NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
15351 | 1y03 | 6427 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H GLY 1 1H GLY 1 21.503 -12.958 4.170 2 2H GLY 1 2H GLY 1 21.068 -11.624 5.122 3 3H GLY 1 3H GLY 1 22.704 -11.980 4.862 4 1HA GLY 1 2HA GLY 1 21.584 -10.096 3.517 5 2HA GLY 1 1HA GLY 1 22.710 -11.193 2.729 6 H SER 2 H SER 2 19.306 -10.479 3.264 7 HA SER 2 HA SER 2 18.694 -11.962 0.798 8 1HB SER 2 1HB SER 2 16.388 -12.017 2.432 9 2HB SER 2 2HB SER 2 17.403 -13.377 1.953 10 HG SER 2 HG SER 2 17.859 -13.515 3.992 11 H MET 3 H MET 3 18.760 -9.986 -0.329 12 HA MET 3 HA MET 3 16.387 -8.303 0.141 13 1HB MET 3 1HB MET 3 19.160 -7.538 -0.004 14 2HB MET 3 2HB MET 3 18.273 -6.802 -1.331 15 1HG MET 3 1HG MET 3 17.086 -6.639 1.381 16 2HG MET 3 2HG MET 3 18.496 -5.641 1.030 17 1HE MET 3 1HE MET 3 18.306 -3.503 0.541 18 2HE MET 3 2HE MET 3 18.349 -3.679 -1.216 19 3HE MET 3 3HE MET 3 17.123 -2.660 -0.461 20 H ASN 4 H ASN 4 17.122 -10.699 -1.553 21 HA ASN 4 HA ASN 4 17.080 -9.710 -4.267 22 1HB ASN 4 1HB ASN 4 16.705 -12.597 -3.570 23 2HB ASN 4 2HB ASN 4 17.561 -11.884 -4.929 24 1HD2 ASN 4 1HD2 ASN 4 19.687 -11.800 -4.829 25 2HD2 ASN 4 2HD2 ASN 4 20.640 -12.042 -3.401 26 H ALA 5 H ALA 5 15.559 -11.173 -5.741 27 HA ALA 5 HA ALA 5 12.961 -10.209 -5.360 28 1HB ALA 5 1HB ALA 5 14.377 -11.645 -7.375 29 2HB ALA 5 2HB ALA 5 12.794 -12.386 -7.131 30 3HB ALA 5 3HB ALA 5 12.914 -10.670 -7.517 31 HA PRO 6 HA PRO 6 11.601 -14.720 -4.180 32 1HB PRO 6 1HB PRO 6 13.526 -16.286 -3.026 33 2HB PRO 6 2HB PRO 6 13.115 -16.340 -4.743 34 1HG PRO 6 1HG PRO 6 15.368 -14.927 -3.378 35 2HG PRO 6 2HG PRO 6 15.378 -15.858 -4.890 36 1HD PRO 6 1HD PRO 6 15.317 -13.171 -4.871 37 2HD PRO 6 2HD PRO 6 14.473 -14.108 -6.107 38 H ALA 7 H ALA 7 13.999 -12.932 -2.425 39 HA ALA 7 HA ALA 7 13.110 -13.691 0.185 40 1HB ALA 7 1HB ALA 7 14.446 -11.131 0.110 41 2HB ALA 7 2HB ALA 7 14.952 -12.642 0.863 42 3HB ALA 7 3HB ALA 7 15.311 -12.342 -0.836 43 H ARG 8 H ARG 8 12.240 -11.334 -2.137 44 HA ARG 8 HA ARG 8 10.759 -9.661 -0.313 45 1HB ARG 8 1HB ARG 8 11.571 -9.579 -3.132 46 2HB ARG 8 2HB ARG 8 9.962 -8.932 -2.841 47 1HG ARG 8 1HG ARG 8 10.801 -7.302 -1.328 48 2HG ARG 8 2HG ARG 8 12.398 -8.059 -1.310 49 1HD ARG 8 1HD ARG 8 11.646 -7.456 -4.005 50 2HD ARG 8 2HD ARG 8 11.462 -6.016 -3.006 51 HE ARG 8 HE ARG 8 13.965 -7.446 -2.698 52 1HH1 ARG 8 2HH1 ARG 8 12.252 -4.867 -4.330 53 2HH1 ARG 8 1HH1 ARG 8 13.692 -3.987 -4.736 54 1HH2 ARG 8 2HH2 ARG 8 15.862 -6.300 -3.219 55 2HH2 ARG 8 1HH2 ARG 8 15.756 -4.796 -4.090 56 H ALA 9 H ALA 9 10.202 -12.475 -2.157 57 HA ALA 9 HA ALA 9 7.434 -12.164 -2.679 58 1HB ALA 9 1HB ALA 9 7.669 -14.803 -2.734 59 2HB ALA 9 2HB ALA 9 8.298 -13.776 -4.023 60 3HB ALA 9 3HB ALA 9 9.383 -14.391 -2.774 61 H ALA 10 H ALA 10 9.169 -12.913 0.172 62 HA ALA 10 HA ALA 10 7.117 -14.421 1.481 63 1HB ALA 10 1HB ALA 10 9.143 -14.885 2.431 64 2HB ALA 10 2HB ALA 10 9.718 -13.225 2.283 65 3HB ALA 10 3HB ALA 10 8.566 -13.649 3.549 66 H ALA 11 H ALA 11 7.682 -11.092 0.910 67 HA ALA 11 HA ALA 11 6.019 -10.222 3.148 68 1HB ALA 11 1HB ALA 11 7.479 -8.599 1.064 69 2HB ALA 11 2HB ALA 11 6.650 -7.961 2.485 70 3HB ALA 11 3HB ALA 11 8.075 -8.983 2.681 71 H LYS 12 H LYS 12 5.252 -11.614 0.462 72 HA LYS 12 HA LYS 12 3.740 -9.940 -1.144 73 1HB LYS 12 1HB LYS 12 4.319 -12.313 -1.636 74 2HB LYS 12 2HB LYS 12 3.106 -12.812 -0.467 75 1HG LYS 12 1HG LYS 12 1.890 -11.014 -2.314 76 2HG LYS 12 2HG LYS 12 2.765 -12.255 -3.213 77 1HD LYS 12 1HD LYS 12 1.635 -13.929 -1.652 78 2HD LYS 12 2HD LYS 12 0.571 -12.600 -1.194 79 1HE LYS 12 2HE LYS 12 0.652 -12.572 -3.987 80 2HE LYS 12 1HE LYS 12 0.504 -14.272 -3.536 81 1HZ LYS 12 1HZ LYS 12 -1.287 -12.039 -2.728 82 2HZ LYS 12 2HZ LYS 12 -1.388 -13.616 -2.100 83 3HZ LYS 12 3HZ LYS 12 -1.668 -13.341 -3.751 84 H THR 13 H THR 13 2.356 -12.127 1.314 85 HA THR 13 HA THR 13 -0.210 -11.223 1.347 86 HB THR 13 HB THR 13 0.780 -11.834 4.028 87 HG1 THR 13 1HG THR 13 1.507 -13.930 3.454 88 1HG2 THR 13 1HG2 THR 13 -1.087 -13.271 2.139 89 2HG2 THR 13 2HG2 THR 13 -1.564 -12.056 3.325 90 3HG2 THR 13 3HG2 THR 13 -0.896 -13.599 3.861 91 H ALA 14 H ALA 14 2.536 -9.736 2.968 92 HA ALA 14 HA ALA 14 1.071 -8.018 4.669 93 1HB ALA 14 1HB ALA 14 3.089 -7.450 5.411 94 2HB ALA 14 2HB ALA 14 3.760 -8.573 4.230 95 3HB ALA 14 3HB ALA 14 3.582 -6.869 3.819 96 H ALA 15 H ALA 15 2.723 -7.341 1.584 97 HA ALA 15 HA ALA 15 1.535 -4.792 1.221 98 1HB ALA 15 1HB ALA 15 3.441 -4.978 -0.026 99 2HB ALA 15 2HB ALA 15 3.124 -6.654 -0.466 100 3HB ALA 15 3HB ALA 15 2.246 -5.352 -1.264 101 H ASP 16 H ASP 16 0.444 -8.000 0.617 102 HA ASP 16 HA ASP 16 -1.482 -7.417 -1.403 103 1HB ASP 16 1HB ASP 16 -0.444 -9.716 -0.527 104 2HB ASP 16 2HB ASP 16 -1.891 -9.696 0.472 105 H ALA 17 H ALA 17 -1.621 -7.814 2.108 106 HA ALA 17 HA ALA 17 -4.388 -7.410 2.420 107 1HB ALA 17 1HB ALA 17 -2.106 -7.729 4.107 108 2HB ALA 17 2HB ALA 17 -3.074 -6.378 4.694 109 3HB ALA 17 3HB ALA 17 -3.810 -7.969 4.496 110 H LEU 18 H LEU 18 -1.654 -5.188 2.348 111 HA LEU 18 HA LEU 18 -3.100 -2.850 3.015 112 1HB LEU 18 1HB LEU 18 -0.513 -3.249 1.523 113 2HB LEU 18 2HB LEU 18 -1.147 -1.671 1.955 114 HG LEU 18 HG LEU 18 -0.283 -3.846 3.863 115 1HD1 LEU 18 1HD1 LEU 18 1.652 -2.830 3.098 116 2HD1 LEU 18 2HD1 LEU 18 0.878 -1.253 2.938 117 3HD1 LEU 18 3HD1 LEU 18 1.265 -1.885 4.538 118 1HD2 LEU 18 1HD2 LEU 18 -0.711 -2.108 5.609 119 2HD2 LEU 18 2HD2 LEU 18 -1.549 -1.158 4.383 120 3HD2 LEU 18 3HD2 LEU 18 -2.167 -2.743 4.845 121 H ALA 19 H ALA 19 -2.215 -4.343 -0.061 122 HA ALA 19 HA ALA 19 -3.177 -2.427 -1.819 123 1HB ALA 19 1HB ALA 19 -3.762 -5.130 -2.717 124 2HB ALA 19 2HB ALA 19 -2.650 -3.932 -3.379 125 3HB ALA 19 3HB ALA 19 -2.137 -4.973 -2.050 126 H ALA 20 H ALA 20 -4.929 -5.123 -0.306 127 HA ALA 20 HA ALA 20 -7.428 -4.545 -1.507 128 1HB ALA 20 1HB ALA 20 -7.729 -5.806 1.060 129 2HB ALA 20 2HB ALA 20 -8.000 -6.470 -0.551 130 3HB ALA 20 3HB ALA 20 -6.391 -6.532 0.169 131 H ALA 21 H ALA 21 -6.019 -3.708 1.634 132 HA ALA 21 HA ALA 21 -8.254 -2.409 2.721 133 1HB ALA 21 1HB ALA 21 -6.746 -1.479 4.343 134 2HB ALA 21 2HB ALA 21 -6.253 -3.136 3.999 135 3HB ALA 21 3HB ALA 21 -5.362 -1.787 3.296 136 H LYS 22 H LYS 22 -5.551 -1.159 0.794 137 HA LYS 22 HA LYS 22 -6.299 1.573 1.007 138 1HB LYS 22 1HB LYS 22 -4.338 -0.028 -0.497 139 2HB LYS 22 2HB LYS 22 -4.864 1.436 -1.313 140 1HG LYS 22 1HG LYS 22 -2.779 1.551 0.160 141 2HG LYS 22 2HG LYS 22 -3.991 2.822 0.339 142 1HD LYS 22 1HD LYS 22 -4.928 1.544 2.272 143 2HD LYS 22 2HD LYS 22 -3.564 0.434 2.135 144 1HE LYS 22 2HE LYS 22 -3.097 2.065 3.840 145 2HE LYS 22 1HE LYS 22 -2.028 2.336 2.465 146 1HZ LYS 22 1HZ LYS 22 -3.586 4.093 1.726 147 2HZ LYS 22 2HZ LYS 22 -2.856 4.425 3.222 148 3HZ LYS 22 3HZ LYS 22 -4.463 3.886 3.165 149 H LYS 23 H LYS 23 -6.932 -0.974 -1.329 150 HA LYS 23 HA LYS 23 -8.184 0.564 -3.315 151 1HB LYS 23 1HB LYS 23 -7.513 -1.682 -3.813 152 2HB LYS 23 2HB LYS 23 -8.498 -2.330 -2.516 153 1HG LYS 23 1HG LYS 23 -9.557 -2.782 -4.624 154 2HG LYS 23 2HG LYS 23 -10.524 -1.614 -3.723 155 1HD LYS 23 1HD LYS 23 -9.537 0.206 -5.059 156 2HD LYS 23 2HD LYS 23 -8.608 -0.985 -5.975 157 1HE LYS 23 2HE LYS 23 -10.362 -1.512 -7.261 158 2HE LYS 23 1HE LYS 23 -11.450 -1.610 -5.877 159 1HZ LYS 23 1HZ LYS 23 -10.631 1.068 -6.658 160 2HZ LYS 23 2HZ LYS 23 -12.156 0.495 -6.166 161 3HZ LYS 23 3HZ LYS 23 -11.631 0.256 -7.764 162 H THR 24 H THR 24 -9.576 -1.403 -0.735 163 HA THR 24 HA THR 24 -12.230 -0.766 -1.226 164 HB THR 24 HB THR 24 -10.719 -1.873 1.085 165 HG1 THR 24 1HG THR 24 -12.685 -2.863 -0.727 166 1HG2 THR 24 1HG2 THR 24 -12.647 -0.455 1.876 167 2HG2 THR 24 2HG2 THR 24 -12.645 -2.139 2.393 168 3HG2 THR 24 3HG2 THR 24 -13.702 -1.620 1.078 169 H ALA 25 H ALA 25 -9.854 0.759 0.944 170 HA ALA 25 HA ALA 25 -11.592 2.477 2.300 171 1HB ALA 25 1HB ALA 25 -8.733 2.213 1.957 172 2HB ALA 25 2HB ALA 25 -9.218 3.909 2.001 173 3HB ALA 25 3HB ALA 25 -9.649 2.835 3.331 174 H ALA 26 H ALA 26 -9.634 3.115 -0.594 175 HA ALA 26 HA ALA 26 -10.770 5.652 -1.140 176 1HB ALA 26 1HB ALA 26 -9.899 4.738 -3.579 177 2HB ALA 26 2HB ALA 26 -8.923 5.600 -2.390 178 3HB ALA 26 3HB ALA 26 -8.901 3.837 -2.438 179 H ASP 27 H ASP 27 -11.613 2.391 -2.098 180 HA ASP 27 HA ASP 27 -13.505 2.907 -4.076 181 1HB ASP 27 1HB ASP 27 -12.547 0.670 -2.825 182 2HB ASP 27 2HB ASP 27 -14.192 0.735 -2.204 183 H ALA 28 H ALA 28 -13.970 2.530 -0.579 184 HA ALA 28 HA ALA 28 -16.725 3.163 -0.572 185 1HB ALA 28 1HB ALA 28 -14.854 2.305 1.294 186 2HB ALA 28 2HB ALA 28 -15.402 3.868 1.897 187 3HB ALA 28 3HB ALA 28 -16.572 2.589 1.570 188 H ALA 29 H ALA 29 -13.821 5.126 -0.303 189 HA ALA 29 HA ALA 29 -15.121 7.525 0.508 190 1HB ALA 29 1HB ALA 29 -12.633 6.912 0.695 191 2HB ALA 29 2HB ALA 29 -12.522 7.441 -0.985 192 3HB ALA 29 3HB ALA 29 -13.048 8.572 0.262 193 H ALA 30 H ALA 30 -14.254 6.113 -2.593 194 HA ALA 30 HA ALA 30 -14.894 8.314 -4.228 195 1HB ALA 30 1HB ALA 30 -15.454 6.109 -5.771 196 2HB ALA 30 2HB ALA 30 -13.871 6.868 -5.590 197 3HB ALA 30 3HB ALA 30 -14.307 5.484 -4.586 198 H ALA 31 H ALA 31 -16.809 5.689 -2.897 199 HA ALA 31 HA ALA 31 -19.211 6.524 -4.284 200 1HB ALA 31 1HB ALA 31 -18.721 4.380 -2.218 201 2HB ALA 31 2HB ALA 31 -20.279 4.687 -2.988 202 3HB ALA 31 3HB ALA 31 -18.903 4.165 -3.961 203 H ALA 32 H ALA 32 -17.665 8.037 -2.015 204 HA ALA 32 HA ALA 32 -19.995 8.599 -0.326 205 1HB ALA 32 1HB ALA 32 -18.071 8.154 0.992 206 2HB ALA 32 2HB ALA 32 -17.077 9.239 0.021 207 3HB ALA 32 3HB ALA 32 -18.340 9.895 1.061 208 H ALA 33 H ALA 33 -19.831 9.457 -3.073 209 HA ALA 33 HA ALA 33 -19.277 12.318 -2.954 210 1HB ALA 33 1HB ALA 33 -20.191 12.048 -5.424 211 2HB ALA 33 2HB ALA 33 -18.540 11.599 -4.992 212 3HB ALA 33 3HB ALA 33 -19.786 10.360 -5.127 213 H ALA 34 H ALA 34 -21.945 10.083 -3.166 214 HA ALA 34 HA ALA 34 -23.841 12.321 -3.012 215 1HB ALA 34 1HB ALA 34 -25.570 10.545 -3.409 216 2HB ALA 34 2HB ALA 34 -24.429 10.776 -4.733 217 3HB ALA 34 3HB ALA 34 -24.249 9.401 -3.644 218 H ALA 35 H ALA 35 -22.710 12.449 -0.785 219 HA ALA 35 HA ALA 35 -24.433 11.066 1.144 220 1HB ALA 35 1HB ALA 35 -22.423 9.770 1.211 221 2HB ALA 35 2HB ALA 35 -21.426 11.223 1.269 222 3HB ALA 35 3HB ALA 35 -22.439 10.797 2.647 Start of MODEL 2 1 1H GLY 1 1H GLY 1 19.057 -20.591 -2.871 2 2H GLY 1 2H GLY 1 18.508 -19.491 -1.700 3 3H GLY 1 3H GLY 1 18.730 -18.988 -3.301 4 1HA GLY 1 2HA GLY 1 16.960 -20.443 -4.047 5 2HA GLY 1 1HA GLY 1 16.731 -20.977 -2.386 6 H SER 2 H SER 2 17.417 -17.690 -3.479 7 HA SER 2 HA SER 2 15.220 -16.695 -1.918 8 1HB SER 2 1HB SER 2 16.641 -14.896 -3.797 9 2HB SER 2 2HB SER 2 16.260 -14.670 -2.089 10 HG SER 2 HG SER 2 18.083 -15.613 -1.532 11 H MET 3 H MET 3 15.754 -17.555 -5.203 12 HA MET 3 HA MET 3 13.443 -16.066 -6.166 13 1HB MET 3 1HB MET 3 15.592 -16.405 -7.508 14 2HB MET 3 2HB MET 3 15.076 -18.073 -7.715 15 1HG MET 3 1HG MET 3 14.531 -16.601 -9.628 16 2HG MET 3 2HG MET 3 13.130 -17.399 -8.919 17 1HE MET 3 1HE MET 3 13.408 -15.224 -10.898 18 2HE MET 3 2HE MET 3 11.802 -14.618 -10.495 19 3HE MET 3 3HE MET 3 13.198 -13.549 -10.387 20 H ASN 4 H ASN 4 12.317 -17.407 -4.405 21 HA ASN 4 HA ASN 4 11.199 -19.823 -5.662 22 1HB ASN 4 1HB ASN 4 12.731 -19.962 -3.458 23 2HB ASN 4 2HB ASN 4 11.184 -19.622 -2.695 24 1HD2 ASN 4 1HD2 ASN 4 12.917 -22.023 -2.751 25 2HD2 ASN 4 2HD2 ASN 4 11.885 -23.311 -3.269 26 H ALA 5 H ALA 5 8.985 -20.286 -5.058 27 HA ALA 5 HA ALA 5 7.353 -18.018 -5.290 28 1HB ALA 5 1HB ALA 5 6.482 -20.779 -4.483 29 2HB ALA 5 2HB ALA 5 5.478 -19.511 -5.184 30 3HB ALA 5 3HB ALA 5 6.762 -20.252 -6.142 31 HA PRO 6 HA PRO 6 5.952 -18.669 -0.731 32 1HB PRO 6 1HB PRO 6 7.574 -20.133 0.904 33 2HB PRO 6 2HB PRO 6 6.190 -20.804 0.038 34 1HG PRO 6 1HG PRO 6 9.091 -20.954 -0.620 35 2HG PRO 6 2HG PRO 6 7.830 -22.185 -0.805 36 1HD PRO 6 1HD PRO 6 8.788 -20.690 -2.870 37 2HD PRO 6 2HD PRO 6 7.142 -21.342 -2.834 38 H ALA 7 H ALA 7 9.314 -18.392 -1.576 39 HA ALA 7 HA ALA 7 10.173 -16.925 0.683 40 1HB ALA 7 1HB ALA 7 11.290 -17.710 -1.884 41 2HB ALA 7 2HB ALA 7 11.829 -16.116 -1.357 42 3HB ALA 7 3HB ALA 7 12.080 -17.518 -0.319 43 H ARG 8 H ARG 8 8.546 -16.091 -2.230 44 HA ARG 8 HA ARG 8 8.796 -13.234 -1.723 45 1HB ARG 8 1HB ARG 8 8.025 -14.911 -3.990 46 2HB ARG 8 2HB ARG 8 6.973 -13.517 -3.773 47 1HG ARG 8 1HG ARG 8 8.877 -12.025 -3.885 48 2HG ARG 8 2HG ARG 8 9.974 -13.403 -3.992 49 1HD ARG 8 1HD ARG 8 7.782 -13.101 -6.000 50 2HD ARG 8 2HD ARG 8 9.247 -12.133 -6.153 51 HE ARG 8 HE ARG 8 10.341 -14.509 -5.912 52 1HH1 ARG 8 2HH1 ARG 8 7.552 -13.557 -7.806 53 2HH1 ARG 8 1HH1 ARG 8 7.767 -14.814 -8.985 54 1HH2 ARG 8 2HH2 ARG 8 10.615 -16.167 -7.468 55 2HH2 ARG 8 1HH2 ARG 8 9.497 -16.301 -8.791 56 H ALA 9 H ALA 9 6.393 -15.807 -1.661 57 HA ALA 9 HA ALA 9 4.102 -14.268 -1.223 58 1HB ALA 9 1HB ALA 9 4.856 -17.067 -1.003 59 2HB ALA 9 2HB ALA 9 3.615 -16.592 0.156 60 3HB ALA 9 3HB ALA 9 3.351 -16.341 -1.570 61 H ALA 10 H ALA 10 6.589 -15.330 0.989 62 HA ALA 10 HA ALA 10 5.217 -14.868 3.411 63 1HB ALA 10 1HB ALA 10 7.183 -15.381 4.453 64 2HB ALA 10 2HB ALA 10 7.501 -16.073 2.860 65 3HB ALA 10 3HB ALA 10 8.161 -14.495 3.283 66 H ALA 11 H ALA 11 6.721 -12.698 1.164 67 HA ALA 11 HA ALA 11 6.525 -10.507 3.126 68 1HB ALA 11 1HB ALA 11 7.982 -10.360 0.499 69 2HB ALA 11 2HB ALA 11 8.161 -9.319 1.912 70 3HB ALA 11 3HB ALA 11 8.742 -10.984 1.962 71 H LYS 12 H LYS 12 5.065 -11.862 0.417 72 HA LYS 12 HA LYS 12 4.055 -9.459 -0.761 73 1HB LYS 12 1HB LYS 12 4.419 -11.727 -1.896 74 2HB LYS 12 2HB LYS 12 2.893 -12.199 -1.155 75 1HG LYS 12 1HG LYS 12 2.150 -9.881 -2.287 76 2HG LYS 12 2HG LYS 12 3.421 -10.377 -3.410 77 1HD LYS 12 1HD LYS 12 2.332 -12.529 -3.706 78 2HD LYS 12 2HD LYS 12 1.078 -12.069 -2.556 79 1HE LYS 12 2HE LYS 12 0.787 -10.026 -4.184 80 2HE LYS 12 1HE LYS 12 1.536 -11.123 -5.346 81 1HZ LYS 12 1HZ LYS 12 -0.202 -12.759 -4.792 82 2HZ LYS 12 2HZ LYS 12 -0.836 -11.337 -5.459 83 3HZ LYS 12 3HZ LYS 12 -0.945 -11.610 -3.786 84 H THR 13 H THR 13 2.764 -11.939 1.395 85 HA THR 13 HA THR 13 0.132 -11.453 1.536 86 HB THR 13 HB THR 13 0.878 -11.663 4.236 87 HG1 THR 13 1HG THR 13 2.498 -13.435 2.724 88 1HG2 THR 13 1HG2 THR 13 -0.471 -13.427 4.042 89 2HG2 THR 13 2HG2 THR 13 0.626 -14.216 2.906 90 3HG2 THR 13 3HG2 THR 13 -0.581 -13.070 2.320 91 H ALA 14 H ALA 14 2.561 -9.520 3.314 92 HA ALA 14 HA ALA 14 0.707 -7.898 4.670 93 1HB ALA 14 1HB ALA 14 2.717 -6.276 4.746 94 2HB ALA 14 2HB ALA 14 2.856 -7.841 5.546 95 3HB ALA 14 3HB ALA 14 3.602 -7.587 3.968 96 H ALA 15 H ALA 15 2.524 -7.314 1.666 97 HA ALA 15 HA ALA 15 1.350 -4.780 1.151 98 1HB ALA 15 1HB ALA 15 3.356 -6.422 0.000 99 2HB ALA 15 2HB ALA 15 2.223 -5.970 -1.273 100 3HB ALA 15 3HB ALA 15 3.014 -4.720 -0.315 101 H ASP 16 H ASP 16 0.439 -8.052 0.481 102 HA ASP 16 HA ASP 16 -1.420 -7.558 -1.611 103 1HB ASP 16 1HB ASP 16 -0.337 -9.806 -0.394 104 2HB ASP 16 2HB ASP 16 -2.026 -9.851 0.105 105 H ALA 17 H ALA 17 -1.675 -7.901 1.891 106 HA ALA 17 HA ALA 17 -4.491 -7.517 2.011 107 1HB ALA 17 1HB ALA 17 -2.805 -6.799 4.340 108 2HB ALA 17 2HB ALA 17 -4.278 -7.762 4.266 109 3HB ALA 17 3HB ALA 17 -2.736 -8.465 3.773 110 H LEU 18 H LEU 18 -1.688 -5.400 2.234 111 HA LEU 18 HA LEU 18 -3.002 -3.050 3.044 112 1HB LEU 18 1HB LEU 18 -0.477 -3.518 1.469 113 2HB LEU 18 2HB LEU 18 -1.031 -1.908 1.885 114 HG LEU 18 HG LEU 18 -0.056 -4.076 3.721 115 1HD1 LEU 18 1HD1 LEU 18 1.730 -2.777 3.045 116 2HD1 LEU 18 2HD1 LEU 18 0.763 -1.303 2.976 117 3HD1 LEU 18 3HD1 LEU 18 1.230 -1.977 4.538 118 1HD2 LEU 18 1HD2 LEU 18 -1.248 -1.515 4.726 119 2HD2 LEU 18 2HD2 LEU 18 -2.250 -2.947 4.491 120 3HD2 LEU 18 3HD2 LEU 18 -0.887 -2.996 5.612 121 H ALA 19 H ALA 19 -2.091 -4.151 -0.212 122 HA ALA 19 HA ALA 19 -3.165 -2.090 -1.699 123 1HB ALA 19 1HB ALA 19 -3.688 -4.333 -3.233 124 2HB ALA 19 2HB ALA 19 -2.200 -3.387 -3.221 125 3HB ALA 19 3HB ALA 19 -2.340 -4.817 -2.200 126 H ALA 20 H ALA 20 -4.826 -4.956 -0.432 127 HA ALA 20 HA ALA 20 -7.327 -4.370 -1.659 128 1HB ALA 20 1HB ALA 20 -8.185 -6.182 -0.459 129 2HB ALA 20 2HB ALA 20 -6.495 -6.607 -0.728 130 3HB ALA 20 3HB ALA 20 -7.012 -5.994 0.844 131 H ALA 21 H ALA 21 -5.961 -3.744 1.549 132 HA ALA 21 HA ALA 21 -8.269 -2.625 2.708 133 1HB ALA 21 1HB ALA 21 -6.560 -3.273 4.181 134 2HB ALA 21 2HB ALA 21 -5.341 -2.338 3.316 135 3HB ALA 21 3HB ALA 21 -6.581 -1.512 4.258 136 H LYS 22 H LYS 22 -5.594 -1.165 0.910 137 HA LYS 22 HA LYS 22 -6.460 1.522 1.318 138 1HB LYS 22 1HB LYS 22 -4.359 0.150 -0.229 139 2HB LYS 22 2HB LYS 22 -4.929 1.660 -0.929 140 1HG LYS 22 1HG LYS 22 -3.231 2.434 0.377 141 2HG LYS 22 2HG LYS 22 -4.574 2.549 1.521 142 1HD LYS 22 1HD LYS 22 -3.948 0.388 2.476 143 2HD LYS 22 2HD LYS 22 -2.613 0.260 1.331 144 1HE LYS 22 2HE LYS 22 -2.753 2.698 3.017 145 2HE LYS 22 1HE LYS 22 -2.282 1.188 3.797 146 1HZ LYS 22 1HZ LYS 22 -0.845 2.805 1.866 147 2HZ LYS 22 2HZ LYS 22 -0.755 1.130 1.618 148 3HZ LYS 22 3HZ LYS 22 -0.250 1.796 3.093 149 H LYS 23 H LYS 23 -6.785 -0.834 -1.270 150 HA LYS 23 HA LYS 23 -8.223 0.630 -3.139 151 1HB LYS 23 1HB LYS 23 -7.470 -1.998 -2.867 152 2HB LYS 23 2HB LYS 23 -9.217 -2.102 -2.725 153 1HG LYS 23 1HG LYS 23 -7.608 -1.057 -5.025 154 2HG LYS 23 2HG LYS 23 -8.692 -2.446 -4.984 155 1HD LYS 23 1HD LYS 23 -10.233 -0.234 -4.196 156 2HD LYS 23 2HD LYS 23 -9.278 0.304 -5.581 157 1HE LYS 23 2HE LYS 23 -10.052 -1.704 -6.822 158 2HE LYS 23 1HE LYS 23 -11.092 -2.104 -5.453 159 1HZ LYS 23 1HZ LYS 23 -12.109 -0.835 -7.403 160 2HZ LYS 23 2HZ LYS 23 -11.284 0.523 -6.808 161 3HZ LYS 23 3HZ LYS 23 -12.438 -0.260 -5.838 162 H THR 24 H THR 24 -9.531 -1.461 -0.587 163 HA THR 24 HA THR 24 -12.215 -0.866 -0.968 164 HB THR 24 HB THR 24 -10.575 -2.173 1.068 165 HG1 THR 24 1HG THR 24 -12.661 -3.478 0.982 166 1HG2 THR 24 1HG2 THR 24 -11.667 -0.588 2.550 167 2HG2 THR 24 2HG2 THR 24 -12.311 -2.212 2.799 168 3HG2 THR 24 3HG2 THR 24 -13.243 -1.024 1.885 169 H ALA 25 H ALA 25 -9.798 0.765 1.061 170 HA ALA 25 HA ALA 25 -11.538 2.549 2.355 171 1HB ALA 25 1HB ALA 25 -9.389 2.397 3.258 172 2HB ALA 25 2HB ALA 25 -8.613 2.660 1.695 173 3HB ALA 25 3HB ALA 25 -9.423 3.996 2.512 174 H ALA 26 H ALA 26 -9.565 3.021 -0.580 175 HA ALA 26 HA ALA 26 -10.621 5.555 -1.235 176 1HB ALA 26 1HB ALA 26 -8.790 3.675 -2.399 177 2HB ALA 26 2HB ALA 26 -9.871 4.316 -3.635 178 3HB ALA 26 3HB ALA 26 -8.911 5.416 -2.647 179 H ASP 27 H ASP 27 -11.617 2.287 -1.988 180 HA ASP 27 HA ASP 27 -13.596 2.802 -3.900 181 1HB ASP 27 1HB ASP 27 -12.608 0.549 -2.835 182 2HB ASP 27 2HB ASP 27 -14.096 0.656 -1.903 183 H ALA 28 H ALA 28 -13.724 2.798 -0.378 184 HA ALA 28 HA ALA 28 -16.473 3.231 -0.064 185 1HB ALA 28 1HB ALA 28 -14.581 2.749 1.687 186 2HB ALA 28 2HB ALA 28 -14.535 4.508 1.809 187 3HB ALA 28 3HB ALA 28 -16.031 3.639 2.152 188 H ALA 29 H ALA 29 -13.804 5.564 -0.330 189 HA ALA 29 HA ALA 29 -15.388 7.890 -0.229 190 1HB ALA 29 1HB ALA 29 -12.629 7.241 -1.113 191 2HB ALA 29 2HB ALA 29 -13.323 8.778 -1.631 192 3HB ALA 29 3HB ALA 29 -13.192 8.404 0.088 193 H ALA 30 H ALA 30 -14.500 5.751 -2.848 194 HA ALA 30 HA ALA 30 -15.507 7.440 -4.928 195 1HB ALA 30 1HB ALA 30 -14.216 6.061 -6.099 196 2HB ALA 30 2HB ALA 30 -14.097 4.941 -4.743 197 3HB ALA 30 3HB ALA 30 -15.438 4.809 -5.880 198 H ALA 31 H ALA 31 -16.963 5.423 -2.628 199 HA ALA 31 HA ALA 31 -19.293 4.822 -4.251 200 1HB ALA 31 1HB ALA 31 -18.107 3.641 -2.009 201 2HB ALA 31 2HB ALA 31 -19.659 4.270 -1.457 202 3HB ALA 31 3HB ALA 31 -19.594 3.149 -2.818 203 H ALA 32 H ALA 32 -18.205 7.490 -2.867 204 HA ALA 32 HA ALA 32 -20.635 8.387 -1.576 205 1HB ALA 32 1HB ALA 32 -17.897 9.243 -1.650 206 2HB ALA 32 2HB ALA 32 -18.965 10.592 -2.032 207 3HB ALA 32 3HB ALA 32 -19.178 9.697 -0.527 208 H ALA 33 H ALA 33 -21.845 7.870 -3.586 209 HA ALA 33 HA ALA 33 -21.552 9.509 -5.892 210 1HB ALA 33 1HB ALA 33 -23.138 7.292 -5.102 211 2HB ALA 33 2HB ALA 33 -24.217 8.561 -5.680 212 3HB ALA 33 3HB ALA 33 -22.920 7.967 -6.718 213 H ALA 34 H ALA 34 -22.550 11.372 -6.450 214 HA ALA 34 HA ALA 34 -23.605 13.360 -6.266 215 1HB ALA 34 1HB ALA 34 -25.259 12.195 -4.035 216 2HB ALA 34 2HB ALA 34 -25.640 13.582 -5.053 217 3HB ALA 34 3HB ALA 34 -25.612 11.962 -5.748 218 H ALA 35 H ALA 35 -21.280 12.533 -4.584 219 HA ALA 35 HA ALA 35 -21.487 14.714 -2.616 220 1HB ALA 35 1HB ALA 35 -19.372 13.372 -1.694 221 2HB ALA 35 2HB ALA 35 -21.024 13.004 -1.199 222 3HB ALA 35 3HB ALA 35 -20.239 12.032 -2.445 Start of MODEL 3 1 1H GLY 1 1H GLY 1 25.635 -8.372 2.090 2 2H GLY 1 2H GLY 1 24.229 -8.045 1.199 3 3H GLY 1 3H GLY 1 24.489 -9.595 1.834 4 1HA GLY 1 2HA GLY 1 24.522 -8.469 4.105 5 2HA GLY 1 1HA GLY 1 23.784 -7.111 3.267 6 H SER 2 H SER 2 22.269 -8.036 5.182 7 HA SER 2 HA SER 2 20.578 -10.210 4.516 8 1HB SER 2 1HB SER 2 19.327 -8.160 6.173 9 