NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
621560 | 5xdj | 36069 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 1.811 -0.001 0.854 2 HA2 GLY 1 2HA GLY 1 1.821 0.893 -1.802 3 HA3 GLY 1 3HA GLY 1 3.128 0.013 -1.024 4 H ILE 2 H ILE 2 3.472 -2.086 -1.539 5 HA ILE 2 HA ILE 2 2.555 -3.140 -3.918 6 HB ILE 2 HB ILE 2 3.279 -5.390 -2.964 7 HG12 ILE 2 2HG1 ILE 2 4.809 -4.329 -0.806 8 HG13 ILE 2 3HG1 ILE 2 3.127 -3.877 -0.549 9 HG21 ILE 2 1HG2 ILE 2 5.552 -3.588 -2.515 10 HG22 ILE 2 2HG2 ILE 2 5.365 -4.921 -3.654 11 HG23 ILE 2 3HG2 ILE 2 4.688 -3.337 -4.032 12 HD11 ILE 2 1HD1 ILE 2 4.045 -6.116 0.393 13 HD12 ILE 2 2HD1 ILE 2 2.438 -6.055 -0.332 14 HD13 ILE 2 3HD1 ILE 2 3.799 -6.691 -1.256 15 H PHE 3 H PHE 3 1.274 -3.599 -0.660 16 HA PHE 3 HA PHE 3 -0.693 -5.520 -1.470 17 HB2 PHE 3 2HB PHE 3 0.063 -4.140 1.037 18 HB3 PHE 3 3HB PHE 3 -1.622 -4.634 0.912 19 HD1 PHE 3 HD1 PHE 3 1.432 -5.606 2.125 20 HD2 PHE 3 HD2 PHE 3 -1.822 -7.138 -0.151 21 HE1 PHE 3 HE1 PHE 3 2.063 -7.895 2.770 22 HE2 PHE 3 HE2 PHE 3 -1.198 -9.429 0.491 23 HZ PHE 3 HZ PHE 3 0.747 -9.810 1.954 24 H SER 4 H SER 4 -0.514 -2.068 -1.295 25 HA SER 4 HA SER 4 -3.332 -1.583 -1.288 26 HB2 SER 4 2HB SER 4 -1.137 0.294 -2.188 27 HB3 SER 4 3HB SER 4 -2.761 0.732 -1.658 28 HG SER 4 HG SER 4 -2.095 -0.359 0.388 29 H LYS 5 H LYS 5 -0.827 -1.719 -3.780 30 HA LYS 5 HA LYS 5 -2.616 -1.025 -5.910 31 HB2 LYS 5 2HB LYS 5 -0.728 -1.636 -7.382 32 HB3 LYS 5 3HB LYS 5 -0.250 -0.520 -6.109 33 HG2 LYS 5 2HG LYS 5 1.484 -2.000 -6.042 34 HG3 LYS 5 3HG LYS 5 0.402 -2.726 -4.851 35 HD2 LYS 5 2HD LYS 5 0.205 -4.582 -6.067 36 HD3 LYS 5 3HD LYS 5 -0.221 -3.658 -7.509 37 HE2 LYS 5 2HE LYS 5 2.111 -3.308 -8.023 38 HE3 LYS 5 3HE LYS 5 2.595 -4.086 -6.517 39 HZ1 LYS 5 1HZ LYS 5 1.135 -6.015 -7.602 40 HZ2 LYS 5 2HZ LYS 5 2.798 -5.859 -7.867 41 HZ3 LYS 5 3HZ LYS 5 1.701 -5.274 -9.014 42 H LEU 6 H LEU 6 -1.417 -3.999 -4.487 43 HA LEU 6 HA LEU 6 -2.407 -5.717 -6.541 44 HB2 LEU 6 2HB LEU 6 -0.682 -6.648 -5.306 45 HB3 LEU 6 3HB LEU 6 -1.356 -6.105 -3.771 46 HG LEU 6 HG LEU 6 -3.123 -7.822 -3.982 47 HD11 LEU 6 1HD1 LEU 6 -1.525 -8.938 -6.269 48 HD12 LEU 6 2HD1 LEU 6 -2.944 -7.918 -6.505 49 HD13 LEU 6 3HD1 LEU 6 -3.099 -9.464 -5.670 50 HD21 LEU 6 1HD2 LEU 6 -1.693 -9.733 -3.481 51 HD22 LEU 6 2HD2 LEU 6 -1.091 -8.270 -2.700 52 HD23 LEU 6 3HD2 LEU 6 -0.304 -8.881 -4.156 53 H ALA 7 H ALA 7 -3.837 -4.089 -3.900 54 HA ALA 7 HA ALA 7 -5.893 -5.762 -3.113 55 HB1 ALA 7 1HB ALA 7 -6.720 -2.974 -3.415 56 HB2 ALA 7 2HB ALA 7 -6.629 -3.983 -1.971 57 HB3 ALA 7 3HB ALA 7 -5.181 -3.179 -2.578 58 H GLY 8 H GLY 8 -5.593 -3.821 -6.024 59 HA2 GLY 8 2HA GLY 8 -8.262 -3.918 -6.889 60 HA3 GLY 8 3HA GLY 8 -6.862 -3.721 -7.933 61 H LYS 9 H LYS 9 -5.854 -6.374 -6.793 62 HA LYS 9 HA LYS 9 -7.088 -8.011 -8.832 63 HB2 LYS 9 2HB LYS 9 -4.715 -8.198 -8.630 64 HB3 LYS 9 3HB LYS 9 -4.821 -8.485 -6.898 65 HG2 LYS 9 2HG LYS 9 -4.325 -10.495 -8.325 66 HG3 LYS 9 3HG LYS 9 -5.683 -10.658 -7.209 67 HD2 LYS 9 2HD LYS 9 -7.253 -10.260 -9.004 68 HD3 LYS 9 3HD LYS 9 -5.932 -9.952 -10.133 69 HE2 LYS 9 2HE LYS 9 -5.193 -12.371 -9.322 70 HE3 LYS 9 3HE LYS 9 -6.921 -12.516 -9.006 71 HZ1 LYS 9 1HZ LYS 9 -6.301 -13.277 -11.235 72 HZ2 LYS 9 2HZ LYS 9 -5.735 -11.729 -11.612 73 HZ3 LYS 9 3HZ LYS 9 -7.378 -11.974 -11.292 74 H LYS 10 H LYS 10 -6.448 -8.503 -5.354 75 HA LYS 10 HA LYS 10 -7.992 -10.736 -4.944 76 HB2 LYS 10 2HB LYS 10 -6.700 -10.090 -3.118 77 HB3 LYS 10 3HB LYS 10 -7.262 -8.424 -3.182 78 HG2 LYS 10 2HG LYS 10 -8.113 -9.692 -1.237 79 HG3 LYS 10 3HG LYS 10 -9.388 -9.039 -2.268 80 HD2 LYS 10 2HD LYS 10 -10.177 -11.076 -2.744 81 HD3 LYS 10 3HD LYS 10 -8.562 -11.711 -3.069 82 HE2 LYS 10 2HE LYS 10 -8.340 -12.557 -0.992 83 HE3 LYS 10 3HE LYS 10 -9.153 -11.187 -0.237 84 HZ1 LYS 10 1HZ LYS 10 -10.434 -13.501 -1.581 85 HZ2 LYS 10 2HZ LYS 10 -11.275 -12.130 -1.060 86 HZ3 LYS 10 3HZ LYS 10 -10.490 -13.118 0.066 87 H ILE 11 H ILE 11 -9.040 -7.346 -4.817 88 HA ILE 11 HA ILE 11 -11.690 -7.783 -4.055 89 HB ILE 11 HB ILE 11 -12.193 -5.590 -4.982 90 HG12 ILE 11 2HG1 ILE 11 -9.939 -4.491 -5.991 91 HG13 ILE 11 3HG1 ILE 11 -9.742 -6.148 -6.551 92 HG21 ILE 11 1HG2 ILE 11 -11.219 -5.352 -2.904 93 HG22 ILE 11 2HG2 ILE 11 -9.659 -5.966 -3.449 94 HG23 ILE 11 3HG2 ILE 11 -10.176 -4.344 -3.907 95 HD11 ILE 11 1HD1 ILE 11 -11.101 -5.713 -8.233 96 HD12 ILE 11 2HD1 ILE 11 -12.406 -5.392 -7.090 97 HD13 ILE 11 3HD1 ILE 11 -11.359 -4.078 -7.626 98 H LYS 12 H LYS 12 -10.153 -7.926 -7.211 99 HA LYS 12 HA LYS 12 -12.602 -8.154 -8.677 100 HB2 LYS 12 2HB LYS 12 -10.105 -7.494 -9.405 101 HB3 LYS 12 3HB LYS 12 -10.072 -9.200 -9.830 102 HG2 LYS 12 2HG LYS 12 -12.132 -7.231 -10.802 103 HG3 LYS 12 3HG LYS 12 -10.702 -7.732 -11.709 104 HD2 LYS 12 2HD LYS 12 -11.762 -10.139 -11.062 105 HD3 LYS 12 3HD LYS 12 -13.226 -9.162 -11.204 106 HE2 LYS 12 2HE LYS 12 -12.929 -9.941 -13.364 107 HE3 LYS 12 3HE LYS 12 -12.174 -8.349 -13.425 108 HZ1 LYS 12 1HZ LYS 12 -10.126 -9.933 -12.686 109 HZ2 LYS 12 2HZ LYS 12 -10.447 -9.454 -14.276 110 HZ3 LYS 12 3HZ LYS 12 -10.986 -10.958 -13.721 111 H ASN 13 H ASN 13 -10.428 -10.362 -7.097 112 HA ASN 13 HA ASN 13 -11.367 -12.721 -8.412 113 HB2 ASN 13 2HB ASN 13 -9.129 -12.494 -7.285 114 HB3 ASN 13 3HB ASN 13 -9.969 -12.535 -5.738 115 HD21 ASN 13 1HD2 ASN 13 -8.909 -14.414 -5.122 116 HD22 ASN 13 2HD2 ASN 13 -9.299 -15.954 -5.801 117 H LEU 14 H LEU 14 -12.299 -10.911 -5.576 118 HA LEU 14 HA LEU 14 -14.064 -12.979 -4.595 119 HB2 LEU 14 2HB LEU 14 -12.944 -11.537 -3.010 120 HB3 LEU 14 3HB LEU 14 -13.663 -10.112 -3.757 121 HG LEU 14 HG LEU 14 -15.817 -10.651 -2.912 122 HD11 LEU 14 1HD1 LEU 14 -15.774 -13.052 -3.313 123 HD12 LEU 14 2HD1 LEU 14 -16.280 -12.698 -1.662 124 HD13 LEU 14 3HD1 LEU 14 -14.641 -13.266 -1.979 125 HD21 LEU 14 1HD2 LEU 14 -13.757 -11.188 -0.775 126 HD22 LEU 14 2HD2 LEU 14 -15.428 -10.697 -0.498 127 HD23 LEU 14 3HD2 LEU 14 -14.309 -9.601 -1.310 128 H LEU 15 H LEU 15 -14.287 -10.040 -6.483 129 HA LEU 15 HA LEU 15 -17.087 -9.709 -6.369 130 HB2 LEU 15 2HB LEU 15 -15.378 -8.033 -7.156 131 HB3 LEU 15 3HB LEU 15 -15.294 -8.943 -8.663 132 HG LEU 15 HG LEU 15 -17.614 -8.427 -9.140 133 HD11 LEU 15 1HD1 LEU 15 -18.510 -8.399 -6.896 134 HD12 LEU 15 2HD1 LEU 15 -18.865 -6.869 -7.698 135 HD13 LEU 15 3HD1 LEU 15 -17.568 -6.960 -6.506 136 HD21 LEU 15 1HD2 LEU 15 -16.125 -6.834 -10.018 137 HD22 LEU 15 2HD2 LEU 15 -15.836 -6.108 -8.436 138 HD23 LEU 15 3HD2 LEU 15 -17.395 -5.895 -9.233 139 H ILE 16 H ILE 16 -14.989 -11.419 -8.659 140 HA ILE 16 HA ILE 16 -17.105 -12.244 -10.373 141 HB ILE 16 HB ILE 16 -15.467 -13.789 -11.354 142 HG12 ILE 16 2HG1 ILE 16 -13.042 -13.277 -10.280 143 HG13 ILE 16 3HG1 ILE 16 -14.038 -13.175 -8.832 144 HG21 ILE 16 1HG2 ILE 16 -15.511 -11.451 -12.063 145 HG22 ILE 16 2HG2 ILE 16 -14.341 -11.046 -10.808 146 HG23 ILE 16 3HG2 ILE 16 -13.877 -12.110 -12.134 147 HD11 ILE 16 1HD1 ILE 16 -14.697 -15.499 -10.414 148 HD12 ILE 16 2HD1 ILE 16 -12.991 -15.465 -9.966 149 HD13 ILE 16 3HD1 ILE 16 -14.233 -15.377 -8.717 150 H SER 17 H SER 17 -15.544 -13.633 -7.554 151 HA SER 17 HA SER 17 -16.762 -16.210 -7.828 152 HB2 SER 17 2HB SER 17 -15.041 -14.847 -5.832 153 HB3 SER 17 3HB SER 17 -16.049 -16.163 -5.232 154 HG SER 17 HG SER 17 -14.406 -17.301 -5.943 155 H GLY 18 H GLY 18 -17.530 -13.227 -6.139 156 HA2 GLY 18 2HA GLY 18 -19.720 -14.402 -4.667 157 HA3 GLY 18 3HA GLY 18 -19.289 -12.700 -4.718 158 H LEU 19 H LEU 19 -19.301 -13.031 -7.782 159 HA LEU 19 HA LEU 19 -22.171 -12.505 -8.057 160 HB2 LEU 19 2HB LEU 19 -20.950 -10.701 -8.891 161 HB3 LEU 19 3HB LEU 19 -19.753 -11.746 -9.653 162 HG LEU 19 HG LEU 19 -21.399 -12.377 -11.358 163 HD11 LEU 19 1HD1 LEU 19 -23.208 -10.279 -10.193 164 HD12 LEU 19 2HD1 LEU 19 -23.378 -11.997 -9.834 165 HD13 LEU 19 3HD1 LEU 19 -23.551 -11.422 -11.492 166 HD21 LEU 19 1HD2 LEU 19 -21.211 -9.381 -11.098 167 HD22 LEU 19 2HD2 LEU 19 -21.370 -10.324 -12.580 168 HD23 LEU 19 3HD2 LEU 19 -19.883 -10.411 -11.635 169 H LYS 20 H LYS 20 -19.761 -14.802 -8.848 170 HA LYS 20 HA LYS 20 -21.014 -15.918 -11.158 171 HB2 LYS 20 2HB LYS 20 -18.666 -16.285 -10.860 172 HB3 LYS 20 3HB LYS 20 -18.917 -16.975 -9.262 173 HG2 LYS 20 2HG LYS 20 -20.402 -18.429 -11.260 174 HG3 LYS 20 3HG LYS 20 -18.687 -18.345 -11.668 175 HD2 LYS 20 2HD LYS 20 -18.064 -19.314 -9.581 176 HD3 LYS 20 3HD LYS 20 -19.708 -19.170 -8.956 177 HE2 LYS 20 2HE LYS 20 -19.780 -21.355 -9.560 178 HE3 LYS 20 3HE LYS 20 -20.217 -20.649 -11.115 179 HZ1 LYS 20 1HZ LYS 20 -17.373 -20.983 -10.602 180 HZ2 LYS 20 2HZ LYS 20 -18.251 -21.218 -12.028 181 HZ3 LYS 20 3HZ LYS 20 -18.260 -22.406 -10.825 182 H GLY 21 H GLY 21 -21.260 -16.438 -7.706 183 HA2 GLY 21 2HA GLY 21 -22.537 -18.936 -7.709 184 HA3 GLY 21 3HA GLY 21 -22.691 -17.720 -6.450 Start of MODEL 2 1 H1 GLY 1 H GLY 1 1.823 1.721 -2.349 2 HA2 GLY 1 2HA GLY 1 2.903 -0.294 -0.537 3 HA3 GLY 1 3HA GLY 1 1.224 0.212 -0.650 4 H ILE 2 H ILE 2 3.487 -2.151 -1.486 5 HA ILE 2 HA ILE 2 2.575 -3.215 -3.862 6 HB ILE 2 HB ILE 2 3.273 -5.464 -2.885 7 HG12 ILE 2 2HG1 ILE 2 4.799 -4.399 -0.727 8 HG13 ILE 2 3HG1 ILE 2 3.120 -3.930 -0.484 9 HG21 ILE 2 1HG2 ILE 2 5.727 -4.474 -2.558 10 HG22 ILE 2 2HG2 ILE 2 4.953 -4.597 -4.137 11 HG23 ILE 2 3HG2 ILE 2 4.954 -3.060 -3.273 12 HD11 ILE 2 1HD1 ILE 2 2.409 -6.101 -0.256 13 HD12 ILE 2 2HD1 ILE 2 3.775 -6.756 -1.160 14 HD13 ILE 2 3HD1 ILE 2 4.008 -6.166 0.485 15 H PHE 3 H PHE 3 1.269 -3.636 -0.609 16 HA PHE 3 HA PHE 3 -0.709 -5.546 -1.416 17 HB2 PHE 3 2HB PHE 3 0.053 -4.161 1.083 18 HB3 PHE 3 3HB PHE 3 -1.642 -4.620 0.955 19 HD1 PHE 3 HD1 PHE 3 1.384 -5.648 2.191 20 HD2 PHE 3 HD2 PHE 3 -1.891 -7.127 -0.091 21 HE1 PHE 3 HE1 PHE 3 1.962 -7.945 2.856 22 HE2 PHE 3 HE2 PHE 3 -1.318 -9.426 0.571 23 HZ PHE 3 HZ PHE 3 0.610 -9.838 2.047 24 H SER 4 H SER 4 -0.501 -2.094 -1.268 25 HA SER 4 HA SER 4 -3.313 -1.585 -1.282 26 HB2 SER 4 2HB SER 4 -1.096 0.266 -2.183 27 HB3 SER 4 3HB SER 4 -2.719 0.722 -1.668 28 HG SER 4 HG SER 4 -2.158 0.476 0.364 29 H LYS 5 H LYS 5 -0.795 -1.763 -3.757 30 HA LYS 5 HA LYS 5 -2.564 -1.071 -5.905 31 HB2 LYS 5 2HB LYS 5 -0.672 -1.710 -7.359 32 HB3 LYS 5 3HB LYS 5 -0.192 -0.588 -6.093 33 HG2 LYS 5 2HG LYS 5 1.528 -2.083 -6.002 34 HG3 LYS 5 3HG LYS 5 0.432 -2.790 -4.813 35 HD2 LYS 5 2HD LYS 5 0.226 -4.654 -6.015 36 HD3 LYS 5 3HD LYS 5 -0.182 -3.738 -7.467 37 HE2 LYS 5 2HE LYS 5 2.265 -3.308 -7.775 38 HE3 LYS 5 3HE LYS 5 2.569 -4.423 -6.445 39 HZ1 LYS 5 1HZ LYS 5 2.652 -5.311 -8.831 40 HZ2 LYS 5 2HZ LYS 5 0.962 -5.261 -8.772 41 HZ3 LYS 5 3HZ LYS 5 1.819 -6.219 -7.672 42 H LEU 6 H LEU 6 -1.401 -4.043 -4.450 43 HA LEU 6 HA LEU 6 -2.393 -5.769 -6.496 44 HB2 LEU 6 2HB LEU 6 -0.684 -6.705 -5.243 45 HB3 LEU 6 3HB LEU 6 -1.363 -6.144 -3.716 46 HG LEU 6 HG LEU 6 -3.145 -7.847 -3.924 47 HD11 LEU 6 1HD1 LEU 6 -2.951 -7.966 -6.445 48 HD12 LEU 6 2HD1 LEU 6 -3.124 -9.503 -5.599 49 HD13 LEU 6 3HD1 LEU 6 -1.542 -8.996 -6.192 50 HD21 LEU 6 1HD2 LEU 6 -0.441 -9.139 -4.160 51 HD22 LEU 6 2HD2 LEU 6 -1.825 -9.656 -3.197 52 HD23 LEU 6 3HD2 LEU 6 -0.927 -8.207 -2.743 53 H ALA 7 H ALA 7 -3.825 -4.107 -3.878 54 HA ALA 7 HA ALA 7 -5.901 -5.754 -3.090 55 HB1 ALA 7 1HB ALA 7 -6.958 -3.854 -2.237 56 HB2 ALA 7 2HB ALA 7 -5.244 -3.435 -2.225 57 HB3 ALA 7 3HB ALA 7 -6.296 -2.809 -3.494 58 H GLY 8 H GLY 8 -5.564 -3.841 -6.015 59 HA2 GLY 8 2HA GLY 8 -8.229 -3.920 -6.896 60 HA3 GLY 8 3HA GLY 8 -6.820 -3.744 -7.932 61 H LYS 9 H LYS 9 -5.844 -6.398 -6.765 62 HA LYS 9 HA LYS 9 -7.080 -8.039 -8.799 63 HB2 LYS 9 2HB LYS 9 -4.710 -8.246 -8.579 64 HB3 LYS 9 3HB LYS 9 -4.831 -8.518 -6.846 65 HG2 LYS 9 2HG LYS 9 -4.343 -10.544 -8.253 66 HG3 LYS 9 3HG LYS 9 -5.710 -10.686 -7.145 67 HD2 LYS 9 2HD LYS 9 -7.265 -10.288 -8.954 68 HD3 LYS 9 3HD LYS 9 -5.933 -10.001 -10.076 69 HE2 LYS 9 2HE LYS 9 -5.522 -12.199 -10.345 70 HE3 LYS 9 3HE LYS 9 -5.823 -12.566 -8.647 71 HZ1 LYS 9 1HZ LYS 9 -7.467 -13.601 -10.080 72 HZ2 LYS 9 2HZ LYS 9 -7.908 -12.094 -10.710 73 HZ3 LYS 9 3HZ LYS 9 -8.198 -12.447 -9.081 74 H LYS 10 H LYS 10 -6.468 -8.510 -5.313 75 HA LYS 10 HA LYS 10 -8.035 -10.724 -4.895 76 HB2 LYS 10 2HB LYS 10 -6.750 -10.075 -3.066 77 HB3 LYS 10 3HB LYS 10 -7.296 -8.405 -3.147 78 HG2 LYS 10 2HG LYS 10 -8.172 -9.649 -1.198 79 HG3 LYS 10 3HG LYS 10 -9.434 -8.994 -2.243 80 HD2 LYS 10 2HD LYS 10 -10.237 -11.028 -2.709 81 HD3 LYS 10 3HD LYS 10 -8.625 -11.680 -3.015 82 HE2 LYS 10 2HE LYS 10 -8.298 -11.828 -0.547 83 HE3 LYS 10 3HE LYS 10 -9.982 -11.346 -0.342 84 HZ1 LYS 10 1HZ LYS 10 -9.443 -13.820 -0.316 85 HZ2 LYS 10 2HZ LYS 10 -9.245 -13.685 -1.991 86 HZ3 LYS 10 3HZ LYS 10 -10.738 -13.319 -1.284 87 H ILE 11 H ILE 11 -9.053 -7.324 -4.801 88 HA ILE 11 HA ILE 11 -11.711 -7.730 -4.054 89 HB ILE 11 HB ILE 11 -12.188 -5.540 -5.003 90 HG12 ILE 11 2HG1 ILE 11 -9.918 -4.471 -6.006 91 HG13 ILE 11 3HG1 ILE 11 -9.733 -6.134 -6.551 92 HG21 ILE 11 1HG2 ILE 11 -10.166 -4.304 -3.927 93 HG22 ILE 11 2HG2 ILE 11 -11.226 -5.291 -2.922 94 HG23 ILE 11 3HG2 ILE 11 -9.668 -5.927 -3.449 95 HD11 ILE 11 1HD1 ILE 11 -12.366 -5.459 -7.153 96 HD12 ILE 11 2HD1 ILE 11 -11.405 -4.044 -7.585 97 HD13 ILE 11 3HD1 ILE 11 -11.015 -5.620 -8.275 98 H LYS 12 H LYS 12 -10.155 -7.913 -7.199 99 HA LYS 12 HA LYS 12 -12.595 -8.130 -8.680 100 HB2 LYS 12 2HB LYS 12 -10.083 -7.507 -9.394 101 HB3 LYS 12 3HB LYS 12 -10.072 -9.217 -9.807 102 HG2 LYS 12 2HG LYS 12 -12.091 -7.220 -10.809 103 HG3 LYS 12 3HG LYS 12 -10.668 -7.761 -11.703 104 HD2 LYS 12 2HD LYS 12 -11.776 -10.139 -11.042 105 HD3 LYS 12 3HD LYS 12 -13.222 -9.136 -11.186 106 HE2 LYS 12 2HE LYS 12 -13.002 -9.836 -13.352 107 HE3 LYS 12 3HE LYS 12 -12.047 -8.355 -13.410 108 HZ1 LYS 12 1HZ LYS 12 -10.588 -10.743 -12.657 109 HZ2 LYS 12 2HZ LYS 12 -10.149 -9.490 -13.705 110 HZ3 LYS 12 3HZ LYS 12 -11.165 -10.728 -14.248 111 H ASN 13 H ASN 13 -10.454 -10.349 -7.070 112 HA ASN 13 HA ASN 13 -11.411 -12.709 -8.368 113 HB2 ASN 13 2HB ASN 13 -9.178 -12.464 -7.200 114 HB3 ASN 13 3HB ASN 13 -10.053 -12.547 -5.674 115 HD21 ASN 13 1HD2 ASN 13 -9.733 -14.295 -8.741 116 HD22 ASN 13 2HD2 ASN 13 -9.812 -15.875 -8.045 117 H LEU 14 H LEU 14 -12.322 -10.881 -5.528 118 HA LEU 14 HA LEU 14 -14.119 -12.914 -4.546 119 HB2 LEU 14 2HB LEU 14 -13.007 -11.460 -2.970 120 HB3 LEU 14 3HB LEU 14 -13.700 -10.038 -3.748 121 HG LEU 14 HG LEU 14 -15.872 -10.542 -2.924 122 HD11 LEU 14 1HD1 LEU 14 -16.368 -12.558 -1.637 123 HD12 LEU 14 2HD1 LEU 14 -14.729 -13.146 -1.920 124 HD13 LEU 14 3HD1 LEU 14 -15.842 -12.953 -3.274 125 HD21 LEU 14 1HD2 LEU 14 -15.559 -10.179 -0.658 126 HD22 LEU 14 2HD2 LEU 14 -14.025 -9.647 -1.346 127 HD23 LEU 14 3HD2 LEU 14 -14.146 -11.231 -0.578 128 H LEU 15 H LEU 15 -14.314 -9.995 -6.471 129 HA LEU 15 HA LEU 15 -17.113 -9.653 -6.385 130 HB2 LEU 15 2HB LEU 15 -15.392 -7.992 -7.177 131 HB3 LEU 15 3HB LEU 15 -15.297 -8.920 -8.672 132 HG LEU 15 HG LEU 15 -17.611 -8.402 -9.177 133 HD11 LEU 15 1HD1 LEU 15 -17.585 -6.911 -6.557 134 HD12 LEU 15 2HD1 LEU 15 -18.532 -8.346 -6.947 135 HD13 LEU 15 3HD1 LEU 15 -18.868 -6.820 -7.764 136 HD21 LEU 15 1HD2 LEU 15 -17.051 -6.436 -10.076 137 HD22 LEU 15 2HD2 LEU 15 -15.500 -6.646 -9.263 138 HD23 LEU 15 3HD2 LEU 15 -16.774 -5.694 -8.500 139 H ILE 16 H ILE 16 -15.002 -11.398 -8.636 140 HA ILE 16 HA ILE 16 -17.106 -12.233 -10.361 141 HB ILE 16 HB ILE 16 -15.461 -13.814 -11.292 142 HG12 ILE 16 2HG1 ILE 16 -13.688 -12.790 -9.064 143 HG13 ILE 16 3HG1 ILE 16 -14.307 -14.429 -9.229 144 HG21 ILE 16 1HG2 ILE 16 -14.631 -12.142 -12.503 145 HG22 ILE 16 2HG2 ILE 16 -15.400 -11.041 -11.360 146 HG23 ILE 16 3HG2 ILE 16 -13.716 -11.514 -11.132 147 HD11 ILE 16 1HD1 ILE 16 -13.059 -14.266 -11.555 148 HD12 ILE 16 2HD1 ILE 16 -12.108 -13.073 -10.670 149 HD13 ILE 16 3HD1 ILE 16 -12.226 -14.727 -10.070 150 H SER 17 H SER 17 -15.593 -13.587 -7.501 151 HA SER 17 HA SER 17 -16.818 -16.164 -7.758 152 HB2 SER 17 2HB SER 17 -15.114 -14.783 -5.758 153 HB3 SER 17 3HB SER 17 -16.135 -16.088 -5.154 154 HG SER 17 HG SER 17 -15.204 -17.417 -6.814 155 H GLY 18 H GLY 18 -17.589 -13.156 -6.117 156 HA2 GLY 18 2HA GLY 18 -19.803 -14.299 -4.656 157 HA3 GLY 18 3HA GLY 18 -19.361 -12.600 -4.724 158 H LEU 19 H LEU 19 -19.340 -12.972 -7.784 159 HA LEU 19 HA LEU 19 -22.203 -12.434 -8.099 160 HB2 LEU 19 2HB LEU 19 -20.961 -10.649 -8.943 161 HB3 LEU 19 3HB LEU 19 -19.763 -11.712 -9.678 162 HG LEU 19 HG LEU 19 -21.393 -12.356 -11.393 163 HD11 LEU 19 1HD1 LEU 19 -23.387 -11.943 -9.897 164 HD12 LEU 19 2HD1 LEU 19 -23.538 -11.388 -11.564 165 HD13 LEU 19 3HD1 LEU 19 -23.202 -10.230 -10.276 166 HD21 LEU 19 1HD2 LEU 19 -21.191 -9.358 -11.172 167 HD22 LEU 19 2HD2 LEU 19 -21.338 -10.320 -12.642 168 HD23 LEU 19 3HD2 LEU 19 -19.863 -10.402 -11.678 169 H LYS 20 H LYS 20 -19.798 -14.756 -8.832 170 HA LYS 20 HA LYS 20 -21.032 -15.896 -11.139 171 HB2 LYS 20 2HB LYS 20 -18.683 -16.262 -10.793 172 HB3 LYS 20 3HB LYS 20 -18.971 -16.956 -9.203 173 HG2 LYS 20 2HG LYS 20 -20.438 -18.410 -11.197 174 HG3 LYS 20 3HG LYS 20 -18.733 -18.303 -11.640 175 HD2 LYS 20 2HD LYS 20 -18.503 -18.900 -9.023 176 HD3 LYS 20 3HD LYS 20 -20.030 -19.707 -9.388 177 HE2 LYS 20 2HE LYS 20 -18.212 -20.264 -11.497 178 HE3 LYS 20 3HE LYS 20 -17.381 -20.560 -9.970 179 HZ1 LYS 20 1HZ LYS 20 -19.846 -21.824 -10.996 180 HZ2 LYS 20 2HZ LYS 20 -19.468 -21.853 -9.347 181 HZ3 LYS 20 3HZ LYS 20 -18.420 -22.565 -10.468 182 H GLY 21 H GLY 21 -20.494 -17.540 -8.030 183 HA2 GLY 21 2HA GLY 21 -23.031 -18.953 -8.422 184 HA3 GLY 21 3HA GLY 21 -21.747 -19.422 -7.317 Start of MODEL 3 1 H1 GLY 1 H GLY 1 3.741 -0.209 -0.100 2 HA2 GLY 1 2HA GLY 1 1.130 0.439 -1.129 3 HA3 GLY 1 3HA GLY 1 2.660 0.607 -1.978 4 H ILE 2 H ILE 2 3.414 -2.188 -1.517 5 HA ILE 2 HA ILE 2 2.546 -3.338 -3.869 6 HB ILE 2 HB ILE 2 3.183 -5.554 -2.781 7 HG12 ILE 2 2HG1 ILE 2 4.671 -4.420 -0.631 8 HG13 ILE 2 3HG1 ILE 2 2.993 -3.918 -0.451 9 HG21 ILE 2 1HG2 ILE 2 5.274 -3.399 -2.587 10 HG22 ILE 2 2HG2 ILE 2 5.505 -5.103 -2.975 11 HG23 ILE 2 3HG2 ILE 2 4.683 -4.042 -4.119 12 HD11 ILE 2 1HD1 ILE 2 3.619 -6.779 -0.993 13 HD12 ILE 2 2HD1 ILE 2 3.823 -6.125 0.632 14 HD13 ILE 2 3HD1 ILE 2 2.244 -6.066 -0.151 15 H PHE 3 H PHE 3 1.152 -3.604 -0.636 16 HA PHE 3 HA PHE 3 -0.835 -5.517 -1.412 17 HB2 PHE 3 2HB PHE 3 -0.413 -3.831 1.048 18 HB3 PHE 3 3HB PHE 3 -1.846 -4.834 0.850 19 HD1 PHE 3 HD1 PHE 3 0.964 -4.791 2.611 20 HD2 PHE 3 HD2 PHE 3 -0.896 -7.271 -0.306 21 HE1 PHE 3 HE1 PHE 3 2.211 -6.731 3.470 22 HE2 PHE 3 HE2 PHE 3 0.347 -9.215 0.549 23 HZ PHE 3 HZ PHE 3 1.902 -8.946 2.440 24 H SER 4 H SER 4 -0.577 -2.065 -1.406 25 HA SER 4 HA SER 4 -3.380 -1.515 -1.516 26 HB2 SER 4 2HB SER 4 -1.108 0.260 -2.434 27 HB3 SER 4 3HB SER 4 -2.739 0.764 -1.990 28 HG SER 4 HG SER 4 -2.004 0.931 -0.040 29 H LYS 5 H LYS 5 -0.803 -1.837 -3.915 30 HA LYS 5 HA LYS 5 -2.508 -1.215 -6.135 31 HB2 LYS 5 2HB LYS 5 -0.590 -1.938 -7.512 32 HB3 LYS 5 3HB LYS 5 -0.126 -0.770 -6.282 33 HG2 LYS 5 2HG LYS 5 1.571 -2.280 -6.085 34 HG3 LYS 5 3HG LYS 5 0.437 -2.923 -4.895 35 HD2 LYS 5 2HD LYS 5 0.235 -4.833 -6.023 36 HD3 LYS 5 3HD LYS 5 -0.124 -3.974 -7.522 37 HE2 LYS 5 2HE LYS 5 2.690 -4.090 -6.536 38 HE3 LYS 5 3HE LYS 5 1.996 -5.502 -7.331 39 HZ1 LYS 5 1HZ LYS 5 1.750 -4.368 -9.314 40 HZ2 LYS 5 2HZ LYS 5 3.224 -3.766 -8.743 41 HZ3 LYS 5 3HZ LYS 5 1.816 -2.841 -8.588 42 H LEU 6 H LEU 6 -1.422 -4.136 -4.525 43 HA LEU 6 HA LEU 6 -2.385 -5.936 -6.520 44 HB2 LEU 6 2HB LEU 6 -0.719 -6.837 -5.186 45 HB3 LEU 6 3HB LEU 6 -1.428 -6.204 -3.702 46 HG LEU 6 HG LEU 6 -3.218 -7.894 -3.867 47 HD11 LEU 6 1HD1 LEU 6 -3.220 -9.597 -5.486 48 HD12 LEU 6 2HD1 LEU 6 -1.612 -9.163 -6.066 49 HD13 LEU 6 3HD1 LEU 6 -2.982 -8.100 -6.388 50 HD21 LEU 6 1HD2 LEU 6 -1.099 -8.274 -2.598 51 HD22 LEU 6 2HD2 LEU 6 -0.481 -9.147 -4.000 52 HD23 LEU 6 3HD2 LEU 6 -1.900 -9.748 -3.142 53 H ALA 7 H ALA 7 -3.861 -4.140 -4.020 54 HA ALA 7 HA ALA 7 -5.971 -5.717 -3.194 55 HB1 ALA 7 1HB ALA 7 -7.210 -3.582 -2.861 56 HB2 ALA 7 2HB ALA 7 -5.581 -3.581 -2.184 57 HB3 ALA 7 3HB ALA 7 -5.904 -2.748 -3.704 58 H GLY 8 H GLY 8 -5.607 -3.896 -6.192 59 HA2 GLY 8 2HA GLY 8 -8.230 -4.057 -7.139 60 HA3 GLY 8 3HA GLY 8 -6.798 -3.944 -8.152 61 H LYS 9 H LYS 9 -5.851 -6.526 -6.821 62 HA LYS 9 HA LYS 9 -7.052 -8.279 -8.782 63 HB2 LYS 9 2HB LYS 9 -4.547 -8.129 -7.907 64 HB3 LYS 9 3HB LYS 9 -5.142 -9.286 -6.724 65 HG2 LYS 9 2HG LYS 9 -5.090 -9.585 -9.715 66 HG3 LYS 9 3HG LYS 9 -4.181 -10.510 -8.518 67 HD2 LYS 9 2HD LYS 9 -6.284 -11.424 -7.644 68 HD3 LYS 9 3HD LYS 9 -7.180 -10.513 -8.861 69 HE2 LYS 9 2HE LYS 9 -5.187 -11.936 -10.241 70 HE3 LYS 9 3HE LYS 9 -5.888 -13.066 -9.083 71 HZ1 LYS 9 1HZ LYS 9 -8.070 -11.870 -10.094 72 HZ2 LYS 9 2HZ LYS 9 -7.437 -13.335 -10.655 73 HZ3 LYS 9 3HZ LYS 9 -7.054 -11.891 -11.447 74 H LYS 10 H LYS 10 -6.462 -8.622 -5.278 75 HA LYS 10 HA LYS 10 -8.070 -10.784 -4.778 76 HB2 LYS 10 2HB LYS 10 -6.787 -10.081 -2.967 77 HB3 LYS 10 3HB LYS 10 -7.306 -8.407 -3.120 78 HG2 LYS 10 2HG LYS 10 -8.213 -9.554 -1.127 79 HG3 LYS 10 3HG LYS 10 -9.460 -8.927 -2.209 80 HD2 LYS 10 2HD LYS 10 -10.287 -10.968 -2.594 81 HD3 LYS 10 3HD LYS 10 -8.682 -11.655 -2.857 82 HE2 LYS 10 2HE LYS 10 -8.404 -12.191 -0.628 83 HE3 LYS 10 3HE LYS 10 -9.561 -10.978 -0.084 84 HZ1 LYS 10 1HZ LYS 10 -10.305 -13.359 0.062 85 HZ2 LYS 10 2HZ LYS 10 -10.370 -13.372 -1.628 86 HZ3 LYS 10 3HZ LYS 10 -11.359 -12.316 -0.752 87 H ILE 11 H ILE 11 -9.041 -7.369 -4.826 88 HA ILE 11 HA ILE 11 -11.706 -7.702 -4.075 89 HB ILE 11 HB ILE 11 -12.149 -5.552 -5.124 90 HG12 ILE 11 2HG1 ILE 11 -9.867 -4.562 -6.177 91 HG13 ILE 11 3HG1 ILE 11 -9.700 -6.252 -6.640 92 HG21 ILE 11 1HG2 ILE 11 -10.111 -4.295 -4.106 93 HG22 ILE 11 2HG2 ILE 11 -11.181 -5.223 -3.056 94 HG23 ILE 11 3HG2 ILE 11 -9.631 -5.900 -3.556 95 HD11 ILE 11 1HD1 ILE 11 -12.326 -5.571 -7.276 96 HD12 