD2 LYS 8 HD2 LYS 8 9.717 -2.358 -12.224 75 HD3 LYS 8 HD3 LYS 8 8.308 -2.432 -13.286 76 HE2 LYS 8 HE2 LYS 8 7.993 -0.019 -12.006 77 HE3 LYS 8 HE3 LYS 8 9.740 -0.123 -12.220 78 HZ1 LYS 8 HZ1 LYS 8 8.028 -0.776 -14.504 79 HZ2 LYS 8 HZ2 LYS 8 8.197 0.853 -14.081 80 HZ3 LYS 8 HZ3 LYS 8 9.563 -0.064 -14.475 81 H ILE 9 H ILE 9 8.142 -6.188 -8.717 82 HA ILE 9 HA ILE 9 10.760 -7.240 -9.134 83 HB ILE 9 HB ILE 9 8.658 -7.995 -7.102 84 HG12 ILE 9 HG12 ILE 9 11.156 -6.474 -6.482 85 HG13 ILE 9 HG13 ILE 9 9.812 -5.619 -7.232 86 HG21 ILE 9 HG21 ILE 9 11.578 -8.731 -7.253 87 HG22 ILE 9 HG22 ILE 9 10.534 -9.016 -5.859 88 HG23 ILE 9 HG23 ILE 9 10.202 -9.826 -7.390 89 HD11 ILE 9 HD11 ILE 9 9.450 -7.259 -4.753 90 HD12 ILE 9 HD12 ILE 9 9.972 -5.575 -4.698 91 HD13 ILE 9 HD13 ILE 9 8.410 -5.991 -5.403 92 H LEU 10 H LEU 10 7.540 -8.767 -9.023 93 HA LEU 10 HA LEU 10 8.273 -11.362 -9.608 94 HB2 LEU 10 HB2 LEU 10 5.821 -9.745 -10.088 95 HB3 LEU 10 HB3 LEU 10 5.942 -11.332 -10.845 96 HG LEU 10 HG LEU 10 6.348 -12.264 -8.528 97 HD11 LEU 10 HD11 LEU 10 5.309 -9.562 -7.688 98 HD12 LEU 10 HD12 LEU 10 5.652 -10.935 -6.637 99 HD13 LEU 10 HD13 LEU 10 6.968 -10.120 -7.481 100 HD21 LEU 10 HD21 LEU 10 3.881 -11.302 -9.738 101 HD22 LEU 10 HD22 LEU 10 4.249 -12.860 -8.999 102 HD23 LEU 10 HD23 LEU 10 3.760 -11.499 -7.990 103 H VAL 11 H VAL 11 7.435 -8.773 -11.899 104 HA VAL 11 HA VAL 11 7.995 -10.378 -14.202 105 HB VAL 11 HB VAL 11 6.403 -8.588 -14.422 106 HG11 VAL 11 HG11 VAL 11 6.650 -6.621 -13.421 107 HG12 VAL 11 HG12 VAL 11 8.225 -7.150 -12.830 108 HG13 VAL 11 HG13 VAL 11 8.103 -6.286 -14.363 109 HG21 VAL 11 HG21 VAL 11 7.197 -7.547 -16.420 110 HG22 VAL 11 HG22 VAL 11 8.878 -7.780 -15.940 111 HG23 VAL 11 HG23 VAL 11 7.879 -9.172 -16.358 Start of MODEL 12 1 H1 GLY 1 H GLY 1 2.970 1.358 -1.457 2 HA2 GLY 1 HA2 GLY 1 0.724 -0.327 -0.532 3 HA3 GLY 1 HA3 GLY 1 1.020 -0.012 -2.236 4 H PHE 2 H PHE 2 0.898 -2.508 -1.957 5 HA PHE 2 HA PHE 2 3.655 -3.486 -1.608 6 HB2 PHE 2 HB2 PHE 2 2.500 -5.729 -1.089 7 HB3 PHE 2 HB3 PHE 2 2.483 -4.491 0.163 8 HD1 PHE 2 HD1 PHE 2 0.493 -6.454 -2.150 9 HD2 PHE 2 HD2 PHE 2 0.423 -3.255 0.658 10 HE1 PHE 2 HE1 PHE 2 -1.961 -6.605 -2.044 11 HE2 PHE 2 HE2 PHE 2 -2.030 -3.401 0.769 12 HZ PHE 2 HZ PHE 2 -3.225 -5.078 -0.582 13 H ILE 3 H ILE 3 0.634 -3.751 -3.394 14 HA ILE 3 HA ILE 3 1.238 -5.774 -5.172 15 HB ILE 3 HB ILE 3 -0.299 -3.235 -5.732 16 HG12 ILE 3 HG12 ILE 3 -1.675 -5.821 -5.334 17 HG13 ILE 3 HG13 ILE 3 -0.902 -5.148 -3.903 18 HG21 ILE 3 HG21 ILE 3 -0.093 -5.814 -7.269 19 HG22 ILE 3 HG22 ILE 3 -1.394 -4.647 -7.504 20 HG23 ILE 3 HG23 ILE 3 0.276 -4.182 -7.829 21 HD11 ILE 3 HD11 ILE 3 -2.861 -3.657 -5.629 22 HD12 ILE 3 HD12 ILE 3 -3.284 -4.528 -4.155 23 HD13 ILE 3 HD13 ILE 3 -2.194 -3.144 -4.079 24 H VAL 4 H VAL 4 2.093 -2.342 -5.369 25 HA VAL 4 HA VAL 4 3.210 -2.303 -7.913 26 HB VAL 4 HB VAL 4 4.118 -0.737 -5.494 27 HG11 VAL 4 HG11 VAL 4 5.786 -0.169 -6.896 28 HG12 VAL 4 HG12 VAL 4 4.909 -0.708 -8.327 29 HG13 VAL 4 HG13 VAL 4 4.561 0.871 -7.623 30 HG21 VAL 4 HG21 VAL 4 2.247 0.451 -5.661 31 HG22 VAL 4 HG22 VAL 4 2.545 0.746 -7.374 32 HG23 VAL 4 HG23 VAL 4 1.664 -0.695 -6.867 33 H LYS 5 H LYS 5 4.864 -2.841 -4.802 34 HA LYS 5 HA LYS 5 7.419 -3.291 -5.809 35 HB2 LYS 5 HB2 LYS 5 6.141 -4.541 -3.369 36 HB3 LYS 5 HB3 LYS 5 7.868 -4.461 -3.693 37 HG2 LYS 5 HG2 LYS 5 6.388 -1.901 -3.697 38 HG3 LYS 5 HG3 LYS 5 6.601 -2.708 -2.141 39 HD2 LYS 5 HD2 LYS 5 8.768 -2.171 -2.055 40 HD3 LYS 5 HD3 LYS 5 9.041 -2.688 -3.721 41 HE2 LYS 5 HE2 LYS 5 8.910 -0.594 -4.506 42 HE3 LYS 5 HE3 LYS 5 7.508 -0.213 -3.508 43 HZ1 LYS 5 HZ1 LYS 5 9.974 -0.465 -2.035 44 HZ2 LYS 5 HZ2 LYS 5 9.971 0.807 -3.151 45 HZ3 LYS 5 HZ3 LYS 5 8.780 0.731 -1.951 46 H ARG 6 H ARG 6 4.714 -5.516 -5.383 47 HA ARG 6 HA ARG 6 6.112 -7.892 -5.975 48 HB2 ARG 6 HB2 ARG 6 3.185 -7.305 -6.452 49 HB3 ARG 6 HB3 ARG 6 3.924 -8.894 -6.309 50 HG2 ARG 6 HG2 ARG 6 4.559 -7.356 -3.990 51 HG3 ARG 6 HG3 ARG 6 2.819 -7.299 -4.274 52 HD2 ARG 6 HD2 ARG 6 2.552 -9.542 -3.947 53 HD3 ARG 6 HD3 ARG 6 4.175 -9.928 -4.519 54 HE ARG 6 HE ARG 6 4.321 -8.503 -2.087 55 HH11 ARG 6 HH11 ARG 6 3.466 -11.626 -3.365 56 HH12 ARG 6 HH12 ARG 6 3.857 -12.475 -1.907 57 HH21 ARG 6 HH21 ARG 6 4.840 -9.609 -0.161 58 HH22 ARG 6 HH22 ARG 6 4.638 -11.327 -0.084 59 H PHE 7 H PHE 7 4.223 -5.689 -8.020 60 HA PHE 7 HA PHE 7 4.418 -7.127 -10.408 61 HB2 PHE 7 HB2 PHE 7 3.090 -4.927 -9.741 62 HB3 PHE 7 HB3 PHE 7 4.477 -4.145 -10.492 63 HD1 PHE 7 HD1 PHE 7 2.473 -7.185 -11.314 64 HD2 PHE 7 HD2 PHE 7 3.956 -3.407 -12.596 65 HE1 PHE 7 HE1 PHE 7 1.470 -7.548 -13.531 66 HE2 PHE 7 HE2 PHE 7 2.954 -3.763 -14.815 67 HZ PHE 7 HZ PHE 7 1.709 -5.835 -15.285 68 H LYS 8 H LYS 8 6.379 -4.331 -9.374 69 HA LYS 8 HA LYS 8 8.199 -4.322 -11.451 70 HB2 LYS 8 HB2 LYS 8 9.730 -3.163 -9.916 71 HB3 LYS 8 HB3 LYS 8 8.090 -2.542 -9.787 72 HG2 LYS 8 HG2 LYS 8 7.738 -3.802 -7.751 73 HG3 LYS 8 HG3 LYS 8 9.343 -4.522 -7.895 74 HD2 LYS 8 HD2 LYS 8 9.531 -2.755 -6.323 75 HD3 LYS 8 HD3 LYS 8 10.274 -2.180 -7.817 76 HE2 LYS 8 HE2 LYS 8 7.665 -1.410 -8.124 77 HE3 LYS 8 HE3 LYS 8 7.912 -1.209 -6.390 78 HZ1 LYS 8 HZ1 LYS 8 8.559 0.815 -7.274 79 HZ2 LYS 8 HZ2 LYS 8 10.036 0.010 -7.092 80 HZ3 LYS 8 HZ3 LYS 8 9.315 0.119 -8.619 81 H ILE 9 H ILE 9 8.136 -6.327 -8.565 82 HA ILE 9 HA ILE 9 10.731 -7.444 -8.920 83 HB ILE 9 HB ILE 9 8.346 -8.327 -7.308 84 HG12 ILE 9 HG12 ILE 9 11.054 -7.484 -6.306 85 HG13 ILE 9 HG13 ILE 9 9.827 -6.291 -6.716 86 HG21 ILE 9 HG21 ILE 9 11.001 -9.679 -7.675 87 HG22 ILE 9 HG22 ILE 9 10.021 -9.916 -6.228 88 HG23 ILE 9 HG23 ILE 9 9.384 -10.370 -7.808 89 HD11 ILE 9 HD11 ILE 9 10.055 -8.025 -4.389 90 HD12 ILE 9 HD12 ILE 9 9.195 -6.499 -4.593 91 HD13 ILE 9 HD13 ILE 9 8.445 -8.010 -5.109 92 H LEU 10 H LEU 10 7.471 -8.782 -9.476 93 HA LEU 10 