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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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642401 |
6mi9 ![]() ![]() |
30516 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H2 PRO 1 HT1 PRO 1 1.998 -2.852 -0.395 2 H3 PRO 1 HT2 PRO 1 0.425 -2.230 -0.213 3 HA PRO 1 HA PRO 1 1.376 -0.252 -0.489 4 HB2 PRO 1 HB2 PRO 1 2.749 -0.013 1.998 5 HB3 PRO 1 HB1 PRO 1 1.091 0.499 1.636 6 HG2 PRO 1 HG2 PRO 1 1.835 -1.577 3.335 7 HG3 PRO 1 HG1 PRO 1 0.213 -1.289 2.687 8 HD2 PRO 1 HD2 PRO 1 2.274 -3.271 1.806 9 HD3 PRO 1 HD1 PRO 1 0.500 -3.374 1.727 10 H MET 2 HN MET 2 2.913 -0.535 -2.113 11 HA MET 2 HA MET 2 5.425 -1.728 -1.834 12 HB2 MET 2 HB2 MET 2 4.533 0.477 -3.710 13 HB3 MET 2 HB1 MET 2 6.028 -0.446 -3.877 14 HG2 MET 2 HG2 MET 2 3.840 -2.280 -3.514 15 HG3 MET 2 HG1 MET 2 3.428 -1.154 -4.806 16 HE1 MET 2 HE1 MET 2 5.207 -0.256 -6.271 17 HE2 MET 2 HE2 MET 2 6.139 -1.331 -7.311 18 HE3 MET 2 HE3 MET 2 6.869 -0.686 -5.844 19 H ALA 3 HN ALA 3 4.284 1.259 -0.622 20 HA ALA 3 HA ALA 3 6.560 2.865 -0.649 21 HB1 ALA 3 HB1 ALA 3 4.461 2.601 1.525 22 HB2 ALA 3 HB2 ALA 3 4.405 3.700 0.145 23 HB3 ALA 3 HB3 ALA 3 5.626 3.918 1.398 24 H ARG 4 HN ARG 4 5.587 0.363 1.672 25 HA ARG 4 HA ARG 4 7.634 0.639 3.532 26 HB2 ARG 4 HB2 ARG 4 6.454 -1.980 2.591 27 HB3 ARG 4 HB1 ARG 4 7.219 -1.662 4.142 28 HG2 ARG 4 HG2 ARG 4 5.381 0.232 4.320 29 HG3 ARG 4 HG1 ARG 4 4.535 -0.770 3.136 30 HD2 ARG 4 HD2 ARG 4 3.975 -1.315 5.533 31 HD3 ARG 4 HD1 ARG 4 4.580 -2.676 4.598 32 HE ARG 4 HE ARG 4 6.404 -1.108 6.334 33 HH11 ARG 4 HH11 ARG 4 7.739 -2.373 7.641 34 HH12 ARG 4 HH12 ARG 4 7.539 -4.095 7.686 35 HH21 ARG 4 HH21 ARG 4 4.913 -4.096 5.396 36 HH22 ARG 4 HH22 ARG 4 5.932 -5.075 6.391 37 H ASN 5 HN ASN 5 7.604 -1.102 0.458 38 HA ASN 5 HA ASN 5 10.305 -2.081 0.759 39 HB2 ASN 5 HB2 ASN 5 8.698 -3.339 -0.600 40 HB3 ASN 5 HB1 ASN 5 8.482 -1.946 -1.662 41 HD21 ASN 5 HD21 ASN 5 10.843 -4.440 -0.672 42 HD22 ASN 5 HD22 ASN 5 11.852 -4.240 -2.025 43 H LYS 6 HN LYS 6 8.656 0.557 -0.900 44 HA LYS 6 HA LYS 6 10.815 1.536 -2.403 45 HB2 LYS 6 HB2 LYS 6 8.162 2.250 -2.027 46 HB3 LYS 6 HB1 LYS 6 9.040 3.630 -1.375 47 HG2 LYS 6 HG2 LYS 6 9.615 2.411 -4.092 48 HG3 LYS 6 HG1 LYS 6 8.537 3.784 -3.844 49 HD2 LYS 6 HD2 LYS 6 10.619 4.748 -2.497 50 HD3 LYS 6 HD1 LYS 6 11.519 3.642 -3.539 51 HE2 LYS 6 HE2 LYS 6 11.314 5.922 -4.538 52 HE3 LYS 6 HE1 LYS 6 10.534 4.697 -5.539 53 HZ1 LYS 6 HZ1 LYS 6 9.343 6.961 -4.713 54 HZ2 LYS 6 HZ2 LYS 6 8.821 5.869 -3.524 55 HZ3 LYS 6 HZ3 LYS 6 8.507 5.555 -5.162 56 H ILE 7 HN ILE 7 9.695 2.486 0.867 57 HA ILE 7 HA ILE 7 11.762 4.397 1.262 58 HB ILE 7 HB ILE 7 11.152 4.306 3.639 59 HG12 ILE 7 HG12 ILE 7 9.629 1.842 2.757 60 HG13 ILE 7 HG11 ILE 7 10.823 1.970 4.044 61 HG21 ILE 7 HG21 ILE 7 8.697 4.119 1.857 62 HG22 ILE 7 HG22 ILE 7 9.723 5.547 1.994 63 HG23 ILE 7 HG23 ILE 7 8.819 4.973 3.394 64 HD11 ILE 7 HD11 ILE 7 7.954 2.801 4.023 65 HD12 ILE 7 HD12 ILE 7 9.080 3.764 4.979 66 HD13 ILE 7 HD13 ILE 7 8.891 2.043 5.312 67 H LEU 8 HN LEU 8 11.461 0.970 2.074 68 HA LEU 8 HA LEU 8 13.934 0.770 3.458 69 HB2 LEU 8 HB2 LEU 8 11.851 -0.902 3.234 70 HB3 LEU 8 HB1 LEU 8 12.849 -1.581 1.954 71 HG LEU 8 HG LEU 8 13.116 -2.549 4.341 72 HD11 LEU 8 HD11 LEU 8 14.733 -3.322 2.897 73 HD12 LEU 8 HD12 LEU 8 15.746 -2.400 4.008 74 HD13 LEU 8 HD13 LEU 8 15.276 -1.707 2.457 75 HD21 LEU 8 HD21 LEU 8 14.277 -1.350 5.953 76 HD22 LEU 8 HD22 LEU 8 13.346 -0.055 5.202 77 HD23 LEU 8 HD23 LEU 8 15.039 -0.291 4.768 78 H GLY 9 HN GLY 9 12.954 0.115 0.100 79 HA2 GLY 9 HA2 GLY 9 15.378 -0.804 -0.928 80 HA3 GLY 9 HA1 GLY 9 14.175 0.095 -1.855 81 H LYS 10 HN LYS 10 14.277 2.465 -0.232 82 HA LYS 10 HA LYS 10 16.306 3.925 -1.520 83 HB2 LYS 10 HB2 LYS 10 14.107 4.528 0.055 84 HB3 LYS 10 HB1 LYS 10 15.465 5.022 1.065 85 HG2 LYS 10 HG2 LYS 10 15.293 5.818 -1.845 86 HG3 LYS 10 HG1 LYS 10 14.520 6.771 -0.582 87 HD2 LYS 10 HD2 LYS 10 17.461 6.021 -0.587 88 HD3 LYS 10 HD1 LYS 10 16.837 7.565 -1.163 89 HE2 LYS 10 HE2 LYS 10 16.940 6.492 1.643 90 HE3 LYS 10 HE1 LYS 10 17.383 8.087 1.044 91 HZ1 LYS 10 HZ1 LYS 10 15.351 8.247 2.252 92 HZ2 LYS 10 HZ2 LYS 10 14.634 7.005 1.347 93 HZ3 LYS 10 HZ3 LYS 10 15.000 8.495 0.611 94 H ILE 11 HN ILE 11 16.174 2.332 1.620 95 HA ILE 11 HA ILE 11 18.645 3.416 2.587 96 HB ILE 11 HB ILE 11 17.326 0.878 3.558 97 HG12 ILE 11 HG12 ILE 11 15.695 2.840 3.277 98 HG13 ILE 11 HG11 ILE 11 15.820 2.158 4.897 99 HG21 ILE 11 HG21 ILE 11 19.266 2.897 4.619 100 HG22 ILE 11 HG22 ILE 11 19.284 1.140 4.767 101 HG23 ILE 11 HG23 ILE 11 18.182 2.094 5.757 102 HD11 ILE 11 HD11 ILE 11 17.456 4.545 3.998 103 HD12 ILE 11 HD12 ILE 11 17.219 3.957 5.642 104 HD13 ILE 11 HD13 ILE 11 15.880 4.705 4.774 105 H LEU 12 HN LEU 12 17.760 0.672 0.631 106 HA LEU 12 HA LEU 12 19.931 -1.002 1.078 107 HB2 LEU 12 HB2 LEU 12 17.979 -0.660 -1.103 108 HB3 LEU 12 HB1 LEU 12 19.484 -1.451 -1.556 109 HG LEU 12 HG LEU 12 17.624 -2.995 -0.734 110 HD11 LEU 12 HD11 LEU 12 20.198 -3.042 0.866 111 HD12 LEU 12 HD12 LEU 12 20.040 -3.622 -0.792 112 HD13 LEU 12 HD13 LEU 12 19.150 -4.414 0.507 113 HD21 LEU 12 HD21 LEU 12 16.908 -2.956 1.465 114 HD22 LEU 12 HD22 LEU 12 17.230 -1.238 1.249 115 HD23 LEU 12 HD23 LEU 12 18.415 -2.261 2.058 116 H ARG 13 HN ARG 13 19.702 1.611 -1.353 117 HA ARG 13 HA ARG 13 22.245 1.194 -2.472 118 HB2 ARG 13 HB2 ARG 13 21.869 3.988 -2.440 119 HB3 ARG 13 HB1 ARG 13 21.507 2.885 -3.759 120 HG2 ARG 13 HG2 ARG 13 19.566 3.321 -1.486 121 HG3 ARG 13 HG1 ARG 13 19.582 4.372 -2.902 122 HD2 ARG 13 HD2 ARG 13 18.248 1.933 -2.657 123 HD3 ARG 13 HD1 ARG 13 18.470 2.856 -4.126 124 HE ARG 13 HE ARG 13 20.714 1.486 -4.176 125 HH11 ARG 13 HH11 ARG 13 21.069 -0.686 -4.735 126 HH12 ARG 13 HH12 ARG 13 19.830 -1.865 -4.443 127 HH21 ARG 13 HH21 ARG 13 17.593 0.425 -3.088 128 HH22 ARG 13 HH22 ARG 13 17.860 -1.232 -3.514 129 H LYS 14 HN LYS 14 21.215 3.025 0.356 130 HA LYS 14 HA LYS 14 23.711 4.199 0.984 131 HB2 LYS 14 HB2 LYS 14 21.863 3.331 3.177 132 HB3 LYS 14 HB1 LYS 14 22.753 4.840 2.999 133 HG2 LYS 14 HG2 LYS 14 20.390 4.061 1.254 134 HG3 LYS 14 HG1 LYS 14 20.265 5.075 2.689 135 HD2 LYS 14 HD2 LYS 14 20.767 6.861 1.406 136 HD3 LYS 14 HD1 LYS 14 22.374 6.183 1.172 137 HE2 LYS 14 HE2 LYS 14 21.737 5.095 -0.846 138 HE3 LYS 14 HE1 LYS 14 20.024 5.338 -0.528 139 HZ1 LYS 14 HZ1 LYS 14 21.612 7.751 -0.633 140 HZ2 LYS 14 HZ2 LYS 14 20.085 7.428 -1.298 141 HZ3 LYS 14 HZ3 LYS 14 21.491 6.913 -2.099 142 H ILE 15 HN ILE 15 22.168 1.172 1.976 143 HA ILE 15 HA ILE 15 24.293 0.266 3.629 144 HB ILE 15 HB ILE 15 22.184 -1.314 2.136 145 HG12 ILE 15 HG12 ILE 15 21.502 0.537 3.841 146 HG13 ILE 15 HG11 ILE 15 20.796 -1.066 4.029 147 HG21 ILE 15 HG21 ILE 15 22.617 -2.967 4.017 148 HG22 ILE 15 HG22 ILE 15 24.059 -2.033 4.402 149 HG23 ILE 15 HG23 ILE 15 23.917 -2.826 2.833 150 HD11 ILE 15 HD11 ILE 15 21.882 0.187 6.096 151 HD12 ILE 15 HD12 ILE 15 23.377 -0.463 5.425 152 HD13 ILE 15 HD13 ILE 15 22.078 -1.555 5.904 153 H ALA 16 HN ALA 16 23.388 -0.398 0.254 154 HA ALA 16 HA ALA 16 25.467 -2.180 -0.370 155 HB1 ALA 16 HB1 ALA 16 23.355 -1.257 -1.750 156 HB2 ALA 16 HB2 ALA 16 24.750 -1.985 -2.543 157 HB3 ALA 16 HB3 ALA 16 24.605 -0.230 -2.452 158 H ALA 17 HN ALA 17 25.288 1.362 -0.569 159 HA ALA 17 HA ALA 17 27.910 1.733 -1.617 160 HB1 ALA 17 HB1 ALA 17 27.591 4.089 -0.630 161 HB2 ALA 17 HB2 ALA 17 25.980 3.545 -0.166 162 HB3 ALA 17 HB3 ALA 17 26.447 3.575 -1.866 163 H PHE 18 HN PHE 18 26.565 1.547 1.622 164 HA PHE 18 HA PHE 18 28.948 2.291 3.007 165 HB2 PHE 18 HB2 PHE 18 27.228 2.519 4.478 166 HB3 PHE 18 HB1 PHE 18 26.258 1.285 3.686 167 HD1 PHE 18 HD1 PHE 18 25.937 -0.772 4.740 168 HD2 PHE 18 HD2 PHE 18 29.342 1.633 5.815 169 HE1 PHE 18 HE1 PHE 18 26.524 -2.375 6.546 170 HE2 PHE 18 HE2 PHE 18 29.917 0.031 7.603 171 HZ PHE 18 HZ PHE 18 28.518 -1.974 7.977 172 H LYS 19 HN LYS 19 27.472 -0.831 2.146 173 HA LYS 19 HA LYS 19 29.643 -2.344 3.316 174 HB2 LYS 19 HB2 LYS 19 27.063 -2.929 2.009 175 HB3 LYS 19 HB1 LYS 19 28.330 -4.116 1.704 176 HG2 LYS 19 HG2 LYS 19 28.490 -4.729 3.928 177 HG3 LYS 19 HG1 LYS 19 27.989 -3.141 4.509 178 HD2 LYS 19 HD2 LYS 19 25.688 -3.568 3.899 179 HD3 LYS 19 HD1 LYS 19 26.126 -5.091 3.122 180 HE2 LYS 19 HE2 LYS 19 26.676 -4.549 6.047 181 HE3 LYS 19 HE1 LYS 19 25.159 -5.255 5.496 182 HZ1 LYS 19 HZ2 LYS 19 26.197 -7.155 4.768 183 HZ2 LYS 19 HZ3 LYS 19 27.092 -6.794 6.162 184 HZ3 LYS 19 HZ1 LYS 19 27.724 -6.418 4.635 185 HN1 NH2 20 H1 LYS 19 29.134 -0.783 0.286 Start of MODEL 2 1 H2 PRO 1 HT1 PRO 1 2.893 -2.809 3.452 2 H3 PRO 1 HT2 PRO 1 1.888 -2.206 4.688 3 HA PRO 1 HA PRO 1 2.872 -0.266 4.435 4 HB2 PRO 1 HB2 PRO 1 5.598 -1.037 5.119 5 HB3 PRO 1 HB1 PRO 1 4.420 -0.149 6.108 6 HG2 PRO 1 HG2 PRO 1 5.245 -2.704 6.617 7 HG3 PRO 1 HG1 PRO 1 3.695 -2.030 7.143 8 HD2 PRO 1 HD2 PRO 1 4.255 -3.902 4.864 9 HD3 PRO 1 HD1 PRO 1 2.835 -3.803 5.929 10 H MET 2 HN MET 2 2.547 -0.779 2.048 11 HA MET 2 HA MET 2 4.563 -1.651 0.342 12 HB2 MET 2 HB2 MET 2 2.391 0.407 -0.136 13 HB3 MET 2 HB1 MET 2 3.370 -0.316 -1.413 14 HG2 MET 2 HG2 MET 2 2.559 -2.535 -0.850 15 HG3 MET 2 HG1 MET 2 1.679 -1.908 0.540 16 HE1 MET 2 HE1 MET 2 2.307 -1.950 -3.079 17 HE2 MET 2 HE2 MET 2 0.793 -1.587 -3.897 18 HE3 MET 2 HE3 MET 2 0.985 -3.131 -3.072 19 H ALA 3 HN ALA 3 4.161 1.448 1.936 20 HA ALA 3 HA ALA 3 5.964 2.911 0.277 21 HB1 ALA 3 HB1 ALA 3 5.883 4.624 1.941 22 HB2 ALA 3 HB2 ALA 3 5.387 3.483 3.190 23 HB3 ALA 3 HB3 ALA 3 4.271 3.911 1.896 24 H ARG 4 HN ARG 4 6.337 1.231 3.401 25 HA ARG 4 HA ARG 4 9.018 1.833 3.871 26 HB2 ARG 4 HB2 ARG 4 7.426 -0.654 4.530 27 HB3 ARG 4 HB1 ARG 4 9.084 -0.404 5.074 28 HG2 ARG 4 HG2 ARG 4 8.349 1.770 6.108 29 HG3 ARG 4 HG1 ARG 4 6.686 1.357 5.681 30 HD2 ARG 4 HD2 ARG 4 7.376 0.773 8.051 31 HD3 ARG 4 HD1 ARG 4 6.691 -0.556 7.129 32 HE ARG 4 HE ARG 4 9.322 -0.879 6.692 33 HH11 ARG 4 HH11 ARG 4 10.756 -1.991 8.066 34 HH12 ARG 4 HH12 ARG 4 10.431 -2.069 9.766 35 HH21 ARG 4 HH21 ARG 4 7.467 -0.265 9.556 36 HH22 ARG 4 HH22 ARG 4 8.574 -1.080 10.611 37 H ASN 5 HN ASN 5 7.586 -0.809 1.985 38 HA ASN 5 HA ASN 5 9.937 -2.110 1.192 39 HB2 ASN 5 HB2 ASN 5 7.592 -2.912 0.750 40 HB3 ASN 5 HB1 ASN 5 7.466 -1.693 -0.516 41 HD21 ASN 5 HD21 ASN 5 10.587 -2.364 -0.854 42 HD22 ASN 5 HD22 ASN 5 10.522 -3.699 -1.900 43 H LYS 6 HN LYS 6 8.211 0.651 -0.219 44 HA LYS 6 HA LYS 6 9.949 1.024 -2.425 45 