NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
629193 | 6gs9 | 34284 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 HT1 GLY 1 42.240 2.497 2.349 2 H2 GLY 1 HT2 GLY 1 41.734 1.802 0.883 3 H3 GLY 1 HT3 GLY 1 41.254 1.119 2.364 4 HA2 GLY 1 HA1 GLY 1 39.484 2.341 2.396 5 HA3 GLY 1 HA2 GLY 1 40.507 3.772 2.388 6 H LEU 2 HN LEU 2 38.010 2.406 0.880 7 HA LEU 2 HA LEU 2 38.173 4.121 -1.390 8 HB2 LEU 2 HB2 LEU 2 38.355 2.533 -3.161 9 HB3 LEU 2 HB1 LEU 2 39.687 2.198 -2.061 10 HG LEU 2 HG LEU 2 37.075 0.668 -2.285 11 HD11 LEU 2 HD11 LEU 2 39.958 -0.188 -2.665 12 HD12 LEU 2 HD12 LEU 2 38.848 0.206 -3.978 13 HD13 LEU 2 HD13 LEU 2 38.525 -1.180 -2.936 14 HD21 LEU 2 HD21 LEU 2 38.251 -0.837 -0.539 15 HD22 LEU 2 HD22 LEU 2 37.543 0.662 0.050 16 HD23 LEU 2 HD23 LEU 2 39.284 0.555 -0.214 17 H PHE 3 HN PHE 3 36.581 2.408 0.862 18 HA PHE 3 HA PHE 3 33.988 2.503 -0.602 19 HB2 PHE 3 HB2 PHE 3 34.725 0.187 -0.051 20 HB3 PHE 3 HB1 PHE 3 34.762 0.634 1.655 21 HD1 PHE 3 HD1 PHE 3 32.565 0.219 -1.321 22 HD2 PHE 3 HD2 PHE 3 32.727 0.864 2.944 23 HE1 PHE 3 HE1 PHE 3 30.116 -0.214 -1.162 24 HE2 PHE 3 HE2 PHE 3 30.279 0.430 3.103 25 HZ PHE 3 HZ PHE 3 28.966 -0.067 1.044 26 H ASP 4 HN ASP 4 35.695 2.963 2.460 27 HA ASP 4 HA ASP 4 33.407 4.051 3.832 28 HB2 ASP 4 HB2 ASP 4 35.025 4.611 5.596 29 HB3 ASP 4 HB1 ASP 4 35.232 2.943 5.059 30 H ILE 5 HN ILE 5 36.098 5.309 1.965 31 HA ILE 5 HA ILE 5 35.717 8.054 2.704 32 HB ILE 5 HB ILE 5 37.047 7.050 0.171 33 HG12 ILE 5 HG12 ILE 5 38.206 7.318 2.967 34 HG13 ILE 5 HG11 ILE 5 37.941 5.805 2.103 35 HG21 ILE 5 HG21 ILE 5 37.730 9.443 1.901 36 HG22 ILE 5 HG22 ILE 5 36.578 9.542 0.570 37 HG23 ILE 5 HG23 ILE 5 38.254 9.110 0.250 38 HD11 ILE 5 HD1 ILE 5 39.928 7.993 1.481 39 HD12 ILE 5 HD2 ILE 5 39.455 6.814 0.258 40 HD13 ILE 5 HD3 ILE 5 40.234 6.278 1.746 41 H VAL 6 HN VAL 6 34.636 5.994 0.039 42 HA VAL 6 HA VAL 6 33.560 7.823 -1.709 43 HB VAL 6 HB VAL 6 32.281 5.199 -0.884 44 HG11 VAL 6 HG11 VAL 6 30.700 6.479 -2.159 45 HG12 VAL 6 HG12 VAL 6 31.421 5.322 -3.278 46 HG13 VAL 6 HG13 VAL 6 31.946 7.006 -3.292 47 HG21 VAL 6 HG21 VAL 6 34.163 5.768 -3.192 48 HG22 VAL 6 HG22 VAL 6 33.597 4.194 -2.631 49 HG23 VAL 6 HG23 VAL 6 34.710 5.136 -1.640 50 H LYS 7 HN LYS 7 32.396 6.934 1.457 51 HA LYS 7 HA LYS 7 29.742 7.864 1.256 52 HB2 LYS 7 HB2 LYS 7 31.625 7.680 3.616 53 HB3 LYS 7 HB1 LYS 7 29.923 8.119 3.762 54 HG2 LYS 7 HG2 LYS 7 29.293 5.981 2.674 55 HG3 LYS 7 HG1 LYS 7 30.998 5.537 2.590 56 HD2 LYS 7 HD2 LYS 7 31.185 5.544 5.003 57 HD3 LYS 7 HD1 LYS 7 29.552 6.190 5.172 58 HE2 LYS 7 HE2 LYS 7 29.835 3.654 5.510 59 HE3 LYS 7 HE1 LYS 7 28.557 4.173 4.410 60 HZ1 LYS 7 HZ1 LYS 7 31.291 3.447 3.522 61 HZ2 LYS 7 HZ2 LYS 7 29.929 3.724 2.546 62 HZ3 LYS 7 HZ3 LYS 7 29.995 2.354 3.548 63 H LYS 8 HN LYS 8 32.652 9.508 2.509 64 HA LYS 8 HA LYS 8 31.539 11.975 3.095 65 HB2 LYS 8 HB2 LYS 8 33.872 11.315 3.622 66 HB3 LYS 8 HB1 LYS 8 34.281 11.479 1.915 67 HG2 LYS 8 HG2 LYS 8 33.834 13.832 1.934 68 HG3 LYS 8 HG1 LYS 8 33.064 13.742 3.518 69 HD2 LYS 8 HD2 LYS 8 35.302 14.647 3.795 70 HD3 LYS 8 HD1 LYS 8 35.255 13.031 4.496 71 HE2 LYS 8 HE2 LYS 8 36.435 12.083 2.664 72 HE3 LYS 8 HE1 LYS 8 36.157 13.495 1.644 73 HZ1 LYS 8 HZ1 LYS 8 37.480 14.768 3.342 74 HZ2 LYS 8 HZ2 LYS 8 38.357 13.657 2.401 75 HZ3 LYS 8 HZ3 LYS 8 37.933 13.272 4.001 76 H VAL 9 HN VAL 9 32.800 10.803 -0.013 77 HA VAL 9 HA VAL 9 32.630 13.116 -1.522 78 HB VAL 9 HB VAL 9 31.806 10.384 -2.542 79 HG11 VAL 9 HG11 VAL 9 31.442 12.224 -4.110 80 HG12 VAL 9 HG12 VAL 9 32.819 11.262 -4.644 81 HG13 VAL 9 HG13 VAL 9 33.084 12.810 -3.841 82 HG21 VAL 9 HG21 VAL 9 34.244 10.113 -3.061 83 HG22 VAL 9 HG22 VAL 9 33.912 10.151 -1.329 84 HG23 VAL 9 HG23 VAL 9 34.568 11.577 -2.133 85 H VAL 10 HN VAL 10 30.127 10.582 -1.701 86 HA VAL 10 HA VAL 10 28.157 12.260 -2.803 87 HB VAL 10 HB VAL 10 26.536 10.494 -2.109 88 HG11 VAL 10 HG11 VAL 10 27.792 10.212 -4.186 89 HG12 VAL 10 HG12 VAL 10 27.623 8.649 -3.388 90 HG13 VAL 10 HG13 VAL 10 29.153 9.523 -3.300 91 HG21 VAL 10 HG21 VAL 10 27.492 9.893 0.048 92 HG22 VAL 10 HG22 VAL 10 28.991 9.373 -0.721 93 HG23 VAL 10 HG23 VAL 10 27.502 8.465 -0.987 94 H GLY 11 HN GLY 11 29.378 12.076 0.365 95 HA2 GLY 11 HA1 GLY 11 27.071 12.775 1.852 96 HA3 GLY 11 HA2 GLY 11 28.738 13.001 2.364 97 H ALA 12 HN ALA 12 29.443 14.656 0.075 98 HA ALA 12 HA ALA 12 29.000 17.193 1.108 99 HB1 ALA 12 HB1 ALA 12 29.421 16.527 -1.808 100 HB2 ALA 12 HB2 ALA 12 30.709 16.581 -0.604 101 HB3 ALA 12 HB3 ALA 12 29.808 18.045 -0.997 102 H PHE 13 HN PHE 13 27.427 15.845 -1.805 103 HA PHE 13 HA PHE 13 25.413 17.894 -1.831 104 HB2 PHE 13 HB2 PHE 13 25.401 15.257 -3.313 105 HB3 PHE 13 HB1 PHE 13 24.508 16.722 -3.726 106 HD1 PHE 13 HD1 PHE 13 25.669 18.718 -4.614 107 HD2 PHE 13 HD2 PHE 13 27.794 15.060 -3.756 108 HE1 PHE 13 HE1 PHE 13 27.616 19.539 -5.935 109 HE2 PHE 13 HE2 PHE 13 29.741 15.881 -5.077 110 HZ PHE 13 HZ PHE 13 29.662 18.132 -6.145 111 H GLY 14 HN GLY 14 25.760 15.877 0.496 112 HA2 GLY 14 HA1 GLY 14 23.429 14.283 0.606 113 HA3 GLY 14 HA2 GLY 14 24.412 14.769 1.981 114 H SER 15 HN SER 15 23.608 17.549 0.452 115 HA SER 15 HA SER 15 20.897 17.907 1.316 116 HB2 SER 15 HB2 SER 15 21.278 19.427 3.148 117 HB3 SER 15 HB1 SER 15 22.138 17.931 3.498 118 HG SER 15 HG SER 15 23.287 20.220 2.266 119 H LEU 16 HN LEU 16 23.376 18.574 -0.630 120 HA LEU 16 HA LEU 16 23.895 20.225 -2.135 121 HB2 LEU 16 HB2 LEU 16 21.707 19.744 -3.010 122 HB3 LEU 16 HB1 LEU 16 20.929 20.685 -1.742 123 HG LEU 16 HG LEU 16 21.781 22.756 -2.648 124 HD11 LEU 16 HD11 LEU 16 23.442 20.938 -4.409 125 HD12 LEU 16 HD12 LEU 16 23.993 22.237 -3.349 126 HD13 LEU 16 HD13 LEU 16 23.142 22.622 -4.842 127 HD21 LEU 16 HD21 LEU 16 19.777 21.835 -3.742 128 HD22 LEU 16 HD22 LEU 16 20.794 20.952 -4.880 129 HD23 LEU 16 HD23 LEU 16 20.767 22.715 -4.907 Start of MODEL 2 1 H1 GLY 1 HT1 GLY 1 39.144 -0.319 2.355 2 H2 GLY 1 HT2 GLY 1 37.675 -0.776 1.631 3 H3 GLY 1 HT3 GLY 1 38.078 -1.346 3.181 4 HA2 GLY 1 HA1 GLY 1 36.540 0.308 3.535 5 HA3 GLY 1 HA2 GLY 1 38.110 0.998 3.919 6 H LEU 2 HN LEU 2 38.053 0.594 0.656 7 HA LEU 2 HA LEU 2 38.109 3.287 0.014 8 HB2 LEU 2 HB2 LEU 2 38.006 2.644 -2.272 9 HB3 LEU 2 HB1 LEU 2 38.845 1.344 -1.437 10 HG LEU 2 HG LEU 2 35.934 1.351 -2.311 11 HD11 LEU 2 HD11 LEU 2 37.666 0.965 -4.066 12 HD12 LEU 2 HD12 LEU 2 36.636 -0.440 -3.795 13 HD13 LEU 2 HD13 LEU 2 38.268 -0.400 -3.126 14 HD21 LEU 2 HD21 LEU 2 36.096 -1.096 -1.501 15 HD22 LEU 2 HD22 LEU 2 35.965 0.136 -0.251 16 HD23 LEU 2 HD23 LEU 2 37.532 -0.587 -0.612 17 H PHE 3 HN PHE 3 35.446 1.548 1.059 18 HA PHE 3 HA PHE 3 33.445 3.065 -0.440 19 HB2 PHE 3 HB2 PHE 3 33.158 0.634 0.230 20 HB3 PHE 3 HB1 PHE 3 33.010 1.189 1.897 21 HD1 PHE 3 HD1 PHE 3 31.481 1.310 -1.487 22 HD2 PHE 3 HD2 PHE 3 31.018 2.338 2.680 23 HE1 PHE 3 HE1 PHE 3 29.081 1.845 -1.885 24 HE2 PHE 3 HE2 PHE 3 28.617 2.873 2.281 25 HZ PHE 3 HZ PHE 3 27.630 2.542 0.016 26 H ASP 4 HN ASP 4 34.916 2.965 2.750 27 HA ASP 4 HA ASP 4 33.119 4.712 4.068 28 HB2 ASP 4 HB2 ASP 4 36.062 4.207 4.576 29 HB3 ASP 4 HB1 ASP 4 34.968 5.038 5.682 30 H ILE 5 HN ILE 5 35.892 5.236 1.989 31 HA ILE 5 HA ILE 5 36.108 8.057 2.517 32 HB ILE 5 HB ILE 5 37.152 6.607 0.066 33 HG12 ILE 5 HG12 ILE 5 38.373 6.815 2.840 34 HG13 ILE 5 HG11 ILE 5 37.827 5.335 2.052 35 HG21 ILE 5 HG21 ILE 5 38.352 8.925 1.605 36 HG22 ILE 5 HG22 ILE 5 37.210 9.165 0.282 37 HG23 ILE 5 HG23 ILE 5 38.755 8.374 -0.022 38 HD11 ILE 5 HD1 ILE 5 40.188 7.076 1.332 39 HD12 ILE 5 HD2 ILE 5 39.498 5.942 0.169 40 HD13 ILE 5 HD3 ILE 5 40.168 5.351 1.691 41 H VAL 6 HN VAL 6 35.006 6.173 -0.317 42 HA VAL 6 HA VAL 6 34.041 8.300 -1.833 43 HB VAL 6 HB VAL 6 32.973 5.463 -1.686 44 HG11 VAL 6 HG11 VAL 6 32.495 7.721 -3.647 45 HG12 VAL 6 HG12 VAL 6 31.290 6.798 -2.749 46 HG13 VAL 6 HG13 VAL 6 32.194 6.031 -4.054 47 HG21 VAL 6 HG21 VAL 6 35.421 5.837 -2.304 48 HG22 VAL 6 HG22 VAL 6 34.842 6.719 -3.717 49 HG23 VAL 6 HG23 VAL 6 34.454 5.009 -3.523 50 H LYS 7 HN LYS 7 32.843 6.990 1.089 51 HA LYS 7 HA LYS 7 30.088 7.677 0.796 52 HB2 LYS 7 HB2 LYS 7 31.024 6.061 2.489 53 HB3 LYS 7 HB1 LYS 7 31.658 7.450 3.371 54 HG2 LYS 7 HG2 LYS 7 29.388 8.372 3.585 55 HG3 LYS 7 HG1 LYS 7 28.741 7.007 2.676 56 HD2 LYS 7 HD2 LYS 7 29.733 5.485 4.439 57 HD3 LYS 7 HD1 LYS 7 30.094 6.930 5.384 58 HE2 LYS 7 HE2 LYS 7 27.721 7.533 5.424 59 HE3 LYS 7 HE1 LYS 7 27.331 6.145 4.408 60 HZ1 LYS 7 HZ1 LYS 7 28.575 4.870 6.301 61 HZ2 LYS 7 HZ2 LYS 7 26.936 5.289 6.469 62 HZ3 LYS 7 HZ3 LYS 7 28.137 6.223 7.225 63 H LYS 8 HN LYS 8 32.948 9.365 1.966 64 HA LYS 8 HA LYS 8 31.577 11.612 3.061 65 HB2 LYS 8 HB2 LYS 8 33.877 11.072 3.705 66 HB3 LYS 8 HB1 LYS 8 34.419 11.347 2.048 67 HG2 LYS 8 HG2 LYS 8 33.920 13.680 2.164 68 HG3 LYS 8 HG1 LYS 8 32.999 13.485 3.655 69 HD2 LYS 8 HD2 LYS 8 35.210 14.432 4.146 70 HD3 LYS 8 HD1 LYS 8 35.073 12.816 4.837 71 HE2 LYS 8 HE2 LYS 8 36.442 11.857 3.152 72 HE3 LYS 8 HE1 LYS 8 36.273 13.261 2.096 73 HZ1 LYS 8 HZ1 LYS 8 37.305 14.211 4.470 74 HZ2 LYS 8 HZ2 LYS 8 38.127 14.032 2.993 75 HZ3 LYS 8 HZ3 LYS 8 38.168 12.787 4.149 76 H VAL 9 HN VAL 9 32.788 10.793 -0.135 77 HA VAL 9 HA VAL 9 32.639 13.358 -1.304 78 HB VAL 9 HB VAL 9 32.178 10.702 -2.694 79 HG11 VAL 9 HG11 VAL 9 31.594 12.591 -4.093 80 HG12 VAL 9 HG12 VAL 9 33.160 11.981 -4.629 81 HG13 VAL 9 HG13 VAL 9 33.072 13.440 -3.640 82 HG21 VAL 9 HG21 VAL 9 34.275 10.679 -1.393 83 HG22 VAL 9 HG22 VAL 9 34.754 12.209 -2.129 84 HG23 VAL 9 HG23 VAL 9 34.617 10.757 -3.121 85 H VAL 10 HN VAL 10 30.329 10.640 -1.541 86 HA VAL 10 HA VAL 10 28.290 12.187 -2.772 87 HB VAL 10 HB VAL 10 26.797 10.289 -2.231 88 HG11 VAL 10 HG11 VAL 10 28.252 10.107 -4.191 89 HG12 VAL 10 HG12 VAL 10 28.110 8.533 -3.411 90 HG13 VAL 10 HG13 VAL 10 29.566 9.501 -3.185 91 HG21 VAL 10 HG21 VAL 10 27.560 9.720 -0.012 92 HG22 VAL 10 HG22 VAL 10 29.191 9.396 -0.598 93 HG23 VAL 10 HG23 VAL 10 27.865 8.321 -1.042 94 H GLY 11 HN GLY 11 29.380 11.951 0.458 95 HA2 GLY 11 HA1 GLY 11 26.927 12.551 1.787 96 HA3 GLY 11 HA2 GLY 11 28.542 12.682 2.469 97 H ALA 12 HN ALA 12 29.193 14.431 0.021 98 HA ALA 12 HA ALA 12 28.836 16.931 1.313 99 HB1 ALA 12 HB1 ALA 12 29.496 16.412 -1.588 100 HB2 ALA 12 HB2 ALA 12 30.674 16.405 -0.276 101 HB3 ALA 12 HB3 ALA 12 29.812 17.890 -0.681 102 H PHE 13 HN PHE 13 27.301 15.515 -1.576 103 HA PHE 13 HA PHE 13 25.478 17.699 -1.922 104 HB2 PHE 13 HB2 PHE 13 25.502 14.889 -3.045 105 HB3 PHE 13 HB1 PHE 13 24.357 16.140 -3.530 106 HD1 PHE 13 HD1 PHE 13 27.888 15.055 -3.615 107 HD2 PHE 13 HD2 PHE 13 25.074 18.096 -4.823 108 HE1 PHE 13 HE1 PHE 13 29.569 15.979 -5.205 109 HE2 PHE 13 HE2 PHE 13 26.755 19.021 -6.413 110 HZ PHE 13 HZ PHE 13 29.013 17.979 -6.584 111 H GLY 14 HN GLY 14 25.555 14.936 0.103 112 HA2 GLY 14 HA1 GLY 14 22.782 14.470 0.410 113 HA3 GLY 14 HA2 GLY 14 24.039 14.004 1.549 114 H SER 15 HN SER 15 24.380 17.242 1.029 115 HA SER 15 HA SER 15 22.286 18.325 2.629 116 HB2 SER 15 HB2 SER 15 23.502 18.773 4.673 117 HB3 SER 15 HB1 SER 15 23.536 17.038 4.369 118 HG SER 15 HG SER 15 25.582 18.566 4.771 119 H LEU 16 HN LEU 16 22.368 19.779 0.845 120 HA LEU 16 HA LEU 16 23.982 22.083 1.324 121 HB2 LEU 16 HB2 LEU 16 25.736 20.854 0.240 122 HB3 LEU 16 HB1 LEU 16 24.657 20.324 -1.045 123 HG LEU 16 HG LEU 16 24.505 22.558 -1.948 124 HD11 LEU 16 HD11 LEU 16 25.921 23.354 0.608 125 HD12 LEU 16 HD12 LEU 16 24.393 23.962 -0.031 126 HD13 LEU 16 HD13 LEU 16 25.909 24.403 -0.812 127 HD21 LEU 16 HD21 LEU 16 26.548 21.232 -2.488 128 HD22 LEU 16 HD22 LEU 16 27.385 22.026 -1.155 129 HD23 LEU 16 HD23 LEU 16 26.841 22.970 -2.541 Start of MODEL 3 1 H1 GLY 1 HT1 GLY 1 39.645 2.613 2.985 2 H2 GLY 1 HT2 GLY 1 39.943 1.066 3.621 3 H3 GLY 1 HT3 GLY 1 38.750 2.059 4.313 4 HA2 GLY 1 HA1 GLY 1 38.659 0.383 1.994 5 HA3 GLY 1 HA2 GLY 1 37.379 0.862 3.102 6 H LEU 2 HN LEU 2 38.299 1.064 -0.003 7 HA LEU 2 HA LEU 2 38.039 3.729 -0.755 8 HB2 LEU 2 HB2 LEU 2 37.630 2.958 -2.963 9 HB3 LEU 2 HB1 LEU 2 38.693 1.766 -2.226 10 HG LEU 2 HG LEU 2 35.689 1.522 -2.619 11 HD11 LEU 2 HD11 LEU 2 37.061 1.148 -4.629 12 HD12 LEU 2 HD12 LEU 2 36.339 -0.361 -4.069 13 HD13 LEU 2 HD13 LEU 2 38.040 -0.024 -3.747 14 HD21 LEU 2 HD21 LEU 2 36.147 0.433 -0.536 15 HD22 LEU 2 HD22 LEU 2 37.678 -0.213 -1.125 16 HD23 LEU 2 HD23 LEU 2 36.155 -0.854 -1.737 17 H PHE 3 HN PHE 3 35.772 1.887 0.845 18 HA PHE 3 HA PHE 3 33.408 3.135 -0.357 19 HB2 PHE 3 HB2 PHE 3 33.243 0.797 0.329 20 HB3 PHE 3 HB1 PHE 3 33.720 1.221 1.974 21 HD1 PHE 3 HD1 PHE 3 31.102 1.821 -0.637 22 HD2 PHE 3 HD2 PHE 3 32.103 1.993 3.559 23 HE1 PHE 3 HE1 PHE 3 28.726 2.333 -0.090 24 HE2 PHE 3 HE2 PHE 3 29.726 2.504 4.105 25 HZ PHE 3 HZ PHE 3 28.060 2.771 2.270 26 H ASP 4 HN ASP 4 35.299 3.208 2.630 27 HA ASP 4 HA ASP 4 33.645 4.924 4.119 28 HB2 ASP 4 HB2 ASP 4 36.666 4.850 4.230 29 HB3 ASP 4 HB1 ASP 4 35.553 5.299 5.524 30 H ILE 5 HN ILE 5 36.059 5.553 1.644 31 HA ILE 5 HA ILE 5 36.142 8.394 2.045 32 HB ILE 5 HB ILE 5 36.877 6.932 -0.506 33 HG12 ILE 5 HG12 ILE 5 38.528 7.323 2.014 34 HG13 ILE 5 HG11 ILE 5 37.937 5.782 1.394 35 HG21 ILE 5 HG21 ILE 5 38.321 8.790 -0.896 36 HG22 ILE 5 HG22 ILE 5 38.148 9.371 0.761 37 HG23 ILE 5 HG23 ILE 5 36.796 9.494 -0.363 38 HD11 ILE 5 HD1 ILE 5 39.223 6.375 -0.774 39 HD12 ILE 5 HD2 ILE 5 40.176 5.894 0.628 40 HD13 ILE 5 HD3 ILE 5 40.036 7.598 0.203 41 H VAL 6 HN VAL 6 34.739 6.357 -0.535 42 HA VAL 6 HA VAL 6 33.401 8.352 -1.931 43 HB VAL 6 HB VAL 6 32.580 5.460 -1.507 44 HG11 VAL 6 HG11 VAL 6 30.623 6.610 -2.273 45 HG12 VAL 6 HG12 VAL 6 31.333 5.868 -3.705 46 HG13 VAL 6 HG13 VAL 6 31.558 7.592 -3.402 47 HG21 VAL 6 HG21 VAL 6 34.832 5.995 -2.589 48 HG22 VAL 6 HG22 VAL 6 33.926 6.759 -3.893 49 HG23 VAL 6 HG23 VAL 6 33.728 5.036 -3.573 50 H LYS 7 HN LYS 7 32.552 6.732 1.055 51 HA LYS 7 HA LYS 7 29.838 7.389 1.231 52 HB2 LYS 7 HB2 LYS 7 31.008 5.863 2.792 53 HB3 LYS 7 HB1 LYS 7 31.851 7.248 3.488 54 HG2 LYS 7 HG2 LYS 7 29.771 8.222 4.241 55 HG3 LYS 7 HG1 LYS 7 28.833 7.005 3.376 56 HD2 LYS 7 HD2 LYS 7 29.809 5.241 4.805 57 HD3 LYS 7 HD1 LYS 7 30.728 6.465 5.681 58 HE2 LYS 7 HE2 LYS 7 28.632 5.835 6.868 59 HE3 LYS 7 HE1 LYS 7 28.660 7.540 6.417 60 HZ1 LYS 7 HZ1 LYS 7 27.021 7.268 4.924 61 HZ2 LYS 7 HZ2 LYS 7 26.634 5.913 5.873 62 HZ3 LYS 7 HZ3 LYS 7 27.541 5.724 4.448 63 H LYS 8 HN LYS 8 32.713 9.237 2.193 64 HA LYS 8 HA LYS 8 31.251 11.452 3.253 65 HB2 LYS 8 HB2 LYS 8 34.113 11.237 