HA LEU 10 8.184 -11.207 -10.576 94 HB2 LEU 10 HB2 LEU 10 5.840 -9.423 -10.770 95 HB3 LEU 10 HB3 LEU 10 5.991 -10.644 -12.032 96 HG LEU 10 HG LEU 10 6.203 -12.329 -10.109 97 HD11 LEU 10 HD11 LEU 10 5.403 -11.737 -7.984 98 HD12 LEU 10 HD12 LEU 10 6.539 -10.459 -8.418 99 HD13 LEU 10 HD13 LEU 10 4.803 -10.178 -8.550 100 HD21 LEU 10 HD21 LEU 10 3.753 -10.887 -10.999 101 HD22 LEU 10 HD22 LEU 10 4.257 -12.550 -11.300 102 HD23 LEU 10 HD23 LEU 10 3.616 -12.095 -9.721 103 H VAL 11 H VAL 11 7.662 -8.129 -12.282 104 HA VAL 11 HA VAL 11 8.337 -9.154 -14.844 105 HB VAL 11 HB VAL 11 8.367 -6.862 -15.601 106 HG11 VAL 11 HG11 VAL 11 6.169 -6.272 -13.944 107 HG12 VAL 11 HG12 VAL 11 6.151 -6.998 -15.552 108 HG13 VAL 11 HG13 VAL 11 6.213 -8.026 -14.120 109 HG21 VAL 11 HG21 VAL 11 8.027 -5.019 -13.903 110 HG22 VAL 11 HG22 VAL 11 8.487 -6.193 -12.669 111 HG23 VAL 11 HG23 VAL 11 9.631 -5.750 -13.937 Start of MODEL 13 1 H1 GLY 1 H GLY 1 3.829 -5.022 1.623 2 HA2 GLY 1 HA2 GLY 1 4.498 -2.673 1.023 3 HA3 GLY 1 HA3 GLY 1 4.804 -3.832 -0.263 4 H PHE 2 H PHE 2 3.993 -3.385 -2.201 5 HA PHE 2 HA PHE 2 1.534 -1.836 -2.429 6 HB2 PHE 2 HB2 PHE 2 3.391 -0.184 -2.441 7 HB3 PHE 2 HB3 PHE 2 4.080 -1.008 -3.836 8 HD1 PHE 2 HD1 PHE 2 0.538 -0.168 -3.082 9 HD2 PHE 2 HD2 PHE 2 3.916 0.501 -5.583 10 HE1 PHE 2 HE1 PHE 2 -0.846 1.214 -4.575 11 HE2 PHE 2 HE2 PHE 2 2.539 1.884 -7.080 12 HZ PHE 2 HZ PHE 2 0.155 2.243 -6.577 13 H ILE 3 H ILE 3 0.411 -2.171 -4.341 14 HA ILE 3 HA ILE 3 0.591 -4.635 -5.564 15 HB ILE 3 HB ILE 3 -0.554 -2.107 -6.757 16 HG12 ILE 3 HG12 ILE 3 -1.834 -4.296 -5.105 17 HG13 ILE 3 HG13 ILE 3 -1.527 -2.645 -4.578 18 HG21 ILE 3 HG21 ILE 3 -1.925 -3.612 -8.121 19 HG22 ILE 3 HG22 ILE 3 -0.205 -3.822 -8.446 20 HG23 ILE 3 HG23 ILE 3 -1.063 -4.997 -7.450 21 HD11 ILE 3 HD11 ILE 3 -3.746 -2.546 -5.116 22 HD12 ILE 3 HD12 ILE 3 -3.012 -2.030 -6.634 23 HD13 ILE 3 HD13 ILE 3 -3.587 -3.687 -6.452 24 H VAL 4 H VAL 4 1.660 -1.518 -6.933 25 HA VAL 4 HA VAL 4 2.808 -2.564 -9.262 26 HB VAL 4 HB VAL 4 3.581 -0.062 -7.754 27 HG11 VAL 4 HG11 VAL 4 4.374 0.678 -10.028 28 HG12 VAL 4 HG12 VAL 4 5.348 -0.571 -9.253 29 HG13 VAL 4 HG13 VAL 4 4.222 -1.003 -10.541 30 HG21 VAL 4 HG21 VAL 4 1.712 -0.399 -10.098 31 HG22 VAL 4 HG22 VAL 4 1.200 -0.189 -8.423 32 HG23 VAL 4 HG23 VAL 4 2.080 1.100 -9.245 33 H LYS 5 H LYS 5 4.216 -1.911 -6.079 34 HA LYS 5 HA LYS 5 6.885 -2.424 -6.652 35 HB2 LYS 5 HB2 LYS 5 5.206 -2.622 -4.190 36 HB3 LYS 5 HB3 LYS 5 6.830 -3.295 -4.153 37 HG2 LYS 5 HG2 LYS 5 7.428 -0.920 -5.170 38 HG3 LYS 5 HG3 LYS 5 5.944 -0.474 -4.325 39 HD2 LYS 5 HD2 LYS 5 6.831 -0.921 -2.252 40 HD3 LYS 5 HD3 LYS 5 7.983 -2.100 -2.881 41 HE2 LYS 5 HE2 LYS 5 9.143 -0.103 -2.142 42 HE3 LYS 5 HE3 LYS 5 9.277 -0.273 -3.891 43 HZ1 LYS 5 HZ1 LYS 5 8.412 1.736 -4.111 44 HZ2 LYS 5 HZ2 LYS 5 6.993 1.239 -3.335 45 HZ3 LYS 5 HZ3 LYS 5 8.266 1.892 -2.432 46 H ARG 6 H ARG 6 4.301 -4.677 -5.760 47 HA ARG 6 HA ARG 6 5.916 -6.986 -5.622 48 HB2 ARG 6 HB2 ARG 6 3.065 -6.359 -5.594 49 HB3 ARG 6 HB3 ARG 6 3.416 -7.887 -6.391 50 HG2 ARG 6 HG2 ARG 6 4.822 -7.505 -3.853 51 HG3 ARG 6 HG3 ARG 6 3.064 -7.561 -3.718 52 HD2 ARG 6 HD2 ARG 6 4.810 -9.623 -5.058 53 HD3 ARG 6 HD3 ARG 6 4.043 -9.785 -3.478 54 HE ARG 6 HE ARG 6 2.118 -9.230 -5.484 55 HH11 ARG 6 HH11 ARG 6 4.142 -11.771 -4.232 56 HH12 ARG 6 HH12 ARG 6 3.087 -13.044 -4.750 57 HH21 ARG 6 HH21 ARG 6 0.721 -10.897 -6.171 58 HH22 ARG 6 HH22 ARG 6 1.142 -12.546 -5.854 59 H PHE 7 H PHE 7 3.898 -5.680 -8.243 60 HA PHE 7 HA PHE 7 4.435 -7.699 -10.116 61 HB2 PHE 7 HB2 PHE 7 2.727 -5.666 -10.111 62 HB3 PHE 7 HB3 PHE 7 4.004 -4.899 -11.050 63 HD1 PHE 7 HD1 PHE 7 2.568 -8.344 -10.969 64 HD2 PHE 7 HD2 PHE 7 3.488 -4.891 -13.281 65 HE1 PHE 7 HE1 PHE 7 1.757 -9.486 -12.991 66 HE2 PHE 7 HE2 PHE 7 2.678 -6.027 -15.307 67 HZ PHE 7 HZ PHE 7 1.810 -8.328 -15.164 68 H LYS 8 H LYS 8 5.847 -4.429 -9.908 69 HA LYS 8 HA LYS 8 7.744 -4.663 -11.894 70 HB2 LYS 8 HB2 LYS 8 8.880 -2.825 -10.889 71 HB3 LYS 8 HB3 LYS 8 7.164 -2.594 -10.577 72 HG2 LYS 8 HG2 LYS 8 7.428 -3.385 -8.313 73 HG3 LYS 8 HG3 LYS 8 9.128 -3.756 -8.611 74 HD2 LYS 8 HD2 LYS 8 7.886 -1.008 -8.755 75 HD3 LYS 8 HD3 LYS 8 8.834 -1.632 -7.402 76 HE2 LYS 8 HE2 LYS 8 9.767 -1.114 -10.220 77 HE3 LYS 8 HE3 LYS 8 10.269 -0.276 -8.752 78 HZ1 LYS 8 HZ1 LYS 8 11.021 -2.943 -9.717 79 HZ2 LYS 8 HZ2 LYS 8 11.990 -1.729 -9.046 80 HZ3 LYS 8 HZ3 LYS 8 10.993 -2.663 -8.048 81 H ILE 9 H ILE 9 7.842 -5.866 -8.601 82 HA ILE 9 HA ILE 9 10.610 -6.590 -8.664 83 HB ILE 9 HB ILE 9 8.345 -7.252 -6.805 84 HG12 ILE 9 HG12 ILE 9 10.984 -5.911 -6.227 85 HG13 ILE 9 HG13 ILE 9 9.578 -5.016 -6.793 86 HG21 ILE 9 HG21 ILE 9 10.234 -8.302 -5.390 87 HG22 ILE 9 HG22 ILE 9 9.505 -9.257 -6.681 88 HG23 ILE 9 HG23 ILE 9 11.070 -8.482 -6.932 89 HD11 ILE 9 HD11 ILE 9 9.398 -4.744 -4.534 90 HD12 ILE 9 HD12 ILE 9 8.404 -6.181 -4.770 91 HD13 ILE 9 HD13 ILE 9 10.057 -6.340 -4.176 92 H LEU 10 H LEU 10 7.603 -8.510 -8.729 93 HA LEU 10 HA LEU 10 8.699 -11.010 -9.115 94 HB2 LEU 10 HB2 LEU 10 6.112 -9.733 -9.719 95 HB3 LEU 10 HB3 LEU 10 6.466 -11.205 -10.620 96 HG LEU 10 HG LEU 10 6.924 -12.258 -8.318 97 HD11 LEU 10 HD11 LEU 10 6.941 -10.044 -7.147 98 HD12 LEU 10 HD12 LEU 10 5.199 -9.963 -7.411 99 HD13 LEU 10 HD13 LEU 10 5.883 -11.258 -6.428 100 HD21 LEU 10 HD21 LEU 10 4.306 -12.326 -7.960 101 HD22 LEU 10 HD22 LEU 10 4.310 -11.560 -9.548 102 HD23 LEU 10 HD23 LEU 10 5.074 -13.134 -9.327 103 H VAL 11 H VAL 11 7.742 -8.660 -11.609 104 HA VAL 11 HA VAL 11 8.600 -10.256 -13.795 105 HB VAL 11 HB VAL 11 8.320 -8.278 -15.163 106 HG11 VAL 11 HG11 VAL 11 6.139 -8.670 -15.061 107 HG12 VAL 11 HG12 VAL 11 6.330 -9.356 -13.448 108 HG13 VAL 11 HG13 VAL 11 6.016 -7.631 -13.642 109 HG21 VAL 11 HG21 VAL 11 8.497 -6.880 -12.537 110 HG22 VAL 11 HG22 VAL 11 9.233 -6.469 -14.086 111 HG23 VAL 11 HG23 VAL 11 7.516 -6.167 -13.818 Start of MODEL 14 1 H1 GLY 1 H GLY 1 0.289 -0.015 -0.413 2 HA2 GLY 1 HA2 GLY 1 1.448 0.190 -2.449 3 HA3 GLY 1 HA3 GLY 1 2.799 0.905 -1.582 4 H PHE 2 H PHE 2 1.106 -2.149 -2.160 5 HA PHE 2 HA PHE 2 3.657 -3.545 -1.681 6 HB2 PHE 2 HB2 PHE 2 1.369 -3.933 -0.259 7 HB3 PHE 2 HB3 PHE 2 1.180 -5.139 -1.528 8 HD1 PHE 2 HD1 PHE 2 3.584 -3.936 1.036 9 HD2 PHE 2 HD2 PHE 2 2.240 -7.193 -1.351 10 HE1 PHE 2 HE1 PHE 2 5.090 -5.449 2.260 11 HE2 PHE 2 HE2 PHE 2 3.742 -8.712 -0.131 12 HZ PHE 2 HZ PHE 2 5.169 -7.841 1.678 13 H ILE 3 H ILE 3 0.770 -3.314 -3.671 14 HA ILE 3 HA ILE 3 1.169 -5.451 -5.394 15 HB ILE 3 HB ILE 3 0.050 -2.733 -6.093 16 HG12 ILE 3 HG12 ILE 3 -1.315 -5.258 -5.133 17 HG13 ILE 3 HG13 ILE 3 -1.115 -3.775 -4.205 18 HG21 ILE 3 HG21 ILE 3 -1.140 -4.865 -7.553 19 HG22 ILE 3 HG22 ILE 3 -0.228 -3.484 -8.161 20 HG23 ILE 3 HG23 ILE 3 0.612 -4.973 -7.729 21 HD11 ILE 3 HD11 ILE 3 -3.343 -3.840 -5.021 22 HD12 ILE 3 HD12 ILE 3 -2.475 -2.606 -5.936 23 HD13 ILE 3 HD13 ILE 3 -2.794 -4.181 -6.662 24 H VAL 4 H VAL 4 2.151 -2.065 -5.962 25 HA VAL 4 HA VAL 4 3.586 -2.461 -8.295 26 HB VAL 4 HB VAL 4 4.194 -0.475 -6.101 27 HG11 VAL 4 HG11 VAL 4 6.020 -0.085 -7.345 28 HG12 VAL 4 HG12 VAL 4 5.382 -0.967 -8.732 29 HG13 VAL 4 HG13 VAL 4 4.900 0.706 -8.454 30 HG21 VAL 4 HG21 VAL 4 2.591 -0.023 -8.607 31 HG22 VAL 4 HG22 VAL 4 1.858 -0.478 -7.069 32 HG23 VAL 4 HG23 VAL 4 2.748 1.038 -7.207 33 H LYS 5 H LYS 5 4.436 -3.250 -5.032 34 HA LYS 5 HA LYS 5 7.251 -3.445 -5.417 35 HB2 LYS 5 HB2 LYS 5 5.385 -3.808 -3.271 36 HB3 LYS 5 HB3 LYS 5 6.445 -5.209 -3.349 37 HG2 LYS 5 HG2 LYS 5 7.944 -4.039 -2.216 38 HG3 LYS 5 HG3 LYS 5 8.133 -3.011 -3.639 39 HD2 LYS 5 HD2 LYS 5 7.484 -1.343 -2.291 40 HD3 LYS 5 HD3 LYS 5 5.860 -2.004 -2.492 41 HE2 LYS 5 HE2 LYS 5 5.952 -1.976 -0.219 42 HE3 LYS 5 HE3 LYS 5 6.665 -3.563 -0.500 43 HZ1 LYS 5 HZ1 LYS 5 8.688 -1.616 -0.610 44 HZ2 LYS 5 HZ2 LYS 5 7.801 -1.386 0.812 45 HZ3 LYS 5 HZ3 LYS 5 8.508 -2.889 0.491 46 H ARG 6 H ARG 6 4.797 -6.002 -4.975 47 HA ARG 6 HA ARG 6 6.495 -8.106 -5.770 48 HB2 ARG 6 HB2 ARG 6 4.582 -9.497 -5.698 49 HB3 ARG 6 HB3 ARG 6 4.331 -8.279 -4.454 50 HG2 ARG 6 HG2 ARG 6 2.290 -8.154 -5.387 51 HG3 ARG 6 HG3 ARG 6 3.109 -7.076 -6.519 52 HD2 ARG 6 HD2 ARG 6 1.751 -8.730 -7.695 53 HD3 ARG 6 HD3 ARG 6 3.465 -8.940 -8.050 54 HE ARG 6 HE ARG 6 3.028 -10.644 -5.986 55 HH11 ARG 6 HH11 ARG 6 1.510 -10.161 -9.081 56 HH12 ARG 6 HH12 ARG 6 1.046 -11.821 -9.258 57 HH21 ARG 6 HH21 ARG 6 2.423 -12.832 -6.208 58 HH22 ARG 6 HH22 ARG 6 1.564 -13.339 -7.623 59 H PHE 7 H PHE 7 4.366 -5.972 -7.554 60 HA PHE 7 HA PHE 7 4.318 -7.433 -9.975 61 HB2 PHE 7 HB2 PHE 7 2.916 -5.343 -9.123 62 HB3 PHE 7 HB3 PHE 7 4.149 -4.455 -10.013 63 HD1 PHE 7 HD1 PHE 7 1.732 -7.257 -10.402 64 HD2 PHE 7 HD2 PHE 7 3.898 -4.112 -12.283 65 HE1 PHE 7 HE1 PHE 7 0.512 -7.674 -12.498 66 HE2 PHE 7 HE2 PHE 7 2.681 -4.524 -14.381 67 HZ PHE 7 HZ PHE 7 0.985 -6.307 -14.490 68 H LYS 8 H LYS 8 6.171 -4.511 -9.104 69 HA LYS 8 HA LYS 8 7.746 -4.339 -11.367 70 HB2 LYS 8 HB2 LYS 8 8.171 -3.530 -8.512 71 HB3 LYS 8 HB3 LYS 8 9.479 -3.343 -9.674 72 HG2 LYS 8 HG2 LYS 8 6.807 -2.266 -10.392 73 HG3 LYS 8 HG3 LYS 8 7.764 -1.403 -9.185 74 HD2 LYS 8 HD2 LYS 8 9.547 -1.066 -10.710 75 HD3 LYS 8 HD3 LYS 8 8.866 -2.211 -11.868 76 HE2 LYS 8 HE2 LYS 8 6.870 -0.639 -12.004 77 HE3 LYS 8 HE3 LYS 8 7.869 0.533 -11.145 78 HZ1 LYS 8 HZ1 LYS 8 8.331 1.082 -13.292 79 HZ2 LYS 8 HZ2 LYS 8 9.550 -0.063 -13.041 80 HZ3 LYS 8 HZ3 LYS 8 8.143 -0.495 -13.874 81 H ILE 9 H ILE 9 8.261 -6.275 -8.455 82 HA ILE 9 HA ILE 9 10.822 -7.247 -9.242 83 HB ILE 9 HB ILE 9 8.856 -8.334 -7.225 84 HG12 ILE 9 HG12 ILE 9 11.423 -6.840 -6.707 85 HG13 ILE 9 HG13 ILE 9 9.880 -6.013 -6.893 86 HG21 ILE 9 HG21 ILE 9 10.121 -10.167 -7.224 87 HG22 ILE 9 HG22 ILE 9 11.336 -9.419 -8.261 88 HG23 ILE 9 HG23 ILE 9 11.394 -9.174 -6.515 89 HD11 ILE 9 HD11 ILE 9 9.063 -7.587 -5.032 90 HD12 ILE 9 HD12 ILE 9 10.778 -7.861 -4.725 91 HD13 ILE 9 HD13 ILE 9 10.110 -6.234 -4.602 92 H LEU 10 H LEU 10 7.525 -8.308 -9.733 93 HA LEU 10 HA LEU 10 8.081 -10.946 -10.573 94 HB2 LEU 10 HB2 LEU 10 5.871 -10.963 -10.389 95 HB3 LEU 10 HB3 LEU 10 5.808 -9.201 -10.404 96 HG LEU 10 HG LEU 10 5.892 -9.360 -12.935 97 HD11 LEU 10 HD11 LEU 10 6.326 -12.067 -12.360 98 HD12 LEU 10 HD12 LEU 10 4.704 -11.968 -13.045 99 HD13 LEU 10 HD13 LEU 10 6.081 -11.326 -13.941 100 HD21 LEU 10 HD21 LEU 10 3.848 -8.759 -11.905 101 HD22 LEU 10 HD22 LEU 10 3.463 -10.035 -13.060 102 HD23 LEU 10 HD23 LEU 10 3.565 -10.405 -11.338 103 H VAL 11 H VAL 11 7.949 -7.869 -12.277 104 HA VAL 11 HA VAL 11 8.352 -9.119 -14.860 105 HB VAL 11 HB VAL 11 8.351 -6.863 -15.768 106 HG11 VAL 11 HG11 VAL 11 6.125 -6.441 -13.964 107 HG12 VAL 11 HG12 VAL 11 6.126 -6.811 -15.689 108 HG13 VAL 11 HG13 VAL 11 6.223 -8.116 -14.506 109 HG21 VAL 11 HG21 VAL 11 8.126 -4.903 -14.358 110 HG22 VAL 11 HG22 VAL 11 8.161 -5.911 -12.911 111 HG23 VAL 11 HG23 VAL 11 9.593 -5.785 -13.933 Start of MODEL 15 1 H1 GLY 1 H GLY 1 1.491 -3.782 1.102 2 HA2 GLY 1 HA2 GLY 1 3.960 -2.230 1.179 3 HA3 GLY 1 HA3 GLY 1 3.984 -3.687 0.197 4 H PHE 2 H PHE 2 3.102 -3.657 -1.806 5 HA PHE 2 HA PHE 2 1.112 -1.908 -2.709 6 HB2 PHE 2 HB2 PHE 2 3.532 -0.578 -2.404 7 HB3 PHE 2 HB3 PHE 2 3.476 -0.959 -4.122 8 HD1 PHE 2 HD1 PHE 2 2.096 1.050 -1.448 9 HD2 PHE 2 HD2 PHE 2 1.628 -0.108 -5.516 10 HE1 PHE 2 HE1 PHE 2 0.590 2.961 -1.815 11 HE2 PHE 2 HE2 PHE 2 0.123 1.801 -5.891 12 HZ PHE 2 HZ PHE 2 -0.397 3.340 -4.039 13 H ILE 3 H ILE 3 0.363 -2.558 -4.662 14 HA ILE 3 HA ILE 3 1.207 -4.990 -5.746 15 HB ILE 3 HB ILE 3 -0.340 -2.882 -7.249 16 HG12 ILE 3 HG12 ILE 3 -1.433 -3.113 -5.129 17 HG13 ILE 3 HG13 ILE 3 -2.363 -4.043 -6.298 18 HG21 ILE 3 HG21 ILE 3 0.537 -5.422 -7.978 19 HG22 