ILE 11 2HD1 ILE 11 -11.342 -4.198 -7.783 97 HD13 ILE 11 3HD1 ILE 11 -10.979 -5.814 -8.387 98 H LYS 12 H LYS 12 -10.145 -8.052 -7.204 99 HA LYS 12 HA LYS 12 -12.585 -8.304 -8.681 100 HB2 LYS 12 2HB LYS 12 -10.057 -7.756 -9.411 101 HB3 LYS 12 3HB LYS 12 -10.079 -9.481 -9.753 102 HG2 LYS 12 2HG LYS 12 -12.042 -7.476 -10.847 103 HG3 LYS 12 3HG LYS 12 -10.642 -8.113 -11.713 104 HD2 LYS 12 2HD LYS 12 -11.824 -10.414 -10.945 105 HD3 LYS 12 3HD LYS 12 -13.240 -9.374 -11.111 106 HE2 LYS 12 2HE LYS 12 -13.047 -9.254 -13.353 107 HE3 LYS 12 3HE LYS 12 -11.286 -9.189 -13.301 108 HZ1 LYS 12 1HZ LYS 12 -12.670 -11.295 -14.167 109 HZ2 LYS 12 2HZ LYS 12 -12.464 -11.728 -12.545 110 HZ3 LYS 12 3HZ LYS 12 -11.114 -11.405 -13.511 111 H ASN 13 H ASN 13 -10.464 -10.480 -6.979 112 HA ASN 13 HA ASN 13 -11.463 -12.881 -8.163 113 HB2 ASN 13 2HB ASN 13 -9.230 -12.449 -6.864 114 HB3 ASN 13 3HB ASN 13 -10.205 -12.808 -5.442 115 HD21 ASN 13 1HD2 ASN 13 -11.186 -14.877 -5.278 116 HD22 ASN 13 2HD2 ASN 13 -10.521 -16.233 -6.116 117 H LEU 14 H LEU 14 -12.333 -10.918 -5.401 118 HA LEU 14 HA LEU 14 -14.145 -12.873 -4.307 119 HB2 LEU 14 2HB LEU 14 -13.014 -11.313 -2.837 120 HB3 LEU 14 3HB LEU 14 -13.739 -9.951 -3.687 121 HG LEU 14 HG LEU 14 -15.884 -10.418 -2.796 122 HD11 LEU 14 1HD1 LEU 14 -16.352 -12.380 -1.410 123 HD12 LEU 14 2HD1 LEU 14 -14.722 -12.981 -1.713 124 HD13 LEU 14 3HD1 LEU 14 -15.869 -12.837 -3.044 125 HD21 LEU 14 1HD2 LEU 14 -15.077 -10.849 -0.237 126 HD22 LEU 14 2HD2 LEU 14 -15.028 -9.288 -1.056 127 HD23 LEU 14 3HD2 LEU 14 -13.579 -10.293 -0.985 128 H LEU 15 H LEU 15 -14.344 -10.047 -6.376 129 HA LEU 15 HA LEU 15 -17.136 -9.698 -6.316 130 HB2 LEU 15 2HB LEU 15 -15.403 -8.106 -7.222 131 HB3 LEU 15 3HB LEU 15 -15.333 -9.126 -8.658 132 HG LEU 15 HG LEU 15 -17.650 -8.616 -9.166 133 HD11 LEU 15 1HD1 LEU 15 -18.864 -6.923 -7.841 134 HD12 LEU 15 2HD1 LEU 15 -17.570 -6.967 -6.645 135 HD13 LEU 15 3HD1 LEU 15 -18.547 -8.405 -6.939 136 HD21 LEU 15 1HD2 LEU 15 -16.251 -7.101 -10.218 137 HD22 LEU 15 2HD2 LEU 15 -15.755 -6.348 -8.702 138 HD23 LEU 15 3HD2 LEU 15 -17.368 -6.048 -9.349 139 H ILE 16 H ILE 16 -15.048 -11.587 -8.473 140 HA ILE 16 HA ILE 16 -17.136 -12.508 -10.153 141 HB ILE 16 HB ILE 16 -14.819 -12.558 -10.897 142 HG12 ILE 16 2HG1 ILE 16 -16.237 -15.210 -10.695 143 HG13 ILE 16 3HG1 ILE 16 -16.198 -14.094 -12.056 144 HG21 ILE 16 1HG2 ILE 16 -13.864 -13.090 -8.652 145 HG22 ILE 16 2HG2 ILE 16 -14.358 -14.764 -8.899 146 HG23 ILE 16 3HG2 ILE 16 -13.174 -14.026 -9.977 147 HD11 ILE 16 1HD1 ILE 16 -14.838 -15.976 -12.580 148 HD12 ILE 16 2HD1 ILE 16 -13.775 -14.596 -12.303 149 HD13 ILE 16 3HD1 ILE 16 -13.958 -15.832 -11.059 150 H SER 17 H SER 17 -15.641 -13.779 -7.225 151 HA SER 17 HA SER 17 -16.984 -16.295 -7.310 152 HB2 SER 17 2HB SER 17 -15.253 -14.846 -5.383 153 HB3 SER 17 3HB SER 17 -16.327 -16.070 -4.707 154 HG SER 17 HG SER 17 -14.887 -17.442 -5.360 155 H GLY 18 H GLY 18 -17.662 -13.163 -5.865 156 HA2 GLY 18 2HA GLY 18 -19.928 -14.129 -4.361 157 HA3 GLY 18 3HA GLY 18 -19.433 -12.453 -4.546 158 H LEU 19 H LEU 19 -19.398 -13.043 -7.571 159 HA LEU 19 HA LEU 19 -22.237 -12.435 -7.955 160 HB2 LEU 19 2HB LEU 19 -20.930 -10.766 -8.923 161 HB3 LEU 19 3HB LEU 19 -19.760 -11.921 -9.557 162 HG LEU 19 HG LEU 19 -21.394 -12.646 -11.236 163 HD11 LEU 19 1HD1 LEU 19 -23.138 -10.374 -10.325 164 HD12 LEU 19 2HD1 LEU 19 -23.386 -12.039 -9.799 165 HD13 LEU 19 3HD1 LEU 19 -23.502 -11.628 -11.510 166 HD21 LEU 19 1HD2 LEU 19 -21.254 -10.718 -12.642 167 HD22 LEU 19 2HD2 LEU 19 -19.791 -10.780 -11.660 168 HD23 LEU 19 3HD2 LEU 19 -21.081 -9.649 -11.250 169 H LYS 20 H LYS 20 -19.922 -14.898 -8.470 170 HA LYS 20 HA LYS 20 -21.171 -16.165 -10.703 171 HB2 LYS 20 2HB LYS 20 -18.939 -16.739 -8.868 172 HB3 LYS 20 3HB LYS 20 -19.765 -18.163 -9.489 173 HG2 LYS 20 2HG LYS 20 -19.392 -17.362 -11.780 174 HG3 LYS 20 3HG LYS 20 -18.522 -15.968 -11.135 175 HD2 LYS 20 2HD LYS 20 -16.652 -17.156 -10.882 176 HD3 LYS 20 3HD LYS 20 -17.511 -18.448 -10.040 177 HE2 LYS 20 2HE LYS 20 -16.486 -19.332 -12.036 178 HE3 LYS 20 3HE LYS 20 -18.239 -19.338 -12.225 179 HZ1 LYS 20 1HZ LYS 20 -17.954 -18.204 -14.089 180 HZ2 LYS 20 2HZ LYS 20 -16.290 -18.060 -13.821 181 HZ3 LYS 20 3HZ LYS 20 -17.350 -16.902 -13.193 182 H GLY 21 H GLY 21 -20.718 -17.643 -7.504 183 HA2 GLY 21 2HA GLY 21 -22.955 -19.344 -7.771 184 HA3 GLY 21 3HA GLY 21 -22.085 -19.021 -6.279 Start of MODEL 4 1 H1 GLY 1 H GLY 1 2.229 -0.168 0.642 2 HA2 GLY 1 2HA GLY 1 1.583 0.883 -1.931 3 HA3 GLY 1 3HA GLY 1 3.122 0.184 -1.451 4 H ILE 2 H ILE 2 3.416 -2.092 -1.622 5 HA ILE 2 HA ILE 2 2.525 -3.239 -3.968 6 HB ILE 2 HB ILE 2 3.183 -5.455 -2.894 7 HG12 ILE 2 2HG1 ILE 2 4.691 -4.323 -0.757 8 HG13 ILE 2 3HG1 ILE 2 3.014 -3.826 -0.557 9 HG21 ILE 2 1HG2 ILE 2 4.710 -4.183 -4.273 10 HG22 ILE 2 2HG2 ILE 2 5.142 -3.164 -2.901 11 HG23 ILE 2 3HG2 ILE 2 5.577 -4.873 -2.902 12 HD11 ILE 2 1HD1 ILE 2 3.866 -6.036 0.508 13 HD12 ILE 2 2HD1 ILE 2 2.276 -5.978 -0.253 14 HD13 ILE 2 3HD1 ILE 2 3.642 -6.684 -1.117 15 H PHE 3 H PHE 3 1.169 -3.519 -0.720 16 HA PHE 3 HA PHE 3 -0.819 -5.437 -1.480 17 HB2 PHE 3 2HB PHE 3 -0.280 -3.808 0.980 18 HB3 PHE 3 3HB PHE 3 -1.811 -4.659 0.808 19 HD1 PHE 3 HD1 PHE 3 1.118 -4.904 2.419 20 HD2 PHE 3 HD2 PHE 3 -1.228 -7.181 -0.306 21 HE1 PHE 3 HE1 PHE 3 2.181 -6.968 3.234 22 HE2 PHE 3 HE2 PHE 3 -0.169 -9.249 0.504 23 HZ PHE 3 HZ PHE 3 1.537 -9.144 2.277 24 H SER 4 H SER 4 -0.574 -1.985 -1.465 25 HA SER 4 HA SER 4 -3.380 -1.446 -1.541 26 HB2 SER 4 2HB SER 4 -1.127 0.342 -2.481 27 HB3 SER 4 3HB SER 4 -2.754 0.838 -2.013 28 HG SER 4 HG SER 4 -2.115 0.872 -0.021 29 H LYS 5 H LYS 5 -0.829 -1.750 -3.971 30 HA LYS 5 HA LYS 5 -2.562 -1.127 -6.169 31 HB2 LYS 5 2HB LYS 5 -0.657 -1.838 -7.570 32 HB3 LYS 5 3HB LYS 5 -0.183 -0.672 -6.342 33 HG2 LYS 5 2HG LYS 5 1.522 -2.177 -6.169 34 HG3 LYS 5 3HG LYS 5 0.403 -2.828 -4.968 35 HD2 LYS 5 2HD LYS 5 0.196 -4.735 -6.100 36 HD3 LYS 5 3HD LYS 5 -0.184 -3.872 -7.593 37 HE2 LYS 5 2HE LYS 5 1.753 -4.831 -8.270 38 HE3 LYS 5 3HE LYS 5 2.448 -3.410 -7.491 39 HZ1 LYS 5 1HZ LYS 5 2.745 -6.151 -6.811 40 HZ2 LYS 5 2HZ LYS 5 2.145 -5.278 -5.492 41 HZ3 LYS 5 3HZ LYS 5 3.593 -4.807 -6.229 42 H LEU 6 H LEU 6 -1.446 -4.049 -4.581 43 HA LEU 6 HA LEU 6 -2.425 -5.846 -6.572 44 HB2 LEU 6 2HB LEU 6 -0.742 -6.746 -5.259 45 HB3 LEU 6 3HB LEU 6 -1.436 -6.119 -3.765 46 HG LEU 6 HG LEU 6 -3.221 -7.815 -3.916 47 HD11 LEU 6 1HD1 LEU 6 -3.242 -9.508 -5.541 48 HD12 LEU 6 2HD1 LEU 6 -1.638 -9.078 -6.133 49 HD13 LEU 6 3HD1 LEU 6 -3.007 -8.010 -6.442 50 HD21 LEU 6 1HD2 LEU 6 -1.842 -9.723 -3.311 51 HD22 LEU 6 2HD2 LEU 6 -1.186 -8.241 -2.615 52 HD23 LEU 6 3HD2 LEU 6 -0.431 -8.956 -4.041 53 H ALA 7 H ALA 7 -3.880 -4.064 -4.049 54 HA ALA 7 HA ALA 7 -5.975 -5.651 -3.205 55 HB1 ALA 7 1HB ALA 7 -7.031 -3.706 -2.473 56 HB2 ALA 7 2HB ALA 7 -5.320 -3.277 -2.482 57 HB3 ALA 7 3HB ALA 7 -6.371 -2.738 -3.791 58 H GLY 8 H GLY 8 -5.651 -3.818 -6.199 59 HA2 GLY 8 2HA GLY 8 -8.284 -3.986 -7.118 60 HA3 GLY 8 3HA GLY 8 -6.864 -3.863 -8.146 61 H LYS 9 H LYS 9 -5.892 -6.447 -6.836 62 HA LYS 9 HA LYS 9 -7.108 -8.197 -8.790 63 HB2 LYS 9 2HB LYS 9 -4.594 -8.039 -7.944 64 HB3 LYS 9 3HB LYS 9 -5.171 -9.204 -6.759 65 HG2 LYS 9 2HG LYS 9 -5.151 -9.491 -9.751 66 HG3 LYS 9 3HG LYS 9 -4.225 -10.417 -8.568 67 HD2 LYS 9 2HD LYS 9 -6.315 -11.343 -7.673 68 HD3 LYS 9 3HD LYS 9 -7.228 -10.431 -8.878 69 HE2 LYS 9 2HE LYS 9 -7.012 -12.640 -9.712 70 HE3 LYS 9 3HE LYS 9 -5.898 -11.637 -10.640 71 HZ1 LYS 9 1HZ LYS 9 -5.175 -13.931 -9.587 72 HZ2 LYS 9 2HZ LYS 9 -4.848 -12.947 -8.251 73 HZ3 LYS 9 3HZ LYS 9 -4.095 -12.637 -9.734 74 H LYS 10 H LYS 10 -6.477 -8.551 -5.294 75 HA LYS 10 HA LYS 10 -8.070 -10.721 -4.784 76 HB2 LYS 10 2HB LYS 10 -6.769 -10.020 -2.986 77 HB3 LYS 10 3HB LYS 10 -7.297 -8.348 -3.126 78 HG2 LYS 10 2HG LYS 10 -8.177 -9.506 -1.128 79 HG3 LYS 10 3HG LYS 10 -9.438 -8.880 -2.192 80 HD2 LYS 10 2HD LYS 10 -10.261 -10.923 -2.577 81 HD3 LYS 10 3HD LYS 10 -8.657 -11.602 -2.860 82 HE2 LYS 10 2HE LYS 10 -9.601 -10.959 -0.088 83 HE3 LYS 10 3HE LYS 10 -10.040 -12.478 -0.867 84 HZ1 LYS 10 1HZ LYS 10 -7.335 -11.504 -0.169 85 HZ2 LYS 10 2HZ LYS 10 -7.578 -12.778 -1.254 86 HZ3 LYS 10 3HZ LYS 10 -8.103 -12.920 0.348 87 H ILE 11 H ILE 11 -9.055 -7.311 -4.808 88 HA ILE 11 HA ILE 11 -11.711 -7.657 -4.029 89 HB ILE 11 HB ILE 11 -12.174 -5.505 -5.065 90 HG12 ILE 11 2HG1 ILE 11 -9.908 -4.501 -6.139 91 HG13 ILE 11 3HG1 ILE 11 -9.739 -6.189 -6.610 92 HG21 ILE 11 1HG2 ILE 11 -11.184 -5.183 -3.005 93 HG22 ILE 11 2HG2 ILE 11 -9.638 -5.849 -3.526 94 HG23 ILE 11 3HG2 ILE 11 -10.131 -4.243 -4.062 95 HD11 ILE 11 1HD1 ILE 11 -11.137 -5.868 -8.286 96 HD12 ILE 11 2HD1 ILE 11 -12.399 -5.358 -7.164 97 HD13 ILE 11 3HD1 ILE 11 -11.279 -4.170 -7.831 98 H LYS 12 H LYS 12 -10.184 -7.988 -7.177 99 HA LYS 12 HA LYS 12 -12.639 -8.245 -8.627 100 HB2 LYS 12 2HB LYS 12 -10.123 -7.682 -9.384 101 HB3 LYS 12 3HB LYS 12 -10.141 -9.406 -9.732 102 HG2 LYS 12 2HG LYS 12 -12.127 -7.408 -10.795 103 HG3 LYS 12 3HG LYS 12 -10.733 -8.032 -11.680 104 HD2 LYS 12 2HD LYS 12 -11.893 -10.344 -10.908 105 HD3 LYS 12 3HD LYS 12 -13.317 -9.311 -11.055 106 HE2 LYS 12 2HE LYS 12 -11.701 -8.799 -13.307 107 HE3 LYS 12 3HE LYS 12 -11.756 -10.550 -13.112 108 HZ1 LYS 12 1HZ LYS 12 -13.880 -8.694 -13.807 109 HZ2 LYS 12 2HZ LYS 12 -14.314 -9.944 -12.753 110 HZ3 LYS 12 3HZ LYS 12 -13.655 -10.306 -14.269 111 H ASN 13 H ASN 13 -10.490 -10.418 -6.957 112 HA ASN 13 HA ASN 13 -11.492 -12.819 -8.140 113 HB2 ASN 13 2HB ASN 13 -9.295 -12.217 -6.638 114 HB3 ASN 13 3HB ASN 13 -10.316 -13.013 -5.444 115 HD21 ASN 13 1HD2 ASN 13 -9.468 -13.458 -8.865 116 HD22 ASN 13 2HD2 ASN 13 -9.153 -15.152 -8.740 117 H LEU 14 H LEU 14 -12.342 -10.867 -5.365 118 HA LEU 14 HA LEU 14 -14.131 -12.836 -4.257 119 HB2 LEU 14 2HB LEU 14 -12.985 -11.275 -2.796 120 HB3 LEU 14 3HB LEU 14 -13.736 -9.914 -3.627 121 HG LEU 14 HG LEU 14 -15.860 -10.401 -2.702 122 HD11 LEU 14 1HD1 LEU 14 -14.668 -12.969 -1.666 123 HD12 LEU 14 2HD1 LEU 14 -15.839 -12.816 -2.975 124 HD13 LEU 14 3HD1 LEU 14 -16.296 -12.380 -1.329 125 HD21 LEU 14 1HD2 LEU 14 -15.384 -9.624 -0.664 126 HD22 LEU 14 2HD2 LEU 14 -13.692 -9.742 -1.148 127 HD23 LEU 14 3HD2 LEU 14 -14.444 -11.055 -0.241 128 H LEU 15 H LEU 15 -14.365 -10.002 -6.310 129 HA LEU 15 HA LEU 15 -17.160 -9.671 -6.216 130 HB2 LEU 15 2HB LEU 15 -15.457 -8.050 -7.118 131 HB3 LEU 15 3HB LEU 15 -15.374 -9.058 -8.561 132 HG LEU 15 HG LEU 15 -17.694 -8.575 -9.070 133 HD11 LEU 15 1HD1 LEU 15 -18.691 -8.395 -6.931 134 HD12 LEU 15 2HD1 LEU 15 -18.867 -6.819 -7.701 135 HD13 LEU 15 3HD1 LEU 15 -17.629 -7.064 -6.470 136 HD21 LEU 15 1HD2 LEU 15 -17.385 -6.425 -9.860 137 HD22 LEU 15 2HD2 LEU 15 -15.727 -6.970 -9.609 138 HD23 LEU 15 3HD2 LEU 15 -16.497 -5.913 -8.425 139 H ILE 16 H ILE 16 -15.077 -11.534 -8.395 140 HA ILE 16 HA ILE 16 -17.167 -12.448 -10.077 141 HB ILE 16 HB ILE 16 -14.855 -12.487 -10.830 142 HG12 ILE 16 2HG1 ILE 16 -16.256 -15.148 -10.637 143 HG13 ILE 16 3HG1 ILE 16 -16.238 -14.022 -11.990 144 HG21 ILE 16 1HG2 ILE 16 -13.201 -13.958 -9.927 145 HG22 ILE 16 2HG2 ILE 16 -13.885 -13.026 -8.596 146 HG23 ILE 16 3HG2 ILE 16 -14.378 -14.700 -8.844 147 HD11 ILE 16 1HD1 ILE 16 -14.868 -15.891 -12.538 148 HD12 ILE 16 2HD1 ILE 16 -13.815 -14.503 -12.264 149 HD13 ILE 16 3HD1 ILE 16 -13.974 -15.747 -11.025 150 H SER 17 H SER 17 -15.656 -13.740 -7.166 151 HA SER 17 HA SER 17 -17.016 -16.251 -7.269 152 HB2 SER 17 2HB SER 17 -15.042 -14.975 -5.587 153 HB3 SER 17 3HB SER 17 -16.279 -15.755 -4.601 154 HG SER 17 HG SER 17 -15.175 -17.496 -5.017 155 H GLY 18 H GLY 18 -17.669 -13.118 -5.844 156 HA2 GLY 18 2HA GLY 18 -19.889 -14.075 -4.261 157 HA3 GLY 18 3HA GLY 18 -19.403 -12.400 -4.477 158 H LEU 19 H LEU 19 -19.442 -13.013 -7.493 159 HA LEU 19 HA LEU 19 -22.304 -12.459 -7.808 160 HB2 LEU 19 2HB LEU 19 -21.804 -11.148 -9.587 161 HB3 LEU 19 3HB LEU 19 -20.280 -11.014 -8.712 162 HG LEU 19 HG LEU 19 -19.628 -13.066 -10.252 163 HD11 LEU 19 1HD1 LEU 19 -20.800 -12.057 -12.538 164 HD12 LEU 19 2HD1 LEU 19 -22.124 -12.104 -11.375 165 HD13 LEU 19 3HD1 LEU 19 -21.213 -13.570 -11.731 166 HD21 LEU 19 1HD2 LEU 19 -18.752 -10.622 -10.088 167 HD22 LEU 19 2HD2 LEU 19 -19.675 -10.385 -11.572 168 HD23 LEU 19 3HD2 LEU 19 -18.386 -11.589 -11.517 169 H LYS 20 H LYS 20 -19.913 -14.829 -8.427 170 HA LYS 20 HA LYS 20 -21.174 -16.099 -10.651 171 HB2 LYS 20 2HB LYS 20 -18.798 -16.410 -10.231 172 HB3 LYS 20 3HB LYS 20 -19.142 -17.131 -8.664 173 HG2 LYS 20 2HG LYS 20 -18.564 -18.785 -10.400 174 HG3 LYS 20 3HG LYS 20 -20.166 -19.038 -9.703 175 HD2 LYS 20 2HD LYS 20 -21.143 -18.805 -11.692 176 HD3 LYS 20 3HD LYS 20 -20.297 -17.286 -11.994 177 HE2 LYS 20 2HE LYS 20 -18.312 -18.589 -12.701 178 HE3 LYS 20 3HE LYS 20 -19.247 -20.069 -12.495 179 HZ1 LYS 20 1HZ LYS 20 -20.603 -18.163 -14.130 180 HZ2 LYS 20 2HZ LYS 20 -20.218 -19.777 -14.456 181 HZ3 LYS 20 3HZ LYS 20 -19.086 -18.559 -14.766 182 H GLY 21 H GLY 21 -20.610 -17.567 -7.459 183 HA2 GLY 21 2HA GLY 21 -22.737 -19.396 -7.696 184 HA3 GLY 21 3HA GLY 21 -21.906 -18.984 -6.204 Start of MODEL 5 1 H1 GLY 1 H GLY 1 3.088 -0.628 0.345 2 HA2 GLY 1 2HA GLY 1 1.226 0.675 -1.503 3 HA3 GLY 1 3HA GLY 1 2.944 0.421 -1.773 4 H ILE 2 H ILE 2 3.405 -2.150 -1.573 5 HA ILE 2 HA ILE 2 2.518 -3.279 -3.929 6 HB ILE 2 HB ILE 2 3.179 -5.503 -2.873 7 HG12 ILE 2 2HG1 ILE 2 4.683 -4.386 -0.725 8 HG13 ILE 2 3HG1 ILE 2 3.005 -3.894 -0.523 9 HG21 ILE 2 1HG2 ILE 2 5.029 -3.144 -3.036 10 HG22 ILE 2 2HG2 ILE 2 5.614 -4.775 -2.713 11 HG23 ILE 2 3HG2 ILE 2 4.769 -4.424 -4.221 12 HD11 ILE 2 1HD1 ILE 2 3.861 -6.111 0.524 13 HD12 ILE 2 2HD1 ILE 2 2.270 -6.049 -0.236 14 HD13 ILE 2 3HD1 ILE 2 3.637 -6.746 -1.106 15 H PHE 3 H PHE 3 1.160 -3.587 -0.685 16 HA PHE 3 HA PHE 3 -0.825 -5.502 -1.462 17 HB2 PHE 3 2HB PHE 3 -0.339 -3.867 1.013 18 HB3 PHE 3 3HB PHE 3 -1.819 -4.801 0.825 19 HD1 PHE 3 HD1 PHE 3 1.055 -4.904 2.507 20 HD2 PHE 3 HD2 PHE 3 -1.035 -7.269 -0.350 21 HE1 PHE 3 HE1 PHE 3 2.226 -6.910 3.316 22 HE2 PHE 3 HE2 PHE 3 0.132 -9.279 0.456 23 HZ PHE 3 HZ PHE 3 1.765 -9.102 2.291 24 H SER 4 H SER 4 -0.585 -2.050 -1.418 25 HA SER 4 HA SER 4 -3.392 -1.514 -1.491 26 HB2 SER 4 2HB SER 4 -1.142 0.286 -2.414 27 HB3 SER 4 3HB SER 4 -2.769 0.774 -1.939 28 HG SER 4 HG SER 4 -0.633 -0.106 -0.342 29 H LYS 5 H LYS 5 -0.839 -1.793 -3.921 30 HA LYS 5 HA LYS 5 -2.568 -1.151 -6.115 31 HB2 LYS 5 2HB LYS 5 -0.662 -1.852 -7.520 32 HB3 LYS 5 3HB LYS 5 -0.190 -0.696 -6.281 33 HG2 LYS 5 2HG LYS 5 1.515 -2.203 -6.119 34 HG3 LYS 5 3HG LYS 5 0.394 -2.863 -4.925 35 HD2 LYS 5 2HD LYS 5 0.188 -4.761 -6.072 36 HD3 LYS 5 3HD LYS 5 -0.190 -3.886 -7.558 37 HE2 LYS 5 2HE LYS 5 1.747 -4.971 -8.159 38 HE3 LYS 5 3HE LYS 5 2.383 -3.428 -7.592 39 HZ1 LYS 5 1HZ LYS 5 3.541 -4.469 -6.038 40 HZ2 LYS 5 2HZ LYS 5 3.051 -5.953 -6.684 41 HZ3 LYS 5 3HZ LYS 5 2.161 -5.240 -5.434 42 H LEU 6 H LEU 6 -1.456 -4.088 -4.552 43 HA LEU 6 HA LEU 6 -2.434 -5.867 -6.559 44 HB2 LEU 6 2HB LEU 6 -0.753 -6.779 -5.251 45 HB3 LEU 6 3HB LEU 6 -1.449 -6.165 -3.753 46 HG LEU 6 HG LEU 6 -3.244 -7.857 -3.936 47 HD11 LEU 6 1HD1 LEU 6 -3.210 -9.566 -5.558 48 HD12 LEU 6 2HD1 LEU 6 -1.618 -9.085 -6.146 49 HD13 LEU 6 3HD1 LEU 6 -3.018 -8.056 -6.448 50 HD21 LEU 6 1HD2 LEU 6 -0.532 -9.151 -4.082 51 HD22 LEU 6 2HD2 LEU 6 -1.942 -9.675 -3.161 52 HD23 LEU 6 3HD2 LEU 6 -1.075 -8.211 -2.692 53 H ALA 7 H ALA 7 -3.889 -4.111 -4.015 54 HA ALA 7 HA ALA 7 -5.992 -5.713 -3.208 55 HB1 ALA 7 1HB ALA 7 -6.191 -2.748 -3.701 56 HB2 ALA 7 2HB ALA 7 -7.130 -3.714 -2.562 57 HB3 ALA 7 3HB ALA 7 -5.405 -3.465 -2.294 58 H GLY 8 H GLY 8 -5.597 -3.893 -6.185 59 HA2 GLY 8 2HA GLY 8 -8.248 -3.979 -7.106 60 HA3 GLY 8 3HA GLY 8 -6.822 -3.853 -8.125 61 H LYS 9 H LYS 9 -5.891 -6.475 -6.855 62 HA LYS 9 HA LYS 9 -7.113 -8.171 -8.851 63 HB2 LYS 9 2HB LYS 9 -4.750 -8.396 -8.589 64 HB3 LYS 9 3HB LYS 9 -4.898 -8.606 -6.849 65 HG2 LYS 9 2HG LYS 9 -4.412 -10.685 -8.179 66 HG3 LYS 9 3HG LYS 9 -5.795 -10.773 -7.085 67 HD2 LYS 9 2HD LYS 9 -7.322 -10.425 -8.927 68 HD3 LYS 9 3HD LYS 9 -5.973 -10.190 -10.041 69 HE2 LYS 9 2HE LYS 9 -5.275 -12.472 -9.762 70 HE3 LYS 9 3HE LYS 9 -6.467 -12.727 -8.489 71 HZ1 LYS 9 1HZ LYS 9 -6.793 -12.793 -11.347 72 HZ2 LYS 9 2HZ LYS 9 -7.977 -11.878 -10.559 73 HZ3 LYS 9 3HZ LYS 9 -7.739 -13.498 -10.134 74 H LYS 10 H LYS 10 -6.556 -8.534 -5.344 75 HA LYS 10 HA LYS 10 -8.155 -10.716 -4.877 76 HB2 LYS 10 2HB LYS 10 -6.888 -10.022 -3.051 77 HB3 LYS 10 3HB LYS 10 -7.414 -8.350 -3.194 78 HG2 LYS 10 2HG LYS 10 -8.332 -9.519 -1.218 79 HG3 LYS 10 3HG LYS 10 -9.572 -8.887 -2.304 80 HD2 LYS 10 2HD LYS 10 -10.386 -10.928 -2.720 81 HD3 LYS 10 3HD LYS 10 -8.775 -11.607 -2.967 82 HE2 LYS 10 2HE LYS 10 -8.499 -12.082 -0.699 83 HE3 LYS 10 3HE LYS 10 -9.779 -10.971 -0.215 84 HZ1 LYS 10 1HZ LYS 10 -10.308 -13.425 -0.127 85 HZ2 LYS 10 2HZ LYS 10 -10.328 -13.397 -1.817 86 HZ3 LYS 10 3HZ LYS 10 -11.423 -12.449 -0.944 87 H ILE 11 H ILE 11 -9.135 -7.304 -4.901 88 HA ILE 11 HA ILE 11 -11.806 -7.652 -4.179 89 HB ILE 11 HB ILE 11 -12.246 -5.493 -5.214 90 HG12 ILE 11 2HG1 ILE 11 -9.951 -4.487 -6.226 91 HG13 ILE 11 3HG1 ILE 11 -9.778 -6.171 -6.708 92 HG21 ILE 11 1HG2 ILE 11 -9.751 -5.853 -3.614 93 HG22 ILE 11 2HG2 ILE 11 -10.218 -4.244 -4.159 94 HG23 ILE 11 3HG2 ILE 11 -11.306 -5.177 -3.132 95 HD11 ILE 11 1HD1 ILE 11 -11.538 -4.094 -7.741 96 HD12 ILE 11 2HD1 ILE 11 -10.955 -5.576 -8.500 97 HD13 ILE 11 3HD1 ILE 11 -12.354 -5.626 -7.428 98 H LYS 12 H LYS 12 -10.215 -7.967 -7.297 99 HA LYS 12 HA LYS 12 -12.637 -8.207 -8.802 100 HB2 LYS 12 2HB LYS 12 -10.096 -7.660 -9.496 101 HB3 LYS 12 3HB LYS 12 -10.125 -9.381 -9.858 102 HG2 LYS 12 2HG LYS 12 -12.052 -7.342 -10.953 103 HG3 LYS 12 3HG LYS 12 -10.658 -8.003 -11.812 104 HD2 LYS 12 2HD LYS 12 -11.880 -10.286 -11.078 105 HD3 LYS 12 3HD LYS 12 -13.282 -9.224 -11.218 106 HE2 LYS 12 2HE LYS 12 -13.225 -9.441 -13.427 107 HE3 LYS 12 3HE LYS 12 -11.603 -8.750 -13.455 108 HZ1 LYS 12 1HZ LYS 12 -10.944 -10.724 -14.190 109 HZ2 LYS 12 2HZ LYS 12 -12.424 -11.459 -13.829 110 HZ3 LYS 12 3HZ LYS 12 -11.231 -11.329 -12.636 111 H ASN 13 H ASN 13 -10.531 -10.402 -7.103 112 HA ASN 13 HA ASN 13 -11.533 -12.789 -8.314 113 HB2 ASN 13 2HB ASN 13 -9.293 -12.551 -7.168 114 HB3 ASN 13 3HB ASN 13 -10.159 -12.548 -5.634 115 HD21 ASN 13 1HD2 ASN 13 -11.252 -14.431 -4.980 116 HD22 ASN 13 2HD2 ASN 13 -10.836 -15.978 -5.627 117 H LEU 14 H LEU 14 -12.381 -10.866 -5.512 118 HA LEU 14 HA LEU 14 -14.192 -12.818 -4.428 119 HB2 LEU 14 2HB LEU 14 -13.094 -11.254 -2.953 120 HB3 LEU 14 3HB LEU 14 -13.790 -9.892 -3.828 121 HG LEU 14 HG LEU 14 -15.963 -10.347 -2.976 122 HD11 LEU 14 1HD1 LEU 14 -16.453 -12.272 -1.554 123 HD12 LEU 14 2HD1 LEU 14 -14.812 -12.871 -1.793 124 HD13 LEU 14 3HD1 LEU 14 -15.923 -12.776 -3.159 125 HD21 LEU 14 1HD2 LEU 14 -14.806 -9.110 -1.385 126 HD22 LEU 14 2HD2 LEU 14 -13.760 -10.461 -0.948 127 HD23 LEU 14 3HD2 LEU 14 -15.453 -10.460 -0.452 128 H LEU 15 H LEU 15 -14.419 -10.008 -6.516 129 HA LEU 15 HA LEU 15 -17.221 -9.708 -6.462 130 HB2 LEU 15 2HB LEU 15 -15.522 -8.067 -7.337 131 HB3 LEU 15 3HB LEU 15 -15.409 -9.073 -8.780 132 HG LEU 15 HG LEU 15 -17.723 -8.613 -9.324 133 HD11 LEU 15 1HD1 LEU 15 -18.930 -8.393 -7.390 134 HD12 LEU 15 2HD1 LEU 15 -18.773 -6.703 -7.869 135 HD13 LEU 15 3HD1 LEU 15 -17.721 -7.367 -6.619 136 HD21 LEU 15 1HD2 LEU 15 -17.551 -6.155 -9.679 137 HD22 LEU 15 2HD2 LEU 15 -16.127 -7.056 -10.198 138 HD23 LEU 15 3HD2 LEU 15 -16.098 -6.158 -8.680 139 H ILE 16 H ILE 16 -15.076 -11.532 -8.618 140 HA ILE 16 HA ILE 16 -17.130 -12.481 -10.325 141 HB ILE 16 HB ILE 16 -14.830 -12.487 -11.078 142 HG12 ILE 16 2HG1 ILE 16 -14.742 -14.683 -12.063 143 HG13 ILE 16 3HG1 ILE 16 -15.736 -15.355 -10.775 144 HG21 ILE 16 1HG2 ILE 16 -13.172 -14.030 -10.144 145 HG22 ILE 16 2HG2 ILE 16 -13.733 -12.870 -8.941 146 HG23 ILE 16 3HG2 ILE 16 -14.334 -14.527 -8.914 147 HD11 ILE 16 1HD1 ILE 16 -17.638 -14.064 -11.544 148 HD12 ILE 16 2HD1 ILE 16 -16.647 -13.330 -12.805 149 HD13 ILE 16 3HD1 ILE 16 -16.989 -15.060 -12.846 150 H SER 17 H SER 17 -15.724 -13.668 -7.339 151 HA SER 17 HA SER 17 -16.998 -16.236 -7.477 152 HB2 SER 17 2HB SER 17 -15.141 -14.865 -5.693 153 HB3 SER 17 3HB SER 17 -16.342 -15.809 -4.812 154 HG SER 17 HG SER 17 -14.218 -16.778 -5.783 155 H GLY 18 H GLY 18 -17.736 -13.112 -6.070 156 HA2 GLY 18 2HA GLY 18 -19.922 -14.052 -4.468 157 HA3 GLY 18 3HA GLY 18 -19.540 -12.375 -4.831 158 H LEU 19 H LEU 19 -19.558 -13.095 -7.772 159 HA LEU 19 HA LEU 19 -22.465 -12.876 -8.096 160 HB2 LEU 19 2HB LEU 19 -20.342 -12.312 -10.151 161 HB3 LEU 19 3HB LEU 19 -22.042 -11.854 -10.210 162 HG LEU 19 HG LEU 19 -20.303 -10.776 -8.033 163 HD11 LEU 19 1HD1 LEU 19 -19.696 -8.886 -9.452 164 HD12 LEU 19 2HD1 LEU 19 -20.451 -9.675 -10.836 165 HD13 LEU 19 3HD1 LEU 19 -19.030 -10.395 -10.078 166 HD21 LEU 19 1HD2 LEU 19 -21.841 -8.856 -8.295 167 HD22 LEU 19 2HD2 LEU 19 -22.672 -10.358 -7.889 168 HD23 LEU 19 3HD2 LEU 19 -22.702 -9.752 -9.546 169 H LYS 20 H LYS 20 -19.669 -14.739 -9.108 170 HA LYS 20 HA LYS 20 -21.467 -16.594 -10.526 171 HB2 LYS 20 2HB LYS 20 -19.678 -15.511 -11.902 172 HB3 LYS 20 3HB LYS 20 -18.480 -16.298 -10.883 173 HG2 LYS 20 2HG LYS 20 -20.548 -17.989 -12.183 174 HG3 LYS 20 3HG LYS 20 -19.242 -17.337 -13.177 175 HD2 LYS 20 2HD LYS 20 -17.807 -18.841 -12.379 176 HD3 LYS 20 3HD LYS 20 -18.199 -18.403 -10.714 177 HE2 LYS 20 2HE LYS 20 -20.144 -19.886 -10.786 178 HE3 LYS 20 3HE LYS 20 -19.757 -20.317 -12.451 179 HZ1 LYS 20 1HZ LYS 20 -18.777 -22.028 -11.342 180 HZ2 LYS 20 2HZ LYS 20 -18.423 -21.108 -9.968 181 HZ3 LYS 20 3HZ LYS 20 -17.475 -20.947 -11.359 182 H GLY 21 H GLY 21 -18.330 -16.687 -8.813 183 HA2 GLY 21 2HA GLY 21 -18.344 -19.384 -8.172 184 HA3 GLY 21 3HA GLY 21 -17.521 -18.146 -7.235 Start of MODEL 6 1 H1 GLY 1 H GLY 1 2.392 1.000 -2.859 2 HA2 GLY 1 2HA GLY 1 3.062 -0.382 -0.573 3 HA3 GLY 1 3HA GLY 1 1.347 -0.037 -0.412 4 H ILE 2 H ILE 2 3.551 -2.254 -1.494 5 HA ILE 2 HA ILE 2 2.576 -3.254 -3.873 6 HB ILE 2 HB ILE 2 3.331 -5.524 -2.992 7 HG12 ILE 2 2HG1 ILE 2 4.913 -4.508 -0.850 8 HG13 ILE 2 3HG1 ILE 2 3.238 -4.068 -0.539 9 HG21 ILE 2 1HG2 ILE 2 5.590 -3.680 -2.570 10 HG22 ILE 2 2HG2 ILE 2 5.422 -5.037 -3.682 11 HG23 ILE 2 3HG2 ILE 2 4.701 -3.478 -4.079 12 HD11 ILE 2 1HD1 ILE 2 4.184 -6.324 0.328 13 HD12 ILE 2 2HD1 ILE 2 2.561 -6.255 -0.360 14 HD13 ILE 2 3HD1 ILE 2 3.903 -6.863 -1.328 15 H PHE 3 H PHE 3 1.381 -3.795 -0.595 16 HA PHE 3 HA PHE 3 -0.600 -5.704 -1.399 17 HB2 PHE 3 2HB PHE 3 -0.016 -4.221 1.148 18 HB3 PHE 3 3HB PHE 3 -1.497 -5.156 0.975 19 HD1 PHE 3 HD1 PHE 3 -0.806 -7.550 -0.342 20 HD2 PHE 3 HD2 PHE 3 1.505 -5.323 2.454 21 HE1 PHE 3 HE1 PHE 3 0.412 -9.597 0.276 22 HE2 PHE 3 HE2 PHE 3 2.727 -7.366 3.076 23 HZ PHE 3 HZ PHE 3 2.182 -9.506 1.986 24 H SER 4 H SER 4 -0.428 -2.256 -1.148 25 HA SER 4 HA SER 4 -3.245 -1.782 -1.056 26 HB2 SER 4 2HB SER 4 -1.077 0.122 -1.964 27 HB3 SER 4 3HB SER 4 -2.690 0.544 -1.391 28 HG SER 4 HG SER 4 -1.191 0.806 0.273 29 H LYS 5 H LYS 5 -0.806 -1.850 -3.614 30 HA LYS 5 HA LYS 5 -2.651 -1.112 -5.681 31 HB2 LYS 5 2HB LYS 5 -0.800 -1.681 -7.214 32 HB3 LYS 5 3HB LYS 5 -0.293 -0.594 -5.929 33 HG2 LYS 5 2HG LYS 5 1.447 -2.069 -5.941 34 HG3 LYS 5 3HG LYS 5 0.399 -2.827 -4.740 35 HD2 LYS 5 2HD LYS 5 0.176 -4.655 -5.994 36 HD3 LYS 5 3HD LYS 5 -0.290 -3.698 -7.403 37 HE2 LYS 5 2HE LYS 5 2.571 -3.985 -6.525 38 HE3 LYS 5 3HE LYS 5 1.801 -5.138 -7.613 39 HZ1 LYS 5 1HZ LYS 5 3.082 -3.245 -8.664 40 HZ2 LYS 5 2HZ LYS 5 1.819 -2.234 -8.173 41 HZ3 LYS 5 3HZ LYS 5 1.515 -3.507 -9.245 42 H LEU 6 H LEU 6 -1.407 -4.115 -4.360 43 HA LEU 6 HA LEU 6 -2.444 -5.787 -6.428 44 HB2 LEU 6 2HB LEU 6 -0.686 -6.742 -5.260 45 HB3 LEU 6 3HB LEU 6 -1.321 -6.236 -3.696 46 HG LEU 6 HG LEU 6 -3.088 -7.954 -3.898 47 HD11 LEU 6 1HD1 LEU 6 -3.131 -9.536 -5.629 48 HD12 LEU 6 2HD1 LEU 6 -1.555 -9.037 -6.242 49 HD13 LEU 6 3HD1 LEU 6 -2.953 -7.979 -6.438 50 HD21 LEU 6 1HD2 LEU 6 -0.292 -9.044 -4.201 51 HD22 LEU 6 2HD2 LEU 6 -1.661 -9.855 -3.440 52 HD23 LEU 6 3HD2 LEU 6 -0.977 -8.402 -2.708 53 H ALA 7 H ALA 7 -3.810 -4.228 -3.712 54 HA ALA 7 HA ALA 7 -5.846 -5.934 -2.928 55 HB1 ALA 7 1HB ALA 7 -6.752 -4.149 -1.828 56 HB2 ALA 7 2HB ALA 7 -5.124 -3.533 -2.113 57 HB3 ALA 7 3HB ALA 7 -6.453 -3.032 -3.160 58 H GLY 8 H GLY 8 -5.591 -3.926 -5.787 59 HA2 GLY 8 2HA GLY 8 -8.297 -3.980 -6.575 60 HA3 GLY 8 3HA GLY 8 -6.925 -3.721 -7.643 61 H LYS 9 H LYS 9 -5.868 -6.415 -6.650 62 HA LYS 9 HA LYS 9 -7.121 -7.965 -8.741 63 HB2 LYS 9 2HB LYS 9 -4.746 -8.152 -8.570 64 HB3 LYS 9 3HB LYS 9 -4.834 -8.517 -6.852 65 HG2 LYS 9 2HG LYS 9 -4.344 -10.458 -8.376 66 HG3 LYS 9 3HG LYS 9 -5.687 -10.677 -7.251 67 HD2 LYS 9 2HD LYS 9 -7.283 -10.209 -9.006 68 HD3 LYS 9 3HD LYS 9 -5.978 -9.841 -10.137 69 HE2 LYS 9 2HE LYS 9 -5.518 -12.018 -10.515 70 HE3 LYS 9 3HE LYS 9 -5.828 -12.481 -8.842 71 HZ1 LYS 9 1HZ LYS 9 -8.143 -12.535 -9.240 72 HZ2 LYS 9 2HZ LYS 9 -7.427 -13.383 -10.516 73 HZ3 LYS 9 3HZ LYS 9 -7.986 -11.805 -10.758 74 H LYS 10 H LYS 10 -6.452 -8.603 -5.293 75 HA LYS 10 HA LYS 10 -7.968 -10.864 -4.961 76 HB2 LYS 10 2HB LYS 10 -6.498 -9.861 -3.232 77 HB3 LYS 10 3HB LYS 10 -7.705 -8.612 -2.959 78 HG2 LYS 10 2HG LYS 10 -8.315 -11.533 -2.635 79 HG3 LYS 10 3HG LYS 10 -7.668 -10.543 -1.325 80 HD2 LYS 10 2HD LYS 10 -9.668 -8.958 -2.010 81 HD3 LYS 10 3HD LYS 10 -10.343 -10.466 -2.631 82 HE2 LYS 10 2HE LYS 10 -11.081 -10.811 -0.551 83 HE3 LYS 10 3HE LYS 10 -9.406 -11.183 -0.147 84 HZ1 LYS 10 1HZ LYS 10 -10.738 -8.543 0.117 85 HZ2 LYS 10 2HZ LYS 10 -9.097 -8.824 0.410 86 HZ3 LYS 10 3HZ LYS 10 -10.267 -9.564 1.381 87 H ILE 11 H ILE 11 -9.072 -7.501 -4.612 88 HA ILE 11 HA ILE 11 -11.708 -8.002 -3.897 89 HB ILE 11 HB ILE 11 -12.249 -5.785 -4.749 90 HG12 ILE 11 2HG1 ILE 11 -10.005 -4.621 -5.714 91 HG13 ILE 11 3HG1 ILE 11 -9.793 -6.253 -6.338 92 HG21 ILE 11 1HG2 ILE 11 -9.685 -6.152 -3.251 93 HG22 ILE 11 2HG2 ILE 11 -10.288 -4.536 -3.616 94 HG23 ILE 11 3HG2 ILE 11 -11.265 -5.645 -2.654 95 HD11 ILE 11 1HD1 ILE 11 -11.481 -4.151 -7.288 96 HD12 ILE 11 2HD1 ILE 11 -11.125 -5.718 -8.016 97 HD13 ILE 11 3HD1 ILE 11 -12.454 -5.561 -6.868 98 H LYS 12 H LYS 12 -10.190 -7.998 -7.067 99 HA LYS 12 HA LYS 12 -12.636 -8.205 -8.532 100 HB2 LYS 12 2HB LYS 12 -10.138 -7.517 -9.239 101 HB3 LYS 12 3HB LYS 12 -10.109 -9.207 -9.726 102 HG2 LYS 12 2HG LYS 12 -12.154 -7.188 -10.625 103 HG3 LYS 12 3HG LYS 12 -10.740 -7.691 -11.555 104 HD2 LYS 12 2HD LYS 12 -11.821 -10.096 -10.987 105 HD3 LYS 12 3HD LYS 12 -13.280 -9.103 -11.043 106 HE2 LYS 12 2HE LYS 12 -11.263 -8.835 -13.222 107 HE3 LYS 12 3HE LYS 12 -12.327 -10.241 -13.214 108 HZ1 LYS 12 1HZ LYS 12 -13.201 -7.403 -13.202 109 HZ2 LYS 12 2HZ LYS 12 -14.231 -8.744 -13.169 110 HZ3 LYS 12 3HZ LYS 12 -13.264 -8.454 -14.526 111 H ASN 13 H ASN 13 -10.451 -10.453 -7.027 112 HA ASN 13 HA ASN 13 -11.369 -12.775 -8.415 113 HB2 ASN 13 2HB ASN 13 -9.165 -12.755 -7.384 114 HB3 ASN 13 3HB ASN 13 -9.880 -12.490 -5.796 115 HD21 ASN 13 1HD2 ASN 13 -9.733 -14.765 -8.483 116 HD22 ASN 13 2HD2 ASN 13 -9.997 -16.183 -7.532 117 H LEU 14 H LEU 14 -12.275 -11.117 -5.459 118 HA LEU 14 HA LEU 14 -14.045 -13.201 -4.570 119 HB2 LEU 14 2HB LEU 14 -12.971 -11.762 -2.952 120 HB3 LEU 14 3HB LEU 14 -13.708 -10.339 -3.686 121 HG LEU 14 HG LEU 14 -15.859 -10.927 -2.872 122 HD11 LEU 14 1HD1 LEU 14 -15.776 -13.319 -3.310 123 HD12 LEU 14 2HD1 LEU 14 -16.300 -13.002 -1.657 124 HD13 LEU 14 3HD1 LEU 14 -14.649 -13.538 -1.970 125 HD21 LEU 14 1HD2 LEU 14 -14.394 -11.723 -0.452 126 HD22 LEU 14 2HD2 LEU 14 -15.494 -10.371 -0.724 127 HD23 LEU 14 3HD2 LEU 14 -13.809 -10.255 -1.235 128 H LEU 15 H LEU 15 -14.323 -10.205 -6.374 129 HA LEU 15 HA LEU 15 -17.130 -9.961 -6.296 130 HB2 LEU 15 2HB LEU 15 -15.999 -8.051 -6.978 131 HB3 LEU 15 3HB LEU 15 -14.985 -8.940 -8.113 132 HG LEU 15 HG LEU 15 -17.906 -8.784 -8.662 133 HD11 LEU 15 1HD1 LEU 15 -17.347 -6.494 -8.051 134 HD12 LEU 15 2HD1 LEU 15 -17.625 -6.633 -9.786 135 HD13 LEU 15 3HD1 LEU 15 -15.979 -6.519 -9.164 136 HD21 LEU 15 1HD2 LEU 15 -15.357 -9.043 -10.201 137 HD22 LEU 15 2HD2 LEU 15 -16.814 -8.452 -11.000 138 HD23 LEU 15 3HD2 LEU 15 -16.805 -10.049 -10.249 139 H ILE 16 H ILE 16 -14.957 -11.524 -8.624 140 HA ILE 16 HA ILE 16 -16.996 -12.344 -10.411 141 HB ILE 16 HB ILE 16 -15.306 -13.901 -11.325 142 HG12 ILE 16 2HG1 ILE 16 -13.616 -12.879 -9.032 143 HG13 ILE 16 3HG1 ILE 16 -14.193 -14.529 -9.245 144 HG21 ILE 16 1HG2 ILE 16 -13.733 -12.194 -12.077 145 HG22 ILE 16 2HG2 ILE 16 -15.384 -11.576 -12.067 146 HG23 ILE 16 3HG2 ILE 16 -14.265 -11.124 -10.780 147 HD11 ILE 16 1HD1 ILE 16 -11.975 -14.597 -9.932 148 HD12 ILE 16 2HD1 ILE 16 -12.883 -14.495 -11.441 149 HD13 ILE 16 3HD1 ILE 16 -12.094 -13.059 -10.788 150 H SER 17 H SER 17 -15.550 -13.797 -7.562 151 HA SER 17 HA SER 17 -16.783 -16.359 -7.945 152 HB2 SER 17 2HB SER 17 -14.904 -15.162 -6.090 153 HB3 SER 17 3HB SER 17 -16.116 -16.117 -5.236 154 HG SER 17 HG SER 17 -14.666 -17.611 -5.780 155 H GLY 18 H GLY 18 -17.600 -13.384 -6.303 156 HA2 GLY 18 2HA GLY 18 -19.811 -14.572 -4.855 157 HA3 GLY 18 3HA GLY 18 -19.371 -12.870 -4.881 158 H LEU 19 H LEU 19 -19.320 -13.188 -7.951 159 HA LEU 19 HA LEU 19 -22.187 -12.664 -8.282 160 HB2 LEU 19 2HB LEU 19 -20.971 -10.827 -9.042 161 HB3 LEU 19 3HB LEU 19 -19.738 -11.837 -9.793 162 HG LEU 19 HG LEU 19 -21.326 -12.452 -11.558 163 HD11 LEU 19 1HD1 LEU 19 -23.352 -12.124 -10.079 164 HD12 LEU 19 2HD1 LEU 19 -23.487 -11.525 -11.731 165 HD13 LEU 19 3HD1 LEU 19 -23.195 -10.398 -10.406 166 HD21 LEU 19 1HD2 LEU 19 -21.182 -9.460 -11.227 167 HD22 LEU 19 2HD2 LEU 19 -21.291 -10.371 -12.734 168 HD23 LEU 19 3HD2 LEU 19 -19.829 -10.464 -11.750 169 H LYS 20 H LYS 20 -19.736 -14.920 -9.056 170 HA LYS 20 HA LYS 20 -20.909 -15.992 -11.428 171 HB2 LYS 20 2HB LYS 20 -18.570 -16.349 -11.072 172 HB3 LYS 20 3HB LYS 20 -18.858 -17.069 -9.493 173 HG2 LYS 20 2HG LYS 20 -20.273 -18.499 -11.561 174 HG3 LYS 20 3HG LYS 20 -18.546 -18.397 -11.912 175 HD2 LYS 20 2HD LYS 20 -17.960 -19.500 -9.939 176 HD3 LYS 20 3HD LYS 20 -19.529 -19.191 -9.191 177 HE2 LYS 20 2HE LYS 20 -20.316 -20.631 -11.315 178 HE3 LYS 20 3HE LYS 20 -18.704 -21.305 -11.088 179 HZ1 LYS 20 1HZ LYS 20 -20.879 -21.197 -9.071 180 HZ2 LYS 20 2HZ LYS 20 -19.304 -21.721 -8.747 181 HZ3 LYS 20 3HZ LYS 20 -20.274 -22.580 -9.835 182 H GLY 21 H GLY 21 -21.261 -16.587 -7.998 183 HA2 GLY 21 2HA GLY 21 -23.001 -18.891 -8.544 184 HA3 GLY 21 3HA GLY 21 -22.329 -18.462 -6.978 Start of MODEL 7 1 H1 GLY 1 H GLY 1 3.145 1.362 -1.762 2 HA2 GLY 1 2HA GLY 1 2.088 -0.538 0.120 3 HA3 GLY 1 3HA GLY 1 1.158 0.500 -0.950 4 H ILE 2 H ILE 2 3.389 -2.272 -1.210 5 HA ILE 2 HA ILE 2 2.539 -3.246 -3.647 6 HB ILE 2 HB ILE 2 3.223 -5.530 -2.742 7 HG12 ILE 2 2HG1 ILE 2 4.692 -4.542 -0.508 8 HG13 ILE 2 3HG1 ILE 2 3.005 -4.090 -0.287 9 HG21 ILE 2 1HG2 ILE 2 5.259 -3.340 -2.389 10 HG22 ILE 2 2HG2 ILE 2 5.543 -5.010 -2.879 11 HG23 ILE 2 3HG2 ILE 2 4.693 -3.906 -3.960 12 HD11 ILE 2 1HD1 ILE 2 3.685 -6.885 -1.060 13 HD12 ILE 2 2HD1 ILE 2 3.884 -6.361 0.613 14 HD13 ILE 2 3HD1 ILE 2 2.300 -6.270 -0.159 15 H PHE 3 H PHE 3 1.158 -3.800 -0.445 16 HA PHE 3 HA PHE 3 -0.792 -5.684 -1.372 17 HB2 PHE 3 2HB PHE 3 -0.187 -4.317 1.205 18 HB3 PHE 3 3HB PHE 3 -1.809 -4.967 0.985 19 HD1 PHE 3 HD1 PHE 3 -1.609 -7.441 -0.267 20 HD2 PHE 3 HD2 PHE 3 1.157 -5.681 2.448 21 HE1 PHE 3 HE1 PHE 3 -0.796 -9.680 0.351 22 HE2 PHE 3 HE2 PHE 3 1.975 -7.917 3.069 23 HZ PHE 3 HZ PHE 3 0.999 -9.920 2.020 24 H SER 4 H SER 4 -0.604 -2.239 -1.088 25 HA SER 4 HA SER 4 -3.417 -1.740 -1.151 26 HB2 SER 4 2HB SER 4 -1.185 0.149 -1.925 27 HB3 SER 4 3HB SER 4 -2.824 0.583 -1.440 28 HG SER 4 HG SER 4 -1.846 0.763 0.438 29 H LYS 5 H LYS 5 -0.840 -1.815 -3.570 30 HA LYS 5 HA LYS 5 -2.562 -1.051 -5.732 31 HB2 LYS 5 2HB LYS 5 -0.633 -1.622 -7.164 32 HB3 LYS 5 3HB LYS 5 -0.190 -0.547 -5.844 33 HG2 LYS 5 2HG LYS 5 1.538 -2.034 -5.770 34 HG3 LYS 5 3HG LYS 5 0.419 -2.793 -4.635 35 HD2 LYS 5 2HD LYS 5 0.254 -4.610 -5.914 36 HD3 LYS 5 3HD LYS 5 -0.126 -3.640 -7.339 37 HE2 LYS 5 2HE LYS 5 2.688 -3.856 -6.334 38 HE3 LYS 5 3HE LYS 5 1.997 -5.120 -7.351 39 HZ1 LYS 5 1HZ LYS 5 1.930 -3.765 -9.155 40 HZ2 LYS 5 2HZ LYS 5 3.258 -3.071 -8.371 41 HZ3 LYS 5 3HZ LYS 5 1.733 -2.349 -8.249 42 H LEU 6 H LEU 6 -1.413 -4.069 -4.363 43 HA LEU 6 HA LEU 6 -2.344 -5.722 -6.496 44 HB2 LEU 6 2HB LEU 6 -0.657 -6.694 -5.240 45 HB3 LEU 6 3HB LEU 6 -1.375 -6.196 -3.710 46 HG LEU 6 HG LEU 6 -3.131 -7.904 -4.009 47 HD11 LEU 6 1HD1 LEU 6 -2.897 -7.903 -6.538 48 HD12 LEU 6 2HD1 LEU 6 -3.103 -9.471 -5.759 49 HD13 LEU 6 3HD1 LEU 6 -1.505 -8.960 -6.303 50 HD21 LEU 6 1HD2 LEU 6 -1.017 -8.349 -2.767 51 HD22 LEU 6 2HD2 LEU 6 -0.361 -9.071 -4.237 52 HD23 LEU 6 3HD2 LEU 6 -1.768 -9.791 -3.452 53 H ALA 7 H ALA 7 -3.851 -4.164 -3.859 54 HA ALA 7 HA ALA 7 -5.926 -5.843 -3.159 55 HB1 ALA 7 1HB ALA 7 -6.444 -2.924 -3.531 56 HB2 ALA 7 2HB ALA 7 -6.972 -4.002 -2.238 57 HB3 ALA 7 3HB ALA 7 -5.292 -3.470 -2.312 58 H GLY 8 H GLY 8 -5.619 -3.767 -5.996 59 HA2 GLY 8 2HA GLY 8 -8.237 -3.918 -6.954 60 HA3 GLY 8 3HA GLY 8 -6.811 -3.691 -7.956 61 H LYS 9 H LYS 9 -5.802 -6.350 -6.836 62 HA LYS 9 HA LYS 9 -6.966 -7.966 -8.932 63 HB2 LYS 9 2HB LYS 9 -4.465 -7.831 -8.048 64 HB3 LYS 9 3HB LYS 9 -5.032 -9.090 -6.959 65 HG2 LYS 9 2HG LYS 9 -4.979 -9.154 -9.964 66 HG3 LYS 9 3HG LYS 9 -4.046 -10.148 -8.843 67 HD2 LYS 9 2HD LYS 9 -6.122 -11.181 -8.044 68 HD3 LYS 9 3HD LYS 9 -7.047 -10.192 -9.177 69 HE2 LYS 9 2HE LYS 9 -6.850 -12.065 -10.446 70 HE3 LYS 9 3HE LYS 9 -5.337 -11.284 -10.901 71 HZ1 LYS 9 1HZ LYS 9 -5.065 -12.875 -8.543 72 HZ2 LYS 9 2HZ LYS 9 -4.166 -12.912 -9.975 73 HZ3 LYS 9 3HZ LYS 9 -5.607 -13.792 -9.858 74 H LYS 10 H LYS 10 -6.364 -8.582 -5.468 75 HA LYS 10 HA LYS 10 -7.926 -10.810 -5.147 76 HB2 LYS 10 2HB LYS 10 -6.650 -10.226 -3.287 77 HB3 LYS 10 3HB LYS 10 -7.215 -8.561 -3.298 78 HG2 LYS 10 2HG LYS 10 -8.086 -9.888 -1.407 79 HG3 LYS 10 3HG LYS 10 -9.354 -9.218 -2.436 80 HD2 LYS 10 2HD LYS 10 -10.096 -11.250 -3.030 81 HD3 LYS 10 3HD LYS 10 -8.462 -11.877 -3.260 82 HE2 LYS 10 2HE LYS 10 -9.434 -13.126 -1.493 83 HE3 LYS 10 3HE LYS 10 -8.280 -12.016 -0.755 84 HZ1 LYS 10 1HZ LYS 10 -10.565 -12.242 0.314 85 HZ2 LYS 10 2HZ LYS 10 -11.141 -11.320 -0.981 86 HZ3 LYS 10 3HZ LYS 10 -9.976 -10.676 0.063 87 H ILE 11 H ILE 11 -8.969 -7.424 -4.879 88 HA ILE 11 HA ILE 11 -11.617 -7.853 -4.158 89 HB ILE 11 HB ILE 11 -12.111 -5.651 -5.069 90 HG12 ILE 11 2HG1 ILE 11 -9.857 -4.554 -6.075 91 HG13 ILE 11 3HG1 ILE 11 -9.662 -6.208 -6.643 92 HG21 ILE 11 1HG2 ILE 11 -11.135 -5.425 -2.993 93 HG22 ILE 11 2HG2 ILE 11 -9.582 -6.055 -3.537 94 HG23 ILE 11 3HG2 ILE 11 -10.079 -4.425 -3.991 95 HD11 ILE 11 1HD1 ILE 11 -10.979 -5.708 -8.343 96 HD12 ILE 11 2HD1 ILE 11 -12.312 -5.513 -7.205 97 HD13 ILE 11 3HD1 ILE 11 -11.331 -4.120 -7.661 98 H LYS 12 H LYS 12 -10.088 -7.965 -7.322 99 HA LYS 12 HA LYS 12 -12.524 -8.155 -8.800 100 HB2 LYS 12 2HB LYS 12 -10.688 -7.362 -10.031 101 HB3 LYS 12 3HB LYS 12 -9.629 -8.640 -9.448 102 HG2 LYS 12 2HG LYS 12 -10.273 -8.902 -11.814 103 HG3 LYS 12 3HG LYS 12 -10.754 -10.269 -10.807 104 HD2 LYS 12 2HD LYS 12 -12.654 -9.896 -12.078 105 HD3 LYS 12 3HD LYS 12 -13.008 -8.998 -10.600 106 HE2 LYS 12 2HE LYS 12 -13.576 -7.461 -12.220 107 HE3 LYS 12 3HE LYS 12 -11.906 -7.011 -11.880 108 HZ1 LYS 12 1HZ LYS 12 -11.178 -7.853 -13.865 109 HZ2 LYS 12 2HZ LYS 12 -12.714 -7.307 -14.317 110 HZ3 LYS 12 3HZ LYS 12 -12.456 -8.952 -14.015 111 H ASN 13 H ASN 13 -10.303 -10.459 -7.358 112 HA ASN 13 HA ASN 13 -11.374 -12.770 -8.618 113 HB2 ASN 13 2HB ASN 13 -9.108 -12.442 -7.368 114 HB3 ASN 13 3HB ASN 13 -10.040 -12.844 -5.929 115 HD21 ASN 13 1HD2 ASN 13 -9.342 -14.819 -5.436 116 HD22 ASN 13 2HD2 ASN 13 -9.387 -16.183 -6.496 117 H LEU 14 H LEU 14 -12.146 -11.002 -5.692 118 HA LEU 14 HA LEU 14 -13.920 -13.001 -4.653 119 HB2 LEU 14 2HB LEU 14 -12.815 -11.477 -3.146 120 HB3 LEU 14 3HB LEU 14 -13.538 -10.092 -3.963 121 HG LEU 14 HG LEU 14 -15.692 -10.597 -3.089 122 HD11 LEU 14 1HD1 LEU 14 -16.136 -12.569 -1.717 123 HD12 LEU 14 2HD1 LEU 14 -14.494 -13.143 -2.005 124 HD13 LEU 14 3HD1 LEU 14 -15.632 -13.018 -3.347 125 HD21 LEU 14 1HD2 LEU 14 -15.311 -9.930 -0.966 126 HD22 LEU 14 2HD2 LEU 14 -13.652 -9.778 -1.547 127 HD23 LEU 14 3HD2 LEU 14 -14.146 -11.217 -0.653 128 H LEU 15 H LEU 15 -14.239 -10.101 -6.610 129 HA LEU 15 HA LEU 15 -17.029 -9.822 -6.492 130 HB2 LEU 15 2HB LEU 15 -15.342 -8.182 -7.409 131 HB3 LEU 15 3HB LEU 15 -15.303 -9.169 -8.869 132 HG LEU 15 HG LEU 15 -17.644 -8.684 -9.291 133 HD11 LEU 15 1HD1 LEU 15 -18.484 -8.527 -7.045 134 HD12 LEU 15 2HD1 LEU 15 -18.824 -7.017 -7.891 135 HD13 LEU 15 3HD1 LEU 15 -17.497 -7.099 -6.732 136 HD21 LEU 15 1HD2 LEU 15 -16.506 -7.080 -10.412 137 HD22 LEU 15 2HD2 LEU 15 -15.643 -6.530 -8.975 138 HD23 LEU 15 3HD2 LEU 15 -17.313 -6.029 -9.247 139 H ILE 16 H ILE 16 -14.962 -11.615 -8.750 140 HA ILE 16 HA ILE 16 -17.059 -12.538 -10.408 141 HB ILE 16 HB ILE 16 -14.381 -13.852 -9.937 142 HG12 ILE 16 2HG1 ILE 16 -14.963 -12.052 -12.253 143 HG13 ILE 16 3HG1 ILE 16 -14.560 -11.331 -10.699 144 HG21 ILE 16 1HG2 ILE 16 -14.954 -14.381 -12.489 145 HG22 ILE 16 2HG2 ILE 16 -15.445 -15.433 -11.163 146 HG23 ILE 16 3HG2 ILE 16 -16.595 -14.285 -11.850 147 HD11 ILE 16 1HD1 ILE 16 -12.418 -11.624 -11.136 148 HD12 ILE 16 2HD1 ILE 16 -12.670 -13.368 -11.214 149 HD13 ILE 16 3HD1 ILE 16 -12.826 -12.388 -12.672 150 H SER 17 H SER 17 -15.508 -13.867 -7.531 151 HA SER 17 HA SER 17 -16.841 -16.383 -7.640 152 HB2 SER 17 2HB SER 17 -14.837 -15.162 -6.029 153 HB3 SER 17 3HB SER 17 -16.109 -15.738 -4.953 154 HG SER 17 HG SER 17 -14.552 -17.206 -6.794 155 H GLY 18 H GLY 18 -17.527 -13.284 -6.128 156 HA2 GLY 18 2HA GLY 18 -19.773 -14.293 -4.624 157 HA3 GLY 18 3HA GLY 18 -19.291 -12.611 -4.781 158 H LEU 19 H LEU 19 -19.279 -13.144 -7.817 159 HA LEU 19 HA LEU 19 -22.131 -12.566 -8.164 160 HB2 LEU 19 2HB LEU 19 -20.852 -10.842 -9.081 161 HB3 LEU 19 3HB LEU 19 -19.678 -11.959 -9.772 162 HG LEU 19 HG LEU 19 -21.322 -12.641 -11.455 163 HD11 LEU 19 1HD1 LEU 19 -23.307 -12.141 -9.981 164 HD12 LEU 19 2HD1 LEU 19 -23.450 -11.635 -11.664 165 HD13 LEU 19 3HD1 LEU 19 -23.092 -10.445 -10.413 166 HD21 LEU 19 1HD2 LEU 19 -21.235 -10.661 -12.788 167 HD22 LEU 19 2HD2 LEU 19 -19.760 -10.726 -11.823 168 HD23 LEU 19 3HD2 LEU 19 -21.071 -9.640 -11.359 169 H LYS 20 H LYS 20 -19.751 -14.947 -8.801 170 HA LYS 20 HA LYS 20 -21.014 -16.174 -11.049 171 HB2 LYS 20 2HB LYS 20 -18.674 -16.561 -10.726 172 HB3 LYS 20 3HB LYS 20 -18.936 -17.146 -9.088 173 HG2 LYS 20 2HG LYS 20 -20.438 -18.697 -11.003 174 HG3 LYS 20 3HG LYS 20 -18.718 -18.670 -11.398 175 HD2 LYS 20 2HD LYS 20 -18.121 -19.768 -9.482 176 HD3 LYS 20 3HD LYS 20 -19.491 -19.137 -8.565 177 HE2 LYS 20 2HE LYS 20 -20.989 -20.625 -9.841 178 HE3 LYS 20 3HE LYS 20 -19.588 -21.284 -10.683 179 HZ1 LYS 20 1HZ LYS 20 -20.544 -21.802 -8.002 180 HZ2 LYS 20 2HZ LYS 20 -18.870 -21.595 -8.125 181 HZ3 LYS 20 3HZ LYS 20 -19.643 -22.788 -9.041 182 H GLY 21 H GLY 21 -21.280 -16.492 -7.574 183 HA2 GLY 21 2HA GLY 21 -22.628 -18.967 -7.485 184 HA3 GLY 21 3HA GLY 21 -22.695 -17.720 -6.248 Start of MODEL 8 1 H1 GLY 1 H GLY 1 1.372 -0.266 0.841 2 HA2 GLY 1 2HA GLY 1 1.289 0.691 -1.283 3 HA3 GLY 1 3HA GLY 1 3.011 0.392 -1.459 4 H ILE 2 H ILE 2 3.485 -2.116 -1.447 5 HA ILE 2 HA ILE 2 2.576 -3.160 -3.834 6 HB ILE 2 HB ILE 2 3.312 -5.413 -2.893 7 HG12 ILE 2 2HG1 ILE 2 4.833 -4.356 -0.727 8 HG13 ILE 2 3HG1 ILE 2 3.148 -3.915 -0.469 9 HG21 ILE 2 1HG2 ILE 2 5.448 -4.937 -3.485 10 HG22 ILE 2 2HG2 ILE 2 4.702 -3.430 -4.014 11 HG23 ILE 2 3HG2 ILE 2 5.530 -3.505 -2.459 12 HD11 ILE 2 1HD1 ILE 2 4.077 -6.154 0.460 13 HD12 ILE 2 2HD1 ILE 2 2.471 -6.099 -0.268 14 HD13 ILE 2 3HD1 ILE 2 3.838 -6.721 -1.193 15 H PHE 3 H PHE 3 1.293 -3.647 -0.581 16 HA PHE 3 HA PHE 3 -0.661 -5.574 -1.405 17 HB2 PHE 3 2HB PHE 3 -0.067 -4.091 1.126 18 HB3 PHE 3 3HB PHE 3 -1.624 -4.894 0.949 19 HD1 PHE 3 HD1 PHE 3 -1.161 -7.366 -0.295 20 HD2 PHE 3 HD2 PHE 3 1.362 -5.298 2.439 21 HE1 PHE 3 HE1 PHE 3 -0.136 -9.502 0.369 22 HE2 PHE 3 HE2 PHE 3 2.392 -7.431 3.107 23 HZ PHE 3 HZ PHE 3 1.643 -9.536 2.071 24 H SER 4 H SER 4 -0.502 -2.122 -1.209 25 HA SER 4 HA SER 4 -3.322 -1.653 -1.202 26 HB2 SER 4 2HB SER 4 -1.137 0.242 -2.087 27 HB3 SER 4 3HB SER 4 -2.764 0.667 -1.557 28 HG SER 4 HG SER 4 -2.082 0.606 0.420 29 H LYS 5 H LYS 5 -0.814 -1.759 -3.692 30 HA LYS 5 HA LYS 5 -2.603 -1.062 -5.820 31 HB2 LYS 5 2HB LYS 5 -0.711 -1.653 -7.293 32 HB3 LYS 5 3HB LYS 5 -0.240 -0.543 -6.013 33 HG2 LYS 5 2HG LYS 5 1.502 -2.014 -5.952 34 HG3 LYS 5 3HG LYS 5 0.422 -2.753 -4.767 35 HD2 LYS 5 2HD LYS 5 0.237 -4.603 -5.995 36 HD3 LYS 5 3HD LYS 5 -0.192 -3.672 -7.432 37 HE2 LYS 5 2HE LYS 5 1.989 -3.544 -8.162 38 HE3 LYS 5 3HE LYS 5 2.654 -3.750 -6.543 39 HZ1 LYS 5 1HZ LYS 5 3.085 -5.757 -7.597 40 HZ2 LYS 5 2HZ LYS 5 1.580 -5.809 -8.366 41 HZ3 LYS 5 3HZ LYS 5 1.690 -6.093 -6.702 42 H LEU 6 H LEU 6 -1.391 -4.038 -4.415 43 HA LEU 6 HA LEU 6 -2.368 -5.749 -6.480 44 HB2 LEU 6 2HB LEU 6 -0.645 -6.686 -5.253 45 HB3 LEU 6 3HB LEU 6 -1.312 -6.143 -3.715 46 HG LEU 6 HG LEU 6 -3.076 -7.861 -3.910 47 HD11 LEU 6 1HD1 LEU 6 -3.376 -9.166 -5.709 48 HD12 LEU 6 2HD1 LEU 6 -1.645 -9.349 -5.994 49 HD13 LEU 6 3HD1 LEU 6 -2.483 -7.903 -6.557 50 HD21 LEU 6 1HD2 LEU 6 -0.296 -9.002 -4.161 51 HD22 LEU 6 2HD2 LEU 6 -1.680 -9.740 -3.354 52 HD23 LEU 6 3HD2 LEU 6 -0.954 -8.273 -2.696 53 H ALA 7 H ALA 7 -3.810 -4.146 -3.830 54 HA ALA 7 HA ALA 7 -5.860 -5.833 -3.058 55 HB1 ALA 7 1HB ALA 7 -6.847 -4.006 -2.077 56 HB2 ALA 7 2HB ALA 7 -5.190 -3.430 -2.266 57 HB3 ALA 7 3HB ALA 7 -6.434 -2.929 -3.411 58 H GLY 8 H GLY 8 -5.576 -3.853 -5.948 59 HA2 GLY 8 2HA GLY 8 -8.243 -3.978 -6.818 60 HA3 GLY 8 3HA GLY 8 -6.845 -3.744 -7.856 61 H LYS 9 H LYS 9 -5.798 -6.398 -6.754 62 HA LYS 9 HA LYS 9 -6.990 -8.022 -8.824 63 HB2 LYS 9 2HB LYS 9 -4.480 -7.886 -7.968 64 HB3 LYS 9 3HB LYS 9 -5.035 -9.141 -6.869 65 HG2 LYS 9 2HG LYS 9 -5.014 -9.214 -9.874 66 HG3 LYS 9 3HG LYS 9 -4.071 -10.206 -8.760 67 HD2 LYS 9 2HD LYS 9 -6.143 -11.231 -7.935 68 HD3 LYS 9 3HD LYS 9 -7.075 -10.248 -9.067 69 HE2 LYS 9 2HE LYS 9 -4.922 -11.706 -10.365 70 HE3 LYS 9 3HE LYS 9 -6.053 -12.774 -9.537 71 HZ1 LYS 9 1HZ LYS 9 -6.936 -12.513 -11.659 72 HZ2 LYS 9 2HZ LYS 9 -6.600 -10.857 -11.716 73 HZ3 LYS 9 3HZ LYS 9 -7.842 -11.433 -10.723 74 H LYS 10 H LYS 10 -6.357 -8.619 -5.362 75 HA LYS 10 HA LYS 10 -7.902 -10.850 -5.008 76 HB2 LYS 10 2HB LYS 10 -6.438 -9.836 -3.281 77 HB3 LYS 10 3HB LYS 10 -7.637 -8.572 -3.037 78 HG2 LYS 10 2HG LYS 10 -8.274 -11.484 -2.677 79 HG3 LYS 10 3HG LYS 10 -7.631 -10.480 -1.375 80 HD2 LYS 10 2HD LYS 10 -9.613 -8.890 -2.105 81 HD3 LYS 10 3HD LYS 10 -10.294 -10.404 -2.704 82 HE2 LYS 10 2HE LYS 10 -10.864 -11.019 -0.646 83 HE3 LYS 10 3HE LYS 10 -9.214 -10.784 -0.072 84 HZ1 LYS 10 1HZ LYS 10 -9.675 -8.712 0.692 85 HZ2 LYS 10 2HZ LYS 10 -11.217 -9.383 0.864 86 HZ3 LYS 10 3HZ LYS 10 -10.865 -8.404 -0.470 87 H ILE 11 H ILE 11 -8.980 -7.473 -4.722 88 HA ILE 11 HA ILE 11 -11.624 -7.935 -4.017 89 HB ILE 11 HB ILE 11 -12.140 -5.733 -4.918 90 HG12 ILE 11 2HG1 ILE 11 -9.887 -4.608 -5.902 91 HG13 ILE 11 3HG1 ILE 11 -9.682 -6.255 -6.487 92 HG21 ILE 11 1HG2 ILE 11 -11.169 -5.534 -2.829 93 HG22 ILE 11 2HG2 ILE 11 -9.599 -6.104 -3.390 94 HG23 ILE 11 3HG2 ILE 11 -10.150 -4.484 -3.813 95 HD11 ILE 11 1HD1 ILE 11 -12.360 -5.390 -6.982 96 HD12 ILE 11 2HD1 ILE 11 -11.216 -4.205 -7.615 