HB2 LYS 6 HB2 LYS 6 7.604 2.227 -1.476 46 HB3 LYS 6 HB1 LYS 6 8.816 3.506 -1.398 47 HG2 LYS 6 HG2 LYS 6 8.773 1.834 -3.871 48 HG3 LYS 6 HG1 LYS 6 7.433 2.959 -3.650 49 HD2 LYS 6 HD2 LYS 6 9.172 4.757 -3.183 50 HD3 LYS 6 HD1 LYS 6 10.390 3.605 -3.723 51 HE2 LYS 6 HE2 LYS 6 8.521 3.478 -5.748 52 HE3 LYS 6 HE1 LYS 6 8.475 5.180 -5.298 53 HZ1 LYS 6 HZ1 LYS 6 11.011 5.000 -5.383 54 HZ2 LYS 6 HZ2 LYS 6 10.155 5.085 -6.843 55 HZ3 LYS 6 HZ3 LYS 6 10.749 3.591 -6.289 56 H ILE 7 HN ILE 7 9.898 2.302 0.876 57 HA ILE 7 HA ILE 7 12.110 4.066 0.563 58 HB ILE 7 HB ILE 7 11.102 2.681 3.063 59 HG12 ILE 7 HG12 ILE 7 9.543 4.234 1.606 60 HG13 ILE 7 HG11 ILE 7 9.607 4.452 3.353 61 HG21 ILE 7 HG21 ILE 7 12.950 5.034 2.604 62 HG22 ILE 7 HG22 ILE 7 13.285 3.557 3.506 63 HG23 ILE 7 HG23 ILE 7 12.148 4.742 4.148 64 HD11 ILE 7 HD11 ILE 7 11.411 5.996 1.476 65 HD12 ILE 7 HD12 ILE 7 11.054 6.345 3.165 66 HD13 ILE 7 HD13 ILE 7 9.814 6.585 1.934 67 H LEU 8 HN LEU 8 11.759 0.673 1.401 68 HA LEU 8 HA LEU 8 14.338 0.105 2.302 69 HB2 LEU 8 HB2 LEU 8 12.066 -1.374 1.760 70 HB3 LEU 8 HB1 LEU 8 13.207 -1.968 0.556 71 HG LEU 8 HG LEU 8 13.402 -3.306 2.591 72 HD11 LEU 8 HD11 LEU 8 15.485 -2.768 1.327 73 HD12 LEU 8 HD12 LEU 8 15.778 -3.039 3.043 74 HD13 LEU 8 HD13 LEU 8 15.750 -1.398 2.406 75 HD21 LEU 8 HD21 LEU 8 12.581 -1.271 4.010 76 HD22 LEU 8 HD22 LEU 8 14.298 -0.876 4.111 77 HD23 LEU 8 HD23 LEU 8 13.709 -2.418 4.729 78 H GLY 9 HN GLY 9 13.036 0.079 -1.015 79 HA2 GLY 9 HA2 GLY 9 15.314 -0.759 -2.383 80 HA3 GLY 9 HA1 GLY 9 14.113 0.351 -3.045 81 H LYS 10 HN LYS 10 14.422 2.424 -1.174 82 HA LYS 10 HA LYS 10 16.659 3.824 -2.274 83 HB2 LYS 10 HB2 LYS 10 14.393 4.741 -1.351 84 HB3 LYS 10 HB1 LYS 10 15.195 4.667 0.219 85 HG2 LYS 10 HG2 LYS 10 16.953 5.872 -1.751 86 HG3 LYS 10 HG1 LYS 10 15.407 6.723 -1.713 87 HD2 LYS 10 HD2 LYS 10 16.048 6.254 0.991 88 HD3 LYS 10 HD1 LYS 10 17.563 6.740 0.235 89 HE2 LYS 10 HE2 LYS 10 16.540 8.776 0.900 90 HE3 LYS 10 HE1 LYS 10 16.238 8.663 -0.829 91 HZ1 LYS 10 HZ1 LYS 10 14.203 9.227 0.119 92 HZ2 LYS 10 HZ2 LYS 10 14.369 8.118 1.390 93 HZ3 LYS 10 HZ3 LYS 10 14.072 7.566 -0.186 94 H ILE 11 HN ILE 11 15.939 2.225 0.773 95 HA ILE 11 HA ILE 11 18.281 3.027 2.159 96 HB ILE 11 HB ILE 11 16.431 0.672 2.591 97 HG12 ILE 11 HG12 ILE 11 15.654 3.190 2.760 98 HG13 ILE 11 HG11 ILE 11 15.202 2.055 4.032 99 HG21 ILE 11 HG21 ILE 11 18.193 -0.006 3.894 100 HG22 ILE 11 HG22 ILE 11 17.484 1.148 5.021 101 HG23 ILE 11 HG23 ILE 11 18.862 1.618 4.027 102 HD11 ILE 11 HD11 ILE 11 16.280 4.386 4.648 103 HD12 ILE 11 HD12 ILE 11 17.787 3.556 4.265 104 HD13 ILE 11 HD13 ILE 11 16.742 2.936 5.542 105 H LEU 12 HN LEU 12 17.618 0.440 -0.105 106 HA LEU 12 HA LEU 12 19.695 -1.303 0.543 107 HB2 LEU 12 HB2 LEU 12 18.583 -0.627 -2.185 108 HB3 LEU 12 HB1 LEU 12 19.672 -1.980 -1.867 109 HG LEU 12 HG LEU 12 16.880 -1.570 -0.761 110 HD11 LEU 12 HD11 LEU 12 16.356 -3.580 -1.970 111 HD12 LEU 12 HD12 LEU 12 18.052 -3.848 -2.367 112 HD13 LEU 12 HD13 LEU 12 17.180 -2.494 -3.087 113 HD21 LEU 12 HD21 LEU 12 17.391 -3.913 0.246 114 HD22 LEU 12 HD22 LEU 12 18.035 -2.498 1.077 115 HD23 LEU 12 HD23 LEU 12 19.085 -3.470 0.045 116 H ARG 13 HN ARG 13 19.722 1.534 -1.529 117 HA ARG 13 HA ARG 13 22.393 1.314 -2.387 118 HB2 ARG 13 HB2 ARG 13 21.260 4.030 -1.949 119 HB3 ARG 13 HB1 ARG 13 22.066 3.361 -3.365 120 HG2 ARG 13 HG2 ARG 13 19.224 2.756 -2.468 121 HG3 ARG 13 HG1 ARG 13 19.693 3.724 -3.869 122 HD2 ARG 13 HD2 ARG 13 19.849 0.758 -3.482 123 HD3 ARG 13 HD1 ARG 13 19.262 1.670 -4.861 124 HE ARG 13 HE ARG 13 22.038 2.134 -4.583 125 HH11 ARG 13 HH11 ARG 13 23.467 1.050 -5.995 126 HH12 ARG 13 HH12 ARG 13 22.966 -0.418 -6.769 127 HH21 ARG 13 HH21 ARG 13 19.800 -0.415 -5.310 128 HH22 ARG 13 HH22 ARG 13 20.875 -1.252 -6.381 129 H LYS 14 HN LYS 14 20.962 2.377 0.601 130 HA LYS 14 HA LYS 14 23.234 3.826 1.576 131 HB2 LYS 14 HB2 LYS 14 21.204 2.452 3.333 132 HB3 LYS 14 HB1 LYS 14 22.100 3.936 3.646 133 HG2 LYS 14 HG2 LYS 14 20.142 3.728 1.348 134 HG3 LYS 14 HG1 LYS 14 19.624 4.186 2.971 135 HD2 LYS 14 HD2 LYS 14 20.142 6.307 2.326 136 HD3 LYS 14 HD1 LYS 14 21.808 5.816 2.630 137 HE2 LYS 14 HE2 LYS 14 21.944 5.047 0.228 138 HE3 LYS 14 HE1 LYS 14 20.359 5.775 -0.038 139 HZ1 LYS 14 HZ1 LYS 14 21.769 7.730 1.215 140 HZ2 LYS 14 HZ2 LYS 14 21.499 7.622 -0.460 141 HZ3 LYS 14 HZ3 LYS 14 22.934 7.016 0.210 142 H ILE 15 HN ILE 15 21.984 0.528 2.061 143 HA ILE 15 HA ILE 15 24.127 -0.244 3.761 144 HB ILE 15 HB ILE 15 23.091 -2.252 3.926 145 HG12 ILE 15 HG12 ILE 15 21.975 -3.305 1.792 146 HG13 ILE 15 HG11 ILE 15 22.973 -2.145 0.919 147 HG21 ILE 15 HG21 ILE 15 20.748 -2.104 3.636 148 HG22 ILE 15 HG22 ILE 15 20.905 -1.053 2.229 149 HG23 ILE 15 HG23 ILE 15 21.277 -0.435 3.838 150 HD11 ILE 15 HD11 ILE 15 24.609 -3.343 2.925 151 HD12 ILE 15 HD12 ILE 15 24.752 -3.507 1.176 152 HD13 ILE 15 HD13 ILE 15 23.759 -4.641 2.090 153 H ALA 16 HN ALA 16 23.597 -0.285 0.295 154 HA ALA 16 HA ALA 16 25.869 -1.816 -0.440 155 HB1 ALA 16 HB1 ALA 16 25.609 -0.635 -2.663 156 HB2 ALA 16 HB2 ALA 16 24.302 0.300 -1.939 157 HB3 ALA 16 HB3 ALA 16 24.153 -1.450 -2.091 158 H ALA 17 HN ALA 17 25.325 1.689 -0.172 159 HA ALA 17 HA ALA 17 28.019 2.411 -0.790 160 HB1 ALA 17 HB1 ALA 17 25.963 3.947 -0.859 161 HB2 ALA 17 HB2 ALA 17 27.429 4.622 -0.150 162 HB3 ALA 17 HB3 ALA 17 26.124 4.060 0.894 163 H PHE 18 HN PHE 18 26.320 1.460 2.079 164 HA PHE 18 HA PHE 18 28.300 2.320 3.964 165 HB2 PHE 18 HB2 PHE 18 26.284 2.008 5.026 166 HB3 PHE 18 HB1 PHE 18 25.828 0.669 3.986 167 HD1 PHE 18 HD1 PHE 18 26.097 -1.554 4.686 168 HD2 PHE 18 HD2 PHE 18 28.137 1.590 6.787 169 HE1 PHE 18 HE1 PHE 18 26.800 -3.169 6.432 170 HE2 PHE 18 HE2 PHE 18 28.841 -0.023 8.527 171 HZ PHE 18 HZ PHE 18 28.174 -2.402 8.354 172 H LYS 19 HN LYS 19 27.704 -0.583 2.073 173 HA LYS 19 HA LYS 19 29.881 -2.017 3.397 174 HB2 LYS 19 HB2 LYS 19 27.874 -2.751 1.266 175 HB3 LYS 19 HB1 LYS 19 29.253 -3.787 1.637 176 HG2 LYS 19 HG2 LYS 19 28.274 -3.216 4.154 177 HG3 LYS 19 HG1 LYS 19 26.800 -3.300 3.193 178 HD2 LYS 19 HD2 LYS 19 26.907 -5.542 3.212 179 HD3 LYS 19 HD1 LYS 19 28.464 -5.476 2.385 180 HE2 LYS 19 HE2 LYS 19 27.983 -5.411 5.379 181 HE3 LYS 19 HE1 LYS 19 28.768 -6.693 4.457 182 HZ1 LYS 19 HZ2 LYS 19 30.390 -4.852 3.764 183 HZ2 LYS 19 HZ3 LYS 19 30.527 -5.488 5.329 184 HZ3 LYS 19 HZ1 LYS 19 29.771 -3.991 5.090 185 HN1 NH2 20 H1 LYS 19 29.220 -0.416 0.287 Start of MODEL 3 1 H2 PRO 1 HT1 PRO 1 4.871 -3.801 1.682 2 H3 PRO 1 HT2 PRO 1 3.489 -4.116 2.627 3 HA PRO 1 HA PRO 1 2.929 -2.011 2.119 4 HB2 PRO 1 HB2 PRO 1 4.772 -0.589 3.740 5 HB3 PRO 1 HB1 PRO 1 3.176 -1.194 4.226 6 HG2 PRO 1 HG2 PRO 1 5.658 -2.107 5.158 7 HG3 PRO 1 HG1 PRO 1 4.085 -2.885 5.392 8 HD2 PRO 1 HD2 PRO 1 6.250 -3.568 3.445 9 HD3 PRO 1 HD1 PRO 1 5.035 -4.630 4.194 10 H MET 2 HN MET 2 3.438 -1.466 0.025 11 HA MET 2 HA MET 2 5.942 -1.297 -1.108 12 HB2 MET 2 HB2 MET 2 4.865 0.314 -2.747 13 HB3 MET 2 HB1 MET 2 4.052 -1.236 -2.544 14 HG2 MET 2 HG2 MET 2 2.247 0.230 -2.384 15 HG3 MET 2 HG1 MET 2 2.684 0.056 -0.687 16 HE1 MET 2 HE1 MET 2 2.785 1.994 -3.878 17 HE2 MET 2 HE2 MET 2 4.520 2.154 -3.621 18 HE3 MET 2 HE3 MET 2 3.488 3.573 -3.506 19 H ALA 3 HN ALA 3 4.164 1.225 0.638 20 HA ALA 3 HA ALA 3 5.890 3.375 0.134 21 HB1 ALA 3 HB1 ALA 3 4.033 2.680 2.393 22 HB2 ALA 3 HB2 ALA 3 3.924 3.999 1.227 23 HB3 ALA 3 HB3 ALA 3 5.099 4.077 2.539 24 H ARG 4 HN ARG 4 5.947 0.939 2.719 25 HA ARG 4 HA ARG 4 8.393 1.943 3.853 26 HB2 ARG 4 HB2 ARG 4 7.068 -0.761 4.208 27 HB3 ARG 4 HB1 ARG 4 8.359 -0.100 5.211 28 HG2 ARG 4 HG2 ARG 4 6.291 1.867 5.069 29 HG3 ARG 4 HG1 ARG 4 5.527 0.324 5.456 30 HD2 ARG 4 HD2 ARG 4 6.139 1.220 7.558 31 HD3 ARG 4 HD1 ARG 4 7.388 0.033 7.205 32 HE ARG 4 HE ARG 4 7.883 2.843 6.456 33 HH11 ARG 4 HH11 ARG 4 9.748 3.742 7.410 34 HH12 ARG 4 HH12 ARG 4 10.640 2.843 8.592 35 HH21 ARG 4 HH21 ARG 4 8.564 0.071 8.458 36 HH22 ARG 4 HH22 ARG 4 9.969 0.775 9.184 37 H ASN 5 HN ASN 5 7.516 -0.818 1.788 38 HA ASN 5 HA ASN 5 9.978 -2.046 1.502 39 HB2 ASN 5 HB2 ASN 5 7.704 -1.654 -0.422 40 HB3 ASN 5 HB1 ASN 5 9.162 -2.488 -0.929 41 HD21 ASN 5 HD21 ASN 5 9.500 -4.615 -0.166 42 HD22 ASN 5 HD22 ASN 5 8.388 -5.444 0.815 43 H LYS 6 HN LYS 6 8.673 0.725 -0.297 44 HA LYS 6 HA LYS 6 11.000 1.081 -1.899 45 HB2 LYS 6 HB2 LYS 6 8.713 1.982 -2.460 46 HB3 LYS 6 HB1 LYS 6 8.919 3.163 -1.173 47 HG2 LYS 6 HG2 LYS 6 9.526 3.895 -3.581 48 HG3 LYS 6 HG1 LYS 6 10.684 4.269 -2.308 49 HD2 LYS 6 HD2 LYS 6 12.178 2.609 -2.992 50 HD3 LYS 6 HD1 LYS 6 10.920 1.669 -3.789 51 HE2 LYS 6 HE2 LYS 6 11.674 4.406 -4.792 52 HE3 LYS 6 HE1 LYS 6 12.570 2.971 -5.293 53 HZ1 LYS 6 HZ1 LYS 6 10.997 2.714 -6.816 54 HZ2 LYS 6 HZ2 LYS 6 9.982 3.856 -6.092 55 HZ3 LYS 6 HZ3 LYS 6 9.959 2.247 -5.559 56 H ILE 7 HN ILE 7 9.808 2.653 1.082 57 HA ILE 7 HA ILE 7 11.920 4.488 1.357 58 HB ILE 7 HB ILE 7 10.179 3.147 3.438 59 HG12 ILE 7 HG12 ILE 7 9.318 4.798 1.564 60 HG13 ILE 7 HG11 ILE 7 8.774 4.991 3.227 61 HG21 ILE 7 HG21 ILE 7 11.928 3.868 4.778 62 HG22 ILE 7 HG22 ILE 7 10.962 5.340 4.707 63 HG23 ILE 7 HG23 ILE 7 12.378 5.165 3.674 64 HD11 ILE 7 HD11 ILE 7 10.267 6.799 3.622 65 HD12 ILE 7 HD12 ILE 7 9.583 7.113 2.028 66 HD13 ILE 7 HD13 ILE 7 11.207 6.444 2.175 67 H LEU 8 HN LEU 8 11.574 1.176 2.696 68 HA LEU 8 HA LEU 8 14.179 1.242 3.890 69 HB2 LEU 8 HB2 LEU 8 13.818 -0.961 4.559 70 HB3 LEU 8 HB1 LEU 8 12.182 -0.319 4.475 71 HG LEU 8 HG LEU 8 12.351 -1.237 1.966 72 HD11 LEU 8 HD11 LEU 8 14.709 -1.999 2.248 73 HD12 LEU 8 HD12 LEU 8 13.621 -3.342 1.901 74 HD13 LEU 8 HD13 LEU 8 14.185 -3.070 3.550 75 HD21 LEU 8 HD21 LEU 8 11.866 -2.965 4.415 76 HD22 LEU 8 HD22 LEU 8 11.291 -3.326 2.787 77 HD23 LEU 8 HD23 LEU 8 10.676 -1.914 3.645 78 H GLY 9 HN GLY 9 12.871 0.193 0.795 79 HA2 GLY 9 HA2 GLY 9 15.111 -1.142 -0.235 80 HA3 GLY 9 HA1 GLY 9 13.926 -0.266 -1.205 81 H LYS 10 HN LYS 10 14.273 2.282 -0.109 82 HA LYS 10 HA LYS 10 16.419 3.296 -1.634 83 HB2 LYS 10 HB2 LYS 10 14.405 4.599 -0.895 84 HB3 LYS 10 HB1 LYS 10 15.078 4.625 0.735 85 HG2 LYS 10 HG2 LYS 10 17.212 5.485 -0.799 86 HG3 LYS 10 HG1 LYS 10 15.837 6.205 -1.632 87 HD2 LYS 10 HD2 LYS 10 16.125 6.401 1.372 88 HD3 LYS 10 HD1 LYS 10 16.913 7.556 0.295 89 HE2 LYS 10 HE2 LYS 10 13.939 6.938 0.285 90 HE3 LYS 10 HE1 LYS 10 14.672 8.347 1.052 91 HZ1 LYS 10 HZ1 LYS 10 14.723 7.666 -1.836 92 HZ2 LYS 10 HZ2 LYS 10 15.599 8.949 -1.146 93 HZ3 LYS 10 