ILE 3 HG22 ILE 3 -1.170 -5.625 -7.585 20 HG23 ILE 3 HG23 ILE 3 -0.679 -4.442 -8.797 21 HD11 ILE 3 HD11 ILE 3 -1.072 -4.900 -3.875 22 HD12 ILE 3 HD12 ILE 3 -2.249 -5.740 -4.885 23 HD13 ILE 3 HD13 ILE 3 -0.529 -5.850 -5.258 24 H VAL 4 H VAL 4 1.669 -1.688 -7.000 25 HA VAL 4 HA VAL 4 3.086 -2.288 -9.298 26 HB VAL 4 HB VAL 4 3.511 0.081 -7.471 27 HG11 VAL 4 HG11 VAL 4 4.282 -0.390 -10.345 28 HG12 VAL 4 HG12 VAL 4 4.288 1.194 -9.569 29 HG13 VAL 4 HG13 VAL 4 5.357 -0.080 -8.982 30 HG21 VAL 4 HG21 VAL 4 1.165 -0.378 -8.354 31 HG22 VAL 4 HG22 VAL 4 1.847 1.214 -8.685 32 HG23 VAL 4 HG23 VAL 4 1.818 -0.013 -9.951 33 H LYS 5 H LYS 5 4.185 -2.179 -5.971 34 HA LYS 5 HA LYS 5 6.969 -2.276 -6.544 35 HB2 LYS 5 HB2 LYS 5 6.535 -1.523 -4.397 36 HB3 LYS 5 HB3 LYS 5 5.279 -2.722 -4.118 37 HG2 LYS 5 HG2 LYS 5 7.272 -3.137 -2.763 38 HG3 LYS 5 HG3 LYS 5 6.947 -4.462 -3.883 39 HD2 LYS 5 HD2 LYS 5 9.327 -3.930 -3.826 40 HD3 LYS 5 HD3 LYS 5 8.642 -3.580 -5.415 41 HE2 LYS 5 HE2 LYS 5 8.566 -1.332 -3.535 42 HE3 LYS 5 HE3 LYS 5 10.190 -1.869 -3.959 43 HZ1 LYS 5 HZ1 LYS 5 9.879 -0.516 -5.705 44 HZ2 LYS 5 HZ2 LYS 5 9.017 -1.818 -6.356 45 HZ3 LYS 5 HZ3 LYS 5 8.192 -0.554 -5.592 46 H ARG 6 H ARG 6 4.792 -4.795 -5.252 47 HA ARG 6 HA ARG 6 6.563 -6.926 -5.479 48 HB2 ARG 6 HB2 ARG 6 3.563 -6.759 -5.487 49 HB3 ARG 6 HB3 ARG 6 4.380 -8.305 -5.677 50 HG2 ARG 6 HG2 ARG 6 4.660 -8.463 -3.490 51 HG3 ARG 6 HG3 ARG 6 5.517 -6.921 -3.457 52 HD2 ARG 6 HD2 ARG 6 3.518 -6.983 -1.987 53 HD3 ARG 6 HD3 ARG 6 3.457 -5.716 -3.211 54 HE ARG 6 HE ARG 6 2.152 -7.810 -4.359 55 HH11 ARG 6 HH11 ARG 6 1.813 -6.067 -1.364 56 HH12 ARG 6 HH12 ARG 6 0.102 -6.320 -1.260 57 HH21 ARG 6 HH21 ARG 6 -0.100 -8.149 -4.233 58 HH22 ARG 6 HH22 ARG 6 -0.985 -7.505 -2.892 59 H PHE 7 H PHE 7 4.113 -5.801 -7.797 60 HA PHE 7 HA PHE 7 4.434 -7.718 -9.760 61 HB2 PHE 7 HB2 PHE 7 2.856 -5.596 -9.568 62 HB3 PHE 7 HB3 PHE 7 4.083 -4.878 -10.606 63 HD1 PHE 7 HD1 PHE 7 2.115 -8.042 -10.373 64 HD2 PHE 7 HD2 PHE 7 3.720 -4.986 -12.863 65 HE1 PHE 7 HE1 PHE 7 1.060 -9.090 -12.333 66 HE2 PHE 7 HE2 PHE 7 2.667 -6.028 -14.827 67 HZ PHE 7 HZ PHE 7 1.334 -8.082 -14.564 68 H LYS 8 H LYS 8 6.088 -4.563 -9.594 69 HA LYS 8 HA LYS 8 7.749 -4.829 -11.776 70 HB2 LYS 8 HB2 LYS 8 7.953 -3.351 -9.192 71 HB3 LYS 8 HB3 LYS 8 9.378 -3.429 -10.220 72 HG2 LYS 8 HG2 LYS 8 7.832 -2.598 -12.089 73 HG3 LYS 8 HG3 LYS 8 6.719 -2.172 -10.787 74 HD2 LYS 8 HD2 LYS 8 8.292 -0.674 -9.821 75 HD3 LYS 8 HD3 LYS 8 9.591 -1.265 -10.860 76 HE2 LYS 8 HE2 LYS 8 7.117 0.154 -11.841 77 HE3 LYS 8 HE3 LYS 8 8.673 0.935 -11.558 78 HZ1 LYS 8 HZ1 LYS 8 8.944 -1.371 -13.208 79 HZ2 LYS 8 HZ2 LYS 8 7.846 -0.271 -13.878 80 HZ3 LYS 8 HZ3 LYS 8 9.421 0.225 -13.508 81 H ILE 9 H ILE 9 8.250 -6.014 -8.480 82 HA ILE 9 HA ILE 9 10.869 -7.021 -8.960 83 HB ILE 9 HB ILE 9 8.867 -7.662 -6.796 84 HG12 ILE 9 HG12 ILE 9 11.386 -5.985 -6.778 85 HG13 ILE 9 HG13 ILE 9 9.742 -5.355 -6.807 86 HG21 ILE 9 HG21 ILE 9 10.312 -9.564 -7.036 87 HG22 ILE 9 HG22 ILE 9 11.739 -8.528 -7.082 88 HG23 ILE 9 HG23 ILE 9 10.797 -8.666 -5.597 89 HD11 ILE 9 HD11 ILE 9 9.331 -6.411 -4.626 90 HD12 ILE 9 HD12 ILE 9 11.008 -6.955 -4.597 91 HD13 ILE 9 HD13 ILE 9 10.641 -5.230 -4.579 92 H LEU 10 H LEU 10 7.638 -8.334 -9.263 93 HA LEU 10 HA LEU 10 8.443 -11.055 -9.557 94 HB2 LEU 10 HB2 LEU 10 6.269 -11.249 -9.156 95 HB3 LEU 10 HB3 LEU 10 5.991 -9.549 -9.531 96 HG LEU 10 HG LEU 10 5.919 -10.231 -11.967 97 HD11 LEU 10 HD11 LEU 10 5.076 -12.912 -11.516 98 HD12 LEU 10 HD12 LEU 10 6.375 -12.318 -12.550 99 HD13 LEU 10 HD13 LEU 10 6.702 -12.711 -10.862 100 HD21 LEU 10 HD21 LEU 10 3.727 -11.664 -10.581 101 HD22 LEU 10 HD22 LEU 10 3.963 -9.963 -10.180 102 HD23 LEU 10 HD23 LEU 10 3.661 -10.442 -11.850 103 H VAL 11 H VAL 11 7.828 -8.392 -11.774 104 HA VAL 11 HA VAL 11 8.138 -10.039 -14.124 105 HB VAL 11 HB VAL 11 7.918 -7.987 -15.397 106 HG11 VAL 11 HG11 VAL 11 5.694 -7.521 -14.895 107 HG12 VAL 11 HG12 VAL 11 5.932 -9.130 -14.215 108 HG13 VAL 11 HG13 VAL 11 5.942 -7.717 -13.160 109 HG21 VAL 11 HG21 VAL 11 9.264 -6.514 -14.012 110 HG22 VAL 11 HG22 VAL 11 7.666 -5.814 -14.272 111 HG23 VAL 11 HG23 VAL 11 8.054 -6.580 -12.731 Start of MODEL 16 1 H1 GLY 1 H GLY 1 -0.124 0.538 -2.536 2 HA2 GLY 1 HA2 GLY 1 2.214 0.565 -2.911 3 HA3 GLY 1 HA3 GLY 1 2.078 0.215 -1.194 4 H PHE 2 H PHE 2 1.534 -2.297 -0.890 5 HA PHE 2 HA PHE 2 3.861 -3.688 -1.409 6 HB2 PHE 2 HB2 PHE 2 2.730 -5.656 -0.648 7 HB3 PHE 2 HB3 PHE 2 2.076 -4.297 0.261 8 HD1 PHE 2 HD1 PHE 2 1.318 -7.097 -1.788 9 HD2 PHE 2 HD2 PHE 2 -0.121 -3.277 -0.579 10 HE1 PHE 2 HE1 PHE 2 -0.955 -7.737 -2.479 11 HE2 PHE 2 HE2 PHE 2 -2.396 -3.912 -1.268 12 HZ PHE 2 HZ PHE 2 -2.815 -6.145 -2.219 13 H ILE 3 H ILE 3 0.968 -3.406 -3.365 14 HA ILE 3 HA ILE 3 1.431 -5.496 -5.169 15 HB ILE 3 HB ILE 3 0.093 -2.843 -5.712 16 HG12 ILE 3 HG12 ILE 3 -1.051 -5.498 -4.818 17 HG13 ILE 3 HG13 ILE 3 -0.925 -4.044 -3.834 18 HG21 ILE 3 HG21 ILE 3 -0.202 -3.527 -7.800 19 HG22 ILE 3 HG22 ILE 3 0.759 -4.966 -7.459 20 HG23 ILE 3 HG23 ILE 3 -0.988 -4.997 -7.223 21 HD11 ILE 3 HD11 ILE 3 -2.381 -2.947 -5.634 22 HD12 ILE 3 HD12 ILE 3 -2.733 -4.596 -6.150 23 HD13 ILE 3 HD13 ILE 3 -3.141 -4.077 -4.514 24 H VAL 4 H VAL 4 2.249 -2.038 -5.487 25 HA VAL 4 HA VAL 4 3.542 -2.117 -7.923 26 HB VAL 4 HB VAL 4 4.335 -0.425 -5.548 27 HG11 VAL 4 HG11 VAL 4 4.822 1.118 -7.683 28 HG12 VAL 4 HG12 VAL 4 6.033 0.054 -6.968 29 HG13 VAL 4 HG13 VAL 4 5.134 -0.465 -8.394 30 HG21 VAL 4 HG21 VAL 4 2.829 1.083 -7.352 31 HG22 VAL 4 HG22 VAL 4 1.963 -0.444 -7.187 32 HG23 VAL 4 HG23 VAL 4 2.331 0.521 -5.757 33 H LYS 5 H LYS 5 4.724 -3.073 -4.765 34 HA LYS 5 HA LYS 5 7.462 -3.308 -5.500 35 HB2 LYS 5 HB2 LYS 5 7.175 -3.144 -3.207 36 HB3 LYS 5 HB3 LYS 5 5.790 -4.228 -3.198 37 HG2 LYS 5 HG2 LYS 5 7.750 -5.222 -2.126 38 HG3 