97 HD13 ILE 11 3HD1 ILE 11 -11.114 -5.889 -8.126 98 H LYS 12 H LYS 12 -10.087 -8.011 -7.178 99 HA LYS 12 HA LYS 12 -12.532 -8.237 -8.648 100 HB2 LYS 12 2HB LYS 12 -10.033 -7.561 -9.361 101 HB3 LYS 12 3HB LYS 12 -10.000 -9.260 -9.815 102 HG2 LYS 12 2HG LYS 12 -12.048 -7.265 -10.759 103 HG3 LYS 12 3HG LYS 12 -10.627 -7.775 -11.674 104 HD2 LYS 12 2HD LYS 12 -11.703 -10.176 -11.064 105 HD3 LYS 12 3HD LYS 12 -13.163 -9.189 -11.157 106 HE2 LYS 12 2HE LYS 12 -11.045 -9.296 -13.300 107 HE3 LYS 12 3HE LYS 12 -12.513 -10.273 -13.308 108 HZ1 LYS 12 1HZ LYS 12 -12.790 -7.375 -13.006 109 HZ2 LYS 12 2HZ LYS 12 -13.816 -8.483 -13.768 110 HZ3 LYS 12 3HZ LYS 12 -12.397 -7.976 -14.538 111 H ASN 13 H ASN 13 -10.351 -10.458 -7.096 112 HA ASN 13 HA ASN 13 -11.272 -12.803 -8.444 113 HB2 ASN 13 2HB ASN 13 -9.058 -12.399 -7.113 114 HB3 ASN 13 3HB ASN 13 -10.024 -12.866 -5.717 115 HD21 ASN 13 1HD2 ASN 13 -8.127 -14.492 -5.930 116 HD22 ASN 13 2HD2 ASN 13 -8.520 -15.963 -6.748 117 H LEU 14 H LEU 14 -12.198 -11.069 -5.547 118 HA LEU 14 HA LEU 14 -13.966 -13.144 -4.614 119 HB2 LEU 14 2HB LEU 14 -12.874 -11.677 -3.023 120 HB3 LEU 14 3HB LEU 14 -13.631 -10.270 -3.768 121 HG LEU 14 HG LEU 14 -15.764 -10.857 -2.920 122 HD11 LEU 14 1HD1 LEU 14 -14.543 -13.467 -2.037 123 HD12 LEU 14 2HD1 LEU 14 -15.691 -13.247 -3.357 124 HD13 LEU 14 3HD1 LEU 14 -16.188 -12.931 -1.695 125 HD21 LEU 14 1HD2 LEU 14 -14.028 -9.907 -1.329 126 HD22 LEU 14 2HD2 LEU 14 -13.889 -11.538 -0.672 127 HD23 LEU 14 3HD2 LEU 14 -15.431 -10.685 -0.597 128 H LEU 15 H LEU 15 -14.225 -10.178 -6.466 129 HA LEU 15 HA LEU 15 -17.025 -9.895 -6.386 130 HB2 LEU 15 2HB LEU 15 -15.326 -8.200 -7.164 131 HB3 LEU 15 3HB LEU 15 -15.232 -9.107 -8.672 132 HG LEU 15 HG LEU 15 -17.559 -8.613 -9.148 133 HD11 LEU 15 1HD1 LEU 15 -17.516 -7.176 -6.500 134 HD12 LEU 15 2HD1 LEU 15 -18.480 -8.589 -6.930 135 HD13 LEU 15 3HD1 LEU 15 -18.802 -7.035 -7.699 136 HD21 LEU 15 1HD2 LEU 15 -17.019 -6.639 -10.039 137 HD22 LEU 15 2HD2 LEU 15 -15.466 -6.827 -9.225 138 HD23 LEU 15 3HD2 LEU 15 -16.757 -5.901 -8.458 139 H ILE 16 H ILE 16 -14.892 -11.569 -8.672 140 HA ILE 16 HA ILE 16 -16.958 -12.407 -10.422 141 HB ILE 16 HB ILE 16 -14.641 -12.344 -11.164 142 HG12 ILE 16 2HG1 ILE 16 -16.001 -15.033 -11.172 143 HG13 ILE 16 3HG1 ILE 16 -15.981 -13.816 -12.443 144 HG21 ILE 16 1HG2 ILE 16 -13.676 -13.028 -8.963 145 HG22 ILE 16 2HG2 ILE 16 -14.127 -14.689 -9.346 146 HG23 ILE 16 3HG2 ILE 16 -12.960 -13.837 -10.358 147 HD11 ILE 16 1HD1 ILE 16 -13.708 -15.580 -11.574 148 HD12 ILE 16 2HD1 ILE 16 -14.580 -15.620 -13.107 149 HD13 ILE 16 3HD1 ILE 16 -13.546 -14.246 -12.715 150 H SER 17 H SER 17 -15.433 -13.860 -7.597 151 HA SER 17 HA SER 17 -16.715 -16.394 -7.876 152 HB2 SER 17 2HB SER 17 -15.017 -15.055 -5.842 153 HB3 SER 17 3HB SER 17 -16.062 -16.352 -5.262 154 HG SER 17 HG SER 17 -14.549 -17.610 -5.989 155 H GLY 18 H GLY 18 -17.469 -13.398 -6.202 156 HA2 GLY 18 2HA GLY 18 -19.711 -14.531 -4.779 157 HA3 GLY 18 3HA GLY 18 -19.255 -12.835 -4.831 158 H LEU 19 H LEU 19 -19.205 -13.188 -7.893 159 HA LEU 19 HA LEU 19 -22.062 -12.633 -8.235 160 HB2 LEU 19 2HB LEU 19 -20.802 -10.840 -9.039 161 HB3 LEU 19 3HB LEU 19 -19.603 -11.898 -9.779 162 HG LEU 19 HG LEU 19 -21.219 -12.508 -11.517 163 HD11 LEU 19 1HD1 LEU 19 -23.033 -10.400 -10.374 164 HD12 LEU 19 2HD1 LEU 19 -23.227 -12.120 -10.037 165 HD13 LEU 19 3HD1 LEU 19 -23.360 -11.526 -11.692 166 HD21 LEU 19 1HD2 LEU 19 -21.012 -9.514 -11.247 167 HD22 LEU 19 2HD2 LEU 19 -21.150 -10.452 -12.734 168 HD23 LEU 19 3HD2 LEU 19 -19.683 -10.554 -11.759 169 H LYS 20 H LYS 20 -19.644 -14.942 -8.980 170 HA LYS 20 HA LYS 20 -20.863 -16.053 -11.310 171 HB2 LYS 20 2HB LYS 20 -18.522 -16.427 -10.975 172 HB3 LYS 20 3HB LYS 20 -18.799 -17.115 -9.381 173 HG2 LYS 20 2HG LYS 20 -20.255 -18.565 -11.405 174 HG3 LYS 20 3HG LYS 20 -18.532 -18.489 -11.780 175 HD2 LYS 20 2HD LYS 20 -17.931 -19.588 -9.820 176 HD3 LYS 20 3HD LYS 20 -19.460 -19.208 -9.024 177 HE2 LYS 20 2HE LYS 20 -19.779 -20.794 -11.452 178 HE3 LYS 20 3HE LYS 20 -18.813 -21.599 -10.216 179 HZ1 LYS 20 1HZ LYS 20 -21.043 -22.188 -9.817 180 HZ2 LYS 20 2HZ LYS 20 -21.590 -20.595 -9.979 181 HZ3 LYS 20 3HZ LYS 20 -20.663 -21.039 -8.635 182 H GLY 21 H GLY 21 -21.173 -16.567 -7.864 183 HA2 GLY 21 2HA GLY 21 -22.563 -19.050 -8.023 184 HA3 GLY 21 3HA GLY 21 -22.510 -17.978 -6.631 Start of MODEL 9 1 H1 GLY 1 H GLY 1 2.488 1.845 -1.607 2 HA2 GLY 1 2HA GLY 1 2.974 -0.419 -0.624 3 HA3 GLY 1 3HA GLY 1 1.269 0.008 -0.578 4 H ILE 2 H ILE 2 3.455 -2.330 -1.471 5 HA ILE 2 HA ILE 2 2.531 -3.401 -3.840 6 HB ILE 2 HB ILE 2 3.189 -5.652 -2.841 7 HG12 ILE 2 2HG1 ILE 2 4.727 -4.592 -0.689 8 HG13 ILE 2 3HG1 ILE 2 3.055 -4.094 -0.454 9 HG21 ILE 2 1HG2 ILE 2 5.435 -5.244 -3.238 10 HG22 ILE 2 2HG2 ILE 2 4.645 -3.925 -4.100 11 HG23 ILE 2 3HG2 ILE 2 5.374 -3.634 -2.521 12 HD11 ILE 2 1HD1 ILE 2 3.662 -6.936 -1.106 13 HD12 ILE 2 2HD1 ILE 2 3.907 -6.337 0.535 14 HD13 ILE 2 3HD1 ILE 2 2.309 -6.250 -0.207 15 H PHE 3 H PHE 3 1.211 -3.771 -0.587 16 HA PHE 3 HA PHE 3 -0.797 -5.655 -1.381 17 HB2 PHE 3 2HB PHE 3 -0.211 -4.110 1.121 18 HB3 PHE 3 3HB PHE 3 -1.758 -4.931 0.942 19 HD1 PHE 3 HD1 PHE 3 -1.244 -7.428 -0.242 20 HD2 PHE 3 HD2 PHE 3 1.201 -5.271 2.494 21 HE1 PHE 3 HE1 PHE 3 -0.209 -9.536 0.489 22 HE2 PHE 3 HE2 PHE 3 2.240 -7.376 3.229 23 HZ PHE 3 HZ PHE 3 1.536 -9.512 2.226 24 H SER 4 H SER 4 -0.532 -2.206 -1.265 25 HA SER 4 HA SER 4 -3.336 -1.650 -1.291 26 HB2 SER 4 2HB SER 4 -1.081 0.151 -2.199 27 HB3 SER 4 3HB SER 4 -2.701 0.644 -1.705 28 HG SER 4 HG SER 4 -1.225 0.929 -0.009 29 H LYS 5 H LYS 5 -0.815 -1.894 -3.758 30 HA LYS 5 HA LYS 5 -2.567 -1.193 -5.917 31 HB2 LYS 5 2HB LYS 5 -0.683 -1.876 -7.360 32 HB3 LYS 5 3HB LYS 5 -0.188 -0.750 -6.103 33 HG2 LYS 5 2HG LYS 5 1.508 -2.270 -5.994 34 HG3 LYS 5 3HG LYS 5 0.399 -2.949 -4.801 35 HD2 LYS 5 2HD LYS 5 0.165 -4.821 -5.987 36 HD3 LYS 5 3HD LYS 5 -0.224 -3.911 -7.449 37 HE2 LYS 5 2HE LYS 5 2.609 -4.095 -6.516 38 HE3 LYS 5 3HE LYS 5 1.884 -5.447 -7.384 39 HZ1 LYS 5 1HZ LYS 5 1.442 -2.881 -8.620 40 HZ2 LYS 5 2HZ LYS 5 1.951 -4.341 -9.308 41 HZ3 LYS 5 3HZ LYS 5 3.072 -3.329 -8.546 42 H LEU 6 H LEU 6 -1.455 -4.170 -4.431 43 HA LEU 6 HA LEU 6 -2.469 -5.899 -6.464 44 HB2 LEU 6 2HB LEU 6 -0.778 -6.850 -5.197 45 HB3 LEU 6 3HB LEU 6 -1.452 -6.264 -3.678 46 HG LEU 6 HG LEU 6 -3.250 -7.942 -3.859 47 HD11 LEU 6 1HD1 LEU 6 -1.704 -9.152 -6.130 48 HD12 LEU 6 2HD1 LEU 6 -3.063 -8.060 -6.394 49 HD13 LEU 6 3HD1 LEU 6 -3.308 -9.581 -5.535 50 HD21 LEU 6 1HD2 LEU 6 -0.455 -9.064 -4.035 51 HD22 LEU 6 2HD2 LEU 6 -1.860 -9.894 -3.365 52 HD23 LEU 6 3HD2 LEU 6 -1.235 -8.442 -2.581 53 H ALA 7 H ALA 7 -3.881 -4.189 -3.867 54 HA ALA 7 HA ALA 7 -5.987 -5.801 -3.075 55 HB1 ALA 7 1HB ALA 7 -6.595 -2.932 -3.456 56 HB2 ALA 7 2HB ALA 7 -6.815 -3.963 -2.041 57 HB3 ALA 7 3HB ALA 7 -5.217 -3.325 -2.428 58 H GLY 8 H GLY 8 -5.588 -3.937 -6.016 59 HA2 GLY 8 2HA GLY 8 -8.267 -3.973 -6.895 60 HA3 GLY 8 3HA GLY 8 -6.854 -3.793 -7.925 61 H LYS 9 H LYS 9 -5.887 -6.457 -6.779 62 HA LYS 9 HA LYS 9 -7.119 -8.079 -8.829 63 HB2 LYS 9 2HB LYS 9 -4.603 -7.990 -7.980 64 HB3 LYS 9 3HB LYS 9 -5.186 -9.218 -6.865 65 HG2 LYS 9 2HG LYS 9 -5.148 -9.326 -9.868 66 HG3 LYS 9 3HG LYS 9 -4.263 -10.345 -8.730 67 HD2 LYS 9 2HD LYS 9 -6.395 -11.268 -7.925 68 HD3 LYS 9 3HD LYS 9 -7.260 -10.268 -9.094 69 HE2 LYS 9 2HE LYS 9 -6.643 -11.562 -10.861 70 HE3 LYS 9 3HE LYS 9 -5.098 -12.005 -10.137 71 HZ1 LYS 9 1HZ LYS 9 -6.253 -13.516 -8.659 72 HZ2 LYS 9 2HZ LYS 9 -6.609 -13.892 -10.269 73 HZ3 LYS 9 3HZ LYS 9 -7.746 -13.075 -9.320 74 H LYS 10 H LYS 10 -6.492 -8.638 -5.359 75 HA LYS 10 HA LYS 10 -8.047 -10.832 -4.939 76 HB2 LYS 10 2HB LYS 10 -6.812 -10.117 -3.093 77 HB3 LYS 10 3HB LYS 10 -7.424 -8.472 -3.197 78 HG2 LYS 10 2HG LYS 10 -8.290 -9.739 -1.258 79 HG3 LYS 10 3HG LYS 10 -9.556 -9.142 -2.335 80 HD2 LYS 10 2HD LYS 10 -10.228 -11.215 -2.884 81 HD3 LYS 10 3HD LYS 10 -8.575 -11.823 -3.001 82 HE2 LYS 10 2HE LYS 10 -10.010 -11.306 -0.401 83 HE3 LYS 10 3HE LYS 10 -9.943 -12.878 -1.197 84 HZ1 LYS 10 1HZ LYS 10 -7.412 -11.503 -0.707 85 HZ2 LYS 10 2HZ LYS 10 -7.768 -13.156 -0.673 86 HZ3 LYS 10 3HZ LYS 10 -8.204 -12.171 0.631 87 H ILE 11 H ILE 11 -9.156 -7.456 -4.838 88 HA ILE 11 HA ILE 11 -11.811 -7.903 -4.163 89 HB ILE 11 HB ILE 11 -12.306 -5.762 -5.343 90 HG12 ILE 11 2HG1 ILE 11 -9.855 -4.696 -5.938 91 HG13 ILE 11 3HG1 ILE 11 -9.665 -6.355 -6.496 92 HG21 ILE 11 1HG2 ILE 11 -9.873 -5.763 -3.560 93 HG22 ILE 11 2HG2 ILE 11 -10.901 -4.369 -3.890 94 HG23 ILE 11 3HG2 ILE 11 -11.556 -5.764 -3.032 95 HD11 ILE 11 1HD1 ILE 11 -10.901 -4.219 -7.820 96 HD12 ILE 11 2HD1 ILE 11 -10.822 -5.908 -8.322 97 HD13 ILE 11 3HD1 ILE 11 -12.188 -5.335 -7.366 98 H LYS 12 H LYS 12 -10.279 -7.892 -7.358 99 HA LYS 12 HA LYS 12 -12.632 -8.237 -8.866 100 HB2 LYS 12 2HB LYS 12 -10.048 -7.765 -9.493 101 HB3 LYS 12 3HB LYS 12 -10.143 -9.477 -9.884 102 HG2 LYS 12 2HG LYS 12 -11.864 -7.278 -11.010 103 HG3 LYS 12 3HG LYS 12 -10.589 -8.163 -11.850 104 HD2 LYS 12 2HD LYS 12 -12.046 -10.247 -11.144 105 HD3 LYS 12 3HD LYS 12 -13.332 -9.039 -11.086 106 HE2 LYS 12 2HE LYS 12 -11.596 -8.987 -13.474 107 HE3 LYS 12 3HE LYS 12 -12.649 -10.392 -13.311 108 HZ1 LYS 12 1HZ LYS 12 -14.475 -9.172 -13.692 109 HZ2 LYS 12 2HZ LYS 12 -13.402 -8.079 -14.410 110 HZ3 LYS 12 3HZ LYS 12 -13.917 -7.835 -12.817 111 H ASN 13 H ASN 13 -10.558 -10.490 -7.177 112 HA ASN 13 HA ASN 13 -11.636 -12.844 -8.384 113 HB2 ASN 13 2HB ASN 13 -9.389 -12.774 -7.340 114 HB3 ASN 13 3HB ASN 13 -10.146 -12.552 -5.766 115 HD21 ASN 13 1HD2 ASN 13 -10.417 -14.311 -4.612 116 HD22 ASN 13 2HD2 ASN 13 -10.525 -15.924 -5.221 117 H LEU 14 H LEU 14 -12.640 -10.744 -5.860 118 HA LEU 14 HA LEU 14 -14.371 -12.696 -4.598 119 HB2 LEU 14 2HB LEU 14 -13.302 -11.023 -3.215 120 HB3 LEU 14 3HB LEU 14 -14.031 -9.732 -4.168 121 HG LEU 14 HG LEU 14 -16.183 -10.168 -3.283 122 HD11 LEU 14 1HD1 LEU 14 -15.014 -12.644 -2.021 123 HD12 LEU 14 2HD1 LEU 14 -16.138 -12.596 -3.379 124 HD13 LEU 14 3HD1 LEU 14 -16.656 -12.045 -1.786 125 HD21 LEU 14 1HD2 LEU 14 -15.789 -10.018 -0.824 126 HD22 LEU 14 2HD2 LEU 14 -14.833 -8.887 -1.781 127 HD23 LEU 14 3HD2 LEU 14 -14.083 -10.344 -1.129 128 H LEU 15 H LEU 15 -14.646 -9.923 -6.756 129 HA LEU 15 HA LEU 15 -17.443 -9.706 -6.776 130 HB2 LEU 15 2HB LEU 15 -15.579 -9.125 -9.070 131 HB3 LEU 15 3HB LEU 15 -17.185 -8.449 -8.809 132 HG LEU 15 HG LEU 15 -14.588 -7.732 -7.545 133 HD11 LEU 15 1HD1 LEU 15 -16.888 -6.371 -8.852 134 HD12 LEU 15 2HD1 LEU 15 -15.156 -6.166 -9.112 135 HD13 LEU 15 3HD1 LEU 15 -15.921 -5.472 -7.682 136 HD21 LEU 15 1HD2 LEU 15 -16.129 -6.466 -5.844 137 HD22 LEU 15 2HD2 LEU 15 -15.610 -8.122 -5.528 138 HD23 LEU 15 3HD2 LEU 15 -17.227 -7.810 -6.161 139 H ILE 16 H ILE 16 -15.240 -11.577 -8.832 140 HA ILE 16 HA ILE 16 -17.241 -12.633 -10.530 141 HB ILE 16 HB ILE 16 -14.896 -12.645 -11.188 142 HG12 ILE 16 2HG1 ILE 16 -16.260 -15.321 -10.943 143 HG13 ILE 16 3HG1 ILE 16 -16.189 -14.255 -12.342 144 HG21 ILE 16 1HG2 ILE 16 -14.138 -13.165 -8.788 145 HG22 ILE 16 2HG2 ILE 16 -14.365 -14.855 -9.236 146 HG23 ILE 16 3HG2 ILE 16 -13.214 -13.855 -10.122 147 HD11 ILE 16 1HD1 ILE 16 -13.748 -14.710 -12.474 148 HD12 ILE 16 2HD1 ILE 16 -13.956 -15.906 -11.194 149 HD13 ILE 16 3HD1 ILE 16 -14.770 -16.122 -12.744 150 H SER 17 H SER 17 -15.814 -13.750 -7.506 151 HA SER 17 HA SER 17 -17.073 -16.306 -7.534 152 HB2 SER 17 2HB SER 17 -15.545 -14.696 -5.542 153 HB3 SER 17 3HB SER 17 -16.536 -16.025 -4.942 154 HG SER 17 HG SER 17 -14.729 -17.063 -5.413 155 H GLY 18 H GLY 18 -17.903 -13.154 -6.198 156 HA2 GLY 18 2HA GLY 18 -20.211 -14.138 -4.783 157 HA3 GLY 18 3HA GLY 18 -19.763 -12.454 -5.009 158 H LEU 19 H LEU 19 -19.570 -13.147 -8.004 159 HA LEU 19 HA LEU 19 -22.393 -12.609 -8.543 160 HB2 LEU 19 2HB LEU 19 -21.019 -11.010 -9.556 161 HB3 LEU 19 3HB LEU 19 -19.860 -12.221 -10.098 162 HG LEU 19 HG LEU 19 -21.461 -13.005 -11.774 163 HD11 LEU 19 1HD1 LEU 19 -23.207 -10.690 -10.970 164 HD12 LEU 19 2HD1 LEU 19 -23.487 -12.349 -10.440 165 HD13 LEU 19 3HD1 LEU 19 -23.550 -11.950 -12.156 166 HD21 LEU 19 1HD2 LEU 19 -21.262 -11.167 -13.276 167 HD22 LEU 19 2HD2 LEU 19 -19.836 -11.155 -12.238 168 HD23 LEU 19 3HD2 LEU 19 -21.150 -10.014 -11.946 169 H LYS 20 H LYS 20 -20.017 -15.071 -8.877 170 HA LYS 20 HA LYS 20 -21.554 -16.524 -10.885 171 HB2 LYS 20 2HB LYS 20 -19.708 -17.985 -11.072 172 HB3 LYS 20 3HB LYS 20 -19.013 -16.380 -10.891 173 HG2 LYS 20 2HG LYS 20 -18.798 -16.910 -8.421 174 HG3 LYS 20 3HG LYS 20 -19.165 -18.581 -8.856 175 HD2 LYS 20 2HD LYS 20 -16.883 -16.934 -9.949 176 HD3 LYS 20 3HD LYS 20 -16.749 -18.192 -8.718 177 HE2 LYS 20 2HE LYS 20 -16.328 -19.560 -10.441 178 HE3 LYS 20 3HE LYS 20 -18.067 -19.498 -10.720 179 HZ1 LYS 20 1HZ LYS 20 -17.570 -17.498 -12.161 180 HZ2 LYS 20 2HZ LYS 20 -17.087 -19.000 -12.769 181 HZ3 LYS 20 3HZ LYS 20 -15.943 -17.957 -12.086 182 H GLY 21 H GLY 21 -20.743 -16.654 -7.469 183 HA2 GLY 21 2HA GLY 21 -22.277 -19.143 -7.181 184 HA3 GLY 21 3HA GLY 21 -21.201 -18.455 -5.974 Start of MODEL 10 1 H1 GLY 1 H GLY 1 2.694 0.041 0.512 2 HA2 GLY 1 2HA GLY 1 0.997 0.762 -1.596 3 HA3 GLY 1 3HA GLY 1 2.738 0.558 -1.723 4 H ILE 2 H ILE 2 3.355 -1.916 -1.617 5 HA ILE 2 HA ILE 2 2.547 -3.086 -3.987 6 HB ILE 2 HB ILE 2 3.429 -5.251 -2.979 7 HG12 ILE 2 2HG1 ILE 2 4.844 -4.043 -0.822 8 HG13 ILE 2 3HG1 ILE 2 3.131 -3.706 -0.596 9 HG21 ILE 2 1HG2 ILE 2 5.330 -2.938 -2.720 10 HG22 ILE 2 2HG2 ILE 2 5.671 -4.585 -3.251 11 HG23 ILE 2 3HG2 ILE 2 4.731 -3.505 -4.279 12 HD11 ILE 2 1HD1 ILE 2 2.594 -5.923 -0.345 13 HD12 ILE 2 2HD1 ILE 2 4.011 -6.479 -1.236 14 HD13 ILE 2 3HD1 ILE 2 4.189 -5.855 0.404 15 H PHE 3 H PHE 3 1.254 -3.527 -0.735 16 HA PHE 3 HA PHE 3 -0.563 -5.609 -1.523 17 HB2 PHE 3 2HB PHE 3 0.098 -4.160 0.971 18 HB3 PHE 3 3HB PHE 3 -1.552 -4.763 0.850 19 HD1 PHE 3 HD1 PHE 3 -1.594 -7.283 -0.186 20 HD2 PHE 3 HD2 PHE 3 1.559 -5.527 2.070 21 HE1 PHE 3 HE1 PHE 3 -0.824 -9.524 0.476 22 HE2 PHE 3 HE2 PHE 3 2.334 -7.765 2.736 23 HZ PHE 3 HZ PHE 3 1.143 -9.767 1.938 24 H SER 4 H SER 4 -0.609 -2.155 -1.406 25 HA SER 4 HA SER 4 -3.456 -1.860 -1.400 26 HB2 SER 4 2HB SER 4 -1.444 0.180 -2.356 27 HB3 SER 4 3HB SER 4 -3.059 0.474 -1.712 28 HG SER 4 HG SER 4 -2.037 -0.722 0.224 29 H LYS 5 H LYS 5 -0.939 -1.870 -3.879 30 HA LYS 5 HA LYS 5 -2.717 -1.266 -6.032 31 HB2 LYS 5 2HB LYS 5 -0.802 -1.919 -7.473 32 HB3 LYS 5 3HB LYS 5 -0.372 -0.732 -6.248 33 HG2 LYS 5 2HG LYS 5 1.397 -2.155 -6.073 34 HG3 LYS 5 3HG LYS 5 0.309 -2.870 -4.881 35 HD2 LYS 5 2HD LYS 5 0.193 -4.774 -6.032 36 HD3 LYS 5 3HD LYS 5 -0.220 -3.916 -7.518 37 HE2 LYS 5 2HE LYS 5 2.360 -3.333 -7.465 38 HE3 LYS 5 3HE LYS 5 2.430 -4.808 -6.502 39 HZ1 LYS 5 1HZ LYS 5 2.768 -5.331 -8.805 40 HZ2 LYS 5 2HZ LYS 5 1.337 -4.546 -9.250 41 HZ3 LYS 5 3HZ LYS 5 1.272 -5.958 -8.322 42 H LEU 6 H LEU 6 -1.469 -4.212 -4.580 43 HA LEU 6 HA LEU 6 -2.445 -5.965 -6.607 44 HB2 LEU 6 2HB LEU 6 -0.990 -7.241 -5.516 45 HB3 LEU 6 3HB LEU 6 -1.003 -6.170 -4.117 46 HG LEU 6 HG LEU 6 -3.202 -8.164 -4.517 47 HD11 LEU 6 1HD1 LEU 6 -0.468 -8.687 -3.371 48 HD12 LEU 6 2HD1 LEU 6 -1.259 -9.527 -4.704 49 HD13 LEU 6 3HD1 LEU 6 -1.874 -9.705 -3.061 50 HD21 LEU 6 1HD2 LEU 6 -3.822 -6.944 -2.721 51 HD22 LEU 6 2HD2 LEU 6 -2.176 -6.418 -2.370 52 HD23 LEU 6 3HD2 LEU 6 -2.712 -8.025 -1.879 53 H ALA 7 H ALA 7 -3.854 -4.404 -3.880 54 HA ALA 7 HA ALA 7 -5.911 -6.096 -3.154 55 HB1 ALA 7 1HB ALA 7 -5.542 -4.110 -1.904 56 HB2 ALA 7 2HB ALA 7 -5.847 -3.090 -3.311 57 HB3 ALA 7 3HB ALA 7 -7.169 -3.999 -2.578 58 H GLY 8 H GLY 8 -5.668 -3.977 -5.956 59 HA2 GLY 8 2HA GLY 8 -8.321 -4.031 -6.818 60 HA3 GLY 8 3HA GLY 8 -6.926 -3.840 -7.870 61 H LYS 9 H LYS 9 -5.965 -6.543 -6.822 62 HA LYS 9 HA LYS 9 -7.266 -8.095 -8.885 63 HB2 LYS 9 2HB LYS 9 -4.727 -8.051 -8.103 64 HB3 LYS 9 3HB LYS 9 -5.290 -9.306 -7.008 65 HG2 LYS 9 2HG LYS 9 -5.361 -9.328 -10.014 66 HG3 LYS 9 3HG LYS 9 -4.417 -10.368 -8.945 67 HD2 LYS 9 2HD LYS 9 -6.495 -11.341 -8.074 68 HD3 LYS 9 3HD LYS 9 -7.427 -10.311 -9.162 69 HE2 LYS 9 2HE LYS 9 -7.278 -12.432 -10.205 70 HE3 LYS 9 3HE LYS 9 -6.161 -11.374 -11.064 71 HZ1 LYS 9 1HZ LYS 9 -5.369 -13.700 -10.414 72 HZ2 LYS 9 2HZ LYS 9 -5.226 -13.081 -8.846 73 HZ3 LYS 9 3HZ LYS 9 -4.331 -12.399 -10.109 74 H LYS 10 H LYS 10 -6.540 -8.770 -5.455 75 HA LYS 10 HA LYS 10 -8.159 -10.951 -5.093 76 HB2 LYS 10 2HB LYS 10 -6.792 -10.437 -3.280 77 HB3 LYS 10 3HB LYS 10 -7.291 -8.751 -3.254 78 HG2 LYS 10 2HG LYS 10 -8.134 -10.068 -1.340 79 HG3 LYS 10 3HG LYS 10 -9.414 -9.329 -2.305 80 HD2 LYS 10 2HD LYS 10 -10.286 -11.316 -2.846 81 HD3 LYS 10 3HD LYS 10 -8.703 -11.994 -3.236 82 HE2 LYS 10 2HE LYS 10 -8.289 -12.336 -0.830 83 HE3 LYS 10 3HE LYS 10 -9.903 -11.718 -0.481 84 HZ1 LYS 10 1HZ LYS 10 -9.594 -13.973 -2.341 85 HZ2 LYS 10 2HZ LYS 10 -10.900 -13.579 -1.340 86 HZ3 LYS 10 3HZ LYS 10 -9.500 -14.258 -0.676 87 H ILE 11 H ILE 11 -9.078 -7.537 -4.780 88 HA ILE 11 HA ILE 11 -11.714 -7.905 -3.950 89 HB ILE 11 HB ILE 11 -12.168 -5.664 -4.778 90 HG12 ILE 11 2HG1 ILE 11 -9.920 -4.607 -5.839 91 HG13 ILE 11 3HG1 ILE 11 -9.798 -6.250 -6.459 92 HG21 ILE 11 1HG2 ILE 11 -9.590 -6.184 -3.363 93 HG22 ILE 11 2HG2 ILE 11 -10.065 -4.530 -3.744 94 HG23 ILE 11 3HG2 ILE 11 -11.104 -5.535 -2.734 95 HD11 ILE 11 1HD1 ILE 11 -11.303 -5.824 -8.020 96 HD12 ILE 11 2HD1 ILE 11 -12.461 -5.249 -6.820 97 HD13 ILE 11 3HD1 ILE 11 -11.280 -4.136 -7.511 98 H LYS 12 H LYS 12 -10.293 -7.988 -7.163 99 HA LYS 12 HA LYS 12 -12.796 -8.075 -8.549 100 HB2 LYS 12 2HB LYS 12 -10.288 -7.498 -9.333 101 HB3 LYS 12 3HB LYS 12 -10.362 -9.182 -9.835 102 HG2 LYS 12 2HG LYS 12 -12.310 -7.034 -10.651 103 HG3 LYS 12 3HG LYS 12 -10.979 -7.646 -11.637 104 HD2 LYS 12 2HD LYS 12 -12.200 -9.962 -11.028 105 HD3 LYS 12 3HD LYS 12 -13.589 -8.873 -10.988 106 HE2 LYS 12 2HE LYS 12 -13.629 -8.719 -13.210 107 HE3 LYS 12 3HE LYS 12 -11.905 -8.357 -13.281 108 HZ1 LYS 12 1HZ LYS 12 -11.412 -10.457 -13.806 109 HZ2 LYS 12 2HZ LYS 12 -13.046 -10.610 -14.215 110 HZ3 LYS 12 3HZ LYS 12 -12.505 -11.114 -12.693 111 H ASN 13 H ASN 13 -10.630 -10.425 -7.157 112 HA ASN 13 HA ASN 13 -11.727 -12.693 -8.503 113 HB2 ASN 13 2HB ASN 13 -9.432 -12.357 -7.212 114 HB3 ASN 13 3HB ASN 13 -10.375 -12.971 -5.857 115 HD21 ASN 13 1HD2 ASN 13 -8.677 -14.666 -6.069 116 HD22 ASN 13 2HD2 ASN 13 -9.014 -16.001 -7.113 117 H LEU 14 H LEU 14 -12.440 -10.970 -5.548 118 HA LEU 14 HA LEU 14 -14.214 -12.999 -4.530 119 HB2 LEU 14 2HB LEU 14 -12.994 -11.564 -2.999 120 HB3 LEU 14 3HB LEU 14 -13.763 -10.138 -3.693 121 HG LEU 14 HG LEU 14 -15.852 -10.677 -2.723 122 HD11 LEU 14 1HD1 LEU 14 -14.655 -13.334 -1.950 123 HD12 LEU 14 2HD1 LEU 14 -15.877 -13.060 -3.191 124 HD13 LEU 14 3HD1 LEU 14 -16.259 -12.757 -1.497 125 HD21 LEU 14 1HD2 LEU 14 -13.537 -11.094 -0.858 126 HD22 LEU 14 2HD2 LEU 14 -15.202 -11.048 -0.279 127 HD23 LEU 14 3HD2 LEU 14 -14.514 -9.646 -1.100 128 H LEU 15 H LEU 15 -14.491 -9.999 -6.332 129 HA LEU 15 HA LEU 15 -17.276 -9.656 -6.113 130 HB2 LEU 15 2HB LEU 15 -16.113 -7.801 -6.887 131 HB3 LEU 15 3HB LEU 15 -15.202 -8.744 -8.065 132 HG LEU 15 HG LEU 15 -18.139 -8.495 -8.454 133 HD11 LEU 15 1HD1 LEU 15 -17.852 -6.358 -9.612 134 HD12 LEU 15 2HD1 LEU 15 -16.179 -6.285 -9.059 135 HD13 LEU 15 3HD1 LEU 15 -17.498 -6.219 -7.890 136 HD21 LEU 15 1HD2 LEU 15 -17.193 -8.220 -10.848 137 HD22 LEU 15 2HD2 LEU 15 -17.137 -9.807 -10.079 138 HD23 LEU 15 3HD2 LEU 15 -15.687 -8.804 -10.140 139 H ILE 16 H ILE 16 -15.297 -11.338 -8.528 140 HA ILE 16 HA ILE 16 -17.445 -12.095 -10.204 141 HB ILE 16 HB ILE 16 -15.159 -12.124 -11.025 142 HG12 ILE 16 2HG1 ILE 16 -16.581 -14.782 -10.971 143 HG13 ILE 16 3HG1 ILE 16 -16.614 -13.559 -12.236 144 HG21 ILE 16 1HG2 ILE 16 -13.510 -13.691 -10.275 145 HG22 ILE 16 2HG2 ILE 16 -14.127 -12.822 -8.871 146 HG23 ILE 16 3HG2 ILE 16 -14.669 -14.468 -9.197 147 HD11 ILE 16 1HD1 ILE 16 -14.215 -14.020 -12.659 148 HD12 ILE 16 2HD1 ILE 16 -14.313 -15.344 -11.497 149 HD13 ILE 16 3HD1 ILE 16 -15.278 -15.391 -12.972 150 H SER 17 H SER 17 -15.884 -13.647 -7.448 151 HA SER 17 HA SER 17 -17.322 -16.105 -7.707 152 HB2 SER 17 2HB SER 17 -15.289 -14.992 -5.939 153 HB3 SER 17 3HB SER 17 -16.484 -15.948 -5.062 154 HG SER 17 HG SER 17 -14.733 -16.738 -7.119 155 H GLY 18 H GLY 18 -17.861 -13.063 -6.088 156 HA2 GLY 18 2HA GLY 18 -20.026 -14.084 -4.459 157 HA3 GLY 18 3HA GLY 18 -19.505 -12.410 -4.576 158 H LEU 19 H LEU 19 -19.681 -12.818 -7.627 159 HA LEU 19 HA LEU 19 -22.535 -12.163 -7.783 160 HB2 LEU 19 2HB LEU 19 -22.068 -10.756 -9.498 161 HB3 LEU 19 3HB LEU 19 -20.509 -10.718 -8.675 162 HG LEU 19 HG LEU 19 -19.980 -12.687 -10.368 163 HD11 LEU 19 1HD1 LEU 19 -22.515 -11.774 -11.256 164 HD12 LEU 19 2HD1 LEU 19 -21.474 -13.004 -11.971 165 HD13 LEU 19 3HD1 LEU 19 -21.312 -11.319 -12.463 166 HD21 LEU 19 1HD2 LEU 19 -19.090 -10.215 -10.075 167 HD22 LEU 19 2HD2 LEU 19 -19.958 -9.979 -11.592 168 HD23 LEU 19 3HD2 LEU 19 -18.676 -11.186 -11.488 169 H LYS 20 H LYS 20 -20.262 -14.569 -8.629 170 HA LYS 20 HA LYS 20 -22.044 -15.727 -10.648 171 HB2 LYS 20 2HB LYS 20 -20.235 -16.958 -11.441 172 HB3 LYS 20 3HB LYS 20 -19.486 -15.445 -10.949 173 HG2 LYS 20 2HG LYS 20 -19.062 -16.662 -8.706 174 HG3 LYS 20 3HG LYS 20 -19.354 -18.129 -9.644 175 HD2 LYS 20 2HD LYS 20 -17.632 -16.788 -11.267 176 HD3 LYS 20 3HD LYS 20 -17.065 -16.288 -9.672 177 HE2 LYS 20 2HE LYS 20 -15.860 -18.252 -10.282 178 HE3 LYS 20 3HE LYS 20 -17.013 -18.704 -9.028 179 HZ1 LYS 20 1HZ LYS 20 -18.429 -19.689 -10.631 180 HZ2 LYS 20 2HZ LYS 20 -16.871 -20.269 -10.944 181 HZ3 LYS 20 3HZ LYS 20 -17.536 -19.062 -11.924 182 H GLY 21 H GLY 21 -20.715 -16.289 -7.457 183 HA2 GLY 21 2HA GLY 21 -22.226 -18.820 -7.307 184 HA3 GLY 21 3HA GLY 21 -20.833 -18.428 -6.310 Start of MODEL 11 1 H1 GLY 1 H GLY 1 4.073 0.627 -1.911 2 HA2 GLY 1 2HA GLY 1 1.829 -0.349 -0.322 3 HA3 GLY 1 3HA GLY 1 1.731 0.703 -1.725 4 H ILE 2 H ILE 2 3.574 -2.269 -1.719 5 HA ILE 2 HA ILE 2 2.551 -3.262 -4.077 6 HB ILE 2 HB ILE 2 3.276 -5.545 -3.187 7 HG12 ILE 2 2HG1 ILE 2 4.926 -4.547 -1.096 8 HG13 ILE 2 3HG1 ILE 2 3.274 -4.047 -0.752 9 HG21 ILE 2 1HG2 ILE 2 5.601 -3.796 -2.825 10 HG22 ILE 2 2HG2 ILE 2 5.325 -5.094 -3.984 11 HG23 ILE 2 3HG2 ILE 2 4.667 -3.487 -4.288 12 HD11 ILE 2 1HD1 ILE 2 4.501 -6.634 -0.498 13 HD12 ILE 2 2HD1 ILE 2 2.950 -6.057 0.110 14 HD13 ILE 2 3HD1 ILE 2 3.069 -6.709 -1.524 15 H PHE 3 H PHE 3 1.410 -3.820 -0.778 16 HA PHE 3 HA PHE 3 -0.621 -5.679 -1.563 17 HB2 PHE 3 2HB PHE 3 0.317 -4.448 0.939 18 HB3 PHE 3 3HB PHE 3 -1.410 -4.787 0.898 19 HD1 PHE 3 HD1 PHE 3 1.091 -6.799 -0.889 20 HD2 PHE 3 HD2 PHE 3 -1.381 -6.492 2.562 21 HE1 PHE 3 HE1 PHE 3 1.546 -9.158 -0.358 22 HE2 PHE 3 HE2 PHE 3 -0.930 -8.850 3.099 23 HZ PHE 3 HZ PHE 3 0.536 -10.186 1.639 24 H SER 4 H SER 4 -0.389 -2.235 -1.271 25 HA SER 4 HA SER 4 -3.194 -1.715 -1.127 26 HB2 SER 4 2HB SER 4 -1.000 0.152 -2.053 27 HB3 SER 4 3HB SER 4 -2.601 0.606 -1.472 28 HG SER 4 HG SER 4 -0.906 0.785 0.119 29 H LYS 5 H LYS 5 -0.807 -1.798 -3.735 30 HA LYS 5 HA LYS 5 -2.696 -1.028 -5.755 31 HB2 LYS 5 2HB LYS 5 -0.879 -1.566 -7.333 32 HB3 LYS 5 3HB LYS 5 -0.339 -0.504 -6.039 33 HG2 LYS 5 2HG LYS 5 1.396 -1.982 -6.121 34 HG3 LYS 5 3HG LYS 5 0.375 -2.759 -4.909 35 HD2 LYS 5 2HD LYS 5 0.110 -4.562 -6.190 36 HD3 LYS 5 3HD LYS 5 -0.375 -3.578 -7.573 37 HE2 LYS 5 2HE LYS 5 1.793 -3.404 -8.371 38 HE3 LYS 5 3HE LYS 5 2.508 -3.755 -6.798 39 HZ1 LYS 5 1HZ LYS 5 1.283 -6.037 -7.215 40 HZ2 LYS 5 2HZ LYS 5 2.837 -5.740 -7.811 41 HZ3 LYS 5 3HZ LYS 5 1.498 -5.591 -8.833 42 H LEU 6 H LEU 6 -1.429 -4.040 -4.484 43 HA LEU 6 HA LEU 6 -2.490 -5.697 -6.551 44 HB2 LEU 6 2HB LEU 6 -0.726 -6.670 -5.415 45 HB3 LEU 6 3HB LEU 6 -1.328 -6.160 -3.839 46 HG LEU 6 HG LEU 6 -3.119 -7.865 -4.023 47 HD11 LEU 6 1HD1 LEU 6 -3.002 -7.917 -6.557 48 HD12 LEU 6 2HD1 LEU 6 -3.159 -9.471 -5.739 49 HD13 LEU 6 3HD1 LEU 6 -1.592 -8.960 -6.366 50 HD21 LEU 6 1HD2 LEU 6 -0.711 -8.188 -3.054 51 HD22 LEU 6 2HD2 LEU 6 -0.527 -9.287 -4.422 52 HD23 LEU 6 3HD2 LEU 6 -1.796 -9.568 -3.229 53 H ALA 7 H ALA 7 -3.834 -4.146 -3.825 54 HA ALA 7 HA ALA 7 -5.858 -5.855 -3.017 55 HB1 ALA 7 1HB ALA 7 -5.124 -3.373 -2.311 56 HB2 ALA 7 2HB ALA 7 -6.584 -3.001 -3.229 57 HB3 ALA 7 3HB ALA 7 -6.664 -4.097 -1.849 58 H GLY 8 H GLY 8 -5.639 -3.849 -5.883 59 HA2 GLY 8 2HA GLY 8 -8.348 -3.913 -6.650 60 HA3 GLY 8 3HA GLY 8 -6.986 -3.662 -7.731 61 H LYS 9 H LYS 9 -5.922 -6.351 -6.729 62 HA LYS 9 HA LYS 9 -7.196 -7.914 -8.798 63 HB2 LYS 9 2HB LYS 9 -4.819 -8.101 -8.648 64 HB3 LYS 9 3HB LYS 9 -4.892 -8.455 -6.927 65 HG2 LYS 9 2HG LYS 9 -4.417 -10.407 -8.441 66 HG3 LYS 9 3HG LYS 9 -5.751 -10.617 -7.304 67 HD2 LYS 9 2HD LYS 9 -7.361 -10.158 -9.049 68 HD3 LYS 9 3HD LYS 9 -6.065 -9.800 -10.193 69 HE2 LYS 9 2HE LYS 9 -7.051 -12.070 -10.456 70 HE3 LYS 9 3HE LYS 9 -5.314 -12.073 -10.151 71 HZ1 LYS 9 1HZ LYS 9 -6.995 -13.622 -8.838 72 HZ2 LYS 9 2HZ LYS 9 -7.056 -12.270 -7.824 73 HZ3 LYS 9 3HZ LYS 9 -5.576 -13.027 -8.135 74 H LYS 10 H LYS 10 -6.498 -8.525 -5.350 75 HA LYS 10 HA LYS 10 -8.010 -10.783 -4.987 76 HB2 LYS 10 2HB LYS 10 -6.526 -9.768 -3.279 77 HB3 LYS 10 3HB LYS 10 -7.730 -8.515 -3.008 78 HG2 LYS 10 2HG LYS 10 -8.341 -11.432 -2.654 79 HG3 LYS 10 3HG LYS 10 -7.680 -10.433 -1.358 80 HD2 LYS 10 2HD LYS 10 -9.683 -8.849 -2.036 81 HD3 LYS 10 3HD LYS 10 -10.367 -10.361 -2.639 82 HE2 LYS 10 2HE LYS 10 -11.091 -10.677 -0.549 83 HE3 LYS 10 3HE LYS 10 -9.416 -11.069 -0.163 84 HZ1 LYS 10 1HZ LYS 10 -10.980 -8.785 0.595 85 HZ2 LYS 10 2HZ LYS 10 -9.468 -8.363 -0.035 86 HZ3 LYS 10 3HZ LYS 10 -9.570 -9.407 1.293 87 H ILE 11 H ILE 11 -9.112 -7.418 -4.658 88 HA ILE 11 HA ILE 11 -11.742 -7.916 -3.918 89 HB ILE 11 HB ILE 11 -12.290 -5.704 -4.779 90 HG12 ILE 11 2HG1 ILE 11 -10.056 -4.545 -5.769 91 HG13 ILE 11 3HG1 ILE 11 -9.848 -6.181 -6.385 92 HG21 ILE 11 1HG2 ILE 11 -10.335 -4.442 -3.664 93 HG22 ILE 11 2HG2 ILE 11 -11.285 -5.564 -2.691 94 HG23 ILE 11 3HG2 ILE 11 -9.707 -6.051 -3.307 95 HD11 ILE 11 1HD1 ILE 11 -12.507 -5.520 -6.911 96 HD12 ILE 11 2HD1 ILE 11 -11.565 -4.085 -7.317 97 HD13 ILE 11 3HD1 ILE 11 -11.176 -5.635 -8.063 98 H LYS 12 H LYS 12 -10.248 -7.932 -7.099 99 HA LYS 12 HA LYS 12 -12.707 -8.151 -8.543 100 HB2 LYS 12 2HB LYS 12 -10.222 -7.453 -9.277 101 HB3 LYS 12 3HB LYS 12 -10.182 -9.147 -9.749 102 HG2 LYS 12 2HG LYS 12 -12.262 -7.165 -10.648 103 HG3 LYS 12 3HG LYS 12 -10.841 -7.637 -11.582 104 HD2 LYS 12 2HD LYS 12 -11.877 -10.064 -10.995 105 HD3 LYS 12 3HD LYS 12 -13.351 -9.096 -11.074 106 HE2 LYS 12 2HE LYS 12 -11.241 -9.104 -13.223 107 HE3 LYS 12 3HE LYS 12 -12.647 -10.166 -13.236 108 HZ1 LYS 12 1HZ LYS 12 -13.690 -7.685 -12.809 109 HZ2 LYS 12 2HZ LYS 12 -13.678 -8.516 -14.282 110 HZ3 LYS 12 3HZ LYS 12 -12.457 -7.400 -13.931 111 H ASN 13 H ASN 13 -10.512 -10.382 -7.033 112 HA ASN 13 HA ASN 13 -11.426 -12.715 -8.406 113 HB2 ASN 13 2HB ASN 13 -9.204 -12.360 -7.126 114 HB3 ASN 13 3HB ASN 13 -10.142 -12.744 -5.686 115 HD21 ASN 13 1HD2 ASN 13 -10.319 -14.799 -5.146 116 HD22 ASN 13 2HD2 ASN 13 -9.984 -16.147 -6.173 117 H LEU 14 H LEU 14 -12.348 -11.023 -5.480 118 HA LEU 14 HA LEU 14 -14.113 -13.117 -4.579 119 HB2 LEU 14 2HB LEU 14 -13.006 -11.680 -2.967 120 HB3 LEU 14 3HB LEU 14 -13.776 -10.261 -3.674 121 HG LEU 14 HG LEU 14 -15.897 -10.870 -2.819 122 HD11 LEU 14 1HD1 LEU 14 -15.829 -13.248 -3.319 123 HD12 LEU 14 2HD1 LEU 14 -16.307 -12.978 -1.643 124 HD13 LEU 14 3HD1 LEU 14 -14.666 -13.504 -2.018 125 HD21 LEU 14 1HD2 LEU 14 -15.389 -11.212 -0.361 126 HD22 LEU 14 2HD2 LEU 14 -14.618 -9.827 -1.135 127 HD23 LEU 14 3HD2 LEU 14 -13.688 -11.294 -0.823 128 H LEU 15 H LEU 15 -14.371 -10.119 -6.377 129 HA LEU 15 HA LEU 15 -17.173 -9.836 -6.278 130 HB2 LEU 15 2HB LEU 15 -15.490 -8.113 -7.008 131 HB3 LEU 15 3HB LEU 15 -15.374 -8.984 -8.536 132 HG LEU 15 HG LEU 15 -17.696 -8.494 -9.028 133 HD11 LEU 15 1HD1 LEU 15 -18.976 -6.974 -7.552 134 HD12 LEU 15 2HD1 LEU 15 -17.704 -7.130 -6.341 135 HD13 LEU 15 3HD1 LEU 15 -18.644 -8.544 -6.820 136 HD21 LEU 15 1HD2 LEU 15 -17.493 -6.166 -9.451 137 HD22 LEU 15 2HD2 LEU 15 -15.871 -6.849 -9.560 138 HD23 LEU 15 3HD2 LEU 15 -16.357 -5.955 -8.119 139 H ILE 16 H ILE 16 -15.039 -11.463 -8.593 140 HA ILE 16 HA ILE 16 -17.103 -12.252 -10.371 141 HB ILE 16 HB ILE 16 -14.783 -12.173 -11.104 142 HG12 ILE 16 2HG1 ILE 16 -16.153 -14.855 -11.186 143 HG13 ILE 16 3HG1 ILE 16 -16.119 -13.607 -12.427 144 HG21 ILE 16 1HG2 ILE 16 -13.826 -12.918 -8.919 145 HG22 ILE 16 2HG2 ILE 16 -14.279 -14.566 -9.348 146 HG23 ILE 16 3HG2 ILE 16 -13.108 -13.690 -10.332 147 HD11 ILE 16 1HD1 ILE 16 -13.863 -15.406 -11.589 148 HD12 ILE 16 2HD1 ILE 16 -14.724 -15.401 -13.129 149 HD13 ILE 16 3HD1 ILE 16 -13.684 -14.044 -12.694 150 H SER 17 H SER 17 -15.588 -13.772 -7.577 151 HA SER 17 HA SER 17 -16.893 -16.292 -7.923 152 HB2 SER 17 2HB SER 17 -14.949 -15.144 -6.124 153 HB3 SER 17 3HB SER 17 -16.179 -16.020 -5.214 154 HG SER 17 HG SER 17 -14.965 -17.157 -7.491 155 H GLY 18 H GLY 18 -17.614 -13.320 -6.214 156 HA2 GLY 18 2HA GLY 18 -19.826 -14.464 -4.748 157 HA3 GLY 18 3HA GLY 18 -19.368 -12.768 -4.795 158 H LEU 19 H LEU 19 -19.376 -13.089 -7.858 159 HA LEU 19 HA LEU 19 -22.249 -12.564 -8.142 160 HB2 LEU 19 2HB LEU 19 -21.769 -11.073 -9.785 161 HB3 LEU 19 3HB LEU 19 -20.270 -10.974 -8.863 162 HG LEU 19 HG LEU 19 -19.513 -12.841 -10.581 163 HD11 LEU 19 1HD1 LEU 19 -22.043 -12.101 -11.590 164 HD12 LEU 19 2HD1 LEU 19 -20.850 -13.178 -12.314 165 HD13 LEU 19 3HD1 LEU 19 -20.829 -11.456 -12.695 166 HD21 LEU 19 1HD2 LEU 19 -18.275 -11.213 -11.629 167 HD22 LEU 19 2HD2 LEU 19 -18.750 -10.377 -10.150 168 HD23 LEU 19 3HD2 LEU 19 -19.610 -10.061 -11.657 169 H LYS 20 H LYS 20 -19.817 -14.821 -8.942 170 HA LYS 20 HA LYS 20 -20.996 -15.873 -11.319 171 HB2 LYS 20 2HB LYS 20 -18.658 -16.249 -10.952 172 HB3 LYS 20 3HB LYS 20 -18.962 -16.984 -9.384 173 HG2 LYS 20 2HG LYS 20 -20.376 -18.375 -11.481 174 HG3 LYS 20 3HG LYS 20 -18.644 -18.288 -11.813 175 HD2 LYS 20 2HD LYS 20 -19.378 -18.977 -9.043 176 HD3 LYS 20 3HD LYS 20 -19.797 -20.181 -10.265 177 HE2 LYS 20 2HE LYS 20 -17.107 -19.060 -10.552 178 HE3 LYS 20 3HE LYS 20 -17.361 -19.944 -9.048 179 HZ1 LYS 20 1HZ LYS 20 -17.239 -21.848 -10.143 180 HZ2 LYS 20 2HZ LYS 20 -16.852 -21.001 -11.555 181 HZ3 LYS 20 3HZ LYS 20 -18.464 -21.383 -11.214 182 H GLY 21 H GLY 21 -21.357 -16.485 -7.892 183 HA2 GLY 21 2HA GLY 21 -22.961 -18.870 -8.353 184 HA3 GLY 21 3HA GLY 21 -22.532 -18.187 -6.792 Start of MODEL 12 1 H1 GLY 1 H GLY 1 2.571 2.028 -1.766 2 HA2 GLY 1 2HA GLY 1 3.078 -0.225 -0.754 3 HA3 GLY 1 3HA GLY 1 1.374 0.201 -0.709 4 H ILE 2 H ILE 2 3.593 -2.118 -1.636 5 HA ILE 2 HA ILE 2 2.617 -3.219 -3.970 6 HB ILE 2 HB ILE 2 3.352 -5.452 -2.983 7 HG12 ILE 2 2HG1 ILE 2 4.935 -4.351 -0.884 8 HG13 ILE 2 3HG1 ILE 2 3.262 -3.885 -0.599 9 HG21 ILE 2 1HG2 ILE 2 5.493 -3.371 -2.750 10 HG22 ILE 2 2HG2 ILE 2 5.586 -4.995 -3.430 11 HG23 ILE 2 3HG2 ILE 2 4.734 -3.721 -4.303 12 HD11 ILE 2 1HD1 ILE 2 4.193 -6.108 0.369 13 HD12 ILE 2 2HD1 ILE 2 2.568 -6.053 -0.317 14 HD13 ILE 2 3HD1 ILE 2 3.903 -6.717 -1.260 15 H PHE 3 H PHE 3 1.408 -3.600 -0.674 16 HA PHE 3 HA PHE 3 -0.585 -5.528 -1.397 17 HB2 PHE 3 2HB PHE 3 0.117 -4.003 1.073 18 HB3 PHE 3 3HB PHE 3 -1.481 -4.732 0.964 19 HD1 PHE 3 HD1 PHE 3 1.545 -5.241 2.356 20 HD2 PHE 3 HD2 PHE 3 -1.195 -7.259 -0.200 21 HE1 PHE 3 HE1 PHE 3 2.490 -7.403 3.055 22 HE2 PHE 3 HE2 PHE 3 -0.255 -9.424 0.495 23 HZ PHE 3 HZ PHE 3 1.590 -9.498 2.125 24 H SER 4 H SER 4 -0.387 -2.074 -1.303 25 HA SER 4 HA SER 4 -3.201 -1.575 -1.243 26 HB2 SER 4 2HB SER 4 -1.020 0.271 -2.234 27 HB3 SER 4 3HB SER 4 -2.629 0.728 -1.675 28 HG SER 4 HG SER 4 -2.060 0.240 0.385 29 H LYS 5 H LYS 5 -0.755 -1.779 -3.787 30 HA LYS 5 HA LYS 5 -2.588 -1.122 -5.892 31 HB2 LYS 5 2HB LYS 5 -0.737 -1.775 -7.391 32 HB3 LYS 5 3HB LYS 5 -0.225 -0.634 -6.155 33 HG2 LYS 5 2HG LYS 5 1.504 -2.121 -6.094 34 HG3 LYS 5 3HG LYS 5 0.446 -2.816 -4.863 35 HD2 LYS 5 2HD LYS 5 0.212 -4.697 -6.033 36 HD3 LYS 5 3HD LYS 5 -0.242 -3.802 -7.485 37 HE2 LYS 5 2HE LYS 5 2.608 -3.661 -6.817 38 HE3 LYS 5 3HE LYS 5 2.032 -5.284 -7.194 39 HZ1 LYS 5 1HZ LYS 5 2.767 -3.419 -9.011 40 HZ2 LYS 5 2HZ LYS 5 1.081 -3.280 -9.021 41 HZ3 LYS 5 3HZ LYS 5 1.808 -4.774 -9.339 42 H LEU 6 H LEU 6 -1.372 -4.071 -4.431 43 HA LEU 6 HA LEU 6 -2.415 -5.828 -6.423 44 HB2 LEU 6 2HB LEU 6 -0.668 -6.741 -5.207 45 HB3 LEU 6 3HB LEU 6 -1.304 -6.160 -3.669 46 HG LEU 6 HG LEU 6 -3.083 -7.872 -3.799 47 HD11 LEU 6 1HD1 LEU 6 -3.131 -9.533 -5.456 48 HD12 LEU 6 2HD1 LEU 6 -1.551 -9.071 -6.086 49 HD13 LEU 6 3HD1 LEU 6 -2.941 -8.015 -6.334 50 HD21 LEU 6 1HD2 LEU 6 -1.665 -9.768 -3.266 51 HD22 LEU 6 2HD2 LEU 6 -0.997 -8.290 -2.572 52 HD23 LEU 6 3HD2 LEU 6 -0.286 -8.978 -4.033 53 H ALA 7 H ALA 7 -3.777 -4.136 -3.786 54 HA ALA 7 HA ALA 7 -5.828 -5.789 -2.931 55 HB1 ALA 7 1HB ALA 7 -6.948 -3.822 -2.166 56 HB2 ALA 7 2HB ALA 7 -5.213 -3.569 -1.966 57 HB3 ALA 7 3HB ALA 7 -6.067 -2.810 -3.310 58 H GLY 8 H GLY 8 -5.549 -3.916 -5.879 59 HA2 GLY 8 2HA GLY 8 -8.253 -3.986 -6.673 60 HA3 GLY 8 3HA GLY 8 -6.876 -3.787 -7.747 61 H LYS 9 H LYS 9 -5.843 -6.441 -6.627 62 HA LYS 9 HA LYS 9 -7.102 -8.077 -8.648 63 HB2 LYS 9 2HB LYS 9 -4.729 -8.274 -8.461 64 HB3 LYS 9 3HB LYS 9 -4.825 -8.557 -6.728 65 HG2 LYS 9 2HG LYS 9 -4.347 -10.572 -8.158 66 HG3 LYS 9 3HG LYS 9 -5.693 -10.728 -7.028 67 HD2 LYS 9 2HD LYS 9 -7.282 -10.330 -8.806 68 HD3 LYS 9 3HD LYS 9 -5.973 -10.025 -9.950 69 HE2 LYS 9 2HE LYS 9 -5.733 -12.588 -8.581 70 HE3 LYS 9 3HE LYS 9 -7.217 -12.441 -9.522 71 HZ1 LYS 9 1HZ LYS 9 -4.586 -12.886 -10.433 72 HZ2 LYS 9 2HZ LYS 9 -5.161 -11.439 -11.093 73 HZ3 LYS 9 3HZ LYS 9 -6.026 -12.875 -11.321 74 H LYS 10 H LYS 10 -6.447 -8.564 -5.172 75 HA LYS 10 HA LYS 10 -7.984 -10.793 -4.742 76 HB2 LYS 10 2HB LYS 10 -6.508 -9.726 -3.057 77 HB3 LYS 10 3HB LYS 10 -7.704 -8.456 -2.844 78 HG2 LYS 10 2HG LYS 10 -8.340 -11.354 -2.391 79 HG3 LYS 10 3HG LYS 10 -7.686 -10.312 -1.125 80 HD2 LYS 10 2HD LYS 10 -9.672 -8.742 -1.884 81 HD3 LYS 10 3HD LYS 10 -10.358 -10.272 -2.438 82 HE2 LYS 10 2HE LYS 10 -11.169 -10.058 -0.264 83 HE3 LYS 10 3HE LYS 10 -9.790 -11.141 -0.088 84 HZ1 LYS 10 1HZ LYS 10 -9.305 -9.693 1.558 85 HZ2 LYS 10 2HZ LYS 10 -10.130 -8.401 0.843 86 HZ3 LYS 10 3HZ LYS 10 -8.587 -8.827 0.295 87 H ILE 11 H ILE 11 -9.057 -7.407 -4.549 88 HA ILE 11 HA ILE 11 -11.698 -7.849 -3.816 89 HB ILE 11 HB ILE 11 -12.217 -5.669 -4.770 90 HG12 ILE 11 2HG1 ILE 11 -9.962 -4.572 -5.787 91 HG13 ILE 11 3HG1 ILE 11 -9.765 -6.234 -6.334 92 HG21 ILE 11 1HG2 ILE 11 -9.663 -5.996 -3.249 93 HG22 ILE 11 2HG2 ILE 11 -10.236 -4.391 -3.698 94 HG23 ILE 11 3HG2 ILE 11 -11.236 -5.432 -2.686 95 HD11 ILE 11 1HD1 ILE 11 -10.939 -5.482 -8.094 96 HD12 ILE 11 2HD1 ILE 11 -12.318 -5.813 -7.045 97 HD13 ILE 11 3HD1 ILE 11 -11.684 -4.173 -7.178 98 H LYS 12 H LYS 12 -10.176 -8.008 -6.980 99 HA LYS 12 HA LYS 12 -12.625 -8.262 -8.437 100 HB2 LYS 12 2HB LYS 12 -10.122 -7.624 -9.173 101 HB3 LYS 12 3HB LYS 12 -10.104 -9.334 -9.582 102 HG2 LYS 12 2HG LYS 12 -12.136 -7.346 -10.574 103 HG3 LYS 12 3HG LYS 12 -10.725 -7.898 -11.479 104 HD2 LYS 12 2HD LYS 12 -11.821 -10.268 -10.802 105 HD3 LYS 12 3HD LYS 12 -13.273 -9.270 -10.908 106 HE2 LYS 12 2HE LYS 12 -12.571 -8.554 -13.165 107 HE3 LYS 12 3HE LYS 12 -11.182 -9.633 -13.052 108 HZ1 LYS 12 1HZ LYS 12 -13.956 -10.247 -13.580 109 HZ2 LYS 12 2HZ LYS 12 -13.208 -11.289 -12.478 110 HZ3 LYS 12 3HZ LYS 12 -12.557 -11.086 -14.026 111 H ASN 13 H ASN 13 -10.455 -10.455 -6.830 112 HA ASN 13 HA ASN 13 -11.394 -12.829 -8.111 113 HB2 ASN 13 2HB ASN 13 -9.175 -12.403 -6.794 114 HB3 ASN 13 3HB ASN 13 -10.142 -12.826 -5.384 115 HD21 ASN 13 1HD2 ASN 13 -9.636 -14.013 -8.694 116 HD22 ASN 13 2HD2 ASN 13 -9.506 -15.679 -8.255 117 H LEU 14 H LEU 14 -12.305 -11.009 -5.261 118 HA LEU 14 HA LEU 14 -14.080 -13.045 -4.262 119 HB2 LEU 14 2HB LEU 14 -12.980 -11.523 -2.726 120 HB3 LEU 14 3HB LEU 14 -13.745 -10.144 -3.514 121 HG LEU 14 HG LEU 14 -15.871 -10.702 -2.636 122 HD11 LEU 14 1HD1 LEU 14 -15.807 -13.103 -3.007 123 HD12 LEU 14 2HD1 LEU 14 -16.290 -12.743 -1.349 124 HD13 LEU 14 3HD1 LEU 14 -14.649 -13.292 -1.690 125 HD21 LEU 14 1HD2 LEU 14 -15.107 -11.202 -0.106 126 HD22 LEU 14 2HD2 LEU 14 -14.970 -9.620 -0.873 127 HD23 LEU 14 3HD2 LEU 14 -13.567 -10.687 -0.795 128 H LEU 15 H LEU 15 -14.339 -10.128 -6.195 129 HA LEU 15 HA LEU 15 -17.137 -9.846 -6.131 130 HB2 LEU 15 2HB LEU 15 -15.973 -8.001 -6.931 131 HB3 LEU 15 3HB LEU 15 -14.992 -8.974 -8.025 132 HG LEU 15 HG LEU 15 -17.916 -8.793 -8.546 133 HD11 LEU 15 1HD1 LEU 15 -15.963 -6.599 -9.225 134 HD12 LEU 15 2HD1 LEU 15 -17.283 -6.481 -8.062 135 HD13 LEU 15 3HD1 LEU 15 -17.635 -6.713 -9.775 136 HD21 LEU 15 1HD2 LEU 15 -15.393 -9.181 -10.101 137 HD22 LEU 15 2HD2 LEU 15 -16.854 -8.616 -10.912 138 HD23 LEU 15 3HD2 LEU 15 -16.855 -10.167 -10.070 139 H ILE 16 H ILE 16 -15.007 -11.569 -8.386 140 HA ILE 16 HA ILE 16 -17.056 -12.458 -10.117 141 HB ILE 16 HB ILE 16 -14.738 -12.459 -10.836 142 HG12 ILE 16 2HG1 ILE 16 -16.083 -15.156 -10.721 143 HG13 ILE 16 3HG1 ILE 16 -16.102 -13.990 -12.039 144 HG21 ILE 16 1HG2 ILE 16 -13.081 -13.945 -9.945 145 HG22 ILE 16 2HG2 ILE 16 -13.782 -13.029 -8.612 146 HG23 ILE 16 3HG2 ILE 16 -14.266 -14.703 -8.882 147 HD11 ILE 16 1HD1 ILE 16 -13.777 -15.665 -11.131 148 HD12 ILE 16 2HD1 ILE 16 -14.679 -15.806 -12.640 149 HD13 ILE 16 3HD1 ILE 16 -13.673 -14.389 -12.344 150 H SER 17 H SER 17 -15.582 -13.849 -7.231 151 HA SER 17 HA SER 17 -16.927 -16.360 -7.444 152 HB2 SER 17 2HB SER 17 -15.005 -15.121 -5.664 153 HB3 SER 17 3HB SER 17 -16.244 -15.983 -4.753 154 HG SER 17 HG SER 17 -15.302 -17.759 -5.324 155 H GLY 18 H GLY 18 -17.643 -13.276 -5.961 156 HA2 GLY 18 2HA GLY 18 -19.884 -14.309 -4.446 157 HA3 GLY 18 3HA GLY 18 -19.396 -12.626 -4.575 158 H LEU 19 H LEU 19 -19.368 -13.126 -7.621 159 HA LEU 19 HA LEU 19 -22.220 -12.542 -7.974 160 HB2 LEU 19 2HB LEU 19 -20.939 -10.789 -8.838 161 HB3 LEU 19 3HB LEU 19 -19.759 -11.886 -9.553 162 HG LEU 19 HG LEU 19 -21.393 -12.528 -11.261 163 HD11 LEU 19 1HD1 LEU 19 -23.388 -12.086 -9.787 164 HD12 LEU 19 2HD1 LEU 19 -23.525 -11.521 -11.452 165 HD13 LEU 19 3HD1 LEU 19 -23.180 -10.374 -10.158 166 HD21 LEU 19 1HD2 LEU 19 -19.842 -10.598 -11.575 167 HD22 LEU 19 2HD2 LEU 19 -21.154 -9.529 -11.078 168 HD23 LEU 19 3HD2 LEU 19 -21.318 -10.508 -12.537 169 H LYS 20 H LYS 20 -19.811 -14.885 -8.662 170 HA LYS 20 HA LYS 20 -21.056 -16.070 -10.941 171 HB2 LYS 20 2HB LYS 20 -18.677 -16.380 -10.510 172 HB3 LYS 20 3HB LYS 20 -19.036 -17.186 -8.988 173 HG2 LYS 20 2HG LYS 20 -18.430 -18.736 -10.815 174 HG3 LYS 20 3HG LYS 20 -20.030 -19.041 -10.135 175 HD2 LYS 20 2HD LYS 20 -21.021 -18.684 -12.101 176 HD3 LYS 20 3HD LYS 20 -20.149 -17.168 -12.339 177 HE2 LYS 20 2HE LYS 20 -19.357 -18.396 -14.107 178 HE3 LYS 20 3HE LYS 20 -18.145 -18.770 -12.883 179 HZ1 LYS 20 1HZ LYS 20 -20.059 -20.499 -14.154 180 HZ2 LYS 20 2HZ LYS 20 -20.031 -20.664 -12.471 181 HZ3 LYS 20 3HZ LYS 20 -18.612 -20.883 -13.365 182 H GLY 21 H GLY 21 -20.500 -17.663 -7.809 183 HA2 GLY 21 2HA GLY 21 -23.047 -19.072 -8.160 184 HA3 GLY 21 3HA GLY 21 -21.753 -19.535 -7.064 Start of MODEL 13 1 H1 GLY 1 H GLY 1 4.182 0.759 -0.253 2 HA2 GLY 1 2HA GLY 1 1.668 -0.133 -0.263 3 HA3 GLY 1 3HA GLY 1 2.268 0.871 -1.575 4 H ILE 2 H ILE 2 3.038 -2.497 -0.762 5 HA ILE 2 HA ILE 2 2.581 -3.266 -3.514 6 HB ILE 2 HB ILE 2 3.248 -5.560 -2.658 7 HG12 ILE 2 2HG1 ILE 2 2.682 -4.610 -0.208 8 HG13 ILE 2 3HG1 ILE 2 3.825 -5.921 -0.483 9 HG21 ILE 2 1HG2 ILE 2 4.875 -4.303 -3.805 10 HG22 ILE 2 2HG2 ILE 2 5.070 -3.180 -2.460 11 HG23 ILE 2 3HG2 ILE 2 5.658 -4.837 -2.318 12 HD11 ILE 2 1HD1 ILE 2 5.657 -4.575 -0.099 13 HD12 ILE 2 2HD1 ILE 2 4.769 -3.091 -0.447 14 HD13 ILE 2 3HD1 ILE 2 4.479 -3.959 1.060 15 H PHE 3 H PHE 3 1.085 -3.762 -0.369 16 HA PHE 3 HA PHE 3 -0.838 -5.661 -1.346 17 HB2 PHE 3 2HB PHE 3 -0.812 -4.093 1.242 18 HB3 PHE 3 3HB PHE 3 -1.838 -5.479 0.885 19 HD1 PHE 3 HD1 PHE 3 0.010 -7.338 -0.381 20 HD2 PHE 3 HD2 PHE 3 0.593 -4.752 2.950 21 HE1 PHE 3 HE1 PHE 3 1.749 -8.849 0.483 22 HE2 PHE 3 HE2 PHE 3 2.334 -6.258 3.818 23 HZ PHE 3 HZ PHE 3 2.915 -8.309 2.585 24 H SER 4 H SER 4 -0.616 -2.225 -1.107 25 HA SER 4 HA SER 4 -3.418 -1.677 -1.204 26 HB2 SER 4 2HB SER 4 -1.136 0.143 -2.003 27 HB3 SER 4 3HB SER 4 -2.774 0.628 -1.568 28 HG SER 4 HG SER 4 -0.670 0.190 0.033 29 H LYS 5 H LYS 5 -0.831 -1.858 -3.608 30 HA LYS 5 HA LYS 5 -2.539 -1.128 -5.795 31 HB2 LYS 5 2HB LYS 5 -0.611 -1.730 -7.206 32 HB3 LYS 5 3HB LYS 5 -0.157 -0.645 -5.898 33 HG2 LYS 5 2HG LYS 5 1.553 -2.150 -5.801 34 HG3 LYS 5 3HG LYS 5 0.422 -2.887 -4.664 35 HD2 LYS 5 2HD LYS 5 0.235 -4.713 -5.928 36 HD3 LYS 5 3HD LYS 5 -0.118 -3.750 -7.365 37 HE2 LYS 5 2HE LYS 5 2.692 -3.836 -6.408 38 HE3 LYS 5 3HE LYS 5 2.044 -5.283 -7.179 39 HZ1 LYS 5 1HZ LYS 5 2.502 -4.315 -9.104 40 HZ2 LYS 5 2HZ LYS 5 2.878 -2.841 -8.365 41 HZ3 LYS 5 3HZ LYS 5 1.278 -3.191 -8.789 42 H LEU 6 H LEU 6 -1.415 -4.118 -4.346 43 HA LEU 6 HA LEU 6 -2.339 -5.821 -6.442 44 HB2 LEU 6 2HB LEU 6 -0.681 -6.783 -5.151 45 HB3 LEU 6 3HB LEU 6 -1.389 -6.218 -3.639 46 HG LEU 6 HG LEU 6 -3.182 -7.906 -3.895 47 HD11 LEU 6 1HD1 LEU 6 -3.129 -9.561 -5.568 48 HD12 LEU 6 2HD1 LEU 6 -1.526 -9.071 -6.115 49 HD13 LEU 6 3HD1 LEU 6 -2.916 -8.027 -6.411 50 HD21 LEU 6 1HD2 LEU 6 -0.906 -8.253 -2.719 51 HD22 LEU 6 2HD2 LEU 6 -0.545 -9.313 -4.081 52 HD23 LEU 6 3HD2 LEU 6 -1.925 -9.657 -3.037 53 H ALA 7 H ALA 7 -3.868 -4.171 -3.878 54 HA ALA 7 HA ALA 7 -5.959 -5.814 -3.144 55 HB1 ALA 7 1HB ALA 7 -6.823 -3.993 -2.138 56 HB2 ALA 7 2HB ALA 7 -5.275 -3.269 -2.574 57 HB3 ALA 7 3HB ALA 7 -6.692 -2.997 -3.588 58 H GLY 8 H GLY 8 -5.592 -3.868 -6.060 59 HA2 GLY 8 2HA GLY 8 -8.200 -4.020 -7.045 60 HA3 GLY 8 3HA GLY 8 -6.757 -3.860 -8.036 61 H LYS 9 H LYS 9 -5.801 -6.480 -6.795 62 HA LYS 9 HA LYS 9 -6.974 -8.171 -8.825 63 HB2 LYS 9 2HB LYS 9 -4.476 -8.030 -7.929 64 HB3 LYS 9 3HB LYS 9 -5.069 -9.236 -6.793 65 HG2 LYS 9 2HG LYS 9 -4.991 -9.423 -9.793 66 HG3 LYS 9 3HG LYS 9 -4.085 -10.385 -8.623 67 HD2 LYS 9 2HD LYS 9 -6.192 -11.344 -7.801 68 HD3 LYS 9 3HD LYS 9 -7.081 -10.397 -8.996 69 HE2 LYS 9 2HE LYS 9 -5.058 -11.761 -10.397 70 HE3 LYS 9 3HE LYS 9 -5.775 -12.933 -9.293 71 HZ1 LYS 9 1HZ LYS 9 -6.918 -11.648 -11.620 72 HZ2 LYS 9 2HZ LYS 9 -7.950 -11.734 -10.283 73 HZ3 LYS 9 3HZ LYS 9 -7.278 -13.148 -10.924 74 H LYS 10 H LYS 10 -6.403 -8.636 -5.332 75 HA LYS 10 HA LYS 10 -7.995 -10.828 -4.922 76 HB2 LYS 10 2HB LYS 10 -6.729 -10.182 -3.079 77 HB3 LYS 10 3HB LYS 10 -7.260 -8.508 -3.174 78 HG2 LYS 10 2HG LYS 10 -8.170 -9.733 -1.230 79 HG3 LYS 10 3HG LYS 10 -9.415 -9.075 -2.295 80 HD2 LYS 10 2HD LYS 10 -10.227 -11.106 -2.755 81 HD3 LYS 10 3HD LYS 10 -8.617 -11.770 -3.043 82 HE2 LYS 10 2HE LYS 10 -8.328 -12.368 -0.824 83 HE3 LYS 10 3HE LYS 10 -9.531 -11.214 -0.251 84 HZ1 LYS 10 1HZ LYS 10 -11.270 -12.587 -0.908 85 HZ2 LYS 10 2HZ LYS 10 -10.147 -13.670 -0.254 86 HZ3 LYS 10 3HZ LYS 10 -10.297 -13.518 -1.932 87 H ILE 11 H ILE 11 -8.993 -7.422 -4.857 88 HA ILE 11 HA ILE 11 -11.661 -7.804 -4.134 89 HB ILE 11 HB ILE 11 -12.115 -5.620 -5.105 90 HG12 ILE 11 2HG1 ILE 11 -9.834 -4.571 -6.103 91 HG13 ILE 11 3HG1 ILE 11 -9.649 -6.241 -6.628 92 HG21 ILE 11 1HG2 ILE 11 -11.164 -5.364 -3.017 93 HG22 ILE 11 2HG2 ILE 11 -9.605 -6.007 -3.533 94 HG23 ILE 11 3HG2 ILE 11 -10.096 -4.385 -4.023 95 HD11 ILE 11 1HD1 ILE 11 -12.285 -5.522 -7.242 96 HD12 ILE 11 2HD1 ILE 11 -11.271 -4.164 -7.729 97 HD13 ILE 11 3HD1 ILE 