2.286 66 HB3 LYS 8 HB1 LYS 8 33.447 12.619 3.156 67 HG2 LYS 8 HG2 LYS 8 32.878 11.142 5.058 68 HG3 LYS 8 HG1 LYS 8 33.568 9.769 4.191 69 HD2 LYS 8 HD2 LYS 8 35.766 10.823 4.180 70 HD3 LYS 8 HD1 LYS 8 35.104 12.278 4.925 71 HE2 LYS 8 HE2 LYS 8 34.950 9.548 6.224 72 HE3 LYS 8 HE1 LYS 8 36.265 10.683 6.526 73 HZ1 LYS 8 HZ1 LYS 8 34.984 11.861 7.879 74 HZ2 LYS 8 HZ2 LYS 8 33.827 10.620 7.788 75 HZ3 LYS 8 HZ3 LYS 8 33.730 11.954 6.741 76 H VAL 9 HN VAL 9 32.611 10.658 0.099 77 HA VAL 9 HA VAL 9 32.430 13.144 -1.152 78 HB VAL 9 HB VAL 9 31.939 10.415 -2.386 79 HG11 VAL 9 HG11 VAL 9 31.172 12.103 -3.911 80 HG12 VAL 9 HG12 VAL 9 32.782 11.638 -4.459 81 HG13 VAL 9 HG13 VAL 9 32.555 13.139 -3.561 82 HG21 VAL 9 HG21 VAL 9 34.484 12.062 -2.283 83 HG22 VAL 9 HG22 VAL 9 34.305 10.412 -2.879 84 HG23 VAL 9 HG23 VAL 9 34.129 10.752 -1.157 85 H VAL 10 HN VAL 10 30.056 10.497 -1.525 86 HA VAL 10 HA VAL 10 28.060 11.993 -2.750 87 HB VAL 10 HB VAL 10 26.466 10.269 -1.916 88 HG11 VAL 10 HG11 VAL 10 29.124 9.128 -2.834 89 HG12 VAL 10 HG12 VAL 10 27.922 9.859 -3.898 90 HG13 VAL 10 HG13 VAL 10 27.541 8.375 -3.027 91 HG21 VAL 10 HG21 VAL 10 27.490 8.390 -0.563 92 HG22 VAL 10 HG22 VAL 10 27.314 9.908 0.317 93 HG23 VAL 10 HG23 VAL 10 28.894 9.427 -0.304 94 H GLY 11 HN GLY 11 28.791 11.603 0.679 95 HA2 GLY 11 HA1 GLY 11 26.464 12.758 1.738 96 HA3 GLY 11 HA2 GLY 11 28.028 12.703 2.539 97 H ALA 12 HN ALA 12 29.517 14.231 0.706 98 HA ALA 12 HA ALA 12 28.762 16.878 1.546 99 HB1 ALA 12 HB1 ALA 12 30.779 17.557 0.256 100 HB2 ALA 12 HB2 ALA 12 30.960 15.883 -0.270 101 HB3 ALA 12 HB3 ALA 12 31.099 16.291 1.441 102 H PHE 13 HN PHE 13 26.892 15.471 -0.251 103 HA PHE 13 HA PHE 13 26.362 17.659 -2.041 104 HB2 PHE 13 HB2 PHE 13 28.110 16.343 -3.286 105 HB3 PHE 13 HB1 PHE 13 26.989 14.982 -3.306 106 HD1 PHE 13 HD1 PHE 13 25.223 14.870 -4.919 107 HD2 PHE 13 HD2 PHE 13 27.362 18.570 -4.306 108 HE1 PHE 13 HE1 PHE 13 24.080 15.860 -6.899 109 HE2 PHE 13 HE2 PHE 13 26.217 19.559 -6.285 110 HZ PHE 13 HZ PHE 13 24.631 18.180 -7.622 111 H GLY 14 HN GLY 14 25.438 15.178 -0.119 112 HA2 GLY 14 HA1 GLY 14 23.115 14.211 -1.459 113 HA3 GLY 14 HA2 GLY 14 23.481 14.033 0.252 114 H SER 15 HN SER 15 22.423 16.459 -2.122 115 HA SER 15 HA SER 15 20.951 18.214 -1.956 116 HB2 SER 15 HB2 SER 15 18.899 17.770 -0.860 117 HB3 SER 15 HB1 SER 15 19.490 16.190 -1.365 118 HG SER 15 HG SER 15 18.856 16.936 1.051 119 H LEU 16 HN LEU 16 23.272 18.805 -0.744 120 HA LEU 16 HA LEU 16 23.254 19.436 1.972 121 HB2 LEU 16 HB2 LEU 16 25.311 19.557 0.741 122 HB3 LEU 16 HB1 LEU 16 24.648 20.749 -0.372 123 HG LEU 16 HG LEU 16 24.598 22.443 1.346 124 HD11 LEU 16 HD11 LEU 16 25.519 21.814 3.674 125 HD12 LEU 16 HD12 LEU 16 25.223 20.139 3.206 126 HD13 LEU 16 HD13 LEU 16 23.882 21.281 3.295 127 HD21 LEU 16 HD21 LEU 16 26.788 22.015 0.271 128 HD22 LEU 16 HD22 LEU 16 27.185 20.871 1.553 129 HD23 LEU 16 HD23 LEU 16 26.985 22.581 1.930 Start of MODEL 4 1 H1 GLY 1 HT1 GLY 1 41.265 0.347 2.486 2 H2 GLY 1 HT2 GLY 1 41.057 0.385 0.800 3 H3 GLY 1 HT3 GLY 1 39.923 -0.413 1.782 4 HA2 GLY 1 HA1 GLY 1 38.936 1.449 2.452 5 HA3 GLY 1 HA2 GLY 1 40.423 2.379 2.315 6 H LEU 2 HN LEU 2 37.442 1.857 0.994 7 HA LEU 2 HA LEU 2 37.942 3.593 -1.220 8 HB2 LEU 2 HB2 LEU 2 37.085 1.834 -2.930 9 HB3 LEU 2 HB1 LEU 2 38.774 1.760 -2.440 10 HG LEU 2 HG LEU 2 38.187 0.018 -0.753 11 HD11 LEU 2 HD11 LEU 2 35.430 0.469 -1.912 12 HD12 LEU 2 HD12 LEU 2 35.910 0.324 -0.221 13 HD13 LEU 2 HD13 LEU 2 35.867 -1.105 -1.246 14 HD21 LEU 2 HD21 LEU 2 37.848 -1.782 -2.398 15 HD22 LEU 2 HD22 LEU 2 38.981 -0.582 -3.020 16 HD23 LEU 2 HD23 LEU 2 37.313 -0.601 -3.593 17 H PHE 3 HN PHE 3 36.080 2.316 1.106 18 HA PHE 3 HA PHE 3 33.500 3.018 -0.202 19 HB2 PHE 3 HB2 PHE 3 33.585 0.705 0.597 20 HB3 PHE 3 HB1 PHE 3 34.061 1.258 2.203 21 HD1 PHE 3 HD1 PHE 3 31.344 1.558 -0.368 22 HD2 PHE 3 HD2 PHE 3 32.407 1.875 3.804 23 HE1 PHE 3 HE1 PHE 3 28.943 1.870 0.221 24 HE2 PHE 3 HE2 PHE 3 30.005 2.186 4.391 25 HZ PHE 3 HZ PHE 3 28.279 2.227 2.595 26 H ASP 4 HN ASP 4 35.307 3.237 2.867 27 HA ASP 4 HA ASP 4 33.577 4.979 4.206 28 HB2 ASP 4 HB2 ASP 4 35.492 5.541 5.614 29 HB3 ASP 4 HB1 ASP 4 35.484 3.811 5.276 30 H ILE 5 HN ILE 5 36.067 5.594 1.806 31 HA ILE 5 HA ILE 5 36.072 8.444 2.114 32 HB ILE 5 HB ILE 5 36.907 6.913 -0.367 33 HG12 ILE 5 HG12 ILE 5 38.465 7.431 2.191 34 HG13 ILE 5 HG11 ILE 5 37.953 5.856 1.586 35 HG21 ILE 5 HG21 ILE 5 36.759 9.477 -0.324 36 HG22 ILE 5 HG22 ILE 5 38.315 8.795 -0.787 37 HG23 ILE 5 HG23 ILE 5 38.083 9.432 0.841 38 HD11 ILE 5 HD1 ILE 5 40.029 7.721 0.429 39 HD12 ILE 5 HD2 ILE 5 39.294 6.450 -0.550 40 HD13 ILE 5 HD3 ILE 5 40.213 6.032 0.895 41 H VAL 6 HN VAL 6 34.765 6.291 -0.419 42 HA VAL 6 HA VAL 6 33.465 8.175 -1.966 43 HB VAL 6 HB VAL 6 32.482 5.376 -1.329 44 HG11 VAL 6 HG11 VAL 6 30.712 6.604 -2.388 45 HG12 VAL 6 HG12 VAL 6 31.463 5.630 -3.650 46 HG13 VAL 6 HG13 VAL 6 31.827 7.350 -3.531 47 HG21 VAL 6 HG21 VAL 6 33.750 4.691 -3.279 48 HG22 VAL 6 HG22 VAL 6 34.841 5.568 -2.208 49 HG23 VAL 6 HG23 VAL 6 34.184 6.362 -3.639 50 H LYS 7 HN LYS 7 32.362 6.615 1.010 51 HA LYS 7 HA LYS 7 29.708 7.435 1.048 52 HB2 LYS 7 HB2 LYS 7 30.733 5.901 2.706 53 HB3 LYS 7 HB1 LYS 7 31.585 7.272 3.416 54 HG2 LYS 7 HG2 LYS 7 29.541 8.317 4.095 55 HG3 LYS 7 HG1 LYS 7 28.573 7.214 3.119 56 HD2 LYS 7 HD2 LYS 7 28.515 6.619 5.531 57 HD3 LYS 7 HD1 LYS 7 29.208 5.332 4.544 58 HE2 LYS 7 HE2 LYS 7 30.453 5.970 6.727 59 HE3 LYS 7 HE1 LYS 7 31.414 5.811 5.260 60 HZ1 LYS 7 HZ1 LYS 7 30.263 8.424 5.952 61 HZ2 LYS 7 HZ2 LYS 7 31.667 8.067 5.067 62 HZ3 LYS 7 HZ3 LYS 7 31.659 7.898 6.757 63 H LYS 8 HN LYS 8 32.624 9.221 1.939 64 HA LYS 8 HA LYS 8 31.237 11.492 2.991 65 HB2 LYS 8 HB2 LYS 8 33.589 10.916 3.572 66 HB3 LYS 8 HB1 LYS 8 34.065 11.329 1.924 67 HG2 LYS 8 HG2 LYS 8 33.342 13.620 2.221 68 HG3 LYS 8 HG1 LYS 8 32.642 13.243 3.795 69 HD2 LYS 8 HD2 LYS 8 34.857 12.716 4.690 70 HD3 LYS 8 HD1 LYS 8 35.586 12.994 3.107 71 HE2 LYS 8 HE2 LYS 8 34.930 15.337 3.164 72 HE3 LYS 8 HE1 LYS 8 34.054 15.090 4.673 73 HZ1 LYS 8 HZ1 LYS 8 36.963 14.607 4.350 74 HZ2 LYS 8 HZ2 LYS 8 36.075 14.596 5.799 75 HZ3 LYS 8 HZ3 LYS 8 36.306 16.050 4.952 76 H VAL 9 HN VAL 9 32.628 10.669 -0.159 77 HA VAL 9 HA VAL 9 32.456 13.114 -1.448 78 HB VAL 9 HB VAL 9 31.774 10.439 -2.703 79 HG11 VAL 9 HG11 VAL 9 32.805 13.069 -3.805 80 HG12 VAL 9 HG12 VAL 9 31.253 12.310 -4.157 81 HG13 VAL 9 HG13 VAL 9 32.746 11.567 -4.729 82 HG21 VAL 9 HG21 VAL 9 34.474 11.795 -2.419 83 HG22 VAL 9 HG22 VAL 9 34.157 10.228 -3.162 84 HG23 VAL 9 HG23 VAL 9 33.935 10.441 -1.425 85 H VAL 10 HN VAL 10 29.979 10.542 -1.639 86 HA VAL 10 HA VAL 10 28.008 12.249 -2.771 87 HB VAL 10 HB VAL 10 26.411 10.410 -2.194 88 HG11 VAL 10 HG11 VAL 10 27.585 10.252 -4.294 89 HG12 VAL 10 HG12 VAL 10 27.615 8.650 -3.559 90 HG13 VAL 10 HG13 VAL 10 29.047 9.677 -3.495 91 HG21 VAL 10 HG21 VAL 10 27.430 9.701 -0.078 92 HG22 VAL 10 HG22 VAL 10 28.895 9.208 -0.927 93 HG23 VAL 10 HG23 VAL 10 27.384 8.341 -1.199 94 H GLY 11 HN GLY 11 29.053 11.660 0.469 95 HA2 GLY 11 HA1 GLY 11 26.691 12.390 1.848 96 HA3 GLY 11 HA2 GLY 11 28.321 12.413 2.507 97 H ALA 12 HN ALA 12 29.467 14.258 0.697 98 HA ALA 12 HA ALA 12 28.690 16.706 1.929 99 HB1 ALA 12 HB1 ALA 12 30.339 17.729 0.434 100 HB2 ALA 12 HB2 ALA 12 30.437 16.229 -0.490 101 HB3 ALA 12 HB3 ALA 12 30.986 16.270 1.185 102 H PHE 13 HN PHE 13 28.049 15.234 -1.214 103 HA PHE 13 HA PHE 13 26.953 17.407 -2.566 104 HB2 PHE 13 HB2 PHE 13 27.406 15.115 -3.515 105 HB3 PHE 13 HB1 PHE 13 25.931 14.563 -2.722 106 HD1 PHE 13 HD1 PHE 13 23.710 15.476 -3.385 107 HD2 PHE 13 HD2 PHE 13 27.330 16.544 -5.480 108 HE1 PHE 13 HE1 PHE 13 22.353 16.357 -5.282 109 HE2 PHE 13 HE2 PHE 13 25.974 17.424 -7.376 110 HZ PHE 13 HZ PHE 13 23.488 17.268 -7.305 111 H GLY 14 HN GLY 14 25.660 15.512 0.048 112 HA2 GLY 14 HA1 GLY 14 22.923 16.277 -0.304 113 HA3 GLY 14 HA2 GLY 14 23.624 15.523 1.122 114 H SER 15 HN SER 15 24.741 18.532 -0.326 115 HA SER 15 HA SER 15 23.305 20.272 1.414 116 HB2 SER 15 HB2 SER 15 24.821 19.198 3.074 117 HB3 SER 15 HB1 SER 15 26.200 19.781 2.147 118 HG SER 15 HG SER 15 24.602 21.834 2.486 119 H LEU 16 HN LEU 16 25.261 19.606 -1.176 120 HA LEU 16 HA LEU 16 26.605 22.093 -1.526 121 HB2 LEU 16 HB2 LEU 16 27.411 20.152 -2.704 122 HB3 LEU 16 HB1 LEU 16 25.845 19.893 -3.463 123 HG LEU 16 HG LEU 16 26.081 21.894 -4.803 124 HD11 LEU 16 HD11 LEU 16 28.319 23.186 -4.605 125 HD12 LEU 16 HD12 LEU 16 28.477 22.414 -3.027 126 HD13 LEU 16 HD13 LEU 16 27.107 23.476 -3.358 127 HD21 LEU 16 HD21 LEU 16 28.119 21.331 -6.085 128 HD22 LEU 16 HD22 LEU 16 27.238 19.876 -5.621 129 HD23 LEU 16 HD23 LEU 16 28.691 20.345 -4.739 Start of MODEL 5 1 H1 GLY 1 HT1 GLY 1 40.011 1.381 4.300 2 H2 GLY 1 HT2 GLY 1 40.099 2.788 3.351 3 H3 GLY 1 HT3 GLY 1 40.078 1.258 2.612 4 HA2 GLY 1 HA1 GLY 1 37.881 0.865 3.288 5 HA3 GLY 1 HA2 GLY 1 37.894 2.341 4.244 6 H LEU 2 HN LEU 2 38.519 1.275 0.899 7 HA LEU 2 HA LEU 2 38.171 3.712 -0.368 8 HB2 LEU 2 HB2 LEU 2 37.863 2.508 -2.394 9 HB3 LEU 2 HB1 LEU 2 38.951 1.539 -1.409 10 HG LEU 2 HG LEU 2 35.975 1.072 -1.815 11 HD11 LEU 2 HD11 LEU 2 38.362 -0.659 -2.503 12 HD12 LEU 2 HD12 LEU 2 37.566 0.416 -3.652 13 HD13 LEU 2 HD13 LEU 2 36.679 -0.937 -2.949 14 HD21 LEU 2 HD21 LEU 2 36.528 -1.065 -0.476 15 HD22 LEU 2 HD22 LEU 2 36.406 0.427 0.448 16 HD23 LEU 2 HD23 LEU 2 37.992 -0.228 0.040 17 H PHE 3 HN PHE 3 35.886 2.075 1.452 18 HA PHE 3 HA PHE 3 33.550 3.053 -0.036 19 HB2 PHE 3 HB2 PHE 3 33.869 1.411 2.489 20 HB3 PHE 3 HB1 PHE 3 32.306 1.969 1.894 21 HD1 PHE 3 HD1 PHE 3 31.862 1.508 -0.697 22 HD2 PHE 3 HD2 PHE 3 34.633 -0.711 1.762 23 HE1 PHE 3 HE1 PHE 3 31.751 -0.402 -2.293 24 HE2 PHE 3 HE2 PHE 3 34.521 -2.619 0.164 25 HZ PHE 3 HZ PHE 3 32.992 -2.505 -1.800 26 H ASP 4 HN ASP 4 35.217 3.539 3.053 27 HA ASP 4 HA ASP 4 33.484 5.391 4.217 28 HB2 ASP 4 HB2 ASP 4 35.486 4.315 5.305 29 HB3 ASP 4 HB1 ASP 4 36.501 5.453 4.419 30 H ILE 5 HN ILE 5 36.082 5.852 1.864 31 HA ILE 5 HA ILE 5 35.975 8.701 1.862 32 HB ILE 5 HB ILE 5 36.898 6.971 -0.451 33 HG12 ILE 5 HG12 ILE 5 38.411 7.755 2.065 34 HG13 ILE 5 HG11 ILE 5 37.913 6.122 1.628 35 HG21 ILE 5 HG21 ILE 5 38.000 9.609 0.551 36 HG22 ILE 5 HG22 ILE 5 36.698 9.523 -0.635 37 HG23 ILE 5 HG23 ILE 5 38.276 8.836 -1.010 38 HD11 ILE 5 HD1 ILE 5 39.988 7.866 0.293 39 HD12 ILE 5 HD2 ILE 5 39.270 6.491 -0.548 40 HD13 ILE 5 HD3 ILE 5 40.178 6.239 0.942 41 H VAL 6 HN VAL 6 34.819 6.305 -0.524 42 HA VAL 6 HA VAL 6 33.455 8.056 -2.197 43 HB VAL 6 HB VAL 6 32.773 5.177 -1.523 44 HG11 VAL 6 HG11 VAL 6 31.801 7.038 -3.706 45 HG12 VAL 6 HG12 VAL 6 30.829 6.130 -2.549 46 HG13 VAL 6 HG13 VAL 6 31.686 5.283 -3.837 47 HG21 VAL 6 HG21 VAL 6 35.069 5.705 -2.474 48 HG22 VAL 6 HG22 VAL 6 34.252 6.327 -3.907 49 HG23 VAL 6 HG23 VAL 6 34.088 4.626 -3.467 50 H LYS 7 HN LYS 7 32.525 6.739 0.910 51 HA LYS 7 HA LYS 7 29.751 7.391 0.733 52 HB2 LYS 7 HB2 LYS 7 30.761 5.753 2.360 53 HB3 LYS 7 HB1 LYS 7 31.408 7.131 3.250 54 HG2 LYS 7 HG2 LYS 7 29.127 8.027 3.536 55 HG3 LYS 7 HG1 LYS 7 28.474 6.652 2.643 56 HD2 LYS 7 HD2 LYS 7 29.462 5.124 4.354 57 HD3 LYS 7 HD1 LYS 7 29.976 6.539 5.275 58 HE2 LYS 7 HE2 LYS 7 27.100 6.022 4.478 59 HE3 LYS 7 HE1 LYS 7 27.779 5.545 6.034 60 HZ1 LYS 7 HZ1 LYS 7 26.667 7.937 5.514 61 HZ2 LYS 7 HZ2 LYS 7 28.317 8.278 5.294 62 HZ3 LYS 7 HZ3 LYS 7 27.768 7.639 6.770 63 H LYS 8 HN LYS 8 32.632 9.109 1.789 64 HA LYS 8 HA LYS 8 31.267 11.308 2.996 65 HB2 LYS 8 HB2 LYS 8 33.630 10.747 3.484 66 HB3 LYS 8 HB1 LYS 8 34.062 11.197 1.834 67 HG2 LYS 8 HG2 LYS 8 33.393 13.481 2.197 68 HG3 LYS 8 HG1 LYS 8 32.675 13.080 3.758 69 HD2 LYS 8 HD2 LYS 8 34.928 12.415 4.588 70 HD3 LYS 8 HD1 LYS 8 35.620 12.930 3.049 71 HE2 LYS 8 HE2 LYS 8 34.070 14.708 4.956 72 HE3 LYS 8 HE1 LYS 8 35.823 14.705 4.759 73 HZ1 LYS 8 HZ1 LYS 8 35.105 16.412 3.384 74 HZ2 LYS 8 HZ2 LYS 8 33.750 15.548 2.833 75 HZ3 LYS 8 HZ3 LYS 8 35.307 15.116 2.308 76 H VAL 9 HN VAL 9 32.620 10.714 -0.227 77 HA VAL 9 HA VAL 9 32.297 13.236 -1.351 78 HB VAL 9 HB VAL 9 31.834 10.580 -2.746 79 HG11 VAL 9 HG11 VAL 9 31.078 12.408 -4.123 80 HG12 VAL 9 HG12 VAL 9 32.662 11.921 -4.729 81 HG13 VAL 9 HG13 VAL 9 32.505 13.366 -3.730 82 HG21 VAL 9 HG21 VAL 9 34.225 10.702 -3.304 83 HG22 VAL 9 HG22 VAL 9 34.012 10.698 -1.554 84 HG23 VAL 9 HG23 VAL 9 34.375 12.205 -2.393 85 H VAL 10 HN VAL 10 29.997 10.509 -1.541 86 HA VAL 10 HA VAL 10 27.900 12.044 -2.681 87 HB VAL 10 HB VAL 10 26.440 10.134 -2.051 88 HG11 VAL 10 HG11 VAL 10 29.151 9.401 -3.199 89 HG12 VAL 10 HG12 VAL 10 27.751 9.978 -4.106 90 HG13 VAL 10 HG13 VAL 10 27.706 8.397 -3.324 91 HG21 VAL 10 HG21 VAL 10 27.363 9.559 0.111 92 HG22 VAL 10 HG22 VAL 10 28.947 9.238 -0.596 93 HG23 VAL 10 HG23 VAL 10 27.591 8.168 -0.950 94 H GLY 11 HN GLY 11 29.022 11.614 0.567 95 HA2 GLY 11 HA1 GLY 11 26.611 12.338 1.906 96 HA3 GLY 11 HA2 GLY 11 28.224 12.320 2.604 97 H ALA 12 HN ALA 12 29.509 14.142 0.934 98 HA ALA 12 HA ALA 12 28.672 16.607 2.101 99 HB1 ALA 12 HB1 ALA 12 30.504 17.588 0.865 100 HB2 ALA 12 HB2 ALA 12 30.617 16.162 -0.166 101 HB3 ALA 12 HB3 ALA 12 31.027 16.048 1.546 102 H PHE 13 HN PHE 13 27.120 14.963 -0.160 103 HA PHE 13 HA PHE 13 25.708 15.462 -1.909 104 HB2 PHE 13 HB2 PHE 13 25.581 18.217 -0.674 105 HB3 PHE 13 HB1 PHE 13 24.328 17.375 -1.587 106 HD1 PHE 13 HD1 PHE 13 23.731 14.931 -0.611 107 HD2 PHE 13 HD2 PHE 13 25.371 18.201 1.683 108 HE1 PHE 13 HE1 PHE 13 22.853 13.905 1.483 109 HE2 PHE 13 HE2 PHE 13 24.492 17.174 3.774 110 HZ PHE 13 HZ PHE 13 23.186 15.055 3.667 111 H GLY 14 HN GLY 14 28.655 16.165 -2.119 112 HA2 GLY 14 HA1 GLY 14 30.072 17.178 -3.611 113 HA3 GLY 14 HA2 GLY 14 28.720 17.072 -4.731 114 H SER 15 HN SER 15 28.863 18.929 -1.736 115 HA SER 15 HA SER 15 28.799 21.178 -1.307 116 HB2 SER 15 HB2 SER 15 29.495 21.774 -4.180 117 HB3 SER 15 HB1 SER 15 29.916 22.676 -2.729 118 HG SER 15 HG SER 15 31.678 21.547 -2.744 119 H LEU 16 HN LEU 16 26.906 19.630 -3.619 120 HA LEU 16 HA LEU 16 25.248 21.843 -4.407 121 HB2 LEU 16 HB2 LEU 16 24.462 18.926 -4.434 122 HB3 LEU 16 HB1 LEU 16 23.866 20.222 -5.468 123 HG LEU 16 HG LEU 16 26.648 19.022 -5.470 124 HD11 LEU 16 HD11 LEU 16 24.497 19.159 -7.603 125 HD12 LEU 16 HD12 LEU 16 24.860 17.738 -6.624 126 HD13 LEU 16 HD13 LEU 16 26.062 18.361 -7.754 127 HD21 LEU 16 HD21 LEU 16 27.004 21.342 -5.887 128 HD22 LEU 16 HD22 LEU 16 25.525 21.482 -6.838 129 