LYS 5 HG3 LYS 5 7.241 -6.135 -3.548 39 HD2 LYS 5 HD2 LYS 5 9.669 -5.904 -3.481 40 HD3 LYS 5 HD3 LYS 5 8.992 -5.051 -4.871 41 HE2 LYS 5 HE2 LYS 5 9.209 -2.939 -3.750 42 HE3 LYS 5 HE3 LYS 5 9.688 -3.732 -2.250 43 HZ1 LYS 5 HZ1 LYS 5 11.228 -3.629 -4.785 44 HZ2 LYS 5 HZ2 LYS 5 11.630 -2.894 -3.315 45 HZ3 LYS 5 HZ3 LYS 5 11.664 -4.580 -3.455 46 H ARG 6 H ARG 6 5.028 -5.833 -4.830 47 HA ARG 6 HA ARG 6 6.516 -8.000 -5.725 48 HB2 ARG 6 HB2 ARG 6 3.570 -7.483 -5.502 49 HB3 ARG 6 HB3 ARG 6 4.149 -8.979 -6.223 50 HG2 ARG 6 HG2 ARG 6 5.559 -8.577 -3.795 51 HG3 ARG 6 HG3 ARG 6 3.838 -8.338 -3.483 52 HD2 ARG 6 HD2 ARG 6 5.072 -10.734 -4.839 53 HD3 ARG 6 HD3 ARG 6 4.504 -10.675 -3.171 54 HE ARG 6 HE ARG 6 2.484 -9.966 -5.078 55 HH11 ARG 6 HH11 ARG 6 4.075 -12.611 -3.469 56 HH12 ARG 6 HH12 ARG 6 2.740 -13.699 -3.655 57 HH21 ARG 6 HH21 ARG 6 0.719 -11.389 -5.329 58 HH22 ARG 6 HH22 ARG 6 0.832 -13.003 -4.714 59 H PHE 7 H PHE 7 4.371 -5.838 -7.523 60 HA PHE 7 HA PHE 7 4.338 -7.189 -9.959 61 HB2 PHE 7 HB2 PHE 7 3.117 -4.992 -9.108 62 HB3 PHE 7 HB3 PHE 7 4.441 -4.207 -9.962 63 HD1 PHE 7 HD1 PHE 7 2.025 -6.995 -10.541 64 HD2 PHE 7 HD2 PHE 7 4.031 -3.592 -12.126 65 HE1 PHE 7 HE1 PHE 7 0.814 -7.274 -12.664 66 HE2 PHE 7 HE2 PHE 7 2.822 -3.865 -14.251 67 HZ PHE 7 HZ PHE 7 1.210 -5.707 -14.522 68 H LYS 8 H LYS 8 6.456 -4.483 -9.001 69 HA LYS 8 HA LYS 8 8.064 -4.391 -11.239 70 HB2 LYS 8 HB2 LYS 8 8.523 -3.736 -8.355 71 HB3 LYS 8 HB3 LYS 8 9.878 -3.673 -9.475 72 HG2 LYS 8 HG2 LYS 8 7.340 -2.238 -10.120 73 HG3 LYS 8 HG3 LYS 8 8.504 -1.531 -8.996 74 HD2 LYS 8 HD2 LYS 8 10.206 -1.491 -10.654 75 HD3 LYS 8 HD3 LYS 8 9.254 -2.495 -11.749 76 HE2 LYS 8 HE2 LYS 8 7.749 -0.749 -12.208 77 HE3 LYS 8 HE3 LYS 8 8.297 0.198 -10.827 78 HZ1 LYS 8 HZ1 LYS 8 10.168 -0.446 -13.008 79 HZ2 LYS 8 HZ2 LYS 8 9.078 0.836 -13.183 80 HZ3 LYS 8 HZ3 LYS 8 10.203 0.848 -11.919 81 H ILE 9 H ILE 9 8.480 -6.392 -8.336 82 HA ILE 9 HA ILE 9 10.883 -7.625 -9.190 83 HB ILE 9 HB ILE 9 8.819 -8.502 -7.172 84 HG12 ILE 9 HG12 ILE 9 11.579 -7.304 -6.848 85 HG13 ILE 9 HG13 ILE 9 10.062 -6.436 -6.641 86 HG21 ILE 9 HG21 ILE 9 10.582 -10.064 -6.363 87 HG22 ILE 9 HG22 ILE 9 9.924 -10.481 -7.945 88 HG23 ILE 9 HG23 ILE 9 11.503 -9.705 -7.823 89 HD11 ILE 9 HD11 ILE 9 11.062 -8.725 -4.967 90 HD12 ILE 9 HD12 ILE 9 10.966 -7.028 -4.496 91 HD13 ILE 9 HD13 ILE 9 9.489 -7.948 -4.785 92 H LEU 10 H LEU 10 7.497 -8.331 -9.707 93 HA LEU 10 HA LEU 10 7.885 -10.976 -10.705 94 HB2 LEU 10 HB2 LEU 10 5.707 -10.934 -10.272 95 HB3 LEU 10 HB3 LEU 10 5.685 -9.172 -10.234 96 HG LEU 10 HG LEU 10 5.511 -9.238 -12.751 97 HD11 LEU 10 HD11 LEU 10 5.689 -11.162 -13.831 98 HD12 LEU 10 HD12 LEU 10 5.953 -11.993 -12.298 99 HD13 LEU 10 HD13 LEU 10 4.318 -11.814 -12.934 100 HD21 LEU 10 HD21 LEU 10 3.530 -8.669 -11.728 101 HD22 LEU 10 HD22 LEU 10 3.062 -10.132 -12.595 102 HD23 LEU 10 HD23 LEU 10 3.407 -10.203 -10.867 103 H VAL 11 H VAL 11 7.661 -7.775 -12.158 104 HA VAL 11 HA VAL 11 7.778 -8.817 -14.853 105 HB VAL 11 HB VAL 11 7.839 -6.473 -15.559 106 HG11 VAL 11 HG11 VAL 11 5.630 -6.639 -15.414 107 HG12 VAL 11 HG12 VAL 11 5.763 -7.711 -14.020 108 HG13 VAL 11 HG13 VAL 11 5.720 -5.964 -13.788 109 HG21 VAL 11 HG21 VAL 11 7.997 -5.895 -12.604 110 HG22 VAL 11 HG22 VAL 11 9.206 -5.513 -13.830 111 HG23 VAL 11 HG23 VAL 11 7.647 -4.687 -13.841 Start of MODEL 17 1 H1 GLY 1 H GLY 1 1.761 1.304 -0.204 2 HA2 GLY 1 HA2 GLY 1 1.680 -0.081 -2.316 3 HA3 GLY 1 HA3 GLY 1 3.304 0.386 -1.832 4 H PHE 2 H PHE 2 1.237 -2.187 -2.535 5 HA PHE 2 HA PHE 2 3.259 -4.098 -1.573 6 HB2 PHE 2 HB2 PHE 2 1.306 -4.323 -0.156 7 HB3 PHE 2 HB3 PHE 2 0.254 -4.435 -1.564 8 HD1 PHE 2 HD1 PHE 2 3.009 -6.156 0.218 9 HD2 PHE 2 HD2 PHE 2 -0.201 -6.498 -2.555 10 HE1 PHE 2 HE1 PHE 2 3.262 -8.604 0.233 11 HE2 PHE 2 HE2 PHE 2 0.046 -8.946 -2.544 12 HZ PHE 2 HZ PHE 2 1.779 -10.002 -1.149 13 H ILE 3 H ILE 3 0.546 -3.677 -3.838 14 HA ILE 3 HA ILE 3 1.305 -5.800 -5.549 15 HB ILE 3 HB ILE 3 -0.399 -3.375 -6.130 16 HG12 ILE 3 HG12 ILE 3 -1.586 -6.067 -5.843 17 HG13 ILE 3 HG13 ILE 3 -0.931 -5.367 -4.367 18 HG21 ILE 3 HG21 ILE 3 0.305 -4.203 -8.223 19 HG22 ILE 3 HG22 ILE 3 0.116 -5.880 -7.710 20 HG23 ILE 3 HG23 ILE 3 -1.307 -4.869 -7.964 21 HD11 ILE 3 HD11 ILE 3 -2.369 -3.471 -4.556 22 HD12 ILE 3 HD12 ILE 3 -2.916 -3.985 -6.152 23 HD13 ILE 3 HD13 ILE 3 -3.344 -4.931 -4.726 24 H VAL 4 H VAL 4 2.124 -2.393 -5.429 25 HA VAL 4 HA VAL 4 3.250 -2.122 -7.985 26 HB VAL 4 HB VAL 4 4.020 -0.690 -5.437 27 HG11 VAL 4 HG11 VAL 4 4.752 -0.282 -8.305 28 HG12 VAL 4 HG12 VAL 4 4.629 1.106 -7.224 29 HG13 VAL 4 HG13 VAL 4 5.765 -0.194 -6.864 30 HG21 VAL 4 HG21 VAL 4 2.528 1.092 -6.312 31 HG22 VAL 4 HG22 VAL 4 2.017 -0.013 -7.588 32 HG23 VAL 4 HG23 VAL 4 1.677 -0.397 -5.901 33 H LYS 5 H LYS 5 4.938 -2.608 -4.876 34 HA LYS 5 HA LYS 5 7.471 -3.059 -5.983 35 HB2 LYS 5 HB2 LYS 5 8.160 -3.685 -3.836 36 HB3 LYS 5 HB3 LYS 5 6.818 -2.587 -3.540 37 HG2 LYS 5 HG2 LYS 5 5.332 -4.497 -3.192 38 HG3 LYS 5 HG3 LYS 5 6.684 -5.595 -3.479 39 HD2 LYS 5 HD2 LYS 5 7.573 -5.239 -1.435 40 HD3 LYS 5 HD3 LYS 5 7.147 -3.526 -1.435 41 HE2 LYS 5 HE2 LYS 5 5.232 -3.890 -0.333 42 HE3 LYS 5 HE3 LYS 5 4.834 -5.302 -1.310 43 HZ1 LYS 5 HZ1 LYS 5 6.046 -6.698 0.077 44 HZ2 LYS 5 HZ2 LYS 5 6.912 -5.428 0.785 45 HZ3 LYS 5 HZ3 LYS 5 5.277 -5.650 1.160 46 H ARG 6 H ARG 6 4.773 -5.215 -5.403 47 HA ARG 6 HA ARG 6 6.190 -7.646 -5.773 48 HB2 ARG 6 HB2 ARG 6 3.340 -6.822 -5.640 49 HB3 ARG 6 HB3 ARG 6 3.688 -8.351 -6.436 50 HG2 ARG 6 HG2 ARG 6 5.114 -8.126 -3.937 51 HG3 ARG 6 HG3 ARG 6 3.376 -7.912 -3.715 52 HD2 ARG 6 HD2 ARG 6 4.722 -10.222 -5.112 53 HD3 ARG 6 HD3 ARG 6 4.010 -10.258 -3.499 54 HE ARG 6 HE ARG 6 2.149 -9.440 -5.513 55 HH11 ARG 6 HH11 ARG 6 3.651 -12.191 -3.997 56 HH12 ARG 6 HH12 ARG 6 2.353 -13.274 -4.379 57 HH21 ARG 6 