2HB SER 2 2HB SER 2 19.749 -9.828 6.573 10 HG SER 2 HG SER 2 21.670 -9.203 7.303 11 H MET 3 H MET 3 19.821 -10.016 2.446 12 HA MET 3 HA MET 3 17.592 -8.245 2.028 13 1HB MET 3 1HB MET 3 20.099 -7.283 1.271 14 2HB MET 3 2HB MET 3 19.400 -7.891 -0.223 15 1HG MET 3 1HG MET 3 17.809 -6.294 -0.298 16 2HG MET 3 2HG MET 3 17.638 -6.224 1.455 17 1HE MET 3 1HE MET 3 18.701 -4.064 2.857 18 2HE MET 3 2HE MET 3 19.702 -5.518 2.902 19 3HE MET 3 3HE MET 3 20.445 -3.942 2.624 20 H ASN 4 H ASN 4 17.837 -11.004 2.144 21 HA ASN 4 HA ASN 4 18.025 -12.123 -0.487 22 1HB ASN 4 1HB ASN 4 18.418 -13.243 1.860 23 2HB ASN 4 2HB ASN 4 16.690 -13.567 1.769 24 1HD2 ASN 4 1HD2 ASN 4 18.157 -15.718 1.916 25 2HD2 ASN 4 2HD2 ASN 4 18.322 -16.508 0.382 26 H ALA 5 H ALA 5 16.385 -12.988 -1.735 27 HA ALA 5 HA ALA 5 14.085 -11.398 -1.941 28 1HB ALA 5 1HB ALA 5 13.942 -12.300 -3.956 29 2HB ALA 5 2HB ALA 5 15.381 -13.234 -3.551 30 3HB ALA 5 3HB ALA 5 13.781 -13.926 -3.295 31 HA PRO 6 HA PRO 6 11.667 -15.432 -0.229 32 1HB PRO 6 1HB PRO 6 13.825 -16.044 1.744 33 2HB PRO 6 2HB PRO 6 12.650 -17.130 0.995 34 1HG PRO 6 1HG PRO 6 15.148 -17.083 0.133 35 2HG PRO 6 2HG PRO 6 13.803 -17.194 -1.021 36 1HD PRO 6 1HD PRO 6 15.541 -14.867 -0.346 37 2HD PRO 6 2HD PRO 6 14.812 -15.325 -1.895 38 H ALA 7 H ALA 7 13.881 -13.500 1.756 39 HA ALA 7 HA ALA 7 12.212 -13.238 3.996 40 1HB ALA 7 1HB ALA 7 13.628 -11.304 4.591 41 2HB ALA 7 2HB ALA 7 14.568 -12.730 4.145 42 3HB ALA 7 3HB ALA 7 14.380 -11.401 2.999 43 H ARG 8 H ARG 8 12.358 -11.528 0.999 44 HA ARG 8 HA ARG 8 10.506 -9.467 1.868 45 1HB ARG 8 1HB ARG 8 11.384 -9.980 -0.967 46 2HB ARG 8 2HB ARG 8 10.807 -8.475 -0.263 47 1HG ARG 8 1HG ARG 8 13.326 -9.738 0.734 48 2HG ARG 8 2HG ARG 8 13.326 -8.780 -0.748 49 1HD ARG 8 1HD ARG 8 11.935 -7.175 0.965 50 2HD ARG 8 2HD ARG 8 13.102 -7.935 2.046 51 HE ARG 8 HE ARG 8 14.439 -7.044 -0.262 52 1HH1 ARG 8 2HH1 ARG 8 12.849 -5.769 2.589 53 2HH1 ARG 8 1HH1 ARG 8 13.799 -4.314 2.624 54 1HH2 ARG 8 2HH2 ARG 8 15.651 -5.109 -0.255 55 2HH2 ARG 8 1HH2 ARG 8 15.403 -3.940 1.014 56 H ALA 9 H ALA 9 10.533 -12.395 -0.060 57 HA ALA 9 HA ALA 9 7.945 -12.201 -1.155 58 1HB ALA 9 1HB ALA 9 8.129 -14.605 -1.550 59 2HB ALA 9 2HB ALA 9 9.606 -13.761 -2.007 60 3HB ALA 9 3HB ALA 9 9.542 -14.672 -0.499 61 H ALA 10 H ALA 10 9.086 -13.233 1.975 62 HA ALA 10 HA ALA 10 6.725 -14.471 2.892 63 1HB ALA 10 1HB ALA 10 7.928 -14.781 4.743 64 2HB ALA 10 2HB ALA 10 9.247 -13.944 3.926 65 3HB ALA 10 3HB ALA 10 8.149 -13.047 4.973 66 H ALA 11 H ALA 11 7.683 -11.130 2.576 67 HA ALA 11 HA ALA 11 5.467 -10.182 4.206 68 1HB ALA 11 1HB ALA 11 8.004 -9.200 3.659 69 2HB ALA 11 2HB ALA 11 6.916 -8.123 2.786 70 3HB ALA 11 3HB ALA 11 6.711 -8.364 4.521 71 H LYS 12 H LYS 12 5.527 -11.427 1.288 72 HA LYS 12 HA LYS 12 4.394 -9.571 -0.469 73 1HB LYS 12 1HB LYS 12 5.094 -12.184 -0.643 74 2HB LYS 12 2HB LYS 12 3.340 -12.315 -0.627 75 1HG LYS 12 1HG LYS 12 4.004 -10.232 -2.409 76 2HG LYS 12 2HG LYS 12 5.061 -11.601 -2.771 77 1HD LYS 12 1HD LYS 12 3.380 -12.555 -3.847 78 2HD LYS 12 2HD LYS 12 2.506 -12.675 -2.322 79 1HE LYS 12 2HE LYS 12 1.773 -10.273 -2.763 80 2HE LYS 12 1HE LYS 12 2.357 -10.517 -4.407 81 1HZ LYS 12 1HZ LYS 12 0.813 -12.699 -3.969 82 2HZ LYS 12 2HZ LYS 12 0.324 -11.305 -4.800 83 3HZ LYS 12 3HZ LYS 12 -0.041 -11.484 -3.150 84 H THR 13 H THR 13 2.960 -11.514 2.068 85 HA THR 13 HA THR 13 0.251 -11.081 1.355 86 HB THR 13 HB THR 13 0.715 -11.635 4.170 87 HG1 THR 13 1HG THR 13 2.256 -13.080 4.011 88 1HG2 THR 13 1HG2 THR 13 -0.457 -13.794 3.387 89 2HG2 THR 13 2HG2 THR 13 -0.617 -12.965 1.840 90 3HG2 THR 13 3HG2 THR 13 -1.346 -12.274 3.290 91 H ALA 14 H ALA 14 2.583 -9.361 3.265 92 HA ALA 14 HA ALA 14 0.809 -7.753 4.771 93 1HB ALA 14 1HB ALA 14 2.680 -6.902 5.656 94 2HB ALA 14 2HB ALA 14 3.541 -8.091 4.676 95 3HB ALA 14 3HB ALA 14 3.319 -6.447 4.074 96 H ALA 15 H ALA 15 2.667 -7.035 1.813 97 HA ALA 15 HA ALA 15 1.345 -4.586 1.279 98 1HB ALA 15 1HB ALA 15 3.284 -4.610 0.108 99 2HB ALA 15 2HB ALA 15 3.226 -6.354 -0.161 100 3HB ALA 15 3HB ALA 15 2.245 -5.274 -1.154 101 H ASP 16 H ASP 16 0.595 -7.899 0.638 102 HA ASP 16 HA ASP 16 -1.262 -7.532 -1.473 103 1HB ASP 16 1HB ASP 16 -0.148 -9.702 -0.103 104 2HB ASP 16 2HB ASP 16 -1.874 -9.788 0.246 105 H ALA 17 H ALA 17 -1.661 -7.968 2.020 106 HA ALA 17 HA ALA 17 -4.463 -7.618 2.063 107 1HB ALA 17 1HB ALA 17 -4.158 -8.240 4.173 108 2HB ALA 17 2HB ALA 17 -2.413 -8.114 3.948 109 3HB ALA 17 3HB ALA 17 -3.331 -6.720 4.520 110 H LEU 18 H LEU 18 -1.772 -5.381 2.176 111 HA LEU 18 HA LEU 18 -3.256 -3.086 2.924 112 1HB LEU 18 1HB LEU 18 -0.624 -3.442 1.510 113 2HB LEU 18 2HB LEU 18 -1.284 -1.861 1.878 114 HG LEU 18 HG LEU 18 -0.580 -3.985 3.899 115 1HD1 LEU 18 1HD1 LEU 18 1.484 -3.206 3.806 116 2HD1 LEU 18 2HD1 LEU 18 1.017 -2.097 2.514 117 3HD1 LEU 18 3HD1 LEU 18 0.895 -1.590 4.200 118 1HD2 LEU 18 1HD2 LEU 18 -1.640 -2.798 5.448 119 2HD2 LEU 18 2HD2 LEU 18 -0.903 -1.293 4.896 120 3HD2 LEU 18 3HD2 LEU 18 -2.382 -1.882 4.137 121 H ALA 19 H ALA 19 -2.312 -4.440 -0.207 122 HA ALA 19 HA ALA 19 -3.228 -2.420 -1.877 123 1HB ALA 19 1HB ALA 19 -3.566 -5.291 -2.641 124 2HB ALA 19 2HB ALA 19 -3.039 -3.927 -3.625 125 3HB ALA 19 3HB ALA 19 -1.953 -4.616 -2.419 126 H ALA 20 H ALA 20 -4.972 -5.170 -0.503 127 HA ALA 20 HA ALA 20 -7.455 -4.585 -1.742 128 1HB ALA 20 1HB ALA 20 -7.359 -6.011 0.866 129 2HB ALA 20 2HB ALA 20 -8.282 -6.379 -0.590 130 3HB ALA 20 3HB ALA 20 -6.559 -6.748 -0.523 131 H ALA 21 H ALA 21 -6.152 -3.919 1.489 132 HA ALA 21 HA ALA 21 -8.425 -2.674 2.554 133 1HB ALA 21 1HB ALA 21 -5.511 -2.524 3.236 134 2HB ALA 21 2HB ALA 21 -6.715 -1.583 4.114 135 3HB ALA 21 3HB ALA 21 -6.810 -3.343 4.103 136 H LYS 22 H LYS 22 -5.642 -1.322 0.805 137 HA LYS 22 HA LYS 22 -6.449 1.384 1.170 138 1HB LYS 22 1HB LYS 22 -4.311 -0.047 -0.224 139 2HB LYS 22 2HB LYS 22 -4.859 1.387 -1.079 140 1HG LYS 22 1HG LYS 22 -3.374 2.448 0.202 141 2HG LYS 22 2HG LYS 22 -4.627 2.346 1.444 142 1HD LYS 22 1HD LYS 22 -3.602 0.513 2.480 143 2HD LYS 22 2HD LYS 22 -2.613 0.152 1.064 144 1HE LYS 22 2HE LYS 22 -2.244 2.806 2.321 145 2HE LYS 22 1HE LYS 22 -1.658 1.409 3.223 146 1HZ LYS 22 1HZ LYS 22 -0.691 0.872 0.804 147 2HZ LYS 22 2HZ LYS 22 0.168 1.751 1.972 148 3HZ LYS 22 3HZ LYS 22 -0.672 2.566 0.745 149 H LYS 23 H LYS 23 -7.041 -1.071 -1.255 150 HA LYS 23 HA LYS 23 -8.199 0.628 -3.208 151 1HB LYS 23 1HB LYS 23 -7.372 -1.818 -3.435 152 2HB LYS 23 2HB LYS 23 -8.970 -2.253 -2.845 153 1HG LYS 23 1HG LYS 23 -9.912 -0.874 -4.735 154 2HG LYS 23 2HG LYS 23 -8.269 -0.791 -5.373 155 1HD LYS 23 1HD LYS 23 -8.925 -2.652 -6.479 156 2HD LYS 23 2HD LYS 23 -8.462 -3.439 -4.969 157 1HE LYS 23 2HE LYS 23 -10.529 -4.254 -4.870 158 2HE LYS 23 1HE LYS 23 -11.072 -2.612 -4.533 159 1HZ LYS 23 1HZ LYS 23 -11.866 -4.125 -6.634 160 2HZ LYS 23 2HZ LYS 23 -10.684 -3.136 -7.340 161 3HZ LYS 23 3HZ LYS 23 -12.008 -2.438 -6.538 162 H THR 24 H THR 24 -9.578 -1.372 -0.633 163 HA THR 24 HA THR 24 -12.259 -0.774 -1.169 164 HB THR 24 HB THR 24 -10.743 -1.921 1.120 165 HG1 THR 24 1HG THR 24 -12.600 -3.523 0.532 166 1HG2 THR 24 1HG2 THR 24 -13.414 -0.705 1.260 167 2HG2 THR 24 2HG2 THR 24 -12.239 -1.020 2.535 168 3HG2 THR 24 3HG2 THR 24 -13.267 -2.324 1.943 169 H ALA 25 H ALA 25 -9.885 0.704 1.017 170 HA ALA 25 HA ALA 25 -11.545 2.615 2.205 171 1HB ALA 25 1HB ALA 25 -9.387 2.336 3.118 172 2HB ALA 25 2HB ALA 25 -8.604 2.647 1.571 173 3HB ALA 25 3HB ALA 25 -9.403 3.960 2.434 174 H ALA 26 H ALA 26 -9.591 2.826 -0.747 175 HA ALA 26 HA ALA 26 -10.367 5.418 -1.509 176 1HB ALA 26 1HB ALA 26 -9.732 4.585 -3.846 177 2HB ALA 26 2HB ALA 26 -8.484 4.566 -2.599 178 3HB ALA 26 3HB ALA 26 -9.307 3.072 -3.046 179 H ASP 27 H ASP 27 -11.790 2.262 -2.160 180 HA ASP 27 HA ASP 27 -13.762 3.055 -3.992 181 1HB ASP 27 1HB ASP 27 -13.021 0.678 -3.262 182 2HB ASP 27 2HB ASP 27 -14.205 0.865 -1.975 183 H ALA 28 H ALA 28 -13.983 2.597 -0.465 184 HA ALA 28 HA ALA 28 -16.650 3.391 -0.180 185 1HB ALA 28 1HB ALA 28 -14.319 3.275 1.693 186 2HB ALA 28 2HB ALA 28 -15.861 3.949 2.221 187 3HB ALA 28 3HB ALA 28 -15.776 2.282 1.654 188 H ALA 29 H ALA 29 -13.670 5.284 -0.153 189 HA ALA 29 HA ALA 29 -14.912 7.728 0.619 190 1HB ALA 29 1HB ALA 29 -12.344 6.880 0.479 191 2HB ALA 29 2HB ALA 29 -12.433 7.916 -0.946 192 3HB ALA 29 3HB ALA 29 -12.829 8.568 0.645 193 H ALA 30 H ALA 30 -14.334 6.139 -2.445 194 HA ALA 30 HA ALA 30 -14.736 8.406 -4.110 195 1HB ALA 30 1HB ALA 30 -13.927 5.791 -4.489 196 2HB ALA 30 2HB ALA 30 -15.463 5.889 -5.349 197 3HB ALA 30 3HB ALA 30 -14.159 7.008 -5.744 198 H ALA 31 H ALA 31 -16.868 6.020 -2.696 199 HA ALA 31 HA ALA 31 -19.148 7.044 -4.208 200 1HB ALA 31 1HB ALA 31 -18.530 4.564 -2.772 201 2HB ALA 31 2HB ALA 31 -20.178 5.149 -2.543 202 3HB ALA 31 3HB ALA 31 -19.573 4.838 -4.168 203 H ALA 32 H ALA 32 -17.589 8.229 -1.753 204 HA ALA 32 HA ALA 32 -19.809 8.590 0.104 205 1HB ALA 32 1HB ALA 32 -18.272 9.101 1.682 206 2HB ALA 32 2HB ALA 32 -17.176 8.273 0.577 207 3HB ALA 32 3HB ALA 32 -17.275 10.033 0.563 208 H ALA 33 H ALA 33 -20.761 9.695 -1.989 209 HA ALA 33 HA ALA 33 -19.934 12.389 -2.465 210 1HB ALA 33 1HB ALA 33 -21.670 10.543 -3.689 211 2HB ALA 33 2HB ALA 33 -22.643 11.952 -3.266 212 3HB ALA 33 3HB ALA 33 -21.203 12.143 -4.267 213 H ALA 34 H ALA 34 -22.163 10.824 -0.300 214 HA ALA 34 HA ALA 34 -22.950 13.469 0.727 215 1HB ALA 34 1HB ALA 34 -25.065 12.559 1.402 216 2HB ALA 34 2HB ALA 34 -24.814 12.193 -0.305 217 3HB ALA 34 3HB ALA 34 -24.575 10.939 0.909 218 H ALA 35 H ALA 35 -20.798 13.035 1.826 219 HA ALA 35 HA ALA 35 -21.318 12.154 4.511 220 1HB ALA 35 1HB ALA 35 -18.889 10.825 3.688 221 2HB ALA 35 2HB ALA 35 -20.300 10.166 4.513 222 3HB ALA 35 3HB ALA 35 -20.269 10.254 2.752 Start of MODEL 4 1 1H GLY 1 1H GLY 1 -6.156 -27.104 10.970 2 2H GLY 1 2H GLY 1 -5.730 -25.718 10.088 3 3H GLY 1 3H GLY 1 -4.599 -26.452 11.113 4 1HA GLY 1 2HA GLY 1 -4.580 -28.433 9.728 5 2HA GLY 1 1HA GLY 1 -5.751 -27.664 8.663 6 H SER 2 H SER 2 -5.012 -25.341 8.020 7 HA SER 2 HA SER 2 -3.604 -24.027 6.834 8 1HB SER 2 1HB SER 2 -1.370 -25.246 8.464 9 2HB SER 2 2HB SER 2 -1.408 -23.648 7.717 10 HG SER 2 HG SER 2 -3.139 -23.121 9.150 11 H MET 3 H MET 3 -0.639 -25.116 6.527 12 HA MET 3 HA MET 3 0.561 -26.132 4.905 13 1HB MET 3 1HB MET 3 -1.191 -28.082 5.868 14 2HB MET 3 2HB MET 3 -1.315 -28.201 4.118 15 1HG