HD23 LEU 16 HD23 LEU 16 26.916 20.617 -7.491 Start of MODEL 6 1 H1 GLY 1 HT1 GLY 1 41.199 0.221 1.052 2 H2 GLY 1 HT2 GLY 1 39.953 -0.921 0.879 3 H3 GLY 1 HT3 GLY 1 40.662 -0.655 2.400 4 HA2 GLY 1 HA1 GLY 1 38.462 0.356 2.099 5 HA3 GLY 1 HA2 GLY 1 39.748 1.452 2.588 6 H LEU 2 HN LEU 2 37.147 1.355 0.764 7 HA LEU 2 HA LEU 2 37.977 3.545 -0.901 8 HB2 LEU 2 HB2 LEU 2 37.170 2.322 -3.037 9 HB3 LEU 2 HB1 LEU 2 38.787 1.957 -2.445 10 HG LEU 2 HG LEU 2 37.879 -0.055 -1.276 11 HD11 LEU 2 HD11 LEU 2 35.310 0.945 -2.521 12 HD12 LEU 2 HD12 LEU 2 35.589 0.347 -0.884 13 HD13 LEU 2 HD13 LEU 2 35.540 -0.781 -2.233 14 HD21 LEU 2 HD21 LEU 2 37.590 -1.383 -3.322 15 HD22 LEU 2 HD22 LEU 2 38.864 -0.184 -3.548 16 HD23 LEU 2 HD23 LEU 2 37.267 0.085 -4.244 17 H PHE 3 HN PHE 3 35.825 1.968 0.931 18 HA PHE 3 HA PHE 3 33.405 3.006 -0.434 19 HB2 PHE 3 HB2 PHE 3 32.161 1.603 1.139 20 HB3 PHE 3 HB1 PHE 3 33.363 0.640 0.281 21 HD1 PHE 3 HD1 PHE 3 32.440 2.167 3.517 22 HD2 PHE 3 HD2 PHE 3 35.372 -0.201 1.414 23 HE1 PHE 3 HE1 PHE 3 33.462 1.500 5.690 24 HE2 PHE 3 HE2 PHE 3 36.394 -0.867 3.585 25 HZ PHE 3 HZ PHE 3 35.389 -0.078 5.725 26 H ASP 4 HN ASP 4 35.177 3.102 2.638 27 HA ASP 4 HA ASP 4 33.410 4.814 4.019 28 HB2 ASP 4 HB2 ASP 4 35.256 3.498 5.071 29 HB3 ASP 4 HB1 ASP 4 36.412 4.620 4.354 30 H ILE 5 HN ILE 5 35.998 5.423 1.727 31 HA ILE 5 HA ILE 5 36.107 8.260 2.175 32 HB ILE 5 HB ILE 5 37.016 6.801 -0.321 33 HG12 ILE 5 HG12 ILE 5 38.467 7.163 2.323 34 HG13 ILE 5 HG11 ILE 5 37.909 5.632 1.652 35 HG21 ILE 5 HG21 ILE 5 38.214 9.221 1.053 36 HG22 ILE 5 HG22 ILE 5 36.961 9.363 -0.178 37 HG23 ILE 5 HG23 ILE 5 38.514 8.643 -0.586 38 HD11 ILE 5 HD1 ILE 5 40.120 7.425 0.640 39 HD12 ILE 5 HD2 ILE 5 39.373 6.214 -0.404 40 HD13 ILE 5 HD3 ILE 5 40.205 5.718 1.069 41 H VAL 6 HN VAL 6 34.764 6.214 -0.422 42 HA VAL 6 HA VAL 6 33.633 8.228 -1.978 43 HB VAL 6 HB VAL 6 32.639 5.399 -1.510 44 HG11 VAL 6 HG11 VAL 6 30.796 6.616 -2.436 45 HG12 VAL 6 HG12 VAL 6 31.554 5.788 -3.795 46 HG13 VAL 6 HG13 VAL 6 31.847 7.508 -3.535 47 HG21 VAL 6 HG21 VAL 6 34.981 5.795 -2.465 48 HG22 VAL 6 HG22 VAL 6 34.189 6.533 -3.856 49 HG23 VAL 6 HG23 VAL 6 33.895 4.838 -3.472 50 H LYS 7 HN LYS 7 32.486 6.735 0.984 51 HA LYS 7 HA LYS 7 29.819 7.681 0.893 52 HB2 LYS 7 HB2 LYS 7 30.633 5.898 2.430 53 HB3 LYS 7 HB1 LYS 7 31.513 7.125 3.340 54 HG2 LYS 7 HG2 LYS 7 29.476 8.256 3.942 55 HG3 LYS 7 HG1 LYS 7 28.529 7.259 2.837 56 HD2 LYS 7 HD2 LYS 7 29.054 5.258 4.167 57 HD3 LYS 7 HD1 LYS 7 30.030 6.234 5.265 58 HE2 LYS 7 HE2 LYS 7 28.074 7.526 5.927 59 HE3 LYS 7 HE1 LYS 7 27.077 6.681 4.744 60 HZ1 LYS 7 HZ1 LYS 7 28.540 5.034 6.650 61 HZ2 LYS 7 HZ2 LYS 7 26.983 4.826 6.004 62 HZ3 LYS 7 HZ3 LYS 7 27.240 5.932 7.267 63 H LYS 8 HN LYS 8 32.844 9.146 1.892 64 HA LYS 8 HA LYS 8 31.668 11.380 3.245 65 HB2 LYS 8 HB2 LYS 8 34.033 10.522 3.555 66 HB3 LYS 8 HB1 LYS 8 34.422 11.258 2.000 67 HG2 LYS 8 HG2 LYS 8 33.545 13.444 2.907 68 HG3 LYS 8 HG1 LYS 8 33.409 12.669 4.485 69 HD2 LYS 8 HD2 LYS 8 35.973 12.890 2.875 70 HD3 LYS 8 HD1 LYS 8 35.545 13.927 4.232 71 HE2 LYS 8 HE2 LYS 8 35.276 11.686 5.560 72 HE3 LYS 8 HE1 LYS 8 36.236 10.990 4.254 73 HZ1 LYS 8 HZ1 LYS 8 36.991 13.207 6.072 74 HZ2 LYS 8 HZ2 LYS 8 37.869 12.812 4.672 75 HZ3 LYS 8 HZ3 LYS 8 37.725 11.684 5.934 76 H VAL 9 HN VAL 9 32.501 10.642 -0.066 77 HA VAL 9 HA VAL 9 32.416 13.329 -1.043 78 HB VAL 9 HB VAL 9 31.957 10.752 -2.580 79 HG11 VAL 9 HG11 VAL 9 31.239 12.667 -3.858 80 HG12 VAL 9 HG12 VAL 9 32.821 12.192 -4.474 81 HG13 VAL 9 HG13 VAL 9 32.676 13.581 -3.397 82 HG21 VAL 9 HG21 VAL 9 34.518 12.331 -2.171 83 HG22 VAL 9 HG22 VAL 9 34.343 10.823 -3.068 84 HG23 VAL 9 HG23 VAL 9 34.127 10.838 -1.318 85 H VAL 10 HN VAL 10 30.099 10.619 -1.164 86 HA VAL 10 HA VAL 10 28.008 12.057 -2.399 87 HB VAL 10 HB VAL 10 27.747 9.708 -0.497 88 HG11 VAL 10 HG11 VAL 10 25.943 10.896 -2.621 89 HG12 VAL 10 HG12 VAL 10 25.608 10.744 -0.896 90 HG13 VAL 10 HG13 VAL 10 25.685 9.303 -1.909 91 HG21 VAL 10 HG21 VAL 10 28.158 9.814 -3.504 92 HG22 VAL 10 HG22 VAL 10 27.765 8.355 -2.594 93 HG23 VAL 10 HG23 VAL 10 29.299 9.180 -2.317 94 H GLY 11 HN GLY 11 29.147 11.929 0.878 95 HA2 GLY 11 HA1 GLY 11 26.865 12.736 2.273 96 HA3 GLY 11 HA2 GLY 11 28.521 13.057 2.769 97 H ALA 12 HN ALA 12 29.392 14.690 0.722 98 HA ALA 12 HA ALA 12 28.257 17.195 1.492 99 HB1 ALA 12 HB1 ALA 12 30.621 16.974 0.916 100 HB2 ALA 12 HB2 ALA 12 29.831 18.145 -0.139 101 HB3 ALA 12 HB3 ALA 12 30.186 16.524 -0.734 102 H PHE 13 HN PHE 13 27.975 15.111 -1.341 103 HA PHE 13 HA PHE 13 26.686 16.830 -3.109 104 HB2 PHE 13 HB2 PHE 13 27.450 14.510 -3.636 105 HB3 PHE 13 HB1 PHE 13 26.072 13.892 -2.725 106 HD1 PHE 13 HD1 PHE 13 23.761 14.216 -3.526 107 HD2 PHE 13 HD2 PHE 13 27.153 15.616 -5.797 108 HE1 PHE 13 HE1 PHE 13 22.301 14.512 -5.523 109 HE2 PHE 13 HE2 PHE 13 25.694 15.912 -7.795 110 HZ PHE 13 HZ PHE 13 23.254 15.432 -7.634 111 H GLY 14 HN GLY 14 25.564 15.482 -0.147 112 HA2 GLY 14 HA1 GLY 14 22.757 15.668 -0.683 113 HA3 GLY 14 HA2 GLY 14 23.509 15.455 0.891 114 H SER 15 HN SER 15 24.405 18.094 -1.199 115 HA SER 15 HA SER 15 22.575 20.017 -0.166 116 HB2 SER 15 HB2 SER 15 23.837 19.739 1.895 117 HB3 SER 15 HB1 SER 15 25.355 19.972 1.031 118 HG SER 15 HG SER 15 24.287 22.058 0.370 119 H LEU 16 HN LEU 16 26.076 20.197 -0.813 120 HA LEU 16 HA LEU 16 25.727 22.373 -2.660 121 HB2 LEU 16 HB2 LEU 16 28.227 20.703 -2.361 122 HB3 LEU 16 HB1 LEU 16 28.091 22.401 -2.818 123 HG LEU 16 HG LEU 16 27.488 21.205 -0.095 124 HD11 LEU 16 HD11 LEU 16 29.559 23.256 -0.928 125 HD12 LEU 16 HD12 LEU 16 29.902 21.534 -0.755 126 HD13 LEU 16 HD13 LEU 16 29.404 22.481 0.648 127 HD21 LEU 16 HD21 LEU 16 25.906 22.970 -0.388 128 HD22 LEU 16 HD22 LEU 16 27.078 23.988 -1.225 129 HD23 LEU 16 HD23 LEU 16 27.236 23.701 0.507 Start of MODEL 7 1 H1 GLY 1 HT1 GLY 1 39.948 2.293 2.673 2 H2 GLY 1 HT2 GLY 1 39.234 0.815 2.231 3 H3 GLY 1 HT3 GLY 1 39.624 1.123 3.856 4 HA2 GLY 1 HA1 GLY 1 37.293 1.343 3.497 5 HA3 GLY 1 HA2 GLY 1 38.031 2.874 3.945 6 H LEU 2 HN LEU 2 38.103 1.215 0.824 7 HA LEU 2 HA LEU 2 37.775 3.375 -0.823 8 HB2 LEU 2 HB2 LEU 2 38.272 1.194 -1.718 9 HB3 LEU 2 HB1 LEU 2 36.745 0.545 -1.131 10 HG LEU 2 HG LEU 2 35.500 1.952 -2.700 11 HD11 LEU 2 HD11 LEU 2 36.928 3.209 -4.460 12 HD12 LEU 2 HD12 LEU 2 38.250 3.073 -3.302 13 HD13 LEU 2 HD13 LEU 2 36.785 3.952 -2.871 14 HD21 LEU 2 HD21 LEU 2 37.821 0.578 -4.088 15 HD22 LEU 2 HD22 LEU 2 36.229 0.895 -4.776 16 HD23 LEU 2 HD23 LEU 2 36.403 -0.251 -3.447 17 H PHE 3 HN PHE 3 35.263 1.605 0.908 18 HA PHE 3 HA PHE 3 33.100 3.127 -0.308 19 HB2 PHE 3 HB2 PHE 3 32.796 0.754 0.354 20 HB3 PHE 3 HB1 PHE 3 33.056 1.208 2.038 21 HD1 PHE 3 HD1 PHE 3 30.833 1.701 -0.915 22 HD2 PHE 3 HD2 PHE 3 31.320 2.258 3.338 23 HE1 PHE 3 HE1 PHE 3 28.433 2.341 -0.723 24 HE2 PHE 3 HE2 PHE 3 28.919 2.900 3.529 25 HZ PHE 3 HZ PHE 3 27.477 2.947 1.498 26 H ASP 4 HN ASP 4 35.155 3.263 2.456 27 HA ASP 4 HA ASP 4 33.500 4.947 4.082 28 HB2 ASP 4 HB2 ASP 4 35.401 3.545 4.938 29 HB3 ASP 4 HB1 ASP 4 36.510 4.681 4.170 30 H ILE 5 HN ILE 5 36.160 5.536 1.805 31 HA ILE 5 HA ILE 5 36.204 8.366 2.209 32 HB ILE 5 HB ILE 5 37.211 6.860 -0.225 33 HG12 ILE 5 HG12 ILE 5 38.603 7.427 2.416 34 HG13 ILE 5 HG11 ILE 5 38.074 5.841 1.859 35 HG21 ILE 5 HG21 ILE 5 38.268 9.393 1.066 36 HG22 ILE 5 HG22 ILE 5 37.078 9.419 -0.232 37 HG23 ILE 5 HG23 ILE 5 38.674 8.738 -0.519 38 HD11 ILE 5 HD1 ILE 5 39.550 6.305 -0.230 39 HD12 ILE 5 HD2 ILE 5 40.366 5.900 1.280 40 HD13 ILE 5 HD3 ILE 5 40.281 7.577 0.750 41 H VAL 6 HN VAL 6 34.763 6.244 -0.258 42 HA VAL 6 HA VAL 6 33.711 8.311 -1.876 43 HB VAL 6 HB VAL 6 32.786 5.444 -1.511 44 HG11 VAL 6 HG11 VAL 6 31.724 5.871 -3.803 45 HG12 VAL 6 HG12 VAL 6 31.954 7.589 -3.480 46 HG13 VAL 6 HG13 VAL 6 30.917 6.625 -2.429 47 HG21 VAL 6 HG21 VAL 6 34.088 4.979 -3.468 48 HG22 VAL 6 HG22 VAL 6 35.130 5.944 -2.423 49 HG23 VAL 6 HG23 VAL 6 34.328 6.693 -3.802 50 H LYS 7 HN LYS 7 32.788 7.140 1.203 51 HA LYS 7 HA LYS 7 29.997 7.789 1.065 52 HB2 LYS 7 HB2 LYS 7 30.965 6.185 2.712 53 HB3 LYS 7 HB1 LYS 7 31.760 7.540 3.513 54 HG2 LYS 7 HG2 LYS 7 29.637 8.562 4.042 55 HG3 LYS 7 HG1 LYS 7 28.768 7.384 3.056 56 HD2 LYS 7 HD2 LYS 7 29.545 5.573 4.560 57 HD3 LYS 7 HD1 LYS 7 30.362 6.772 5.562 58 HE2 LYS 7 HE2 LYS 7 27.384 6.565 5.041 59 HE3 LYS 7 HE1 LYS 7 28.214 6.294 6.574 60 HZ1 LYS 7 HZ1 LYS 7 27.728 8.436 6.926 61 HZ2 LYS 7 HZ2 LYS 7 27.484 8.773 5.279 62 HZ3 LYS 7 HZ3 LYS 7 29.057 8.751 5.921 63 H LYS 8 HN LYS 8 32.928 9.534 1.822 64 HA LYS 8 HA LYS 8 31.649 11.774 3.074 65 HB2 LYS 8 HB2 LYS 8 34.062 11.144 3.382 66 HB3 LYS 8 HB1 LYS 8 34.359 11.693 1.733 67 HG2 LYS 8 HG2 LYS 8 33.547 13.937 2.311 68 HG3 LYS 8 HG1 LYS 8 33.191 13.399 3.952 69 HD2 LYS 8 HD2 LYS 8 35.591 12.853 4.277 70 HD3 LYS 8 HD1 LYS 8 35.932 13.458 2.655 71 HE2 LYS 8 HE2 LYS 8 34.987 15.674 3.335 72 HE3 LYS 8 HE1 LYS 8 34.811 15.052 4.977 73 HZ1 LYS 8 HZ1 LYS 8 36.869 15.879 5.209 74 HZ2 LYS 8 HZ2 LYS 8 37.200 15.850 3.544 75 HZ3 LYS 8 HZ3 LYS 8 37.349 14.432 4.466 76 H VAL 9 HN VAL 9 32.711 11.008 -0.212 77 HA VAL 9 HA VAL 9 32.277 13.566 -1.336 78 HB VAL 9 HB VAL 9 32.008 10.904 -2.763 79 HG11 VAL 9 HG11 VAL 9 31.240 12.816 -4.071 80 HG12 VAL 9 HG12 VAL 9 32.796 12.272 -4.701 81 HG13 VAL 9 HG13 VAL 9 32.710 13.708 -3.681 82 HG21 VAL 9 HG21 VAL 9 34.484 12.597 -2.284 83 HG22 VAL 9 HG22 VAL 9 34.413 11.104 -3.221 84 HG23 VAL 9 HG23 VAL 9 34.136 11.066 -1.479 85 H VAL 10 HN VAL 10 30.231 10.638 -1.489 86 HA VAL 10 HA VAL 10 28.014 11.931 -2.673 87 HB VAL 10 HB VAL 10 28.021 9.440 -0.940 88 HG11 VAL 10 HG11 VAL 10 25.969 8.933 -2.349 89 HG12 VAL 10 HG12 VAL 10 26.031 10.608 -2.902 90 HG13 VAL 10 HG13 VAL 10 25.773 10.250 -1.194 91 HG21 VAL 10 HG21 VAL 10 28.308 9.813 -3.941 92 HG22 VAL 10 HG22 VAL 10 28.123 8.257 -3.131 93 HG23 VAL 10 HG23 VAL 10 29.562 9.235 -2.842 94 H GLY 11 HN GLY 11 28.878 11.283 0.699 95 HA2 GLY 11 HA1 GLY 11 26.468 12.146 1.871 96 HA3 GLY 11 HA2 GLY 11 28.032 12.083 2.672 97 H ALA 12 HN ALA 12 29.077 13.900 0.459 98 HA ALA 12 HA ALA 12 28.597 16.378 1.857 99 HB1 ALA 12 HB1 ALA 12 30.798 15.762 0.886 100 HB2 ALA 12 HB2 ALA 12 30.201 17.320 0.312 101 HB3 ALA 12 HB3 ALA 12 30.089 15.895 -0.723 102 H PHE 13 HN PHE 13 27.308 14.780 -0.931 103 HA PHE 13 HA PHE 13 25.756 15.401 -2.513 104 HB2 PHE 13 HB2 PHE 13 24.914 17.204 -0.231 105 HB3 PHE 13 HB1 PHE 13 23.950 16.893 -1.674 106 HD1 PHE 13 HD1 PHE 13 23.477 14.391 -2.270 107 HD2 PHE 13 HD2 PHE 13 24.733 15.741 1.634 108 HE1 PHE 13 HE1 PHE 13 22.603 12.287 -1.260 109 HE2 PHE 13 HE2 PHE 13 23.859 13.638 2.642 110 HZ PHE 13 HZ PHE 13 22.738 11.940 1.203 111 H GLY 14 HN GLY 14 28.331 16.842 -2.431 112 HA2 GLY 14 HA1 GLY 14 28.185 19.564 -2.814 113 HA3 GLY 14 HA2 GLY 14 29.324 18.515 -3.646 114 H SER 15 HN SER 15 26.874 17.082 -4.805 115 HA SER 15 HA SER 15 25.614 19.009 -6.527 116 HB2 SER 15 HB2 SER 15 27.846 18.901 -7.577 117 HB3 SER 15 HB1 SER 15 27.681 17.155 -7.736 118 HG SER 15 HG SER 15 26.998 18.761 -9.527 119 H LEU 16 HN LEU 16 26.402 15.676 -5.745 120 HA LEU 16 HA LEU 16 24.434 14.424 -7.355 121 HB2 LEU 16 HB2 LEU 16 25.925 13.609 -4.859 122 HB3 LEU 16 HB1 LEU 16 24.683 12.566 -5.549 123 HG LEU 16 HG LEU 16 25.879 12.459 -7.666 124 HD11 LEU 16 HD11 LEU 16 26.856 14.619 -7.889 125 HD12 LEU 16 HD12 LEU 16 28.225 13.521 -7.725 126 HD13 LEU 16 HD13 LEU 16 27.699 14.486 -6.345 127 HD21 LEU 16 HD21 LEU 16 26.532 10.899 -5.840 128 HD22 LEU 16 HD22 LEU 16 27.779 12.039 -5.336 129 HD23 LEU 16 HD23 LEU 16 27.885 11.259 -6.914 Start of MODEL 8 1 H1 GLY 1 HT1 GLY 1 37.648 1.271 4.321 2 H2 GLY 1 HT2 GLY 1 38.854 1.831 3.262 3 H3 GLY 1 HT3 GLY 1 38.923 0.247 3.875 4 HA2 GLY 1 HA1 GLY 1 38.063 -0.254 1.917 5 HA3 GLY 1 HA2 GLY 1 36.575 0.138 2.770 6 H LEU 2 HN LEU 2 37.449 0.373 -0.111 7 HA LEU 2 HA LEU 2 37.736 3.079 -0.811 8 HB2 LEU 2 HB2 LEU 2 37.248 2.426 -3.044 9 HB3 LEU 2 HB1 LEU 2 38.095 1.069 -2.313 10 HG LEU 2 HG LEU 2 35.089 1.292 -2.720 11 HD11 LEU 2 HD11 LEU 2 36.400 0.839 -4.763 12 HD12 LEU 2 HD12 LEU 2 35.443 -0.564 -4.286 13 HD13 LEU 2 HD13 LEU 2 37.175 -0.525 -3.957 14 HD21 LEU 2 HD21 LEU 2 36.818 -0.787 -1.347 15 HD22 LEU 2 HD22 LEU 2 35.217 -1.172 -1.976 16 HD23 LEU 2 HD23 LEU 2 35.395 0.033 -0.706 17 H PHE 3 HN PHE 3 35.074 1.444 0.507 18 HA PHE 3 HA PHE 3 33.046 3.225 -0.625 19 HB2 PHE 3 HB2 PHE 3 32.600 0.797 -0.148 20 HB3 PHE 3 HB1 PHE 3 32.759 1.160 1.571 21 HD1 PHE 3 HD1 PHE 3 30.627 1.451 -1.396 22 HD2 PHE 3 HD2 PHE 3 31.166 2.729 2.691 23 HE1 PHE 3 HE1 PHE 3 28.263 2.231 -1.328 24 HE2 PHE 3 HE2 PHE 3 28.799 3.509 2.759 25 HZ PHE 3 HZ PHE 3 27.342 3.240 0.755 26 H ASP 4 HN ASP 4 34.869 2.764 2.343 27 HA ASP 4 HA ASP 4 33.371 4.473 4.018 28 HB2 ASP 4 HB2 ASP 4 36.314 3.768 4.069 29 HB3 ASP 4 HB1 ASP 4 35.458 4.597 5.370 30 H ILE 5 HN ILE 5 35.973 5.069 1.718 31 HA ILE 5 HA ILE 5 36.326 7.829 2.430 32 HB ILE 5 HB ILE 5 37.091 6.549 -0.211 33 HG12 ILE 5 HG12 ILE 5 38.593 6.519 2.431 34 HG13 ILE 5 HG11 ILE 5 37.885 5.116 1.631 35 HG21 ILE 5 HG21 ILE 5 37.264 9.080 0.191 36 HG22 ILE 5 HG22 ILE 5 38.742 8.269 -0.315 37 HG23 ILE 5 HG23 ILE 5 38.510 8.703 1.379 38 HD11 ILE 5 HD1 ILE 5 40.170 5.045 1.007 39 HD12 ILE 5 HD2 ILE 5 40.241 6.787 0.744 40 HD13 ILE 5 HD3 ILE 5 39.369 5.757 -0.393 41 H VAL 6 HN VAL 6 34.916 6.229 -0.438 42 HA VAL 6 HA VAL 6 33.917 8.498 -1.695 43 HB VAL 6 HB VAL 6 32.746 5.698 -1.675 44 HG11 VAL 6 HG11 VAL 6 32.224 8.117 -3.422 45 HG12 VAL 6 HG12 VAL 6 31.050 7.173 -2.506 46 HG13 VAL 6 HG13 VAL 6 31.823 6.476 -3.929 47 HG21 VAL 6 HG21 VAL 6 34.070 5.332 -3.647 48 HG22 VAL 6 HG22 VAL 6 35.157 6.030 -2.448 49 HG23 VAL 6 HG23 VAL 6 34.514 7.036 -3.744 50 H LYS 7 HN LYS 7 32.875 7.013 1.218 51 HA LYS 7 HA LYS 7 30.139 7.728 1.199 52 HB2 LYS 7 HB2 LYS 7 31.312 6.167 2.834 53 HB3 LYS 7 HB1 LYS 7 31.900 7.613 3.657 54 HG2 LYS 7 HG2 LYS 7 29.418 8.356 3.724 55 HG3 LYS 7 HG1 LYS 7 29.041 6.685 3.309 56 HD2 LYS 7 HD2 LYS 7 30.610 7.619 5.732 57 HD3 LYS 7 HD1 LYS 7 28.971 6.971 5.738 58 HE2 LYS 7 HE2 LYS 7 29.969 4.866 4.649 59 HE3 LYS 7 HE1 LYS 7 31.544 5.522 5.100 60 HZ1 LYS 7 HZ1 LYS 7 30.628 5.716 7.409 61 HZ2 LYS 7 HZ2 LYS 7 30.868 4.129 6.854 62 HZ3 LYS 7 HZ3 LYS 7 29.303 4.791 6.893 63 H LYS 8 HN LYS 8 33.059 9.472 2.154 64 HA LYS 8 HA LYS 8 31.725 11.721 3.282 65 HB2 LYS 8 HB2 LYS 8 34.120 11.103 3.698 66 HB3 LYS 8 HB1 LYS 8 34.490 11.638 