HZ3 LYS 10 13.900 8.959 -1.115 94 H ILE 11 HN ILE 11 16.114 2.408 1.768 95 HA ILE 11 HA ILE 11 18.596 3.444 2.639 96 HB ILE 11 HB ILE 11 17.085 1.071 3.747 97 HG12 ILE 11 HG12 ILE 11 15.827 3.317 3.466 98 HG13 ILE 11 HG11 ILE 11 15.825 2.571 5.062 99 HG21 ILE 11 HG21 ILE 11 18.865 0.966 5.114 100 HG22 ILE 11 HG22 ILE 11 18.301 2.483 5.808 101 HG23 ILE 11 HG23 ILE 11 19.511 2.496 4.525 102 HD11 ILE 11 HD11 ILE 11 17.552 4.054 5.838 103 HD12 ILE 11 HD12 ILE 11 16.315 5.044 5.062 104 HD13 ILE 11 HD13 ILE 11 17.819 4.685 4.212 105 H LEU 12 HN LEU 12 17.659 0.401 1.137 106 HA LEU 12 HA LEU 12 20.003 -1.057 1.598 107 HB2 LEU 12 HB2 LEU 12 18.323 -1.138 -0.910 108 HB3 LEU 12 HB1 LEU 12 19.394 -2.405 -0.313 109 HG LEU 12 HG LEU 12 16.875 -1.396 1.049 110 HD11 LEU 12 HD11 LEU 12 16.247 -3.844 0.773 111 HD12 LEU 12 HD12 LEU 12 17.636 -3.995 -0.299 112 HD13 LEU 12 HD13 LEU 12 16.312 -2.914 -0.727 113 HD21 LEU 12 HD21 LEU 12 19.036 -3.309 1.928 114 HD22 LEU 12 HD22 LEU 12 17.410 -3.346 2.612 115 HD23 LEU 12 HD23 LEU 12 18.412 -1.905 2.791 116 H ARG 13 HN ARG 13 19.189 1.273 -0.902 117 HA ARG 13 HA ARG 13 21.470 0.990 -2.505 118 HB2 ARG 13 HB2 ARG 13 20.292 3.698 -2.046 119 HB3 ARG 13 HB1 ARG 13 20.774 2.933 -3.556 120 HG2 ARG 13 HG2 ARG 13 18.328 2.228 -1.892 121 HG3 ARG 13 HG1 ARG 13 18.320 3.081 -3.433 122 HD2 ARG 13 HD2 ARG 13 18.901 0.190 -2.868 123 HD3 ARG 13 HD1 ARG 13 17.835 0.895 -4.076 124 HE ARG 13 HE ARG 13 20.603 1.548 -4.511 125 HH11 ARG 13 HH11 ARG 13 21.520 0.670 -6.407 126 HH12 ARG 13 HH12 ARG 13 20.747 -0.670 -7.191 127 HH21 ARG 13 HH21 ARG 13 18.137 -0.850 -4.917 128 HH22 ARG 13 HH22 ARG 13 18.832 -1.528 -6.348 129 H LYS 14 HN LYS 14 20.906 2.649 0.528 130 HA LYS 14 HA LYS 14 23.408 4.080 0.534 131 HB2 LYS 14 HB2 LYS 14 22.108 3.382 3.123 132 HB3 LYS 14 HB1 LYS 14 22.790 4.911 2.588 133 HG2 LYS 14 HG2 LYS 14 20.292 3.928 1.243 134 HG3 LYS 14 HG1 LYS 14 20.162 4.605 2.859 135 HD2 LYS 14 HD2 LYS 14 19.901 6.517 1.584 136 HD3 LYS 14 HD1 LYS 14 21.644 6.539 1.833 137 HE2 LYS 14 HE2 LYS 14 21.744 5.139 -0.364 138 HE3 LYS 14 HE1 LYS 14 20.104 5.731 -0.633 139 HZ1 LYS 14 HZ1 LYS 14 20.830 7.922 -0.690 140 HZ2 LYS 14 HZ2 LYS 14 22.029 7.087 -1.551 141 HZ3 LYS 14 HZ3 LYS 14 22.311 7.562 0.050 142 H ILE 15 HN ILE 15 22.132 1.125 2.003 143 HA ILE 15 HA ILE 15 24.502 0.352 3.334 144 HB ILE 15 HB ILE 15 22.295 -1.423 2.244 145 HG12 ILE 15 HG12 ILE 15 21.675 0.532 3.835 146 HG13 ILE 15 HG11 ILE 15 21.135 -1.085 4.276 147 HG21 ILE 15 HG21 ILE 15 23.957 -2.915 2.880 148 HG22 ILE 15 HG22 ILE 15 23.114 -2.714 4.416 149 HG23 ILE 15 HG23 ILE 15 24.611 -1.832 4.107 150 HD11 ILE 15 HD11 ILE 15 23.745 0.065 5.286 151 HD12 ILE 15 HD12 ILE 15 22.861 -1.336 5.893 152 HD13 ILE 15 HD13 ILE 15 22.222 0.288 6.147 153 H ALA 16 HN ALA 16 23.216 -0.328 0.104 154 HA ALA 16 HA ALA 16 25.147 -2.180 -0.745 155 HB1 ALA 16 HB1 ALA 16 24.487 -1.597 -2.996 156 HB2 ALA 16 HB2 ALA 16 23.845 -0.048 -2.453 157 HB3 ALA 16 HB3 ALA 16 23.044 -1.546 -1.982 158 H ALA 17 HN ALA 17 25.162 1.342 -0.651 159 HA ALA 17 HA ALA 17 27.706 1.578 -1.991 160 HB1 ALA 17 HB1 ALA 17 26.216 3.621 -0.324 161 HB2 ALA 17 HB2 ALA 17 25.982 3.371 -2.055 162 HB3 ALA 17 HB3 ALA 17 27.533 3.944 -1.447 163 H PHE 18 HN PHE 18 26.545 1.840 1.363 164 HA PHE 18 HA PHE 18 29.098 2.399 2.494 165 HB2 PHE 18 HB2 PHE 18 27.253 3.010 3.837 166 HB3 PHE 18 HB1 PHE 18 26.478 1.441 3.630 167 HD1 PHE 18 HD1 PHE 18 26.441 0.222 5.615 168 HD2 PHE 18 HD2 PHE 18 29.920 2.544 4.651 169 HE1 PHE 18 HE1 PHE 18 27.562 -0.613 7.667 170 HE2 PHE 18 HE2 PHE 18 31.039 1.707 6.694 171 HZ PHE 18 HZ PHE 18 29.858 0.142 8.212 172 H LYS 19 HN LYS 19 27.186 -0.605 2.228 173 HA LYS 19 HA LYS 19 29.449 -2.137 3.273 174 HB2 LYS 19 HB2 LYS 19 26.630 -2.505 3.199 175 HB3 LYS 19 HB1 LYS 19 27.346 -3.811 2.257 176 HG2 LYS 19 HG2 LYS 19 27.237 -4.542 4.548 177 HG3 LYS 19 HG1 LYS 19 28.931 -4.221 4.181 178 HD2 LYS 19 HD2 LYS 19 28.928 -2.190 5.389 179 HD3 LYS 19 HD1 LYS 19 27.165 -2.098 5.404 180 HE2 LYS 19 HE2 LYS 19 28.820 -4.200 6.829 181 HE3 LYS 19 HE1 LYS 19 28.068 -2.805 7.603 182 HZ1 LYS 19 HZ2 LYS 19 25.919 -3.695 6.598 183 HZ2 LYS 19 HZ3 LYS 19 26.567 -4.529 7.924 184 HZ3 LYS 19 HZ1 LYS 19 26.767 -5.153 6.359 185 HN1 NH2 20 H1 LYS 19 28.547 -0.965 0.247 Start of MODEL 4 1 H2 PRO 1 HT1 PRO 1 2.816 -1.859 2.713 2 H3 PRO 1 HT2 PRO 1 2.805 -2.125 4.392 3 HA PRO 1 HA PRO 1 4.970 -2.477 4.355 4 HB2 PRO 1 HB2 PRO 1 5.076 -4.590 2.337 5 HB3 PRO 1 HB1 PRO 1 5.377 -4.691 4.083 6 HG2 PRO 1 HG2 PRO 1 3.183 -5.737 2.840 7 HG3 PRO 1 HG1 PRO 1 3.237 -5.266 4.545 8 HD2 PRO 1 HD2 PRO 1 1.941 -3.869 2.246 9 HD3 PRO 1 HD1 PRO 1 1.494 -3.866 3.963 10 H MET 2 HN MET 2 3.459 -2.142 1.209 11 HA MET 2 HA MET 2 5.649 -1.873 -0.462 12 HB2 MET 2 HB2 MET 2 2.890 -0.755 -0.444 13 HB3 MET 2 HB1 MET 2 4.055 -0.034 -1.552 14 HG2 MET 2 HG2 MET 2 3.548 -3.017 -1.367 15 HG3 MET 2 HG1 MET 2 2.750 -1.958 -2.533 16 HE1 MET 2 HE1 MET 2 4.272 -4.405 -3.534 17 HE2 MET 2 HE2 MET 2 5.302 -4.410 -2.106 18 HE3 MET 2 HE3 MET 2 6.030 -4.304 -3.705 19 H ALA 3 HN ALA 3 4.212 0.553 1.679 20 HA ALA 3 HA ALA 3 5.638 2.785 0.834 21 HB1 ALA 3 HB1 ALA 3 4.564 1.983 3.534 22 HB2 ALA 3 HB2 ALA 3 3.914 3.171 2.404 23 HB3 ALA 3 HB3 ALA 3 5.399 3.516 3.291 24 H ARG 4 HN ARG 4 6.524 0.354 3.277 25 HA ARG 4 HA ARG 4 9.080 1.545 3.781 26 HB2 ARG 4 HB2 ARG 4 7.733 -1.012 4.548 27 HB3 ARG 4 HB1 ARG 4 9.478 -0.866 4.751 28 HG2 ARG 4 HG2 ARG 4 9.276 0.987 6.221 29 HG3 ARG 4 HG1 ARG 4 7.584 1.253 5.781 30 HD2 ARG 4 HD2 ARG 4 7.850 0.140 8.005 31 HD3 ARG 4 HD1 ARG 4 6.927 -0.822 6.855 32 HE ARG 4 HE ARG 4 9.725 -1.482 6.779 33 HH11 ARG 4 HH11 ARG 4 10.333 -3.510 7.655 34 HH12 ARG 4 HH12 ARG 4 9.225 -4.368 8.677 35 HH21 ARG 4 HH21 ARG 4 6.786 -1.880 8.540 36 HH22 ARG 4 HH22 ARG 4 7.203 -3.426 9.193 37 H ASN 5 HN ASN 5 7.937 -1.247 1.905 38 HA ASN 5 HA ASN 5 10.360 -2.215 0.966 39 HB2 ASN 5 HB2 ASN 5 8.105 -3.205 0.480 40 HB3 ASN 5 HB1 ASN 5 7.860 -1.926 -0.709 41 HD21 ASN 5 HD21 ASN 5 10.085 -4.613 0.103 42 HD22 ASN 5 HD22 ASN 5 10.611 -4.858 -1.491 43 H LYS 6 HN LYS 6 8.419 0.494 -0.173 44 HA LYS 6 HA LYS 6 10.076 1.177 -2.385 45 HB2 LYS 6 HB2 LYS 6 7.676 1.924 -1.979 46 HB3 LYS 6 HB1 LYS 6 8.320 3.062 -0.799 47 HG2 LYS 6 HG2 LYS 6 9.591 3.057 -3.506 48 HG3 LYS 6 HG1 LYS 6 7.976 3.748 -3.368 49 HD2 LYS 6 HD2 LYS 6 9.218 4.840 -1.177 50 HD3 LYS 6 HD1 LYS 6 10.543 4.771 -2.340 51 HE2 LYS 6 HE2 LYS 6 7.977 6.314 -2.471 52 HE3 LYS 6 HE1 LYS 6 9.611 6.821 -2.889 53 HZ1 LYS 6 HZ1 LYS 6 9.381 5.067 -4.750 54 HZ2 LYS 6 HZ2 LYS 6 8.623 6.571 -4.941 55 HZ3 LYS 6 HZ3 LYS 6 7.714 5.215 -4.476 56 H ILE 7 HN ILE 7 9.878 2.350 0.967 57 HA ILE 7 HA ILE 7 11.943 4.284 0.687 58 HB ILE 7 HB ILE 7 10.747 2.921 3.102 59 HG12 ILE 7 HG12 ILE 7 9.376 4.523 1.640 60 HG13 ILE 7 HG11 ILE 7 9.500 4.950 3.343 61 HG21 ILE 7 HG21 ILE 7 11.891 5.192 4.082 62 HG22 ILE 7 HG22 ILE 7 13.066 4.769 2.840 63 HG23 ILE 7 HG23 ILE 7 12.687 3.618 4.123 64 HD11 ILE 7 HD11 ILE 7 11.735 6.075 1.871 65 HD12 ILE 7 HD12 ILE 7 10.530 6.899 2.858 66 HD13 ILE 7 HD13 ILE 7 10.205 6.585 1.153 67 H LEU 8 HN LEU 8 11.963 0.931 1.992 68 HA LEU 8 HA LEU 8 14.714 1.018 2.673 69 HB2 LEU 8 HB2 LEU 8 14.661 -1.410 2.802 70 HB3 LEU 8 HB1 LEU 8 13.215 -0.745 3.551 71 HG LEU 8 HG LEU 8 12.149 -1.089 1.184 72 HD11 LEU 8 HD11 LEU 8 13.410 -2.143 -0.365 73 HD12 LEU 8 HD12 LEU 8 13.656 -3.490 0.743 74 HD13 LEU 8 HD13 LEU 8 14.770 -2.129 0.758 75 HD21 LEU 8 HD21 LEU 8 12.833 -3.292 3.148 76 HD22 LEU 8 HD22 LEU 8 11.676 -3.519 1.837 77 HD23 LEU 8 HD23 LEU 8 11.364 -2.321 3.097 78 H GLY 9 HN GLY 9 13.001 0.298 -0.303 79 HA2 GLY 9 HA2 GLY 9 15.109 -0.773 -1.824 80 HA3 GLY 9 HA1 GLY 9 13.763 0.164 -2.482 81 H LYS 10 HN LYS 10 14.092 2.580 -1.258 82 HA LYS 10 HA LYS 10 16.193 3.756 -2.800 83 HB2 LYS 10 HB2 LYS 10 13.869 4.718 -1.753 84 HB3 LYS 10 HB1 LYS 10 15.029 5.344 -0.584 85 HG2 LYS 10 HG2 LYS 10 15.297 5.680 -3.584 86 HG3 LYS 10 HG1 LYS 10 14.619 6.904 -2.510 87 HD2 LYS 10 HD2 LYS 10 16.777 6.840 -1.204 88 HD3 LYS 10 HD1 LYS 10 17.436 5.783 -2.453 89 HE2 LYS 10 HE2 LYS 10 16.442 8.619 -2.813 90 HE3 LYS 10 HE1 LYS 10 18.103 8.044 -2.972 91 HZ1 LYS 10 HZ1 LYS 10 17.329 8.153 -5.137 92 HZ2 LYS 10 HZ2 LYS 10 15.792 7.537 -4.744 93 HZ3 LYS 10 HZ3 LYS 10 17.145 6.513 -4.759 94 H ILE 11 HN ILE 11 15.769 2.867 0.577 95 HA ILE 11 HA ILE 11 18.184 4.118 1.501 96 HB ILE 11 HB ILE 11 16.349 2.065 2.735 97 HG12 ILE 11 HG12 ILE 11 15.700 4.552 2.356 98 HG13 ILE 11 HG11 ILE 11 15.476 3.883 3.974 99 HG21 ILE 11 HG21 ILE 11 18.468 1.628 3.754 100 HG22 ILE 11 HG22 ILE 11 17.629 2.712 4.864 101 HG23 ILE 11 HG23 ILE 11 18.881 3.344 3.796 102 HD11 ILE 11 HD11 ILE 11 17.566 4.873 4.733 103 HD12 ILE 11 HD12 ILE 11 16.602 6.134 3.970 104 HD13 ILE 11 HD13 ILE 11 17.950 5.413 3.095 105 H LEU 12 HN LEU 12 17.442 1.002 0.095 106 HA LEU 12 HA LEU 12 19.504 -0.549 1.116 107 HB2 LEU 12 HB2 LEU 12 17.952 -0.586 -1.422 108 HB3 LEU 12 HB1 LEU 12 19.413 -1.567 -1.355 109 HG LEU 12 HG LEU 12 17.278 -1.671 0.787 110 HD11 LEU 12 HD11 LEU 12 16.870 -3.979 -0.422 111 HD12 LEU 12 HD12 LEU 12 17.532 -3.135 -1.822 112 HD13 LEU 12 HD13 LEU 12 16.080 -2.525 -1.027 113 HD21 LEU 12 HD21 LEU 12 18.526 -3.340 1.736 114 HD22 LEU 12 HD22 LEU 12 19.850 -2.544 0.887 115 HD23 LEU 12 HD23 LEU 12 19.072 -3.961 0.182 116 H ARG 13 HN ARG 13 19.703 1.812 -1.534 117 HA ARG 13 HA ARG 13 22.287 1.116 -2.419 118 HB2 ARG 13 HB2 ARG 13 22.243 3.893 -2.605 119 HB3 ARG 13 HB1 ARG 13 21.724 2.768 -3.858 120 HG2 ARG 13 HG2 ARG 13 19.888 3.643 -1.642 121 HG3 ARG 13 HG1 ARG 13 20.053 4.593 -3.113 122 HD2 ARG 13 HD2 ARG 13 18.471 2.233 -2.669 123 HD3 ARG 13 HD1 ARG 13 18.515 3.268 -4.086 124 HE ARG 13 HE ARG 13 20.746 1.678 -4.353 125 HH11 ARG 13 HH11 ARG 13 20.699 -0.244 -5.553 126 HH12 ARG 13 HH12 ARG 13 19.223 -1.139 -5.704 127 HH21 ARG 13 HH21 ARG 13 17.386 1.066 -3.728 128 HH22 ARG 13 HH22 ARG 13 17.341 -0.387 -4.674 129 H LYS 14 HN LYS 14 21.148 2.950 0.329 130 HA LYS 14 HA LYS 14 23.631 4.060 1.143 131 HB2 LYS 14 HB2 LYS 14 21.464 3.198 3.059 132 HB3 LYS 14 HB1 LYS 14 22.572 4.561 3.198 133 HG2 LYS 14 HG2 LYS 14 20.551 4.397 0.952 134 HG3 LYS 14 HG1 LYS 14 20.138 5.091 2.517 135 HD2 LYS 14 HD2 LYS 14 20.925 7.024 1.623 136 HD3 LYS 14 HD1 LYS 14 22.514 6.356 1.994 137 HE2 LYS 14 HE2 LYS 14 22.674 5.416 -0.272 138 HE3 LYS 14 HE1 LYS 