MET 3 1HG MET 3 0.467 -29.580 5.439 16 2HG MET 3 2HG MET 3 0.848 -28.881 3.867 17 1HE MET 3 1HE MET 3 1.776 -27.463 7.982 18 2HE MET 3 2HE MET 3 1.050 -28.980 7.445 19 3HE MET 3 3HE MET 3 2.803 -28.845 7.593 20 H ASN 4 H ASN 4 -1.051 -23.989 4.166 21 HA ASN 4 HA ASN 4 -1.827 -24.705 1.420 22 1HB ASN 4 1HB ASN 4 -2.930 -22.214 1.855 23 2HB ASN 4 2HB ASN 4 -3.794 -23.740 1.941 24 1HD2 ASN 4 1HD2 ASN 4 -5.168 -23.532 3.554 25 2HD2 ASN 4 2HD2 ASN 4 -4.773 -23.006 5.162 26 H ALA 5 H ALA 5 -1.177 -23.383 -0.268 27 HA ALA 5 HA ALA 5 1.420 -22.401 -0.128 28 1HB ALA 5 1HB ALA 5 -0.566 -21.587 -2.229 29 2HB ALA 5 2HB ALA 5 1.184 -21.742 -2.381 30 3HB ALA 5 3HB ALA 5 0.185 -23.183 -2.170 31 HA PRO 6 HA PRO 6 -0.651 -17.827 -0.252 32 1HB PRO 6 1HB PRO 6 -2.813 -18.690 1.626 33 2HB PRO 6 2HB PRO 6 -2.802 -17.369 0.457 34 1HG PRO 6 1HG PRO 6 -4.053 -19.620 -0.124 35 2HG PRO 6 2HG PRO 6 -3.075 -18.801 -1.360 36 1HD PRO 6 1HD PRO 6 -2.469 -21.261 0.206 37 2HD PRO 6 2HD PRO 6 -2.020 -20.837 -1.451 38 H ALA 7 H ALA 7 -0.723 -20.047 2.496 39 HA ALA 7 HA ALA 7 -0.135 -18.126 4.478 40 1HB ALA 7 1HB ALA 7 -0.627 -20.920 4.388 41 2HB ALA 7 2HB ALA 7 0.846 -20.641 5.315 42 3HB ALA 7 3HB ALA 7 -0.652 -19.841 5.784 43 H ARG 8 H ARG 8 1.846 -20.121 2.445 44 HA ARG 8 HA ARG 8 4.314 -19.419 3.765 45 1HB ARG 8 1HB ARG 8 3.731 -20.855 1.172 46 2HB ARG 8 2HB ARG 8 5.359 -20.546 1.759 47 1HG ARG 8 1HG ARG 8 4.778 -21.808 3.826 48 2HG ARG 8 2HG ARG 8 3.245 -22.242 3.064 49 1HD ARG 8 1HD ARG 8 5.974 -22.840 1.924 50 2HD ARG 8 2HD ARG 8 4.984 -23.987 2.826 51 HE ARG 8 HE ARG 8 3.409 -23.989 1.026 52 1HH1 ARG 8 2HH1 ARG 8 6.422 -22.316 0.335 53 2HH1 ARG 8 1HH1 ARG 8 6.207 -22.385 -1.393 54 1HH2 ARG 8 2HH2 ARG 8 3.131 -24.067 -1.248 55 2HH2 ARG 8 1HH2 ARG 8 4.362 -23.410 -2.284 56 H ALA 9 H ALA 9 2.317 -18.141 1.310 57 HA ALA 9 HA ALA 9 4.402 -16.411 0.233 58 1HB ALA 9 1HB ALA 9 3.164 -16.889 -1.583 59 2HB ALA 9 2HB ALA 9 1.733 -17.286 -0.629 60 3HB ALA 9 3HB ALA 9 2.115 -15.602 -0.989 61 H ALA 10 H ALA 10 3.218 -16.281 3.019 62 HA ALA 10 HA ALA 10 1.504 -14.138 3.383 63 1HB ALA 10 1HB ALA 10 2.998 -15.856 5.009 64 2HB ALA 10 2HB ALA 10 3.439 -14.221 5.500 65 3HB ALA 10 3HB ALA 10 1.748 -14.718 5.511 66 H ALA 11 H ALA 11 4.911 -14.091 2.631 67 HA ALA 11 HA ALA 11 5.568 -11.481 3.381 68 1HB ALA 11 1HB ALA 11 6.792 -13.552 1.957 69 2HB ALA 11 2HB ALA 11 6.771 -12.174 0.859 70 3HB ALA 11 3HB ALA 11 7.516 -12.021 2.450 71 H LYS 12 H LYS 12 3.982 -12.739 0.493 72 HA LYS 12 HA LYS 12 3.785 -10.143 -0.751 73 1HB LYS 12 1HB LYS 12 3.834 -12.599 -1.793 74 2HB LYS 12 2HB LYS 12 2.090 -12.435 -1.625 75 1HG LYS 12 1HG LYS 12 3.317 -10.094 -2.826 76 2HG LYS 12 2HG LYS 12 3.620 -11.572 -3.743 77 1HD LYS 12 1HD LYS 12 1.342 -11.971 -4.078 78 2HD LYS 12 2HD LYS 12 0.867 -10.877 -2.777 79 1HE LYS 12 2HE LYS 12 1.997 -9.059 -4.249 80 2HE LYS 12 1HE LYS 12 1.802 -10.238 -5.544 81 1HZ LYS 12 1HZ LYS 12 -0.341 -9.745 -5.710 82 2HZ LYS 12 2HZ LYS 12 -0.089 -8.453 -4.638 83 3HZ LYS 12 3HZ LYS 12 -0.601 -9.957 -4.046 84 H THR 13 H THR 13 1.641 -12.398 0.939 85 HA THR 13 HA THR 13 -0.761 -11.025 0.589 86 HB THR 13 HB THR 13 -0.260 -12.526 3.123 87 HG1 THR 13 1HG THR 13 -0.114 -14.441 2.037 88 1HG2 THR 13 1HG2 THR 13 -2.495 -12.866 1.140 89 2HG2 THR 13 2HG2 THR 13 -2.504 -11.554 2.315 90 3HG2 THR 13 3HG2 THR 13 -2.483 -13.226 2.868 91 H ALA 14 H ALA 14 1.898 -10.319 2.688 92 HA ALA 14 HA ALA 14 0.541 -8.699 4.572 93 1HB ALA 14 1HB ALA 14 3.375 -8.250 3.676 94 2HB ALA 14 2HB ALA 14 2.658 -7.933 5.256 95 3HB ALA 14 3HB ALA 14 2.919 -9.593 4.724 96 H ALA 15 H ALA 15 2.501 -7.749 1.754 97 HA ALA 15 HA ALA 15 1.624 -5.060 1.725 98 1HB ALA 15 1HB ALA 15 3.610 -6.411 0.481 99 2HB ALA 15 2HB ALA 15 2.465 -6.209 -0.847 100 3HB ALA 15 3HB ALA 15 3.067 -4.796 0.021 101 H ASP 16 H ASP 16 0.345 -8.001 0.417 102 HA ASP 16 HA ASP 16 -1.432 -6.907 -1.493 103 1HB ASP 16 1HB ASP 16 -0.694 -9.455 -0.703 104 2HB ASP 16 2HB ASP 16 -2.381 -9.351 -0.210 105 H ALA 17 H ALA 17 -1.729 -7.650 1.943 106 HA ALA 17 HA ALA 17 -4.487 -7.099 2.183 107 1HB ALA 17 1HB ALA 17 -4.178 -7.663 4.319 108 2HB ALA 17 2HB ALA 17 -2.506 -8.005 3.875 109 3HB ALA 17 3HB ALA 17 -2.937 -6.433 4.550 110 H LEU 18 H LEU 18 -1.615 -5.103 2.296 111 HA LEU 18 HA LEU 18 -2.889 -2.718 3.157 112 1HB LEU 18 1HB LEU 18 -0.346 -3.183 1.599 113 2HB LEU 18 2HB LEU 18 -0.864 -1.605 2.158 114 HG LEU 18 HG LEU 18 0.142 -3.933 3.754 115 1HD1 LEU 18 1HD1 LEU 18 1.831 -2.416 3.170 116 2HD1 LEU 18 2HD1 LEU 18 0.797 -1.017 3.464 117 3HD1 LEU 18 3HD1 LEU 18 1.389 -1.975 4.821 118 1HD2 LEU 18 1HD2 LEU 18 -0.561 -2.206 5.694 119 2HD2 LEU 18 2HD2 LEU 18 -1.893 -1.950 4.566 120 3HD2 LEU 18 3HD2 LEU 18 -1.567 -3.566 5.193 121 H ALA 19 H ALA 19 -2.030 -4.016 -0.028 122 HA ALA 19 HA ALA 19 -3.003 -1.944 -1.609 123 1HB ALA 19 1HB ALA 19 -3.254 -4.825 -2.406 124 2HB ALA 19 2HB ALA 19 -2.897 -3.423 -3.415 125 3HB ALA 19 3HB ALA 19 -1.683 -4.033 -2.291 126 H ALA 20 H ALA 20 -4.678 -4.811 -0.366 127 HA ALA 20 HA ALA 20 -7.200 -4.220 -1.476 128 1HB ALA 20 1HB ALA 20 -7.161 -6.387 -0.790 129 2HB ALA 20 2HB ALA 20 -6.184 -6.035 0.638 130 3HB ALA 20 3HB ALA 20 -7.910 -5.672 0.637 131 H ALA 21 H ALA 21 -5.758 -3.449 1.665 132 HA ALA 21 HA ALA 21 -8.018 -2.259 2.835 133 1HB ALA 21 1HB ALA 21 -5.914 -2.973 4.009 134 2HB ALA 21 2HB ALA 21 -5.156 -1.505 3.391 135 3HB ALA 21 3HB ALA 21 -6.538 -1.389 4.482 136 H LYS 22 H LYS 22 -5.385 -0.851 0.895 137 HA LYS 22 HA LYS 22 -6.340 1.815 1.247 138 1HB LYS 22 1HB LYS 22 -4.100 0.492 -0.115 139 2HB LYS 22 2HB LYS 22 -4.688 1.942 -0.920 140 1HG LYS 22 1HG LYS 22 -3.084 2.805 0.475 141 2HG LYS 22 2HG LYS 22 -4.542 2.983 1.454 142 1HD LYS 22 1HD LYS 22 -3.895 1.419 2.956 143 2HD LYS 22 2HD LYS 22 -3.094 0.428 1.737 144 1HE LYS 22 2HE LYS 22 -1.616 1.544 3.488 145 2HE LYS 22 1HE LYS 22 -1.146 1.724 1.799 146 1HZ LYS 22 1HZ LYS 22 -2.129 3.922 1.777 147 2HZ LYS 22 2HZ LYS 22 -0.981 3.813 3.017 148 3HZ LYS 22 3HZ LYS 22 -2.633 3.751 3.386 149 H LYS 23 H LYS 23 -6.645 -0.690 -1.200 150 HA LYS 23 HA LYS 23 -8.062 0.824 -3.106 151 1HB LYS 23 1HB LYS 23 -7.102 -1.520 -3.390 152 2HB LYS 23 2HB LYS 23 -8.520 -2.101 -2.530 153 1HG LYS 23 1HG LYS 23 -9.423 -0.384 -4.589 154 2HG LYS 23 2HG LYS 23 -8.240 -1.490 -5.289 155 1HD LYS 23 1HD LYS 23 -10.027 -2.859 -5.473 156 2HD LYS 23 2HD LYS 23 -9.671 -3.207 -3.779 157 1HE LYS 23 2HE LYS 23 -11.931 -2.733 -3.714 158 2HE LYS 23 1HE LYS 23 -11.209 -1.181 -3.294 159 1HZ LYS 23 1HZ LYS 23 -11.613 -0.353 -5.448 160 2HZ LYS 23 2HZ LYS 23 -13.053 -1.121 -4.984 161 3HZ LYS 23 3HZ LYS 23 -11.992 -1.887 -6.069 162 H THR 24 H THR 24 -9.129 -1.171 -0.395 163 HA THR 24 HA THR 24 -11.878 -0.803 -0.700 164 HB THR 24 HB THR 24 -10.092 -1.940 1.273 165 HG1 THR 24 1HG THR 24 -12.848 -2.334 0.624 166 1HG2 THR 24 1HG2 THR 24 -10.696 -0.532 2.976 167 2HG2 THR 24 2HG2 THR 24 -11.982 -1.735 3.097 168 3HG2 THR 24 3HG2 THR 24 -12.286 -0.196 2.289 169 H ALA 25 H ALA 25 -9.451 1.166 0.958 170 HA ALA 25 HA ALA 25 -11.152 3.022 2.163 171 1HB ALA 25 1HB ALA 25 -8.354 3.228 1.103 172 2HB ALA 25 2HB ALA 25 -9.165 4.607 1.838 173 3HB ALA 25 3HB ALA 25 -8.900 3.140 2.778 174 H ALA 26 H ALA 26 -9.587 3.190 -1.031 175 HA ALA 26 HA ALA 26 -10.920 5.537 -1.882 176 1HB ALA 26 1HB ALA 26 -10.335 4.247 -4.211 177 2HB ALA 26 2HB ALA 26 -9.209 5.256 -3.305 178 3HB ALA 26 3HB ALA 26 -9.191 3.506 -3.091 179 H ASP 27 H ASP 27 -11.629 2.125 -2.192 180 HA ASP 27 HA ASP 27 -13.850 2.186 -3.870 181 1HB ASP 27 1HB ASP 27 -12.604 0.168 -2.977 182 2HB ASP 27 2HB ASP 27 -13.510 0.364 -1.486 183 H ALA 28 H ALA 28 -13.718 2.315 -0.329 184 HA ALA 28 HA ALA 28 -16.491 2.600 0.090 185 1HB ALA 28 1HB ALA 28 -14.501 3.765 1.988 186 2HB ALA 28 2HB ALA 28 -15.988 2.880 2.325 187 3HB ALA 28 3HB ALA 28 -14.561 2.019 1.744 188 H ALA 29 H ALA 29 -13.965 4.915 -0.611 189 HA ALA 29 HA ALA 29 -15.588 7.228 -0.091 190 1HB ALA 29 1HB ALA 29 -13.702 8.402 -0.413 191 2HB ALA 29 2HB ALA 29 -12.903 6.830 -0.385 192 3HB ALA 29 3HB ALA 29 -13.331 7.574 -1.926 193 H ALA 30 H ALA 30 -14.900 5.164 -2.806 194 HA ALA 30 HA ALA 30 -15.983 6.856 -4.831 195 1HB ALA 30 1HB ALA 30 -14.501 5.268 -5.649 196 2HB ALA 30 2HB ALA 30 -15.214 3.964 -4.701 197 3HB ALA 30 3HB ALA 30 -16.072 4.606 -6.102 198 H ALA 31 H ALA 31 -17.264 4.302 -2.774 199 HA ALA 31 HA ALA 31 -19.864 4.424 -4.066 200 1HB ALA 31 1HB ALA 31 -20.381 2.811 -2.057 201 2HB ALA 31 2HB ALA 31 -19.466 2.249 -3.457 202 3HB ALA 31 3HB ALA 31 -18.624 2.705 -1.976 203 H ALA 32 H ALA 32 -18.399 6.469 -2.128 204 HA ALA 32 HA ALA 32 -20.616 6.904 -0.272 205 1HB ALA 32 1HB ALA 32 -19.091 8.653 0.701 206 2HB ALA 32 2HB ALA 32 -18.504 6.992 0.807 207 3HB ALA 32 3HB ALA 32 -17.854 8.085 -0.419 208 H ALA 33 H ALA 33 -21.829 7.415 -2.348 209 HA ALA 33 HA ALA 33 -21.361 9.960 -3.584 210 1HB ALA 33 1HB ALA 33 -23.883 8.313 -3.686 211 2HB ALA 33 2HB ALA 33 -23.336 9.523 -4.846 212 3HB ALA 33 3HB ALA 33 -22.471 7.995 -4.695 213 H ALA 34 H ALA 34 -23.466 8.685 -1.090 214 HA ALA 34 HA ALA 34 -23.924 11.389 -0.113 215 1HB ALA 34 1HB ALA 34 -26.327 9.643 -0.214 216 2HB ALA 34 2HB ALA 34 -26.203 11.402 -0.276 217 3HB ALA 34 3HB ALA 34 -25.825 10.438 -1.704 218 H ALA 35 H ALA 35 -22.318 10.333 1.349 219 HA ALA 35 HA ALA 35 -23.292 8.230 3.085 220 1HB ALA 35 1HB ALA 35 -20.726 9.684 2.724 221 2HB ALA 35 2HB ALA 35 -21.038 8.925 4.285 222 3HB ALA 35 3HB ALA 35 -21.043 7.953 2.814 Start of MODEL 5 1 1H GLY 1 1H GLY 1 13.050 -15.674 -13.322 2 2H GLY 1 2H GLY 1 13.118 -15.852 -11.638 3 3H GLY 1 3H GLY 1 14.399 -15.111 -12.463 4 1HA GLY 1 2HA GLY 1 12.997 -13.493 -11.314 5 2HA GLY 1 1HA GLY 1 13.040 -13.251 -13.055 6 H SER 2 H SER 2 11.114 -12.718 -13.838 7 HA SER 2 HA SER 2 8.698 -13.252 -12.413 8 1HB SER 2 1HB SER 2 8.296 -12.483 -15.186 9 2HB SER 2 2HB SER 2 7.912 -11.592 -13.712 10 HG SER 2 HG SER 2 9.474 -10.339 -14.362 11 H MET 3 H MET 3 8.652 -15.494 -12.250 12 HA MET 3 HA MET 3 7.252 -16.779 -14.411 13 1HB MET 3 1HB MET 3 9.787 -17.095 -14.831 14 2HB MET 3 2HB MET 3 9.744 -18.167 -13.440 15 1HG MET 3 1HG MET 3 7.788 -18.605 -15.635 16 2HG MET 3 2HG MET 3 9.467 -19.078 -15.883 17 1HE MET 3 1HE MET 3 7.600 -22.089 -15.721 18 2HE MET 3 2HE MET 3 6.319 -21.470 -14.677 19 3HE MET 3 3HE MET 3 6.879 -20.515 -16.052 20 H ASN 4 H ASN 4 9.006 -17.286 -11.373 21 HA ASN 4 HA ASN 4 6.830 -19.032 -10.474 22 1HB ASN 4 1HB ASN 4 8.597 -19.352 -8.507 23 2HB ASN 4 2HB ASN 4 8.685 -20.286 -9.992 24 1HD2 ASN 4 1HD2 ASN 4 10.875 -20.650 -9.698 25 2HD2 ASN 4 2HD2 ASN 4 12.060 -19.412 -9.961 26 H ALA 5 H ALA 5 5.320 -18.123 -9.317 27 HA ALA 5 HA ALA 5 5.438 -15.520 -8.303 28 1HB ALA 5 1HB ALA 5 3.404 -16.513 -6.881 29 2HB ALA 5 2HB ALA 5 3.276 -16.085 -8.588 30 3HB ALA 5 3HB ALA 5 3.536 -17.765 -8.117 31 HA PRO 6 HA PRO 6 5.830 -17.685 -3.825 32 1HB PRO 6 1HB PRO 6 7.669 -19.825 -4.796 33 2HB PRO 6 2HB PRO 6 6.531 -19.849 -3.447 34 1HG PRO 6 1HG PRO 6 5.929 -21.072 -5.713 35 2HG PRO 6 2HG PRO 6 4.695 -20.146 -4.834 36 1HD PRO 6 1HD PRO 6 6.186 -19.438 -7.314 37 2HD PRO 6 2HD PRO 6 4.516 -19.070 -6.854 38 H ALA 7 H ALA 7 8.438 -17.829 -6.213 39 HA ALA 7 HA ALA 7 10.546 -17.288 -4.433 40 1HB ALA 7 1HB ALA 7 10.864 -16.406 -7.226 41 2HB ALA 7 2HB ALA 7 11.896 -17.439 -6.234 42 3HB ALA 7 3HB ALA 7 10.441 -18.102 -6.980 43 H ARG 8 H ARG 8 8.178 -15.250 -5.749 44 HA ARG 8 HA ARG 8 9.707 -12.884 -4.882 45 1HB ARG 8 1HB ARG 8 7.543 -12.344 -6.782 46 2HB ARG 8 2HB ARG 8 9.198 -11.754 -6.766 47 1HG ARG 8 1HG ARG 8 9.570 -14.340 -7.508 48 2HG ARG 8 2HG ARG 8 8.005 -13.984 -8.242 49 1HD ARG 8 1HD ARG 8 10.425 -12.219 -8.555 50 2HD ARG 8 2HD ARG 8 10.019 -13.514 -9.680 51 HE ARG 8 HE ARG 8 7.837 -12.268 -9.971 52 1HH1 ARG 8 2HH1 ARG 8 10.876 -10.680 -9.236 53 2HH1 ARG 8 1HH1 ARG 8 10.348 -9.120 -9.801 54 1HH2 ARG 8 2HH2 ARG 8 7.139 -10.227 -10.728 55 2HH2 ARG 8 1HH2 ARG 8 8.226 -8.868 -10.672 56 H ALA 9 H ALA 9 7.362 -14.845 -3.933 57 HA ALA 9 HA ALA 9 5.476 -12.739 -3.124 58 1HB ALA 9 1HB ALA 9 4.536 -15.386 -2.541 59 2HB ALA 9 2HB ALA 9 3.841 -14.159 -3.601 60 3HB ALA 9 3HB ALA 9 5.053 -15.279 -4.223 61 H ALA 10 H ALA 10 8.113 -13.592 -1.833 62 HA ALA 10 HA ALA 10 7.579 -15.052 0.508 63 1HB ALA 10 1HB ALA 10 9.827 -14.784 -0.335 64 2HB ALA 10 2HB ALA 10 9.762 -13.049 -0.027 65 3HB ALA 10 3HB ALA 10 9.724 -14.185 1.321 66 H ALA 11 H ALA 11 7.708 -11.534 -0.030 67 HA ALA 11 HA ALA 11 6.486 -11.187 2.640 68 1HB ALA 11 1HB ALA 11 7.479 -9.038 2.770 69 2HB ALA 11 2HB ALA 11 8.741 -10.128 2.197 70 3HB ALA 11 3HB ALA 11 7.917 -9.058 1.062 71 H LYS 12 H LYS 12 5.435 -11.628 -0.260 72 HA LYS 12 HA LYS 12 4.169 -9.312 -1.173 73 1HB LYS 12 1HB LYS 12 4.427 -11.877 -2.078 74 2HB LYS 12 2HB LYS 12 2.714 -11.809 -1.682 75 1HG LYS 12 1HG LYS 12 3.724 -9.509 -3.196 76 2HG LYS 12 2HG LYS 12 3.778 -11.055 -4.047 77 1HD LYS 12 1HD LYS 12 1.304 -10.163 -2.605 78 2HD LYS 12 2HD LYS 12 1.649 -9.619 -4.247 79 1HE LYS 12 2HE LYS 12 1.864 -12.019 -4.910 80 2HE LYS 12 1HE LYS 12 1.303 -12.460 -3.298 81 1HZ LYS 12 1HZ LYS 12 -0.558 -12.498 -4.736 82 2HZ LYS 12 2HZ LYS 12 -0.195 -10.976 -5.384 83 3HZ LYS 12 3HZ LYS 12 -0.722 -11.107 -3.772 84 H THR 13 H THR 13 2.875 -11.938 0.826 85 HA THR 13 HA THR 13 0.255 -11.271 1.003 86 HB THR 13 HB THR 13 1.357 -12.082 3.592 87 HG1 THR 13 1HG THR 13 2.885 -13.286 2.723 88 1HG2 THR 13 1HG2 THR 13 -0.626 -13.092 3.613 89 2HG2 THR 13 2HG2 THR 13 -0.137 -14.097 2.248 90 3HG2 THR 13 3HG2 THR 13 -0.924 -12.544 1.963 91 H ALA 14 H ALA 14 2.858 -9.744 2.851 92 HA ALA 14 HA ALA 14 1.231 -8.323 4.666 93 1HB ALA 14 1HB ALA 14 3.154 -7.389 5.408 94 2HB ALA 14 2HB ALA 14 3.887 -8.662 4.430 95 3HB ALA 14 3HB ALA 14 3.736 -7.030 3.781 96 H ALA 15 H ALA 15 2.824 -7.213 1.695 97 HA ALA 15 HA ALA 15 1.454 -4.749 1.536 98 1HB ALA 15 1HB ALA 15 3.400 -4.773 0.304 99 2HB ALA 15 2HB ALA 15 3.073 -6.365 -0.383 100 3HB ALA 15 3HB ALA 15 2.181 -4.955 -0.957 101 H ASP 16 H ASP 16 0.510 -7.941 0.745 102 HA ASP 16 HA ASP 16 -1.375 -7.400 -1.314 103 1HB ASP 16 1HB ASP 16 -0.319 -9.672 -0.313 104 2HB ASP 16 2HB ASP 16 -1.867 -9.681 0.520 105 H ALA 17 H ALA 17 -1.598 -7.738 2.191 106 HA ALA 17 HA ALA 17 -4.382 -7.426 2.427 107 1HB ALA 17 1HB ALA 17 -2.108 -7.549 4.196 108 2HB ALA 17 2HB ALA 17 -3.262 -6.331 4.738 109 3HB ALA 17 3HB ALA 17 -3.786 -7.998 4.494 110 H LEU 18 H LEU 18 -1.731 -5.113 2.332 111 HA LEU 18 HA LEU 18 -3.289 -2.834 2.993 112 1HB LEU 18 1HB LEU 18 -0.630 -3.114 1.599 113 2HB LEU 18 2HB LEU 18 -1.343 -1.567 2.016 114 HG LEU 18 HG LEU 18 -0.449 -3.718 3.931 115 1HD1 LEU 18 1HD1 LEU 18 0.511 -0.888 3.824 116 2HD1 LEU 18 2HD1 LEU 18 1.297 -2.312 4.506 117 3HD1 LEU 18 3HD1 LEU 18 1.198 -2.112 2.757 118 1HD2 LEU 18 1HD2 LEU 18 -1.421 -2.623 5.676 119 2HD2 LEU 18 2HD2 LEU 18 -1.367 -1.054 4.871 120 3HD2 LEU 18 3HD2 LEU 18 -2.597 -2.237 4.422 121 H ALA 19 H ALA 19 -2.193 -4.233 -0.068 122 HA ALA 19 HA ALA 19 -3.163 -2.316 -1.820 123 1HB ALA 19 1HB ALA 19 -1.949 -3.806 -2.998 124 2HB ALA 19 2HB ALA 19 -2.455 -5.169 -2.000 125 3HB ALA 19 3HB ALA 19 -3.518 -4.564 -3.271 126 H ALA 20 H ALA 20 -4.845 -5.068 -0.367 127 HA ALA 20 HA ALA 20 -7.308 -4.561 -1.741 128 1HB ALA 20 1HB ALA 20 -8.021 -6.095 0.393 129 2HB ALA 20 2HB ALA 20 -7.407 -6.719 -1.139 130 3HB ALA 20 3HB ALA 20 -6.312 -6.493 0.224 131 H ALA 21 H ALA 21 -6.104 -3.911 1.535 132 HA ALA 21 HA ALA 21 -8.512 -2.896 2.581 133 1HB ALA 21 1HB ALA 21 -6.717 -3.630 4.022 134 2HB ALA 21 2HB ALA 21 -5.673 -2.341 3.419 135 3HB ALA 21 3HB ALA 21 -7.110 -1.944 4.361 136 H LYS 22 H LYS 22 -5.777 -1.274 1.001 137 HA LYS 22 HA LYS 22 -6.798 1.346 1.476 138 1HB LYS 22 1HB LYS 22 -4.506 0.157 0.063 139 2HB LYS 22 2HB LYS 22 -5.092 1.669 -0.619 140 1HG LYS 22 1HG LYS 22 -3.520 2.414 0.876 141 2HG LYS 22 2HG LYS 22 -4.995 2.495 1.846 142 1HD LYS 22 1HD LYS 22 -4.398 0.144 2.637 143 2HD LYS 22 2HD LYS 22 -2.807 0.437 1.934 144 1HE LYS 22 2HE LYS 22 -4.109 2.226 3.978 145 2HE LYS 22 1HE LYS 22 -2.967 0.941 4.374 146 1HZ LYS 22 1HZ LYS 22 -1.694 2.880 4.253 147 2HZ LYS 22 2HZ LYS 22 -2.476 3.430 2.853 148 3HZ LYS 22 3HZ LYS 22 -1.414 2.111 2.762 149 H LYS 23 H LYS 23 -7.078 -1.029 -1.051 150 HA LYS 23 HA LYS 23 -8.248 0.560 -3.045 151 1HB LYS 23 1HB LYS 23 -7.440 -1.938 -3.083 152 2HB LYS 23 2HB LYS 23 -9.107 -2.279 -2.630 153 1HG LYS 23 1HG LYS 23 -9.136 -0.426 -4.767 154 2HG LYS 23 2HG LYS 23 -8.052 -1.749 -5.195 155 1HD LYS 23 1HD LYS 23 -9.742 -3.344 -5.038 156 2HD LYS 23 2HD LYS 23 -10.759 -2.299 -4.043 157 1HE LYS 23 2HE LYS 23 -10.066 -1.550 -6.863 158 2HE LYS 23 1HE LYS 23 -11.393 -2.659 -6.523 159 1HZ LYS 23 1HZ LYS 23 -12.376 -0.561 -6.619 160 2HZ LYS 23 2HZ LYS 23 -11.135 0.183 -5.738 161 3HZ LYS 23 3HZ LYS 23 -12.230 -0.857 -4.958 162 H THR 24 H THR 24 -9.725 -1.407 -0.496 163 HA THR 24 HA THR 24 -12.376 -0.663 -1.072 164 HB THR 24 HB THR 24 -11.080 -2.321 0.836 165 HG1 THR 24 1HG THR 24 -13.729 -1.937 -0.105 166 1HG2 THR 24 1HG2 THR 24 -13.151 -0.494 2.063 167 2HG2 THR 24 2HG2 THR 24 -11.462 -0.643 2.550 168 3HG2 THR 24 3HG2 THR 24 -12.574 -1.992 2.787 169 H ALA 25 H ALA 25 -9.921 0.850 0.977 170 HA ALA 25 HA ALA 25 -11.556 2.779 2.183 171 1HB ALA 25 1HB ALA 25 -9.636 3.679 2.969 172 2HB ALA 25 2HB ALA 25 -8.932 2.186 2.349 173 3HB ALA 25 3HB ALA 25 -8.856 3.661 1.386 174 H ALA 26 H ALA 26 -9.597 3.026 -0.774 175 HA ALA 26 HA ALA 26 -10.580 5.506 -1.646 176 1HB ALA 26 1HB ALA 26 -8.564 4.487 -2.570 177 2HB ALA 26 2HB ALA 26 -9.534 3.203 -3.292 178 3HB ALA 26 3HB ALA 26 -9.716 4.864 -3.852 179 H ASP 27 H ASP 27 -11.776 2.244 -2.052 180 HA ASP 27 HA ASP 27 -13.769 2.622 -3.946 181 1HB ASP 27 1HB ASP 27 -12.909 0.588 -2.212 182 2HB ASP 27 2HB ASP 27 -14.610 0.819 -1.847 183 H ALA 28 H ALA 28 -14.006 2.778 -0.406 184 HA ALA 28 HA ALA 28 -16.719 3.597 -0.334 185 1HB ALA 28 1HB ALA 28 -14.497 3.420 1.624 186 2HB ALA 28 2HB ALA 28 -15.885 4.423 2.046 187 3HB ALA 28 3HB ALA 28 -16.112 2.716 1.676 188 H ALA 29 H ALA 29 -13.678 5.351 -0.429 189 HA ALA 29 HA ALA 29 -14.735 7.913 0.160 190 1HB ALA 29 1HB ALA 29 -12.258 7.023 0.078 191 2HB ALA 29 2HB ALA 29 -12.333 7.642 -1.574 192 3HB ALA 29 3HB ALA 29 -12.631 8.723 -0.211 193 H ALA 30 H ALA 30 -14.181 6.166 -2.863 194 HA ALA 30 HA ALA 30 -14.859 8.297 -4.597 195 1HB ALA 30 1HB ALA 30 -14.774 5.318 -4.951 196 2HB ALA 30 2HB ALA 30 -15.284 6.396 -6.249 197 3HB ALA 30 3HB ALA 30 -13.660 6.535 -5.574 198 H ALA 31 H ALA 31 -16.753 5.863 -2.934 199 HA ALA 31 HA ALA 31 -19.146 6.384 -4.419 200 1HB ALA 31 1HB ALA 31 -18.530 4.749 -1.989 201 2HB ALA 31 2HB ALA 31 -20.185 4.975 -2.558 202 3HB ALA 31 3HB ALA 31 -18.991 4.203 -3.603 203 H ALA 32 H ALA 32 -17.574 8.110 -2.140 204 HA ALA 32 HA ALA 32 -19.911 9.081 -0.705 205 1HB ALA 32 1HB ALA 32 -17.748 10.701 -0.039 206 2HB ALA 32 2HB ALA 32 -18.368 9.331 0.880 207 3HB ALA 32 3HB ALA 32 -17.052 9.097 -0.273 208 H ALA 33 H ALA 33 -20.174 9.523 -3.381 209 HA ALA 33 HA ALA 33 -19.256 12.141 -4.138 210 1HB ALA 33 1HB ALA 33 -21.165 10.176 -5.380 211 2HB ALA 33 2HB ALA 33 -20.852 11.767 -6.076 212 3HB ALA 33 3HB ALA 33 -19.537 10.603 -5.907 213 H ALA 34 H ALA 34 -22.551 10.836 -3.835 214 HA ALA 34 HA ALA 34 -23.375 13.377 -2.601 215 1HB ALA 34 1HB ALA 34 -24.266 13.590 -4.748 216 2HB ALA 34 2HB ALA 34 -24.663 11.877 -4.859 217 3HB ALA 34 3HB ALA 34 -25.611 12.935 -3.813 218 H ALA 35 H ALA 35 -22.624 10.692 -1.574 219 HA ALA 35 HA ALA 35 -25.105 10.085 -0.134 220 1HB ALA 35 1HB ALA 35 -23.743 7.654 -0.406 221 2HB ALA 35 2HB ALA 35 -25.267 8.118 -1.163 222 3HB ALA 35 3HB ALA 35 -23.742 8.384 -2.010 Start of MODEL 6 1 1H GLY 1 1H GLY 1 19.416 -17.171 -2.035 2 2H GLY 1 2H GLY 1 17.825 -17.728 -2.248 3 3H GLY 1 3H GLY 1 18.107 -16.119 -1.786 4 1HA GLY 1 2HA GLY 1 19.393 -15.911 -3.960 5 2HA GLY 1 1HA GLY 1 18.566 -17.398 -4.404 6 H SER 2 H SER 2 18.280 -14.933 -5.751 7 HA SER 2 HA SER 2 15.837 -13.687 -4.834 8 1HB SER 2 1HB SER 2 16.321 -12.560 -7.258 9 2HB SER 2 2HB SER 2 17.075 -12.018 -5.757 10 HG SER 2 HG SER 2 18.133 -13.678 -7.786 11 H MET 3 H MET 3 16.164 -16.548 -6.127 12 HA MET 3 HA MET 3 14.046 -16.216 -8.141 13 1HB MET 3 1HB MET 3 16.330 -17.286 -8.730 14 2HB MET 3 2HB MET 3 15.734 -18.686 -7.847 15 1HG MET 3 1HG MET 3 13.700 -17.907 -9.637 16 2HG MET 3 2HG MET 3 15.219 -17.899 -10.531 17 1HE MET 3 1HE MET 3 15.831 -21.337 -11.430 18 2HE MET 3 2HE MET 3 14.655 -20.242 -12.163 19 3HE MET 3 3HE MET 3 16.182 -19.610 -11.540 20 H ASN 4 H ASN 4 14.415 -17.005 -4.989 21 HA ASN 4 HA ASN 4 12.827 -19.392 -4.878 22 1HB ASN 4 1HB ASN 4 14.552 -18.559 -3.151 23 2HB ASN 4 2HB ASN 4 13.256 -17.542 -2.544 24 1HD2 ASN 4 1HD2 ASN 4 13.630 -18.800 -0.583 25 2HD2 ASN 4 