11 -10.943 -5.779 -8.355 98 H LYS 12 H LYS 12 -10.076 -8.024 -7.263 99 HA LYS 12 HA LYS 12 -12.507 -8.244 -8.762 100 HB2 LYS 12 2HB LYS 12 -9.990 -7.627 -9.462 101 HB3 LYS 12 3HB LYS 12 -9.975 -9.339 -9.862 102 HG2 LYS 12 2HG LYS 12 -11.990 -7.353 -10.893 103 HG3 LYS 12 3HG LYS 12 -10.557 -7.893 -11.772 104 HD2 LYS 12 2HD LYS 12 -11.666 -10.271 -11.102 105 HD3 LYS 12 3HD LYS 12 -13.111 -9.273 -11.276 106 HE2 LYS 12 2HE LYS 12 -11.095 -8.965 -13.399 107 HE3 LYS 12 3HE LYS 12 -11.876 -10.544 -13.323 108 HZ1 LYS 12 1HZ LYS 12 -13.168 -7.902 -13.679 109 HZ2 LYS 12 2HZ LYS 12 -14.037 -9.303 -13.302 110 HZ3 LYS 12 3HZ LYS 12 -13.170 -9.210 -14.751 111 H ASN 13 H ASN 13 -10.378 -10.454 -7.122 112 HA ASN 13 HA ASN 13 -11.335 -12.820 -8.411 113 HB2 ASN 13 2HB ASN 13 -9.121 -12.372 -7.040 114 HB3 ASN 13 3HB ASN 13 -10.115 -12.895 -5.683 115 HD21 ASN 13 1HD2 ASN 13 -9.731 -14.926 -5.218 116 HD22 ASN 13 2HD2 ASN 13 -9.485 -16.206 -6.353 117 H LEU 14 H LEU 14 -12.277 -10.948 -5.622 118 HA LEU 14 HA LEU 14 -14.070 -12.981 -4.617 119 HB2 LEU 14 2HB LEU 14 -12.950 -11.519 -3.049 120 HB3 LEU 14 3HB LEU 14 -13.649 -10.102 -3.830 121 HG LEU 14 HG LEU 14 -15.815 -10.604 -2.995 122 HD11 LEU 14 1HD1 LEU 14 -15.794 -13.012 -3.350 123 HD12 LEU 14 2HD1 LEU 14 -16.309 -12.623 -1.710 124 HD13 LEU 14 3HD1 LEU 14 -14.673 -13.213 -2.003 125 HD21 LEU 14 1HD2 LEU 14 -14.519 -11.348 -0.509 126 HD22 LEU 14 2HD2 LEU 14 -15.364 -9.862 -0.943 127 HD23 LEU 14 3HD2 LEU 14 -13.658 -10.059 -1.351 128 H LEU 15 H LEU 15 -14.246 -10.075 -6.560 129 HA LEU 15 HA LEU 15 -17.044 -9.716 -6.480 130 HB2 LEU 15 2HB LEU 15 -15.312 -8.070 -7.279 131 HB3 LEU 15 3HB LEU 15 -15.221 -9.007 -8.769 132 HG LEU 15 HG LEU 15 -17.532 -8.477 -9.277 133 HD11 LEU 15 1HD1 LEU 15 -18.782 -6.884 -7.875 134 HD12 LEU 15 2HD1 LEU 15 -17.498 -6.967 -6.669 135 HD13 LEU 15 3HD1 LEU 15 -18.449 -8.404 -7.043 136 HD21 LEU 15 1HD2 LEU 15 -15.453 -6.805 -9.532 137 HD22 LEU 15 2HD2 LEU 15 -16.516 -5.801 -8.545 138 HD23 LEU 15 3HD2 LEU 15 -17.079 -6.420 -10.099 139 H ILE 16 H ILE 16 -14.938 -11.484 -8.719 140 HA ILE 16 HA ILE 16 -17.045 -12.319 -10.440 141 HB ILE 16 HB ILE 16 -14.813 -12.279 -11.315 142 HG12 ILE 16 2HG1 ILE 16 -14.691 -14.449 -12.338 143 HG13 ILE 16 3HG1 ILE 16 -15.564 -15.189 -11.001 144 HG21 ILE 16 1HG2 ILE 16 -14.101 -13.304 -8.805 145 HG22 ILE 16 2HG2 ILE 16 -13.631 -14.528 -9.983 146 HG23 ILE 16 3HG2 ILE 16 -13.028 -12.878 -10.138 147 HD11 ILE 16 1HD1 ILE 16 -17.544 -14.684 -11.879 148 HD12 ILE 16 2HD1 ILE 16 -17.045 -13.044 -12.296 149 HD13 ILE 16 3HD1 ILE 16 -16.653 -14.386 -13.371 150 H SER 17 H SER 17 -15.531 -13.668 -7.578 151 HA SER 17 HA SER 17 -16.767 -16.241 -7.821 152 HB2 SER 17 2HB SER 17 -15.057 -14.857 -5.828 153 HB3 SER 17 3HB SER 17 -16.081 -16.157 -5.219 154 HG SER 17 HG SER 17 -14.473 -16.506 -7.511 155 H GLY 18 H GLY 18 -17.526 -13.222 -6.193 156 HA2 GLY 18 2HA GLY 18 -19.743 -14.352 -4.725 157 HA3 GLY 18 3HA GLY 18 -19.295 -12.654 -4.801 158 H LEU 19 H LEU 19 -19.278 -13.039 -7.859 159 HA LEU 19 HA LEU 19 -22.139 -12.493 -8.175 160 HB2 LEU 19 2HB LEU 19 -20.892 -10.716 -9.027 161 HB3 LEU 19 3HB LEU 19 -19.697 -11.786 -9.759 162 HG LEU 19 HG LEU 19 -21.331 -12.431 -11.469 163 HD11 LEU 19 1HD1 LEU 19 -23.132 -10.296 -10.360 164 HD12 LEU 19 2HD1 LEU 19 -23.322 -12.006 -9.974 165 HD13 LEU 19 3HD1 LEU 19 -23.473 -11.458 -11.643 166 HD21 LEU 19 1HD2 LEU 19 -21.267 -10.403 -12.728 167 HD22 LEU 19 2HD2 LEU 19 -19.793 -10.484 -11.762 168 HD23 LEU 19 3HD2 LEU 19 -21.120 -9.433 -11.263 169 H LYS 20 H LYS 20 -19.742 -14.826 -8.899 170 HA LYS 20 HA LYS 20 -20.981 -15.972 -11.201 171 HB2 LYS 20 2HB LYS 20 -18.638 -16.351 -10.865 172 HB3 LYS 20 3HB LYS 20 -18.918 -17.020 -9.263 173 HG2 LYS 20 2HG LYS 20 -20.390 -18.485 -11.259 174 HG3 LYS 20 3HG LYS 20 -18.672 -18.416 -11.656 175 HD2 LYS 20 2HD LYS 20 -18.065 -19.384 -9.572 176 HD3 LYS 20 3HD LYS 20 -19.700 -19.192 -8.933 177 HE2 LYS 20 2HE LYS 20 -20.530 -20.808 -10.565 178 HE3 LYS 20 3HE LYS 20 -18.906 -20.985 -11.227 179 HZ1 LYS 20 1HZ LYS 20 -19.035 -22.759 -9.801 180 HZ2 LYS 20 2HZ LYS 20 -19.977 -21.937 -8.661 181 HZ3 LYS 20 3HZ LYS 20 -18.324 -21.602 -8.792 182 H GLY 21 H GLY 21 -21.271 -16.425 -7.743 183 HA2 GLY 21 2HA GLY 21 -22.586 -18.912 -7.737 184 HA3 GLY 21 3HA GLY 21 -22.707 -17.691 -6.478 Start of MODEL 14 1 H1 GLY 1 H GLY 1 3.914 0.405 0.305 2 HA2 GLY 1 2HA GLY 1 1.528 0.140 -0.589 3 HA3 GLY 1 3HA GLY 1 2.685 0.857 -1.700 4 H ILE 2 H ILE 2 3.097 -2.465 -0.895 5 HA ILE 2 HA ILE 2 2.572 -3.212 -3.642 6 HB ILE 2 HB ILE 2 3.277 -5.510 -2.827 7 HG12 ILE 2 2HG1 ILE 2 2.770 -4.588 -0.353 8 HG13 ILE 2 3HG1 ILE 2 3.914 -5.887 -0.671 9 HG21 ILE 2 1HG2 ILE 2 5.694 -4.752 -2.518 10 HG22 ILE 2 2HG2 ILE 2 4.876 -4.261 -4.000 11 HG23 ILE 2 3HG2 ILE 2 5.073 -3.109 -2.680 12 HD11 ILE 2 1HD1 ILE 2 4.838 -3.050 -0.632 13 HD12 ILE 2 2HD1 ILE 2 4.597 -3.938 0.873 14 HD13 ILE 2 3HD1 ILE 2 5.746 -4.530 -0.326 15 H PHE 3 H PHE 3 1.163 -3.748 -0.463 16 HA PHE 3 HA PHE 3 -0.772 -5.652 -1.406 17 HB2 PHE 3 2HB PHE 3 -0.688 -4.108 1.195 18 HB3 PHE 3 3HB PHE 3 -1.713 -5.497 0.852 19 HD1 PHE 3 HD1 PHE 3 0.768 -4.771 2.856 20 HD2 PHE 3 HD2 PHE 3 0.112 -7.333 -0.479 21 HE1 PHE 3 HE1 PHE 3 2.542 -6.272 3.665 22 HE2 PHE 3 HE2 PHE 3 1.884 -8.839 0.325 23 HZ PHE 3 HZ PHE 3 3.101 -8.310 2.400 24 H SER 4 H SER 4 -0.567 -2.216 -1.142 25 HA SER 4 HA SER 4 -3.374 -1.688 -1.159 26 HB2 SER 4 2HB SER 4 -1.128 0.156 -2.003 27 HB3 SER 4 3HB SER 4 -2.757 0.625 -1.517 28 HG SER 4 HG SER 4 -2.248 -0.338 0.557 29 H LYS 5 H LYS 5 -0.851 -1.828 -3.633 30 HA LYS 5 HA LYS 5 -2.623 -1.091 -5.767 31 HB2 LYS 5 2HB LYS 5 -0.729 -1.667 -7.234 32 HB3 LYS 5 3HB LYS 5 -0.248 -0.591 -5.929 33 HG2 LYS 5 2HG LYS 5 1.474 -2.084 -5.891 34 HG3 LYS 5 3HG LYS 5 0.379 -2.839 -4.731 35 HD2 LYS 5 2HD LYS 5 0.171 -4.655 -6.005 36 HD3 LYS 5 3HD LYS 5 -0.227 -3.682 -7.424 37 HE2 LYS 5 2HE LYS 5 2.291 -3.211 -7.560 38 HE3 LYS 5 3HE LYS 5 2.470 -4.561 -6.442 39 HZ1 LYS 5 1HZ LYS 5 1.895 -6.060 -8.012 40 HZ2 LYS 5 2HZ LYS 5 2.486 -4.869 -9.059 41 HZ3 LYS 5 3HZ LYS 5 0.820 -5.017 -8.800 42 H LEU 6 H LEU 6 -1.440 -4.086 -4.376 43 HA LEU 6 HA LEU 6 -2.408 -5.776 -6.461 44 HB2 LEU 6 2HB LEU 6 -0.710 -6.739 -5.223 45 HB3 LEU 6 3HB LEU 6 -1.382 -6.192 -3.688 46 HG LEU 6 HG LEU 6 -3.170 -7.889 -3.911 47 HD11 LEU 6 1HD1 LEU 6 -3.153 -9.528 -5.600 48 HD12 LEU 6 2HD1 LEU 6 -1.567 -9.026 -6.184 49 HD13 LEU 6 3HD1 LEU 6 -2.968 -7.986 -6.435 50 HD21 LEU 6 1HD2 LEU 6 -0.535 -9.282 -4.181 51 HD22 LEU 6 2HD2 LEU 6 -1.881 -9.636 -3.098 52 HD23 LEU 6 3HD2 LEU 6 -0.857 -8.231 -2.803 53 H ALA 7 H ALA 7 -3.879 -4.162 -3.842 54 HA ALA 7 HA ALA 7 -5.944 -5.834 -3.082 55 HB1 ALA 7 1HB ALA 7 -7.104 -3.898 -2.334 56 HB2 ALA 7 2HB ALA 7 -5.381 -3.589 -2.112 57 HB3 ALA 7 3HB ALA 7 -6.240 -2.863 -3.471 58 H GLY 8 H GLY 8 -5.613 -3.889 -5.990 59 HA2 GLY 8 2HA GLY 8 -8.265 -4.004 -6.898 60 HA3 GLY 8 3HA GLY 8 -6.849 -3.808 -7.921 61 H LYS 9 H LYS 9 -5.849 -6.452 -6.758 62 HA LYS 9 HA LYS 9 -7.042 -8.100 -8.811 63 HB2 LYS 9 2HB LYS 9 -4.536 -7.974 -7.935 64 HB3 LYS 9 3HB LYS 9 -5.114 -9.207 -6.822 65 HG2 LYS 9 2HG LYS 9 -5.067 -9.325 -9.826 66 HG3 LYS 9 3HG LYS 9 -4.145 -10.310 -8.688 67 HD2 LYS 9 2HD LYS 9 -6.237 -11.298 -7.866 68 HD3 LYS 9 3HD LYS 9 -7.145 -10.325 -9.027 69 HE2 LYS 9 2HE LYS 9 -6.761 -11.793 -10.654 70 HE3 LYS 9 3HE LYS 9 -5.026 -11.767 -10.342 71 HZ1 LYS 9 1HZ LYS 9 -6.374 -13.222 -8.321 72 HZ2 LYS 9 2HZ LYS 9 -5.157 -13.741 -9.375 73 HZ3 LYS 9 3HZ LYS 9 -6.779 -13.840 -9.843 74 H LYS 10 H LYS 10 -6.437 -8.644 -5.335 75 HA LYS 10 HA LYS 10 -8.010 -10.851 -4.954 76 HB2 LYS 10 2HB LYS 10 -6.726 -10.200 -3.115 77 HB3 LYS 10 3HB LYS 10 -7.322 -8.546 -3.160 78 HG2 LYS 10 2HG LYS 10 -8.187 -9.793 -1.241 79 HG3 LYS 10 3HG LYS 10 -9.476 -9.264 -2.324 80 HD2 LYS 10 2HD LYS 10 -9.460 -11.526 -3.355 81 HD3 LYS 10 3HD LYS 10 -8.282 -12.029 -2.141 82 HE2 LYS 10 2HE LYS 10 -9.869 -11.560 -0.369 83 HE3 LYS 10 3HE LYS 10 -11.036 -10.953 -1.542 84 HZ1 LYS 10 1HZ LYS 10 -10.734 -13.312 -2.562 85 HZ2 LYS 10 2HZ LYS 10 -11.763 -13.087 -1.239 86 HZ3 LYS 10 3HZ LYS 10 -10.211 -13.719 -1.005 87 H ILE 11 H ILE 11 -9.047 -7.457 -4.777 88 HA ILE 11 HA ILE 11 -11.707 -7.886 -4.072 89 HB ILE 11 HB ILE 11 -12.187 -5.684 -4.991 90 HG12 ILE 11 2HG1 ILE 11 -9.913 -4.589 -5.958 91 HG13 ILE 11 3HG1 ILE 11 -9.718 -6.243 -6.530 92 HG21 ILE 11 1HG2 ILE 11 -11.236 -5.486 -2.892 93 HG22 ILE 11 2HG2 ILE 11 -9.665 -6.072 -3.436 94 HG23 ILE 11 3HG2 ILE 11 -10.199 -4.449 -3.871 95 HD11 ILE 11 1HD1 ILE 11 -12.344 -5.585 -7.149 96 HD12 ILE 11 2HD1 ILE 11 -11.406 -4.140 -7.528 97 HD13 ILE 11 3HD1 ILE 11 -10.978 -5.687 -8.259 98 H LYS 12 H LYS 12 -10.131 -8.004 -7.212 99 HA LYS 12 HA LYS 12 -12.550 -8.198 -8.721 100 HB2 LYS 12 2HB LYS 12 -10.002 -7.616 -9.383 101 HB3 LYS 12 3HB LYS 12 -10.045 -9.312 -9.847 102 HG2 LYS 12 2HG LYS 12 -11.902 -7.155 -10.829 103 HG3 LYS 12 3HG LYS 12 -10.575 -7.888 -11.733 104 HD2 LYS 12 2HD LYS 12 -11.892 -10.110 -11.106 105 HD3 LYS 12 3HD LYS 12 -13.250 -8.983 -11.044 106 HE2 LYS 12 2HE LYS 12 -11.688 -8.450 -13.377 107 HE3 LYS 12 3HE LYS 12 -12.061 -10.172 -13.315 108 HZ1 LYS 12 1HZ LYS 12 -14.419 -9.031 -12.668 109 HZ2 LYS 12 2HZ LYS 12 -13.994 -9.564 -14.216 110 HZ3 LYS 12 3HZ LYS 12 -13.805 -7.935 -13.802 111 H ASN 13 H ASN 13 -10.398 -10.469 -7.170 112 HA ASN 13 HA ASN 13 -11.394 -12.797 -8.482 113 HB2 ASN 13 2HB ASN 13 -9.188 -12.820 -7.463 114 HB3 ASN 13 3HB ASN 13 -9.882 -12.477 -5.881 115 HD21 ASN 13 1HD2 ASN 13 -10.295 -14.807 -8.528 116 HD22 ASN 13 2HD2 ASN 13 -10.415 -16.198 -7.510 117 H LEU 14 H LEU 14 -12.273 -11.016 -5.598 118 HA LEU 14 HA LEU 14 -14.082 -13.037 -4.633 119 HB2 LEU 14 2HB LEU 14 -12.987 -11.576 -3.057 120 HB3 LEU 14 3HB LEU 14 -13.668 -10.157 -3.848 121 HG LEU 14 HG LEU 14 -15.850 -10.653 -3.040 122 HD11 LEU 14 1HD1 LEU 14 -15.816 -13.067 -3.367 123 HD12 LEU 14 2HD1 LEU 14 -16.360 -12.656 -1.741 124 HD13 LEU 14 3HD1 LEU 14 -14.718 -13.246 -1.998 125 HD21 LEU 14 1HD2 LEU 14 -13.817 -11.121 -0.861 126 HD22 LEU 14 2HD2 LEU 14 -15.500 -10.656 -0.606 127 HD23 LEU 14 3HD2 LEU 14 -14.396 -9.558 -1.436 128 H LEU 15 H LEU 15 -14.293 -10.104 -6.544 129 HA LEU 15 HA LEU 15 -17.093 -9.790 -6.477 130 HB2 LEU 15 2HB LEU 15 -15.383 -8.113 -7.256 131 HB3 LEU 15 3HB LEU 15 -15.273 -9.036 -8.753 132 HG LEU 15 HG LEU 15 -17.589 -8.536 -9.268 133 HD11 LEU 15 1HD1 LEU 15 -18.849 -6.945 -7.848 134 HD12 LEU 15 2HD1 LEU 15 -17.582 -7.080 -6.629 135 HD13 LEU 15 3HD1 LEU 15 -18.543 -8.494 -7.063 136 HD21 LEU 15 1HD2 LEU 15 -17.102 -6.517 -10.118 137 HD22 LEU 15 2HD2 LEU 15 -15.509 -6.796 -9.415 138 HD23 LEU 15 3HD2 LEU 15 -16.702 -5.835 -8.541 139 H ILE 16 H ILE 16 -14.959 -11.513 -8.723 140 HA ILE 16 HA ILE 16 -17.040 -12.356 -10.466 141 HB ILE 16 HB ILE 16 -15.377 -13.947 -11.365 142 HG12 ILE 16 2HG1 ILE 16 -13.629 -12.871 -9.142 143 HG13 ILE 16 3HG1 ILE 16 -14.235 -14.517 -9.280 144 HG21 ILE 16 1HG2 ILE 16 -14.296 -12.331 -12.524 145 HG22 ILE 16 2HG2 ILE 16 -15.453 -11.294 -11.691 146 HG23 ILE 16 3HG2 ILE 16 -13.810 -11.459 -11.071 147 HD11 ILE 16 1HD1 ILE 16 -12.063 -13.160 -10.781 148 HD12 ILE 16 2HD1 ILE 16 -12.119 -14.778 -10.081 149 HD13 ILE 16 3HD1 ILE 16 -12.978 -14.437 -11.582 150 H SER 17 H SER 17 -15.560 -13.709 -7.589 151 HA SER 17 HA SER 17 -16.779 -16.287 -7.861 152 HB2 SER 17 2HB SER 17 -14.962 -14.965 -5.998 153 HB3 SER 17 3HB SER 17 -16.131 -16.001 -5.179 154 HG SER 17 HG SER 17 -14.655 -16.882 -7.423 155 H GLY 18 H GLY 18 -17.573 -13.280 -6.228 156 HA2 GLY 18 2HA GLY 18 -19.805 -14.426 -4.795 157 HA3 GLY 18 3HA GLY 18 -19.365 -12.725 -4.859 158 H LEU 19 H LEU 19 -19.305 -13.099 -7.918 159 HA LEU 19 HA LEU 19 -22.164 -12.566 -8.270 160 HB2 LEU 19 2HB LEU 19 -20.914 -10.780 -9.099 161 HB3 LEU 19 3HB LEU 19 -19.705 -11.841 -9.819 162 HG LEU 19 HG LEU 19 -21.313 -12.487 -11.553 163 HD11 LEU 19 1HD1 LEU 19 -23.326 -12.078 -10.082 164 HD12 LEU 19 2HD1 LEU 19 -23.457 -11.522 -11.750 165 HD13 LEU 19 3HD1 LEU 19 -23.139 -10.365 -10.458 166 HD21 LEU 19 1HD2 LEU 19 -21.116 -9.489 -11.328 167 HD22 LEU 19 2HD2 LEU 19 -21.249 -10.450 -12.802 168 HD23 LEU 19 3HD2 LEU 19 -19.783 -10.533 -11.823 169 H LYS 20 H LYS 20 -19.745 -14.883 -8.973 170 HA LYS 20 HA LYS 20 -20.950 -16.027 -11.294 171 HB2 LYS 20 2HB LYS 20 -18.610 -16.397 -10.937 172 HB3 LYS 20 3HB LYS 20 -18.901 -17.065 -9.336 173 HG2 LYS 20 2HG LYS 20 -20.347 -18.543 -11.341 174 HG3 LYS 20 3HG LYS 20 -18.625 -18.465 -11.724 175 HD2 LYS 20 2HD LYS 20 -18.024 -19.453 -9.664 176 HD3 LYS 20 3HD LYS 20 -19.639 -19.217 -8.993 177 HE2 LYS 20 2HE LYS 20 -20.058 -20.723 -11.286 178 HE3 LYS 20 3HE LYS 20 -18.588 -21.400 -10.586 179 HZ1 LYS 20 1HZ LYS 20 -19.778 -22.391 -9.022 180 HZ2 LYS 20 2HZ LYS 20 -21.192 -21.882 -9.798 181 HZ3 LYS 20 3HZ LYS 20 -20.516 -20.939 -8.567 182 H GLY 21 H GLY 21 -21.286 -16.488 -7.843 183 HA2 GLY 21 2HA GLY 21 -23.151 -18.718 -8.337 184 HA3 GLY 21 3HA GLY 21 -22.329 -18.412 -6.814 Start of MODEL 15 1 H1 GLY 1 H GLY 1 3.490 -0.564 0.366 2 HA2 GLY 1 2HA GLY 1 1.885 0.704 -1.666 3 HA3 GLY 1 3HA GLY 1 3.607 0.360 -1.756 4 H ILE 2 H ILE 2 3.262 -2.477 -1.143 5 HA ILE 2 HA ILE 2 2.653 -3.356 -3.832 6 HB ILE 2 HB ILE 2 3.338 -5.621 -2.916 7 HG12 ILE 2 2HG1 ILE 2 2.910 -4.562 -0.482 8 HG13 ILE 2 3HG1 ILE 2 4.022 -5.899 -0.759 9 HG21 ILE 2 1HG2 ILE 2 5.189 -3.256 -2.921 10 HG22 ILE 2 2HG2 ILE 2 5.772 -4.907 -2.719 11 HG23 ILE 2 3HG2 ILE 2 4.923 -4.447 -4.194 12 HD11 ILE 2 1HD1 ILE 2 4.998 -3.082 -0.891 13 HD12 ILE 2 2HD1 ILE 2 4.780 -3.886 0.664 14 HD13 ILE 2 3HD1 ILE 2 5.887 -4.562 -0.531 15 H PHE 3 H PHE 3 1.317 -3.697 -0.596 16 HA PHE 3 HA PHE 3 -0.676 -5.609 -1.389 17 HB2 PHE 3 2HB PHE 3 -0.495 -3.934 1.124 18 HB3 PHE 3 3HB PHE 3 -1.556 -5.318 0.881 19 HD1 PHE 3 HD1 PHE 3 0.196 -7.258 -0.395 20 HD2 PHE 3 HD2 PHE 3 0.993 -4.538 2.780 21 HE1 PHE 3 HE1 PHE 3 1.959 -8.757 0.442 22 HE2 PHE 3 HE2 PHE 3 2.758 -6.032 3.621 23 HZ PHE 3 HZ PHE 3 3.244 -8.144 2.451 24 H SER 4 H SER 4 -0.401 -2.169 -1.311 25 HA SER 4 HA SER 4 -3.198 -1.588 -1.286 26 HB2 SER 4 2HB SER 4 -0.944 0.167 -2.283 27 HB3 SER 4 3HB SER 4 -2.550 0.691 -1.777 28 HG SER 4 HG SER 4 -1.905 -0.364 0.315 29 H LYS 5 H LYS 5 -0.743 -1.906 -3.811 30 HA LYS 5 HA LYS 5 -2.554 -1.245 -5.936 31 HB2 LYS 5 2HB LYS 5 -0.710 -1.936 -7.417 32 HB3 LYS 5 3HB LYS 5 -0.175 -0.803 -6.183 33 HG2 LYS 5 2HG LYS 5 1.518 -2.329 -6.109 34 HG3 LYS 5 3HG LYS 5 0.439 -2.999 -4.883 35 HD2 LYS 5 2HD LYS 5 0.163 -4.874 -6.055 36 HD3 LYS 5 3HD LYS 5 -0.252 -3.969 -7.512 37 HE2 LYS 5 2HE LYS 5 2.553 -4.501 -6.539 38 HE3 LYS 5 3HE LYS 5 1.731 -5.415 -7.803 39 HZ1 LYS 5 1HZ LYS 5 1.790 -3.629 -9.249 40 HZ2 LYS 5 2HZ LYS 5 3.290 -3.513 -8.476 41 HZ3 LYS 5 3HZ LYS 5 2.023 -2.489 -8.020 42 H LEU 6 H LEU 6 -1.395 -4.187 -4.419 43 HA LEU 6 HA LEU 6 -2.448 -5.964 -6.388 44 HB2 LEU 6 2HB LEU 6 -0.739 -6.896 -5.142 45 HB3 LEU 6 3HB LEU 6 -1.361 -6.255 -3.622 46 HG LEU 6 HG LEU 6 -3.190 -7.923 -3.716 47 HD11 LEU 6 1HD1 LEU 6 -2.998 -8.151 -6.252 48 HD12 LEU 6 2HD1 LEU 6 -3.279 -9.622 -5.320 49 HD13 LEU 6 3HD1 LEU 6 -1.663 -9.258 -5.927 50 HD21 LEU 6 1HD2 LEU 6 -0.592 -9.387 -3.962 51 HD22 LEU 6 2HD2 LEU 6 -1.919 -9.645 -2.829 52 HD23 LEU 6 3HD2 LEU 6 -0.857 -8.250 -2.640 53 H ALA 7 H ALA 7 -3.818 -4.188 -3.817 54 HA ALA 7 HA ALA 7 -5.907 -5.793 -2.952 55 HB1 ALA 7 1HB ALA 7 -5.274 -3.580 -2.005 56 HB2 ALA 7 2HB ALA 7 -6.067 -2.815 -3.383 57 HB3 ALA 7 3HB ALA 7 -7.009 -3.785 -2.251 58 H GLY 8 H GLY 8 -5.549 -3.994 -5.933 59 HA2 GLY 8 2HA GLY 8 -8.248 -4.030 -6.760 60 HA3 GLY 8 3HA GLY 8 -6.854 -3.866 -7.818 61 H LYS 9 H LYS 9 -5.870 -6.515 -6.648 62 HA LYS 9 HA LYS 9 -7.135 -8.165 -8.655 63 HB2 LYS 9 2HB LYS 9 -4.761 -8.376 -8.446 64 HB3 LYS 9 3HB LYS 9 -4.878 -8.654 -6.713 65 HG2 LYS 9 2HG LYS 9 -4.405 -10.680 -8.116 66 HG3 LYS 9 3HG LYS 9 -5.783 -10.814 -7.021 67 HD2 LYS 9 2HD LYS 9 -7.317 -10.392 -8.845 68 HD3 LYS 9 3HD LYS 9 -5.970 -10.124 -9.954 69 HE2 LYS 9 2HE LYS 9 -5.446 -12.354 -10.072 70 HE3 LYS 9 3HE LYS 9 -6.105 -12.704 -8.474 71 HZ1 LYS 9 1HZ LYS 9 -7.436 -13.620 -10.322 72 HZ2 LYS 9 2HZ LYS 9 -7.758 -12.046 -10.850 73 HZ3 LYS 9 3HZ LYS 9 -8.314 -12.561 -9.337 74 H LYS 10 H LYS 10 -6.528 -8.564 -5.160 75 HA LYS 10 HA LYS 10 -8.063 -10.786 -4.689 76 HB2 LYS 10 2HB LYS 10 -6.794 -10.027 -2.878 77 HB3 LYS 10 3HB LYS 10 -7.427 -8.391 -2.997 78 HG2 LYS 10 2HG LYS 10 -8.269 -9.580 -1.028 79 HG3 LYS 10 3HG LYS 10 -9.565 -9.115 -2.134 80 HD2 LYS 10 2HD LYS 10 -9.516 -11.412 -3.074 81 HD3 LYS 10 3HD LYS 10 -8.320 -11.850 -1.852 82 HE2 LYS 10 2HE LYS 10 -9.961 -11.184 -0.103 83 HE3 LYS 10 3HE LYS 10 -11.152 -10.927 -1.377 84 HZ1 LYS 10 1HZ LYS 10 -11.561 -13.071 -0.604 85 HZ2 LYS 10 2HZ LYS 10 -9.920 -13.466 -0.502 86 HZ3 LYS 10 3HZ LYS 10 -10.663 -13.325 -2.015 87 H ILE 11 H ILE 11 -9.152 -7.403 -4.655 88 HA ILE 11 HA ILE 11 -11.817 -7.866 -3.964 89 HB ILE 11 HB ILE 11 -12.321 -5.688 -4.927 90 HG12 ILE 11 2HG1 ILE 11 -10.050 -4.571 -5.878 91 HG13 ILE 11 3HG1 ILE 11 -9.820 -6.230 -6.419 92 HG21 ILE 11 1HG2 ILE 11 -10.438 -4.378 -3.777 93 HG22 ILE 11 2HG2 ILE 11 -11.381 -5.503 -2.801 94 HG23 ILE 11 3HG2 ILE 11 -9.775 -5.960 -3.368 95 HD11 ILE 11 1HD1 ILE 11 -11.544 -4.169 -7.463 96 HD12 ILE 11 2HD1 ILE 11 -11.054 -5.705 -8.180 97 HD13 ILE 11 3HD1 ILE 11 -12.442 -5.641 -7.094 98 H LYS 12 H LYS 12 -10.189 -8.016 -7.075 99 HA LYS 12 HA LYS 12 -12.581 -8.273 -8.619 100 HB2 LYS 12 2HB LYS 12 -10.055 -7.642 -9.266 101 HB3 LYS 12 3HB LYS 12 -10.019 -9.356 -9.661 102 HG2 LYS 12 2HG LYS 12 -12.031 -7.394 -10.740 103 HG3 LYS 12 3HG LYS 12 -10.570 -7.911 -11.584 104 HD2 LYS 12 2HD LYS 12 -11.670 -10.305 -10.931 105 HD3 LYS 12 3HD LYS 12 -13.117 -9.321 -11.165 106 HE2 LYS 12 2HE LYS 12 -11.083 -8.935 -13.227 107 HE3 LYS 12 3HE LYS 12 -11.704 -10.583 -13.147 108 HZ1 LYS 12 1HZ LYS 12 -13.180 -9.580 -14.567 109 HZ2 LYS 12 2HZ LYS 12 -13.134 -8.090 -13.767 110 HZ3 LYS 12 3HZ LYS 12 -13.985 -9.387 -13.092 111 H ASN 13 H ASN 13 -10.475 -10.469 -6.931 112 HA ASN 13 HA ASN 13 -11.378 -12.844 -8.236 113 HB2 ASN 13 2HB ASN 13 -9.213 -12.829 -7.149 114 HB3 ASN 13 3HB ASN 13 -9.952 -12.428 -5.601 115 HD21 ASN 13 1HD2 ASN 13 -9.073 -14.903 -7.763 116 HD22 ASN 13 2HD2 ASN 13 -9.682 -16.238 -6.850 117 H LEU 14 H LEU 14 -12.416 -10.984 -5.468 118 HA LEU 14 HA LEU 14 -14.241 -13.024 -4.538 119 HB2 LEU 14 2HB LEU 14 -13.175 -11.573 -2.924 120 HB3 LEU 14 3HB LEU 14 -13.849 -10.151 -3.717 121 HG LEU 14 HG LEU 14 -16.041 -10.660 -2.958 122 HD11 LEU 14 1HD1 LEU 14 -14.931 -13.275 -1.948 123 HD12 LEU 14 2HD1 LEU 14 -16.005 -13.066 -3.331 124 HD13 LEU 14 3HD1 LEU 14 -16.577 -12.688 -1.706 125 HD21 LEU 14 1HD2 LEU 14 -13.933 -10.139 -1.236 126 HD22 LEU 14 2HD2 LEU 14 -14.841 -11.419 -0.433 127 HD23 LEU 14 3HD2 LEU 14 -15.650 -9.921 -0.895 128 H LEU 15 H LEU 15 -14.354 -10.106 -6.468 129 HA LEU 15 HA LEU 15 -17.153 -9.747 -6.478 130 HB2 LEU 15 2HB LEU 15 -15.395 -8.097 -7.210 131 HB3 LEU 15 3HB LEU 15 -15.257 -9.026 -8.702 132 HG LEU 15 HG LEU 15 -17.550 -8.492 -9.281 133 HD11 LEU 15 1HD1 LEU 15 -18.561 -8.426 -7.101 134 HD12 LEU 15 2HD1 LEU 15 -18.825 -6.878 -7.903 135 HD13 LEU 15 3HD1 LEU 15 -17.592 -7.023 -6.650 136 HD21 LEU 15 1HD2 LEU 15 -16.892 -6.570 -10.190 137 HD22 LEU 15 2HD2 LEU 15 -15.417 -6.719 -9.234 138 HD23 LEU 15 3HD2 LEU 15 -16.779 -5.782 -8.617 139 H ILE 16 H ILE 16 -14.976 -11.502 -8.658 140 HA ILE 16 HA ILE 16 -17.026 -12.328 -10.450 141 HB ILE 16 HB ILE 16 -14.756 -12.274 -11.238 142 HG12 ILE 16 2HG1 ILE 16 -14.598 -14.456 -12.272 143 HG13 ILE 16 3HG1 ILE 16 -15.595 -15.171 -11.010 144 HG21 ILE 16 1HG2 ILE 16 -13.007 -12.954 -10.046 145 HG22 ILE 16 2HG2 ILE 16 -14.127 -13.310 -8.732 146 HG23 ILE 16 3HG2 ILE 16 -13.679 -14.576 -9.874 147 HD11 ILE 16 1HD1 ILE 16 -17.499 -13.854 -11.767 148 HD12 ILE 16 2HD1 ILE 16 -16.500 -13.132 -13.028 149 HD13 ILE 16 3HD1 ILE 16 -16.851 -14.859 -13.062 150 H SER 17 H SER 17 -15.598 -13.696 -7.552 151 HA SER 17 HA SER 17 -16.825 -16.267 -7.849 152 HB2 SER 17 2HB SER 17 -15.179 -14.894 -5.794 153 HB3 SER 17 3HB SER 17 -16.221 -16.199 -5.226 154 HG SER 17 HG SER 17 -14.004 -16.286 -6.907 155 H GLY 18 H GLY 18 -17.637 -13.259 -6.226 156 HA2 GLY 18 2HA GLY 18 -19.898 -14.400 -4.836 157 HA3 GLY 18 3HA GLY 18 -19.450 -12.702 -4.887 158 H LEU 19 H LEU 19 -19.336 -13.067 -7.945 159 HA LEU 19 HA LEU 19 -22.187 -12.521 -8.347 160 HB2 LEU 19 2HB LEU 19 -20.915 -10.737 -9.148 161 HB3 LEU 19 3HB LEU 19 -19.697 -11.801 -9.849 162 HG LEU 19 HG LEU 19 -21.276 -12.437 -11.614 163 HD11 LEU 19 1HD1 LEU 19 -23.113 -10.310 -10.547 164 HD12 LEU 19 2HD1 LEU 19 -23.314 -12.023 -10.178 165 HD13 LEU 19 3HD1 LEU 19 -23.412 -11.464 -11.848 166 HD21 LEU 19 1HD2 LEU 19 -19.733 -10.489 -11.850 167 HD22 LEU 19 2HD2 LEU 19 -21.069 -9.439 -11.377 168 HD23 LEU 19 3HD2 LEU 19 -21.179 -10.396 -12.855 169 H LYS 20 H LYS 20 -19.766 -14.847 -9.010 170 HA LYS 20 HA LYS 20 -20.931 -15.979 -11.358 171 HB2 LYS 20 2HB LYS 20 -18.601 -16.362 -10.957 172 HB3 LYS 20 3HB LYS 20 -18.924 -17.031 -9.363 173 HG2 LYS 20 2HG LYS 20 -20.334 -18.493 -11.413 174 HG3 LYS 20 3HG LYS 20 -18.600 -18.434 -11.736 175 HD2 LYS 20 2HD LYS 20 -18.563 -18.987 -9.103 176 HD3 LYS 20 3HD LYS 20 -20.085 -19.760 -9.553 177 HE2 LYS 20 2HE LYS 20 -18.740 -21.504 -10.043 178 HE3 LYS 20 3HE LYS 20 -18.503 -20.626 -11.553 179 HZ1 LYS 20 1HZ LYS 20 -16.527 -21.426 -9.913 180 HZ2 LYS 20 2HZ LYS 20 -16.732 -19.819 -9.425 181 HZ3 LYS 20 3HZ LYS 20 -16.389 -20.174 -11.043 182 H GLY 21 H GLY 21 -21.338 -16.445 -7.916 183 HA2 GLY 21 2HA GLY 21 -22.855 -18.884 -8.209 184 HA3 GLY 21 3HA GLY 21 -22.610 -17.978 -6.724 Start of MODEL 