14 21.051 5.997 -0.641 139 HZ1 LYS 14 HZ1 LYS 14 22.544 7.573 -1.508 140 HZ2 LYS 14 HZ2 LYS 14 23.463 7.624 -0.076 141 HZ3 LYS 14 HZ3 LYS 14 21.891 8.271 -0.110 142 H ILE 15 HN ILE 15 21.955 1.028 1.828 143 HA ILE 15 HA ILE 15 23.869 0.001 3.657 144 HB ILE 15 HB ILE 15 22.063 -1.582 1.799 145 HG12 ILE 15 HG12 ILE 15 20.793 0.131 3.087 146 HG13 ILE 15 HG11 ILE 15 20.405 -1.505 3.615 147 HG21 ILE 15 HG21 ILE 15 23.208 -2.238 4.537 148 HG22 ILE 15 HG22 ILE 15 23.844 -2.856 3.013 149 HG23 ILE 15 HG23 ILE 15 22.220 -3.300 3.536 150 HD11 ILE 15 HD11 ILE 15 20.737 -0.285 5.631 151 HD12 ILE 15 HD12 ILE 15 22.167 0.528 4.999 152 HD13 ILE 15 HD13 ILE 15 22.233 -1.188 5.403 153 H ALA 16 HN ALA 16 23.431 -0.255 0.145 154 HA ALA 16 HA ALA 16 25.568 -2.008 -0.386 155 HB1 ALA 16 HB1 ALA 16 24.009 -1.510 -2.156 156 HB2 ALA 16 HB2 ALA 16 25.584 -0.895 -2.663 157 HB3 ALA 16 HB3 ALA 16 24.359 0.216 -2.052 158 H ALA 17 HN ALA 17 25.402 1.527 -0.230 159 HA ALA 17 HA ALA 17 28.122 2.054 -0.764 160 HB1 ALA 17 HB1 ALA 17 27.549 4.138 0.776 161 HB2 ALA 17 HB2 ALA 17 25.902 3.538 0.594 162 HB3 ALA 17 HB3 ALA 17 26.837 3.989 -0.832 163 H PHE 18 HN PHE 18 26.355 1.386 2.219 164 HA PHE 18 HA PHE 18 28.545 1.756 3.998 165 HB2 PHE 18 HB2 PHE 18 26.723 1.709 5.325 166 HB3 PHE 18 HB1 PHE 18 25.783 0.812 4.141 167 HD1 PHE 18 HD1 PHE 18 25.312 -1.457 4.465 168 HD2 PHE 18 HD2 PHE 18 28.472 0.367 6.727 169 HE1 PHE 18 HE1 PHE 18 25.537 -3.520 5.808 170 HE2 PHE 18 HE2 PHE 18 28.699 -1.708 8.081 171 HZ PHE 18 HZ PHE 18 27.229 -3.652 7.613 172 H LYS 19 HN LYS 19 27.213 -1.066 2.310 173 HA LYS 19 HA LYS 19 28.961 -2.978 3.490 174 HB2 LYS 19 HB2 LYS 19 27.338 -2.949 0.940 175 HB3 LYS 19 HB1 LYS 19 28.364 -4.315 1.378 176 HG2 LYS 19 HG2 LYS 19 27.138 -4.396 3.596 177 HG3 LYS 19 HG1 LYS 19 26.019 -3.203 2.941 178 HD2 LYS 19 HD2 LYS 19 24.862 -4.852 1.928 179 HD3 LYS 19 HD1 LYS 19 26.295 -5.257 0.981 180 HE2 LYS 19 HE2 LYS 19 25.608 -6.328 3.740 181 HE3 LYS 19 HE1 LYS 19 25.534 -7.227 2.225 182 HZ1 LYS 19 HZ2 LYS 19 27.789 -7.333 2.063 183 HZ2 LYS 19 HZ3 LYS 19 27.620 -7.371 3.748 184 HZ3 LYS 19 HZ1 LYS 19 28.056 -5.928 2.976 185 HN1 NH2 20 H1 LYS 19 29.122 -1.237 0.341 Start of MODEL 5 1 H2 PRO 1 HT1 PRO 1 2.823 0.821 3.823 2 H3 PRO 1 HT2 PRO 1 2.466 0.412 5.432 3 HA PRO 1 HA PRO 1 3.504 -1.503 5.080 4 HB2 PRO 1 HB2 PRO 1 1.795 -2.621 3.030 5 HB3 PRO 1 HB1 PRO 1 1.823 -2.985 4.764 6 HG2 PRO 1 HG2 PRO 1 -0.214 -1.657 3.475 7 HG3 PRO 1 HG1 PRO 1 0.120 -1.579 5.209 8 HD2 PRO 1 HD2 PRO 1 0.733 0.434 3.086 9 HD3 PRO 1 HD1 PRO 1 0.334 0.686 4.799 10 H MET 2 HN MET 2 2.287 -0.554 1.854 11 HA MET 2 HA MET 2 4.386 -1.763 0.418 12 HB2 MET 2 HB2 MET 2 3.602 -0.256 -1.457 13 HB3 MET 2 HB1 MET 2 2.364 -1.284 -0.742 14 HG2 MET 2 HG2 MET 2 2.758 1.452 0.409 15 HG3 MET 2 HG1 MET 2 1.926 1.311 -1.137 16 HE1 MET 2 HE1 MET 2 0.285 -0.002 -1.711 17 HE2 MET 2 HE2 MET 2 -1.227 0.044 -0.797 18 HE3 MET 2 HE3 MET 2 -0.236 -1.412 -0.779 19 H ALA 3 HN ALA 3 4.070 1.420 1.858 20 HA ALA 3 HA ALA 3 6.049 2.813 0.499 21 HB1 ALA 3 HB1 ALA 3 4.721 4.032 2.039 22 HB2 ALA 3 HB2 ALA 3 6.351 4.054 2.711 23 HB3 ALA 3 HB3 ALA 3 5.138 2.954 3.373 24 H ARG 4 HN ARG 4 6.369 0.380 3.024 25 HA ARG 4 HA ARG 4 8.989 0.823 3.820 26 HB2 ARG 4 HB2 ARG 4 7.800 -1.908 3.297 27 HB3 ARG 4 HB1 ARG 4 9.114 -1.502 4.402 28 HG2 ARG 4 HG2 ARG 4 7.632 -0.251 5.825 29 HG3 ARG 4 HG1 ARG 4 6.313 -0.378 4.669 30 HD2 ARG 4 HD2 ARG 4 7.638 -2.744 5.995 31 HD3 ARG 4 HD1 ARG 4 6.126 -2.021 6.544 32 HE ARG 4 HE ARG 4 5.638 -2.459 3.951 33 HH11 ARG 4 HH11 ARG 4 4.837 -4.427 3.092 34 HH12 ARG 4 HH12 ARG 4 5.215 -5.920 3.885 35 HH21 ARG 4 HH21 ARG 4 7.031 -4.445 6.426 36 HH22 ARG 4 HH22 ARG 4 6.449 -5.930 5.749 37 H ASN 5 HN ASN 5 7.798 -1.072 1.040 38 HA ASN 5 HA ASN 5 10.236 -1.973 0.064 39 HB2 ASN 5 HB2 ASN 5 7.722 -2.256 -0.814 40 HB3 ASN 5 HB1 ASN 5 8.253 -1.012 -1.946 41 HD21 ASN 5 HD21 ASN 5 7.858 -3.088 -3.412 42 HD22 ASN 5 HD22 ASN 5 9.227 -4.058 -3.674 43 H LYS 6 HN LYS 6 8.645 1.127 -0.335 44 HA LYS 6 HA LYS 6 10.529 2.245 -2.157 45 HB2 LYS 6 HB2 LYS 6 8.095 3.042 -0.978 46 HB3 LYS 6 HB1 LYS 6 9.281 4.238 -0.463 47 HG2 LYS 6 HG2 LYS 6 9.063 3.337 -3.343 48 HG3 LYS 6 HG1 LYS 6 8.097 4.671 -2.710 49 HD2 LYS 6 HD2 LYS 6 11.081 4.625 -2.292 50 HD3 LYS 6 HD1 LYS 6 10.404 5.207 -3.812 51 HE2 LYS 6 HE2 LYS 6 8.879 6.691 -2.341 52 HE3 LYS 6 HE1 LYS 6 10.003 6.319 -1.032 53 HZ1 LYS 6 HZ1 LYS 6 11.138 8.051 -1.828 54 HZ2 LYS 6 HZ2 LYS 6 10.341 8.033 -3.323 55 HZ3 LYS 6 HZ3 LYS 6 11.657 6.996 -3.049 56 H ILE 7 HN ILE 7 10.114 2.466 1.367 57 HA ILE 7 HA ILE 7 12.357 4.155 1.793 58 HB ILE 7 HB ILE 7 11.094 2.215 3.745 59 HG12 ILE 7 HG12 ILE 7 9.511 3.842 2.540 60 HG13 ILE 7 HG11 ILE 7 9.526 3.914 4.301 61 HG21 ILE 7 HG21 ILE 7 13.081 3.040 4.712 62 HG22 ILE 7 HG22 ILE 7 11.834 4.123 5.326 63 HG23 ILE 7 HG23 ILE 7 12.870 4.638 3.996 64 HD11 ILE 7 HD11 ILE 7 11.026 5.766 2.430 65 HD12 ILE 7 HD12 ILE 7 11.133 5.804 4.189 66 HD13 ILE 7 HD13 ILE 7 9.609 6.174 3.391 67 H LEU 8 HN LEU 8 11.976 0.601 2.075 68 HA LEU 8 HA LEU 8 14.680 0.203 2.875 69 HB2 LEU 8 HB2 LEU 8 14.322 -2.152 2.468 70 HB3 LEU 8 HB1 LEU 8 12.903 -1.484 3.263 71 HG LEU 8 HG LEU 8 12.073 -1.163 0.753 72 HD11 LEU 8 HD11 LEU 8 14.467 -2.808 0.530 73 HD12 LEU 8 HD12 LEU 8 13.504 -2.066 -0.747 74 HD13 LEU 8 HD13 LEU 8 13.050 -3.644 -0.104 75 HD21 LEU 8 HD21 LEU 8 10.826 -2.480 2.322 76 HD22 LEU 8 HD22 LEU 8 12.091 -3.703 2.406 77 HD23 LEU 8 HD23 LEU 8 11.120 -3.541 0.944 78 H GLY 9 HN GLY 9 13.051 0.306 -0.248 79 HA2 GLY 9 HA2 GLY 9 15.199 -0.605 -1.843 80 HA3 GLY 9 HA1 GLY 9 13.902 0.456 -2.388 81 H LYS 10 HN LYS 10 14.202 2.650 -0.827 82 HA LYS 10 HA LYS 10 16.264 4.073 -2.099 83 HB2 LYS 10 HB2 LYS 10 14.425 5.342 -1.293 84 HB3 LYS 10 HB1 LYS 10 14.546 4.650 0.322 85 HG2 LYS 10 HG2 LYS 10 15.424 6.921 0.361 86 HG3 LYS 10 HG1 LYS 10 16.755 5.790 0.605 87 HD2 LYS 10 HD2 LYS 10 17.527 6.054 -1.643 88 HD3 LYS 10 HD1 LYS 10 16.034 6.855 -2.136 89 HE2 LYS 10 HE2 LYS 10 18.390 8.113 -1.309 90 HE3 LYS 10 HE1 LYS 10 16.817 8.874 -1.498 91 HZ1 LYS 10 HZ1 LYS 10 18.012 9.057 0.746 92 HZ2 LYS 10 HZ2 LYS 10 17.497 7.463 1.001 93 HZ3 LYS 10 HZ3 LYS 10 16.357 8.696 0.749 94 H ILE 11 HN ILE 11 16.077 2.573 1.104 95 HA ILE 11 HA ILE 11 18.688 3.498 1.881 96 HB ILE 11 HB ILE 11 16.886 1.392 3.095 97 HG12 ILE 11 HG12 ILE 11 16.376 4.055 2.906 98 HG13 ILE 11 HG11 ILE 11 15.845 3.063 4.257 99 HG21 ILE 11 HG21 ILE 11 19.433 2.709 4.065 100 HG22 ILE 11 HG22 ILE 11 19.100 0.985 3.894 101 HG23 ILE 11 HG23 ILE 11 18.295 1.917 5.156 102 HD11 ILE 11 HD11 ILE 11 18.531 4.452 4.263 103 HD12 ILE 11 HD12 ILE 11 17.649 3.781 5.634 104 HD13 ILE 11 HD13 ILE 11 17.067 5.245 4.842 105 H LEU 12 HN LEU 12 17.403 0.629 0.325 106 HA LEU 12 HA LEU 12 19.442 -1.172 0.899 107 HB2 LEU 12 HB2 LEU 12 17.415 -0.921 -1.237 108 HB3 LEU 12 HB1 LEU 12 18.818 -1.912 -1.636 109 HG LEU 12 HG LEU 12 17.185 -2.245 0.898 110 HD11 LEU 12 HD11 LEU 12 15.913 -2.712 -1.227 111 HD12 LEU 12 HD12 LEU 12 16.093 -4.105 -0.162 112 HD13 LEU 12 HD13 LEU 12 17.109 -3.959 -1.595 113 HD21 LEU 12 HD21 LEU 12 19.479 -3.726 -0.388 114 HD22 LEU 12 HD22 LEU 12 18.362 -4.571 0.679 115 HD23 LEU 12 HD23 LEU 12 19.302 -3.213 1.290 116 H ARG 13 HN ARG 13 19.276 1.118 -1.812 117 HA ARG 13 HA ARG 13 21.703 0.368 -3.019 118 HB2 ARG 13 HB2 ARG 13 21.229 3.229 -3.220 119 HB3 ARG 13 HB1 ARG 13 21.176 2.004 -4.483 120 HG2 ARG 13 HG2 ARG 13 18.923 2.500 -2.504 121 HG3 ARG 13 HG1 ARG 13 18.984 3.191 -4.120 122 HD2 ARG 13 HD2 ARG 13 18.315 0.443 -3.285 123 HD3 ARG 13 HD1 ARG 13 17.833 1.329 -4.723 124 HE ARG 13 HE ARG 13 20.596 0.311 -4.600 125 HH11 ARG 13 HH11 ARG 13 21.140 -1.014 -6.366 126 HH12 ARG 13 HH12 ARG 13 19.904 -1.559 -7.454 127 HH21 ARG 13 HH21 ARG 13 17.338 0.042 -5.779 128 HH22 ARG 13 HH22 ARG 13 17.768 -0.947 -7.130 129 H LYS 14 HN LYS 14 20.984 2.270 -0.211 130 HA LYS 14 HA LYS 14 23.544 3.545 0.013 131 HB2 LYS 14 HB2 LYS 14 21.690 3.050 2.333 132 HB3 LYS 14 HB1 LYS 14 22.775 4.414 2.055 133 HG2 LYS 14 HG2 LYS 14 20.315 3.782 0.389 134 HG3 LYS 14 HG1 LYS 14 20.387 5.010 1.648 135 HD2 LYS 14 HD2 LYS 14 21.760 6.414 0.399 136 HD3 LYS 14 HD1 LYS 14 22.423 5.090 -0.555 137 HE2 LYS 14 HE2 LYS 14 20.163 4.823 -1.632 138 HE3 LYS 14 HE1 LYS 14 19.648 6.284 -0.794 139 HZ1 LYS 14 HZ1 LYS 14 21.213 7.567 -1.950 140 HZ2 LYS 14 HZ2 LYS 14 20.508 6.573 -3.132 141 HZ3 LYS 14 HZ3 LYS 14 22.046 6.208 -2.519 142 H ILE 15 HN ILE 15 22.092 0.581 1.244 143 HA ILE 15 HA ILE 15 23.988 -0.126 3.158 144 HB ILE 15 HB ILE 15 22.555 -1.978 1.229 145 HG12 ILE 15 HG12 ILE 15 21.005 -0.477 2.473 146 HG13 ILE 15 HG11 ILE 15 20.850 -2.147 3.009 147 HG21 ILE 15 HG21 ILE 15 22.929 -3.698 2.895 148 HG22 ILE 15 HG22 ILE 15 23.620 -2.529 4.020 149 HG23 ILE 15 HG23 ILE 15 24.488 -2.954 2.546 150 HD11 ILE 15 HD11 ILE 15 22.043 0.196 4.445 151 HD12 ILE 15 HD12 ILE 15 22.716 -1.403 4.752 152 HD13 ILE 15 HD13 ILE 15 21.014 -1.092 5.068 153 H ALA 16 HN ALA 16 24.008 -0.629 -0.359 154 HA ALA 16 HA ALA 16 26.385 -2.111 -0.549 155 HB1 ALA 16 HB1 ALA 16 24.951 -1.879 -2.479 156 HB2 ALA 16 HB2 ALA 16 26.513 -1.165 -2.879 157 HB3 ALA 16 HB3 ALA 16 25.146 -0.126 -2.473 158 H ALA 17 HN ALA 17 25.809 1.372 -0.457 159 HA ALA 17 HA ALA 17 28.604 2.037 -0.731 160 HB1 ALA 17 HB1 ALA 17 27.742 4.050 -1.225 161 HB2 ALA 17 HB2 ALA 17 27.080 4.185 0.403 162 HB3 ALA 17 HB3 ALA 17 26.128 3.433 -0.873 163 H PHE 18 HN PHE 18 26.243 1.805 1.870 164 HA PHE 18 HA PHE 18 27.888 2.830 3.934 165 HB2 PHE 18 HB2 PHE 18 25.728 2.808 4.659 166 HB3 PHE 18 HB1 PHE 18 25.316 1.387 3.711 167 HD1 PHE 18 HD1 PHE 18 25.324 -0.788 4.672 168 HD2 PHE 18 HD2 PHE 18 27.011 2.518 6.829 169 HE1 PHE 18 HE1 PHE 18 25.516 -2.204 6.701 170 HE2 PHE 18 HE2 PHE 18 27.205 1.104 8.852 171 HZ PHE 18 HZ PHE 18 26.464 -1.255 8.790 172 H LYS 19 HN LYS 19 27.269 -0.485 2.805 173 HA LYS 19 HA LYS 19 29.769 -1.321 4.136 174 HB2 LYS 19 HB2 LYS 19 27.040 -2.508 4.416 175 HB3 LYS 19 HB1 LYS 19 28.421 -3.601 4.377 176 HG2 LYS 19 HG2 LYS 19 28.358 -1.193 6.202 177 HG3 LYS 19 HG1 LYS 19 27.683 -2.746 6.687 178 HD2 LYS 19 HD2 LYS 19 29.867 -3.826 6.296 179 HD3 LYS 19 HD1 LYS 19 30.544 -2.274 5.794 180 HE2 LYS 19 HE2 LYS 19 29.236 -2.658 8.483 181 HE3 LYS 19 HE1 LYS 19 30.955 -2.946 8.232 182 HZ1 LYS 19 HZ2 LYS 19 31.374 -0.759 8.017 183 HZ2 LYS 19 HZ3 LYS 19 29.930 -0.577 