2HD2 ASN 4 12.844 -20.329 -0.405 26 H ALA 5 H ALA 5 10.706 -19.633 -4.401 27 HA ALA 5 HA ALA 5 9.030 -17.398 -5.100 28 1HB ALA 5 1HB ALA 5 8.835 -20.173 -5.357 29 2HB ALA 5 2HB ALA 5 7.507 -19.682 -4.306 30 3HB ALA 5 3HB ALA 5 7.687 -18.952 -5.902 31 HA PRO 6 HA PRO 6 7.179 -18.093 -0.727 32 1HB PRO 6 1HB PRO 6 8.687 -19.396 1.126 33 2HB PRO 6 2HB PRO 6 7.494 -20.197 0.098 34 1HG PRO 6 1HG PRO 6 10.458 -20.101 -0.158 35 2HG PRO 6 2HG PRO 6 9.342 -21.430 -0.506 36 1HD PRO 6 1HD PRO 6 10.457 -19.827 -2.423 37 2HD PRO 6 2HD PRO 6 8.916 -20.671 -2.624 38 H ALA 7 H ALA 7 10.262 -17.112 -1.555 39 HA ALA 7 HA ALA 7 10.882 -15.609 0.809 40 1HB ALA 7 1HB ALA 7 12.839 -15.888 -0.299 41 2HB ALA 7 2HB ALA 7 12.059 -15.944 -1.880 42 3HB ALA 7 3HB ALA 7 12.351 -14.391 -1.092 43 H ARG 8 H ARG 8 8.781 -15.282 -1.800 44 HA ARG 8 HA ARG 8 8.538 -12.370 -1.474 45 1HB ARG 8 1HB ARG 8 7.147 -14.069 -3.543 46 2HB ARG 8 2HB ARG 8 7.410 -12.329 -3.567 47 1HG ARG 8 1HG ARG 8 9.859 -12.787 -3.746 48 2HG ARG 8 2HG ARG 8 9.461 -14.495 -3.938 49 1HD ARG 8 1HD ARG 8 7.856 -13.547 -5.809 50 2HD ARG 8 2HD ARG 8 9.007 -12.212 -5.790 51 HE ARG 8 HE ARG 8 9.405 -14.811 -6.895 52 1HH1 ARG 8 2HH1 ARG 8 11.046 -12.167 -5.313 53 2HH1 ARG 8 1HH1 ARG 8 12.601 -12.525 -5.995 54 1HH2 ARG 8 2HH2 ARG 8 11.445 -15.295 -7.833 55 2HH2 ARG 8 1HH2 ARG 8 12.827 -14.315 -7.430 56 H ALA 9 H ALA 9 7.336 -15.027 -0.077 57 HA ALA 9 HA ALA 9 4.542 -14.824 -0.379 58 1HB ALA 9 1HB ALA 9 6.180 -16.671 0.703 59 2HB ALA 9 2HB ALA 9 5.534 -15.920 2.163 60 3HB ALA 9 3HB ALA 9 4.438 -16.622 0.974 61 H ALA 10 H ALA 10 6.776 -13.434 1.973 62 HA ALA 10 HA ALA 10 4.953 -12.410 3.802 63 1HB ALA 10 1HB ALA 10 6.771 -11.544 4.765 64 2HB ALA 10 2HB ALA 10 7.688 -12.301 3.461 65 3HB ALA 10 3HB ALA 10 7.187 -10.616 3.325 66 H ALA 11 H ALA 11 6.375 -10.757 0.984 67 HA ALA 11 HA ALA 11 4.834 -8.412 1.227 68 1HB ALA 11 1HB ALA 11 5.991 -9.471 -1.340 69 2HB ALA 11 2HB ALA 11 5.668 -7.795 -0.901 70 3HB ALA 11 3HB ALA 11 6.957 -8.683 -0.093 71 H LYS 12 H LYS 12 4.284 -11.441 -0.451 72 HA LYS 12 HA LYS 12 2.025 -10.602 -1.945 73 1HB LYS 12 1HB LYS 12 3.530 -12.610 -2.382 74 2HB LYS 12 2HB LYS 12 2.653 -13.425 -1.096 75 1HG LYS 12 1HG LYS 12 1.768 -14.057 -3.233 76 2HG LYS 12 2HG LYS 12 0.569 -13.123 -2.339 77 1HD LYS 12 1HD LYS 12 1.325 -11.102 -3.620 78 2HD LYS 12 2HD LYS 12 2.306 -12.179 -4.613 79 1HE LYS 12 2HE LYS 12 0.540 -12.793 -5.828 80 2HE LYS 12 1HE LYS 12 -0.409 -13.143 -4.386 81 1HZ LYS 12 1HZ LYS 12 -0.379 -10.772 -6.053 82 2HZ LYS 12 2HZ LYS 12 -0.450 -10.473 -4.385 83 3HZ LYS 12 3HZ LYS 12 -1.636 -11.433 -5.125 84 H THR 13 H THR 13 2.419 -11.179 1.338 85 HA THR 13 HA THR 13 -0.475 -11.544 1.649 86 HB THR 13 HB THR 13 1.478 -11.928 3.899 87 HG1 THR 13 1HG THR 13 2.104 -13.297 2.133 88 1HG2 THR 13 1HG2 THR 13 -1.369 -12.294 3.442 89 2HG2 THR 13 2HG2 THR 13 -0.468 -12.244 4.957 90 3HG2 THR 13 3HG2 THR 13 -0.594 -13.754 4.058 91 H ALA 14 H ALA 14 2.280 -9.824 3.138 92 HA ALA 14 HA ALA 14 0.617 -8.198 4.773 93 1HB ALA 14 1HB ALA 14 3.522 -7.904 4.024 94 2HB ALA 14 2HB ALA 14 2.696 -6.954 5.260 95 3HB ALA 14 3HB ALA 14 2.871 -8.699 5.457 96 H ALA 15 H ALA 15 2.811 -7.149 2.151 97 HA ALA 15 HA ALA 15 1.627 -4.594 1.906 98 1HB ALA 15 1HB ALA 15 3.208 -4.181 0.323 99 2HB ALA 15 2HB ALA 15 3.940 -5.603 1.065 100 3HB ALA 15 3HB ALA 15 3.025 -5.764 -0.434 101 H ASP 16 H ASP 16 0.900 -7.676 0.528 102 HA ASP 16 HA ASP 16 -0.660 -6.781 -1.678 103 1HB ASP 16 1HB ASP 16 0.396 -9.097 -1.259 104 2HB ASP 16 2HB ASP 16 -1.023 -9.425 -0.279 105 H ALA 17 H ALA 17 -1.448 -7.883 1.603 106 HA ALA 17 HA ALA 17 -4.245 -7.588 1.379 107 1HB ALA 17 1HB ALA 17 -4.301 -8.312 3.502 108 2HB ALA 17 2HB ALA 17 -2.571 -8.583 3.286 109 3HB ALA 17 3HB ALA 17 -3.142 -7.097 4.044 110 H LEU 18 H LEU 18 -1.662 -5.362 2.142 111 HA LEU 18 HA LEU 18 -3.223 -3.224 3.097 112 1HB LEU 18 1HB LEU 18 -0.558 -3.302 1.705 113 2HB LEU 18 2HB LEU 18 -1.271 -1.816 2.294 114 HG LEU 18 HG LEU 18 -0.245 -4.153 3.878 115 1HD1 LEU 18 1HD1 LEU 18 1.520 -2.792 3.943 116 2HD1 LEU 18 2HD1 LEU 18 0.603 -1.446 3.268 117 3HD1 LEU 18 3HD1 LEU 18 0.557 -1.759 5.002 118 1HD2 LEU 18 1HD2 LEU 18 -1.918 -1.877 4.945 119 2HD2 LEU 18 2HD2 LEU 18 -2.470 -3.540 4.760 120 3HD2 LEU 18 3HD2 LEU 18 -1.168 -3.165 5.888 121 H ALA 19 H ALA 19 -2.205 -4.160 -0.150 122 HA ALA 19 HA ALA 19 -3.205 -1.960 -1.555 123 1HB ALA 19 1HB ALA 19 -3.507 -3.843 -3.398 124 2HB ALA 19 2HB ALA 19 -1.915 -3.256 -2.915 125 3HB ALA 19 3HB ALA 19 -2.538 -4.766 -2.249 126 H ALA 20 H ALA 20 -4.767 -4.919 -0.456 127 HA ALA 20 HA ALA 20 -7.274 -4.419 -1.717 128 1HB ALA 20 1HB ALA 20 -6.457 -6.228 0.550 129 2HB ALA 20 2HB ALA 20 -8.105 -6.148 -0.076 130 3HB ALA 20 3HB ALA 20 -6.786 -6.665 -1.128 131 H ALA 21 H ALA 21 -5.966 -3.813 1.513 132 HA ALA 21 HA ALA 21 -8.317 -2.773 2.666 133 1HB ALA 21 1HB ALA 21 -6.451 -1.505 4.084 134 2HB ALA 21 2HB ALA 21 -6.799 -3.222 4.296 135 3HB ALA 21 3HB ALA 21 -5.426 -2.715 3.311 136 H LYS 22 H LYS 22 -5.688 -1.233 0.851 137 HA LYS 22 HA LYS 22 -6.678 1.415 1.195 138 1HB LYS 22 1HB LYS 22 -4.514 0.099 -0.296 139 2HB LYS 22 2HB LYS 22 -5.158 1.540 -1.073 140 1HG LYS 22 1HG LYS 22 -3.523 2.475 0.198 141 2HG LYS 22 2HG LYS 22 -4.867 2.554 1.341 142 1HD LYS 22 1HD LYS 22 -3.934 1.055 2.727 143 2HD LYS 22 2HD LYS 22 -3.348 0.044 1.406 144 1HE LYS 22 2HE LYS 22 -2.092 2.603 2.391 145 2HE LYS 22 1HE LYS 22 -1.490 0.971 2.675 146 1HZ LYS 22 1HZ LYS 22 -1.702 2.336 0.045 147 2HZ LYS 22 2HZ LYS 22 -1.215 0.725 0.260 148 3HZ LYS 22 3HZ LYS 22 -0.276 1.984 0.888 149 H LYS 23 H LYS 23 -7.199 -1.145 -1.132 150 HA LYS 23 HA LYS 23 -8.559 0.346 -3.101 151 1HB LYS 23 1HB LYS 23 -7.728 -2.038 -3.312 152 2HB LYS 23 2HB LYS 23 -9.108 -2.530 -2.344 153 1HG LYS 23 1HG LYS 23 -9.617 -2.889 -4.651 154 2HG LYS 23 2HG LYS 23 -10.603 -1.551 -4.063 155 1HD LYS 23 1HD LYS 23 -8.225 -0.411 -5.024 156 2HD LYS 23 2HD LYS 23 -8.713 -1.613 -6.223 157 1HE LYS 23 2HE LYS 23 -10.663 0.369 -5.092 158 2HE LYS 23 1HE LYS 23 -9.622 0.784 -6.451 159 1HZ LYS 23 1HZ LYS 23 -11.968 -0.899 -6.380 160 2HZ LYS 23 2HZ LYS 23 -10.667 -1.591 -7.216 161 3HZ LYS 23 3HZ LYS 23 -11.263 -0.072 -7.682 162 H THR 24 H THR 24 -9.670 -1.419 -0.255 163 HA THR 24 HA THR 24 -12.370 -0.897 -0.375 164 HB THR 24 HB THR 24 -10.529 -1.152 1.984 165 HG1 THR 24 1HG THR 24 -10.876 -3.279 1.796 166 1HG2 THR 24 1HG2 THR 24 -13.440 -1.736 2.046 167 2HG2 THR 24 2HG2 THR 24 -12.850 -0.094 2.307 168 3HG2 THR 24 3HG2 THR 24 -12.338 -1.400 3.379 169 H ALA 25 H ALA 25 -9.790 0.997 1.179 170 HA ALA 25 HA ALA 25 -11.367 3.070 2.181 171 1HB ALA 25 1HB ALA 25 -8.945 2.624 2.692 172 2HB ALA 25 2HB ALA 25 -8.554 3.399 1.154 173 3HB ALA 25 3HB ALA 25 -9.359 4.318 2.425 174 H ALA 26 H ALA 26 -9.724 2.781 -0.948 175 HA ALA 26 HA ALA 26 -10.560 5.277 -1.985 176 1HB ALA 26 1HB ALA 26 -8.787 3.481 -2.828 177 2HB ALA 26 2HB ALA 26 -10.141 3.019 -3.861 178 3HB ALA 26 3HB ALA 26 -9.514 4.668 -3.913 179 H ASP 27 H ASP 27 -11.919 2.042 -2.163 180 HA ASP 27 HA ASP 27 -14.062 2.488 -3.875 181 1HB ASP 27 1HB ASP 27 -13.101 0.346 -2.559 182 2HB ASP 27 2HB ASP 27 -14.479 0.712 -1.533 183 H ALA 28 H ALA 28 -13.971 2.634 -0.323 184 HA ALA 28 HA ALA 28 -16.611 3.561 0.014 185 1HB ALA 28 1HB ALA 28 -15.378 4.482 2.233 186 2HB ALA 28 2HB ALA 28 -15.882 2.806 2.012 187 3HB ALA 28 3HB ALA 28 -14.211 3.275 1.697 188 H ALA 29 H ALA 29 -13.550 5.239 -0.496 189 HA ALA 29 HA ALA 29 -14.412 7.841 0.143 190 1HB ALA 29 1HB ALA 29 -12.332 7.179 -1.929 191 2HB ALA 29 2HB ALA 29 -12.442 8.621 -0.917 192 3HB ALA 29 3HB ALA 29 -12.036 7.064 -0.194 193 H ALA 30 H ALA 30 -14.779 5.894 -2.719 194 HA ALA 30 HA ALA 30 -15.663 8.004 -4.425 195 1HB ALA 30 1HB ALA 30 -14.833 6.141 -5.561 196 2HB ALA 30 2HB ALA 30 -15.782 5.010 -4.594 197 3HB ALA 30 3HB ALA 30 -16.579 6.033 -5.788 198 H ALA 31 H ALA 31 -17.243 5.716 -2.268 199 HA ALA 31 HA ALA 31 -19.877 6.484 -3.148 200 1HB ALA 31 1HB ALA 31 -18.920 4.643 -0.979 201 2HB ALA 31 2HB ALA 31 -20.625 4.982 -1.272 202 3HB ALA 31 3HB ALA 31 -19.649 4.213 -2.526 203 H ALA 32 H ALA 32 -17.640 7.724 -1.052 204 HA ALA 32 HA ALA 32 -19.520 8.854 0.848 205 1HB ALA 32 1HB ALA 32 -17.488 8.242 1.844 206 2HB ALA 32 2HB ALA 32 -16.535 8.985 0.558 207 3HB ALA 32 3HB ALA 32 -17.405 9.999 1.709 208 H ALA 33 H ALA 33 -20.109 9.609 -1.732 209 HA ALA 33 HA ALA 33 -19.161 12.375 -1.981 210 1HB ALA 33 1HB ALA 33 -21.030 11.491 -4.023 211 2HB ALA 33 2HB ALA 33 -19.392 12.127 -4.188 212 3HB ALA 33 3HB ALA 33 -19.644 10.410 -3.875 213 H ALA 34 H ALA 34 -21.716 10.557 -0.773 214 HA ALA 34 HA ALA 34 -23.210 12.877 -0.019 215 1HB ALA 34 1HB ALA 34 -24.597 12.936 -1.772 216 2HB ALA 34 2HB ALA 34 -24.020 11.384 -2.381 217 3HB ALA 34 3HB ALA 34 -25.282 11.434 -1.150 218 H ALA 35 H ALA 35 -23.028 12.196 2.077 219 HA ALA 35 HA ALA 35 -24.631 9.908 2.859 220 1HB ALA 35 1HB ALA 35 -22.695 8.661 2.689 221 2HB ALA 35 2HB ALA 35 -21.659 10.009 3.159 222 3HB ALA 35 3HB ALA 35 -22.636 9.184 4.371 Start of MODEL 7 1 1H GLY 1 1H GLY 1 0.999 -0.317 -5.174 2 2H GLY 1 2H GLY 1 2.103 -1.125 -6.171 3 3H GLY 1 3H GLY 1 1.969 -1.552 -4.533 4 1HA GLY 1 2HA GLY 1 -0.014 -2.643 -4.815 5 2HA GLY 1 1HA GLY 1 -0.381 -1.745 -6.282 6 H SER 2 H SER 2 -0.753 -3.524 -7.567 7 HA SER 2 HA SER 2 1.206 -5.645 -7.726 8 1HB SER 2 1HB SER 2 -0.779 -5.746 -9.812 9 2HB SER 2 2HB SER 2 -0.560 -6.830 -8.437 10 HG SER 2 HG SER 2 -1.958 -5.659 -7.250 11 H MET 3 H MET 3 2.796 -3.838 -8.357 12 HA MET 3 HA MET 3 2.687 -3.107 -11.164 13 1HB MET 3 1HB MET 3 3.447 -1.483 -9.451 14 2HB MET 3 2HB MET 3 4.817 -2.530 -9.100 15 1HG MET 3 1HG MET 3 5.729 -2.185 -11.272 16 2HG MET 3 2HG MET 3 4.280 -1.334 -11.803 17 1HE MET 3 1HE MET 3 3.786 1.435 -9.957 18 2HE MET 3 2HE MET 3 4.755 2.067 -11.288 19 3HE MET 3 3HE MET 3 3.668 0.705 -11.560 20 H ASN 4 H ASN 4 4.533 -5.199 -9.019 21 HA ASN 4 HA ASN 4 5.546 -6.637 -11.333 22 1HB ASN 4 1HB ASN 4 7.155 -4.739 -10.188 23 2HB ASN 4 2HB ASN 4 7.634 -6.192 -9.315 24 1HD2 ASN 4 1HD2 ASN 4 8.613 -4.378 -11.682 25 2HD2 ASN 4 2HD2 ASN 4 9.246 -5.547 -12.788 26 H ALA 5 H ALA 5 6.523 -8.703 -10.746 27 HA ALA 5 HA ALA 5 4.948 -10.022 -8.782 28 1HB ALA 5 1HB ALA 5 5.985 -10.902 -11.032 29 2HB ALA 5 2HB ALA 5 7.309 -11.380 -9.966 30 3HB ALA 5 3HB ALA 5 5.679 -11.986 -9.676 31 HA PRO 6 