2.058 67 HG2 LYS 8 HG2 LYS 8 33.706 13.888 2.567 68 HG3 LYS 8 HG1 LYS 8 33.189 13.377 4.175 69 HD2 LYS 8 HD2 LYS 8 35.503 12.857 4.786 70 HD3 LYS 8 HD1 LYS 8 36.047 13.285 3.162 71 HE2 LYS 8 HE2 LYS 8 35.147 15.593 3.522 72 HE3 LYS 8 HE1 LYS 8 34.764 15.146 5.184 73 HZ1 LYS 8 HZ1 LYS 8 37.060 14.732 5.619 74 HZ2 LYS 8 HZ2 LYS 8 36.929 16.279 4.930 75 HZ3 LYS 8 HZ3 LYS 8 37.477 14.972 3.993 76 H VAL 9 HN VAL 9 32.888 10.936 0.040 77 HA VAL 9 HA VAL 9 32.621 13.451 -1.158 78 HB VAL 9 HB VAL 9 32.067 10.762 -2.451 79 HG11 VAL 9 HG11 VAL 9 32.874 12.023 -4.494 80 HG12 VAL 9 HG12 VAL 9 32.779 13.501 -3.536 81 HG13 VAL 9 HG13 VAL 9 31.320 12.566 -3.865 82 HG21 VAL 9 HG21 VAL 9 34.422 10.715 -3.003 83 HG22 VAL 9 HG22 VAL 9 34.292 10.973 -1.263 84 HG23 VAL 9 HG23 VAL 9 34.662 12.327 -2.330 85 H VAL 10 HN VAL 10 30.284 10.757 -1.410 86 HA VAL 10 HA VAL 10 28.188 12.243 -2.501 87 HB VAL 10 HB VAL 10 27.922 9.865 -0.635 88 HG11 VAL 10 HG11 VAL 10 25.789 10.936 -0.978 89 HG12 VAL 10 HG12 VAL 10 25.831 9.514 -2.021 90 HG13 VAL 10 HG13 VAL 10 26.097 11.118 -2.705 91 HG21 VAL 10 HG21 VAL 10 28.002 8.501 -2.655 92 HG22 VAL 10 HG22 VAL 10 29.461 9.487 -2.579 93 HG23 VAL 10 HG23 VAL 10 28.145 9.942 -3.661 94 H GLY 11 HN GLY 11 29.296 11.957 0.798 95 HA2 GLY 11 HA1 GLY 11 27.095 12.758 2.254 96 HA3 GLY 11 HA2 GLY 11 28.754 13.158 2.676 97 H ALA 12 HN ALA 12 29.234 14.697 0.258 98 HA ALA 12 HA ALA 12 28.285 17.233 1.178 99 HB1 ALA 12 HB1 ALA 12 29.637 16.512 -1.427 100 HB2 ALA 12 HB2 ALA 12 30.468 16.938 0.070 101 HB3 ALA 12 HB3 ALA 12 29.468 18.134 -0.755 102 H PHE 13 HN PHE 13 27.605 15.251 -1.704 103 HA PHE 13 HA PHE 13 25.555 17.036 -2.662 104 HB2 PHE 13 HB2 PHE 13 26.288 14.206 -3.453 105 HB3 PHE 13 HB1 PHE 13 25.116 15.218 -4.301 106 HD1 PHE 13 HD1 PHE 13 28.683 14.651 -3.587 107 HD2 PHE 13 HD2 PHE 13 25.830 17.251 -5.517 108 HE1 PHE 13 HE1 PHE 13 30.531 15.736 -4.857 109 HE2 PHE 13 HE2 PHE 13 27.678 18.337 -6.787 110 HZ PHE 13 HZ PHE 13 30.034 17.612 -6.423 111 H GLY 14 HN GLY 14 25.695 14.695 -0.237 112 HA2 GLY 14 HA1 GLY 14 23.326 13.312 -0.320 113 HA3 GLY 14 HA2 GLY 14 24.075 13.875 1.169 114 H SER 15 HN SER 15 23.825 16.691 0.491 115 HA SER 15 HA SER 15 21.185 17.135 1.511 116 HB2 SER 15 HB2 SER 15 21.801 19.561 1.182 117 HB3 SER 15 HB1 SER 15 22.923 18.645 2.184 118 HG SER 15 HG SER 15 23.866 19.986 0.473 119 H LEU 16 HN LEU 16 22.780 17.811 -1.601 120 HA LEU 16 HA LEU 16 20.441 18.880 -2.842 121 HB2 LEU 16 HB2 LEU 16 23.096 17.866 -3.867 122 HB3 LEU 16 HB1 LEU 16 21.821 18.348 -4.983 123 HG LEU 16 HG LEU 16 21.751 20.584 -3.991 124 HD11 LEU 16 HD11 LEU 16 23.638 21.141 -2.324 125 HD12 LEU 16 HD12 LEU 16 23.780 19.401 -2.081 126 HD13 LEU 16 HD13 LEU 16 22.268 20.225 -1.698 127 HD21 LEU 16 HD21 LEU 16 23.977 21.354 -4.704 128 HD22 LEU 16 HD22 LEU 16 23.377 20.115 -5.807 129 HD23 LEU 16 HD23 LEU 16 24.594 19.705 -4.598 Start of MODEL 9 1 H1 GLY 1 HT1 GLY 1 39.921 1.689 1.640 2 H2 GLY 1 HT2 GLY 1 40.072 1.086 3.222 3 H3 GLY 1 HT3 GLY 1 40.449 2.709 2.886 4 HA2 GLY 1 HA1 GLY 1 37.890 1.411 3.211 5 HA3 GLY 1 HA2 GLY 1 38.428 2.998 3.740 6 H LEU 2 HN LEU 2 38.539 1.504 0.530 7 HA LEU 2 HA LEU 2 37.939 3.677 -1.008 8 HB2 LEU 2 HB2 LEU 2 38.550 1.570 -2.007 9 HB3 LEU 2 HB1 LEU 2 37.104 0.791 -1.376 10 HG LEU 2 HG LEU 2 35.685 2.152 -2.823 11 HD11 LEU 2 HD11 LEU 2 38.306 3.518 -3.493 12 HD12 LEU 2 HD12 LEU 2 36.791 4.255 -2.972 13 HD13 LEU 2 HD13 LEU 2 36.928 3.587 -4.593 14 HD21 LEU 2 HD21 LEU 2 36.335 1.203 -4.948 15 HD22 LEU 2 HD22 LEU 2 36.786 0.053 -3.690 16 HD23 LEU 2 HD23 LEU 2 38.016 1.074 -4.433 17 H PHE 3 HN PHE 3 35.669 1.645 0.773 18 HA PHE 3 HA PHE 3 33.330 3.037 -0.258 19 HB2 PHE 3 HB2 PHE 3 33.534 1.092 2.057 20 HB3 PHE 3 HB1 PHE 3 32.067 1.577 1.207 21 HD1 PHE 3 HD1 PHE 3 35.245 -0.322 0.939 22 HD2 PHE 3 HD2 PHE 3 31.507 0.670 -0.978 23 HE1 PHE 3 HE1 PHE 3 35.615 -2.139 -0.726 24 HE2 PHE 3 HE2 PHE 3 31.878 -1.146 -2.643 25 HZ PHE 3 HZ PHE 3 33.876 -2.621 -2.444 26 H ASP 4 HN ASP 4 35.500 3.186 2.434 27 HA ASP 4 HA ASP 4 33.852 4.691 4.206 28 HB2 ASP 4 HB2 ASP 4 35.969 3.436 4.819 29 HB3 ASP 4 HB1 ASP 4 36.873 4.756 4.075 30 H ILE 5 HN ILE 5 36.231 5.581 1.735 31 HA ILE 5 HA ILE 5 36.026 8.405 2.230 32 HB ILE 5 HB ILE 5 37.051 7.072 -0.294 33 HG12 ILE 5 HG12 ILE 5 38.459 7.616 2.343 34 HG13 ILE 5 HG11 ILE 5 38.159 6.038 1.619 35 HG21 ILE 5 HG21 ILE 5 37.936 9.647 1.041 36 HG22 ILE 5 HG22 ILE 5 36.667 9.606 -0.183 37 HG23 ILE 5 HG23 ILE 5 38.302 9.094 -0.593 38 HD11 ILE 5 HD1 ILE 5 39.512 6.932 -0.410 39 HD12 ILE 5 HD2 ILE 5 40.409 6.504 1.047 40 HD13 ILE 5 HD3 ILE 5 40.061 8.194 0.695 41 H VAL 6 HN VAL 6 34.961 6.340 -0.492 42 HA VAL 6 HA VAL 6 33.565 8.211 -1.953 43 HB VAL 6 HB VAL 6 32.886 5.288 -1.509 44 HG11 VAL 6 HG11 VAL 6 30.878 6.287 -2.345 45 HG12 VAL 6 HG12 VAL 6 31.678 5.593 -3.753 46 HG13 VAL 6 HG13 VAL 6 31.772 7.329 -3.451 47 HG21 VAL 6 HG21 VAL 6 34.202 6.637 -3.885 48 HG22 VAL 6 HG22 VAL 6 34.120 4.912 -3.532 49 HG23 VAL 6 HG23 VAL 6 35.128 5.967 -2.544 50 H LYS 7 HN LYS 7 32.691 6.781 1.102 51 HA LYS 7 HA LYS 7 29.909 7.373 1.024 52 HB2 LYS 7 HB2 LYS 7 30.919 5.777 2.633 53 HB3 LYS 7 HB1 LYS 7 31.719 7.129 3.437 54 HG2 LYS 7 HG2 LYS 7 29.627 8.096 4.096 55 HG3 LYS 7 HG1 LYS 7 28.718 7.015 3.043 56 HD2 LYS 7 HD2 LYS 7 28.525 6.213 5.330 57 HD3 LYS 7 HD1 LYS 7 29.510 5.077 4.411 58 HE2 LYS 7 HE2 LYS 7 30.820 7.307 5.974 59 HE3 LYS 7 HE1 LYS 7 30.346 5.807 6.771 60 HZ1 LYS 7 HZ1 LYS 7 32.204 4.916 6.012 61 HZ2 LYS 7 HZ2 LYS 7 32.572 6.304 5.104 62 HZ3 LYS 7 HZ3 LYS 7 31.616 5.073 4.430 63 H LYS 8 HN LYS 8 32.750 9.154 2.152 64 HA LYS 8 HA LYS 8 31.262 11.354 3.226 65 HB2 LYS 8 HB2 LYS 8 34.168 11.083 2.424 66 HB3 LYS 8 HB1 LYS 8 33.489 12.491 3.243 67 HG2 LYS 8 HG2 LYS 8 32.926 11.215 5.185 68 HG3 LYS 8 HG1 LYS 8 33.219 9.687 4.353 69 HD2 LYS 8 HD2 LYS 8 35.098 10.228 5.844 70 HD3 LYS 8 HD1 LYS 8 35.618 10.255 4.160 71 HE2 LYS 8 HE2 LYS 8 35.685 12.623 4.099 72 HE3 LYS 8 HE1 LYS 8 34.705 12.776 5.559 73 HZ1 LYS 8 HZ1 LYS 8 37.402 12.874 5.473 74 HZ2 LYS 8 HZ2 LYS 8 37.121 11.265 5.938 75 HZ3 LYS 8 HZ3 LYS 8 36.481 12.542 6.859 76 H VAL 9 HN VAL 9 32.535 10.521 0.083 77 HA VAL 9 HA VAL 9 32.562 13.066 -1.111 78 HB VAL 9 HB VAL 9 31.916 10.409 -2.430 79 HG11 VAL 9 HG11 VAL 9 32.781 13.110 -3.496 80 HG12 VAL 9 HG12 VAL 9 31.316 12.214 -3.899 81 HG13 VAL 9 HG13 VAL 9 32.887 11.625 -4.441 82 HG21 VAL 9 HG21 VAL 9 34.565 11.863 -2.121 83 HG22 VAL 9 HG22 VAL 9 34.312 10.316 -2.929 84 HG23 VAL 9 HG23 VAL 9 34.082 10.448 -1.186 85 H VAL 10 HN VAL 10 30.082 10.552 -1.642 86 HA VAL 10 HA VAL 10 28.165 12.281 -2.740 87 HB VAL 10 HB VAL 10 26.510 10.492 -2.178 88 HG11 VAL 10 HG11 VAL 10 27.482 8.824 -3.631 89 HG12 VAL 10 HG12 VAL 10 29.115 9.375 -3.254 90 HG13 VAL 10 HG13 VAL 10 28.031 10.404 -4.192 91 HG21 VAL 10 HG21 VAL 10 27.369 9.762 -0.033 92 HG22 VAL 10 HG22 VAL 10 28.919 9.326 -0.750 93 HG23 VAL 10 HG23 VAL 10 27.472 8.399 -1.146 94 H GLY 11 HN GLY 11 29.236 11.945 0.473 95 HA2 GLY 11 HA1 GLY 11 26.831 12.677 1.826 96 HA3 GLY 11 HA2 GLY 11 28.457 12.714 2.495 97 H ALA 12 HN ALA 12 29.188 14.427 0.049 98 HA ALA 12 HA ALA 12 28.832 16.961 1.361 99 HB1 ALA 12 HB1 ALA 12 30.850 16.283 0.019 100 HB2 ALA 12 HB2 ALA 12 30.173 17.855 -0.405 101 HB3 ALA 12 HB3 ALA 12 29.861 16.453 -1.429 102 H PHE 13 HN PHE 13 26.765 15.142 -0.437 103 HA PHE 13 HA PHE 13 24.839 15.570 -1.617 104 HB2 PHE 13 HB2 PHE 13 25.002 18.275 -0.271 105 HB3 PHE 13 HB1 PHE 13 23.557 17.500 -0.922 106 HD1 PHE 13 HD1 PHE 13 22.721 15.339 0.104 107 HD2 PHE 13 HD2 PHE 13 25.819 17.732 1.927 108 HE1 PHE 13 HE1 PHE 13 22.359 14.161 2.268 109 HE2 PHE 13 HE2 PHE 13 25.455 16.552 4.091 110 HZ PHE 13 HZ PHE 13 23.683 14.812 4.277 111 H GLY 14 HN GLY 14 27.355 16.128 -2.919 112 HA2 GLY 14 HA1 GLY 14 27.397 18.565 -4.297 113 HA3 GLY 14 HA2 GLY 14 28.145 17.072 -4.849 114 H SER 15 HN SER 15 25.003 16.309 -4.387 115 HA SER 15 HA SER 15 23.781 17.470 -6.704 116 HB2 SER 15 HB2 SER 15 23.699 15.505 -8.112 117 HB3 SER 15 HB1 SER 15 25.385 15.869 -7.759 118 HG SER 15 HG SER 15 25.174 14.316 -6.012 119 H LEU 16 HN LEU 16 23.705 14.306 -5.037 120 HA LEU 16 HA LEU 16 20.840 14.285 -4.918 121 HB2 LEU 16 HB2 LEU 16 22.659 12.576 -3.217 122 HB3 LEU 16 HB1 LEU 16 21.060 12.187 -3.850 123 HG LEU 16 HG LEU 16 23.611 12.511 -5.458 124 HD11 LEU 16 HD11 LEU 16 23.312 10.380 -4.165 125 HD12 LEU 16 HD12 LEU 16 23.352 10.140 -5.911 126 HD13 LEU 16 HD13 LEU 16 21.812 10.105 -5.051 127 HD21 LEU 16 HD21 LEU 16 21.851 13.361 -6.835 128 HD22 LEU 16 HD22 LEU 16 20.723 12.119 -6.293 129 HD23 LEU 16 HD23 LEU 16 22.070 11.688 -7.348 Start of MODEL 10 1 H1 GLY 1 HT1 GLY 1 39.740 -1.116 3.330 2 H2 GLY 1 HT2 GLY 1 39.181 0.466 3.604 3 H3 GLY 1 HT3 GLY 1 40.540 0.198 2.617 4 HA2 GLY 1 HA1 GLY 1 39.085 -1.099 1.129 5 HA3 GLY 1 HA2 GLY 1 37.739 -0.478 2.077 6 H LEU 2 HN LEU 2 36.761 0.901 0.747 7 HA LEU 2 HA LEU 2 38.045 3.396 0.130 8 HB2 LEU 2 HB2 LEU 2 37.973 3.307 -2.253 9 HB3 LEU 2 HB1 LEU 2 38.817 1.855 -1.729 10 HG LEU 2 HG LEU 2 35.925 2.054 -2.633 11 HD11 LEU 2 HD11 LEU 2 36.651 0.643 -4.457 12 HD12 LEU 2 HD12 LEU 2 38.252 0.463 -3.741 13 HD13 LEU 2 HD13 LEU 2 37.740 2.028 -4.371 14 HD21 LEU 2 HD21 LEU 2 37.462 -0.198 -1.310 15 HD22 LEU 2 HD22 LEU 2 36.078 -0.518 -2.354 16 HD23 LEU 2 HD23 LEU 2 35.869 0.436 -0.890 17 H PHE 3 HN PHE 3 35.464 1.586 0.938 18 HA PHE 3 HA PHE 3 33.365 3.136 -0.354 19 HB2 PHE 3 HB2 PHE 3 33.278 1.054 1.846 20 HB3 PHE 3 HB1 PHE 3 31.861 1.787 1.095 21 HD1 PHE 3 HD1 PHE 3 34.095 -0.973 0.927 22 HD2 PHE 3 HD2 PHE 3 31.851 1.744 -1.571 23 HE1 PHE 3 HE1 PHE 3 34.206 -2.604 -0.950 24 HE2 PHE 3 HE2 PHE 3 31.965 0.109 -3.447 25 HZ PHE 3 HZ PHE 3 33.178 -2.046 -3.150 26 H ASP 4 HN ASP 4 35.115 3.032 2.655 27 HA ASP 4 HA ASP 4 33.371 4.706 4.167 28 HB2 ASP 4 HB2 ASP 4 35.321 4.982 5.670 29 HB3 ASP 4 HB1 ASP 4 35.035 3.288 5.263 30 H ILE 5 HN ILE 5 35.862 5.279 1.813 31 HA ILE 5 HA ILE 5 36.158 8.103 2.433 32 HB ILE 5 HB ILE 5 37.103 6.683 -0.075 33 HG12 ILE 5 HG12 ILE 5 38.495 6.913 2.617 34 HG13 ILE 5 HG11 ILE 5 37.862 5.424 1.916 35 HG21 ILE 5 HG21 ILE 5 37.146 9.240 0.156 36 HG22 ILE 5 HG22 ILE 5 38.682 8.467 -0.223 37 HG23 ILE 5 HG23 ILE 5 38.347 9.003 1.424 38 HD11 ILE 5 HD1 ILE 5 40.191 7.097 0.964 39 HD12 ILE 5 HD2 ILE 5 39.393 5.945 -0.107 40 HD13 ILE 5 HD3 ILE 5 40.169 5.383 1.373 41 H VAL 6 HN VAL 6 34.916 6.224 -0.343 42 HA VAL 6 HA VAL 6 33.890 8.362 -1.811 43 HB VAL 6 HB VAL 6 32.885 5.503 -1.647 44 HG11 VAL 6 HG11 VAL 6 32.223 7.772 -3.540 45 HG12 VAL 6 HG12 VAL 6 31.102 6.793 -2.594 46 HG13 VAL 6 HG13 VAL 6 31.957 6.080 -3.962 47 HG21 VAL 6 HG21 VAL 6 34.248 5.151 -3.614 48 HG22 VAL 6 HG22 VAL 6 35.267 5.914 -2.394 49 HG23 VAL 6 HG23 VAL 6 34.619 6.871 -3.725 50 H LYS 7 HN LYS 7 32.673 6.817 1.055 51 HA LYS 7 HA LYS 7 29.958 7.582 0.864 52 HB2 LYS 7 HB2 LYS 7 30.744 5.922 2.492 53 HB3 LYS 7 HB1 LYS 7 31.665 7.170 3.331 54 HG2 LYS 7 HG2 LYS 7 29.671 8.344 3.966 55 HG3 LYS 7 HG1 LYS 7 28.673 7.356 2.898 56 HD2 LYS 7 HD2 LYS 7 29.201 5.360 4.255 57 HD3 LYS 7 HD1 LYS 7 30.181 6.356 5.333 58 HE2 LYS 7 HE2 LYS 7 27.239 6.840 4.791 59 HE3 LYS 7 HE1 LYS 7 27.850 5.948 6.184 60 HZ1 LYS 7 HZ1 LYS 7 28.966 7.850 6.976 61 HZ2 LYS 7 HZ2 LYS 7 27.405 8.372 6.554 62 HZ3 LYS 7 HZ3 LYS 7 28.721 8.704 5.531 63 H LYS 8 HN LYS 8 32.844 9.328 1.671 64 HA LYS 8 HA LYS 8 31.534 11.531 2.987 65 HB2 LYS 8 HB2 LYS 8 33.893 10.974 3.429 66 HB3 LYS 8 HB1 LYS 8 34.294 11.345 1.752 67 HG2 LYS 8 HG2 LYS 8 33.686 13.657 2.034 68 HG3 LYS 8 HG1 LYS 8 32.993 13.339 3.623 69 HD2 LYS 8 HD2 LYS 8 35.169 12.821 4.544 70 HD3 LYS 8 HD1 LYS 8 35.912 12.897 2.945 71 HE2 LYS 8 HE2 LYS 8 34.513 15.242 4.257 72 HE3 LYS 8 HE1 LYS 8 36.255 14.974 4.332 73 HZ1 LYS 8 HZ1 LYS 8 35.396 14.724 1.667 74 HZ2 LYS 8 HZ2 LYS 8 36.466 15.863 2.334 75 HZ3 LYS 8 HZ3 LYS 8 34.798 16.184 2.291 76 H VAL 9 HN VAL 9 32.924 10.987 -0.246 77 HA VAL 9 HA VAL 9 32.515 13.488 -1.362 78 HB VAL 9 HB VAL 9 32.084 10.859 -2.810 79 HG11 VAL 9 HG11 VAL 9 31.415 12.785 -4.128 80 HG12 VAL 9 HG12 VAL 9 32.966 12.209 -4.737 81 HG13 VAL 9 HG13 VAL 9 32.899 13.640 -3.708 82 HG21 VAL 9 HG21 VAL 9 34.624 12.403 -2.192 83 HG22 VAL 9 HG22 VAL 9 34.528 11.063 -3.335 84 HG23 VAL 9 HG23 VAL 9 34.212 10.785 -1.623 85 H VAL 10 HN VAL 10 30.277 10.710 -1.614 86 HA VAL 10 HA VAL 10 28.161 12.226 -2.739 87 HB VAL 10 HB VAL 10 26.734 10.280 -2.200 88 HG11 VAL 10 HG11 VAL 10 29.480 9.446 -3.182 89 HG12 VAL 10 HG12 VAL 10 28.267 10.253 -4.176 90 HG13 VAL 10 HG13 VAL 10 27.950 8.641 -3.532 91 HG21 VAL 10 HG21 VAL 10 27.884 8.316 -1.080 92 HG22 VAL 10 HG22 VAL 10 27.568 9.684 -0.013 93 HG23 VAL 10 HG23 VAL 10 29.192 9.416 -0.648 94 H GLY 11 HN GLY 11 29.343 11.931 0.459 95 HA2 GLY 11 HA1 GLY 11 26.907 12.467 1.856 96 HA3 GLY 11 HA2 GLY 11 28.535 12.588 2.510 97 H ALA 12 HN ALA 12 29.268 14.425 0.238 98 HA ALA 12 HA ALA 12 28.693 16.877 1.588 99 HB1 ALA 12 HB1 ALA 12 29.849 16.429 -1.168 100 HB2 ALA 12 HB2 ALA 12 30.779 16.485 0.330 101 HB3 ALA 12 HB3 ALA 12 29.928 17.923 -0.234 102 H PHE 13 HN PHE 13 27.599 15.440 -1.475 103 HA PHE 13 HA PHE 13 25.900 17.614 -2.189 104 HB2 PHE 13 HB2 PHE 13 26.796 15.875 -3.776 105 HB3 PHE 13 HB1 PHE 13 25.657 14.729 -3.069 106 HD1 PHE 13 HD1 PHE 13 23.205 15.058 -3.303 107 HD2 PHE 13 HD2 PHE 13 26.045 17.676 -5.231 108 HE1 PHE 13 HE1 PHE 13 21.396 15.941 -4.772 109 HE2 PHE 13 HE2 PHE 13 24.236 18.558 -6.700 110 HZ PHE 13 HZ PHE 13 21.900 17.733 -6.428 111 H GLY 14 HN GLY 14 25.581 14.924 -0.045 112 HA2 GLY 14 HA1 GLY 14 22.727 14.794 -0.013 113 HA3 GLY 14 HA2 GLY 14 23.816 14.092 1.174 114 H SER 15 HN SER 15 24.926 17.047 1.209 115 HA SER 15 HA SER 15 22.842 18.512 2.556 116 HB2 SER 15 HB2 SER 15 25.152 17.473 4.214 117 HB3 SER 15 HB1 SER 15 23.877 18.556 4.763 118 HG SER 15 HG SER 15 22.645 16.883 5.030 119 H LEU 16 HN LEU 16 23.595 19.888 0.793 120 HA LEU 16 HA LEU 16 26.139 20.883 0.425 121 HB2 LEU 16 HB2 LEU 16 24.294 21.405 -1.084 122 HB3 LEU 16 HB1 LEU 16 23.491 22.334 0.175 123 HG LEU 16 HG LEU 16 25.324 23.968 0.185 124 HD11 LEU 16 HD11 LEU 16 27.020 23.711 -1.790 125 HD12 LEU 16 HD12 LEU 16 26.572 22.006 -1.752 126 HD13 LEU 16 HD13 LEU 16 27.294 22.763 -0.332 127 HD21 LEU 16 HD21 LEU 16 24.972 24.883 -2.083 128 HD22 LEU 16 HD22 LEU 16 23.464 24.270 -1.405 129 HD23 LEU 16 HD23 LEU 16 24.337 