8.884 184 HZ3 LYS 19 HZ1 LYS 19 29.927 -0.432 7.198 185 HN1 NH2 20 H1 LYS 19 30.192 -0.770 1.635 Start of MODEL 6 1 H2 PRO 1 HT1 PRO 1 0.787 -0.365 0.674 2 H3 PRO 1 HT2 PRO 1 -0.248 0.832 1.285 3 HA PRO 1 HA PRO 1 1.523 2.074 1.643 4 HB2 PRO 1 HB2 PRO 1 2.919 0.396 3.556 5 HB3 PRO 1 HB1 PRO 1 1.941 1.844 3.857 6 HG2 PRO 1 HG2 PRO 1 1.210 -0.709 4.569 7 HG3 PRO 1 HG1 PRO 1 0.090 0.643 4.345 8 HD2 PRO 1 HD2 PRO 1 0.664 -1.654 2.515 9 HD3 PRO 1 HD1 PRO 1 -0.847 -0.753 2.757 10 H MET 2 HN MET 2 1.897 0.653 -0.642 11 HA MET 2 HA MET 2 4.090 -1.028 -0.873 12 HB2 MET 2 HB2 MET 2 2.414 0.410 -2.647 13 HB3 MET 2 HB1 MET 2 4.076 0.783 -3.101 14 HG2 MET 2 HG2 MET 2 4.573 -1.673 -3.078 15 HG3 MET 2 HG1 MET 2 2.857 -1.977 -2.798 16 HE1 MET 2 HE1 MET 2 3.635 -3.495 -5.283 17 HE2 MET 2 HE2 MET 2 5.144 -2.609 -5.059 18 HE3 MET 2 HE3 MET 2 4.326 -2.561 -6.617 19 H ALA 3 HN ALA 3 4.003 2.400 -0.278 20 HA ALA 3 HA ALA 3 6.554 3.157 -1.129 21 HB1 ALA 3 HB1 ALA 3 6.413 4.797 0.846 22 HB2 ALA 3 HB2 ALA 3 4.834 4.079 1.169 23 HB3 ALA 3 HB3 ALA 3 5.133 4.890 -0.367 24 H ARG 4 HN ARG 4 5.502 1.343 1.683 25 HA ARG 4 HA ARG 4 7.759 1.460 3.299 26 HB2 ARG 4 HB2 ARG 4 5.921 0.299 4.193 27 HB3 ARG 4 HB1 ARG 4 5.727 -0.691 2.752 28 HG2 ARG 4 HG2 ARG 4 8.281 -1.361 3.594 29 HG3 ARG 4 HG1 ARG 4 7.423 -1.128 5.114 30 HD2 ARG 4 HD2 ARG 4 7.332 -3.484 4.009 31 HD3 ARG 4 HD1 ARG 4 5.841 -2.785 4.628 32 HE ARG 4 HE ARG 4 6.461 -2.354 1.785 33 HH11 ARG 4 HH11 ARG 4 4.831 -3.015 0.379 34 HH12 ARG 4 HH12 ARG 4 3.494 -3.959 0.966 35 HH21 ARG 4 HH21 ARG 4 4.674 -4.062 4.240 36 HH22 ARG 4 HH22 ARG 4 3.414 -4.558 3.160 37 H ASN 5 HN ASN 5 7.075 -0.619 0.511 38 HA ASN 5 HA ASN 5 9.424 -2.163 0.523 39 HB2 ASN 5 HB2 ASN 5 7.847 -1.207 -1.884 40 HB3 ASN 5 HB1 ASN 5 8.947 -2.579 -1.843 41 HD21 ASN 5 HD21 ASN 5 7.811 -4.518 -1.699 42 HD22 ASN 5 HD22 ASN 5 6.369 -4.738 -0.829 43 H LYS 6 HN LYS 6 8.668 0.960 -0.943 44 HA LYS 6 HA LYS 6 11.221 1.317 -2.151 45 HB2 LYS 6 HB2 LYS 6 8.761 2.799 -1.946 46 HB3 LYS 6 HB1 LYS 6 10.117 3.856 -1.560 47 HG2 LYS 6 HG2 LYS 6 9.860 2.135 -4.048 48 HG3 LYS 6 HG1 LYS 6 9.677 3.888 -3.977 49 HD2 LYS 6 HD2 LYS 6 12.096 3.767 -2.879 50 HD3 LYS 6 HD1 LYS 6 12.166 2.227 -3.737 51 HE2 LYS 6 HE2 LYS 6 13.071 3.972 -5.169 52 HE3 LYS 6 HE1 LYS 6 11.540 3.415 -5.841 53 HZ1 LYS 6 HZ1 LYS 6 11.069 5.502 -4.007 54 HZ2 LYS 6 HZ2 LYS 6 10.732 5.453 -5.670 55 HZ3 LYS 6 HZ3 LYS 6 12.244 6.000 -5.120 56 H ILE 7 HN ILE 7 9.800 2.272 0.968 57 HA ILE 7 HA ILE 7 11.897 3.916 1.851 58 HB ILE 7 HB ILE 7 9.981 2.168 3.411 59 HG12 ILE 7 HG12 ILE 7 9.127 4.092 1.949 60 HG13 ILE 7 HG11 ILE 7 8.673 4.148 3.651 61 HG21 ILE 7 HG21 ILE 7 11.974 4.254 4.336 62 HG22 ILE 7 HG22 ILE 7 11.825 2.586 4.887 63 HG23 ILE 7 HG23 ILE 7 10.587 3.767 5.310 64 HD11 ILE 7 HD11 ILE 7 10.870 5.732 2.285 65 HD12 ILE 7 HD12 ILE 7 10.684 5.646 4.035 66 HD13 ILE 7 HD13 ILE 7 9.411 6.361 3.052 67 H LEU 8 HN LEU 8 11.409 0.400 2.352 68 HA LEU 8 HA LEU 8 13.887 0.120 3.749 69 HB2 LEU 8 HB2 LEU 8 13.571 -2.327 3.430 70 HB3 LEU 8 HB1 LEU 8 12.161 -1.540 4.129 71 HG LEU 8 HG LEU 8 11.431 -1.363 1.569 72 HD11 LEU 8 HD11 LEU 8 12.612 -2.638 0.123 73 HD12 LEU 8 HD12 LEU 8 12.500 -4.034 1.193 74 HD13 LEU 8 HD13 LEU 8 13.807 -2.871 1.398 75 HD21 LEU 8 HD21 LEU 8 10.194 -3.474 1.882 76 HD22 LEU 8 HD22 LEU 8 10.209 -2.544 3.378 77 HD23 LEU 8 HD23 LEU 8 11.286 -3.925 3.189 78 H GLY 9 HN GLY 9 12.864 -0.285 0.402 79 HA2 GLY 9 HA2 GLY 9 15.167 -1.437 -0.677 80 HA3 GLY 9 HA1 GLY 9 14.078 -0.364 -1.553 81 H LYS 10 HN LYS 10 14.408 1.947 0.020 82 HA LYS 10 HA LYS 10 16.739 3.063 -1.174 83 HB2 LYS 10 HB2 LYS 10 14.436 4.102 -0.117 84 HB3 LYS 10 HB1 LYS 10 15.602 4.499 1.145 85 HG2 LYS 10 HG2 LYS 10 16.733 5.021 -1.473 86 HG3 LYS 10 HG1 LYS 10 15.200 5.865 -1.290 87 HD2 LYS 10 HD2 LYS 10 16.978 6.015 1.073 88 HD3 LYS 10 HD1 LYS 10 17.596 6.814 -0.371 89 HE2 LYS 10 HE2 LYS 10 16.096 8.219 1.209 90 HE3 LYS 10 HE1 LYS 10 15.741 8.269 -0.517 91 HZ1 LYS 10 HZ1 LYS 10 13.850 7.067 -0.268 92 HZ2 LYS 10 HZ2 LYS 10 13.881 7.786 1.268 93 HZ3 LYS 10 HZ3 LYS 10 14.426 6.193 1.066 94 H ILE 11 HN ILE 11 15.964 1.925 2.064 95 HA ILE 11 HA ILE 11 18.251 2.831 3.407 96 HB ILE 11 HB ILE 11 16.481 0.422 3.873 97 HG12 ILE 11 HG12 ILE 11 15.508 2.727 4.103 98 HG13 ILE 11 HG11 ILE 11 15.505 1.811 5.605 99 HG21 ILE 11 HG21 ILE 11 18.271 -0.295 5.123 100 HG22 ILE 11 HG22 ILE 11 17.599 0.847 6.286 101 HG23 ILE 11 HG23 ILE 11 18.956 1.323 5.267 102 HD11 ILE 11 HD11 ILE 11 17.333 4.080 4.806 103 HD12 ILE 11 HD12 ILE 11 17.776 2.957 6.094 104 HD13 ILE 11 HD13 ILE 11 16.319 3.939 6.242 105 H LEU 12 HN LEU 12 17.709 -0.088 1.479 106 HA LEU 12 HA LEU 12 20.068 -1.443 2.126 107 HB2 LEU 12 HB2 LEU 12 18.664 -1.417 -0.549 108 HB3 LEU 12 HB1 LEU 12 19.783 -2.649 0.028 109 HG LEU 12 HG LEU 12 17.147 -1.958 1.369 110 HD11 LEU 12 HD11 LEU 12 16.364 -4.099 0.492 111 HD12 LEU 12 HD12 LEU 12 17.930 -4.391 -0.265 112 HD13 LEU 12 HD13 LEU 12 16.896 -3.084 -0.845 113 HD21 LEU 12 HD21 LEU 12 18.609 -2.813 3.038 114 HD22 LEU 12 HD22 LEU 12 19.334 -3.968 1.917 115 HD23 LEU 12 HD23 LEU 12 17.689 -4.220 2.495 116 H ARG 13 HN ARG 13 19.449 1.036 -0.271 117 HA ARG 13 HA ARG 13 21.891 0.957 -1.630 118 HB2 ARG 13 HB2 ARG 13 20.490 3.558 -1.095 119 HB3 ARG 13 HB1 ARG 13 21.258 2.995 -2.577 120 HG2 ARG 13 HG2 ARG 13 18.674 1.954 -1.378 121 HG3 ARG 13 HG1 ARG 13 18.828 2.909 -2.853 122 HD2 ARG 13 HD2 ARG 13 19.352 0.027 -2.395 123 HD3 ARG 13 HD1 ARG 13 18.774 0.842 -3.839 124 HE ARG 13 HE ARG 13 21.462 1.557 -3.495 125 HH11 ARG 13 HH11 ARG 13 23.085 0.451 -4.631 126 HH12 ARG 13 HH12 ARG 13 22.779 -1.133 -5.264 127 HH21 ARG 13 HH21 ARG 13 19.513 -1.253 -4.058 128 HH22 ARG 13 HH22 ARG 13 20.739 -2.097 -4.947 129 H LYS 14 HN LYS 14 20.989 2.464 1.428 130 HA LYS 14 HA LYS 14 23.272 4.087 1.776 131 HB2 LYS 14 HB2 LYS 14 21.910 2.606 4.035 132 HB3 LYS 14 HB1 LYS 14 22.706 4.178 4.085 133 HG2 LYS 14 HG2 LYS 14 20.174 3.569 2.525 134 HG3 LYS 14 HG1 LYS 14 20.220 4.372 4.092 135 HD2 LYS 14 HD2 LYS 14 20.500 6.339 3.027 136 HD3 LYS 14 HD1 LYS 14 22.068 5.768 2.464 137 HE2 LYS 14 HE2 LYS 14 21.003 4.745 0.489 138 HE3 LYS 14 HE1 LYS 14 19.427 5.288 1.056 139 HZ1 LYS 14 HZ1 LYS 14 20.347 7.587 1.001 140 HZ2 LYS 14 HZ2 LYS 14 20.183 6.858 -0.520 141 HZ3 LYS 14 HZ3 LYS 14 21.710 6.970 0.213 142 H ILE 15 HN ILE 15 22.592 0.728 2.588 143 HA ILE 15 HA ILE 15 25.199 0.205 3.679 144 HB ILE 15 HB ILE 15 23.224 -1.826 2.609 145 HG12 ILE 15 HG12 ILE 15 22.073 -0.257 4.155 146 HG13 ILE 15 HG11 ILE 15 22.244 -1.862 4.861 147 HG21 ILE 15 HG21 ILE 15 25.721 -1.911 4.142 148 HG22 ILE 15 HG22 ILE 15 24.887 -3.197 3.274 149 HG23 ILE 15 HG23 ILE 15 24.402 -2.787 4.918 150 HD11 ILE 15 HD11 ILE 15 24.596 -0.557 5.598 151 HD12 ILE 15 HD12 ILE 15 23.204 -0.861 6.635 152 HD13 ILE 15 HD13 ILE 15 23.347 0.672 5.778 153 H ALA 16 HN ALA 16 23.562 -0.547 0.611 154 HA ALA 16 HA ALA 16 25.677 -1.884 -0.656 155 HB1 ALA 16 HB1 ALA 16 23.170 -1.414 -1.375 156 HB2 ALA 16 HB2 ALA 16 24.414 -1.740 -2.580 157 HB3 ALA 16 HB3 ALA 16 23.914 -0.079 -2.258 158 H ALA 17 HN ALA 17 24.902 1.577 -0.539 159 HA ALA 17 HA ALA 17 26.970 2.404 -2.297 160 HB1 ALA 17 HB1 ALA 17 25.110 3.893 -1.770 161 HB2 ALA 17 HB2 ALA 17 26.623 4.645 -1.270 162 HB3 ALA 17 HB3 ALA 17 25.569 3.908 -0.066 163 H PHE 18 HN PHE 18 26.789 1.962 1.199 164 HA PHE 18 HA PHE 18 29.441 2.952 1.706 165 HB2 PHE 18 HB2 PHE 18 28.310 3.153 3.660 166 HB3 PHE 18 HB1 PHE 18 27.200 1.847 3.268 167 HD1 PHE 18 HD1 PHE 18 27.297 -0.031 4.610 168 HD2 PHE 18 HD2 PHE 18 30.868 2.275 4.008 169 HE1 PHE 18 HE1 PHE 18 28.531 -1.544 6.138 170 HE2 PHE 18 HE2 PHE 18 32.106 0.764 5.532 171 HZ PHE 18 HZ PHE 18 30.936 -1.148 6.596 172 H LYS 19 HN LYS 19 27.963 -0.292 1.573 173 HA LYS 19 HA LYS 19 30.486 -1.637 1.960 174 HB2 LYS 19 HB2 LYS 19 27.758 -2.602 1.075 175 HB3 LYS 19 HB1 LYS 19 29.147 -3.669 1.277 176 HG2 LYS 19 HG2 LYS 19 29.365 -2.746 3.647 177 HG3 LYS 19 HG1 LYS 19 27.787 -1.999 3.410 178 HD2 LYS 19 HD2 LYS 19 26.793 -3.945 3.932 179 HD3 LYS 19 HD1 LYS 19 27.586 -4.708 2.553 180 HE2 LYS 19 HE2 LYS 19 28.732 -4.419 5.350 181 HE3 LYS 19 HE1 LYS 19 28.194 -5.918 4.594 182 HZ1 LYS 19 HZ2 LYS 19 30.708 -4.667 4.409 183 HZ2 LYS 19 HZ3 LYS 19 30.020 -4.701 2.858 184 HZ3 LYS 19 HZ1 LYS 19 30.209 -6.142 3.731 185 HN1 NH2 20 H1 LYS 19 29.422 0.108 -0.665 Start of MODEL 7 1 H2 PRO 1 HT1 PRO 1 2.203 -0.005 2.141 2 H3 PRO 1 HT2 PRO 1 1.482 -0.118 3.672 3 HA PRO 1 HA PRO 1 3.110 -1.474 4.260 4 HB2 PRO 1 HB2 PRO 1 2.638 -3.628 2.370 5 HB3 PRO 1 HB1 PRO 1 2.227 -3.559 4.093 6 HG2 PRO 1 HG2 PRO 1 0.389 -3.506 2.069 7 HG3 PRO 1 HG1 PRO 1 0.111 -2.863 3.696 8 HD2 PRO 1 HD2 PRO 1 0.707 -1.381 1.156 9 HD3 PRO 1 HD1 PRO 1 -0.287 -0.892 2.544 10 H MET 2 HN MET 2 2.855 -1.907 0.724 11 HA MET 2 HA MET 2 5.536 -2.494 0.243 12 HB2 MET 2 HB2 MET 2 3.653 -1.009 -1.605 13 HB3 MET 2 HB1 MET 2 5.095 -1.912 -2.073 14 HG2 MET 2 HG2 MET 2 3.409 -3.490 -2.447 15 HG3 MET 2 HG1 MET 2 3.931 -3.901 -0.816 16 HE1 MET 2 HE1 MET 2 1.976 -1.734 -2.933 17 HE2 MET 2 HE2 MET 2 0.738 -0.985 -1.932 18 HE3 MET 2 HE3 MET 2 0.402 -2.515 -2.737 19 H ALA 3 HN ALA 3 3.955 0.581 0.744 20 HA ALA 3 HA ALA 3 5.848 2.324 -0.332 21 HB1 ALA 3 HB1 ALA 3 5.035 3.727 1.822 22 HB2 ALA 3 HB2 ALA 3 3.773 2.496 1.779 23 HB3 ALA 3 HB3 ALA 3 4.044 3.529 0.376 24 H ARG 4 HN ARG 4 5.728 0.784 2.866 25 HA ARG 4 HA ARG 4 8.007 2.053 3.944 26 HB2 ARG 4 HB2 ARG 4 6.234 0.510 5.082 27 HB3 ARG 4 HB1 ARG 4 7.322 -0.795 4.603 28 HG2 ARG 4 HG2 ARG 4 9.194 0.443 5.716 29 HG3 ARG 4 HG1 ARG 4 8.019 1.615 6.312 30 HD2 ARG 4 HD2 ARG 4 8.562 -1.159 7.203 31 HD3 ARG 4 HD1 ARG 4 7.981 0.222 8.126 32 HE ARG 4 HE ARG 4 6.015 -0.793 6.275 33 HH11 ARG 4 HH11 ARG 4 4.179 -1.760 7.205 34 HH12 ARG 4 HH12 ARG 4 4.204 -2.261 8.866 35 HH21 ARG 4 HH21 ARG 4 7.487 -1.184 9.387 36 HH22 ARG 4 HH22 ARG 4 6.103 -1.935 10.112 37 H ASN 5 HN ASN 5 7.600 -0.869 2.004 38 HA ASN 5 HA ASN 5 10.325 -1.673 2.073 39 HB2 ASN 5 HB2 ASN 5 8.363 -3.093 1.328 40 HB3 ASN 5 HB1 ASN 5 8.388 -2.205 -0.190 41 HD21 ASN 5 HD21 ASN 5 11.498 -2.065 0.241 42 HD22 ASN 5 HD22 ASN 5 12.023 -3.580 -0.318 43 H LYS 6 HN LYS 6 8.436 0.360 -0.137 44 HA LYS 6 HA LYS 6 10.418 0.759 -2.072 45 HB2 LYS 6 HB2 LYS 6 7.832 1.684 -1.647 46 HB3 LYS 6 HB1 LYS 6 8.812 3.149 -1.581 47 HG2 LYS 6 HG2 LYS 6 8.800 1.098 -3.821 48 