16 1 H1 GLY 1 H GLY 1 1.495 0.129 1.693 2 HA2 GLY 1 2HA GLY 1 1.580 0.863 -0.784 3 HA3 GLY 1 3HA GLY 1 2.972 -0.013 -0.165 4 H ILE 2 H ILE 2 3.371 -2.090 -0.850 5 HA ILE 2 HA ILE 2 2.615 -2.836 -3.395 6 HB ILE 2 HB ILE 2 3.315 -5.188 -2.688 7 HG12 ILE 2 2HG1 ILE 2 4.710 -4.382 -0.336 8 HG13 ILE 2 3HG1 ILE 2 3.009 -3.987 -0.119 9 HG21 ILE 2 1HG2 ILE 2 5.494 -3.345 -1.917 10 HG22 ILE 2 2HG2 ILE 2 5.471 -4.639 -3.113 11 HG23 ILE 2 3HG2 ILE 2 4.744 -3.077 -3.491 12 HD11 ILE 2 1HD1 ILE 2 3.787 -6.685 -1.118 13 HD12 ILE 2 2HD1 ILE 2 3.902 -6.307 0.601 14 HD13 ILE 2 3HD1 ILE 2 2.350 -6.187 -0.227 15 H PHE 3 H PHE 3 1.179 -3.791 -0.305 16 HA PHE 3 HA PHE 3 -0.689 -5.614 -1.444 17 HB2 PHE 3 2HB PHE 3 -0.337 -4.335 1.241 18 HB3 PHE 3 3HB PHE 3 -1.847 -5.163 0.873 19 HD1 PHE 3 HD1 PHE 3 1.078 -5.595 2.514 20 HD2 PHE 3 HD2 PHE 3 -1.256 -7.521 -0.480 21 HE1 PHE 3 HE1 PHE 3 2.125 -7.747 3.086 22 HE2 PHE 3 HE2 PHE 3 -0.213 -9.676 0.089 23 HZ PHE 3 HZ PHE 3 1.479 -9.791 1.874 24 H SER 4 H SER 4 -0.647 -2.187 -0.900 25 HA SER 4 HA SER 4 -3.450 -1.745 -1.053 26 HB2 SER 4 2HB SER 4 -1.246 0.211 -1.738 27 HB3 SER 4 3HB SER 4 -2.900 0.596 -1.263 28 HG SER 4 HG SER 4 -0.732 -0.085 0.286 29 H LYS 5 H LYS 5 -0.836 -1.712 -3.431 30 HA LYS 5 HA LYS 5 -2.514 -0.893 -5.600 31 HB2 LYS 5 2HB LYS 5 -0.415 -0.372 -6.241 32 HB3 LYS 5 3HB LYS 5 0.306 -1.597 -5.206 33 HG2 LYS 5 2HG LYS 5 -1.120 -2.508 -7.642 34 HG3 LYS 5 3HG LYS 5 0.450 -1.726 -7.838 35 HD2 LYS 5 2HD LYS 5 0.896 -3.477 -5.769 36 HD3 LYS 5 3HD LYS 5 -0.212 -4.377 -6.807 37 HE2 LYS 5 2HE LYS 5 2.072 -2.965 -8.082 38 HE3 LYS 5 3HE LYS 5 2.412 -4.434 -7.170 39 HZ1 LYS 5 1HZ LYS 5 1.712 -5.623 -8.881 40 HZ2 LYS 5 2HZ LYS 5 1.408 -4.214 -9.764 41 HZ3 LYS 5 3HZ LYS 5 0.187 -4.894 -8.811 42 H LEU 6 H LEU 6 -1.309 -3.975 -4.383 43 HA LEU 6 HA LEU 6 -2.290 -5.540 -6.546 44 HB2 LEU 6 2HB LEU 6 -0.595 -6.562 -5.343 45 HB3 LEU 6 3HB LEU 6 -1.299 -6.122 -3.788 46 HG LEU 6 HG LEU 6 -3.068 -7.812 -4.151 47 HD11 LEU 6 1HD1 LEU 6 -2.853 -7.742 -6.666 48 HD12 LEU 6 2HD1 LEU 6 -3.000 -9.345 -5.946 49 HD13 LEU 6 3HD1 LEU 6 -1.425 -8.761 -6.484 50 HD21 LEU 6 1HD2 LEU 6 -0.969 -8.302 -2.908 51 HD22 LEU 6 2HD2 LEU 6 -0.292 -8.964 -4.396 52 HD23 LEU 6 3HD2 LEU 6 -1.704 -9.721 -3.656 53 H ALA 7 H ALA 7 -3.807 -4.012 -3.930 54 HA ALA 7 HA ALA 7 -5.859 -5.707 -3.199 55 HB1 ALA 7 1HB ALA 7 -7.026 -3.811 -2.427 56 HB2 ALA 7 2HB ALA 7 -5.315 -3.408 -2.278 57 HB3 ALA 7 3HB ALA 7 -6.262 -2.758 -3.617 58 H GLY 8 H GLY 8 -5.551 -3.721 -6.091 59 HA2 GLY 8 2HA GLY 8 -8.167 -3.878 -7.048 60 HA3 GLY 8 3HA GLY 8 -6.737 -3.706 -8.055 61 H LYS 9 H LYS 9 -5.757 -6.331 -6.845 62 HA LYS 9 HA LYS 9 -6.947 -8.011 -8.874 63 HB2 LYS 9 2HB LYS 9 -4.440 -7.868 -8.007 64 HB3 LYS 9 3HB LYS 9 -5.015 -9.083 -6.873 65 HG2 LYS 9 2HG LYS 9 -4.975 -9.250 -9.874 66 HG3 LYS 9 3HG LYS 9 -4.048 -10.215 -8.723 67 HD2 LYS 9 2HD LYS 9 -6.134 -11.195 -7.880 68 HD3 LYS 9 3HD LYS 9 -7.049 -10.241 -9.050 69 HE2 LYS 9 2HE LYS 9 -6.872 -12.207 -10.199 70 HE3 LYS 9 3HE LYS 9 -5.407 -11.400 -10.757 71 HZ1 LYS 9 1HZ LYS 9 -4.911 -12.823 -8.357 72 HZ2 LYS 9 2HZ LYS 9 -4.171 -12.991 -9.869 73 HZ3 LYS 9 3HZ LYS 9 -5.582 -13.856 -9.517 74 H LYS 10 H LYS 10 -6.333 -8.503 -5.393 75 HA LYS 10 HA LYS 10 -7.914 -10.703 -4.981 76 HB2 LYS 10 2HB LYS 10 -6.627 -10.069 -3.148 77 HB3 LYS 10 3HB LYS 10 -7.164 -8.396 -3.223 78 HG2 LYS 10 2HG LYS 10 -8.047 -9.639 -1.278 79 HG3 LYS 10 3HG LYS 10 -9.307 -8.978 -2.323 80 HD2 LYS 10 2HD LYS 10 -10.116 -11.008 -2.793 81 HD3 LYS 10 3HD LYS 10 -8.507 -11.665 -3.099 82 HE2 LYS 10 2HE LYS 10 -8.267 -12.430 -0.975 83 HE3 LYS 10 3HE LYS 10 -9.206 -11.111 -0.278 84 HZ1 LYS 10 1HZ LYS 10 -10.699 -12.761 -0.005 85 HZ2 LYS 10 2HZ LYS 10 -10.095 -13.695 -1.278 86 HZ3 LYS 10 3HZ LYS 10 -11.110 -12.381 -1.602 87 H ILE 11 H ILE 11 -8.921 -7.300 -4.872 88 HA ILE 11 HA ILE 11 -11.578 -7.694 -4.120 89 HB ILE 11 HB ILE 11 -12.050 -5.505 -5.069 90 HG12 ILE 11 2HG1 ILE 11 -9.787 -4.445 -6.094 91 HG13 ILE 11 3HG1 ILE 11 -9.605 -6.111 -6.632 92 HG21 ILE 11 1HG2 ILE 11 -11.069 -5.260 -2.994 93 HG22 ILE 11 2HG2 ILE 11 -9.517 -5.896 -3.537 94 HG23 ILE 11 3HG2 ILE 11 -10.018 -4.273 -4.010 95 HD11 ILE 11 1HD1 ILE 11 -10.760 -5.333 -8.400 96 HD12 ILE 11 2HD1 ILE 11 -12.141 -5.690 -7.362 97 HD13 ILE 11 3HD1 ILE 11 -11.525 -4.042 -7.474 98 H LYS 12 H LYS 12 -10.034 -7.890 -7.271 99 HA LYS 12 HA LYS 12 -12.481 -8.103 -8.742 100 HB2 LYS 12 2HB LYS 12 -9.965 -7.495 -9.463 101 HB3 LYS 12 3HB LYS 12 -9.971 -9.203 -9.881 102 HG2 LYS 12 2HG LYS 12 -11.962 -7.173 -10.872 103 HG3 LYS 12 3HG LYS 12 -10.562 -7.756 -11.775 104 HD2 LYS 12 2HD LYS 12 -11.715 -10.102 -11.102 105 HD3 LYS 12 3HD LYS 12 -13.143 -9.070 -11.211 106 HE2 LYS 12 2HE LYS 12 -12.458 -8.384 -13.466 107 HE3 LYS 12 3HE LYS 12 -11.050 -9.438 -13.353 108 HZ1 LYS 12 1HZ LYS 12 -13.057 -10.343 -14.563 109 HZ2 LYS 12 2HZ LYS 12 -13.808 -10.466 -13.053 110 HZ3 LYS 12 3HZ LYS 12 -12.394 -11.339 -13.367 111 H ASN 13 H ASN 13 -10.324 -10.329 -7.153 112 HA ASN 13 HA ASN 13 -11.305 -12.686 -8.435 113 HB2 ASN 13 2HB ASN 13 -9.151 -12.909 -7.527 114 HB3 ASN 13 3HB ASN 13 -9.619 -12.168 -5.999 115 HD21 ASN 13 1HD2 ASN 13 -10.814 -14.869 -7.972 116 HD22 ASN 13 2HD2 ASN 13 -10.834 -16.020 -6.684 117 H LEU 14 H LEU 14 -12.176 -10.857 -5.582 118 HA LEU 14 HA LEU 14 -13.957 -12.879 -4.563 119 HB2 LEU 14 2HB LEU 14 -12.834 -11.373 -3.033 120 HB3 LEU 14 3HB LEU 14 -13.579 -9.982 -3.818 121 HG LEU 14 HG LEU 14 -15.713 -10.512 -2.934 122 HD11 LEU 14 1HD1 LEU 14 -16.150 -12.537 -1.633 123 HD12 LEU 14 2HD1 LEU 14 -14.516 -13.105 -1.969 124 HD13 LEU 14 3HD1 LEU 14 -15.672 -12.917 -3.287 125 HD21 LEU 14 1HD2 LEU 14 -13.860 -9.587 -1.393 126 HD22 LEU 14 2HD2 LEU 14 -13.916 -11.178 -0.633 127 HD23 LEU 14 3HD2 LEU 14 -15.360 -10.165 -0.666 128 H LEU 15 H LEU 15 -14.205 -9.967 -6.503 129 HA LEU 15 HA LEU 15 -16.999 -9.653 -6.409 130 HB2 LEU 15 2HB LEU 15 -15.291 -8.004 -7.258 131 HB3 LEU 15 3HB LEU 15 -15.222 -8.960 -8.737 132 HG LEU 15 HG LEU 15 -17.549 -8.454 -9.204 133 HD11 LEU 15 1HD1 LEU 15 -18.431 -8.349 -6.965 134 HD12 LEU 15 2HD1 LEU 15 -18.768 -6.831 -7.797 135 HD13 LEU 15 3HD1 LEU 15 -17.464 -6.916 -6.613 136 HD21 LEU 15 1HD2 LEU 15 -16.872 -6.603 -10.223 137 HD22 LEU 15 2HD2 LEU 15 -15.422 -6.619 -9.218 138 HD23 LEU 15 3HD2 LEU 15 -16.849 -5.723 -8.695 139 H ILE 16 H ILE 16 -14.908 -11.422 -8.661 140 HA ILE 16 HA ILE 16 -16.999 -12.294 -10.364 141 HB ILE 16 HB ILE 16 -14.688 -12.284 -11.128 142 HG12 ILE 16 2HG1 ILE 16 -16.073 -14.959 -11.030 143 HG13 ILE 16 3HG1 ILE 16 -16.059 -13.785 -12.341 144 HG21 ILE 16 1HG2 ILE 16 -13.708 -12.901 -8.915 145 HG22 ILE 16 2HG2 ILE 16 -14.185 -14.568 -9.231 146 HG23 ILE 16 3HG2 ILE 16 -13.018 -13.771 -10.285 147 HD11 ILE 16 1HD1 ILE 16 -13.789 -15.536 -11.440 148 HD12 ILE 16 2HD1 ILE 16 -14.681 -15.623 -12.960 149 HD13 ILE 16 3HD1 ILE 16 -13.633 -14.244 -12.629 150 H SER 17 H SER 17 -15.465 -13.674 -7.506 151 HA SER 17 HA SER 17 -16.780 -16.199 -7.691 152 HB2 SER 17 2HB SER 17 -14.788 -15.007 -6.038 153 HB3 SER 17 3HB SER 17 -16.057 -15.633 -4.987 154 HG SER 17 HG SER 17 -14.158 -16.988 -6.242 155 H GLY 18 H GLY 18 -17.485 -13.141 -6.109 156 HA2 GLY 18 2HA GLY 18 -19.729 -14.200 -4.633 157 HA3 GLY 18 3HA GLY 18 -19.253 -12.512 -4.744 158 H LEU 19 H LEU 19 -19.232 -12.965 -7.793 159 HA LEU 19 HA LEU 19 -22.085 -12.387 -8.131 160 HB2 LEU 19 2HB LEU 19 -20.812 -10.637 -9.003 161 HB3 LEU 19 3HB LEU 19 -19.630 -11.732 -9.716 162 HG LEU 19 HG LEU 19 -21.266 -12.380 -11.422 163 HD11 LEU 19 1HD1 LEU 19 -23.257 -11.919 -9.941 164 HD12 LEU 19 2HD1 LEU 19 -23.396 -11.380 -11.614 165 HD13 LEU 19 3HD1 LEU 19 -23.047 -10.213 -10.339 166 HD21 LEU 19 1HD2 LEU 19 -21.020 -9.382 -11.250 167 HD22 LEU 19 2HD2 LEU 19 -21.185 -10.364 -12.705 168 HD23 LEU 19 3HD2 LEU 19 -19.709 -10.455 -11.742 169 H LYS 20 H LYS 20 -19.701 -14.749 -8.818 170 HA LYS 20 HA LYS 20 -20.951 -15.920 -11.102 171 HB2 LYS 20 2HB LYS 20 -18.610 -16.309 -10.769 172 HB3 LYS 20 3HB LYS 20 -18.886 -16.947 -9.154 173 HG2 LYS 20 2HG LYS 20 -20.376 -18.442 -11.114 174 HG3 LYS 20 3HG LYS 20 -18.659 -18.389 -11.522 175 HD2 LYS 20 2HD LYS 20 -18.040 -19.551 -9.654 176 HD3 LYS 20 3HD LYS 20 -19.399 -18.954 -8.700 177 HE2 LYS 20 2HE LYS 20 -20.562 -20.793 -9.143 178 HE3 LYS 20 3HE LYS 20 -20.389 -20.522 -10.876 179 HZ1 LYS 20 1HZ LYS 20 -18.115 -21.561 -10.619 180 HZ2 LYS 20 2HZ LYS 20 -19.438 -22.605 -10.466 181 HZ3 LYS 20 3HZ LYS 20 -18.616 -22.073 -9.086 182 H GLY 21 H GLY 21 -21.246 -16.311 -7.640 183 HA2 GLY 21 2HA GLY 21 -22.768 -18.753 -7.813 184 HA3 GLY 21 3HA GLY 21 -22.500 -17.789 -6.369 Start of MODEL 17 1 H1 GLY 1 H GLY 1 4.184 -0.115 -3.172 2 HA2 GLY 1 2HA GLY 1 2.361 -0.360 -0.866 3 HA3 GLY 1 3HA GLY 1 1.864 0.506 -2.311 4 H ILE 2 H ILE 2 3.599 -2.569 -1.866 5 HA ILE 2 HA ILE 2 2.465 -3.909 -3.994 6 HB ILE 2 HB ILE 2 2.950 -6.024 -2.655 7 HG12 ILE 2 2HG1 ILE 2 4.683 -4.792 -0.758 8 HG13 ILE 2 3HG1 ILE 2 3.080 -4.094 -0.558 9 HG21 ILE 2 1HG2 ILE 2 5.488 -5.431 -2.630 10 HG22 ILE 2 2HG2 ILE 2 4.606 -5.465 -4.155 11 HG23 ILE 2 3HG2 ILE 2 4.947 -3.924 -3.368 12 HD11 ILE 2 1HD1 ILE 2 3.381 -7.052 -0.745 13 HD12 ILE 2 2HD1 ILE 2 3.756 -6.221 0.765 14 HD13 ILE 2 3HD1 ILE 2 2.142 -6.094 0.066 15 H PHE 3 H PHE 3 1.271 -3.608 -0.685 16 HA PHE 3 HA PHE 3 -0.945 -5.380 -1.092 17 HB2 PHE 3 2HB PHE 3 -0.112 -3.505 1.098 18 HB3 PHE 3 3HB PHE 3 -1.722 -4.217 1.108 19 HD1 PHE 3 HD1 PHE 3 1.244 -4.533 2.627 20 HD2 PHE 3 HD2 PHE 3 -1.422 -6.910 0.311 21 HE1 PHE 3 HE1 PHE 3 2.157 -6.567 3.669 22 HE2 PHE 3 HE2 PHE 3 -0.514 -8.947 1.350 23 HZ PHE 3 HZ PHE 3 1.277 -8.777 3.031 24 H SER 4 H SER 4 -0.343 -2.003 -1.559 25 HA SER 4 HA SER 4 -3.078 -1.174 -1.590 26 HB2 SER 4 2HB SER 4 -0.709 0.217 -2.856 27 HB3 SER 4 3HB SER 4 -2.247 0.946 -2.393 28 HG SER 4 HG SER 4 -0.055 0.312 -0.851 29 H LYS 5 H LYS 5 -0.712 -2.071 -4.059 30 HA LYS 5 HA LYS 5 -2.488 -1.551 -6.249 31 HB2 LYS 5 2HB LYS 5 -0.750 -2.653 -7.616 32 HB3 LYS 5 3HB LYS 5 -0.088 -1.395 -6.579 33 HG2 LYS 5 2HG LYS 5 1.454 -3.047 -6.270 34 HG3 LYS 5 3HG LYS 5 0.341 -3.403 -4.948 35 HD2 LYS 5 2HD LYS 5 -0.129 -5.408 -5.797 36 HD3 LYS 5 3HD LYS 5 -0.498 -4.712 -7.377 37 HE2 LYS 5 2HE LYS 5 2.323 -5.154 -6.443 38 HE3 LYS 5 3HE LYS 5 1.399 -6.418 -7.253 39 HZ1 LYS 5 1HZ LYS 5 1.339 -3.884 -8.616 40 HZ2 LYS 5 2HZ LYS 5 1.651 -5.431 -9.224 41 HZ3 LYS 5 3HZ LYS 5 2.893 -4.543 -8.496 42 H LEU 6 H LEU 6 -1.604 -4.348 -4.325 43 HA LEU 6 HA LEU 6 -2.877 -6.269 -6.010 44 HB2 LEU 6 2HB LEU 6 -1.237 -7.181 -4.658 45 HB3 LEU 6 3HB LEU 6 -1.764 -6.278 -3.239 46 HG LEU 6 HG LEU 6 -3.738 -7.753 -3.073 47 HD11 LEU 6 1HD1 LEU 6 -2.604 -9.783 -4.857 48 HD12 LEU 6 2HD1 LEU 6 -3.262 -8.366 -5.675 49 HD13 LEU 6 3HD1 LEU 6 -4.282 -9.310 -4.590 50 HD21 LEU 6 1HD2 LEU 6 -1.129 -9.264 -3.149 51 HD22 LEU 6 2HD2 LEU 6 -2.564 -9.675 -2.209 52 HD23 LEU 6 3HD2 LEU 6 -1.650 -8.214 -1.831 53 H ALA 7 H ALA 7 -3.990 -4.025 -3.685 54 HA ALA 7 HA ALA 7 -6.248 -5.323 -2.663 55 HB1 ALA 7 1HB ALA 7 -5.128 -2.739 -2.539 56 HB2 ALA 7 2HB ALA 7 -6.812 -2.549 -3.028 57 HB3 ALA 7 3HB ALA 7 -6.418 -3.416 -1.544 58 H GLY 8 H GLY 8 -5.687 -3.741 -5.732 59 HA2 GLY 8 2HA GLY 8 -8.466 -3.647 -6.473 60 HA3 GLY 8 3HA GLY 8 -7.093 -3.323 -7.522 61 H LYS 9 H LYS 9 -5.979 -6.022 -6.612 62 HA LYS 9 HA LYS 9 -7.194 -7.534 -8.754 63 HB2 LYS 9 2HB LYS 9 -4.811 -7.657 -8.586 64 HB3 LYS 9 3HB LYS 9 -4.892 -8.095 -6.884 65 HG2 LYS 9 2HG LYS 9 -4.354 -9.954 -8.504 66 HG3 LYS 9 3HG LYS 9 -5.670 -10.260 -7.369 67 HD2 LYS 9 2HD LYS 9 -7.310 -9.776 -9.075 68 HD3 LYS 9 3HD LYS 9 -6.040 -9.309 -10.209 69 HE2 LYS 9 2HE LYS 9 -5.134 -11.670 -9.913 70 HE3 LYS 9 3HE LYS 9 -6.666 -12.043 -9.124 71 HZ1 LYS 9 1HZ LYS 9 -6.548 -12.546 -11.560 72 HZ2 LYS 9 2HZ LYS 9 -6.499 -10.880 -11.844 73 HZ3 LYS 9 3HZ LYS 9 -7.849 -11.570 -11.093 74 H LYS 10 H LYS 10 -6.481 -8.293 -5.339 75 HA LYS 10 HA LYS 10 -7.915 -10.595 -5.055 76 HB2 LYS 10 2HB LYS 10 -6.675 -9.943 -3.185 77 HB3 LYS 10 3HB LYS 10 -7.383 -8.333 -3.156 78 HG2 LYS 10 2HG LYS 10 -8.137 -9.780 -1.302 79 HG3 LYS 10 3HG LYS 10 -9.457 -9.195 -2.317 80 HD2 LYS 10 2HD LYS 10 -9.975 -11.265 -3.057 81 HD3 LYS 10 3HD LYS 10 -8.286 -11.775 -3.123 82 HE2 LYS 10 2HE LYS 10 -9.316 -11.322 -0.416 83 HE3 LYS 10 3HE LYS 10 -10.114 -12.629 -1.288 84 HZ1 LYS 10 1HZ LYS 10 -8.310 -13.915 -1.155 85 HZ2 LYS 10 2HZ LYS 10 -7.799 -12.866 0.069 86 HZ3 LYS 10 3HZ LYS 10 -7.242 -12.652 -1.514 87 H ILE 11 H ILE 11 -9.183 -7.293 -4.674 88 HA ILE 11 HA ILE 11 -11.798 -7.911 -3.996 89 HB ILE 11 HB ILE 11 -12.419 -5.724 -5.021 90 HG12 ILE 11 2HG1 ILE 11 -10.036 -4.502 -5.590 91 HG13 ILE 11 3HG1 ILE 11 -9.776 -6.110 -6.257 92 HG21 ILE 11 1HG2 ILE 11 -10.921 -4.363 -3.544 93 HG22 ILE 11 2HG2 ILE 11 -11.700 -5.731 -2.751 94 HG23 ILE 11 3HG2 ILE 11 -10.005 -5.835 -3.226 95 HD11 ILE 11 1HD1 ILE 11 -10.970 -5.585 -8.038 96 HD12 ILE 11 2HD1 ILE 11 -12.361 -5.191 -7.027 97 HD13 ILE 11 3HD1 ILE 11 -11.164 -3.952 -7.401 98 H LYS 12 H LYS 12 -10.334 -7.627 -7.208 99 HA LYS 12 HA LYS 12 -12.691 -7.969 -8.704 100 HB2 LYS 12 2HB LYS 12 -10.940 -7.174 -9.982 101 HB3 LYS 12 3HB LYS 12 -9.772 -8.272 -9.257 102 HG2 LYS 12 2HG LYS 12 -10.234 -8.803 -11.606 103 HG3 LYS 12 3HG LYS 12 -10.668 -10.124 -10.520 104 HD2 LYS 12 2HD LYS 12 -12.752 -10.099 -11.294 105 HD3 LYS 12 3HD LYS 12 -12.925 -8.407 -10.822 106 HE2 LYS 12 2HE LYS 12 -13.233 -8.114 -13.040 107 HE3 LYS 12 3HE LYS 12 -11.470 -8.114 -13.062 108 HZ1 LYS 12 1HZ LYS 12 -12.277 -9.585 -14.747 109 HZ2 LYS 12 2HZ LYS 12 -13.250 -10.418 -13.642 110 HZ3 LYS 12 3HZ LYS 12 -11.565 -10.520 -13.529 111 H ASN 13 H ASN 13 -10.454 -10.265 -7.268 112 HA ASN 13 HA ASN 13 -11.512 -12.567 -8.568 113 HB2 ASN 13 2HB ASN 13 -9.225 -12.342 -7.462 114 HB3 ASN 13 3HB ASN 13 -10.057 -12.545 -5.924 115 HD21 ASN 13 1HD2 ASN 13 -9.641 -14.064 -9.089 116 HD22 ASN 13 2HD2 ASN 13 -9.746 -15.691 -8.516 117 H LEU 14 H LEU 14 -12.523 -10.662 -5.901 118 HA LEU 14 HA LEU 14 -14.147 -12.751 -4.715 119 HB2 LEU 14 2HB LEU 14 -13.117 -11.143 -3.246 120 HB3 LEU 14 3HB LEU 14 -13.874 -9.810 -4.116 121 HG LEU 14 HG LEU 14 -16.019 -10.351 -3.248 122 HD11 LEU 14 1HD1 LEU 14 -16.426 -12.298 -1.830 123 HD12 LEU 14 2HD1 LEU 14 -14.765 -12.833 -2.083 124 HD13 LEU 14 3HD1 LEU 14 -15.888 -12.775 -3.441 125 HD21 LEU 14 1HD2 LEU 14 -13.934 -10.595 -1.083 126 HD22 LEU 14 2HD2 LEU 14 -15.637 -10.221 -0.815 127 HD23 LEU 14 3HD2 LEU 14 -14.619 -9.102 -1.723 128 H LEU 15 H LEU 15 -14.577 -9.870 -6.699 129 HA LEU 15 HA LEU 15 -17.384 -9.767 -6.637 130 HB2 LEU 15 2HB LEU 15 -15.605 -8.952 -8.926 131 HB3 LEU 15 3HB LEU 15 -17.228 -8.362 -8.578 132 HG LEU 15 HG LEU 15 -14.628 -7.631 -7.328 133 HD11 LEU 15 1HD1 LEU 15 -16.052 -5.421 -7.282 134 HD12 LEU 15 2HD1 LEU 15 -17.006 -6.276 -8.495 135 HD13 LEU 15 3HD1 LEU 15 -15.288 -5.984 -8.769 136 HD21 LEU 15 1HD2 LEU 15 -15.585 -8.193 -5.321 137 HD22 LEU 15 2HD2 LEU 15 -17.227 -7.908 -5.897 138 HD23 LEU 15 3HD2 LEU 15 -16.177 -6.543 -5.513 139 H ILE 16 H ILE 16 -15.153 -11.403 -8.854 140 HA ILE 16 HA ILE 16 -17.164 -12.433 -10.567 141 HB ILE 16 HB ILE 16 -14.898 -12.286 -11.369 142 HG12 ILE 16 2HG1 ILE 16 -14.642 -14.486 -12.338 143 HG13 ILE 16 3HG1 ILE 16 -15.588 -15.213 -11.044 144 HG21 ILE 16 1HG2 ILE 16 -14.197 -13.173 -8.839 145 HG22 ILE 16 2HG2 ILE 16 -13.732 -14.496 -9.907 146 HG23 ILE 16 3HG2 ILE 16 -13.103 -12.873 -10.189 147 HD11 ILE 16 1HD1 ILE 16 -16.623 -13.278 -13.102 148 HD12 ILE 16 2HD1 ILE 16 -16.871 -15.024 -13.100 149 HD13 ILE 16 3HD1 ILE 16 -17.568 -14.032 -11.819 150 H SER 17 H SER 17 -15.635 -13.617 -7.637 151 HA SER 17 HA SER 17 -16.713 -16.259 -7.819 152 HB2 SER 17 2HB SER 17 -15.223 -14.690 -5.765 153 HB3 SER 17 3HB SER 17 -16.117 -16.112 -5.228 154 HG SER 17 HG SER 17 -14.133 -16.852 -5.788 155 H GLY 18 H GLY 18 -17.692 -13.255 -6.263 156 HA2 GLY 18 2HA GLY 18 -19.894 -14.470 -4.857 157 HA3 GLY 18 3HA GLY 18 -19.552 -12.750 -4.978 158 H LEU 19 H LEU 19 -19.405 -13.224 -8.016 159 HA LEU 19 HA LEU 19 -22.271 -12.832 -8.447 160 HB2 LEU 19 2HB LEU 19 -21.039 -11.074 -9.371 161 HB3 LEU 19 3HB LEU 19 -19.813 -12.159 -10.023 162 HG LEU 19 HG LEU 19 -21.399 -12.932 -11.719 163 HD11 LEU 19 1HD1 LEU 19 -23.563 -12.006 -11.980 164 HD12 LEU 19 2HD1 LEU 19 -23.276 -10.803 -10.724 165 HD13 LEU 19 3HD1 LEU 19 -23.429 -12.506 -10.294 166 HD21 LEU 19 1HD2 LEU 19 -19.915 -10.959 -12.096 167 HD22 LEU 19 2HD2 LEU 19 -21.276 -9.922 -11.668 168 HD23 LEU 19 3HD2 LEU 19 -21.377 -10.971 -13.083 169 H LYS 20 H LYS 20 -19.760 -15.106 -9.004 170 HA LYS 20 HA LYS 20 -21.185 -16.486 -11.127 171 HB2 LYS 20 2HB LYS 20 -19.288 -17.921 -11.274 172 HB3 LYS 20 3HB LYS 20 -18.675 -16.286 -11.065 173 HG2 LYS 20 2HG LYS 20 -17.390 -17.160 -9.471 174 HG3 LYS 20 3HG LYS 20 -18.853 -17.176 -8.484 175 HD2 LYS 20 2HD LYS 20 -18.039 -19.355 -8.305 176 HD3 LYS 20 3HD LYS 20 -19.292 -19.479 -9.542 177 HE2 LYS 20 2HE LYS 20 -17.101 -18.889 -11.043 178 HE3 LYS 20 3HE LYS 20 -16.386 -19.845 -9.745 179 HZ1 LYS 20 1HZ LYS 20 -18.456 -20.646 -11.694 180 HZ2 LYS 20 2HZ LYS 20 -18.256 -21.485 -10.239 181 HZ3 LYS 20 3HZ LYS 20 -16.981 -21.399 -11.347 182 H GLY 21 H GLY 21 -20.772 -16.657 -7.689 183 HA2 GLY 21 2HA GLY 21 -22.154 -19.263 -7.641 184 HA3 GLY 21 3HA GLY 21 -21.159 -18.631 -6.337 Start of MODEL 18 1 H1 GLY 1 H GLY 1 2.604 0.960 -0.561 2 HA2 GLY 1 2HA GLY 1 0.823 0.624 -1.987 3 HA3 GLY 1 3HA GLY 1 1.962 1.186 -3.201 4 H ILE 2 H ILE 2 2.750 -1.726 -1.556 5 HA ILE 2 HA ILE 2 2.489 -3.213 -4.025 6 HB ILE 2 HB ILE 2 3.429 -5.106 -2.580 7 HG12 ILE 2 2HG1 ILE 2 2.748 -3.580 -0.482 8 HG13 ILE 2 3HG1 ILE 2 4.070 -4.740 -0.421 9 HG21 ILE 2 1HG2 ILE 2 4.909 -2.560 -3.168 10 HG22 ILE 2 2HG2 ILE 2 5.723 -3.997 -2.550 11 HG23 ILE 2 3HG2 ILE 2 4.881 -4.058 -4.098 12 HD11 ILE 2 1HD1 ILE 2 4.591 -1.919 -1.238 13 HD12 ILE 2 2HD1 ILE 2 4.431 -2.344 0.466 14 HD13 ILE 2 3HD1 ILE 2 5.685 -3.099 -0.517 15 H PHE 3 H PHE 3 1.003 -3.142 -0.834 16 HA PHE 3 HA PHE 3 -0.635 -5.459 -1.357 17 HB2 PHE 3 2HB PHE 3 -0.876 -3.451 0.890 18 HB3 PHE 3 3HB PHE 3 -1.579 -5.065 0.836 19 HD1 PHE 3 HD1 PHE 3 0.478 -6.829 0.063 20 HD2 PHE 3 HD2 PHE 3 0.781 -3.326 2.461 21 HE1 PHE 3 HE1 PHE 3 2.494 -7.744 1.137 22 HE2 PHE 3 HE2 PHE 3 2.798 -4.234 3.539 23 HZ PHE 3 HZ PHE 3 3.658 -6.445 2.876 24 H SER 4 H SER 4 -0.863 -2.038 -1.760 25 HA SER 4 HA SER 4 -3.729 -1.935 -1.909 26 HB2 SER 4 2HB SER 4 -1.815 0.123 -3.010 27 HB3 SER 4 3HB SER 4 -3.468 0.367 -2.445 28 HG SER 4 HG SER 4 -2.467 0.912 -0.666 29 H LYS 5 H LYS 5 -1.067 -2.173 -4.200 30 HA LYS 5 HA LYS 5 -2.715 -1.889 -6.524 31 HB2 LYS 5 2HB LYS 5 -0.696 -2.622 -7.754 32 HB3 LYS 5 3HB LYS 5 -0.369 -1.300 -6.641 33 HG2 LYS 5 2HG LYS 5 1.413 -2.637 -6.192 34 HG3 LYS 5 3HG LYS 5 0.262 -3.275 -5.016 35 HD2 LYS 5 2HD LYS 5 0.292 -5.282 -5.982 36 HD3 LYS 5 3HD LYS 5 -0.051 -4.583 -7.566 37 HE2 LYS 5 2HE LYS 5 2.299 -4.132 -7.914 38 HE3 LYS 5 3HE LYS 5 2.679 -4.695 -6.287 39 HZ1 LYS 5 1HZ LYS 5 1.808 -6.898 -6.956 40 HZ2 LYS 5 2HZ LYS 5 3.178 -6.425 -7.829 41 HZ3 LYS 5 3HZ LYS 5 1.647 -6.327 -8.541 42 H LEU 6 H LEU 6 -1.445 -4.588 -4.657 43 HA LEU 6 HA LEU 6 -2.282 -6.601 -6.503 44 HB2 LEU 6 2HB LEU 6 -1.176 -8.003 -5.164 45 HB3 LEU 6 3HB LEU 6 -0.603 -6.542 -4.363 46 HG LEU 6 HG LEU 6 -2.753 -6.879 -2.894 47 HD11 LEU 6 1HD1 LEU 6 -3.915 -8.703 -3.411 48 HD12 LEU 6 2HD1 LEU 6 -2.578 -9.635 -2.738 49 HD13 LEU 6 3HD1 LEU 6 -2.641 -9.307 -4.470 50 HD21 LEU 6 1HD2 LEU 6 -0.791 -8.896 -2.122 51 HD22 LEU 6 2HD2 LEU 6 -1.290 -7.421 -1.293 52 HD23 LEU 6 3HD2 LEU 6 -0.072 -7.348 -2.568 53 H ALA 7 H ALA 7 -3.840 -4.776 -4.048 54 HA ALA 7 HA ALA 7 -5.869 -6.524 -3.246 55 HB1 ALA 7 1HB ALA 7 -6.769 -4.745 -2.169 56 HB2 ALA 7 2HB ALA 7 -5.184 -4.051 -2.514 57 HB3 ALA 7 3HB ALA 7 -6.560 -3.663 -3.546 58 H GLY 8 H GLY 8 -5.547 -4.513 -6.108 59 HA2 GLY 8 2HA GLY 8 -8.175 -4.540 -7.032 60 HA3 GLY 8 3HA GLY 8 -6.753 -4.448 -8.059 61 H LYS 9 H LYS 9 -5.888 -7.117 -6.876 62 HA LYS 9 HA LYS 9 -7.212 -8.733 -8.874 63 HB2 LYS 9 2HB LYS 9 -4.680 -8.718 -8.069 64 HB3 LYS 9 3HB LYS 9 -5.287 -9.903 -6.919 65 HG2 LYS 9 2HG LYS 9 -5.331 -10.071 -9.921 66 HG3 LYS 9 3HG LYS 9 -4.425 -11.082 -8.793 67 HD2 LYS 9 2HD LYS 9 -6.536 -11.955 -7.896 68 HD3 LYS 9 3HD LYS 9 -7.432 -10.955 -9.042 69 HE2 LYS 9 2HE LYS 9 -5.414 -12.542 -10.371 70 HE3 LYS 9 3HE LYS 9 -6.515 -13.555 -9.438 71 HZ1 LYS 9 1HZ LYS 9 -7.046 -11.901 -11.781 72 HZ2 LYS 9 2HZ LYS 9 -8.266 -11.982 -10.613 73 HZ3 LYS 9 3HZ LYS 9 -7.699 -13.399 -11.343 74 H LYS 10 H LYS 10 -6.537 -9.258 -5.408 75 HA LYS 10 HA LYS 10 -8.218 -11.374 -4.956 76 HB2 LYS 10 2HB LYS 10 -6.855 -10.810 -3.157 77 HB3 LYS 10 3HB LYS 10 -7.304 -9.111 -3.218 78 HG2 LYS 10 2HG LYS 10 -8.202 -10.309 -1.251 79 HG3 LYS 10 3HG LYS 10 -9.451 -9.580 -2.263 80 HD2 LYS 10 2HD LYS 10 -10.381 -11.563 -2.706 81 HD3 LYS 10 3HD LYS 10 -8.818 -12.302 -3.065 82 HE2 LYS 10 2HE LYS 10 -8.409 -12.623 -0.686 83 HE3 LYS 10 3HE LYS 10 -9.938 -11.834 -0.302 84 HZ1 LYS 10 1HZ LYS 10 -10.484 -13.880 -2.110 85 HZ2 LYS 10 2HZ LYS 10 -10.923 -13.792 -0.479 86 HZ3 LYS 10 3HZ LYS 10 -9.470 -14.534 -0.924 87 H ILE 11 H ILE 11 -9.044 -7.924 -4.828 88 HA ILE 11 HA ILE 11 -11.698 -8.182 -4.006 89 HB ILE 11 HB ILE 11 -12.080 -5.969 -4.943 90 HG12 ILE 11 2HG1 ILE 11 -9.790 -5.024 -6.019 91 HG13 ILE 11 3HG1 ILE 11 -9.708 -6.696 -6.564 92 HG21 ILE 11 1HG2 ILE 11 -9.535 -6.493 -3.471 93 HG22 ILE 11 2HG2 ILE 11 -9.961 -4.846 -3.932 94 HG23 ILE 11 3HG2 ILE 11 -11.039 -5.777 -2.892 95 HD11 ILE 11 1HD1 ILE 11 -12.324 -5.860 -7.077 96 HD12 ILE 11 2HD1 ILE 11 -11.278 -4.529 -7.574 97 HD13 ILE 11 3HD1 ILE 11 -11.030 -6.141 -8.242 98 H LYS 12 H LYS 