23.325 -2.611 Start of MODEL 11 1 H1 GLY 1 HT1 GLY 1 39.953 2.582 3.290 2 H2 GLY 1 HT2 GLY 1 39.916 1.152 4.208 3 H3 GLY 1 HT3 GLY 1 38.792 2.392 4.510 4 HA2 GLY 1 HA1 GLY 1 38.895 0.441 2.370 5 HA3 GLY 1 HA2 GLY 1 37.528 0.991 3.328 6 H LEU 2 HN LEU 2 37.320 0.780 0.604 7 HA LEU 2 HA LEU 2 37.758 3.382 -0.629 8 HB2 LEU 2 HB2 LEU 2 36.024 1.246 -1.867 9 HB3 LEU 2 HB1 LEU 2 37.147 2.363 -2.644 10 HG LEU 2 HG LEU 2 37.895 -0.019 -0.923 11 HD11 LEU 2 HD11 LEU 2 38.822 -0.889 -3.052 12 HD12 LEU 2 HD12 LEU 2 38.187 0.525 -3.894 13 HD13 LEU 2 HD13 LEU 2 37.080 -0.634 -3.157 14 HD21 LEU 2 HD21 LEU 2 39.551 1.712 -0.603 15 HD22 LEU 2 HD22 LEU 2 39.554 2.101 -2.322 16 HD23 LEU 2 HD23 LEU 2 40.224 0.569 -1.765 17 H PHE 3 HN PHE 3 35.246 1.604 0.960 18 HA PHE 3 HA PHE 3 33.090 3.363 0.120 19 HB2 PHE 3 HB2 PHE 3 33.222 1.197 2.236 20 HB3 PHE 3 HB1 PHE 3 31.755 2.053 1.759 21 HD1 PHE 3 HD1 PHE 3 30.649 1.597 -0.359 22 HD2 PHE 3 HD2 PHE 3 34.392 -0.308 0.638 23 HE1 PHE 3 HE1 PHE 3 30.356 0.023 -2.267 24 HE2 PHE 3 HE2 PHE 3 34.099 -1.883 -1.271 25 HZ PHE 3 HZ PHE 3 32.122 -1.662 -2.771 26 H ASP 4 HN ASP 4 35.475 3.195 2.567 27 HA ASP 4 HA ASP 4 34.127 4.892 4.488 28 HB2 ASP 4 HB2 ASP 4 37.023 4.039 4.253 29 HB3 ASP 4 HB1 ASP 4 36.332 4.912 5.622 30 H ILE 5 HN ILE 5 35.029 5.602 1.516 31 HA ILE 5 HA ILE 5 35.862 8.367 2.193 32 HB ILE 5 HB ILE 5 36.936 6.840 -0.200 33 HG12 ILE 5 HG12 ILE 5 38.269 7.375 2.479 34 HG13 ILE 5 HG11 ILE 5 37.733 5.798 1.904 35 HG21 ILE 5 HG21 ILE 5 36.815 9.402 -0.176 36 HG22 ILE 5 HG22 ILE 5 38.409 8.708 -0.452 37 HG23 ILE 5 HG23 ILE 5 37.990 9.349 1.137 38 HD11 ILE 5 HD1 ILE 5 39.978 7.515 0.841 39 HD12 ILE 5 HD2 ILE 5 39.260 6.241 -0.145 40 HD13 ILE 5 HD3 ILE 5 40.042 5.839 1.383 41 H VAL 6 HN VAL 6 34.767 6.278 -0.500 42 HA VAL 6 HA VAL 6 33.664 8.279 -2.094 43 HB VAL 6 HB VAL 6 32.706 5.416 -1.756 44 HG11 VAL 6 HG11 VAL 6 32.112 7.540 -3.833 45 HG12 VAL 6 HG12 VAL 6 30.957 6.641 -2.848 46 HG13 VAL 6 HG13 VAL 6 31.849 5.820 -4.127 47 HG21 VAL 6 HG21 VAL 6 34.152 4.907 -3.609 48 HG22 VAL 6 HG22 VAL 6 35.123 5.823 -2.457 49 HG23 VAL 6 HG23 VAL 6 34.487 6.615 -3.898 50 H LYS 7 HN LYS 7 32.596 7.039 0.924 51 HA LYS 7 HA LYS 7 29.816 7.665 0.667 52 HB2 LYS 7 HB2 LYS 7 30.656 6.067 2.347 53 HB3 LYS 7 HB1 LYS 7 31.515 7.377 3.158 54 HG2 LYS 7 HG2 LYS 7 29.456 8.500 3.700 55 HG3 LYS 7 HG1 LYS 7 28.525 7.404 2.679 56 HD2 LYS 7 HD2 LYS 7 29.105 5.518 4.146 57 HD3 LYS 7 HD1 LYS 7 30.073 6.592 5.157 58 HE2 LYS 7 HE2 LYS 7 27.754 6.152 6.046 59 HE3 LYS 7 HE1 LYS 7 28.121 7.860 5.799 60 HZ1 LYS 7 HZ1 LYS 7 25.963 6.584 4.811 61 HZ2 LYS 7 HZ2 LYS 7 27.022 6.551 3.482 62 HZ3 LYS 7 HZ3 LYS 7 26.597 8.032 4.198 63 H LYS 8 HN LYS 8 32.649 9.362 1.940 64 HA LYS 8 HA LYS 8 31.262 11.616 2.960 65 HB2 LYS 8 HB2 LYS 8 33.553 11.096 3.638 66 HB3 LYS 8 HB1 LYS 8 34.117 11.350 1.986 67 HG2 LYS 8 HG2 LYS 8 33.626 13.684 2.065 68 HG3 LYS 8 HG1 LYS 8 32.668 13.511 3.535 69 HD2 LYS 8 HD2 LYS 8 34.922 14.472 3.984 70 HD3 LYS 8 HD1 LYS 8 34.668 12.939 4.818 71 HE2 LYS 8 HE2 LYS 8 36.916 13.253 3.583 72 HE3 LYS 8 HE1 LYS 8 36.042 11.752 3.292 73 HZ1 LYS 8 HZ1 LYS 8 35.587 14.093 1.564 74 HZ2 LYS 8 HZ2 LYS 8 35.362 12.445 1.216 75 HZ3 LYS 8 HZ3 LYS 8 36.930 13.092 1.300 76 H VAL 9 HN VAL 9 32.604 10.829 -0.205 77 HA VAL 9 HA VAL 9 32.472 13.344 -1.416 78 HB VAL 9 HB VAL 9 31.893 10.674 -2.734 79 HG11 VAL 9 HG11 VAL 9 32.843 11.902 -4.735 80 HG12 VAL 9 HG12 VAL 9 32.748 13.385 -3.784 81 HG13 VAL 9 HG13 VAL 9 31.277 12.498 -4.184 82 HG21 VAL 9 HG21 VAL 9 34.271 10.554 -3.175 83 HG22 VAL 9 HG22 VAL 9 34.059 10.802 -1.442 84 HG23 VAL 9 HG23 VAL 9 34.529 12.152 -2.476 85 H VAL 10 HN VAL 10 30.068 10.730 -1.811 86 HA VAL 10 HA VAL 10 28.077 12.466 -2.866 87 HB VAL 10 HB VAL 10 26.528 10.554 -2.528 88 HG11 VAL 10 HG11 VAL 10 28.057 10.664 -4.499 89 HG12 VAL 10 HG12 VAL 10 27.674 9.008 -4.028 90 HG13 VAL 10 HG13 VAL 10 29.236 9.708 -3.602 91 HG21 VAL 10 HG21 VAL 10 27.333 9.689 -0.416 92 HG22 VAL 10 HG22 VAL 10 28.936 9.398 -1.092 93 HG23 VAL 10 HG23 VAL 10 27.564 8.428 -1.628 94 H GLY 11 HN GLY 11 28.984 11.504 0.356 95 HA2 GLY 11 HA1 GLY 11 26.600 12.121 1.717 96 HA3 GLY 11 HA2 GLY 11 28.210 12.110 2.424 97 H ALA 12 HN ALA 12 29.346 14.120 0.754 98 HA ALA 12 HA ALA 12 28.460 16.455 2.168 99 HB1 ALA 12 HB1 ALA 12 30.383 16.219 -0.150 100 HB2 ALA 12 HB2 ALA 12 30.820 16.074 1.552 101 HB3 ALA 12 HB3 ALA 12 30.209 17.605 0.925 102 H PHE 13 HN PHE 13 28.075 15.194 -1.102 103 HA PHE 13 HA PHE 13 27.007 17.481 -2.329 104 HB2 PHE 13 HB2 PHE 13 27.707 15.487 -3.583 105 HB3 PHE 13 HB1 PHE 13 26.376 14.571 -2.877 106 HD1 PHE 13 HD1 PHE 13 24.158 14.712 -3.782 107 HD2 PHE 13 HD2 PHE 13 27.186 17.536 -5.006 108 HE1 PHE 13 HE1 PHE 13 22.641 15.567 -5.563 109 HE2 PHE 13 HE2 PHE 13 25.668 18.391 -6.786 110 HZ PHE 13 HZ PHE 13 23.367 17.459 -7.012 111 H GLY 14 HN GLY 14 25.587 15.114 -0.192 112 HA2 GLY 14 HA1 GLY 14 22.859 15.865 -0.690 113 HA3 GLY 14 HA2 GLY 14 23.444 14.842 0.616 114 H SER 15 HN SER 15 24.472 18.141 -0.123 115 HA SER 15 HA SER 15 22.864 19.356 1.919 116 HB2 SER 15 HB2 SER 15 25.801 18.904 2.489 117 HB3 SER 15 HB1 SER 15 24.749 19.974 3.411 118 HG SER 15 HG SER 15 25.106 17.548 3.971 119 H LEU 16 HN LEU 16 26.085 19.721 0.412 120 HA LEU 16 HA LEU 16 25.823 22.553 0.120 121 HB2 LEU 16 HB2 LEU 16 27.706 20.814 -1.478 122 HB3 LEU 16 HB1 LEU 16 27.935 22.479 -0.943 123 HG LEU 16 HG LEU 16 27.846 20.014 0.823 124 HD11 LEU 16 HD11 LEU 16 30.191 20.584 1.279 125 HD12 LEU 16 HD12 LEU 16 30.074 21.981 0.207 126 HD13 LEU 16 HD13 LEU 16 29.946 20.350 -0.452 127 HD21 LEU 16 HD21 LEU 16 27.974 22.974 1.466 128 HD22 LEU 16 HD22 LEU 16 28.530 21.745 2.602 129 HD23 LEU 16 HD23 LEU 16 26.844 21.773 2.094 Start of MODEL 12 1 H1 GLY 1 HT1 GLY 1 39.913 0.278 3.552 2 H2 GLY 1 HT2 GLY 1 39.736 1.827 2.878 3 H3 GLY 1 HT3 GLY 1 40.773 0.693 2.152 4 HA2 GLY 1 HA1 GLY 1 38.983 -0.679 1.546 5 HA3 GLY 1 HA2 GLY 1 37.870 0.356 2.434 6 H LEU 2 HN LEU 2 36.599 1.133 0.886 7 HA LEU 2 HA LEU 2 37.624 3.148 -0.869 8 HB2 LEU 2 HB2 LEU 2 37.152 2.157 -2.987 9 HB3 LEU 2 HB1 LEU 2 38.151 1.003 -2.110 10 HG LEU 2 HG LEU 2 35.144 0.886 -2.508 11 HD11 LEU 2 HD11 LEU 2 35.699 -1.235 -3.646 12 HD12 LEU 2 HD12 LEU 2 37.412 -0.944 -3.345 13 HD13 LEU 2 HD13 LEU 2 36.510 0.133 -4.409 14 HD21 LEU 2 HD21 LEU 2 35.454 -1.369 -1.281 15 HD22 LEU 2 HD22 LEU 2 35.472 0.082 -0.287 16 HD23 LEU 2 HD23 LEU 2 36.989 -0.712 -0.709 17 H PHE 3 HN PHE 3 35.294 1.780 0.985 18 HA PHE 3 HA PHE 3 33.020 3.109 -0.374 19 HB2 PHE 3 HB2 PHE 3 33.176 1.083 1.872 20 HB3 PHE 3 HB1 PHE 3 31.683 1.914 1.440 21 HD1 PHE 3 HD1 PHE 3 31.147 1.927 -1.194 22 HD2 PHE 3 HD2 PHE 3 33.600 -0.998 0.827 23 HE1 PHE 3 HE1 PHE 3 30.752 0.311 -3.047 24 HE2 PHE 3 HE2 PHE 3 33.202 -2.610 -1.029 25 HZ PHE 3 HZ PHE 3 31.831 -1.933 -2.996 26 H ASP 4 HN ASP 4 34.823 3.030 2.675 27 HA ASP 4 HA ASP 4 33.263 4.907 4.082 28 HB2 ASP 4 HB2 ASP 4 35.327 5.225 5.463 29 HB3 ASP 4 HB1 ASP 4 34.869 3.534 5.254 30 H ILE 5 HN ILE 5 35.958 5.293 1.834 31 HA ILE 5 HA ILE 5 36.241 8.117 2.265 32 HB ILE 5 HB ILE 5 37.133 6.587 -0.194 33 HG12 ILE 5 HG12 ILE 5 38.463 6.833 2.525 34 HG13 ILE 5 HG11 ILE 5 37.896 5.348 1.766 35 HG21 ILE 5 HG21 ILE 5 38.767 8.320 -0.406 36 HG22 ILE 5 HG22 ILE 5 38.438 8.929 1.216 37 HG23 ILE 5 HG23 ILE 5 37.248 9.146 -0.066 38 HD11 ILE 5 HD1 ILE 5 40.236 7.084 0.968 39 HD12 ILE 5 HD2 ILE 5 39.515 5.941 -0.167 40 HD13 ILE 5 HD3 ILE 5 40.226 5.361 1.338 41 H VAL 6 HN VAL 6 34.746 6.134 -0.294 42 HA VAL 6 HA VAL 6 33.827 8.288 -1.869 43 HB VAL 6 HB VAL 6 32.682 5.489 -1.590 44 HG11 VAL 6 HG11 VAL 6 32.179 7.714 -3.584 45 HG12 VAL 6 HG12 VAL 6 30.993 6.864 -2.596 46 HG13 VAL 6 HG13 VAL 6 31.793 6.028 -3.925 47 HG21 VAL 6 HG21 VAL 6 34.479 6.625 -3.752 48 HG22 VAL 6 HG22 VAL 6 34.045 4.936 -3.489 49 HG23 VAL 6 HG23 VAL 6 35.105 5.763 -2.348 50 H LYS 7 HN LYS 7 32.634 6.861 1.064 51 HA LYS 7 HA LYS 7 29.941 7.722 0.923 52 HB2 LYS 7 HB2 LYS 7 30.747 6.061 2.562 53 HB3 LYS 7 HB1 LYS 7 31.677 7.322 3.373 54 HG2 LYS 7 HG2 LYS 7 29.683 8.521 3.975 55 HG3 LYS 7 HG1 LYS 7 28.683 7.494 2.947 56 HD2 LYS 7 HD2 LYS 7 29.120 5.565 4.363 57 HD3 LYS 7 HD1 LYS 7 30.254 6.497 5.341 58 HE2 LYS 7 HE2 LYS 7 27.320 7.186 5.022 59 HE3 LYS 7 HE1 LYS 7 27.984 6.290 6.388 60 HZ1 LYS 7 HZ1 LYS 7 29.613 8.414 6.282 61 HZ2 LYS 7 HZ2 LYS 7 28.235 8.317 7.270 62 HZ3 LYS 7 HZ3 LYS 7 28.153 9.109 5.769 63 H LYS 8 HN LYS 8 32.907 9.284 2.019 64 HA LYS 8 HA LYS 8 31.693 11.575 3.176 65 HB2 LYS 8 HB2 LYS 8 34.055 10.856 3.568 66 HB3 LYS 8 HB1 LYS 8 34.440 11.361 1.923 67 HG2 LYS 8 HG2 LYS 8 33.814 13.652 2.416 68 HG3 LYS 8 HG1 LYS 8 33.231 13.190 4.016 69 HD2 LYS 8 HD2 LYS 8 35.483 12.552 4.699 70 HD3 LYS 8 HD1 LYS 8 36.097 12.876 3.078 71 HE2 LYS 8 HE2 LYS 8 35.509 15.244 3.300 72 HE3 LYS 8 HE1 LYS 8 34.817 14.942 4.893 73 HZ1 LYS 8 HZ1 LYS 8 37.525 15.372 4.174 74 HZ2 LYS 8 HZ2 LYS 8 37.357 13.871 4.952 75 HZ3 LYS 8 HZ3 LYS 8 36.828 15.292 5.719 76 H VAL 9 HN VAL 9 33.062 10.950 -0.047 77 HA VAL 9 HA VAL 9 32.752 13.456 -1.189 78 HB VAL 9 HB VAL 9 32.252 10.807 -2.580 79 HG11 VAL 9 HG11 VAL 9 31.562 12.666 -3.958 80 HG12 VAL 9 HG12 VAL 9 33.128 12.119 -4.555 81 HG13 VAL 9 HG13 VAL 9 33.022 13.570 -3.558 82 HG21 VAL 9 HG21 VAL 9 34.669 10.925 -3.137 83 HG22 VAL 9 HG22 VAL 9 34.410 10.811 -1.396 84 HG23 VAL 9 HG23 VAL 9 34.821 12.363 -2.126 85 H VAL 10 HN VAL 10 30.436 10.751 -1.485 86 HA VAL 10 HA VAL 10 28.360 12.256 -2.631 87 HB VAL 10 HB VAL 10 28.047 9.814 -0.862 88 HG11 VAL 10 HG11 VAL 10 25.927 10.885 -1.318 89 HG12 VAL 10 HG12 VAL 10 26.045 9.466 -2.357 90 HG13 VAL 10 HG13 VAL 10 26.334 11.073 -3.023 91 HG21 VAL 10 HG21 VAL 10 29.674 9.347 -2.619 92 HG22 VAL 10 HG22 VAL 10 28.614 10.067 -3.833 93 HG23 VAL 10 HG23 VAL 10 28.147 8.566 -3.032 94 H GLY 11 HN GLY 11 29.277 11.711 0.718 95 HA2 GLY 11 HA1 GLY 11 27.012 12.507 2.072 96 HA3 GLY 11 HA2 GLY 11 28.651 12.786 2.644 97 H ALA 12 HN ALA 12 29.289 14.472 0.296 98 HA ALA 12 HA ALA 12 28.537 16.983 1.410 99 HB1 ALA 12 HB1 ALA 12 29.778 17.956 -0.385 100 HB2 ALA 12 HB2 ALA 12 29.655 16.482 -1.346 101 HB3 ALA 12 HB3 ALA 12 30.641 16.502 0.116 102 H PHE 13 HN PHE 13 27.560 15.249 -1.543 103 HA PHE 13 HA PHE 13 25.618 17.261 -2.275 104 HB2 PHE 13 HB2 PHE 13 26.102 14.460 -3.321 105 HB3 PHE 13 HB1 PHE 13 24.991 15.629 -4.037 106 HD1 PHE 13 HD1 PHE 13 28.501 14.663 -3.608 107 HD2 PHE 13 HD2 PHE 13 25.847 17.761 -5.019 108 HE1 PHE 13 HE1 PHE 13 30.386 15.709 -4.858 109 HE2 PHE 13 HE2 PHE 13 27.731 18.806 -6.269 110 HZ PHE 13 HZ PHE 13 30.018 17.828 -6.116 111 H GLY 14 HN GLY 14 25.603 15.302 0.254 112 HA2 GLY 14 HA1 GLY 14 23.142 13.904 0.075 113 HA3 GLY 14 HA2 GLY 14 24.009 14.287 1.555 114 H SER 15 HN SER 15 23.564 17.115 -0.113 115 HA SER 15 HA SER 15 20.837 17.691 0.565 116 HB2 SER 15 HB2 SER 15 22.989 18.951 2.280 117 HB3 SER 15 HB1 SER 15 21.266 19.317 2.336 118 HG SER 15 HG SER 15 20.902 17.479 3.342 119 H LEU 16 HN LEU 16 20.797 18.430 -1.574 120 HA LEU 16 HA LEU 16 21.426 21.178 -1.925 121 HB2 LEU 16 HB2 LEU 16 23.697 20.465 -2.241 122 HB3 LEU 16 HB1 LEU 16 23.202 19.152 -3.303 123 HG LEU 16 HG LEU 16 22.552 20.694 -5.042 124 HD11 LEU 16 HD11 LEU 16 22.940 23.210 -4.615 125 HD12 LEU 16 HD12 LEU 16 22.947 22.796 -2.901 126 HD13 LEU 16 HD13 LEU 16 21.511 22.488 -3.878 127 HD21 LEU 16 HD21 LEU 16 24.961 20.207 -4.873 128 HD22 LEU 16 HD22 LEU 16 25.169 21.581 -3.788 129 HD23 LEU 16 HD23 LEU 16 24.699 21.847 -5.466 Start of MODEL 13 1 H1 GLY 1 HT1 GLY 1 38.865 -1.046 2.875 2 H2 GLY 1 HT2 GLY 1 38.498 -0.266 1.410 3 H3 GLY 1 HT3 GLY 1 37.256 -0.949 2.350 4 HA2 GLY 1 HA1 GLY 1 37.224 0.702 3.817 5 HA3 GLY 1 HA2 GLY 1 38.936 1.035 3.601 6 H LEU 2 HN LEU 2 38.313 0.887 0.576 7 HA LEU 2 HA LEU 2 38.213 3.650 0.116 8 HB2 LEU 2 HB2 LEU 2 38.138 3.140 -2.197 9 HB3 LEU 2 HB1 LEU 2 39.060 1.836 -1.461 10 HG LEU 2 HG LEU 2 36.147 1.741 -2.322 11 HD11 LEU 2 HD11 LEU 2 36.956 0.034 -3.877 12 HD12 LEU 2 HD12 LEU 2 38.590 0.196 -3.236 13 HD13 LEU 2 HD13 LEU 2 37.851 1.535 -4.113 14 HD21 LEU 2 HD21 LEU 2 37.848 -0.229 -0.765 15 HD22 LEU 2 HD22 LEU 2 36.400 -0.719 -1.643 16 HD23 LEU 2 HD23 LEU 2 36.276 0.429 -0.314 17 H PHE 3 HN PHE 3 35.768 1.751 1.256 18 HA PHE 3 HA PHE 3 33.568 3.018 -0.188 19 HB2 PHE 3 HB2 PHE 3 33.399 0.659 0.539 20 HB3 PHE 3 HB1 PHE 3 33.536 1.177 2.219 21 HD1 PHE 3 HD1 PHE 3 31.383 1.148 -0.785 22 HD2 PHE 3 HD2 PHE 3 31.718 2.389 3.334 23 HE1 PHE 3 HE1 PHE 3 28.935 1.605 -0.724 24 HE2 PHE 3 HE2 PHE 3 29.270 2.847 3.396 25 HZ PHE 3 HZ PHE 3 27.895 2.535 1.341 26 H ASP 4 HN ASP 4 35.348 3.382 2.779 27 HA ASP 4 HA ASP 4 33.448 4.986 4.173 28 HB2 ASP 4 HB2 ASP 4 36.450 4.708 4.439 29 HB3 ASP 4 HB1 ASP 4 35.454 5.670 5.534 30 H ILE 5 HN ILE 5 36.054 5.666 1.903 31 HA ILE 5 HA ILE 5 35.932 8.520 2.214 32 HB ILE 5 HB ILE 5 37.053 7.025 -0.174 33 HG12 ILE 5 HG12 ILE 5 38.329 7.587 2.525 34 HG13 ILE 5 HG11 ILE 5 37.966 6.000 1.850 35 HG21 ILE 5 HG21 ILE 5 36.799 9.579 -0.153 36 HG22 ILE 5 HG22 ILE 5 38.417 8.962 -0.468 37 HG23 ILE 5 HG23 ILE 5 38.008 9.587 1.130 38 HD11 ILE 5 HD1 ILE 5 39.486 6.704 -0.128 39 HD12 ILE 5 HD2 ILE 5 40.273 6.306 1.400 40 HD13 ILE 5 HD3 ILE 5 40.047 7.992 0.940 41 H VAL 6 HN VAL 6 34.926 6.294 -0.397 42 HA VAL 6 HA VAL 6 33.686 8.136 -2.061 43 HB VAL 6 HB VAL 6 32.892 5.256 -1.518 44 HG11 VAL 6 HG11 VAL 6 31.891 5.471 -3.863 45 HG12 VAL 6 HG12 VAL 6 32.043 7.216 -3.665 46 HG13 VAL 6 HG13 VAL 6 31.009 6.292 -2.576 47 HG21 VAL 6 HG21 VAL 6 35.240 5.787 -2.385 48 HG22 VAL 6 HG22 VAL 6 34.464 6.417 -3.836 49 HG23 VAL 6 HG23 VAL 6 34.276 4.718 -3.403 50 H LYS 7 HN LYS 7 32.674 6.917 1.016 51 HA LYS 7 HA LYS 7 29.891 7.533 0.766 52 HB2 LYS 7 HB2 LYS 7 30.891 5.941 2.447 53 HB3 LYS 7 HB1 LYS 7 31.510 7.347 3.314 54 HG2 LYS 7 HG2 LYS 7 29.226 8.220 3.564 55 HG3 LYS 7 HG1 LYS 7 28.591 6.841 2.667 56 HD2 LYS 7 HD2 LYS 7 29.651 5.344 4.421 57 HD3 LYS 7 HD1 LYS 7 29.976 6.802 5.359 58 HE2 LYS 7 HE2 LYS 7 27.872 5.802 6.104 59 HE3 LYS 7 HE1 LYS 7 27.546 7.343 5.308 60 HZ1 LYS 7 HZ1 LYS 7 26.064 5.511 4.602 61 HZ2 LYS 7 HZ2 LYS 7 27.411 4.706 3.951 62 HZ3 LYS 7 HZ3 LYS 7 26.929 6.209 3.321 63 H LYS 8 HN LYS 8 32.734 9.269 1.936 64 HA LYS 8 HA LYS 8 31.317 11.499 3.005 65 HB2 LYS 8 HB2 LYS 8 34.181 11.188 2.079 66 HB3 LYS 8 HB1 LYS 8 33.557 12.623 2.894 67 HG2 LYS 8 HG2 LYS 8 