HG3 LYS 6 HG1 LYS 6 8.120 2.722 -3.890 49 HD2 LYS 6 HD2 LYS 6 10.431 3.619 -3.391 50 HD3 LYS 6 HD1 LYS 6 11.042 1.977 -3.597 51 HE2 LYS 6 HE2 LYS 6 10.261 3.938 -5.626 52 HE3 LYS 6 HE1 LYS 6 11.230 2.476 -5.802 53 HZ1 LYS 6 HZ1 LYS 6 9.111 1.197 -5.761 54 HZ2 LYS 6 HZ2 LYS 6 9.261 2.231 -7.098 55 HZ3 LYS 6 HZ3 LYS 6 8.267 2.666 -5.795 56 H ILE 7 HN ILE 7 9.693 2.681 0.857 57 HA ILE 7 HA ILE 7 11.843 4.510 0.415 58 HB ILE 7 HB ILE 7 11.494 5.167 2.794 59 HG12 ILE 7 HG12 ILE 7 9.460 2.917 2.726 60 HG13 ILE 7 HG11 ILE 7 10.929 2.948 3.695 61 HG21 ILE 7 HG21 ILE 7 10.111 6.229 1.111 62 HG22 ILE 7 HG22 ILE 7 9.076 5.849 2.488 63 HG23 ILE 7 HG23 ILE 7 9.033 4.833 1.045 64 HD11 ILE 7 HD11 ILE 7 9.587 3.818 5.305 65 HD12 ILE 7 HD12 ILE 7 8.349 4.299 4.142 66 HD13 ILE 7 HD13 ILE 7 9.762 5.323 4.402 67 H LEU 8 HN LEU 8 11.518 1.405 2.012 68 HA LEU 8 HA LEU 8 13.971 1.396 3.415 69 HB2 LEU 8 HB2 LEU 8 12.537 -0.354 4.014 70 HB3 LEU 8 HB1 LEU 8 12.162 -0.757 2.343 71 HG LEU 8 HG LEU 8 14.491 -1.600 2.039 72 HD11 LEU 8 HD11 LEU 8 14.679 -0.907 4.986 73 HD12 LEU 8 HD12 LEU 8 15.645 -0.230 3.676 74 HD13 LEU 8 HD13 LEU 8 15.849 -1.917 4.139 75 HD21 LEU 8 HD21 LEU 8 12.992 -2.773 4.406 76 HD22 LEU 8 HD22 LEU 8 14.241 -3.608 3.483 77 HD23 LEU 8 HD23 LEU 8 12.719 -3.166 2.711 78 H GLY 9 HN GLY 9 13.088 0.375 0.130 79 HA2 GLY 9 HA2 GLY 9 15.517 -0.650 -0.741 80 HA3 GLY 9 HA1 GLY 9 14.371 0.194 -1.781 81 H LYS 10 HN LYS 10 14.492 2.673 -0.319 82 HA LYS 10 HA LYS 10 16.567 3.979 -1.694 83 HB2 LYS 10 HB2 LYS 10 14.489 5.058 -0.778 84 HB3 LYS 10 HB1 LYS 10 15.205 4.953 0.828 85 HG2 LYS 10 HG2 LYS 10 16.992 6.112 -1.206 86 HG3 LYS 10 HG1 LYS 10 15.540 7.065 -0.900 87 HD2 LYS 10 HD2 LYS 10 17.241 6.009 1.371 88 HD3 LYS 10 HD1 LYS 10 17.601 7.549 0.592 89 HE2 LYS 10 HE2 LYS 10 15.026 6.774 1.991 90 HE3 LYS 10 HE1 LYS 10 16.197 7.980 2.526 91 HZ1 LYS 10 HZ1 LYS 10 14.633 9.264 1.488 92 HZ2 LYS 10 HZ2 LYS 10 14.275 8.097 0.313 93 HZ3 LYS 10 HZ3 LYS 10 15.712 9.001 0.207 94 H ILE 11 HN ILE 11 16.375 2.610 1.526 95 HA ILE 11 HA ILE 11 18.867 3.671 2.447 96 HB ILE 11 HB ILE 11 17.674 1.135 3.535 97 HG12 ILE 11 HG12 ILE 11 15.763 2.705 3.115 98 HG13 ILE 11 HG11 ILE 11 16.041 2.401 4.827 99 HG21 ILE 11 HG21 ILE 11 19.748 2.786 4.307 100 HG22 ILE 11 HG22 ILE 11 18.910 1.639 5.350 101 HG23 ILE 11 HG23 ILE 11 18.419 3.331 5.330 102 HD11 ILE 11 HD11 ILE 11 15.662 4.824 4.252 103 HD12 ILE 11 HD12 ILE 11 17.176 4.786 3.354 104 HD13 ILE 11 HD13 ILE 11 17.178 4.506 5.094 105 H LEU 12 HN LEU 12 17.904 0.839 0.625 106 HA LEU 12 HA LEU 12 20.138 -0.783 1.043 107 HB2 LEU 12 HB2 LEU 12 18.173 -0.536 -1.198 108 HB3 LEU 12 HB1 LEU 12 19.608 -1.527 -1.431 109 HG LEU 12 HG LEU 12 17.565 -2.764 -0.536 110 HD11 LEU 12 HD11 LEU 12 20.277 -3.065 0.032 111 HD12 LEU 12 HD12 LEU 12 19.022 -4.261 0.352 112 HD13 LEU 12 HD13 LEU 12 19.515 -3.141 1.622 113 HD21 LEU 12 HD21 LEU 12 17.012 -2.491 1.816 114 HD22 LEU 12 HD22 LEU 12 16.860 -0.928 1.018 115 HD23 LEU 12 HD23 LEU 12 18.273 -1.277 2.013 116 H ARG 13 HN ARG 13 19.615 1.790 -1.297 117 HA ARG 13 HA ARG 13 21.977 1.488 -2.764 118 HB2 ARG 13 HB2 ARG 13 21.136 4.277 -2.228 119 HB3 ARG 13 HB1 ARG 13 21.399 3.463 -3.764 120 HG2 ARG 13 HG2 ARG 13 18.980 3.119 -1.963 121 HG3 ARG 13 HG1 ARG 13 19.012 4.012 -3.487 122 HD2 ARG 13 HD2 ARG 13 19.013 1.066 -3.005 123 HD3 ARG 13 HD1 ARG 13 18.191 2.000 -4.249 124 HE ARG 13 HE ARG 13 21.089 1.917 -4.502 125 HH11 ARG 13 HH11 ARG 13 21.833 0.992 -6.414 126 HH12 ARG 13 HH12 ARG 13 20.770 0.037 -7.392 127 HH21 ARG 13 HH21 ARG 13 18.048 0.433 -5.257 128 HH22 ARG 13 HH22 ARG 13 18.608 -0.289 -6.729 129 H LYS 14 HN LYS 14 21.320 3.120 0.277 130 HA LYS 14 HA LYS 14 23.970 4.200 0.565 131 HB2 LYS 14 HB2 LYS 14 22.268 3.664 2.959 132 HB3 LYS 14 HB1 LYS 14 23.212 5.097 2.550 133 HG2 LYS 14 HG2 LYS 14 20.617 4.278 1.193 134 HG3 LYS 14 HG1 LYS 14 20.765 5.527 2.431 135 HD2 LYS 14 HD2 LYS 14 22.088 6.925 1.029 136 HD3 LYS 14 HD1 LYS 14 22.382 5.627 -0.128 137 HE2 LYS 14 HE2 LYS 14 20.161 5.702 -0.953 138 HE3 LYS 14 HE1 LYS 14 19.584 6.605 0.446 139 HZ1 LYS 14 HZ1 LYS 14 21.472 7.633 -1.607 140 HZ2 LYS 14 HZ2 LYS 14 20.907 8.497 -0.262 141 HZ3 LYS 14 HZ3 LYS 14 19.830 8.028 -1.490 142 H ILE 15 HN ILE 15 22.162 1.432 1.800 143 HA ILE 15 HA ILE 15 24.154 0.308 3.418 144 HB ILE 15 HB ILE 15 21.862 -0.908 1.867 145 HG12 ILE 15 HG12 ILE 15 21.688 0.638 4.012 146 HG13 ILE 15 HG11 ILE 15 20.685 -0.805 3.868 147 HG21 ILE 15 HG21 ILE 15 22.298 -2.939 3.352 148 HG22 ILE 15 HG22 ILE 15 23.889 -2.247 3.668 149 HG23 ILE 15 HG23 ILE 15 23.433 -2.694 2.023 150 HD11 ILE 15 HD11 ILE 15 22.110 -2.059 5.302 151 HD12 ILE 15 HD12 ILE 15 21.911 -0.498 6.090 152 HD13 ILE 15 HD13 ILE 15 23.394 -0.855 5.208 153 H ALA 16 HN ALA 16 23.433 -0.091 -0.036 154 HA ALA 16 HA ALA 16 25.317 -2.068 -0.647 155 HB1 ALA 16 HB1 ALA 16 25.311 -0.917 -2.957 156 HB2 ALA 16 HB2 ALA 16 24.136 0.195 -2.252 157 HB3 ALA 16 HB3 ALA 16 23.770 -1.527 -2.349 158 H ALA 17 HN ALA 17 25.646 1.476 -0.657 159 HA ALA 17 HA ALA 17 28.375 1.505 -1.432 160 HB1 ALA 17 HB1 ALA 17 28.380 3.820 -0.621 161 HB2 ALA 17 HB2 ALA 17 26.851 3.548 0.215 162 HB3 ALA 17 HB3 ALA 17 26.912 3.509 -1.546 163 H PHE 18 HN PHE 18 26.721 1.491 1.682 164 HA PHE 18 HA PHE 18 29.052 1.684 3.296 165 HB2 PHE 18 HB2 PHE 18 27.101 2.208 4.443 166 HB3 PHE 18 HB1 PHE 18 26.201 0.877 3.723 167 HD1 PHE 18 HD1 PHE 18 26.146 -1.294 4.762 168 HD2 PHE 18 HD2 PHE 18 28.828 1.736 6.204 169 HE1 PHE 18 HE1 PHE 18 26.652 -2.686 6.751 170 HE2 PHE 18 HE2 PHE 18 29.328 0.342 8.192 171 HZ PHE 18 HZ PHE 18 28.245 -1.874 8.470 172 H LYS 19 HN LYS 19 27.082 -1.067 2.218 173 HA LYS 19 HA LYS 19 28.692 -3.066 3.454 174 HB2 LYS 19 HB2 LYS 19 26.231 -3.087 2.363 175 HB3 LYS 19 HB1 LYS 19 27.140 -3.733 1.001 176 HG2 LYS 19 HG2 LYS 19 26.475 -5.622 2.312 177 HG3 LYS 19 HG1 LYS 19 28.188 -5.381 2.652 178 HD2 LYS 19 HD2 LYS 19 27.712 -4.304 4.745 179 HD3 LYS 19 HD1 LYS 19 25.992 -4.199 4.370 180 HE2 LYS 19 HE2 LYS 19 27.448 -6.849 4.575 181 HE3 LYS 19 HE1 LYS 19 26.668 -6.083 5.959 182 HZ1 LYS 19 HZ2 LYS 19 25.490 -7.398 3.677 183 HZ2 LYS 19 HZ3 LYS 19 24.737 -5.937 4.110 184 HZ3 LYS 19 HZ1 LYS 19 24.879 -7.190 5.243 185 HN1 NH2 20 H1 LYS 19 30.748 -1.787 2.488 Start of MODEL 8 1 H2 PRO 1 HT1 PRO 1 2.918 -0.075 3.412 2 H3 PRO 1 HT2 PRO 1 3.245 0.052 5.068 3 HA PRO 1 HA PRO 1 5.139 -1.025 4.759 4 HB2 PRO 1 HB2 PRO 1 4.085 -3.443 3.500 5 HB3 PRO 1 HB1 PRO 1 4.801 -3.236 5.112 6 HG2 PRO 1 HG2 PRO 1 2.154 -3.707 4.695 7 HG3 PRO 1 HG1 PRO 1 2.796 -2.844 6.100 8 HD2 PRO 1 HD2 PRO 1 1.433 -1.741 3.671 9 HD3 PRO 1 HD1 PRO 1 1.390 -1.163 5.348 10 H MET 2 HN MET 2 2.981 -1.427 1.941 11 HA MET 2 HA MET 2 4.872 -2.047 0.010 12 HB2 MET 2 HB2 MET 2 2.292 -0.496 -0.132 13 HB3 MET 2 HB1 MET 2 3.282 -0.764 -1.568 14 HG2 MET 2 HG2 MET 2 1.685 -2.563 -1.481 15 HG3 MET 2 HG1 MET 2 3.243 -3.239 -1.010 16 HE1 MET 2 HE1 MET 2 1.025 -4.633 -0.831 17 HE2 MET 2 HE2 MET 2 -0.199 -4.425 0.421 18 HE3 MET 2 HE3 MET 2 1.217 -5.421 0.741 19 H ALA 3 HN ALA 3 3.929 1.129 1.277 20 HA ALA 3 HA ALA 3 5.623 2.636 -0.461 21 HB1 ALA 3 HB1 ALA 3 3.694 3.295 1.385 22 HB2 ALA 3 HB2 ALA 3 4.806 4.442 0.642 23 HB3 ALA 3 HB3 ALA 3 5.175 3.757 2.224 24 H ARG 4 HN ARG 4 5.933 1.367 2.826 25 HA ARG 4 HA ARG 4 8.523 2.306 3.369 26 HB2 ARG 4 HB2 ARG 4 7.147 1.349 5.134 27 HB3 ARG 4 HB1 ARG 4 7.128 -0.213 4.315 28 HG2 ARG 4 HG2 ARG 4 8.770 -0.063 6.216 29 HG3 ARG 4 HG1 ARG 4 9.502 -0.512 4.676 30 HD2 ARG 4 HD2 ARG 4 10.757 1.252 5.984 31 HD3 ARG 4 HD1 ARG 4 10.342 1.709 4.345 32 HE ARG 4 HE ARG 4 8.758 3.216 5.216 33 HH11 ARG 4 HH11 ARG 4 8.195 4.629 6.899 34 HH12 ARG 4 HH12 ARG 4 8.643 4.248 8.528 35 HH21 ARG 4 HH21 ARG 4 10.217 1.286 7.692 36 HH22 ARG 4 HH22 ARG 4 9.818 2.377 8.969 37 H ASN 5 HN ASN 5 7.371 -0.661 1.802 38 HA ASN 5 HA ASN 5 9.763 -2.007 1.428 39 HB2 ASN 5 HB2 ASN 5 7.562 -2.910 0.738 40 HB3 ASN 5 HB1 ASN 5 7.508 -1.748 -0.586 41 HD21 ASN 5 HD21 ASN 5 9.246 -4.584 0.650 42 HD22 ASN 5 HD22 ASN 5 9.942 -5.010 -0.839 43 H LYS 6 HN LYS 6 8.334 0.569 -0.554 44 HA LYS 6 HA LYS 6 10.481 0.672 -2.422 45 HB2 LYS 6 HB2 LYS 6 7.984 1.815 -2.314 46 HB3 LYS 6 HB1 LYS 6 9.023 3.194 -1.960 47 HG2 LYS 6 HG2 LYS 6 9.239 1.355 -4.369 48 HG3 LYS 6 HG1 LYS 6 8.694 3.034 -4.376 49 HD2 LYS 6 HD2 LYS 6 10.987 3.597 -3.332 50 HD3 LYS 6 HD1 LYS 6 11.474 1.974 -3.824 51 HE2 LYS 6 HE2 LYS 6 10.308 4.049 -5.705 52 HE3 LYS 6 HE1 LYS 6 12.034 3.746 -5.510 53 HZ1 LYS 6 HZ1 LYS 6 9.968 1.899 -6.551 54 HZ2 LYS 6 HZ2 LYS 6 11.502 1.361 -6.064 55 HZ3 LYS 6 HZ3 LYS 6 11.356 2.471 -7.337 56 H ILE 7 HN ILE 7 9.655 2.592 0.458 57 HA ILE 7 HA ILE 7 11.872 4.327 0.378 58 HB ILE 7 HB ILE 7 10.266 3.301 2.736 59 HG12 ILE 7 HG12 ILE 7 10.163 5.815 1.043 60 HG13 ILE 7 HG11 ILE 7 8.923 4.570 1.165 61 HG21 ILE 7 HG21 ILE 7 11.295 5.721 3.498 62 HG22 ILE 7 HG22 ILE 7 12.638 5.058 2.573 63 HG23 ILE 7 HG23 ILE 7 11.990 4.166 3.946 64 HD11 ILE 7 HD11 ILE 7 9.699 6.669 3.161 65 HD12 ILE 7 HD12 ILE 7 9.012 5.152 3.740 66 HD13 ILE 7 HD13 ILE 7 8.092 6.172 2.635 67 H LEU 8 HN LEU 8 11.454 1.096 1.749 68 HA LEU 8 HA LEU 8 13.882 0.881 3.139 69 HB2 LEU 8 HB2 LEU 8 12.350 -0.877 3.480 70 HB3 LEU 8 HB1 LEU 8 12.103 -1.121 1.756 71 HG LEU 8 HG LEU 8 14.400 -1.998 1.536 72 HD11 LEU 8 HD11 LEU 8 15.544 -2.533 3.806 73 HD12 LEU 8 HD12 LEU 8 14.495 -1.277 4.463 74 HD13 LEU 8 HD13 LEU 8 15.657 -0.883 3.198 75 HD21 LEU 8 HD21 LEU 8 14.096 -4.041 3.031 76 HD22 LEU 8 HD22 LEU 8 12.733 -3.668 1.975 77 HD23 LEU 8 HD23 LEU 8 12.666 -3.244 3.686 78 H GLY 9 HN GLY 9 13.086 0.248 -0.262 79 HA2 GLY 9 HA2 GLY 9 15.551 -0.735 -1.116 80 HA3 GLY 9 HA1 GLY 9 14.437 0.183 -2.127 81 H LYS 10 HN LYS 10 14.440 2.529 -0.488 82 HA LYS 10 HA LYS 10 16.567 3.975 -1.624 83 HB2 LYS 10 HB2 LYS 10 14.262 4.615 -0.230 84 HB3 LYS 10 HB1 LYS 10 15.530 5.060 0.911 85 HG2 LYS 10 HG2 LYS 10 15.969 5.909 -1.905 86 HG3 LYS 10 HG1 LYS 10 14.650 6.713 -1.057 87 HD2 LYS 10 HD2 LYS 10 17.217 6.424 0.435 88 HD3 LYS 10 HD1 LYS 10 17.203 7.565 -0.906 89 HE2 LYS 10 HE2 LYS 10 16.565 8.743 1.133 90 HE3 LYS 10 HE1 LYS 10 15.167 8.636 0.067 91 HZ1 LYS 10 HZ1 LYS 10 14.352 6.774 1.313 92 HZ2 LYS 10 HZ2 LYS 10 14.639 8.065 2.372 93 HZ3 LYS 10 HZ3 LYS 10 15.728 6.765 2.307 94 H ILE 11 HN ILE 11 16.152 2.392 1.483 95 HA ILE 11 HA ILE 11 18.612 3.329 2.616 96 HB ILE 11 HB ILE 11 