12 -10.245 -8.450 -7.195 99 HA LYS 12 HA LYS 12 -12.739 -8.537 -8.601 100 HB2 LYS 12 2HB LYS 12 -10.224 -8.035 -9.392 101 HB3 LYS 12 3HB LYS 12 -10.307 -9.742 -9.807 102 HG2 LYS 12 2HG LYS 12 -12.261 -7.653 -10.744 103 HG3 LYS 12 3HG LYS 12 -10.891 -8.252 -11.681 104 HD2 LYS 12 2HD LYS 12 -12.087 -10.580 -10.988 105 HD3 LYS 12 3HD LYS 12 -13.488 -9.512 -11.098 106 HE2 LYS 12 2HE LYS 12 -13.211 -10.449 -13.248 107 HE3 LYS 12 3HE LYS 12 -12.601 -8.798 -13.356 108 HZ1 LYS 12 1HZ LYS 12 -11.219 -11.279 -13.731 109 HZ2 LYS 12 2HZ LYS 12 -10.414 -10.253 -12.655 110 HZ3 LYS 12 3HZ LYS 12 -10.783 -9.718 -14.217 111 H ASN 13 H ASN 13 -10.659 -10.863 -7.062 112 HA ASN 13 HA ASN 13 -11.780 -13.168 -8.332 113 HB2 ASN 13 2HB ASN 13 -9.614 -13.498 -7.487 114 HB3 ASN 13 3HB ASN 13 -10.001 -12.740 -5.945 115 HD21 ASN 13 1HD2 ASN 13 -11.183 -13.905 -4.406 116 HD22 ASN 13 2HD2 ASN 13 -11.295 -15.628 -4.469 117 H LEU 14 H LEU 14 -12.524 -11.276 -5.498 118 HA LEU 14 HA LEU 14 -14.371 -13.231 -4.436 119 HB2 LEU 14 2HB LEU 14 -13.114 -11.833 -2.908 120 HB3 LEU 14 3HB LEU 14 -13.790 -10.381 -3.644 121 HG LEU 14 HG LEU 14 -15.931 -10.798 -2.713 122 HD11 LEU 14 1HD1 LEU 14 -16.457 -12.816 -1.436 123 HD12 LEU 14 2HD1 LEU 14 -14.867 -13.474 -1.820 124 HD13 LEU 14 3HD1 LEU 14 -16.041 -13.197 -3.107 125 HD21 LEU 14 1HD2 LEU 14 -15.172 -9.926 -0.820 126 HD22 LEU 14 2HD2 LEU 14 -13.585 -10.652 -1.078 127 HD23 LEU 14 3HD2 LEU 14 -14.843 -11.558 -0.236 128 H LEU 15 H LEU 15 -14.481 -10.302 -6.349 129 HA LEU 15 HA LEU 15 -17.258 -9.822 -6.157 130 HB2 LEU 15 2HB LEU 15 -15.500 -8.226 -6.981 131 HB3 LEU 15 3HB LEU 15 -15.473 -9.143 -8.485 132 HG LEU 15 HG LEU 15 -17.770 -8.525 -8.941 133 HD11 LEU 15 1HD1 LEU 15 -18.641 -8.469 -6.686 134 HD12 LEU 15 2HD1 LEU 15 -18.949 -6.928 -7.486 135 HD13 LEU 15 3HD1 LEU 15 -17.645 -7.064 -6.307 136 HD21 LEU 15 1HD2 LEU 15 -17.182 -6.544 -9.802 137 HD22 LEU 15 2HD2 LEU 15 -15.605 -6.865 -9.079 138 HD23 LEU 15 3HD2 LEU 15 -16.783 -5.868 -8.222 139 H ILE 16 H ILE 16 -15.306 -11.652 -8.479 140 HA ILE 16 HA ILE 16 -17.493 -12.355 -10.157 141 HB ILE 16 HB ILE 16 -15.966 -13.999 -11.155 142 HG12 ILE 16 2HG1 ILE 16 -13.498 -13.631 -10.121 143 HG13 ILE 16 3HG1 ILE 16 -14.462 -13.460 -8.658 144 HG21 ILE 16 1HG2 ILE 16 -15.315 -11.158 -10.799 145 HG22 ILE 16 2HG2 ILE 16 -13.995 -12.157 -11.405 146 HG23 ILE 16 3HG2 ILE 16 -15.528 -12.100 -12.275 147 HD11 ILE 16 1HD1 ILE 16 -14.657 -15.652 -8.503 148 HD12 ILE 16 2HD1 ILE 16 -15.369 -15.736 -10.114 149 HD13 ILE 16 3HD1 ILE 16 -13.618 -15.822 -9.918 150 H SER 17 H SER 17 -15.978 -13.821 -7.353 151 HA SER 17 HA SER 17 -17.378 -16.315 -7.600 152 HB2 SER 17 2HB SER 17 -15.337 -15.182 -5.869 153 HB3 SER 17 3HB SER 17 -16.542 -16.081 -4.947 154 HG SER 17 HG SER 17 -15.483 -17.772 -5.589 155 H GLY 18 H GLY 18 -17.899 -13.269 -5.957 156 HA2 GLY 18 2HA GLY 18 -20.079 -14.275 -4.349 157 HA3 GLY 18 3HA GLY 18 -19.559 -12.602 -4.475 158 H LEU 19 H LEU 19 -19.727 -13.010 -7.520 159 HA LEU 19 HA LEU 19 -22.573 -12.339 -7.689 160 HB2 LEU 19 2HB LEU 19 -22.085 -10.975 -9.429 161 HB3 LEU 19 3HB LEU 19 -20.516 -10.959 -8.626 162 HG LEU 19 HG LEU 19 -20.045 -12.968 -10.281 163 HD11 LEU 19 1HD1 LEU 19 -22.463 -11.648 -11.355 164 HD12 LEU 19 2HD1 LEU 19 -21.902 -13.311 -11.528 165 HD13 LEU 19 3HD1 LEU 19 -21.183 -12.032 -12.507 166 HD21 LEU 19 1HD2 LEU 19 -18.765 -11.509 -11.502 167 HD22 LEU 19 2HD2 LEU 19 -19.084 -10.534 -10.067 168 HD23 LEU 19 3HD2 LEU 19 -20.018 -10.268 -11.540 169 H LYS 20 H LYS 20 -20.346 -14.805 -8.481 170 HA LYS 20 HA LYS 20 -22.161 -15.983 -10.461 171 HB2 LYS 20 2HB LYS 20 -19.312 -16.624 -9.695 172 HB3 LYS 20 3HB LYS 20 -20.259 -17.614 -10.797 173 HG2 LYS 20 2HG LYS 20 -20.391 -15.870 -12.394 174 HG3 LYS 20 3HG LYS 20 -19.752 -14.687 -11.251 175 HD2 LYS 20 2HD LYS 20 -17.612 -15.891 -11.221 176 HD3 LYS 20 3HD LYS 20 -18.256 -17.051 -12.385 177 HE2 LYS 20 2HE LYS 20 -18.765 -14.721 -13.662 178 HE3 LYS 20 3HE LYS 20 -17.299 -14.294 -12.780 179 HZ1 LYS 20 1HZ LYS 20 -16.954 -15.243 -15.054 180 HZ2 LYS 20 2HZ LYS 20 -17.518 -16.724 -14.463 181 HZ3 LYS 20 3HZ LYS 20 -16.114 -16.035 -13.818 182 H GLY 21 H GLY 21 -20.041 -17.481 -8.027 183 HA2 GLY 21 2HA GLY 21 -21.699 -19.694 -7.586 184 HA3 GLY 21 3HA GLY 21 -20.437 -19.142 -6.494 Start of MODEL 19 1 H1 GLY 1 H GLY 1 1.535 1.695 -1.911 2 HA2 GLY 1 2HA GLY 1 2.986 -0.424 -0.699 3 HA3 GLY 1 3HA GLY 1 1.269 -0.103 -0.504 4 H ILE 2 H ILE 2 3.444 -2.332 -1.552 5 HA ILE 2 HA ILE 2 2.491 -3.357 -3.930 6 HB ILE 2 HB ILE 2 3.210 -5.621 -3.005 7 HG12 ILE 2 2HG1 ILE 2 4.773 -4.590 -0.856 8 HG13 ILE 2 3HG1 ILE 2 3.097 -4.129 -0.575 9 HG21 ILE 2 1HG2 ILE 2 5.665 -4.718 -2.760 10 HG22 ILE 2 2HG2 ILE 2 4.821 -4.645 -4.306 11 HG23 ILE 2 3HG2 ILE 2 4.927 -3.207 -3.291 12 HD11 ILE 2 1HD1 ILE 2 3.739 -6.941 -1.316 13 HD12 ILE 2 2HD1 ILE 2 4.012 -6.383 0.335 14 HD13 ILE 2 3HD1 ILE 2 2.396 -6.303 -0.367 15 H PHE 3 H PHE 3 1.245 -3.837 -0.661 16 HA PHE 3 HA PHE 3 -0.745 -5.736 -1.465 17 HB2 PHE 3 2HB PHE 3 0.026 -4.362 1.048 18 HB3 PHE 3 3HB PHE 3 -1.647 -4.899 0.930 19 HD1 PHE 3 HD1 PHE 3 -1.674 -7.402 -0.298 20 HD2 PHE 3 HD2 PHE 3 1.324 -5.797 2.262 21 HE1 PHE 3 HE1 PHE 3 -0.985 -9.682 0.320 22 HE2 PHE 3 HE2 PHE 3 2.018 -8.074 2.883 23 HZ PHE 3 HZ PHE 3 0.864 -10.020 1.911 24 H SER 4 H SER 4 -0.539 -2.287 -1.261 25 HA SER 4 HA SER 4 -3.353 -1.783 -1.216 26 HB2 SER 4 2HB SER 4 -1.156 0.087 -2.125 27 HB3 SER 4 3HB SER 4 -2.770 0.531 -1.571 28 HG SER 4 HG SER 4 -1.129 0.765 0.049 29 H LYS 5 H LYS 5 -0.879 -1.914 -3.739 30 HA LYS 5 HA LYS 5 -2.688 -1.187 -5.842 31 HB2 LYS 5 2HB LYS 5 -0.822 -1.799 -7.341 32 HB3 LYS 5 3HB LYS 5 -0.321 -0.698 -6.064 33 HG2 LYS 5 2HG LYS 5 1.403 -2.191 -6.030 34 HG3 LYS 5 3HG LYS 5 0.330 -2.920 -4.834 35 HD2 LYS 5 2HD LYS 5 0.105 -4.764 -6.064 36 HD3 LYS 5 3HD LYS 5 -0.331 -3.823 -7.492 37 HE2 LYS 5 2HE LYS 5 2.043 -3.437 -7.954 38 HE3 LYS 5 3HE LYS 5 2.473 -4.381 -6.528 39 HZ1 LYS 5 1HZ LYS 5 1.775 -5.275 -9.146 40 HZ2 LYS 5 2HZ LYS 5 0.818 -6.016 -7.965 41 HZ3 LYS 5 3HZ LYS 5 2.504 -6.127 -7.879 42 H LEU 6 H LEU 6 -1.495 -4.183 -4.460 43 HA LEU 6 HA LEU 6 -2.521 -5.875 -6.517 44 HB2 LEU 6 2HB LEU 6 -0.790 -6.831 -5.312 45 HB3 LEU 6 3HB LEU 6 -1.440 -6.295 -3.764 46 HG LEU 6 HG LEU 6 -3.222 -7.996 -3.964 47 HD11 LEU 6 1HD1 LEU 6 -1.672 -9.132 -6.270 48 HD12 LEU 6 2HD1 LEU 6 -3.053 -8.061 -6.501 49 HD13 LEU 6 3HD1 LEU 6 -3.263 -9.603 -5.672 50 HD21 LEU 6 1HD2 LEU 6 -1.736 -9.964 -3.617 51 HD22 LEU 6 2HD2 LEU 6 -1.282 -8.546 -2.671 52 HD23 LEU 6 3HD2 LEU 6 -0.373 -8.966 -4.123 53 H ALA 7 H ALA 7 -3.907 -4.262 -3.844 54 HA ALA 7 HA ALA 7 -5.972 -5.934 -3.063 55 HB1 ALA 7 1HB ALA 7 -5.381 -3.772 -1.998 56 HB2 ALA 7 2HB ALA 7 -6.159 -2.939 -3.344 57 HB3 ALA 7 3HB ALA 7 -7.112 -3.971 -2.277 58 H GLY 8 H GLY 8 -5.656 -3.971 -5.947 59 HA2 GLY 8 2HA GLY 8 -8.351 -4.008 -6.772 60 HA3 GLY 8 3HA GLY 8 -6.962 -3.778 -7.824 61 H LYS 9 H LYS 9 -5.948 -6.470 -6.778 62 HA LYS 9 HA LYS 9 -7.190 -8.036 -8.863 63 HB2 LYS 9 2HB LYS 9 -4.819 -8.246 -8.658 64 HB3 LYS 9 3HB LYS 9 -4.934 -8.584 -6.936 65 HG2 LYS 9 2HG LYS 9 -4.445 -10.553 -8.424 66 HG3 LYS 9 3HG LYS 9 -5.805 -10.742 -7.314 67 HD2 LYS 9 2HD LYS 9 -7.373 -10.283 -9.096 68 HD3 LYS 9 3HD LYS 9 -6.050 -9.945 -10.215 69 HE2 LYS 9 2HE LYS 9 -5.385 -12.429 -9.340 70 HE3 LYS 9 3HE LYS 9 -7.145 -12.512 -9.291 71 HZ1 LYS 9 1HZ LYS 9 -7.117 -11.676 -11.625 72 HZ2 LYS 9 2HZ LYS 9 -6.455 -13.220 -11.428 73 HZ3 LYS 9 3HZ LYS 9 -5.438 -11.884 -11.633 74 H LYS 10 H LYS 10 -6.573 -8.635 -5.398 75 HA LYS 10 HA LYS 10 -8.120 -10.872 -5.056 76 HB2 LYS 10 2HB LYS 10 -6.659 -9.865 -3.322 77 HB3 LYS 10 3HB LYS 10 -7.854 -8.597 -3.081 78 HG2 LYS 10 2HG LYS 10 -8.504 -11.507 -2.727 79 HG3 LYS 10 3HG LYS 10 -7.859 -10.508 -1.422 80 HD2 LYS 10 2HD LYS 10 -9.831 -8.907 -2.150 81 HD3 LYS 10 3HD LYS 10 -10.518 -10.415 -2.759 82 HE2 LYS 10 2HE LYS 10 -10.973 -11.164 -0.699 83 HE3 LYS 10 3HE LYS 10 -9.410 -10.647 -0.070 84 HZ1 LYS 10 1HZ LYS 10 -11.656 -8.778 -0.572 85 HZ2 LYS 10 2HZ LYS 10 -10.225 -8.467 0.274 86 HZ3 LYS 10 3HZ LYS 10 -11.381 -9.516 0.926 87 H ILE 11 H ILE 11 -9.186 -7.491 -4.768 88 HA ILE 11 HA ILE 11 -11.836 -7.950 -4.076 89 HB ILE 11 HB ILE 11 -12.339 -5.738 -4.965 90 HG12 ILE 11 2HG1 ILE 11 -10.072 -4.616 -5.922 91 HG13 ILE 11 3HG1 ILE 11 -9.873 -6.259 -6.520 92 HG21 ILE 11 1HG2 ILE 11 -9.802 -6.122 -3.428 93 HG22 ILE 11 2HG2 ILE 11 -10.365 -4.501 -3.832 94 HG23 ILE 11 3HG2 ILE 11 -11.380 -5.571 -2.864 95 HD11 ILE 11 1HD1 ILE 11 -11.570 -4.147 -7.481 96 HD12 ILE 11 2HD1 ILE 11 -11.147 -5.685 -8.234 97 HD13 ILE 11 3HD1 ILE 11 -12.506 -5.596 -7.114 98 H LYS 12 H LYS 12 -10.280 -8.012 -7.228 99 HA LYS 12 HA LYS 12 -12.717 -8.217 -8.714 100 HB2 LYS 12 2HB LYS 12 -10.216 -7.540 -9.410 101 HB3 LYS 12 3HB LYS 12 -10.178 -9.237 -9.870 102 HG2 LYS 12 2HG LYS 12 -12.232 -7.250 -10.817 103 HG3 LYS 12 3HG LYS 12 -10.795 -7.732 -11.723 104 HD2 LYS 12 2HD LYS 12 -11.853 -10.152 -11.139 105 HD3 LYS 12 3HD LYS 12 -13.320 -9.177 -11.257 106 HE2 LYS 12 2HE LYS 12 -13.113 -9.732 -13.448 107 HE3 LYS 12 3HE LYS 12 -12.076 -8.307 -13.447 108 HZ1 LYS 12 1HZ LYS 12 -10.495 -10.467 -12.707 109 HZ2 LYS 12 2HZ LYS 12 -10.434 -9.590 -14.152 110 HZ3 LYS 12 3HZ LYS 12 -11.399 -10.975 -14.043 111 H ASN 13 H ASN 13 -10.564 -10.454 -7.153 112 HA ASN 13 HA ASN 13 -11.486 -12.787 -8.528 113 HB2 ASN 13 2HB ASN 13 -9.276 -12.744 -7.486 114 HB3 ASN 13 3HB ASN 13 -10.009 -12.503 -5.902 115 HD21 ASN 13 1HD2 ASN 13 -9.553 -14.752 -8.534 116 HD22 ASN 13 2HD2 ASN 13 -9.921 -16.180 -7.633 117 H LEU 14 H LEU 14 -12.458 -11.026 -5.677 118 HA LEU 14 HA LEU 14 -14.223 -13.116 -4.744 119 HB2 LEU 14 2HB LEU 14 -13.125 -11.678 -3.133 120 HB3 LEU 14 3HB LEU 14 -13.860 -10.254 -3.867 121 HG LEU 14 HG LEU 14 -16.007 -10.826 -3.039 122 HD11 LEU 14 1HD1 LEU 14 -14.818 -13.454 -2.164 123 HD12 LEU 14 2HD1 LEU 14 -15.953 -13.215 -3.492 124 HD13 LEU 14 3HD1 LEU 14 -16.461 -12.904 -1.832 125 HD21 LEU 14 1HD2 LEU 14 -13.908 -11.341 -0.937 126 HD22 LEU 14 2HD2 LEU 14 -15.605 -10.997 -0.601 127 HD23 LEU 14 3HD2 LEU 14 -14.598 -9.782 -1.390 128 H LEU 15 H LEU 15 -14.447 -10.134 -6.573 129 HA LEU 15 HA LEU 15 -17.249 -9.835 -6.499 130 HB2 LEU 15 2HB LEU 15 -15.524 -8.140 -7.237 131 HB3 LEU 15 3HB LEU 15 -15.452 -9.012 -8.767 132 HG LEU 15 HG LEU 15 -17.781 -8.481 -9.206 133 HD11 LEU 15 1HD1 LEU 15 -18.670 -8.483 -6.972 134 HD12 LEU 15 2HD1 LEU 15 -18.985 -6.915 -7.715 135 HD13 LEU 15 3HD1 LEU 15 -17.685 -7.086 -6.537 136 HD21 LEU 15 1HD2 LEU 15 -16.358 -5.967 -8.360 137 HD22 LEU 15 2HD2 LEU 15 -17.532 -6.164 -9.662 138 HD23 LEU 15 3HD2 LEU 15 -15.929 -6.888 -9.802 139 H ILE 16 H ILE 16 -15.107 -11.442 -8.829 140 HA ILE 16 HA ILE 16 -17.169 -12.253 -10.594 141 HB ILE 16 HB ILE 16 -15.513 -13.805 -11.537 142 HG12 ILE 16 2HG1 ILE 16 -13.122 -13.325 -10.372 143 HG13 ILE 16 3HG1 ILE 16 -14.168 -13.237 -8.960 144 HG21 ILE 16 1HG2 ILE 16 -13.693 -12.014 -11.940 145 HG22 ILE 16 2HG2 ILE 16 -15.343 -11.689 -12.469 146 HG23 ILE 16 3HG2 ILE 16 -14.738 -10.970 -10.977 147 HD11 ILE 16 1HD1 ILE 16 -13.649 -15.449 -8.941 148 HD12 ILE 16 2HD1 ILE 16 -15.100 -15.494 -9.943 149 HD13 ILE 16 3HD1 ILE 16 -13.506 -15.547 -10.695 150 H SER 17 H SER 17 -15.714 -13.706 -7.748 151 HA SER 17 HA SER 17 -16.955 -16.262 -8.101 152 HB2 SER 17 2HB SER 17 -15.111 -15.030 -6.227 153 HB3 SER 17 3HB SER 17 -16.323 -16.002 -5.392 154 HG SER 17 HG SER 17 -14.321 -17.082 -6.191 155 H GLY 18 H GLY 18 -17.748 -13.293 -6.402 156 HA2 GLY 18 2HA GLY 18 -19.920 -14.391 -4.903 157 HA3 GLY 18 3HA GLY 18 -19.587 -12.684 -5.155 158 H LEU 19 H LEU 19 -19.592 -13.124 -8.121 159 HA LEU 19 HA LEU 19 -22.486 -12.909 -8.445 160 HB2 LEU 19 2HB LEU 19 -20.333 -12.389 -10.485 161 HB3 LEU 19 3HB LEU 19 -22.026 -11.907 -10.572 162 HG LEU 19 HG LEU 19 -20.333 -10.857 -8.351 163 HD11 LEU 19 1HD1 LEU 19 -20.332 -9.782 -11.168 164 HD12 LEU 19 2HD1 LEU 19 -18.962 -10.508 -10.328 165 HD13 LEU 19 3HD1 LEU 19 -19.636 -8.982 -9.759 166 HD21 LEU 19 1HD2 LEU 19 -21.850 -9.052 -8.392 167 HD22 LEU 19 2HD2 LEU 19 -22.832 -10.506 -8.576 168 HD23 LEU 19 3HD2 LEU 19 -22.466 -9.504 -9.982 169 H LYS 20 H LYS 20 -19.750 -14.825 -9.553 170 HA LYS 20 HA LYS 20 -21.278 -16.369 -11.421 171 HB2 LYS 20 2HB LYS 20 -19.304 -17.555 -11.845 172 HB3 LYS 20 3HB LYS 20 -18.743 -15.940 -11.432 173 HG2 LYS 20 2HG LYS 20 -17.316 -17.111 -10.137 174 HG3 LYS 20 3HG LYS 20 -18.666 -17.040 -9.002 175 HD2 LYS 20 2HD LYS 20 -18.759 -19.260 -8.981 176 HD3 LYS 20 3HD LYS 20 -19.086 -19.263 -10.716 177 HE2 LYS 20 2HE LYS 20 -16.889 -19.644 -11.265 178 HE3 LYS 20 3HE LYS 20 -16.279 -18.902 -9.787 179 HZ1 LYS 20 1HZ LYS 20 -17.815 -21.410 -9.647 180 HZ2 LYS 20 2HZ LYS 20 -16.660 -20.804 -8.570 181 HZ3 LYS 20 3HZ LYS 20 -16.174 -21.449 -10.056 182 H GLY 21 H GLY 21 -20.573 -16.558 -8.031 183 HA2 GLY 21 2HA GLY 21 -21.357 -19.344 -7.815 184 HA3 GLY 21 3HA GLY 21 -20.906 -18.279 -6.492 Start of MODEL 20 1 H1 GLY 1 H GLY 1 3.399 1.729 -1.084 2 HA2 GLY 1 2HA GLY 1 1.442 0.338 -0.966 3 HA3 GLY 1 3HA GLY 1 1.316 1.239 -2.470 4 H ILE 2 H ILE 2 2.934 -1.710 -1.280 5 HA ILE 2 HA ILE 2 2.624 -2.969 -3.867 6 HB ILE 2 HB ILE 2 3.648 -4.964 -2.633 7 HG12 ILE 2 2HG1 ILE 2 3.004 -3.655 -0.383 8 HG13 ILE 2 3HG1 ILE 2 4.351 -4.784 -0.469 9 HG21 ILE 2 1HG2 ILE 2 5.001 -3.700 -4.105 10 HG22 ILE 2 2HG2 ILE 2 5.085 -2.346 -2.979 11 HG23 ILE 2 3HG2 ILE 2 5.917 -3.855 -2.606 12 HD11 ILE 2 1HD1 ILE 2 5.927 -3.105 -0.457 13 HD12 ILE 2 2HD1 ILE 2 4.788 -1.889 -1.037 14 HD13 ILE 2 3HD1 ILE 2 4.688 -2.470 0.625 15 H PHE 3 H PHE 3 1.241 -3.227 -0.640 16 HA PHE 3 HA PHE 3 -0.366 -5.524 -1.327 17 HB2 PHE 3 2HB PHE 3 -0.568 -3.736 1.104 18 HB3 PHE 3 3HB PHE 3 -1.252 -5.348 0.922 19 HD1 PHE 3 HD1 PHE 3 0.815 -6.989 -0.092 20 HD2 PHE 3 HD2 PHE 3 1.123 -3.745 2.646 21 HE1 PHE 3 HE1 PHE 3 2.876 -7.967 0.830 22 HE2 PHE 3 HE2 PHE 3 3.185 -4.717 3.571 23 HZ PHE 3 HZ PHE 3 4.064 -6.831 2.663 24 H SER 4 H SER 4 -0.677 -2.086 -1.403 25 HA SER 4 HA SER 4 -3.547 -2.037 -1.456 26 HB2 SER 4 2HB SER 4 -1.710 0.157 -2.417 27 HB3 SER 4 3HB SER 4 -3.350 0.311 -1.789 28 HG SER 4 HG SER 4 -1.668 0.866 -0.269 29 H LYS 5 H LYS 5 -0.956 -2.000 -3.839 30 HA LYS 5 HA LYS 5 -2.684 -1.543 -6.075 31 HB2 LYS 5 2HB LYS 5 -0.690 -2.113 -7.428 32 HB3 LYS 5 3HB LYS 5 -0.355 -0.891 -6.209 33 HG2 LYS 5 2HG LYS 5 1.468 -2.221 -5.938 34 HG3 LYS 5 3HG LYS 5 0.369 -2.992 -4.792 35 HD2 LYS 5 2HD LYS 5 0.409 -4.900 -5.940 36 HD3 LYS 5 3HD LYS 5 0.001 -4.067 -7.442 37 HE2 LYS 5 2HE LYS 5 2.051 -4.818 -8.046 38 HE3 LYS 5 3HE LYS 5 2.564 -3.339 -7.235 39 HZ1 LYS 5 1HZ LYS 5 3.548 -5.736 -6.664 40 HZ2 LYS 5 2HZ LYS 5 2.280 -5.686 -5.546 41 HZ3 LYS 5 3HZ LYS 5 3.465 -4.480 -5.534 42 H LEU 6 H LEU 6 -1.299 -4.372 -4.505 43 HA LEU 6 HA LEU 6 -2.153 -6.226 -6.504 44 HB2 LEU 6 2HB LEU 6 -0.976 -7.719 -5.334 45 HB3 LEU 6 3HB LEU 6 -0.408 -6.324 -4.418 46 HG LEU 6 HG LEU 6 -2.503 -6.845 -2.924 47 HD11 LEU 6 1HD1 LEU 6 -2.498 -9.043 -4.753 48 HD12 LEU 6 2HD1 LEU 6 -3.627 -8.681 -3.447 49 HD13 LEU 6 3HD1 LEU 6 -2.177 -9.631 -3.121 50 HD21 LEU 6 1HD2 LEU 6 -0.424 -8.866 -2.458 51 HD22 LEU 6 2HD2 LEU 6 -1.008 -7.571 -1.412 52 HD23 LEU 6 3HD2 LEU 6 0.172 -7.220 -2.676 53 H ALA 7 H ALA 7 -3.669 -4.671 -3.845 54 HA ALA 7 HA ALA 7 -5.637 -6.535 -3.153 55 HB1 ALA 7 1HB ALA 7 -6.793 -4.748 -2.116 56 HB2 ALA 7 2HB ALA 7 -5.073 -4.392 -1.952 57 HB3 ALA 7 3HB ALA 7 -6.035 -3.553 -3.169 58 H GLY 8 H GLY 8 -5.425 -4.280 -5.831 59 HA2 GLY 8 2HA GLY 8 -8.089 -4.266 -6.667 60 HA3 GLY 8 3HA GLY 8 -6.702 -4.039 -7.722 61 H LYS 9 H LYS 9 -5.763 -6.799 -6.802 62 HA LYS 9 HA LYS 9 -7.091 -8.241 -8.927 63 HB2 LYS 9 2HB LYS 9 -4.723 -8.520 -8.794 64 HB3 LYS 9 3HB LYS 9 -4.801 -8.925 -7.085 65 HG2 LYS 9 2HG LYS 9 -4.402 -10.844 -8.661 66 HG3 LYS 9 3HG LYS 9 -5.739 -11.042 -7.525 67 HD2 LYS 9 2HD LYS 9 -7.337 -10.472 -9.248 68 HD3 LYS 9 3HD LYS 9 -6.032 -10.124 -10.385 69 HE2 LYS 9 2HE LYS 9 -6.713 -12.267 -10.983 70 HE3 LYS 9 3HE LYS 9 -5.306 -12.558 -9.962 71 HZ1 LYS 9 1HZ LYS 9 -6.774 -14.015 -9.051 72 HZ2 LYS 9 2HZ LYS 9 -8.134 -13.082 -9.424 73 HZ3 LYS 9 3HZ LYS 9 -7.150 -12.657 -8.116 74 H LYS 10 H LYS 10 -6.393 -9.015 -5.512 75 HA LYS 10 HA LYS 10 -8.006 -11.219 -5.232 76 HB2 LYS 10 2HB LYS 10 -6.652 -10.758 -3.395 77 HB3 LYS 10 3HB LYS 10 -7.155 -9.074 -3.320 78 HG2 LYS 10 2HG LYS 10 -8.009 -10.454 -1.455 79 HG3 LYS 10 3HG LYS 10 -9.282 -9.684 -2.404 80 HD2 LYS 10 2HD LYS 10 -10.151 -11.653 -3.012 81 HD3 LYS 10 3HD LYS 10 -8.566 -12.316 -3.418 82 HE2 LYS 10 2HE LYS 10 -9.612 -13.594 -1.628 83 HE3 LYS 10 3HE LYS 10 -8.156 -12.783 -1.053 84 HZ1 LYS 10 1HZ LYS 10 -9.345 -11.369 0.253 85 HZ2 LYS 10 2HZ LYS 10 -10.378 -12.707 0.305 86 HZ3 LYS 10 3HZ LYS 10 -10.723 -11.412 -0.727 87 H ILE 11 H ILE 11 -8.930 -7.816 -4.824 88 HA ILE 11 HA ILE 11 -11.575 -8.217 -4.029 89 HB ILE 11 HB ILE 11 -12.022 -5.947 -4.779 90 HG12 ILE 11 2HG1 ILE 11 -9.760 -4.852 -5.773 91 HG13 ILE 11 3HG1 ILE 11 -9.635 -6.470 -6.455 92 HG21 ILE 11 1HG2 ILE 11 -10.968 -5.941 -2.711 93 HG22 ILE 11 2HG2 ILE 11 -9.432 -6.488 -3.381 94 HG23 ILE 11 3HG2 ILE 11 -9.977 -4.834 -3.659 95 HD11 ILE 11 1HD1 ILE 11 -12.286 -5.586 -6.858 96 HD12 ILE 11 2HD1 ILE 11 -11.203 -4.280 -7.340 97 HD13 ILE 11 3HD1 ILE 11 -11.029 -5.881 -8.059 98 H LYS 12 H LYS 12 -10.119 -8.181 -7.227 99 HA LYS 12 HA LYS 12 -12.606 -8.216 -8.643 100 HB2 LYS 12 2HB LYS 12 -10.095 -7.609 -9.381 101 HB3 LYS 12 3HB LYS 12 -10.153 -9.277 -9.935 102 HG2 LYS 12 2HG LYS 12 -12.121 -7.131 -10.704 103 HG3 LYS 12 3HG LYS 12 -10.756 -7.663 -11.688 104 HD2 LYS 12 2HD LYS 12 -11.942 -10.035 -11.181 105 HD3 LYS 12 3HD LYS 12 -13.350 -8.969 -11.170 106 HE2 LYS 12 2HE LYS 12 -12.323 -8.043 -13.376 107 HE3 LYS 12 3HE LYS 12 -11.435 -9.566 -13.390 108 HZ1 LYS 12 1HZ LYS 12 -13.961 -10.363 -12.884 109 HZ2 LYS 12 2HZ LYS 12 -13.239 -10.352 -14.414 110 HZ3 LYS 12 3HZ LYS 12 -14.218 -9.059 -13.932 111 H ASN 13 H ASN 13 -10.472 -10.615 -7.295 112 HA ASN 13 HA ASN 13 -11.539 -12.835 -8.742 113 HB2 ASN 13 2HB ASN 13 -9.339 -13.084 -7.865 114 HB3 ASN 13 3HB ASN 13 -9.856 -12.622 -6.246 115 HD21 ASN 13 1HD2 ASN 13 -10.138 -14.215 -4.873 116 HD22 ASN 13 2HD2 ASN 13 -10.472 -15.861 -5.274 117 H LEU 14 H LEU 14 -12.300 -11.231 -5.726 118 HA LEU 14 HA LEU 14 -14.115 -13.285 -4.840 119 HB2 LEU 14 2HB LEU 14 -12.918 -11.945 -3.215 120 HB3 LEU 14 3HB LEU 14 -13.642 -10.474 -3.862 121 HG LEU 14 HG LEU 14 -15.770 -11.023 -2.975 122 HD11 LEU 14 1HD1 LEU 14 -16.233 -13.141 -1.840 123 HD12 LEU 14 2HD1 LEU 14 -14.622 -13.720 -2.265 124 HD13 LEU 14 3HD1 LEU 14 -15.803 -13.390 -3.533 125 HD21 LEU 14 1HD2 LEU 14 -14.959 -11.746 -0.514 126 HD22 LEU 14 2HD2 LEU 14 -14.782 -10.114 -1.160 127 HD23 LEU 14 3HD2 LEU 14 -13.419 -11.233 -1.205 128 H LEU 15 H LEU 15 -14.322 -10.215 -6.523 129 HA LEU 15 HA LEU 15 -17.105 -9.837 -6.336 130 HB2 LEU 15 2HB LEU 15 -15.369 -8.167 -7.083 131 HB3 LEU 15 3HB LEU 15 -15.358 -8.995 -8.638 132 HG LEU 15 HG LEU 15 -17.679 -8.392 -9.007 133 HD11 LEU 15 1HD1 LEU 15 -18.828 -6.871 -7.442 134 HD12 LEU 15 2HD1 LEU 15 -17.499 -7.075 -6.301 135 HD13 LEU 15 3HD1 LEU 15 -18.504 -8.456 -6.740 136 HD21 LEU 15 1HD2 LEU 15 -15.867 -6.825 -9.649 137 HD22 LEU 15 2HD2 LEU 15 -16.102 -5.980 -8.119 138 HD23 LEU 15 3HD2 LEU 15 -17.401 -6.023 -9.311 139 H ILE 16 H ILE 16 -15.111 -11.462 -8.778 140 HA ILE 16 HA ILE 16 -17.262 -12.132 -10.498 141 HB ILE 16 HB ILE 16 -14.969 -12.116 -11.313 142 HG12 ILE 16 2HG1 ILE 16 -16.425 -14.753 -11.409 143 HG13 ILE 16 3HG1 ILE 16 -16.406 -13.472 -12.617 144 HG21 ILE 16 1HG2 ILE 16 -13.959 -12.945 -9.185 145 HG22 ILE 16 2HG2 ILE 16 -14.488 -14.567 -9.630 146 HG23 ILE 16 3HG2 ILE 16 -13.322 -13.712 -10.640 147 HD11 ILE 16 1HD1 ILE 16 -14.168 -15.353 -11.920 148 HD12 ILE 16 2HD1 ILE 16 -15.093 -15.286 -13.421 149 HD13 ILE 16 3HD1 ILE 16 -14.000 -13.968 -12.999 150 H SER 17 H SER 17 -15.706 -13.788 -7.805 151 HA SER 17 HA SER 17 -17.092 -16.255 -8.170 152 HB2 SER 17 2HB SER 17 -15.029 -15.264 -6.478 153 HB3 SER 17 3HB SER 17 -16.294 -15.930 -5.445 154 HG SER 17 HG SER 17 -15.203 -17.305 -7.671 155 H GLY 18 H GLY 18 -17.679 -13.326 -6.319 156 HA2 GLY 18 2HA GLY 18 -19.918 -14.448 -4.885 157 HA3 GLY 18 3HA GLY 18 -19.399 -12.770 -4.864 158 H LEU 19 H LEU 19 -19.456 -12.962 -7.940 159 HA LEU 19 HA LEU 19 -22.299 -12.285 -8.160 160 HB2 LEU 19 2HB LEU 19 -20.997 -10.500 -8.911 161 HB3 LEU 19 3HB LEU 19 -19.862 -11.560 -9.743 162 HG LEU 19 HG LEU 19 -21.553 -12.018 -11.457 163 HD11 LEU 19 1HD1 LEU 19 -23.248 -9.908 -10.149 164 HD12 LEU 19 2HD1 LEU 19 -23.497 -11.634 -9.894 165 HD13 LEU 19 3HD1 LEU 19 -23.658 -10.950 -11.512 166 HD21 LEU 19 1HD2 LEU 19 -21.436 -9.910 -12.570 167 HD22 LEU 19 2HD2 LEU 19 -19.949 -10.110 -11.642 168 HD23 LEU 19 3HD2 LEU 19 -21.227 -9.052 -11.043 169 H LYS 20 H LYS 20 -19.996 -14.639 -9.101 170 HA LYS 20 HA LYS 20 -21.328 -15.580 -11.445 171 HB2 LYS 20 2HB LYS 20 -18.991 -16.055 -11.201 172 HB3 LYS 20 3HB LYS 20 -19.251 -16.823 -9.640 173 HG2 LYS 20 2HG LYS 20 -20.818 -18.098 -11.700 174 HG3 LYS 20 3HG LYS 20 -19.104 -18.065 -12.120 175 HD2 LYS 20 2HD LYS 20 -18.510 -19.170 -10.089 176 HD3 LYS 20 3HD LYS 20 -20.147 -19.002 -9.452 177 HE2 LYS 20 2HE LYS 20 -20.729 -20.933 -10.380 178 HE3 LYS 20 3HE LYS 20 -20.275 -20.327 -11.972 179 HZ1 LYS 20 1HZ LYS 20 -18.616 -21.771 -11.960 180 HZ2 LYS 20 2HZ LYS 20 -18.969 -22.253 -10.377 181 HZ3 LYS 20 3HZ LYS 20 -17.919 -20.955 -10.652 182 H GLY 21 H GLY 21 -21.545 -16.271 -8.021 183 HA2 GLY 21 2HA GLY 21 -23.487 -18.415 -8.578 184 HA3 GLY 21 3HA GLY 21 -22.634 -18.190 -7.058
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