32.888 11.231 4.826 68 HG3 LYS 8 HG1 LYS 8 33.538 9.805 4.016 69 HD2 LYS 8 HD2 LYS 8 35.771 10.958 3.925 70 HD3 LYS 8 HD1 LYS 8 35.087 12.249 4.913 71 HE2 LYS 8 HE2 LYS 8 36.219 10.698 6.389 72 HE3 LYS 8 HE1 LYS 8 34.482 10.519 6.634 73 HZ1 LYS 8 HZ1 LYS 8 34.733 8.383 6.165 74 HZ2 LYS 8 HZ2 LYS 8 36.365 8.600 5.740 75 HZ3 LYS 8 HZ3 LYS 8 35.146 8.807 4.574 76 H VAL 9 HN VAL 9 32.534 10.664 -0.174 77 HA VAL 9 HA VAL 9 32.417 13.223 -1.361 78 HB VAL 9 HB VAL 9 31.932 10.558 -2.724 79 HG11 VAL 9 HG11 VAL 9 32.814 13.286 -3.707 80 HG12 VAL 9 HG12 VAL 9 31.342 12.421 -4.149 81 HG13 VAL 9 HG13 VAL 9 32.912 11.817 -4.678 82 HG21 VAL 9 HG21 VAL 9 34.346 10.532 -3.130 83 HG22 VAL 9 HG22 VAL 9 34.046 10.617 -1.395 84 HG23 VAL 9 HG23 VAL 9 34.530 12.065 -2.279 85 H VAL 10 HN VAL 10 30.079 10.533 -1.626 86 HA VAL 10 HA VAL 10 28.062 12.078 -2.871 87 HB VAL 10 HB VAL 10 26.533 10.219 -2.244 88 HG11 VAL 10 HG11 VAL 10 29.229 9.199 -3.178 89 HG12 VAL 10 HG12 VAL 10 28.112 10.090 -4.209 90 HG13 VAL 10 HG13 VAL 10 27.646 8.519 -3.554 91 HG21 VAL 10 HG21 VAL 10 27.357 9.675 -0.039 92 HG22 VAL 10 HG22 VAL 10 28.963 9.315 -0.671 93 HG23 VAL 10 HG23 VAL 10 27.606 8.257 -1.056 94 H GLY 11 HN GLY 11 28.944 11.570 0.470 95 HA2 GLY 11 HA1 GLY 11 26.530 12.430 1.669 96 HA3 GLY 11 HA2 GLY 11 28.113 12.409 2.435 97 H ALA 12 HN ALA 12 29.502 14.167 0.795 98 HA ALA 12 HA ALA 12 28.926 16.646 1.906 99 HB1 ALA 12 HB1 ALA 12 31.078 16.115 0.883 100 HB2 ALA 12 HB2 ALA 12 30.401 17.580 0.170 101 HB3 ALA 12 HB3 ALA 12 30.320 16.053 -0.709 102 H PHE 13 HN PHE 13 27.938 15.321 -1.235 103 HA PHE 13 HA PHE 13 26.656 17.601 -2.240 104 HB2 PHE 13 HB2 PHE 13 27.166 15.581 -3.580 105 HB3 PHE 13 HB1 PHE 13 25.901 14.716 -2.708 106 HD1 PHE 13 HD1 PHE 13 26.573 17.597 -4.980 107 HD2 PHE 13 HD2 PHE 13 23.572 15.025 -3.244 108 HE1 PHE 13 HE1 PHE 13 24.869 18.532 -6.540 109 HE2 PHE 13 HE2 PHE 13 21.869 15.959 -4.806 110 HZ PHE 13 HZ PHE 13 22.503 17.762 -6.405 111 H GLY 14 HN GLY 14 24.937 14.762 -1.149 112 HA2 GLY 14 HA1 GLY 14 23.108 14.500 0.233 113 HA3 GLY 14 HA2 GLY 14 23.309 16.171 0.745 114 H SER 15 HN SER 15 22.708 17.818 -1.012 115 HA SER 15 HA SER 15 20.785 17.044 -2.986 116 HB2 SER 15 HB2 SER 15 18.838 18.182 -1.912 117 HB3 SER 15 HB1 SER 15 19.338 16.713 -1.079 118 HG SER 15 HG SER 15 20.297 17.930 0.484 119 H LEU 16 HN LEU 16 22.894 19.188 -1.548 120 HA LEU 16 HA LEU 16 21.871 21.674 -2.522 121 HB2 LEU 16 HB2 LEU 16 24.785 21.077 -1.991 122 HB3 LEU 16 HB1 LEU 16 23.934 22.614 -1.832 123 HG LEU 16 HG LEU 16 23.561 20.153 -0.100 124 HD11 LEU 16 HD11 LEU 16 24.621 22.935 0.486 125 HD12 LEU 16 HD12 LEU 16 25.585 21.462 0.390 126 HD13 LEU 16 HD13 LEU 16 24.400 21.656 1.681 127 HD21 LEU 16 HD21 LEU 16 21.395 21.142 -0.278 128 HD22 LEU 16 HD22 LEU 16 22.052 22.779 -0.244 129 HD23 LEU 16 HD23 LEU 16 22.063 21.791 1.217 Start of MODEL 14 1 H1 GLY 1 HT1 GLY 1 39.856 -0.277 2.571 2 H2 GLY 1 HT2 GLY 1 41.270 0.596 2.213 3 H3 GLY 1 HT3 GLY 1 40.276 0.027 0.957 4 HA2 GLY 1 HA1 GLY 1 38.648 1.507 2.562 5 HA3 GLY 1 HA2 GLY 1 40.143 2.421 2.409 6 H LEU 2 HN LEU 2 37.187 1.869 1.061 7 HA LEU 2 HA LEU 2 37.769 3.458 -1.249 8 HB2 LEU 2 HB2 LEU 2 36.852 1.610 -2.844 9 HB3 LEU 2 HB1 LEU 2 38.540 1.532 -2.356 10 HG LEU 2 HG LEU 2 37.927 -0.081 -0.559 11 HD11 LEU 2 HD11 LEU 2 35.663 0.328 -0.034 12 HD12 LEU 2 HD12 LEU 2 35.578 -1.174 -0.946 13 HD13 LEU 2 HD13 LEU 2 35.172 0.355 -1.727 14 HD21 LEU 2 HD21 LEU 2 36.980 -0.891 -3.325 15 HD22 LEU 2 HD22 LEU 2 37.566 -1.975 -2.064 16 HD23 LEU 2 HD23 LEU 2 38.668 -0.823 -2.817 17 H PHE 3 HN PHE 3 35.832 2.361 1.124 18 HA PHE 3 HA PHE 3 33.307 3.147 -0.247 19 HB2 PHE 3 HB2 PHE 3 33.331 0.820 0.615 20 HB3 PHE 3 HB1 PHE 3 33.665 1.442 2.231 21 HD1 PHE 3 HD1 PHE 3 31.141 1.119 -0.438 22 HD2 PHE 3 HD2 PHE 3 31.971 2.727 3.482 23 HE1 PHE 3 HE1 PHE 3 28.706 1.516 -0.084 24 HE2 PHE 3 HE2 PHE 3 29.537 3.122 3.834 25 HZ PHE 3 HZ PHE 3 27.905 2.527 2.048 26 H ASP 4 HN ASP 4 35.126 3.335 2.807 27 HA ASP 4 HA ASP 4 33.453 5.169 4.121 28 HB2 ASP 4 HB2 ASP 4 35.286 3.894 5.217 29 HB3 ASP 4 HB1 ASP 4 36.459 4.908 4.376 30 H ILE 5 HN ILE 5 36.015 5.604 1.757 31 HA ILE 5 HA ILE 5 36.187 8.450 2.024 32 HB ILE 5 HB ILE 5 36.942 6.844 -0.435 33 HG12 ILE 5 HG12 ILE 5 38.535 7.294 2.114 34 HG13 ILE 5 HG11 ILE 5 37.898 5.748 1.555 35 HG21 ILE 5 HG21 ILE 5 38.470 8.627 -0.862 36 HG22 ILE 5 HG22 ILE 5 38.267 9.292 0.759 37 HG23 ILE 5 HG23 ILE 5 36.955 9.411 -0.413 38 HD11 ILE 5 HD1 ILE 5 39.264 6.176 -0.604 39 HD12 ILE 5 HD2 ILE 5 40.159 5.731 0.849 40 HD13 ILE 5 HD3 ILE 5 40.102 7.414 0.334 41 H VAL 6 HN VAL 6 34.733 6.320 -0.444 42 HA VAL 6 HA VAL 6 33.524 8.304 -1.995 43 HB VAL 6 HB VAL 6 32.487 5.504 -1.450 44 HG11 VAL 6 HG11 VAL 6 30.754 6.801 -2.489 45 HG12 VAL 6 HG12 VAL 6 31.495 5.841 -3.768 46 HG13 VAL 6 HG13 VAL 6 31.898 7.550 -3.604 47 HG21 VAL 6 HG21 VAL 6 34.208 6.499 -3.739 48 HG22 VAL 6 HG22 VAL 6 33.774 4.829 -3.376 49 HG23 VAL 6 HG23 VAL 6 34.868 5.708 -2.309 50 H LYS 7 HN LYS 7 32.505 6.783 0.998 51 HA LYS 7 HA LYS 7 29.822 7.584 1.062 52 HB2 LYS 7 HB2 LYS 7 30.856 5.994 2.664 53 HB3 LYS 7 HB1 LYS 7 31.729 7.337 3.402 54 HG2 LYS 7 HG2 LYS 7 29.657 8.410 4.053 55 HG3 LYS 7 HG1 LYS 7 28.711 7.218 3.162 56 HD2 LYS 7 HD2 LYS 7 29.615 5.434 4.646 57 HD3 LYS 7 HD1 LYS 7 30.469 6.669 5.571 58 HE2 LYS 7 HE2 LYS 7 28.369 7.731 6.188 59 HE3 LYS 7 HE1 LYS 7 27.466 6.625 5.151 60 HZ1 LYS 7 HZ1 LYS 7 29.152 5.224 6.969 61 HZ2 LYS 7 HZ2 LYS 7 27.477 5.081 6.722 62 HZ3 LYS 7 HZ3 LYS 7 28.083 6.251 7.795 63 H LYS 8 HN LYS 8 32.780 9.317 1.894 64 HA LYS 8 HA LYS 8 31.484 11.568 3.079 65 HB2 LYS 8 HB2 LYS 8 34.240 11.301 1.854 66 HB3 LYS 8 HB1 LYS 8 33.682 12.673 2.812 67 HG2 LYS 8 HG2 LYS 8 33.407 11.307 4.769 68 HG3 LYS 8 HG1 LYS 8 33.637 9.826 3.840 69 HD2 LYS 8 HD2 LYS 8 35.674 10.449 5.119 70 HD3 LYS 8 HD1 LYS 8 35.961 10.430 3.381 71 HE2 LYS 8 HE2 LYS 8 36.854 12.460 4.741 72 HE3 LYS 8 HE1 LYS 8 35.995 12.789 3.237 73 HZ1 LYS 8 HZ1 LYS 8 35.370 14.014 5.445 74 HZ2 LYS 8 HZ2 LYS 8 34.448 12.614 5.720 75 HZ3 LYS 8 HZ3 LYS 8 34.170 13.559 4.336 76 H VAL 9 HN VAL 9 32.466 10.727 -0.193 77 HA VAL 9 HA VAL 9 32.161 13.283 -1.363 78 HB VAL 9 HB VAL 9 31.735 10.583 -2.680 79 HG11 VAL 9 HG11 VAL 9 30.897 12.360 -4.077 80 HG12 VAL 9 HG12 VAL 9 32.476 11.901 -4.713 81 HG13 VAL 9 HG13 VAL 9 32.309 13.363 -3.741 82 HG21 VAL 9 HG21 VAL 9 34.252 12.271 -2.549 83 HG22 VAL 9 HG22 VAL 9 34.088 10.657 -3.240 84 HG23 VAL 9 HG23 VAL 9 33.951 10.889 -1.496 85 H VAL 10 HN VAL 10 29.953 10.481 -1.578 86 HA VAL 10 HA VAL 10 27.785 11.868 -2.676 87 HB VAL 10 HB VAL 10 27.631 9.472 -0.822 88 HG11 VAL 10 HG11 VAL 10 25.453 10.445 -1.198 89 HG12 VAL 10 HG12 VAL 10 25.577 9.015 -2.221 90 HG13 VAL 10 HG13 VAL 10 25.773 10.620 -2.924 91 HG21 VAL 10 HG21 VAL 10 27.804 8.116 -2.845 92 HG22 VAL 10 HG22 VAL 10 29.212 9.173 -2.745 93 HG23 VAL 10 HG23 VAL 10 27.891 9.566 -3.846 94 H GLY 11 HN GLY 11 28.778 11.420 0.675 95 HA2 GLY 11 HA1 GLY 11 26.433 12.399 1.903 96 HA3 GLY 11 HA2 GLY 11 28.031 12.340 2.635 97 H ALA 12 HN ALA 12 29.440 14.016 0.931 98 HA ALA 12 HA ALA 12 28.734 16.569 1.958 99 HB1 ALA 12 HB1 ALA 12 30.637 15.833 -0.271 100 HB2 ALA 12 HB2 ALA 12 31.045 15.963 1.441 101 HB3 ALA 12 HB3 ALA 12 30.560 17.399 0.537 102 H PHE 13 HN PHE 13 27.156 14.861 -0.295 103 HA PHE 13 HA PHE 13 25.696 15.361 -1.998 104 HB2 PHE 13 HB2 PHE 13 25.745 18.186 -0.927 105 HB3 PHE 13 HB1 PHE 13 24.427 17.359 -1.759 106 HD1 PHE 13 HD1 PHE 13 26.082 17.925 1.444 107 HD2 PHE 13 HD2 PHE 13 23.246 15.428 -0.643 108 HE1 PHE 13 HE1 PHE 13 25.212 17.091 3.624 109 HE2 PHE 13 HE2 PHE 13 22.377 14.595 1.538 110 HZ PHE 13 HZ PHE 13 23.418 15.363 3.667 111 H GLY 14 HN GLY 14 28.723 16.052 -2.161 112 HA2 GLY 14 HA1 GLY 14 29.058 18.218 -3.916 113 HA3 GLY 14 HA2 GLY 14 30.159 16.857 -3.753 114 H SER 15 HN SER 15 28.028 14.929 -4.470 115 HA SER 15 HA SER 15 28.459 14.939 -7.303 116 HB2 SER 15 HB2 SER 15 26.637 13.212 -5.612 117 HB3 SER 15 HB1 SER 15 27.074 12.905 -7.291 118 HG SER 15 HG SER 15 28.369 12.141 -5.163 119 H LEU 16 HN LEU 16 25.685 15.584 -5.194 120 HA LEU 16 HA LEU 16 23.844 16.005 -7.360 121 HB2 LEU 16 HB2 LEU 16 23.507 17.068 -4.554 122 HB3 LEU 16 HB1 LEU 16 22.261 16.557 -5.692 123 HG LEU 16 HG LEU 16 24.280 14.769 -4.302 124 HD11 LEU 16 HD11 LEU 16 22.365 13.863 -3.144 125 HD12 LEU 16 HD12 LEU 16 21.255 14.817 -4.130 126 HD13 LEU 16 HD13 LEU 16 22.313 15.618 -2.968 127 HD21 LEU 16 HD21 LEU 16 22.848 12.943 -5.413 128 HD22 LEU 16 HD22 LEU 16 23.945 13.825 -6.472 129 HD23 LEU 16 HD23 LEU 16 22.225 14.218 -6.462 Start of MODEL 15 1 H1 GLY 1 HT1 GLY 1 40.103 2.206 3.943 2 H2 GLY 1 HT2 GLY 1 39.817 1.710 2.344 3 H3 GLY 1 HT3 GLY 1 39.570 0.629 3.630 4 HA2 GLY 1 HA1 GLY 1 37.497 1.217 3.675 5 HA3 GLY 1 HA2 GLY 1 38.048 2.790 4.236 6 H LEU 2 HN LEU 2 38.439 1.214 1.082 7 HA LEU 2 HA LEU 2 38.137 3.380 -0.552 8 HB2 LEU 2 HB2 LEU 2 38.730 1.220 -1.445 9 HB3 LEU 2 HB1 LEU 2 37.182 0.536 -0.961 10 HG LEU 2 HG LEU 2 36.006 1.944 -2.577 11 HD11 LEU 2 HD11 LEU 2 38.762 3.134 -2.988 12 HD12 LEU 2 HD12 LEU 2 37.251 3.974 -2.641 13 HD13 LEU 2 HD13 LEU 2 37.514 3.259 -4.228 14 HD21 LEU 2 HD21 LEU 2 37.057 -0.236 -3.282 15 HD22 LEU 2 HD22 LEU 2 38.426 0.687 -3.900 16 HD23 LEU 2 HD23 LEU 2 36.825 0.909 -4.603 17 H PHE 3 HN PHE 3 35.571 1.527 1.004 18 HA PHE 3 HA PHE 3 33.443 3.007 -0.309 19 HB2 PHE 3 HB2 PHE 3 33.445 0.985 1.945 20 HB3 PHE 3 HB1 PHE 3 31.986 1.713 1.273 21 HD1 PHE 3 HD1 PHE 3 31.111 1.036 -0.879 22 HD2 PHE 3 HD2 PHE 3 34.921 -0.445 0.509 23 HE1 PHE 3 HE1 PHE 3 31.135 -0.636 -2.726 24 HE2 PHE 3 HE2 PHE 3 34.943 -2.117 -1.339 25 HZ PHE 3 HZ PHE 3 33.058 -2.201 -2.967 26 H ASP 4 HN ASP 4 35.309 3.120 2.604 27 HA ASP 4 HA ASP 4 33.572 4.767 4.149 28 HB2 ASP 4 HB2 ASP 4 35.531 3.438 5.034 29 HB3 ASP 4 HB1 ASP 4 36.589 4.662 4.330 30 H ILE 5 HN ILE 5 36.157 5.445 1.837 31 HA ILE 5 HA ILE 5 36.132 8.287 2.269 32 HB ILE 5 HB ILE 5 37.192 6.812 -0.162 33 HG12 ILE 5 HG12 ILE 5 38.529 7.402 2.501 34 HG13 ILE 5 HG11 ILE 5 38.114 5.807 1.881 35 HG21 ILE 5 HG21 ILE 5 38.165 9.380 1.122 36 HG22 ILE 5 HG22 ILE 5 36.968 9.365 -0.170 37 HG23 ILE 5 HG23 ILE 5 38.585 8.738 -0.464 38 HD11 ILE 5 HD1 ILE 5 39.597 6.437 -0.161 39 HD12 ILE 5 HD2 ILE 5 40.408 6.029 1.351 40 HD13 ILE 5 HD3 ILE 5 40.226 7.716 0.880 41 H VAL 6 HN VAL 6 34.983 6.196 -0.393 42 HA VAL 6 HA VAL 6 33.787 8.197 -1.935 43 HB VAL 6 HB VAL 6 32.949 5.295 -1.636 44 HG11 VAL 6 HG11 VAL 6 31.131 6.469 -2.669 45 HG12 VAL 6 HG12 VAL 6 32.029 5.714 -3.984 46 HG13 VAL 6 HG13 VAL 6 32.229 7.435 -3.655 47 HG21 VAL 6 HG21 VAL 6 34.378 4.876 -3.524 48 HG22 VAL 6 HG22 VAL 6 35.334 5.813 -2.377 49 HG23 VAL 6 HG23 VAL 6 34.637 6.600 -3.791 50 H LYS 7 HN LYS 7 32.823 6.873 1.087 51 HA LYS 7 HA LYS 7 30.012 7.406 0.866 52 HB2 LYS 7 HB2 LYS 7 30.871 5.778 2.484 53 HB3 LYS 7 HB1 LYS 7 31.758 7.057 3.314 54 HG2 LYS 7 HG2 LYS 7 29.738 8.147 3.996 55 HG3 LYS 7 HG1 LYS 7 28.758 7.156 2.916 56 HD2 LYS 7 HD2 LYS 7 28.507 6.319 5.187 57 HD3 LYS 7 HD1 LYS 7 29.412 5.138 4.242 58 HE2 LYS 7 HE2 LYS 7 31.474 5.743 5.255 59 HE3 LYS 7 HE1 LYS 7 30.813 7.245 5.900 60 HZ1 LYS 7 HZ1 LYS 7 29.214 5.687 7.143 61 HZ2 LYS 7 HZ2 LYS 7 30.805 5.847 7.716 62 HZ3 LYS 7 HZ3 LYS 7 30.360 4.481 6.811 63 H LYS 8 HN LYS 8 32.818 9.197 2.036 64 HA LYS 8 HA LYS 8 31.332 11.345 3.190 65 HB2 LYS 8 HB2 LYS 8 33.739 10.745 3.706 66 HB3 LYS 8 HB1 LYS 8 34.170 11.463 2.154 67 HG2 LYS 8 HG2 LYS 8 33.139 13.598 2.861 68 HG3 LYS 8 HG1 LYS 8 32.738 12.881 4.422 69 HD2 LYS 8 HD2 LYS 8 35.130 12.488 4.865 70 HD3 LYS 8 HD1 LYS 8 35.540 13.192 3.301 71 HE2 LYS 8 HE2 LYS 8 34.446 15.321 4.020 72 HE3 LYS 8 HE1 LYS 8 34.181 14.608 5.612 73 HZ1 LYS 8 HZ1 LYS 8 36.367 14.718 6.131 74 HZ2 LYS 8 HZ2 LYS 8 36.324 16.019 5.039 75 HZ3 LYS 8 HZ3 LYS 8 36.890 14.499 4.533 76 H VAL 9 HN VAL 9 32.719 10.730 0.005 77 HA VAL 9 HA VAL 9 32.485 13.279 -1.114 78 HB VAL 9 HB VAL 9 32.005 10.654 -2.553 79 HG11 VAL 9 HG11 VAL 9 32.952 11.981 -4.479 80 HG12 VAL 9 HG12 VAL 9 32.854 13.418 -3.460 81 HG13 VAL 9 HG13 VAL 9 31.385 12.556 -3.912 82 HG21 VAL 9 HG21 VAL 9 34.602 12.165 -2.133 83 HG22 VAL 9 HG22 VAL 9 34.403 10.624 -2.969 84 HG23 VAL 9 HG23 VAL 9 34.139 10.724 -1.227 85 H VAL 10 HN VAL 10 30.190 10.580 -1.583 86 HA VAL 10 HA VAL 10 28.142 12.095 -2.732 87 HB VAL 10 HB VAL 10 26.616 10.249 -1.982 88 HG11 VAL 10 HG11 VAL 10 29.282 9.448 -3.186 89 HG12 VAL 10 HG12 VAL 10 27.861 10.010 -4.065 90 HG13 VAL 10 HG13 VAL 10 27.826 8.456 -3.234 91 HG21 VAL 10 HG21 VAL 10 27.630 9.750 0.177 92 HG22 VAL 10 HG22 VAL 10 29.152 9.314 -0.600 93 HG23 VAL 10 HG23 VAL 10 27.721 8.309 -0.835 94 H GLY 11 HN GLY 11 29.250 11.997 0.505 95 HA2 GLY 11 HA1 GLY 11 26.819 12.718 1.814 96 HA3 GLY 11 HA2 GLY 11 28.441 12.851 2.478 97 H ALA 12 HN ALA 12 29.341 14.498 0.183 98 HA ALA 12 HA ALA 12 28.910 17.047 1.281 99 HB1 ALA 12 HB1 ALA 12 29.995 17.898 -0.717 100 HB2 ALA 12 HB2 ALA 12 29.724 16.367 -1.548 101 HB3 ALA 12 HB3 ALA 12 30.822 16.441 -0.169 102 H PHE 13 HN PHE 13 26.800 15.119 -0.461 103 HA PHE 13 HA PHE 13 24.778 15.487 -1.484 104 HB2 PHE 13 HB2 PHE 13 24.397 16.610 0.733 105 HB3 PHE 13 HB1 PHE 13 24.850 18.137 -0.025 106 HD1 PHE 13 HD1 PHE 13 23.221 19.406 -1.213 107 HD2 PHE 13 HD2 PHE 13 22.500 15.231 -0.383 108 HE1 PHE 13 HE1 PHE 13 20.902 19.629 -2.099 109 HE2 PHE 13 HE2 PHE 13 20.184 15.455 -1.270 110 HZ PHE 13 HZ PHE 13 19.417 17.633 -2.209 111 H GLY 14 HN GLY 14 27.316 16.496 -2.729 112 HA2 GLY 14 HA1 GLY 14 26.707 18.918 -4.110 113 HA3 GLY 14 HA2 GLY 14 28.002 17.795 -4.498 114 H SER 15 HN SER 15 24.460 18.091 -4.693 115 HA SER 15 HA SER 15 22.960 17.357 -6.276 116 HB2 SER 15 HB2 SER 15 25.275 17.731 -8.184 117 HB3 SER 15 HB1 SER 15 23.557 17.784 -8.569 118 HG SER 15 HG SER 15 24.409 19.876 -8.309 119 H LEU 16 HN LEU 16 23.130 15.215 -5.213 120 HA LEU 16 HA LEU 16 24.788 13.141 -5.995 121 HB2 LEU 16 HB2 LEU 16 23.317 12.857 -4.118 122 HB3 LEU 16 HB1 LEU 16 21.892 13.120 -5.116 123 HG LEU 16 HG LEU 16 22.211 11.021 -6.266 124 HD11 LEU 16 HD11 LEU 16 24.885 11.004 -4.845 125 HD12 LEU 16 HD12 LEU 16 24.565 10.871 -6.575 126 HD13 LEU 16 HD13 LEU 16 24.175 9.529 -5.503 127 HD21 LEU 16 HD21 LEU 16 21.160 10.922 -4.023 128 HD22 LEU 16 HD22 LEU 16 22.744 10.637 -3.303 129 HD23 LEU 16 HD23 LEU 16 22.041 9.439 -4.391 Start of MODEL 