17.026 0.889 3.437 97 HG12 ILE 11 HG12 ILE 11 15.521 2.875 3.261 98 HG13 ILE 11 HG11 ILE 11 15.771 2.400 4.941 99 HG21 ILE 11 HG21 ILE 11 18.966 2.756 4.819 100 HG22 ILE 11 HG22 ILE 11 19.132 1.016 4.575 101 HG23 ILE 11 HG23 ILE 11 17.928 1.639 5.704 102 HD11 ILE 11 HD11 ILE 11 17.801 4.117 4.749 103 HD12 ILE 11 HD12 ILE 11 16.171 4.666 5.134 104 HD13 ILE 11 HD13 ILE 11 16.782 4.803 3.486 105 H LEU 12 HN LEU 12 17.599 0.535 0.735 106 HA LEU 12 HA LEU 12 19.807 -1.109 1.197 107 HB2 LEU 12 HB2 LEU 12 17.960 -0.843 -1.164 108 HB3 LEU 12 HB1 LEU 12 19.286 -2.008 -1.160 109 HG LEU 12 HG LEU 12 17.079 -1.846 0.921 110 HD11 LEU 12 HD11 LEU 12 17.542 -4.135 -0.971 111 HD12 LEU 12 HD12 LEU 12 16.609 -2.734 -1.500 112 HD13 LEU 12 HD13 LEU 12 16.073 -3.681 -0.113 113 HD21 LEU 12 HD21 LEU 12 19.652 -3.323 0.731 114 HD22 LEU 12 HD22 LEU 12 18.258 -4.277 1.238 115 HD23 LEU 12 HD23 LEU 12 18.726 -2.847 2.155 116 H ARG 13 HN ARG 13 19.349 1.472 -1.166 117 HA ARG 13 HA ARG 13 21.777 1.145 -2.548 118 HB2 ARG 13 HB2 ARG 13 20.900 3.937 -2.100 119 HB3 ARG 13 HB1 ARG 13 21.234 3.097 -3.610 120 HG2 ARG 13 HG2 ARG 13 18.731 2.752 -1.919 121 HG3 ARG 13 HG1 ARG 13 18.839 3.704 -3.405 122 HD2 ARG 13 HD2 ARG 13 18.741 0.752 -3.046 123 HD3 ARG 13 HD1 ARG 13 18.068 1.752 -4.324 124 HE ARG 13 HE ARG 13 20.975 1.550 -4.326 125 HH11 ARG 13 HH11 ARG 13 21.854 0.514 -6.146 126 HH12 ARG 13 HH12 ARG 13 20.831 -0.380 -7.220 127 HH21 ARG 13 HH21 ARG 13 17.929 0.270 -5.421 128 HH22 ARG 13 HH22 ARG 13 18.599 -0.507 -6.815 129 H LYS 14 HN LYS 14 20.980 2.493 0.559 130 HA LYS 14 HA LYS 14 23.487 3.830 1.006 131 HB2 LYS 14 HB2 LYS 14 21.719 2.784 3.212 132 HB3 LYS 14 HB1 LYS 14 22.727 4.227 3.192 133 HG2 LYS 14 HG2 LYS 14 20.368 3.930 1.330 134 HG3 LYS 14 HG1 LYS 14 20.194 4.582 2.957 135 HD2 LYS 14 HD2 LYS 14 20.843 6.589 2.194 136 HD3 LYS 14 HD1 LYS 14 22.426 5.904 1.854 137 HE2 LYS 14 HE2 LYS 14 20.608 5.111 -0.234 138 HE3 LYS 14 HE1 LYS 14 20.506 6.853 -0.015 139 HZ1 LYS 14 HZ1 LYS 14 22.427 7.062 -1.059 140 HZ2 LYS 14 HZ2 LYS 14 22.541 5.382 -1.251 141 HZ3 LYS 14 HZ3 LYS 14 23.205 6.125 0.121 142 H ILE 15 HN ILE 15 22.055 0.710 1.859 143 HA ILE 15 HA ILE 15 24.142 -0.342 3.388 144 HB ILE 15 HB ILE 15 22.314 -1.803 1.453 145 HG12 ILE 15 HG12 ILE 15 21.209 -0.401 3.280 146 HG13 ILE 15 HG11 ILE 15 20.828 -2.119 3.325 147 HG21 ILE 15 HG21 ILE 15 22.853 -3.544 3.489 148 HG22 ILE 15 HG22 ILE 15 24.391 -2.688 3.372 149 HG23 ILE 15 HG23 ILE 15 23.734 -3.517 1.961 150 HD11 ILE 15 HD11 ILE 15 22.624 -2.445 5.023 151 HD12 ILE 15 HD12 ILE 15 21.355 -1.355 5.581 152 HD13 ILE 15 HD13 ILE 15 22.893 -0.704 5.025 153 H ALA 16 HN ALA 16 23.613 -0.307 -0.112 154 HA ALA 16 HA ALA 16 25.857 -1.817 -0.883 155 HB1 ALA 16 HB1 ALA 16 23.830 -0.454 -2.192 156 HB2 ALA 16 HB2 ALA 16 25.174 -1.284 -2.970 157 HB3 ALA 16 HB3 ALA 16 25.273 0.446 -2.645 158 H ALA 17 HN ALA 17 25.446 1.677 -0.365 159 HA ALA 17 HA ALA 17 28.147 2.387 -0.927 160 HB1 ALA 17 HB1 ALA 17 26.086 3.942 -0.792 161 HB2 ALA 17 HB2 ALA 17 27.607 4.541 -0.131 162 HB3 ALA 17 HB3 ALA 17 26.356 3.925 0.949 163 H PHE 18 HN PHE 18 26.387 1.503 1.989 164 HA PHE 18 HA PHE 18 28.505 2.013 3.817 165 HB2 PHE 18 HB2 PHE 18 26.556 1.781 4.994 166 HB3 PHE 18 HB1 PHE 18 25.883 0.634 3.848 167 HD1 PHE 18 HD1 PHE 18 25.339 -1.368 4.893 168 HD2 PHE 18 HD2 PHE 18 28.976 0.644 5.981 169 HE1 PHE 18 HE1 PHE 18 25.900 -3.219 6.444 170 HE2 PHE 18 HE2 PHE 18 29.537 -1.208 7.521 171 HZ PHE 18 HZ PHE 18 27.999 -3.136 7.764 172 H LYS 19 HN LYS 19 27.396 -0.896 2.100 173 HA LYS 19 HA LYS 19 29.528 -2.550 3.117 174 HB2 LYS 19 HB2 LYS 19 27.469 -2.866 0.927 175 HB3 LYS 19 HB1 LYS 19 28.726 -4.076 1.202 176 HG2 LYS 19 HG2 LYS 19 27.151 -3.112 3.552 177 HG3 LYS 19 HG1 LYS 19 26.364 -4.230 2.440 178 HD2 LYS 19 HD2 LYS 19 28.313 -5.782 2.683 179 HD3 LYS 19 HD1 LYS 19 28.992 -4.683 3.885 180 HE2 LYS 19 HE2 LYS 19 26.960 -4.963 5.276 181 HE3 LYS 19 HE1 LYS 19 26.309 -6.090 4.080 182 HZ1 LYS 19 HZ2 LYS 19 28.569 -6.436 5.929 183 HZ2 LYS 19 HZ3 LYS 19 28.577 -7.276 4.450 184 HZ3 LYS 19 HZ1 LYS 19 27.308 -7.505 5.550 185 HN1 NH2 20 H1 LYS 19 30.944 -0.423 2.246 Start of MODEL 9 1 H2 PRO 1 HT1 PRO 1 2.656 -1.630 3.137 2 H3 PRO 1 HT2 PRO 1 2.668 -2.030 4.791 3 HA PRO 1 HA PRO 1 4.869 -1.839 4.660 4 HB2 PRO 1 HB2 PRO 1 5.523 -4.106 3.079 5 HB3 PRO 1 HB1 PRO 1 5.394 -4.028 4.845 6 HG2 PRO 1 HG2 PRO 1 3.674 -5.409 3.107 7 HG3 PRO 1 HG1 PRO 1 3.408 -5.086 4.823 8 HD2 PRO 1 HD2 PRO 1 2.223 -3.736 2.460 9 HD3 PRO 1 HD1 PRO 1 1.585 -3.882 4.110 10 H MET 2 HN MET 2 3.182 -1.813 1.665 11 HA MET 2 HA MET 2 5.184 -1.730 -0.243 12 HB2 MET 2 HB2 MET 2 2.647 -0.089 -0.107 13 HB3 MET 2 HB1 MET 2 3.651 -0.268 -1.546 14 HG2 MET 2 HG2 MET 2 1.829 -2.239 -0.240 15 HG3 MET 2 HG1 MET 2 2.172 -1.984 -1.952 16 HE1 MET 2 HE1 MET 2 3.632 -3.321 -3.322 17 HE2 MET 2 HE2 MET 2 5.179 -3.978 -2.802 18 HE3 MET 2 HE3 MET 2 4.890 -2.243 -2.694 19 H ALA 3 HN ALA 3 3.976 0.946 1.771 20 HA ALA 3 HA ALA 3 5.538 2.984 0.646 21 HB1 ALA 3 HB1 ALA 3 4.269 4.094 2.130 22 HB2 ALA 3 HB2 ALA 3 5.393 3.569 3.380 23 HB3 ALA 3 HB3 ALA 3 3.942 2.627 3.046 24 H ARG 4 HN ARG 4 6.241 0.782 3.351 25 HA ARG 4 HA ARG 4 8.874 1.785 3.819 26 HB2 ARG 4 HB2 ARG 4 7.634 0.448 5.498 27 HB3 ARG 4 HB1 ARG 4 7.738 -0.957 4.436 28 HG2 ARG 4 HG2 ARG 4 9.583 -1.309 5.804 29 HG3 ARG 4 HG1 ARG 4 10.325 -0.426 4.469 30 HD2 ARG 4 HD2 ARG 4 11.087 0.587 6.522 31 HD3 ARG 4 HD1 ARG 4 9.951 1.701 5.772 32 HE ARG 4 HE ARG 4 8.593 -0.021 7.599 33 HH11 ARG 4 HH11 ARG 4 7.930 0.861 9.593 34 HH12 ARG 4 HH12 ARG 4 8.634 2.339 10.158 35 HH21 ARG 4 HH21 ARG 4 10.728 2.709 7.406 36 HH22 ARG 4 HH22 ARG 4 10.216 3.393 8.913 37 H ASN 5 HN ASN 5 7.556 -0.943 1.988 38 HA ASN 5 HA ASN 5 9.899 -2.102 1.064 39 HB2 ASN 5 HB2 ASN 5 7.522 -2.886 0.643 40 HB3 ASN 5 HB1 ASN 5 7.450 -1.696 -0.654 41 HD21 ASN 5 HD21 ASN 5 7.974 -2.578 -2.663 42 HD22 ASN 5 HD22 ASN 5 9.055 -3.866 -2.902 43 H LYS 6 HN LYS 6 8.098 0.644 -0.291 44 HA LYS 6 HA LYS 6 9.860 1.078 -2.481 45 HB2 LYS 6 HB2 LYS 6 7.551 2.428 -1.280 46 HB3 LYS 6 HB1 LYS 6 8.739 3.550 -1.944 47 HG2 LYS 6 HG2 LYS 6 7.647 1.164 -3.455 48 HG3 LYS 6 HG1 LYS 6 6.998 2.794 -3.606 49 HD2 LYS 6 HD2 LYS 6 9.840 2.952 -3.897 50 HD3 LYS 6 HD1 LYS 6 9.263 1.662 -4.948 51 HE2 LYS 6 HE2 LYS 6 9.252 3.898 -6.066 52 HE3 LYS 6 HE1 LYS 6 7.656 3.153 -5.990 53 HZ1 LYS 6 HZ1 LYS 6 6.933 4.913 -4.891 54 HZ2 LYS 6 HZ2 LYS 6 8.476 5.625 -4.944 55 HZ3 LYS 6 HZ3 LYS 6 8.035 4.624 -3.646 56 H ILE 7 HN ILE 7 9.643 2.487 0.766 57 HA ILE 7 HA ILE 7 11.781 4.335 0.381 58 HB ILE 7 HB ILE 7 10.458 3.270 2.881 59 HG12 ILE 7 HG12 ILE 7 10.284 5.951 1.463 60 HG13 ILE 7 HG11 ILE 7 9.078 4.668 1.326 61 HG21 ILE 7 HG21 ILE 7 12.840 5.000 2.504 62 HG22 ILE 7 HG22 ILE 7 12.338 4.063 3.911 63 HG23 ILE 7 HG23 ILE 7 11.619 5.643 3.605 64 HD11 ILE 7 HD11 ILE 7 8.539 4.819 3.660 65 HD12 ILE 7 HD12 ILE 7 8.557 6.468 3.041 66 HD13 ILE 7 HD13 ILE 7 9.925 5.862 3.975 67 H LEU 8 HN LEU 8 11.627 1.112 1.941 68 HA LEU 8 HA LEU 8 14.311 1.124 2.817 69 HB2 LEU 8 HB2 LEU 8 14.078 -1.153 3.283 70 HB3 LEU 8 HB1 LEU 8 12.425 -0.557 3.392 71 HG LEU 8 HG LEU 8 12.262 -1.225 0.871 72 HD11 LEU 8 HD11 LEU 8 14.942 -2.064 1.529 73 HD12 LEU 8 HD12 LEU 8 14.117 -2.153 -0.025 74 HD13 LEU 8 HD13 LEU 8 13.976 -3.481 1.124 75 HD21 LEU 8 HD21 LEU 8 12.525 -3.457 2.908 76 HD22 LEU 8 HD22 LEU 8 11.450 -3.401 1.513 77 HD23 LEU 8 HD23 LEU 8 11.166 -2.336 2.889 78 H GLY 9 HN GLY 9 12.882 0.476 -0.315 79 HA2 GLY 9 HA2 GLY 9 15.007 -0.814 -1.600 80 HA3 GLY 9 HA1 GLY 9 13.875 0.277 -2.399 81 H LYS 10 HN LYS 10 14.467 2.579 -0.854 82 HA LYS 10 HA LYS 10 16.700 3.629 -2.270 83 HB2 LYS 10 HB2 LYS 10 14.593 4.639 -0.639 84 HB3 LYS 10 HB1 LYS 10 16.109 5.209 0.055 85 HG2 LYS 10 HG2 LYS 10 15.994 5.372 -2.892 86 HG3 LYS 10 HG1 LYS 10 14.804 6.383 -2.078 87 HD2 LYS 10 HD2 LYS 10 17.051 6.877 -0.570 88 HD3 LYS 10 HD1 LYS 10 17.745 6.636 -2.170 89 HE2 LYS 10 HE2 LYS 10 17.110 9.022 -1.686 90 HE3 LYS 10 HE1 LYS 10 16.343 8.353 -3.122 91 HZ1 LYS 10 HZ1 LYS 10 14.318 8.344 -2.157 92 HZ2 LYS 10 HZ2 LYS 10 14.991 9.611 -1.252 93 HZ3 LYS 10 HZ3 LYS 10 14.918 8.047 -0.602 94 H ILE 11 HN ILE 11 16.182 2.385 0.978 95 HA ILE 11 HA ILE 11 18.697 3.099 2.054 96 HB ILE 11 HB ILE 11 16.971 0.739 2.847 97 HG12 ILE 11 HG12 ILE 11 15.740 2.976 2.722 98 HG13 ILE 11 HG11 ILE 11 15.767 2.207 4.309 99 HG21 ILE 11 HG21 ILE 11 19.173 0.731 3.894 100 HG22 ILE 11 HG22 ILE 11 17.975 1.220 5.090 101 HG23 ILE 11 HG23 ILE 11 19.007 2.431 4.331 102 HD11 ILE 11 HD11 ILE 11 17.685 4.381 3.409 103 HD12 ILE 11 HD12 ILE 11 17.629 3.638 5.009 104 HD13 ILE 11 HD13 ILE 11 16.284 4.630 4.450 105 H LEU 12 HN LEU 12 17.634 0.433 0.029 106 HA LEU 12 HA LEU 12 19.721 -1.350 0.539 107 HB2 LEU 12 HB2 LEU 12 18.263 -0.863 -2.066 108 HB3 LEU 12 HB1 LEU 12 19.271 -2.266 -1.719 109 HG LEU 12 HG LEU 12 16.764 -1.477 -0.194 110 HD11 LEU 12 HD11 LEU 12 15.657 -3.236 -1.309 111 HD12 LEU 12 HD12 LEU 12 17.170 -3.962 -1.850 112 HD13 LEU 12 HD13 LEU 12 16.598 -2.466 -2.586 113 HD21 LEU 12 HD21 LEU 12 18.097 -2.594 1.384 114 HD22 LEU 12 HD22 LEU 12 18.827 -3.643 0.168 115 HD23 LEU 12 HD23 LEU 12 17.161 -3.910 0.679 116 H ARG 13 HN ARG 13 19.510 1.270 -1.820 117 HA ARG 13 HA ARG 13 22.065 0.902 -2.946 118 HB2 ARG 13 HB2 ARG 13 21.239 3.711 -2.681 119 HB3 ARG 13 HB1 ARG 13 21.605 2.783 -4.126 120 HG2 ARG 13 HG2 ARG 13 19.008 2.598 -2.560 121 HG3 ARG 13 HG1 ARG 13 19.220 3.515 -4.049 122 HD2 ARG 13 HD2 ARG 13 18.833 0.628 -3.668 123 HD3 ARG 13 HD1 ARG 13 18.518 1.620 -5.085 124 HE ARG 13 HE ARG 13 21.264 1.412 -4.987 125 HH11 ARG 13 HH11 ARG 13 22.408 -0.249 -6.038 126 HH12 ARG 13 HH12 ARG 13 21.611 -1.735 -6.432 127 HH21 ARG 13 HH21 ARG 13 18.562 -0.771 -5.071 128 HH22 ARG 13 HH22 ARG 13 19.437 -2.038 -5.861 129 H LYS 14 HN LYS 14 20.970 2.344 0.034 130 HA LYS 14 HA LYS 14 23.417 3.695 0.677 131 HB2 LYS 14 HB2 LYS 14 21.442 2.694 2.723 132 HB3 LYS 14 HB1 LYS 14 22.459 4.136 2.782 133 HG2 LYS 14 HG2 LYS 14 20.258 3.741 0.736 134 HG3 LYS 14 HG1 LYS 14 20.008 4.577 2.270 135 HD2 LYS 14 HD2 LYS 14 20.923 6.467 1.454 136 HD3 LYS 14 HD1 LYS 14 22.394 5.604 1.013 137 HE2 LYS 14 HE2 LYS 14 20.961 4.753 -1.019 138 HE3 LYS 14 HE1 LYS 14 19.957 6.153 -0.655 139 HZ1 LYS 14 HZ1 LYS 14 22.865 6.168 -1.253 140 HZ2 LYS 14 HZ2 LYS 14 21.979 7.533 -0.766 141 HZ3 LYS 14 HZ3 LYS 