HA PRO 6 9.095 -10.676 -6.378 32 1HB PRO 6 1HB PRO 6 11.145 -8.957 -6.916 33 2HB PRO 6 2HB PRO 6 10.965 -10.530 -7.697 34 1HG PRO 6 1HG PRO 6 10.222 -7.819 -8.711 35 2HG PRO 6 2HG PRO 6 11.011 -9.161 -9.563 36 1HD PRO 6 1HD PRO 6 8.387 -8.632 -9.845 37 2HD PRO 6 2HD PRO 6 9.021 -10.282 -9.899 38 H ALA 7 H ALA 7 8.093 -7.510 -7.397 39 HA ALA 7 HA ALA 7 8.852 -6.082 -5.077 40 1HB ALA 7 1HB ALA 7 7.217 -4.370 -5.902 41 2HB ALA 7 2HB ALA 7 8.441 -4.850 -7.076 42 3HB ALA 7 3HB ALA 7 6.800 -5.488 -7.201 43 H ARG 8 H ARG 8 6.362 -8.293 -5.684 44 HA ARG 8 HA ARG 8 5.014 -7.478 -3.198 45 1HB ARG 8 1HB ARG 8 3.897 -8.464 -5.798 46 2HB ARG 8 2HB ARG 8 3.023 -8.760 -4.300 47 1HG ARG 8 1HG ARG 8 3.430 -6.158 -3.988 48 2HG ARG 8 2HG ARG 8 3.506 -6.221 -5.751 49 1HD ARG 8 1HD ARG 8 1.224 -6.779 -3.919 50 2HD ARG 8 2HD ARG 8 1.262 -5.864 -5.425 51 HE ARG 8 HE ARG 8 1.422 -8.036 -6.588 52 1HH1 ARG 8 2HH1 ARG 8 0.177 -7.932 -3.323 53 2HH1 ARG 8 1HH1 ARG 8 -0.691 -9.433 -3.452 54 1HH2 ARG 8 2HH2 ARG 8 0.290 -10.016 -6.777 55 2HH2 ARG 8 1HH2 ARG 8 -0.636 -10.609 -5.429 56 H ALA 9 H ALA 9 7.234 -9.482 -4.011 57 HA ALA 9 HA ALA 9 5.964 -11.967 -3.132 58 1HB ALA 9 1HB ALA 9 7.299 -12.642 -4.817 59 2HB ALA 9 2HB ALA 9 8.410 -11.285 -4.623 60 3HB ALA 9 3HB ALA 9 8.524 -12.678 -3.548 61 H ALA 10 H ALA 10 8.685 -9.856 -2.225 62 HA ALA 10 HA ALA 10 9.313 -11.296 0.147 63 1HB ALA 10 1HB ALA 10 10.330 -8.811 0.597 64 2HB ALA 10 2HB ALA 10 11.141 -10.077 -0.325 65 3HB ALA 10 3HB ALA 10 10.214 -8.832 -1.164 66 H ALA 11 H ALA 11 7.134 -8.704 -0.618 67 HA ALA 11 HA ALA 11 6.432 -8.386 2.215 68 1HB ALA 11 1HB ALA 11 6.698 -6.230 1.594 69 2HB ALA 11 2HB ALA 11 6.426 -6.576 -0.114 70 3HB ALA 11 3HB ALA 11 5.054 -6.416 0.984 71 H LYS 12 H LYS 12 5.659 -10.450 0.090 72 HA LYS 12 HA LYS 12 3.401 -10.499 -1.169 73 1HB LYS 12 1HB LYS 12 4.910 -12.456 -0.267 74 2HB LYS 12 2HB LYS 12 3.572 -12.679 0.851 75 1HG LYS 12 1HG LYS 12 2.794 -12.389 -1.961 76 2HG LYS 12 2HG LYS 12 3.749 -13.827 -1.587 77 1HD LYS 12 1HD LYS 12 1.481 -13.135 0.212 78 2HD LYS 12 2HD LYS 12 1.112 -13.818 -1.374 79 1HE LYS 12 2HE LYS 12 3.063 -15.492 -0.560 80 2HE LYS 12 1HE LYS 12 2.346 -15.066 0.994 81 1HZ LYS 12 1HZ LYS 12 0.771 -16.541 0.565 82 2HZ LYS 12 2HZ LYS 12 1.364 -16.818 -1.000 83 3HZ LYS 12 3HZ LYS 12 0.236 -15.579 -0.724 84 H THR 13 H THR 13 2.968 -11.535 2.229 85 HA THR 13 HA THR 13 0.183 -11.381 2.116 86 HB THR 13 HB THR 13 1.156 -11.082 4.806 87 HG1 THR 13 1HG THR 13 2.749 -12.569 4.861 88 1HG2 THR 13 1HG2 THR 13 0.257 -13.411 4.969 89 2HG2 THR 13 2HG2 THR 13 -0.037 -13.359 3.230 90 3HG2 THR 13 3HG2 THR 13 -0.879 -12.238 4.300 91 H ALA 14 H ALA 14 2.599 -9.101 3.300 92 HA ALA 14 HA ALA 14 0.783 -7.351 4.601 93 1HB ALA 14 1HB ALA 14 3.170 -7.366 5.132 94 2HB ALA 14 2HB ALA 14 3.540 -6.785 3.508 95 3HB ALA 14 3HB ALA 14 2.645 -5.760 4.630 96 H ALA 15 H ALA 15 2.460 -7.158 1.468 97 HA ALA 15 HA ALA 15 1.119 -4.809 0.611 98 1HB ALA 15 1HB ALA 15 2.831 -4.919 -0.804 99 2HB ALA 15 2HB ALA 15 3.110 -6.621 -0.432 100 3HB ALA 15 3HB ALA 15 1.946 -6.169 -1.679 101 H ASP 16 H ASP 16 0.404 -8.204 0.450 102 HA ASP 16 HA ASP 16 -1.617 -8.138 -1.524 103 1HB ASP 16 1HB ASP 16 -0.372 -10.126 -0.084 104 2HB ASP 16 2HB ASP 16 -1.969 -10.082 0.666 105 H ALA 17 H ALA 17 -1.747 -8.024 2.000 106 HA ALA 17 HA ALA 17 -4.555 -7.696 2.185 107 1HB ALA 17 1HB ALA 17 -3.073 -8.524 4.011 108 2HB ALA 17 2HB ALA 17 -2.491 -6.871 4.218 109 3HB ALA 17 3HB ALA 17 -4.189 -7.252 4.509 110 H LEU 18 H LEU 18 -1.850 -5.405 2.313 111 HA LEU 18 HA LEU 18 -3.465 -3.151 2.874 112 1HB LEU 18 1HB LEU 18 -0.677 -3.358 1.757 113 2HB LEU 18 2HB LEU 18 -1.438 -1.848 2.223 114 HG LEU 18 HG LEU 18 -1.152 -4.107 4.174 115 1HD1 LEU 18 1HD1 LEU 18 1.067 -3.887 3.775 116 2HD1 LEU 18 2HD1 LEU 18 0.914 -2.233 3.181 117 3HD1 LEU 18 3HD1 LEU 18 0.859 -2.555 4.913 118 1HD2 LEU 18 1HD2 LEU 18 -2.655 -2.048 4.521 119 2HD2 LEU 18 2HD2 LEU 18 -1.544 -2.500 5.814 120 3HD2 LEU 18 3HD2 LEU 18 -1.145 -1.163 4.735 121 H ALA 19 H ALA 19 -2.422 -4.643 -0.140 122 HA ALA 19 HA ALA 19 -3.114 -2.598 -1.913 123 1HB ALA 19 1HB ALA 19 -3.882 -4.860 -3.258 124 2HB ALA 19 2HB ALA 19 -2.238 -4.224 -3.189 125 3HB ALA 19 3HB ALA 19 -2.741 -5.494 -2.073 126 H ALA 20 H ALA 20 -5.100 -5.164 -0.500 127 HA ALA 20 HA ALA 20 -7.523 -4.279 -1.701 128 1HB ALA 20 1HB ALA 20 -8.333 -5.716 0.468 129 2HB ALA 20 2HB ALA 20 -7.905 -6.406 -1.098 130 3HB ALA 20 3HB ALA 20 -6.710 -6.353 0.199 131 H ALA 21 H ALA 21 -5.974 -3.762 1.427 132 HA ALA 21 HA ALA 21 -8.093 -2.468 2.721 133 1HB ALA 21 1HB ALA 21 -5.127 -2.431 3.118 134 2HB ALA 21 2HB ALA 21 -6.197 -1.441 4.111 135 3HB ALA 21 3HB ALA 21 -6.373 -3.196 4.106 136 H LYS 22 H LYS 22 -5.372 -1.083 0.863 137 HA LYS 22 HA LYS 22 -6.199 1.599 1.301 138 1HB LYS 22 1HB LYS 22 -4.093 0.201 -0.176 139 2HB LYS 22 2HB LYS 22 -4.648 1.673 -0.966 140 1HG LYS 22 1HG LYS 22 -2.932 2.446 0.361 141 2HG LYS 22 2HG LYS 22 -4.353 2.737 1.368 142 1HD LYS 22 1HD LYS 22 -3.919 0.596 2.531 143 2HD LYS 22 2HD LYS 22 -2.440 0.420 1.586 144 1HE LYS 22 2HE LYS 22 -2.032 1.340 3.845 145 2HE LYS 22 1HE LYS 22 -1.526 2.428 2.555 146 1HZ LYS 22 1HZ LYS 22 -2.963 3.235 4.609 147 2HZ LYS 22 2HZ LYS 22 -4.235 2.777 3.583 148 3HZ LYS 22 3HZ LYS 22 -3.106 3.937 3.071 149 H LYS 23 H LYS 23 -6.704 -0.766 -1.252 150 HA LYS 23 HA LYS 23 -7.953 0.923 -3.121 151 1HB LYS 23 1HB LYS 23 -7.126 -1.425 -3.532 152 2HB LYS 23 2HB LYS 23 -8.552 -2.007 -2.689 153 1HG LYS 23 1HG LYS 23 -9.517 -0.221 -4.598 154 2HG LYS 23 2HG LYS 23 -8.262 -1.153 -5.417 155 1HD LYS 23 1HD LYS 23 -9.922 -2.645 -5.736 156 2HD LYS 23 2HD LYS 23 -9.549 -3.121 -4.078 157 1HE LYS 23 2HE LYS 23 -11.710 -2.735 -3.666 158 2HE LYS 23 1HE LYS 23 -11.272 -1.027 -3.714 159 1HZ LYS 23 1HZ LYS 23 -11.682 -1.333 -6.253 160 2HZ LYS 23 2HZ LYS 23 -13.000 -1.110 -5.203 161 3HZ LYS 23 3HZ LYS 23 -12.611 -2.664 -5.758 162 H THR 24 H THR 24 -9.298 -1.164 -0.596 163 HA THR 24 HA THR 24 -11.989 -0.647 -1.122 164 HB THR 24 HB THR 24 -10.412 -1.823 1.086 165 HG1 THR 24 1HG THR 24 -12.791 -2.783 -0.132 166 1HG2 THR 24 1HG2 THR 24 -12.666 -2.217 2.276 167 2HG2 THR 24 2HG2 THR 24 -13.187 -0.773 1.406 168 3HG2 THR 24 3HG2 THR 24 -11.823 -0.688 2.519 169 H ALA 25 H ALA 25 -9.727 0.883 1.164 170 HA ALA 25 HA ALA 25 -11.511 2.617 2.423 171 1HB ALA 25 1HB ALA 25 -8.805 3.666 1.869 172 2HB ALA 25 2HB ALA 25 -9.686 3.536 3.392 173 3HB ALA 25 3HB ALA 25 -8.894 2.116 2.708 174 H ALA 26 H ALA 26 -9.503 3.173 -0.449 175 HA ALA 26 HA ALA 26 -10.516 5.744 -1.034 176 1HB ALA 26 1HB ALA 26 -9.709 4.339 -3.412 177 2HB ALA 26 2HB ALA 26 -8.941 5.704 -2.600 178 3HB ALA 26 3HB ALA 26 -8.566 4.054 -2.099 179 H ASP 27 H ASP 27 -11.441 2.522 -2.091 180 HA ASP 27 HA ASP 27 -13.307 3.256 -4.062 181 1HB ASP 27 1HB ASP 27 -12.199 0.951 -3.403 182 2HB ASP 27 2HB ASP 27 -13.677 0.757 -2.466 183 H ALA 28 H ALA 28 -13.706 2.510 -0.629 184 HA ALA 28 HA ALA 28 -16.501 2.653 -0.516 185 1HB ALA 28 1HB ALA 28 -14.905 1.805 1.263 186 2HB ALA 28 2HB ALA 28 -14.676 3.491 1.727 187 3HB ALA 28 3HB ALA 28 -16.277 2.756 1.831 188 H ALA 29 H ALA 29 -14.050 5.164 -0.324 189 HA ALA 29 HA ALA 29 -15.947 7.248 0.276 190 1HB ALA 29 1HB ALA 29 -14.126 8.376 0.869 191 2HB ALA 29 2HB ALA 29 -13.166 6.967 0.420 192 3HB ALA 29 3HB ALA 29 -13.460 8.242 -0.759 193 H ALA 30 H ALA 30 -14.640 5.762 -2.547 194 HA ALA 30 HA ALA 30 -15.229 7.929 -4.347 195 1HB ALA 30 1HB ALA 30 -14.735 5.064 -5.119 196 2HB ALA 30 2HB ALA 30 -14.470 6.517 -6.083 197 3HB ALA 30 3HB ALA 30 -13.432 6.176 -4.697 198 H ALA 31 H ALA 31 -16.826 5.021 -3.221 199 HA ALA 31 HA ALA 31 -18.979 5.238 -5.121 200 1HB ALA 31 1HB ALA 31 -19.013 3.062 -4.594 201 2HB ALA 31 2HB ALA 31 -18.135 3.329 -3.088 202 3HB ALA 31 3HB ALA 31 -19.882 3.555 -3.141 203 H ALA 32 H ALA 32 -18.152 6.930 -2.473 204 HA ALA 32 HA ALA 32 -20.901 7.472 -1.630 205 1HB ALA 32 1HB ALA 32 -18.875 7.001 -0.027 206 2HB ALA 32 2HB ALA 32 -18.544 8.712 -0.293 207 3HB ALA 32 3HB ALA 32 -20.091 8.210 0.390 208 H ALA 33 H ALA 33 -21.800 8.896 -2.965 209 HA ALA 33 HA ALA 33 -20.217 11.182 -3.902 210 1HB ALA 33 1HB ALA 33 -21.345 9.893 -5.630 211 2HB ALA 33 2HB ALA 33 -22.897 10.164 -4.836 212 3HB ALA 33 3HB ALA 33 -22.013 11.522 -5.534 213 H ALA 34 H ALA 34 -22.906 10.294 -1.906 214 HA ALA 34 HA ALA 34 -23.177 13.103 -1.084 215 1HB ALA 34 1HB ALA 34 -25.056 12.820 -2.480 216 2HB ALA 34 2HB ALA 34 -25.405 11.221 -1.822 217 3HB ALA 34 3HB ALA 34 -25.659 12.658 -0.831 218 H ALA 35 H ALA 35 -21.846 10.652 -0.019 219 HA ALA 35 HA ALA 35 -23.194 10.591 2.594 220 1HB ALA 35 1HB ALA 35 -21.466 8.320 1.762 221 2HB ALA 35 2HB ALA 35 -22.875 8.341 2.824 222 3HB ALA 35 3HB ALA 35 -23.088 8.435 1.076 Start of MODEL 8 1 1H GLY 1 1H GLY 1 17.184 -21.129 4.185 2 2H GLY 1 2H GLY 1 17.434 -22.136 2.843 3 3H GLY 1 3H GLY 1 15.874 -21.581 3.209 4 1HA GLY 1 2HA GLY 1 18.108 -19.764 2.528 5 2HA GLY 1 1HA GLY 1 17.012 -20.420 1.320 6 H SER 2 H SER 2 17.574 -17.876 3.377 7 HA SER 2 HA SER 2 14.873 -17.193 4.038 8 1HB SER 2 1HB SER 2 16.878 -15.032 4.024 9 2HB SER 2 2HB SER 2 15.831 -15.594 5.330 10 HG SER 2 HG SER 2 18.285 -15.967 5.378 11 H MET 3 H MET 3 16.672 -17.016 1.206 12 HA MET 3 HA MET 3 15.171 -14.757 0.118 13 1HB MET 3 1HB MET 3 17.730 -15.571 -0.297 14 2HB MET 3 2HB MET 3 16.922 -16.351 -1.651 15 1HG MET 3 1HG MET 3 15.898 -14.003 -2.054 16 2HG MET 3 2HG MET 3 17.239 -13.447 -1.053 17 1HE MET 3 1HE MET 3 20.367 -14.322 -2.925 18 2HE MET 3 2HE MET 3 19.567 -14.349 -1.355 19 3HE MET 3 3HE MET 3 19.641 -15.816 -2.333 20 H ASN 4 H ASN 4 14.225 -17.622 0.821 21 HA ASN 4 HA ASN 4 13.505 -18.846 -1.658 22 1HB ASN 4 1HB ASN 4 13.646 -19.681 0.954 23 2HB ASN 4 2HB ASN 4 11.912 -19.582 0.692 24 1HD2 ASN 4 1HD2 ASN 4 13.650 -21.901 1.109 25 2HD2 ASN 4 2HD2 ASN 4 13.377 -22.934 -0.254 26 H ALA 5 H ALA 5 11.480 -19.057 -2.570 27 HA ALA 5 HA ALA 5 9.822 -16.799 -2.597 28 1HB ALA 5 1HB ALA 5 9.628 -19.538 -3.739 29 2HB ALA 5 2HB ALA 5 8.179 -18.532 -3.719 30 3HB ALA 5 3HB ALA 5 9.632 -17.969 -4.545 31 HA PRO 6 HA PRO 6 6.714 -19.500 0.182 32 1HB PRO 6 1HB PRO 6 8.869 -20.843 1.741 33 2HB PRO 6 2HB PRO 6 7.259 -21.425 1.317 34 1HG PRO 6 1HG PRO 6 9.392 -22.341 0.040 35 2HG PRO 6 2HG PRO 6 7.891 -22.000 -0.842 36 1HD PRO 6 1HD PRO 6 10.422 -20.427 -0.726 37 2HD PRO 