16 1 H1 GLY 1 HT1 GLY 1 39.569 -1.281 0.393 2 H2 GLY 1 HT2 GLY 1 40.708 -1.166 1.648 3 H3 GLY 1 HT3 GLY 1 40.942 -0.308 0.199 4 HA2 GLY 1 HA1 GLY 1 38.554 0.142 1.801 5 HA3 GLY 1 HA2 GLY 1 40.079 0.893 2.255 6 H LEU 2 HN LEU 2 37.312 1.225 0.470 7 HA LEU 2 HA LEU 2 38.204 3.685 -0.714 8 HB2 LEU 2 HB2 LEU 2 37.937 3.148 -3.021 9 HB3 LEU 2 HB1 LEU 2 39.000 1.919 -2.348 10 HG LEU 2 HG LEU 2 36.044 1.638 -2.971 11 HD11 LEU 2 HD11 LEU 2 37.621 1.444 -4.872 12 HD12 LEU 2 HD12 LEU 2 36.837 -0.095 -4.515 13 HD13 LEU 2 HD13 LEU 2 38.500 0.188 -4.002 14 HD21 LEU 2 HD21 LEU 2 36.507 -0.796 -2.234 15 HD22 LEU 2 HD22 LEU 2 36.333 0.400 -0.955 16 HD23 LEU 2 HD23 LEU 2 37.939 -0.156 -1.427 17 H PHE 3 HN PHE 3 35.945 1.755 0.656 18 HA PHE 3 HA PHE 3 33.589 3.002 -0.599 19 HB2 PHE 3 HB2 PHE 3 33.896 0.890 1.550 20 HB3 PHE 3 HB1 PHE 3 32.341 1.538 1.033 21 HD1 PHE 3 HD1 PHE 3 34.662 -1.072 0.472 22 HD2 PHE 3 HD2 PHE 3 32.001 1.599 -1.638 23 HE1 PHE 3 HE1 PHE 3 34.617 -2.640 -1.463 24 HE2 PHE 3 HE2 PHE 3 31.965 0.032 -3.571 25 HZ PHE 3 HZ PHE 3 33.344 -2.042 -3.519 26 H ASP 4 HN ASP 4 35.443 3.032 2.393 27 HA ASP 4 HA ASP 4 33.625 4.557 3.943 28 HB2 ASP 4 HB2 ASP 4 36.636 4.559 4.213 29 HB3 ASP 4 HB1 ASP 4 35.438 4.858 5.474 30 H ILE 5 HN ILE 5 36.199 5.428 1.699 31 HA ILE 5 HA ILE 5 36.143 8.231 2.297 32 HB ILE 5 HB ILE 5 37.122 6.978 -0.284 33 HG12 ILE 5 HG12 ILE 5 38.529 7.228 2.396 34 HG13 ILE 5 HG11 ILE 5 38.094 5.727 1.580 35 HG21 ILE 5 HG21 ILE 5 38.194 9.369 1.239 36 HG22 ILE 5 HG22 ILE 5 36.931 9.521 0.019 37 HG23 ILE 5 HG23 ILE 5 38.520 8.909 -0.432 38 HD11 ILE 5 HD1 ILE 5 40.185 7.758 0.779 39 HD12 ILE 5 HD2 ILE 5 39.542 6.597 -0.385 40 HD13 ILE 5 HD3 ILE 5 40.385 6.028 1.055 41 H VAL 6 HN VAL 6 34.825 6.239 -0.351 42 HA VAL 6 HA VAL 6 33.603 8.323 -1.783 43 HB VAL 6 HB VAL 6 32.816 5.400 -1.569 44 HG11 VAL 6 HG11 VAL 6 30.880 6.552 -2.385 45 HG12 VAL 6 HG12 VAL 6 31.690 5.910 -3.813 46 HG13 VAL 6 HG13 VAL 6 31.856 7.617 -3.398 47 HG21 VAL 6 HG21 VAL 6 34.257 6.846 -3.810 48 HG22 VAL 6 HG22 VAL 6 34.102 5.106 -3.568 49 HG23 VAL 6 HG23 VAL 6 35.118 6.061 -2.487 50 H LYS 7 HN LYS 7 32.790 6.906 1.231 51 HA LYS 7 HA LYS 7 29.979 7.413 1.195 52 HB2 LYS 7 HB2 LYS 7 31.198 5.839 2.769 53 HB3 LYS 7 HB1 LYS 7 31.755 7.267 3.638 54 HG2 LYS 7 HG2 LYS 7 29.337 7.965 3.872 55 HG3 LYS 7 HG1 LYS 7 28.886 6.395 3.207 56 HD2 LYS 7 HD2 LYS 7 30.010 5.246 5.037 57 HD3 LYS 7 HD1 LYS 7 30.612 6.780 5.670 58 HE2 LYS 7 HE2 LYS 7 28.637 6.085 6.938 59 HE3 LYS 7 HE1 LYS 7 28.265 7.534 6.005 60 HZ1 LYS 7 HZ1 LYS 7 26.864 6.422 4.663 61 HZ2 LYS 7 HZ2 LYS 7 26.758 5.350 5.977 62 HZ3 LYS 7 HZ3 LYS 7 27.787 4.999 4.671 63 H LYS 8 HN LYS 8 32.823 9.270 2.106 64 HA LYS 8 HA LYS 8 31.384 11.419 3.341 65 HB2 LYS 8 HB2 LYS 8 34.157 11.524 2.143 66 HB3 LYS 8 HB1 LYS 8 33.492 12.555 3.410 67 HG2 LYS 8 HG2 LYS 8 33.225 10.524 4.852 68 HG3 LYS 8 HG1 LYS 8 34.046 9.582 3.607 69 HD2 LYS 8 HD2 LYS 8 36.018 11.081 3.802 70 HD3 LYS 8 HD1 LYS 8 35.202 11.958 5.098 71 HE2 LYS 8 HE2 LYS 8 35.806 8.987 5.164 72 HE3 LYS 8 HE1 LYS 8 36.798 10.220 5.941 73 HZ1 LYS 8 HZ1 LYS 8 35.299 9.359 7.551 74 HZ2 LYS 8 HZ2 LYS 8 33.963 9.569 6.522 75 HZ3 LYS 8 HZ3 LYS 8 34.769 10.921 7.160 76 H VAL 9 HN VAL 9 32.455 10.675 0.085 77 HA VAL 9 HA VAL 9 32.191 13.225 -1.074 78 HB VAL 9 HB VAL 9 31.688 10.524 -2.367 79 HG11 VAL 9 HG11 VAL 9 30.805 12.256 -3.780 80 HG12 VAL 9 HG12 VAL 9 32.383 11.831 -4.440 81 HG13 VAL 9 HG13 VAL 9 32.196 13.297 -3.478 82 HG21 VAL 9 HG21 VAL 9 34.056 10.779 -3.118 83 HG22 VAL 9 HG22 VAL 9 33.916 10.651 -1.365 84 HG23 VAL 9 HG23 VAL 9 34.191 12.223 -2.115 85 H VAL 10 HN VAL 10 29.877 10.510 -1.320 86 HA VAL 10 HA VAL 10 27.751 11.907 -2.411 87 HB VAL 10 HB VAL 10 26.273 10.186 -1.327 88 HG11 VAL 10 HG11 VAL 10 27.317 9.679 -3.461 89 HG12 VAL 10 HG12 VAL 10 27.389 8.237 -2.448 90 HG13 VAL 10 HG13 VAL 10 28.826 9.237 -2.661 91 HG21 VAL 10 HG21 VAL 10 27.414 8.393 -0.031 92 HG22 VAL 10 HG22 VAL 10 27.509 9.954 0.783 93 HG23 VAL 10 HG23 VAL 10 28.909 9.327 -0.087 94 H GLY 11 HN GLY 11 29.017 12.033 0.803 95 HA2 GLY 11 HA1 GLY 11 26.698 13.027 2.118 96 HA3 GLY 11 HA2 GLY 11 28.352 13.134 2.705 97 H ALA 12 HN ALA 12 29.353 14.533 0.376 98 HA ALA 12 HA ALA 12 28.752 17.208 1.194 99 HB1 ALA 12 HB1 ALA 12 30.967 16.439 0.319 100 HB2 ALA 12 HB2 ALA 12 30.338 17.877 -0.487 101 HB3 ALA 12 HB3 ALA 12 30.233 16.304 -1.278 102 H PHE 13 HN PHE 13 26.857 15.179 -0.419 103 HA PHE 13 HA PHE 13 25.134 15.370 -1.931 104 HB2 PHE 13 HB2 PHE 13 25.245 18.303 -1.197 105 HB3 PHE 13 HB1 PHE 13 23.856 17.408 -1.810 106 HD1 PHE 13 HD1 PHE 13 25.622 18.442 1.150 107 HD2 PHE 13 HD2 PHE 13 23.031 15.369 -0.425 108 HE1 PHE 13 HE1 PHE 13 24.991 17.786 3.469 109 HE2 PHE 13 HE2 PHE 13 22.400 14.713 1.894 110 HZ PHE 13 HZ PHE 13 23.313 15.980 3.836 111 H GLY 14 HN GLY 14 28.051 16.147 -2.698 112 HA2 GLY 14 HA1 GLY 14 27.784 17.992 -4.868 113 HA3 GLY 14 HA2 GLY 14 29.174 16.971 -4.530 114 H SER 15 HN SER 15 25.905 15.764 -4.972 115 HA SER 15 HA SER 15 26.230 15.086 -7.739 116 HB2 SER 15 HB2 SER 15 26.434 12.831 -5.730 117 HB3 SER 15 HB1 SER 15 26.373 12.663 -7.482 118 HG SER 15 HG SER 15 28.371 13.457 -7.641 119 H LEU 16 HN LEU 16 24.185 16.411 -7.027 120 HA LEU 16 HA LEU 16 21.948 14.693 -7.383 121 HB2 LEU 16 HB2 LEU 16 22.197 14.199 -5.035 122 HB3 LEU 16 HB1 LEU 16 22.364 15.907 -4.641 123 HG LEU 16 HG LEU 16 20.054 16.339 -5.223 124 HD11 LEU 16 HD11 LEU 16 18.607 14.288 -5.873 125 HD12 LEU 16 HD12 LEU 16 20.132 13.510 -6.294 126 HD13 LEU 16 HD13 LEU 16 19.633 14.983 -7.125 127 HD21 LEU 16 HD21 LEU 16 18.914 14.883 -3.586 128 HD22 LEU 16 HD22 LEU 16 20.485 15.410 -2.979 129 HD23 LEU 16 HD23 LEU 16 20.287 13.776 -3.614 Start of MODEL 17 1 H1 GLY 1 HT1 GLY 1 40.154 -0.834 0.669 2 H2 GLY 1 HT2 GLY 1 38.568 -1.439 0.771 3 H3 GLY 1 HT3 GLY 1 39.591 -1.488 2.128 4 HA2 GLY 1 HA1 GLY 1 37.916 0.257 2.222 5 HA3 GLY 1 HA2 GLY 1 39.577 0.820 2.349 6 H LEU 2 HN LEU 2 36.651 1.212 0.789 7 HA LEU 2 HA LEU 2 37.670 3.317 -0.873 8 HB2 LEU 2 HB2 LEU 2 36.641 2.231 -3.001 9 HB3 LEU 2 HB1 LEU 2 38.240 1.700 -2.486 10 HG LEU 2 HG LEU 2 37.201 -0.240 -1.319 11 HD11 LEU 2 HD11 LEU 2 34.679 1.036 -2.394 12 HD12 LEU 2 HD12 LEU 2 34.993 0.385 -0.785 13 HD13 LEU 2 HD13 LEU 2 34.753 -0.709 -2.141 14 HD21 LEU 2 HD21 LEU 2 36.447 0.044 -4.245 15 HD22 LEU 2 HD22 LEU 2 36.644 -1.478 -3.375 16 HD23 LEU 2 HD23 LEU 2 38.035 -0.427 -3.640 17 H PHE 3 HN PHE 3 35.390 1.917 0.972 18 HA PHE 3 HA PHE 3 33.059 3.221 -0.293 19 HB2 PHE 3 HB2 PHE 3 32.891 0.863 0.555 20 HB3 PHE 3 HB1 PHE 3 33.163 1.481 2.184 21 HD1 PHE 3 HD1 PHE 3 30.872 1.594 -0.750 22 HD2 PHE 3 HD2 PHE 3 31.419 2.623 3.406 23 HE1 PHE 3 HE1 PHE 3 28.454 2.172 -0.574 24 HE2 PHE 3 HE2 PHE 3 29.002 3.198 3.582 25 HZ PHE 3 HZ PHE 3 27.507 2.910 1.610 26 H ASP 4 HN ASP 4 35.064 3.281 2.616 27 HA ASP 4 HA ASP 4 33.550 5.168 4.078 28 HB2 ASP 4 HB2 ASP 4 36.546 4.730 4.160 29 HB3 ASP 4 HB1 ASP 4 35.553 5.463 5.421 30 H ILE 5 HN ILE 5 35.996 5.484 1.577 31 HA ILE 5 HA ILE 5 36.339 8.320 1.880 32 HB ILE 5 HB ILE 5 36.954 6.703 -0.610 33 HG12 ILE 5 HG12 ILE 5 38.591 7.021 1.927 34 HG13 ILE 5 HG11 ILE 5 37.907 5.519 1.308 35 HG21 ILE 5 HG21 ILE 5 38.432 9.064 0.579 36 HG22 ILE 5 HG22 ILE 5 37.101 9.266 -0.559 37 HG23 ILE 5 HG23 ILE 5 38.560 8.411 -1.055 38 HD11 ILE 5 HD1 ILE 5 40.168 5.463 0.599 39 HD12 ILE 5 HD2 ILE 5 40.161 7.167 0.153 40 HD13 ILE 5 HD3 ILE 5 39.286 5.995 -0.833 41 H VAL 6 HN VAL 6 34.627 6.256 -0.469 42 HA VAL 6 HA VAL 6 33.505 8.393 -1.955 43 HB VAL 6 HB VAL 6 32.488 5.552 -1.642 44 HG11 VAL 6 HG11 VAL 6 31.474 6.081 -3.921 45 HG12 VAL 6 HG12 VAL 6 31.845 7.773 -3.597 46 HG13 VAL 6 HG13 VAL 6 30.724 6.901 -2.553 47 HG21 VAL 6 HG21 VAL 6 34.862 5.876 -2.504 48 HG22 VAL 6 HG22 VAL 6 34.164 6.758 -3.862 49 HG23 VAL 6 HG23 VAL 6 33.769 5.056 -3.619 50 H LYS 7 HN LYS 7 32.720 7.035 1.101 51 HA LYS 7 HA LYS 7 29.944 7.642 1.180 52 HB2 LYS 7 HB2 LYS 7 31.017 6.100 2.775 53 HB3 LYS 7 HB1 LYS 7 31.930 7.446 3.457 54 HG2 LYS 7 HG2 LYS 7 29.920 8.526 4.224 55 HG3 LYS 7 HG1 LYS 7 28.905 7.388 3.336 56 HD2 LYS 7 HD2 LYS 7 29.592 5.559 4.761 57 HD3 LYS 7 HD1 LYS 7 30.796 6.573 5.558 58 HE2 LYS 7 HE2 LYS 7 28.587 6.240 6.814 59 HE3 LYS 7 HE1 LYS 7 29.127 7.907 6.611 60 HZ1 LYS 7 HZ1 LYS 7 27.433 6.765 4.522 61 HZ2 LYS 7 HZ2 LYS 7 27.503 8.356 5.116 62 HZ3 LYS 7 HZ3 LYS 7 26.695 7.152 5.999 63 H LYS 8 HN LYS 8 32.850 9.444 2.121 64 HA LYS 8 HA LYS 8 31.483 11.673 3.230 65 HB2 LYS 8 HB2 LYS 8 33.886 11.136 3.641 66 HB3 LYS 8 HB1 LYS 8 34.239 11.614 1.980 67 HG2 LYS 8 HG2 LYS 8 33.482 13.872 2.398 68 HG3 LYS 8 HG1 LYS 8 32.889 13.426 3.997 69 HD2 LYS 8 HD2 LYS 8 35.175 12.916 4.728 70 HD3 LYS 8 HD1 LYS 8 35.789 13.304 3.121 71 HE2 LYS 8 HE2 LYS 8 34.267 15.265 4.858 72 HE3 LYS 8 HE1 LYS 8 36.027 15.182 4.784 73 HZ1 LYS 8 HZ1 LYS 8 35.809 16.598 3.092 74 HZ2 LYS 8 HZ2 LYS 8 34.156 16.265 2.884 75 HZ3 LYS 8 HZ3 LYS 8 35.324 15.252 2.181 76 H VAL 9 HN VAL 9 32.617 10.895 -0.022 77 HA VAL 9 HA VAL 9 32.229 13.419 -1.206 78 HB VAL 9 HB VAL 9 31.870 10.713 -2.532 79 HG11 VAL 9 HG11 VAL 9 32.466 13.497 -3.574 80 HG12 VAL 9 HG12 VAL 9 31.052 12.505 -3.932 81 HG13 VAL 9 HG13 VAL 9 32.637 12.035 -4.545 82 HG21 VAL 9 HG21 VAL 9 34.361 12.425 -2.258 83 HG22 VAL 9 HG22 VAL 9 34.248 10.866 -3.076 84 HG23 VAL 9 HG23 VAL 9 34.048 10.962 -1.326 85 H VAL 10 HN VAL 10 30.090 10.562 -1.447 86 HA VAL 10 HA VAL 10 27.901 11.945 -2.545 87 HB VAL 10 HB VAL 10 27.799 9.451 -0.821 88 HG11 VAL 10 HG11 VAL 10 25.917 10.661 -2.866 89 HG12 VAL 10 HG12 VAL 10 25.595 10.385 -1.153 90 HG13 VAL 10 HG13 VAL 10 25.762 9.015 -2.251 91 HG21 VAL 10 HG21 VAL 10 27.976 8.225 -2.943 92 HG22 VAL 10 HG22 VAL 10 29.391 9.255 -2.722 93 HG23 VAL 10 HG23 VAL 10 28.106 9.745 -3.827 94 H GLY 11 HN GLY 11 28.997 11.546 0.746 95 HA2 GLY 11 HA1 GLY 11 26.619 12.244 2.091 96 HA3 GLY 11 HA2 GLY 11 28.247 12.397 2.738 97 H ALA 12 HN ALA 12 29.315 14.202 0.888 98 HA ALA 12 HA ALA 12 28.215 16.673 1.892 99 HB1 ALA 12 HB1 ALA 12 30.638 16.345 1.601 100 HB2 ALA 12 HB2 ALA 12 30.049 17.719 0.664 101 HB3 ALA 12 HB3 ALA 12 30.399 16.188 -0.140 102 H PHE 13 HN PHE 13 27.342 14.671 -0.599 103 HA PHE 13 HA PHE 13 26.104 14.921 -2.521 104 HB2 PHE 13 HB2 PHE 13 25.193 17.461 -1.148 105 HB3 PHE 13 HB1 PHE 13 24.340 16.589 -2.421 106 HD1 PHE 13 HD1 PHE 13 24.966 16.810 1.148 107 HD2 PHE 13 HD2 PHE 13 23.584 14.188 -1.991 108 HE1 PHE 13 HE1 PHE 13 23.890 15.341 2.848 109 HE2 PHE 13 HE2 PHE 13 22.508 12.720 -0.289 110 HZ PHE 13 HZ PHE 13 22.601 13.335 2.122 111 H GLY 14 HN GLY 14 28.805 16.287 -2.262 112 HA2 GLY 14 HA1 GLY 14 28.650 18.655 -3.883 113 HA3 GLY 14 HA2 GLY 14 30.113 17.811 -3.396 114 H SER 15 HN SER 15 27.263 16.897 -5.337 115 HA SER 15 HA SER 15 28.722 16.789 -7.787 116 HB2 SER 15 HB2 SER 15 28.551 14.289 -8.059 117 HB3 SER 15 HB1 SER 15 29.748 14.818 -6.880 118 HG SER 15 HG SER 15 28.150 13.079 -6.297 119 H LEU 16 HN LEU 16 26.001 15.357 -5.992 120 HA LEU 16 HA LEU 16 24.313 15.021 -8.251 121 HB2 LEU 16 HB2 LEU 16 23.834 15.160 -5.274 122 HB3 LEU 16 HB1 LEU 16 22.482 15.039 -6.398 123 HG LEU 16 HG LEU 16 23.423 12.972 -7.338 124 HD11 LEU 16 HD11 LEU 16 25.775 13.244 -7.102 125 HD12 LEU 16 HD12 LEU 16 25.366 11.925 -6.010 126 HD13 LEU 16 HD13 LEU 16 25.649 13.544 -5.369 127 HD21 LEU 16 HD21 LEU 16 23.115 11.538 -5.335 128 HD22 LEU 16 HD22 LEU 16 21.896 12.809 -5.416 129 HD23 LEU 16 HD23 LEU 16 23.258 12.964 -4.306 Start of MODEL 18 1 H1 GLY 1 HT1 GLY 1 41.212 1.243 1.461 2 H2 GLY 1 HT2 GLY 1 40.188 0.197 2.324 3 H3 GLY 1 HT3 GLY 1 41.151 1.326 3.153 4 HA2 GLY 1 HA1 GLY 1 38.658 1.751 2.734 5 HA3 GLY 1 HA2 GLY 1 39.844 3.048 2.673 6 H LEU 2 HN LEU 2 37.231 1.946 1.182 7 HA LEU 2 HA LEU 2 37.750 3.412 -1.231 8 HB2 LEU 2 HB2 LEU 2 37.567 1.652 -2.829 9 HB3 LEU 2 HB1 LEU 2 38.796 1.143 -1.678 10 HG LEU 2 HG LEU 2 35.909 0.213 -1.801 11 HD11 LEU 2 HD11 LEU 2 36.876 -1.943 -2.290 12 HD12 LEU 2 HD12 LEU 2 38.505 -1.337 -1.989 13 HD13 LEU 2 HD13 LEU 2 37.598 -0.771 -3.392 14 HD21 LEU 2 HD21 LEU 2 38.044 -0.174 0.316 15 HD22 LEU 2 HD22 LEU 2 36.727 -1.329 0.111 16 HD23 LEU 2 HD23 LEU 2 36.371 0.342 0.534 17 H PHE 3 HN PHE 3 35.824 2.317 1.155 18 HA PHE 3 HA PHE 3 33.317 2.875 -0.354 19 HB2 PHE 3 HB2 PHE 3 33.553 0.489 0.428 20 HB3 PHE 3 HB1 PHE 3 33.589 1.097 2.082 21 HD1 PHE 3 HD1 PHE 3 31.504 0.535 -0.900 22 HD2 PHE 3 HD2 PHE 3 31.607 2.187 3.086 23 HE1 PHE 3 HE1 PHE 3 29.015 0.648 -0.883 24 HE2 PHE 3 HE2 PHE 3 29.118 2.300 3.105 25 HZ PHE 3 HZ PHE 3 27.828 1.608 1.087 26 H ASP 4 HN ASP 4 35.068 3.126 2.712 27 HA ASP 4 HA ASP 4 33.128 4.783 3.997 28 HB2 ASP 4 HB2 ASP 4 34.891 3.421 5.175 29 HB3 ASP 4 HB1 ASP 4 36.084 4.594 4.614 30 H ILE 5 HN ILE 5 35.859 5.334 1.884 31 HA ILE 5 HA ILE 5 36.017 8.172 2.351 32 HB ILE 5 HB ILE 5 37.040 6.690 -0.089 33 HG12 ILE 5 HG12 ILE 5 38.343 7.027 2.635 34 HG13 ILE 5 HG11 ILE 5 37.791 5.506 1.935 35 HG21 ILE 5 HG21 ILE 5 37.029 9.253 0.049 36 HG22 ILE 5 HG22 ILE 5 38.589 8.499 -0.266 37 HG23 ILE 5 HG23 ILE 5 38.206 9.087 1.353 38 HD11 ILE 5 HD1 ILE 5 39.380 6.052 -0.037 39 HD12 ILE 5 HD2 ILE 5 40.115 5.539 1.482 40 HD13 ILE 5 HD3 ILE 5 40.095 7.247 1.048 41 H VAL 6 HN VAL 6 34.635 6.088 -0.177 42 HA VAL 6 HA VAL 6 33.694 8.090 -1.893 43 HB VAL 6 HB VAL 6 32.422 5.394 -1.322 44 HG11 VAL 6 HG11 VAL 6 30.862 6.769 -2.523 45 HG12 VAL 6 HG12 VAL 6 31.614 5.707 -3.713 46 HG13 VAL 6 HG13 VAL 6 32.129 7.390 -3.581 47 HG21 VAL 6 HG21 VAL 6 34.845 5.344 -2.010 48 HG22 VAL 6 HG22 VAL 6 34.394 6.200 -3.484 49 HG23 VAL 6 HG23 VAL 6 33.765 4.581 -3.177 50 H LYS 7 HN LYS 7 32.490 6.921 1.154 51 HA LYS 7 HA LYS 7 29.832 7.892 0.972 52 HB2 LYS 7 HB2 LYS 7 30.757 6.253 2.680 53 HB3 LYS 7 HB1 LYS 7 31.466 7.641 3.505 54 HG2 LYS 7 HG2 LYS 7 29.113 8.659 3.508 55 HG3 LYS 7 HG1 LYS 7 28.533 7.068 3.020 56 HD2 LYS 7 HD2 LYS 7 30.078 7.731 5.545 57 HD3 LYS 7 HD1 LYS 7 28.382 7.260 5.444 58 HE2 LYS 7 HE2 LYS 7 30.834 5.569 4.946 59 HE3 LYS 7 HE1 LYS 7 29.480 5.249 6.029 60 HZ1 LYS 7 HZ1 LYS 7 29.704 4.824 3.162 61 HZ2 LYS 7 HZ2 LYS 7 28.205 5.400 3.715 62 HZ3 LYS 7 HZ3 LYS 7 28.838 3.946 4.326 63 H LYS 8 HN LYS 8 32.887 9.373 1.865 64 HA LYS 8 HA LYS 8 31.802 11.744 3.009 65 HB2 LYS 8 HB2 LYS 8 34.498 11.410 1.677 66 HB3 LYS 8 HB1 LYS 8 34.046 12.613 2.888 67 HG2 LYS 8 HG2 LYS 8 33.578 10.749 4.493 68 HG3 