14 21.624 6.764 -2.239 142 H ILE 15 HN ILE 15 22.064 0.490 1.279 143 HA ILE 15 HA ILE 15 23.900 -0.448 3.169 144 HB ILE 15 HB ILE 15 22.543 -1.950 0.907 145 HG12 ILE 15 HG12 ILE 15 21.183 -0.711 2.771 146 HG13 ILE 15 HG11 ILE 15 20.791 -2.394 2.424 147 HG21 ILE 15 HG21 ILE 15 24.057 -2.912 3.353 148 HG22 ILE 15 HG22 ILE 15 24.383 -3.309 1.665 149 HG23 ILE 15 HG23 ILE 15 22.936 -3.935 2.456 150 HD11 ILE 15 HD11 ILE 15 22.908 -1.935 4.471 151 HD12 ILE 15 HD12 ILE 15 21.633 -3.152 4.427 152 HD13 ILE 15 HD13 ILE 15 21.264 -1.502 4.938 153 H ALA 16 HN ALA 16 24.073 -0.245 -0.347 154 HA ALA 16 HA ALA 16 26.564 -1.551 -0.681 155 HB1 ALA 16 HB1 ALA 16 26.649 -0.342 -2.842 156 HB2 ALA 16 HB2 ALA 16 25.273 0.639 -2.334 157 HB3 ALA 16 HB3 ALA 16 25.076 -1.097 -2.574 158 H ALA 17 HN ALA 17 25.626 1.782 0.017 159 HA ALA 17 HA ALA 17 28.236 2.909 -0.155 160 HB1 ALA 17 HB1 ALA 17 27.169 4.842 0.332 161 HB2 ALA 17 HB2 ALA 17 26.492 4.185 1.822 162 HB3 ALA 17 HB3 ALA 17 25.672 3.912 0.285 163 H PHE 18 HN PHE 18 26.290 1.583 2.479 164 HA PHE 18 HA PHE 18 28.192 2.024 4.541 165 HB2 PHE 18 HB2 PHE 18 26.205 1.554 5.537 166 HB3 PHE 18 HB1 PHE 18 25.663 0.541 4.202 167 HD1 PHE 18 HD1 PHE 18 25.484 -1.751 4.576 168 HD2 PHE 18 HD2 PHE 18 28.275 0.546 6.895 169 HE1 PHE 18 HE1 PHE 18 26.067 -3.777 5.889 170 HE2 PHE 18 HE2 PHE 18 28.860 -1.472 8.197 171 HZ PHE 18 HZ PHE 18 27.754 -3.638 7.703 172 H LYS 19 HN LYS 19 27.435 -0.829 2.551 173 HA LYS 19 HA LYS 19 29.614 -2.355 3.672 174 HB2 LYS 19 HB2 LYS 19 27.645 -2.807 1.436 175 HB3 LYS 19 HB1 LYS 19 29.009 -3.897 1.677 176 HG2 LYS 19 HG2 LYS 19 28.136 -3.850 4.203 177 HG3 LYS 19 HG1 LYS 19 26.615 -3.434 3.413 178 HD2 LYS 19 HD2 LYS 19 26.303 -5.555 2.734 179 HD3 LYS 19 HD1 LYS 19 27.907 -5.614 1.995 180 HE2 LYS 19 HE2 LYS 19 27.312 -6.027 4.944 181 HE3 LYS 19 HE1 LYS 19 27.654 -7.310 3.789 182 HZ1 LYS 19 HZ2 LYS 19 29.840 -6.712 3.626 183 HZ2 LYS 19 HZ3 LYS 19 29.536 -6.297 5.248 184 HZ3 LYS 19 HZ1 LYS 19 29.567 -5.098 4.058 185 HN1 NH2 20 H1 LYS 19 29.545 0.138 1.380 Start of MODEL 10 1 H2 PRO 1 HT1 PRO 1 3.144 -3.616 1.620 2 H3 PRO 1 HT2 PRO 1 1.844 -3.388 2.691 3 HA PRO 1 HA PRO 1 2.762 -1.485 3.321 4 HB2 PRO 1 HB2 PRO 1 5.326 -2.500 4.277 5 HB3 PRO 1 HB1 PRO 1 3.939 -1.904 5.211 6 HG2 PRO 1 HG2 PRO 1 4.695 -4.521 5.128 7 HG3 PRO 1 HG1 PRO 1 3.049 -3.963 5.460 8 HD2 PRO 1 HD2 PRO 1 4.162 -5.127 2.927 9 HD3 PRO 1 HD1 PRO 1 2.539 -5.293 3.624 10 H MET 2 HN MET 2 3.004 -1.573 0.754 11 HA MET 2 HA MET 2 5.452 -1.727 -0.518 12 HB2 MET 2 HB2 MET 2 3.387 0.345 -1.249 13 HB3 MET 2 HB1 MET 2 4.469 -0.554 -2.312 14 HG2 MET 2 HG2 MET 2 3.135 -2.609 -1.112 15 HG3 MET 2 HG1 MET 2 1.879 -1.369 -1.122 16 HE1 MET 2 HE1 MET 2 1.222 -3.999 -3.432 17 HE2 MET 2 HE2 MET 2 0.258 -2.587 -3.847 18 HE3 MET 2 HE3 MET 2 0.660 -2.909 -2.164 19 H ALA 3 HN ALA 3 4.122 0.967 1.363 20 HA ALA 3 HA ALA 3 5.917 2.976 0.592 21 HB1 ALA 3 HB1 ALA 3 5.249 4.149 2.521 22 HB2 ALA 3 HB2 ALA 3 4.985 2.667 3.440 23 HB3 ALA 3 HB3 ALA 3 3.861 3.122 2.162 24 H ARG 4 HN ARG 4 6.205 0.547 3.182 25 HA ARG 4 HA ARG 4 8.745 1.365 4.118 26 HB2 ARG 4 HB2 ARG 4 7.249 -1.254 4.252 27 HB3 ARG 4 HB1 ARG 4 8.874 -1.086 4.915 28 HG2 ARG 4 HG2 ARG 4 8.131 0.065 6.719 29 HG3 ARG 4 HG1 ARG 4 7.129 1.125 5.728 30 HD2 ARG 4 HD2 ARG 4 5.759 -0.230 7.269 31 HD3 ARG 4 HD1 ARG 4 5.397 -0.611 5.598 32 HE ARG 4 HE ARG 4 6.563 -2.660 5.870 33 HH11 ARG 4 HH11 ARG 4 6.967 -4.408 7.271 34 HH12 ARG 4 HH12 ARG 4 6.982 -4.147 8.984 35 HH21 ARG 4 HH21 ARG 4 6.412 -0.725 8.735 36 HH22 ARG 4 HH22 ARG 4 6.679 -2.049 9.816 37 H ASN 5 HN ASN 5 7.729 -1.052 1.747 38 HA ASN 5 HA ASN 5 10.235 -2.050 1.017 39 HB2 ASN 5 HB2 ASN 5 8.810 -3.283 -0.216 40 HB3 ASN 5 HB1 ASN 5 7.536 -2.091 -0.036 41 HD21 ASN 5 HD21 ASN 5 7.299 -0.504 -1.690 42 HD22 ASN 5 HD22 ASN 5 8.089 -0.627 -3.188 43 H LYS 6 HN LYS 6 8.478 0.814 -0.058 44 HA LYS 6 HA LYS 6 10.289 1.549 -2.109 45 HB2 LYS 6 HB2 LYS 6 7.906 2.640 -0.875 46 HB3 LYS 6 HB1 LYS 6 9.098 3.907 -1.167 47 HG2 LYS 6 HG2 LYS 6 8.259 1.883 -3.263 48 HG3 LYS 6 HG1 LYS 6 7.533 3.483 -3.109 49 HD2 LYS 6 HD2 LYS 6 9.929 4.413 -3.266 50 HD3 LYS 6 HD1 LYS 6 10.401 2.799 -3.795 51 HE2 LYS 6 HE2 LYS 6 8.462 4.685 -5.137 52 HE3 LYS 6 HE1 LYS 6 9.981 4.070 -5.784 53 HZ1 LYS 6 HZ1 LYS 6 7.383 2.805 -5.639 54 HZ2 LYS 6 HZ2 LYS 6 8.687 1.797 -5.234 55 HZ3 LYS 6 HZ3 LYS 6 8.641 2.567 -6.747 56 H ILE 7 HN ILE 7 9.951 2.712 1.261 57 HA ILE 7 HA ILE 7 12.169 4.486 1.039 58 HB ILE 7 HB ILE 7 11.980 4.773 3.451 59 HG12 ILE 7 HG12 ILE 7 10.114 2.392 3.260 60 HG13 ILE 7 HG11 ILE 7 11.630 2.471 4.157 61 HG21 ILE 7 HG21 ILE 7 10.127 6.028 3.130 62 HG22 ILE 7 HG22 ILE 7 9.122 4.592 2.958 63 HG23 ILE 7 HG23 ILE 7 9.958 5.252 1.556 64 HD11 ILE 7 HD11 ILE 7 9.783 2.775 5.716 65 HD12 ILE 7 HD12 ILE 7 9.113 4.070 4.726 66 HD13 ILE 7 HD13 ILE 7 10.652 4.299 5.554 67 H LEU 8 HN LEU 8 11.898 1.178 2.449 68 HA LEU 8 HA LEU 8 14.570 1.135 3.378 69 HB2 LEU 8 HB2 LEU 8 14.364 -1.252 3.569 70 HB3 LEU 8 HB1 LEU 8 12.797 -0.565 3.975 71 HG LEU 8 HG LEU 8 12.274 -0.937 1.420 72 HD11 LEU 8 HD11 LEU 8 14.883 -1.869 1.442 73 HD12 LEU 8 HD12 LEU 8 13.677 -2.282 0.222 74 HD13 LEU 8 HD13 LEU 8 13.951 -3.354 1.595 75 HD21 LEU 8 HD21 LEU 8 11.845 -3.467 2.112 76 HD22 LEU 8 HD22 LEU 8 10.947 -2.159 2.878 77 HD23 LEU 8 HD23 LEU 8 12.331 -2.874 3.696 78 H GLY 9 HN GLY 9 13.145 0.424 0.221 79 HA2 GLY 9 HA2 GLY 9 15.410 -0.636 -1.050 80 HA3 GLY 9 HA1 GLY 9 14.122 0.259 -1.862 81 H LYS 10 HN LYS 10 14.312 2.703 -0.627 82 HA LYS 10 HA LYS 10 16.353 3.989 -2.078 83 HB2 LYS 10 HB2 LYS 10 14.406 5.237 -1.415 84 HB3 LYS 10 HB1 LYS 10 14.686 4.885 0.285 85 HG2 LYS 10 HG2 LYS 10 16.984 6.187 -1.011 86 HG3 LYS 10 HG1 LYS 10 15.521 7.172 -1.019 87 HD2 LYS 10 HD2 LYS 10 15.283 6.894 1.403 88 HD3 LYS 10 HD1 LYS 10 16.699 5.839 1.445 89 HE2 LYS 10 HE2 LYS 10 17.450 8.021 2.108 90 HE3 LYS 10 HE1 LYS 10 18.026 7.775 0.462 91 HZ1 LYS 10 HZ1 LYS 10 15.825 8.905 -0.188 92 HZ2 LYS 10 HZ2 LYS 10 17.096 9.876 0.385 93 HZ3 LYS 10 HZ3 LYS 10 15.804 9.473 1.408 94 H ILE 11 HN ILE 11 16.156 2.846 1.254 95 HA ILE 11 HA ILE 11 18.674 3.965 2.068 96 HB ILE 11 HB ILE 11 17.050 1.742 3.335 97 HG12 ILE 11 HG12 ILE 11 15.911 4.043 2.962 98 HG13 ILE 11 HG11 ILE 11 15.928 3.417 4.608 99 HG21 ILE 11 HG21 ILE 11 18.281 2.757 5.403 100 HG22 ILE 11 HG22 ILE 11 19.402 3.415 4.214 101 HG23 ILE 11 HG23 ILE 11 19.176 1.671 4.346 102 HD11 ILE 11 HD11 ILE 11 17.976 5.372 3.509 103 HD12 ILE 11 HD12 ILE 11 17.855 4.804 5.170 104 HD13 ILE 11 HD13 ILE 11 16.591 5.831 4.500 105 H LEU 12 HN LEU 12 17.600 0.900 0.723 106 HA LEU 12 HA LEU 12 19.806 -0.684 1.337 107 HB2 LEU 12 HB2 LEU 12 17.794 -0.727 -0.864 108 HB3 LEU 12 HB1 LEU 12 19.191 -1.796 -0.964 109 HG LEU 12 HG LEU 12 17.369 -1.637 1.455 110 HD11 LEU 12 HD11 LEU 12 17.435 -3.906 -0.528 111 HD12 LEU 12 HD12 LEU 12 16.360 -2.531 -0.777 112 HD13 LEU 12 HD13 LEU 12 16.200 -3.527 0.670 113 HD21 LEU 12 HD21 LEU 12 19.507 -2.507 2.084 114 HD22 LEU 12 HD22 LEU 12 19.636 -3.468 0.611 115 HD23 LEU 12 HD23 LEU 12 18.473 -3.915 1.858 116 H ARG 13 HN ARG 13 19.366 1.467 -1.453 117 HA ARG 13 HA ARG 13 21.730 0.756 -2.780 118 HB2 ARG 13 HB2 ARG 13 21.304 3.608 -3.004 119 HB3 ARG 13 HB1 ARG 13 21.099 2.370 -4.230 120 HG2 ARG 13 HG2 ARG 13 19.041 2.927 -2.086 121 HG3 ARG 13 HG1 ARG 13 19.002 3.694 -3.671 122 HD2 ARG 13 HD2 ARG 13 18.555 0.812 -2.956 123 HD3 ARG 13 HD1 ARG 13 17.605 1.860 -3.996 124 HE ARG 13 HE ARG 13 20.301 0.971 -4.839 125 HH11 ARG 13 HH11 ARG 13 20.341 0.115 -6.940 126 HH12 ARG 13 HH12 ARG 13 18.865 -0.079 -7.823 127 HH21 ARG 13 HH21 ARG 13 16.858 1.138 -5.267 128 HH22 ARG 13 HH22 ARG 13 16.889 0.496 -6.872 129 H LYS 14 HN LYS 14 21.127 2.848 -0.036 130 HA LYS 14 HA LYS 14 23.795 3.923 0.099 131 HB2 LYS 14 HB2 LYS 14 22.026 3.716 2.514 132 HB3 LYS 14 HB1 LYS 14 23.109 5.019 2.036 133 HG2 LYS 14 HG2 LYS 14 20.556 4.307 0.562 134 HG3 LYS 14 HG1 LYS 14 20.672 5.585 1.773 135 HD2 LYS 14 HD2 LYS 14 21.751 7.012 0.358 136 HD3 LYS 14 HD1 LYS 14 22.753 5.735 -0.333 137 HE2 LYS 14 HE2 LYS 14 21.125 5.141 -1.903 138 HE3 LYS 14 HE1 LYS 14 19.813 5.855 -0.969 139 HZ1 LYS 14 HZ1 LYS 14 20.080 7.464 -2.512 140 HZ2 LYS 14 HZ2 LYS 14 21.726 7.143 -2.765 141 HZ3 LYS 14 HZ3 LYS 14 21.225 8.024 -1.397 142 H ILE 15 HN ILE 15 21.992 1.367 1.757 143 HA ILE 15 HA ILE 15 24.008 0.480 3.480 144 HB ILE 15 HB ILE 15 21.843 -1.133 2.102 145 HG12 ILE 15 HG12 ILE 15 21.091 0.864 3.477 146 HG13 ILE 15 HG11 ILE 15 20.503 -0.689 4.067 147 HG21 ILE 15 HG21 ILE 15 22.166 -2.472 4.329 148 HG22 ILE 15 HG22 ILE 15 23.750 -1.699 4.362 149 HG23 ILE 15 HG23 ILE 15 23.299 -2.735 3.007 150 HD11 ILE 15 HD11 ILE 15 22.399 -0.744 5.693 151 HD12 ILE 15 HD12 ILE 15 21.322 0.625 5.955 152 HD13 ILE 15 HD13 ILE 15 22.873 0.865 5.155 153 H ALA 16 HN ALA 16 23.246 -0.414 0.133 154 HA ALA 16 HA ALA 16 25.160 -2.445 -0.212 155 HB1 ALA 16 HB1 ALA 16 23.343 -1.871 -1.836 156 HB2 ALA 16 HB2 ALA 16 24.928 -2.042 -2.593 157 HB3 ALA 16 HB3 ALA 16 24.260 -0.435 -2.291 158 H ALA 17 HN ALA 17 25.385 1.063 -0.700 159 HA ALA 17 HA ALA 17 28.140 1.012 -1.505 160 HB1 ALA 17 HB1 ALA 17 28.062 3.425 -1.323 161 HB2 ALA 17 HB2 ALA 17 26.588 3.353 -0.358 162 HB3 ALA 17 HB3 ALA 17 26.555 2.879 -2.056 163 H PHE 18 HN PHE 18 26.425 1.647 1.520 164 HA PHE 18 HA PHE 18 28.697 2.315 3.082 165 HB2 PHE 18 HB2 PHE 18 26.607 2.909 3.993 166 HB3 PHE 18 HB1 PHE 18 25.929 1.310 3.718 167 HD1 PHE 18 HD1 PHE 18 25.609 0.029 5.628 168 HD2 PHE 18 HD2 PHE 18 28.918 2.763 5.491 169 HE1 PHE 18 HE1 PHE 18 26.253 -0.637 7.924 170 HE2 PHE 18 HE2 PHE 18 29.565 2.096 7.797 171 HZ PHE 18 HZ PHE 18 28.228 0.389 9.011 172 H LYS 19 HN LYS 19 27.040 -0.767 2.460 173 HA LYS 19 HA LYS 19 28.916 -2.236 4.127 174 HB2 LYS 19 HB2 LYS 19 26.665 -3.101 2.303 175 HB3 LYS 19 HB1 LYS 19 27.689 -4.236 3.186 176 HG2 LYS 19 HG2 LYS 19 27.069 -2.941 5.300 177 HG3 LYS 19 HG1 LYS 19 25.843 -2.125 4.333 178 HD2 LYS 19 HD2 LYS 19 24.455 -3.873 4.612 179 HD3 LYS 19 HD1 LYS 19 25.627 -4.929 3.821 180 HE2 LYS 19 HE2 LYS 19 25.433 -4.271 6.776 181 HE3 LYS 19 HE1 LYS 19 25.245 -5.847 6.009 182 HZ1 LYS 19 HZ2 LYS 19 27.396 -6.102 6.489 183 HZ2 LYS 19 HZ3 LYS 19 27.652 -4.447 6.750 184 HZ3 LYS 19 HZ1 LYS 19 27.698 -5.073 5.176 185 HN1 NH2 20 H1 LYS 19 28.513 -1.535 0.675
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