HH21 ARG 6 0.434 -10.856 -6.021 58 HH22 ARG 6 HH22 ARG 6 0.524 -12.513 -5.530 59 H PHE 7 H PHE 7 4.127 -5.721 -7.943 60 HA PHE 7 HA PHE 7 4.326 -7.332 -10.202 61 HB2 PHE 7 HB2 PHE 7 2.952 -5.120 -9.689 62 HB3 PHE 7 HB3 PHE 7 4.293 -4.369 -10.547 63 HD1 PHE 7 HD1 PHE 7 2.058 -7.334 -10.943 64 HD2 PHE 7 HD2 PHE 7 3.992 -4.021 -12.787 65 HE1 PHE 7 HE1 PHE 7 1.003 -7.917 -13.088 66 HE2 PHE 7 HE2 PHE 7 2.940 -4.598 -14.935 67 HZ PHE 7 HZ PHE 7 1.442 -6.548 -15.087 68 H LYS 8 H LYS 8 6.265 -4.446 -9.411 69 HA LYS 8 HA LYS 8 8.008 -4.512 -11.552 70 HB2 LYS 8 HB2 LYS 8 8.293 -3.553 -8.723 71 HB3 LYS 8 HB3 LYS 8 9.669 -3.491 -9.817 72 HG2 LYS 8 HG2 LYS 8 7.100 -2.342 -10.757 73 HG3 LYS 8 HG3 LYS 8 8.009 -1.457 -9.530 74 HD2 LYS 8 HD2 LYS 8 10.026 -1.745 -11.074 75 HD3 LYS 8 HD3 LYS 8 8.858 -2.213 -12.312 76 HE2 LYS 8 HE2 LYS 8 8.488 0.323 -10.769 77 HE3 LYS 8 HE3 LYS 8 9.613 0.267 -12.124 78 HZ1 LYS 8 HZ1 LYS 8 7.522 -0.828 -13.273 79 HZ2 LYS 8 HZ2 LYS 8 6.699 0.096 -12.120 80 HZ3 LYS 8 HZ3 LYS 8 7.736 0.849 -13.224 81 H ILE 9 H ILE 9 8.364 -6.121 -8.402 82 HA ILE 9 HA ILE 9 10.851 -7.329 -8.967 83 HB ILE 9 HB ILE 9 8.690 -8.101 -7.009 84 HG12 ILE 9 HG12 ILE 9 11.389 -6.888 -6.437 85 HG13 ILE 9 HG13 ILE 9 9.981 -5.894 -6.791 86 HG21 ILE 9 HG21 ILE 9 11.136 -9.492 -7.791 87 HG22 ILE 9 HG22 ILE 9 11.007 -9.198 -6.056 88 HG23 ILE 9 HG23 ILE 9 9.732 -10.078 -6.900 89 HD11 ILE 9 HD11 ILE 9 9.445 -5.981 -4.652 90 HD12 ILE 9 HD12 ILE 9 9.184 -7.717 -4.814 91 HD13 ILE 9 HD13 ILE 9 10.766 -7.105 -4.331 92 H LEU 10 H LEU 10 7.539 -8.294 -9.583 93 HA LEU 10 HA LEU 10 8.127 -10.994 -10.276 94 HB2 LEU 10 HB2 LEU 10 5.924 -11.035 -9.997 95 HB3 LEU 10 HB3 LEU 10 5.815 -9.281 -10.133 96 HG LEU 10 HG LEU 10 5.821 -9.598 -12.640 97 HD11 LEU 10 HD11 LEU 10 4.742 -12.187 -12.747 98 HD12 LEU 10 HD12 LEU 10 6.255 -11.614 -13.450 99 HD13 LEU 10 HD13 LEU 10 6.244 -12.312 -11.830 100 HD21 LEU 10 HD21 LEU 10 3.500 -10.942 -11.281 101 HD22 LEU 10 HD22 LEU 10 3.802 -9.209 -11.153 102 HD23 LEU 10 HD23 LEU 10 3.492 -9.935 -12.729 103 H VAL 11 H VAL 11 7.857 -7.981 -12.078 104 HA VAL 11 HA VAL 11 8.280 -9.332 -14.617 105 HB VAL 11 HB VAL 11 8.060 -7.149 -15.643 106 HG11 VAL 11 HG11 VAL 11 6.070 -8.502 -14.431 107 HG12 VAL 11 HG12 VAL 11 5.908 -6.933 -13.642 108 HG13 VAL 11 HG13 VAL 11 5.819 -7.049 -15.400 109 HG21 VAL 11 HG21 VAL 11 8.045 -6.092 -12.819 110 HG22 VAL 11 HG22 VAL 11 9.263 -5.791 -14.058 111 HG23 VAL 11 HG23 VAL 11 7.634 -5.143 -14.248 Start of MODEL 18 1 H1 GLY 1 H GLY 1 0.197 0.112 -0.082 2 HA2 GLY 1 HA2 GLY 1 1.296 0.037 -2.097 3 HA3 GLY 1 HA3 GLY 1 2.617 0.833 -1.254 4 H PHE 2 H PHE 2 1.204 -2.326 -1.978 5 HA PHE 2 HA PHE 2 3.906 -3.478 -1.755 6 HB2 PHE 2 HB2 PHE 2 2.643 -5.656 -1.214 7 HB3 PHE 2 HB3 PHE 2 2.759 -4.440 0.055 8 HD1 PHE 2 HD1 PHE 2 0.549 -6.243 -2.189 9 HD2 PHE 2 HD2 PHE 2 0.802 -3.093 0.663 10 HE1 PHE 2 HE1 PHE 2 -1.902 -6.249 -1.970 11 HE2 PHE 2 HE2 PHE 2 -1.648 -3.094 0.887 12 HZ PHE 2 HZ PHE 2 -3.003 -4.674 -0.430 13 H ILE 3 H ILE 3 0.802 -3.514 -3.408 14 HA ILE 3 HA ILE 3 1.198 -5.545 -5.239 15 HB ILE 3 HB ILE 3 -0.192 -2.910 -5.738 16 HG12 ILE 3 HG12 ILE 3 -1.255 -5.558 -4.731 17 HG13 ILE 3 HG13 ILE 3 -1.075 -4.088 -3.779 18 HG21 ILE 3 HG21 ILE 3 0.372 -5.060 -7.491 19 HG22 ILE 3 HG22 ILE 3 -1.357 -5.090 -7.142 20 HG23 ILE 3 HG23 ILE 3 -0.613 -3.629 -7.793 21 HD11 ILE 3 HD11 ILE 3 -3.254 -3.860 -4.273 22 HD12 ILE 3 HD12 ILE 3 -2.618 -3.158 -5.761 23 HD13 ILE 3 HD13 ILE 3 -3.139 -4.842 -5.734 24 H VAL 4 H VAL 4 1.918 -2.084 -5.732 25 HA VAL 4 HA VAL 4 3.087 -2.258 -8.231 26 HB VAL 4 HB VAL 4 3.952 -0.397 -6.014 27 HG11 VAL 4 HG11 VAL 4 4.318 1.099 -8.104 28 HG12 VAL 4 HG12 VAL 4 5.526 -0.117 -7.688 29 HG13 VAL 4 HG13 VAL 4 4.364 -0.433 -8.976 30 HG21 VAL 4 HG21 VAL 4 1.627 -0.114 -6.184 31 HG22 VAL 4 HG22 VAL 4 2.310 1.166 -7.186 32 HG23 VAL 4 HG23 VAL 4 1.648 -0.285 -7.939 33 H LYS 5 H LYS 5 4.536 -2.791 -5.057 34 HA LYS 5 HA LYS 5 7.211 -3.021 -5.926 35 HB2 LYS 5 HB2 LYS 5 5.773 -3.275 -3.477 36 HB3 LYS 5 HB3 LYS 5 6.786 -4.700 -3.664 37 HG2 LYS 5 HG2 LYS 5 8.693 -3.547 -3.372 38 HG3 LYS 5 HG3 LYS 5 8.098 -2.132 -4.244 39 HD2 LYS 5 HD2 LYS 5 6.519 -2.110 -2.025 40 HD3 LYS 5 HD3 LYS 5 8.028 -2.756 -1.375 41 HE2 LYS 5 HE2 LYS 5 8.046 -0.331 -3.129 42 HE3 LYS 5 HE3 LYS 5 7.645 -0.188 -1.419 43 HZ1 LYS 5 HZ1 LYS 5 10.154 -1.331 -2.524 44 HZ2 LYS 5 HZ2 LYS 5 9.994 0.185 -1.791 45 HZ3 LYS 5 HZ3 LYS 5 9.768 -1.223 -0.880 46 H ARG 6 H ARG 6 4.834 -5.552 -5.108 47 HA ARG 6 HA ARG 6 6.350 -7.766 -5.778 48 HB2 ARG 6 HB2 ARG 6 3.378 -7.288 -5.946 49 HB3 ARG 6 HB3 ARG 6 4.103 -8.857 -6.275 50 HG2 ARG 6 HG2 ARG 6 4.657 -7.436 -3.704 51 HG3 ARG 6 HG3 ARG 6 3.175 -8.369 -3.922 52 HD2 ARG 6 HD2 ARG 6 4.319 -10.196 -3.384 53 HD3 ARG 6 HD3 ARG 6 5.244 -9.997 -4.872 54 HE ARG 6 HE ARG 6 6.497 -8.353 -3.115 55 HH11 ARG 6 HH11 ARG 6 5.597 -11.715 -3.061 56 HH12 ARG 6 HH12 ARG 6 6.921 -12.188 -2.049 57 HH21 ARG 6 HH21 ARG 6 8.244 -8.963 -1.781 58 HH22 ARG 6 HH22 ARG 6 8.426 -10.622 -1.321 59 H PHE 7 H PHE 7 4.132 -5.929 -7.870 60 HA PHE 7 HA PHE 7 4.382 -7.391 -10.194 61 HB2 PHE 7 HB2 PHE 7 3.008 -5.204 -9.589 62 HB3 PHE 7 HB3 PHE 7 4.351 -4.415 -10.410 63 HD1 PHE 7 HD1 PHE 7 1.709 -6.974 -10.831 64 HD2 PHE 7 HD2 PHE 7 4.465 -4.355 -12.744 65 HE1 PHE 7 HE1 PHE 7 0.659 -7.460 -13.003 66 HE2 PHE 7 HE2 PHE 7 3.420 -4.837 -14.918 67 HZ PHE 7 HZ PHE 7 1.513 -6.390 -15.050 68 H LYS 8 H LYS 8 6.295 -4.504 -9.336 69 HA LYS 8 HA LYS 8 8.047 -4.508 -11.462 70 HB2 LYS 8 HB2 LYS 8 8.273 -3.596 -8.621 71 HB3 LYS 8 HB3 LYS 8 9.701 -3.557 -9.647 72 HG2 LYS 8 HG2 LYS 8 8.425 -2.178 -11.272 73 HG3 LYS 8 HG3 LYS 8 7.094 -2.126 -10.114 74 HD2 LYS 8 HD2 LYS 8 8.512 -1.023 -8.487 75 HD3 LYS 8 HD3 LYS 8 9.901 -1.157 -9.569 76 HE2 LYS 8 HE2 LYS 8 