LYS 8 HG1 LYS 8 34.189 9.611 3.291 69 HD2 LYS 8 HD2 LYS 8 36.375 10.712 3.312 70 HD3 LYS 8 HD1 LYS 8 35.775 11.924 4.445 71 HE2 LYS 8 HE2 LYS 8 35.322 10.134 6.100 72 HE3 LYS 8 HE1 LYS 8 35.973 8.944 4.975 73 HZ1 LYS 8 HZ1 LYS 8 38.100 9.892 5.108 74 HZ2 LYS 8 HZ2 LYS 8 37.548 9.825 6.714 75 HZ3 LYS 8 HZ3 LYS 8 37.529 11.297 5.867 76 H VAL 9 HN VAL 9 32.916 10.902 -0.256 77 HA VAL 9 HA VAL 9 32.691 13.428 -1.438 78 HB VAL 9 HB VAL 9 32.052 10.784 -2.783 79 HG11 VAL 9 HG11 VAL 9 32.923 12.005 -4.788 80 HG12 VAL 9 HG12 VAL 9 33.021 13.469 -3.810 81 HG13 VAL 9 HG13 VAL 9 31.455 12.725 -4.129 82 HG21 VAL 9 HG21 VAL 9 34.724 12.191 -2.473 83 HG22 VAL 9 HG22 VAL 9 34.436 10.674 -3.324 84 HG23 VAL 9 HG23 VAL 9 34.238 10.753 -1.574 85 H VAL 10 HN VAL 10 30.315 10.771 -1.701 86 HA VAL 10 HA VAL 10 28.235 12.368 -2.726 87 HB VAL 10 HB VAL 10 27.888 9.865 -1.053 88 HG11 VAL 10 HG11 VAL 10 25.810 11.050 -1.516 89 HG12 VAL 10 HG12 VAL 10 25.880 9.601 -2.520 90 HG13 VAL 10 HG13 VAL 10 26.230 11.181 -3.225 91 HG21 VAL 10 HG21 VAL 10 29.527 9.432 -2.820 92 HG22 VAL 10 HG22 VAL 10 28.468 10.181 -4.017 93 HG23 VAL 10 HG23 VAL 10 27.994 8.668 -3.242 94 H GLY 11 HN GLY 11 29.254 11.639 0.555 95 HA2 GLY 11 HA1 GLY 11 27.082 12.372 2.059 96 HA3 GLY 11 HA2 GLY 11 28.745 12.675 2.541 97 H ALA 12 HN ALA 12 29.472 14.515 0.557 98 HA ALA 12 HA ALA 12 28.552 16.931 1.672 99 HB1 ALA 12 HB1 ALA 12 29.804 18.021 -0.049 100 HB2 ALA 12 HB2 ALA 12 29.747 16.587 -1.077 101 HB3 ALA 12 HB3 ALA 12 30.700 16.572 0.408 102 H PHE 13 HN PHE 13 27.745 15.350 -1.417 103 HA PHE 13 HA PHE 13 25.681 17.298 -2.029 104 HB2 PHE 13 HB2 PHE 13 26.506 14.704 -3.353 105 HB3 PHE 13 HB1 PHE 13 25.245 15.772 -3.970 106 HD1 PHE 13 HD1 PHE 13 25.782 17.894 -5.026 107 HD2 PHE 13 HD2 PHE 13 28.876 15.463 -3.250 108 HE1 PHE 13 HE1 PHE 13 27.520 19.306 -6.120 109 HE2 PHE 13 HE2 PHE 13 30.613 16.874 -4.345 110 HZ PHE 13 HZ PHE 13 29.935 18.805 -5.769 111 H GLY 14 HN GLY 14 25.636 15.369 0.386 112 HA2 GLY 14 HA1 GLY 14 23.407 13.634 -0.056 113 HA3 GLY 14 HA2 GLY 14 24.124 14.038 1.497 114 H SER 15 HN SER 15 23.146 16.649 -0.530 115 HA SER 15 HA SER 15 20.448 16.860 0.408 116 HB2 SER 15 HB2 SER 15 22.554 18.595 1.712 117 HB3 SER 15 HB1 SER 15 20.823 18.918 1.783 118 HG SER 15 HG SER 15 22.198 16.612 2.711 119 H LEU 16 HN LEU 16 23.281 18.750 -0.642 120 HA LEU 16 HA LEU 16 21.724 20.684 -2.070 121 HB2 LEU 16 HB2 LEU 16 24.639 20.062 -2.561 122 HB3 LEU 16 HB1 LEU 16 23.799 21.599 -2.771 123 HG LEU 16 HG LEU 16 24.320 20.197 -0.129 124 HD11 LEU 16 HD11 LEU 16 26.324 21.230 -1.104 125 HD12 LEU 16 HD12 LEU 16 25.778 22.158 0.293 126 HD13 LEU 16 HD13 LEU 16 25.447 22.741 -1.339 127 HD21 LEU 16 HD21 LEU 16 22.252 21.361 0.119 128 HD22 LEU 16 HD22 LEU 16 22.807 22.721 -0.858 129 HD23 LEU 16 HD23 LEU 16 23.466 22.466 0.758 Start of MODEL 19 1 H1 GLY 1 HT1 GLY 1 41.542 1.327 1.684 2 H2 GLY 1 HT2 GLY 1 41.892 1.827 0.099 3 H3 GLY 1 HT3 GLY 1 40.593 0.771 0.395 4 HA2 GLY 1 HA1 GLY 1 39.439 2.446 1.596 5 HA3 GLY 1 HA2 GLY 1 40.799 3.538 1.358 6 H LEU 2 HN LEU 2 37.871 2.428 0.145 7 HA LEU 2 HA LEU 2 37.897 4.300 -2.012 8 HB2 LEU 2 HB2 LEU 2 37.779 2.825 -3.885 9 HB3 LEU 2 HB1 LEU 2 39.205 2.353 -2.970 10 HG LEU 2 HG LEU 2 36.501 0.972 -2.978 11 HD11 LEU 2 HD11 LEU 2 38.038 0.544 -4.895 12 HD12 LEU 2 HD12 LEU 2 37.757 -0.893 -3.913 13 HD13 LEU 2 HD13 LEU 2 39.267 0.003 -3.752 14 HD21 LEU 2 HD21 LEU 2 37.793 -0.706 -1.483 15 HD22 LEU 2 HD22 LEU 2 37.234 0.778 -0.720 16 HD23 LEU 2 HD23 LEU 2 38.926 0.616 -1.194 17 H PHE 3 HN PHE 3 36.444 2.535 0.298 18 HA PHE 3 HA PHE 3 33.722 2.877 -0.868 19 HB2 PHE 3 HB2 PHE 3 34.303 0.493 -0.551 20 HB3 PHE 3 HB1 PHE 3 34.634 0.811 1.152 21 HD1 PHE 3 HD1 PHE 3 32.854 0.956 2.759 22 HD2 PHE 3 HD2 PHE 3 31.972 0.920 -1.467 23 HE1 PHE 3 HE1 PHE 3 30.428 0.701 3.267 24 HE2 PHE 3 HE2 PHE 3 29.547 0.664 -0.958 25 HZ PHE 3 HZ PHE 3 28.768 0.637 1.409 26 H ASP 4 HN ASP 4 35.768 3.039 2.010 27 HA ASP 4 HA ASP 4 33.727 4.132 3.706 28 HB2 ASP 4 HB2 ASP 4 35.621 4.613 5.240 29 HB3 ASP 4 HB1 ASP 4 35.621 2.943 4.674 30 H ILE 5 HN ILE 5 36.177 5.429 1.558 31 HA ILE 5 HA ILE 5 35.948 8.144 2.472 32 HB ILE 5 HB ILE 5 36.971 7.248 -0.238 33 HG12 ILE 5 HG12 ILE 5 38.446 7.349 2.417 34 HG13 ILE 5 HG11 ILE 5 38.045 5.886 1.518 35 HG21 ILE 5 HG21 ILE 5 36.605 9.722 0.342 36 HG22 ILE 5 HG22 ILE 5 38.222 9.279 -0.195 37 HG23 ILE 5 HG23 ILE 5 37.902 9.531 1.521 38 HD11 ILE 5 HD1 ILE 5 40.294 6.334 0.921 39 HD12 ILE 5 HD2 ILE 5 39.999 8.064 0.768 40 HD13 ILE 5 HD3 ILE 5 39.360 6.951 -0.442 41 H VAL 6 HN VAL 6 34.586 6.240 -0.184 42 HA VAL 6 HA VAL 6 33.307 8.261 -1.610 43 HB VAL 6 HB VAL 6 32.273 5.448 -1.130 44 HG11 VAL 6 HG11 VAL 6 31.260 5.860 -3.426 45 HG12 VAL 6 HG12 VAL 6 31.687 7.558 -3.223 46 HG13 VAL 6 HG13 VAL 6 30.546 6.798 -2.115 47 HG21 VAL 6 HG21 VAL 6 34.645 5.645 -2.002 48 HG22 VAL 6 HG22 VAL 6 33.988 6.498 -3.400 49 HG23 VAL 6 HG23 VAL 6 33.531 4.822 -3.094 50 H LYS 7 HN LYS 7 32.621 7.006 1.519 51 HA LYS 7 HA LYS 7 29.853 7.609 1.668 52 HB2 LYS 7 HB2 LYS 7 31.074 6.147 3.282 53 HB3 LYS 7 HB1 LYS 7 31.874 7.583 3.923 54 HG2 LYS 7 HG2 LYS 7 29.783 8.523 4.653 55 HG3 LYS 7 HG1 LYS 7 28.862 7.288 3.794 56 HD2 LYS 7 HD2 LYS 7 29.801 5.549 5.260 57 HD3 LYS 7 HD1 LYS 7 30.744 6.770 6.115 58 HE2 LYS 7 HE2 LYS 7 28.606 6.154 7.282 59 HE3 LYS 7 HE1 LYS 7 28.727 7.868 6.891 60 HZ1 LYS 7 HZ1 LYS 7 27.118 7.724 5.331 61 HZ2 LYS 7 HZ2 LYS 7 26.609 6.420 6.293 62 HZ3 LYS 7 HZ3 LYS 7 27.515 6.137 4.884 63 H LYS 8 HN LYS 8 32.770 9.509 2.129 64 HA LYS 8 HA LYS 8 31.454 11.779 3.296 65 HB2 LYS 8 HB2 LYS 8 34.134 11.595 1.899 66 HB3 LYS 8 HB1 LYS 8 33.582 12.933 2.906 67 HG2 LYS 8 HG2 LYS 8 33.443 11.465 4.850 68 HG3 LYS 8 HG1 LYS 8 33.880 10.071 3.861 69 HD2 LYS 8 HD2 LYS 8 36.051 11.171 3.325 70 HD3 LYS 8 HD1 LYS 8 35.619 12.496 4.405 71 HE2 LYS 8 HE2 LYS 8 35.894 9.585 5.210 72 HE3 LYS 8 HE1 LYS 8 37.059 10.863 5.561 73 HZ1 LYS 8 HZ1 LYS 8 34.341 10.490 6.636 74 HZ2 LYS 8 HZ2 LYS 8 35.050 12.033 6.618 75 HZ3 LYS 8 HZ3 LYS 8 35.791 10.764 7.472 76 H VAL 9 HN VAL 9 32.419 10.818 0.040 77 HA VAL 9 HA VAL 9 31.978 13.221 -1.311 78 HB VAL 9 HB VAL 9 31.414 10.432 -2.365 79 HG11 VAL 9 HG11 VAL 9 31.978 13.098 -3.689 80 HG12 VAL 9 HG12 VAL 9 30.528 12.108 -3.852 81 HG13 VAL 9 HG13 VAL 9 32.053 11.557 -4.544 82 HG21 VAL 9 HG21 VAL 9 33.739 10.450 -3.117 83 HG22 VAL 9 HG22 VAL 9 33.696 10.707 -1.373 84 HG23 VAL 9 HG23 VAL 9 33.968 12.070 -2.460 85 H VAL 10 HN VAL 10 29.709 10.467 -1.051 86 HA VAL 10 HA VAL 10 27.495 11.771 -2.161 87 HB VAL 10 HB VAL 10 26.117 10.069 -0.956 88 HG11 VAL 10 HG11 VAL 10 28.649 9.105 -2.318 89 HG12 VAL 10 HG12 VAL 10 27.105 9.465 -3.090 90 HG13 VAL 10 HG13 VAL 10 27.247 8.085 -2.002 91 HG21 VAL 10 HG21 VAL 10 27.393 8.347 0.361 92 HG22 VAL 10 HG22 VAL 10 27.357 9.934 1.131 93 HG23 VAL 10 HG23 VAL 10 28.806 9.398 0.280 94 H GLY 11 HN GLY 11 29.008 12.185 0.883 95 HA2 GLY 11 HA1 GLY 11 26.749 13.123 2.354 96 HA3 GLY 11 HA2 GLY 11 28.439 13.349 2.782 97 H ALA 12 HN ALA 12 29.459 14.789 0.750 98 HA ALA 12 HA ALA 12 28.356 17.402 1.232 99 HB1 ALA 12 HB1 ALA 12 30.739 17.183 1.029 100 HB2 ALA 12 HB2 ALA 12 30.163 18.124 -0.347 101 HB3 ALA 12 HB3 ALA 12 30.585 16.424 -0.555 102 H PHE 13 HN PHE 13 27.151 15.058 -0.580 103 HA PHE 13 HA PHE 13 25.756 14.945 -2.399 104 HB2 PHE 13 HB2 PHE 13 25.544 17.955 -2.256 105 HB3 PHE 13 HB1 PHE 13 24.323 16.790 -2.768 106 HD1 PHE 13 HD1 PHE 13 23.812 14.883 -0.914 107 HD2 PHE 13 HD2 PHE 13 25.298 18.853 -0.082 108 HE1 PHE 13 HE1 PHE 13 22.955 14.719 1.420 109 HE2 PHE 13 HE2 PHE 13 24.439 18.685 2.248 110 HZ PHE 13 HZ PHE 13 23.354 16.582 3.026 111 H GLY 14 HN GLY 14 28.745 16.010 -2.550 112 HA2 GLY 14 HA1 GLY 14 30.219 16.185 -4.310 113 HA3 GLY 14 HA2 GLY 14 28.869 15.941 -5.410 114 H SER 15 HN SER 15 27.343 17.872 -5.560 115 HA SER 15 HA SER 15 28.382 20.479 -4.982 116 HB2 SER 15 HB2 SER 15 28.758 21.189 -7.308 117 HB3 SER 15 HB1 SER 15 29.868 19.899 -6.852 118 HG SER 15 HG SER 15 27.809 18.647 -7.747 119 H LEU 16 HN LEU 16 25.981 18.343 -5.787 120 HA LEU 16 HA LEU 16 24.125 20.040 -7.136 121 HB2 LEU 16 HB2 LEU 16 23.870 17.463 -5.580 122 HB3 LEU 16 HB1 LEU 16 22.447 18.292 -6.209 123 HG LEU 16 HG LEU 16 23.434 18.213 -8.489 124 HD11 LEU 16 HD11 LEU 16 25.781 18.135 -8.127 125 HD12 LEU 16 HD12 LEU 16 25.385 16.531 -8.738 126 HD13 LEU 16 HD13 LEU 16 25.649 16.775 -7.011 127 HD21 LEU 16 HD21 LEU 16 21.910 16.425 -7.638 128 HD22 LEU 16 HD22 LEU 16 23.325 15.500 -7.133 129 HD23 LEU 16 HD23 LEU 16 23.050 15.826 -8.844 Start of MODEL 20 1 H1 GLY 1 HT1 GLY 1 40.134 2.527 1.472 2 H2 GLY 1 HT2 GLY 1 40.896 1.013 1.604 3 H3 GLY 1 HT3 GLY 1 39.900 1.581 2.858 4 HA2 GLY 1 HA1 GLY 1 39.150 -0.091 0.934 5 HA3 GLY 1 HA2 GLY 1 38.071 0.900 1.907 6 H LEU 2 HN LEU 2 36.546 1.602 0.589 7 HA LEU 2 HA LEU 2 37.168 3.490 -1.461 8 HB2 LEU 2 HB2 LEU 2 36.420 2.317 -3.396 9 HB3 LEU 2 HB1 LEU 2 37.595 1.269 -2.609 10 HG LEU 2 HG LEU 2 34.571 1.021 -2.514 11 HD11 LEU 2 HD11 LEU 2 36.764 -0.792 -3.564 12 HD12 LEU 2 HD12 LEU 2 35.654 0.164 -4.548 13 HD13 LEU 2 HD13 LEU 2 35.041 -1.166 -3.565 14 HD21 LEU 2 HD21 LEU 2 36.740 -0.363 -0.912 15 HD22 LEU 2 HD22 LEU 2 35.173 -1.121 -1.192 16 HD23 LEU 2 HD23 LEU 2 35.267 0.404 -0.319 17 H PHE 3 HN PHE 3 35.259 2.202 0.849 18 HA PHE 3 HA PHE 3 32.730 3.362 -0.190 19 HB2 PHE 3 HB2 PHE 3 32.676 1.003 0.606 20 HB3 PHE 3 HB1 PHE 3 33.179 1.560 2.202 21 HD1 PHE 3 HD1 PHE 3 30.484 1.769 -0.363 22 HD2 PHE 3 HD2 PHE 3 31.622 2.625 3.712 23 HE1 PHE 3 HE1 PHE 3 28.116 2.313 0.184 24 HE2 PHE 3 HE2 PHE 3 29.252 3.167 4.259 25 HZ PHE 3 HZ PHE 3 27.505 3.043 2.487 26 H ASP 4 HN ASP 4 34.672 3.195 2.804 27 HA ASP 4 HA ASP 4 33.304 5.199 4.209 28 HB2 ASP 4 HB2 ASP 4 34.954 3.627 5.213 29 HB3 ASP 4 HB1 ASP 4 36.246 4.517 4.407 30 H ILE 5 HN ILE 5 35.855 5.379 1.804 31 HA ILE 5 HA ILE 5 36.370 8.193 2.201 32 HB ILE 5 HB ILE 5 37.098 6.554 -0.243 33 HG12 ILE 5 HG12 ILE 5 38.533 6.778 2.424 34 HG13 ILE 5 HG11 ILE 5 37.819 5.318 1.745 35 HG21 ILE 5 HG21 ILE 5 37.383 9.103 -0.166 36 HG22 ILE 5 HG22 ILE 5 38.829 8.171 -0.538 37 HG23 ILE 5 HG23 ILE 5 38.597 8.829 1.082 38 HD11 ILE 5 HD1 ILE 5 39.395 5.712 -0.274 39 HD12 ILE 5 HD2 ILE 5 40.122 5.130 1.224 40 HD13 ILE 5 HD3 ILE 5 40.252 6.833 0.787 41 H VAL 6 HN VAL 6 34.650 6.235 -0.227 42 HA VAL 6 HA VAL 6 33.813 8.456 -1.800 43 HB VAL 6 HB VAL 6 32.649 5.659 -1.601 44 HG11 VAL 6 HG11 VAL 6 31.757 6.274 -3.915 45 HG12 VAL 6 HG12 VAL 6 32.155 7.946 -3.526 46 HG13 VAL 6 HG13 VAL 6 30.965 7.074 -2.559 47 HG21 VAL 6 HG21 VAL 6 35.058 5.905 -2.353 48 HG22 VAL 6 HG22 VAL 6 34.467 6.876 -3.700 49 HG23 VAL 6 HG23 VAL 6 33.987 5.185 -3.558 50 H LYS 7 HN LYS 7 32.649 7.017 1.124 51 HA LYS 7 HA LYS 7 29.945 7.796 1.036 52 HB2 LYS 7 HB2 LYS 7 30.892 6.248 2.725 53 HB3 LYS 7 HB1 LYS 7 31.747 7.604 3.461 54 HG2 LYS 7 HG2 LYS 7 29.669 8.710 4.005 55 HG3 LYS 7 HG1 LYS 7 28.742 7.521 3.090 56 HD2 LYS 7 HD2 LYS 7 29.373 5.759 4.641 57 HD3 LYS 7 HD1 LYS 7 30.447 6.859 5.507 58 HE2 LYS 7 HE2 LYS 7 27.445 7.201 5.247 59 HE3 LYS 7 HE1 LYS 7 28.277 6.594 6.678 60 HZ1 LYS 7 HZ1 LYS 7 28.364 8.724 7.282 61 HZ2 LYS 7 HZ2 LYS 7 27.999 9.292 5.723 62 HZ3 LYS 7 HZ3 LYS 7 29.599 8.888 6.132 63 H LYS 8 HN LYS 8 32.871 9.547 1.910 64 HA LYS 8 HA LYS 8 31.533 11.837 2.983 65 HB2 LYS 8 HB2 LYS 8 34.342 11.512 1.899 66 HB3 LYS 8 HB1 LYS 8 33.756 12.918 2.791 67 HG2 LYS 8 HG2 LYS 8 33.255 11.499 4.733 68 HG3 LYS 8 HG1 LYS 8 33.795 10.074 3.846 69 HD2 LYS 8 HD2 LYS 8 36.044 11.181 3.587 70 HD3 LYS 8 HD1 LYS 8 35.479 12.455 4.666 71 HE2 LYS 8 HE2 LYS 8 34.993 10.705 6.392 72 HE3 LYS 8 HE1 LYS 8 35.722 9.506 5.324 73 HZ1 LYS 8 HZ1 LYS 8 36.983 11.623 6.877 74 HZ2 LYS 8 HZ2 LYS 8 37.638 11.321 5.338 75 HZ3 LYS 8 HZ3 LYS 8 37.553 10.074 6.489 76 H VAL 9 HN VAL 9 32.721 10.913 -0.204 77 HA VAL 9 HA VAL 9 32.460 13.433 -1.458 78 HB VAL 9 HB VAL 9 32.122 10.711 -2.755 79 HG11 VAL 9 HG11 VAL 9 31.442 12.529 -4.210 80 HG12 VAL 9 HG12 VAL 9 33.028 11.967 -4.739 81 HG13 VAL 9 HG13 VAL 9 32.888 13.453 -3.801 82 HG21 VAL 9 HG21 VAL 9 34.614 12.357 -2.198 83 HG22 VAL 9 HG22 VAL 9 34.568 10.920 -3.220 84 HG23 VAL 9 HG23 VAL 9 34.221 10.788 -1.496 85 H VAL 10 HN VAL 10 30.282 10.602 -1.636 86 HA VAL 10 HA VAL 10 28.168 12.068 -2.865 87 HB VAL 10 HB VAL 10 27.948 9.461 -1.330 88 HG11 VAL 10 HG11 VAL 10 26.045 9.119 -2.939 89 HG12 VAL 10 HG12 VAL 10 26.266 10.783 -3.480 90 HG13 VAL 10 HG13 VAL 10 25.788 10.454 -1.814 91 HG21 VAL 10 HG21 VAL 10 28.516 9.928 -4.276 92 HG22 VAL 10 HG22 VAL 10 28.333 8.361 -3.486 93 HG23 VAL 10 HG23 VAL 10 29.710 9.392 -3.094 94 H GLY 11 HN GLY 11 29.027 11.312 0.454 95 HA2 GLY 11 HA1 GLY 11 26.564 12.026 1.654 96 HA3 GLY 11 HA2 GLY 11 28.124 11.950 2.463 97 H ALA 12 HN ALA 12 29.326 13.882 0.586 98 HA ALA 12 HA ALA 12 28.638 16.278 2.016 99 HB1 ALA 12 HB1 ALA 12 30.938 15.783 1.270 100 HB2 ALA 12 HB2 ALA 12 30.357 17.327 0.645 101 HB3 ALA 12 HB3 ALA 12 30.407 15.913 -0.406 102 H PHE 13 HN PHE 13 27.835 14.885 -1.090 103 HA PHE 13 HA PHE 13 26.824 17.250 -2.308 104 HB2 PHE 13 HB2 PHE 13 27.433 15.237 -3.595 105 HB3 PHE 13 HB1 PHE 13 26.102 14.358 -2.841 106 HD1 PHE 13 HD1 PHE 13 26.967 17.200 -5.087 107 HD2 PHE 13 HD2 PHE 13 23.813 14.685 -3.550 108 HE1 PHE 13 HE1 PHE 13 25.403 18.114 -6.799 109 HE2 PHE 13 HE2 PHE 13 22.250 15.599 -5.262 110 HZ PHE 13 HZ PHE 13 23.056 17.284 -6.910 111 H GLY 14 HN GLY 14 25.522 14.964 -0.030 112 HA2 GLY 14 HA1 GLY 14 22.783 15.349 -0.380 113 HA3 GLY 14 HA2 GLY 14 23.555 14.921 1.141 114 H SER 15 HN SER 15 25.169 17.330 1.270 115 HA SER 15 HA SER 15 23.270 19.039 2.567 116 HB2 SER 15 HB2 SER 15 25.230 20.492 2.977 117 HB3 SER 15 HB1 SER 15 25.551 18.817 3.417 118 HG SER 15 HG SER 15 26.731 20.385 1.541 119 H LEU 16 HN LEU 16 25.133 19.201 -0.444 120 HA LEU 16 HA LEU 16 24.275 21.827 -1.160 121 HB2 LEU 16 HB2 LEU 16 25.160 19.694 -3.108 122 HB3 LEU 16 HB1 LEU 16 25.356 21.442 -3.235 123 HG LEU 16 HG LEU 16 26.730 19.623 -1.233 124 HD11 LEU 16 HD11 LEU 16 28.768 20.267 -2.446 125 HD12 LEU 16 HD12 LEU 16 27.814 21.267 -3.542 126 HD13 LEU 16 HD13 LEU 16 27.613 19.514 -3.546 127 HD21 LEU 16 HD21 LEU 16 28.011 21.808 -0.744 128 HD22 LEU 16 HD22 LEU 16 26.373 21.701 -0.109 129 HD23 LEU 16 HD23 LEU 16 26.690 22.636 -1.570
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