8.326 0.133 -11.227 77 HE3 LYS 8 HE3 LYS 8 7.514 0.625 -9.742 78 HZ1 LYS 8 HZ1 LYS 8 9.640 1.874 -10.818 79 HZ2 LYS 8 HZ2 LYS 8 9.185 1.982 -9.192 80 HZ3 LYS 8 HZ3 LYS 8 10.385 0.887 -9.663 81 H ILE 9 H ILE 9 8.103 -6.483 -8.561 82 HA ILE 9 HA ILE 9 10.712 -7.564 -9.032 83 HB ILE 9 HB ILE 9 8.483 -8.579 -7.264 84 HG12 ILE 9 HG12 ILE 9 10.983 -7.190 -6.345 85 HG13 ILE 9 HG13 ILE 9 9.586 -6.255 -6.867 86 HG21 ILE 9 HG21 ILE 9 9.710 -10.398 -6.942 87 HG22 ILE 9 HG22 ILE 9 10.943 -9.791 -8.048 88 HG23 ILE 9 HG23 ILE 9 11.020 -9.387 -6.333 89 HD11 ILE 9 HD11 ILE 9 10.019 -7.801 -4.415 90 HD12 ILE 9 HD12 ILE 9 9.024 -6.374 -4.705 91 HD13 ILE 9 HD13 ILE 9 8.421 -7.973 -5.142 92 H LEU 10 H LEU 10 7.411 -8.557 -9.753 93 HA LEU 10 HA LEU 10 8.006 -11.177 -10.619 94 HB2 LEU 10 HB2 LEU 10 5.806 -11.336 -10.964 95 HB3 LEU 10 HB3 LEU 10 5.730 -9.752 -10.194 96 HG LEU 10 HG LEU 10 6.017 -8.883 -12.652 97 HD11 LEU 10 HD11 LEU 10 5.420 -11.754 -12.977 98 HD12 LEU 10 HD12 LEU 10 4.494 -10.642 -13.986 99 HD13 LEU 10 HD13 LEU 10 6.256 -10.635 -14.054 100 HD21 LEU 10 HD21 LEU 10 3.900 -9.195 -10.909 101 HD22 LEU 10 HD22 LEU 10 3.897 -8.244 -12.394 102 HD23 LEU 10 HD23 LEU 10 3.308 -9.906 -12.411 103 H VAL 11 H VAL 11 8.208 -8.065 -12.165 104 HA VAL 11 HA VAL 11 8.807 -9.338 -14.744 105 HB VAL 11 HB VAL 11 7.155 -7.644 -14.996 106 HG11 VAL 11 HG11 VAL 11 8.284 -5.218 -14.286 107 HG12 VAL 11 HG12 VAL 11 7.019 -6.081 -13.412 108 HG13 VAL 11 HG13 VAL 11 8.709 -6.293 -12.954 109 HG21 VAL 11 HG21 VAL 11 8.931 -7.706 -16.706 110 HG22 VAL 11 HG22 VAL 11 8.225 -6.100 -16.525 111 HG23 VAL 11 HG23 VAL 11 9.802 -6.454 -15.821 Start of MODEL 19 1 H1 GLY 1 H GLY 1 1.493 -0.348 -3.074 2 HA2 GLY 1 HA2 GLY 1 3.677 0.473 -2.016 3 HA3 GLY 1 HA3 GLY 1 2.862 0.107 -0.503 4 H PHE 2 H PHE 2 1.541 -2.270 -1.478 5 HA PHE 2 HA PHE 2 3.861 -4.065 -1.447 6 HB2 PHE 2 HB2 PHE 2 1.478 -4.047 0.028 7 HB3 PHE 2 HB3 PHE 2 1.314 -5.392 -1.096 8 HD1 PHE 2 HD1 PHE 2 2.196 -4.680 2.100 9 HD2 PHE 2 HD2 PHE 2 3.756 -6.683 -1.317 10 HE1 PHE 2 HE1 PHE 2 3.610 -6.066 3.561 11 HE2 PHE 2 HE2 PHE 2 5.171 -8.072 0.139 12 HZ PHE 2 HZ PHE 2 5.099 -7.765 2.582 13 H ILE 3 H ILE 3 0.896 -3.348 -3.194 14 HA ILE 3 HA ILE 3 0.984 -5.549 -4.966 15 HB ILE 3 HB ILE 3 -0.218 -2.856 -5.587 16 HG12 ILE 3 HG12 ILE 3 -1.032 -3.481 -3.404 17 HG13 ILE 3 HG13 ILE 3 -2.310 -3.784 -4.576 18 HG21 ILE 3 HG21 ILE 3 -0.011 -4.710 -7.339 19 HG22 ILE 3 HG22 ILE 3 -1.239 -5.557 -6.399 20 HG23 ILE 3 HG23 ILE 3 -1.599 -3.980 -7.102 21 HD11 ILE 3 HD11 ILE 3 -1.757 -6.157 -4.565 22 HD12 ILE 3 HD12 ILE 3 -0.472 -5.853 -3.396 23 HD13 ILE 3 HD13 ILE 3 -2.155 -5.576 -2.948 24 H VAL 4 H VAL 4 1.799 -2.126 -5.571 25 HA VAL 4 HA VAL 4 2.886 -2.420 -8.095 26 HB VAL 4 HB VAL 4 3.803 -0.487 -5.961 27 HG11 VAL 4 HG11 VAL 4 4.186 -0.561 -8.942 28 HG12 VAL 4 HG12 VAL 4 4.349 0.922 -8.001 29 HG13 VAL 4 HG13 VAL 4 5.414 -0.447 -7.681 30 HG21 VAL 4 HG21 VAL 4 2.228 1.041 -7.344 31 HG22 VAL 4 HG22 VAL 4 1.501 -0.476 -7.873 32 HG23 VAL 4 HG23 VAL 4 1.533 -0.065 -6.158 33 H LYS 5 H LYS 5 4.413 -2.878 -4.949 34 HA LYS 5 HA LYS 5 7.061 -3.170 -5.861 35 HB2 LYS 5 HB2 LYS 5 5.670 -3.356 -3.386 36 HB3 LYS 5 HB3 LYS 5 6.632 -4.817 -3.569 37 HG2 LYS 5 HG2 LYS 5 8.639 -3.515 -3.855 38 HG3 LYS 5 HG3 LYS 5 7.707 -2.016 -3.827 39 HD2 LYS 5 HD2 LYS 5 6.993 -2.543 -1.522 40 HD3 LYS 5 HD3 LYS 5 8.007 -3.987 -1.561 41 HE2 LYS 5 HE2 LYS 5 9.874 -2.813 -1.180 42 HE3 LYS 5 HE3 LYS 5 9.428 -1.564 -2.341 43 HZ1 LYS 5 HZ1 LYS 5 9.612 -0.835 0.038 44 HZ2 LYS 5 HZ2 LYS 5 8.153 -0.447 -0.725 45 HZ3 LYS 5 HZ3 LYS 5 8.221 -1.744 0.359 46 H ARG 6 H ARG 6 4.449 -5.504 -5.381 47 HA ARG 6 HA ARG 6 5.964 -7.826 -5.886 48 HB2 ARG 6 HB2 ARG 6 3.028 -7.195 -6.042 49 HB3 ARG 6 HB3 ARG 6 3.643 -8.774 -6.513 50 HG2 ARG 6 HG2 ARG 6 4.042 -7.505 -3.812 51 HG3 ARG 6 HG3 ARG 6 2.814 -8.711 -4.198 52 HD2 ARG 6 HD2 ARG 6 5.806 -9.062 -4.322 53 HD3 ARG 6 HD3 ARG 6 4.702 -9.792 -3.157 54 HE ARG 6 HE ARG 6 3.896 -10.539 -5.731 55 HH11 ARG 6 HH11 ARG 6 6.536 -11.050 -3.520 56 HH12 ARG 6 HH12 ARG 6 6.919 -12.624 -4.136 57 HH21 ARG 6 HH21 ARG 6 4.391 -12.609 -6.551 58 HH22 ARG 6 HH22 ARG 6 5.699 -13.509 -5.861 59 H PHE 7 H PHE 7 4.135 -5.672 -8.005 60 HA PHE 7 HA PHE 7 4.335 -7.210 -10.352 61 HB2 PHE 7 HB2 PHE 7 2.965 -5.011 -9.758 62 HB3 PHE 7 HB3 PHE 7 4.343 -4.233 -10.530 63 HD1 PHE 7 HD1 PHE 7 1.764 -6.849 -11.072 64 HD2 PHE 7 HD2 PHE 7 4.444 -4.056 -12.842 65 HE1 PHE 7 HE1 PHE 7 0.774 -7.302 -13.279 66 HE2 PHE 7 HE2 PHE 7 3.458 -4.504 -15.051 67 HZ PHE 7 HZ PHE 7 1.620 -6.128 -15.272 68 H LYS 8 H LYS 8 6.229 -4.343 -9.391 69 HA LYS 8 HA LYS 8 8.073 -4.371 -11.448 70 HB2 LYS 8 HB2 LYS 8 9.566 -3.132 -9.931 71 HB3 LYS 8 HB3 LYS 8 7.915 -2.531 -9.862 72 HG2 LYS 8 HG2 LYS 8 7.537 -3.711 -7.783 73 HG3 LYS 8 HG3 LYS 8 9.154 -4.414 -7.865 74 HD2 LYS 8 HD2 LYS 8 9.195 -2.550 -6.344 75 HD3 LYS 8 HD3 LYS 8 10.098 -2.117 -7.798 76 HE2 LYS 8 HE2 LYS 8 7.345 -1.411 -8.136 77 HE3 LYS 8 HE3 LYS 8 7.936 -0.745 -6.614 78 HZ1 LYS 8 HZ1 LYS 8 9.218 0.720 -7.676 79 HZ2 LYS 8 HZ2 LYS 8 9.762 -0.408 -8.813 80 HZ3 LYS 8 HZ3 LYS 8 8.282 0.380 -9.044 81 H ILE 9 H ILE 9 8.014 -6.272 -8.493 82 HA ILE 9 HA ILE 9 10.637 -7.362 -8.829 83 HB ILE 9 HB ILE 9 8.315 -8.243 -7.115 84 HG12 ILE 9 HG12 ILE 9 10.931 -7.075 -6.197 85 HG13 ILE 9 HG13 ILE 9 9.603 -6.036 -6.700 86 HG21 ILE 9 HG21 ILE 9 10.026 -9.634 -5.931 87 HG22 ILE 9 HG22 ILE 9 9.611 -10.197 -7.550 88 HG23 ILE 9 HG23 ILE 9 11.120 -9.325 -7.279 89 HD11 ILE 9 HD11 ILE 9 9.123 -6.120 -4.504 90 HD12 ILE 9 HD12 ILE 9 8.298 -7.606 -4.976 91 HD13 ILE 9 HD13 ILE 9 9.915 -7.679 -4.275 92 H LEU 10 H LEU 10 7.382 -8.350 -9.719 93 HA LEU 10 HA LEU 10 8.017 -10.996 -10.491 94 HB2 LEU 10 HB2 LEU 10 5.835 -11.163 -10.918 95 HB3 LEU 10 HB3 LEU 10 5.722 -9.554 -10.210 96 HG LEU 10 HG LEU 10 6.122 -8.768 -12.677 97 HD11 LEU 10 HD11 LEU 10 6.198 -11.486 -13.089 98 HD12 LEU 10 HD12 LEU 10 4.554 -11.053 -13.558 99 HD13 LEU 10 HD13 LEU 10 5.929 -10.256 -14.324 100 HD21 LEU 10 HD21 LEU 10 4.081 -8.034 -12.194 101 HD22 LEU 10 HD22 LEU 10 3.450 -9.556 -12.824 102 HD23 LEU 10 HD23 LEU 10 3.790 -9.388 -11.102 103 H VAL 11 H VAL 11 8.286 -7.913 -12.084 104 HA VAL 11 HA VAL 11 8.821 -9.143 -14.671 105 HB VAL 11 HB VAL 11 9.014 -6.853 -15.519 106 HG11 VAL 11 HG11 VAL 11 6.716 -6.229 -15.301 107 HG12 VAL 11 HG12 VAL 11 6.800 -7.990 -15.296 108 HG13 VAL 11 HG13 VAL 11 6.565 -7.115 -13.783 109 HG21 VAL 11 HG21 VAL 11 8.664 -4.931 -14.114 110 HG22 VAL 11 HG22 VAL 11 8.401 -5.960 -12.705 111 HG23 VAL 11 HG23 VAL 11 9.996 -5.882 -13.455 Start of MODEL 20 1 H1 GLY 1 H GLY 1 0.410 0.229 -2.024 2 HA2 GLY 1 HA2 GLY 1 3.183 0.536 -2.530 3 HA3 GLY 1 HA3 GLY 1 2.460 0.062 -1.000 4 H PHE 2 H PHE 2 1.706 -2.251 -0.890 5 HA PHE 2 HA PHE 2 3.852 -3.976 -1.356 6 HB2 PHE 2 HB2 PHE 2 1.413 -4.106 -0.004 7 HB3 PHE 2 HB3 PHE 2 1.322 -5.392 -1.204 8 HD1 PHE 2 HD1 PHE 2 1.917 -4.981 2.051 9 HD2 PHE 2 HD2 PHE 2 3.938 -6.482 -1.381 10 HE1 PHE 2 HE1 PHE 2 3.297 -6.417 3.495 11 HE2 PHE 2 HE2 PHE 2 5.320 -7.922 0.058 12 HZ PHE 2 HZ PHE 2 5.000 -7.891 2.499 13 H ILE 3 H ILE 3 0.825 -3.554 -3.154 14 HA ILE 3 HA ILE 3 1.171 -5.610 -5.010 15 HB ILE 3 HB ILE 3 -0.199 -2.950 -5.425 16 HG12 ILE 3 HG12 ILE 3 -1.270 -5.629 -4.511 17 HG13 ILE 3 HG13 ILE 3 -1.105 -4.185 -3.518 18 HG21 ILE 3 HG21 ILE 3 -0.465 -5.540 -6.946 19 HG22 ILE 3 HG22 ILE 3 -1.445 -4.096 -7.196 20 HG23 ILE 3 HG23 ILE 3 0.285 -4.058 -7.537 21 HD11 ILE 3 HD11 ILE 3 -2.937 -4.544 -5.876 22 HD12 ILE 3 HD12 ILE 3 -3.396 -4.465 -4.175 23 HD13 ILE 3 HD13 ILE 3 -2.729 -3.042 -4.975 24 H VAL 4 H VAL 4 1.920 -2.143 -5.409 25 HA VAL 4 HA VAL 4 3.082 -2.244 -7.909 26 HB VAL 4 HB VAL 4 3.945 -0.484 -5.609 27 HG11 VAL 4 HG11 VAL 4 4.597 -0.539 -8.503 28 HG12 VAL 4 HG12 VAL 4 4.353 1.036 -7.748 29 HG13 VAL 4 HG13 VAL 4 5.589 -0.058 -7.126 30 HG21 VAL 4 HG21 VAL 4 1.676 -0.344 -7.547 31 HG22 VAL 4 HG22 VAL 4 1.695 -0.014 -5.815 32 HG23 VAL 4 HG23 VAL 4 2.404 1.144 -6.942 33 H LYS 5 H LYS 5 4.540 -2.927 -4.768 34 HA LYS 5 HA LYS 5 7.205 -3.166 -5.649 35 HB2 LYS 5 HB2 LYS 5 5.728 -4.296 -3.278 36 HB3 LYS 5 HB3 LYS 5 7.438 -4.606 -3.545 37 HG2 LYS 5 HG2 LYS 5 6.236 -1.857 -3.312 38 HG3 LYS 5 HG3 LYS 5 6.971 -2.743 -1.974 39 HD2 LYS 5 HD2 LYS 5 8.988 -2.939 -3.662 40 HD3 LYS 5 HD3 LYS 5 8.244 -1.501 -4.364 41 HE2 LYS 5 HE2 LYS 5 9.166 -1.854 -1.514 42 HE3 LYS 5 HE3 LYS 5 9.922 -0.850 -2.750 43 HZ1 LYS 5 HZ1 LYS 5 7.551 0.222 -2.806 44 HZ2 LYS 5 HZ2 LYS 5 7.461 -0.389 -1.231 45 HZ3 LYS 5 HZ3 LYS 5 8.690 0.697 -1.648 46 H ARG 6 H ARG 6 4.741 -5.667 -5.037 47 HA ARG 6 HA ARG 6 6.206 -7.895 -5.760 48 HB2 ARG 6 HB2 ARG 6 3.317 -7.215 -5.706 49 HB3 ARG 6 HB3 ARG 6 3.777 -8.638 -6.631 50 HG2 ARG 6 HG2 ARG 6 5.154 -9.013 -4.307 51 HG3 ARG 6 HG3 ARG 6 3.681 -8.221 -3.743 52 HD2 ARG 6 HD2 ARG 6 3.868 -10.721 -5.418 53 HD3 ARG 6 HD3 ARG 6 3.369 -10.615 -3.731 54 HE ARG 6 HE ARG 6 1.746 -9.020 -5.466 55 HH11 ARG 6 HH11 ARG 6 2.264 -12.238 -4.242 56 HH12 ARG 6 HH12 ARG 6 0.624 -12.737 -4.490 57 HH21 ARG 6 HH21 ARG 6 -0.416 -9.666 -5.797 58 HH22 ARG 6 HH22 ARG 6 -0.900 -11.274 -5.376 59 H PHE 7 H PHE 7 4.127 -5.903 -7.858 60 HA PHE 7 HA PHE 7 4.485 -7.246 -10.240 61 HB2 PHE 7 HB2 PHE 7 3.091 -5.086 -9.593 62 HB3 PHE 7 HB3 PHE 7 4.478 -4.262 -10.298 63 HD1 PHE 7 HD1 PHE 7 2.196 -7.108 -11.086 64 HD2 PHE 7 HD2 PHE 7 4.372 -3.746 -12.526 65 HE1 PHE 7 HE1 PHE 7 1.261 -7.471 -13.333 66 HE2 PHE 7 HE2 PHE 7 3.441 -4.103 -14.775 67 HZ PHE 7 HZ PHE 7 1.883 -5.966 -15.181 68 H LYS 8 H LYS 8 6.386 -4.455 -9.093 69 HA LYS 8 HA LYS 8 8.234 -4.321 -11.131 70 HB2 LYS 8 HB2 LYS 8 8.392 -3.677 -8.205 71 HB3 LYS 8 HB3 LYS 8 9.818 -3.511 -9.221 72 HG2 LYS 8 HG2 LYS 8 7.226 -2.206 -9.961 73 HG3 LYS 8 HG3 LYS 8 8.351 -1.449 -8.831 74 HD2 LYS 8 HD2 LYS 8 9.613 -0.730 -10.515 75 HD3 LYS 8 HD3 LYS 8 9.785 -2.375 -11.130 76 HE2 LYS 8 HE2 LYS 8 7.374 -1.960 -12.056 77 HE3 LYS 8 HE3 LYS 8 7.811 -0.261 -11.874 78 HZ1 LYS 8 HZ1 LYS 8 8.367 -1.779 -14.030 79 HZ2 LYS 8 HZ2 LYS 8 9.180 -0.354 -13.618 80 HZ3 LYS 8 HZ3 LYS 8 9.826 -1.854 -13.177 81 H ILE 9 H ILE 9 8.133 -6.519 -8.395 82 HA ILE 9 HA ILE 9 10.740 -7.622 -8.907 83 HB ILE 9 HB ILE 9 8.493 -8.581 -7.133 84 HG12 ILE 9 HG12 ILE 9 11.138 -7.319 -6.394 85 HG13 ILE 9 HG13 ILE 9 9.636 -6.415 -6.548 86 HG21 ILE 9 HG21 ILE 9 10.811 -9.734 -6.211 87 HG22 ILE 9 HG22 ILE 9 9.557 -10.544 -7.150 88 HG23 ILE 9 HG23 ILE 9 10.969 -9.869 -7.962 89 HD11 ILE 9 HD11 ILE 9 10.600 -8.091 -4.378 90 HD12 ILE 9 HD12 ILE 9 9.389 -6.809 -4.375 91 HD13 ILE 9 HD13 ILE 9 8.939 -8.446 -4.853 92 H LEU 10 H LEU 10 7.440 -8.365 -9.786 93 HA LEU 10 HA LEU 10 7.973 -11.004 -10.744 94 HB2 LEU 10 HB2 LEU 10 5.762 -11.007 -10.538 95 HB3 LEU 10 HB3 LEU 10 5.704 -9.247 -10.481 96 HG LEU 10 HG LEU 10 5.787 -9.283 -13.005 97 HD11 LEU 10 HD11 LEU 10 6.112 -11.194 -14.075 98 HD12 LEU 10 HD12 LEU 10 6.207 -12.043 -12.532 99 HD13 LEU 10 HD13 LEU 10 4.653 -11.865 -13.346 100 HD21 LEU 10 HD21 LEU 10 3.405 -9.817 -13.221 101 HD22 LEU 10 HD22 LEU 10 3.437 -10.587 -11.634 102 HD23 LEU 10 HD23 LEU 10 3.730 -8.854 -11.779 103 H VAL 11 H VAL 11 7.789 -7.801 -12.215 104 HA VAL 11 HA VAL 11 8.151 -8.786 -14.891 105 HB VAL 11 HB VAL 11 6.939 -6.725 -14.603 106 HG11 VAL 11 HG11 VAL 11 7.527 -5.481 -12.836 107 HG12 VAL 11 HG12 VAL 11 9.190 -6.067 -12.859 108 HG13 VAL 11 HG13 VAL 11 8.705 -4.749 -13.925 109 HG21 VAL 11 HG21 VAL 11 9.635 -6.205 -15.856 110 HG22 VAL 11 HG22 VAL 11 8.248 -6.955 -16.648 111 HG23 VAL 11 HG23 VAL 11 8.168 -5.268 -16.140
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