6 2HD PRO 6 9.306 -20.684 -2.080 38 H ALA 7 H ALA 7 9.916 -18.517 1.315 39 HA ALA 7 HA ALA 7 9.108 -17.490 3.813 40 1HB ALA 7 1HB ALA 7 11.464 -16.560 2.188 41 2HB ALA 7 2HB ALA 7 11.270 -16.472 3.938 42 3HB ALA 7 3HB ALA 7 11.463 -18.038 3.149 43 H ARG 8 H ARG 8 9.274 -16.172 0.623 44 HA ARG 8 HA ARG 8 8.846 -13.444 1.304 45 1HB ARG 8 1HB ARG 8 8.533 -14.998 -1.256 46 2HB ARG 8 2HB ARG 8 8.177 -13.281 -1.157 47 1HG ARG 8 1HG ARG 8 10.589 -13.109 -0.194 48 2HG ARG 8 2HG ARG 8 10.803 -14.684 -0.966 49 1HD ARG 8 1HD ARG 8 9.600 -13.342 -2.963 50 2HD ARG 8 2HD ARG 8 10.435 -12.012 -2.164 51 HE ARG 8 HE ARG 8 11.757 -14.405 -3.269 52 1HH1 ARG 8 2HH1 ARG 8 11.799 -11.051 -2.285 53 2HH1 ARG 8 1HH1 ARG 8 13.362 -10.726 -2.982 54 1HH2 ARG 8 2HH2 ARG 8 13.826 -14.003 -4.178 55 2HH2 ARG 8 1HH2 ARG 8 14.510 -12.405 -4.072 56 H ALA 9 H ALA 9 6.789 -16.150 1.177 57 HA ALA 9 HA ALA 9 4.368 -14.827 0.441 58 1HB ALA 9 1HB ALA 9 4.128 -17.047 0.060 59 2HB ALA 9 2HB ALA 9 5.112 -17.509 1.449 60 3HB ALA 9 3HB ALA 9 3.442 -16.989 1.683 61 H ALA 10 H ALA 10 6.195 -15.009 3.324 62 HA ALA 10 HA ALA 10 3.945 -14.307 5.036 63 1HB ALA 10 1HB ALA 10 6.775 -15.080 5.469 64 2HB ALA 10 2HB ALA 10 6.028 -14.039 6.679 65 3HB ALA 10 3HB ALA 10 5.314 -15.607 6.303 66 H ALA 11 H ALA 11 5.941 -12.719 2.931 67 HA ALA 11 HA ALA 11 5.814 -10.206 4.459 68 1HB ALA 11 1HB ALA 11 7.937 -9.906 3.906 69 2HB ALA 11 2HB ALA 11 7.930 -11.414 2.990 70 3HB ALA 11 3HB ALA 11 7.486 -9.901 2.201 71 H LYS 12 H LYS 12 5.332 -11.642 1.264 72 HA LYS 12 HA LYS 12 4.418 -9.349 -0.064 73 1HB LYS 12 1HB LYS 12 5.095 -11.656 -0.995 74 2HB LYS 12 2HB LYS 12 3.414 -12.097 -0.707 75 1HG LYS 12 1HG LYS 12 3.000 -9.837 -2.025 76 2HG LYS 12 2HG LYS 12 4.582 -10.244 -2.694 77 1HD LYS 12 1HD LYS 12 3.804 -12.071 -3.772 78 2HD LYS 12 2HD LYS 12 2.581 -12.415 -2.555 79 1HE LYS 12 2HE LYS 12 1.888 -9.954 -3.732 80 2HE LYS 12 1HE LYS 12 2.310 -11.041 -5.055 81 1HZ LYS 12 1HZ LYS 12 0.290 -11.898 -4.837 82 2HZ LYS 12 2HZ LYS 12 -0.019 -11.024 -3.415 83 3HZ LYS 12 3HZ LYS 12 0.752 -12.536 -3.337 84 H THR 13 H THR 13 2.809 -11.523 2.102 85 HA THR 13 HA THR 13 0.138 -11.060 1.378 86 HB THR 13 HB THR 13 -0.005 -11.670 4.019 87 HG1 THR 13 1HG THR 13 2.100 -13.303 3.574 88 1HG2 THR 13 1HG2 THR 13 0.363 -14.128 3.059 89 2HG2 THR 13 2HG2 THR 13 0.271 -13.262 1.525 90 3HG2 THR 13 3HG2 THR 13 -1.070 -13.178 2.670 91 H ALA 14 H ALA 14 2.412 -9.326 3.348 92 HA ALA 14 HA ALA 14 0.573 -7.722 4.794 93 1HB ALA 14 1HB ALA 14 2.500 -6.276 5.256 94 2HB ALA 14 2HB ALA 14 2.892 -7.979 5.503 95 3HB ALA 14 3HB ALA 14 3.442 -7.153 4.047 96 H ALA 15 H ALA 15 2.557 -7.023 1.922 97 HA ALA 15 HA ALA 15 1.275 -4.565 1.322 98 1HB ALA 15 1HB ALA 15 2.318 -5.059 -1.007 99 2HB ALA 15 2HB ALA 15 3.378 -4.758 0.370 100 3HB ALA 15 3HB ALA 15 3.093 -6.409 -0.179 101 H ASP 16 H ASP 16 0.625 -7.889 0.575 102 HA ASP 16 HA ASP 16 -1.178 -7.558 -1.567 103 1HB ASP 16 1HB ASP 16 -0.067 -9.725 -0.491 104 2HB ASP 16 2HB ASP 16 -1.565 -9.738 0.439 105 H ALA 17 H ALA 17 -1.674 -7.902 1.917 106 HA ALA 17 HA ALA 17 -4.482 -7.542 1.850 107 1HB ALA 17 1HB ALA 17 -3.993 -6.892 4.356 108 2HB ALA 17 2HB ALA 17 -3.834 -8.555 3.791 109 3HB ALA 17 3HB ALA 17 -2.399 -7.545 3.973 110 H LEU 18 H LEU 18 -1.778 -5.330 2.181 111 HA LEU 18 HA LEU 18 -3.276 -3.046 2.897 112 1HB LEU 18 1HB LEU 18 -0.587 -3.390 1.595 113 2HB LEU 18 2HB LEU 18 -1.252 -1.812 1.973 114 HG LEU 18 HG LEU 18 -0.523 -3.995 3.924 115 1HD1 LEU 18 1HD1 LEU 18 0.612 -1.314 3.215 116 2HD1 LEU 18 2HD1 LEU 18 0.911 -2.051 4.789 117 3HD1 LEU 18 3HD1 LEU 18 1.428 -2.873 3.315 118 1HD2 LEU 18 1HD2 LEU 18 -2.624 -2.261 4.229 119 2HD2 LEU 18 2HD2 LEU 18 -1.723 -3.013 5.544 120 3HD2 LEU 18 3HD2 LEU 18 -1.300 -1.388 5.000 121 H ALA 19 H ALA 19 -2.195 -4.322 -0.226 122 HA ALA 19 HA ALA 19 -3.141 -2.283 -1.870 123 1HB ALA 19 1HB ALA 19 -2.315 -5.044 -2.192 124 2HB ALA 19 2HB ALA 19 -3.598 -4.596 -3.314 125 3HB ALA 19 3HB ALA 19 -2.102 -3.667 -3.273 126 H ALA 20 H ALA 20 -4.822 -5.074 -0.528 127 HA ALA 20 HA ALA 20 -7.318 -4.520 -1.778 128 1HB ALA 20 1HB ALA 20 -7.784 -6.544 -0.999 129 2HB ALA 20 2HB ALA 20 -6.244 -6.557 -0.141 130 3HB ALA 20 3HB ALA 20 -7.694 -5.950 0.660 131 H ALA 21 H ALA 21 -6.015 -3.882 1.464 132 HA ALA 21 HA ALA 21 -8.322 -2.741 2.572 133 1HB ALA 21 1HB ALA 21 -7.011 -2.896 4.358 134 2HB ALA 21 2HB ALA 21 -5.587 -3.112 3.338 135 3HB ALA 21 3HB ALA 21 -6.116 -1.489 3.779 136 H LYS 22 H LYS 22 -5.656 -1.267 0.756 137 HA LYS 22 HA LYS 22 -6.508 1.406 1.198 138 1HB LYS 22 1HB LYS 22 -4.405 0.047 -0.284 139 2HB LYS 22 2HB LYS 22 -5.047 1.433 -1.157 140 1HG LYS 22 1HG LYS 22 -3.550 2.592 0.029 141 2HG LYS 22 2HG LYS 22 -4.733 2.466 1.337 142 1HD LYS 22 1HD LYS 22 -2.949 1.620 2.450 143 2HD LYS 22 2HD LYS 22 -3.477 0.129 1.665 144 1HE LYS 22 2HE LYS 22 -1.352 0.023 0.944 145 2HE LYS 22 1HE LYS 22 -1.891 1.197 -0.258 146 1HZ LYS 22 1HZ LYS 22 -0.224 1.586 2.111 147 2HZ LYS 22 2HZ LYS 22 -1.272 2.845 1.688 148 3HZ LYS 22 3HZ LYS 22 -0.113 2.302 0.573 149 H LYS 23 H LYS 23 -7.105 -0.995 -1.296 150 HA LYS 23 HA LYS 23 -8.323 0.790 -3.141 151 1HB LYS 23 1HB LYS 23 -7.333 -1.614 -3.487 152 2HB LYS 23 2HB LYS 23 -8.965 -2.132 -3.083 153 1HG LYS 23 1HG LYS 23 -9.832 -0.716 -4.889 154 2HG LYS 23 2HG LYS 23 -8.178 -0.286 -5.323 155 1HD LYS 23 1HD LYS 23 -7.782 -2.279 -6.307 156 2HD LYS 23 2HD LYS 23 -8.734 -3.169 -5.117 157 1HE LYS 23 2HE LYS 23 -10.295 -1.395 -6.845 158 2HE LYS 23 1HE LYS 23 -9.483 -2.713 -7.693 159 1HZ LYS 23 1HZ LYS 23 -10.499 -4.072 -5.686 160 2HZ LYS 23 2HZ LYS 23 -11.384 -3.766 -7.101 161 3HZ LYS 23 3HZ LYS 23 -11.637 -2.817 -5.718 162 H THR 24 H THR 24 -9.540 -1.386 -0.655 163 HA THR 24 HA THR 24 -12.256 -0.924 -1.046 164 HB THR 24 HB THR 24 -10.947 -1.497 1.585 165 HG1 THR 24 1HG THR 24 -10.089 -3.067 0.311 166 1HG2 THR 24 1HG2 THR 24 -13.471 -1.038 1.136 167 2HG2 THR 24 2HG2 THR 24 -12.965 -2.323 2.234 168 3HG2 THR 24 3HG2 THR 24 -13.447 -2.709 0.582 169 H ALA 25 H ALA 25 -9.911 0.660 1.129 170 HA ALA 25 HA ALA 25 -11.677 2.532 2.243 171 1HB ALA 25 1HB ALA 25 -9.806 3.629 3.078 172 2HB ALA 25 2HB ALA 25 -9.233 1.972 2.876 173 3HB ALA 25 3HB ALA 25 -8.811 3.202 1.684 174 H ALA 26 H ALA 26 -9.786 2.570 -0.708 175 HA ALA 26 HA ALA 26 -10.398 5.218 -1.508 176 1HB ALA 26 1HB ALA 26 -9.878 3.040 -3.489 177 2HB ALA 26 2HB ALA 26 -9.346 4.722 -3.506 178 3HB ALA 26 3HB ALA 26 -8.597 3.572 -2.397 179 H ASP 27 H ASP 27 -11.878 2.099 -2.203 180 HA ASP 27 HA ASP 27 -13.887 2.927 -3.950 181 1HB ASP 27 1HB ASP 27 -13.152 0.546 -3.115 182 2HB ASP 27 2HB ASP 27 -14.412 0.794 -1.912 183 H ALA 28 H ALA 28 -13.970 2.586 -0.406 184 HA ALA 28 HA ALA 28 -16.585 3.569 -0.072 185 1HB ALA 28 1HB ALA 28 -14.926 4.177 2.192 186 2HB ALA 28 2HB ALA 28 -16.211 2.981 2.036 187 3HB ALA 28 3HB ALA 28 -14.558 2.565 1.578 188 H ALA 29 H ALA 29 -13.474 5.166 -0.317 189 HA ALA 29 HA ALA 29 -14.296 7.739 0.508 190 1HB ALA 29 1HB ALA 29 -11.979 6.648 -1.014 191 2HB ALA 29 2HB ALA 29 -12.272 8.388 -1.045 192 3HB ALA 29 3HB ALA 29 -12.012 7.565 0.494 193 H ALA 30 H ALA 30 -14.304 6.112 -2.622 194 HA ALA 30 HA ALA 30 -15.107 8.364 -4.151 195 1HB ALA 30 1HB ALA 30 -15.073 6.950 -5.914 196 2HB ALA 30 2HB ALA 30 -14.249 5.880 -4.777 197 3HB ALA 30 3HB ALA 30 -15.980 5.699 -5.061 198 H ALA 31 H ALA 31 -16.805 5.838 -2.407 199 HA ALA 31 HA ALA 31 -19.407 6.844 -3.212 200 1HB ALA 31 1HB ALA 31 -18.879 4.396 -2.965 201 2HB ALA 31 2HB ALA 31 -18.831 4.660 -1.223 202 3HB ALA 31 3HB ALA 31 -20.322 4.948 -2.119 203 H ALA 32 H ALA 32 -17.409 8.319 -1.408 204 HA ALA 32 HA ALA 32 -19.023 8.546 1.019 205 1HB ALA 32 1HB ALA 32 -16.346 8.374 0.786 206 2HB ALA 32 2HB ALA 32 -16.548 10.125 0.823 207 3HB ALA 32 3HB ALA 32 -17.168 9.137 2.147 208 H ALA 33 H ALA 33 -19.846 9.643 -1.554 209 HA ALA 33 HA ALA 33 -19.884 12.515 -0.944 210 1HB ALA 33 1HB ALA 33 -19.580 11.364 -3.333 211 2HB ALA 33 2HB ALA 33 -21.342 11.433 -3.293 212 3HB ALA 33 3HB ALA 33 -20.399 12.915 -3.129 213 H ALA 34 H ALA 34 -21.955 9.708 -1.367 214 HA ALA 34 HA ALA 34 -24.041 11.093 0.181 215 1HB ALA 34 1HB ALA 34 -25.283 8.997 -1.183 216 2HB ALA 34 2HB ALA 34 -25.436 10.722 -1.512 217 3HB ALA 34 3HB ALA 34 -24.229 9.765 -2.371 218 H ALA 35 H ALA 35 -22.805 10.233 2.016 219 HA ALA 35 HA ALA 35 -23.458 7.407 2.527 220 1HB ALA 35 1HB ALA 35 -21.282 7.369 3.875 221 2HB ALA 35 2HB ALA 35 -21.149 7.309 2.117 222 3HB ALA 35 3HB ALA 35 -20.847 8.822 2.973 Start of MODEL 9 1 1H GLY 1 1H GLY 1 19.815 -4.042 1.309 2 2H GLY 1 2H GLY 1 19.938 -5.673 1.754 3 3H GLY 1 3H GLY 1 20.416 -4.466 2.839 4 1HA GLY 1 2HA GLY 1 18.370 -4.982 3.685 5 2HA GLY 1 1HA GLY 1 17.977 -3.656 2.596 6 H SER 2 H SER 2 15.817 -4.561 2.552 7 HA SER 2 HA SER 2 15.409 -7.176 1.446 8 1HB SER 2 1HB SER 2 13.118 -5.324 1.478 9 2HB SER 2 2HB SER 2 13.272 -6.947 2.152 10 HG SER 2 HG SER 2 13.033 -5.238 3.733 11 H MET 3 H MET 3 16.919 -6.101 -0.386 12 HA MET 3 HA MET 3 15.244 -5.029 -2.530 13 1HB MET 3 1HB MET 3 17.560 -4.119 -2.028 14 2HB MET 3 2HB MET 3 18.205 -5.644 -2.618 15 1HG MET 3 1HG MET 3 16.399 -4.630 -4.563 16 2HG MET 3 2HG MET 3 17.504 -3.338 -4.091 17 1HE MET 3 1HE MET 3 17.629 -6.497 -6.822 18 2HE MET 3 2HE MET 3 16.757 -4.978 -6.599 19 3HE MET 3 3HE MET 3 18.271 -5.003 -7.506 20 H ASN 4 H ASN 4 16.341 -7.940 -1.314 21 HA ASN 4 HA ASN 4 16.429 -9.366 -3.823 22 1HB ASN 4 1HB ASN 4 16.721 -11.361 -2.235 23 2HB ASN 4 2HB ASN 4 18.017 -10.179 -2.303 24 1HD2 ASN 4 1HD2 ASN 4 17.904 -11.882 -0.222 25 2HD2 ASN 4 2HD2 ASN 4 17.420 -11.052 1.221 26 H ALA 5 H ALA 5 15.072 -11.103 -4.340 27 HA ALA 5 HA ALA 5 12.360 -10.540 -4.106 28 1HB ALA 5 1HB ALA 5 13.936 -12.324 -5.574 29 2HB ALA 5 2HB ALA 5 12.733 -13.310 -4.742 30 3HB ALA 5 3HB ALA 5 12.217 -11.977 -5.776 31 HA PRO 6 HA PRO 6 12.049 -14.423 -1.027 32 1HB PRO 6 1HB PRO 6 14.667 -13.915 0.309 33 2HB PRO 6 2HB PRO 6 13.806 -15.437 0.065 34 1HG PRO 6 1HG PRO 6 15.885 -14.841 -1.448 35 2HG PRO 6 2HG PRO 6 14.443 -15.587 -2.167 36 1HD PRO 6 1HD PRO 6 15.360 -12.750 -2.272 37 2HD PRO 6 2HD PRO 6 14.573 -13.729 -3.521 38 H ALA 7 H ALA 7 13.882 -11.532 -0.076 39 HA ALA 7 HA ALA 7 12.615 -11.317 2.464 40 1HB ALA 7 1HB ALA 7 14.657 -9.886 1.013 41 2HB ALA 7 2HB ALA 7 13.554 -8.784 1.838 42 3HB ALA 7 3HB ALA 7 14.403 -10.028 2.754 43 H ARG 8 H ARG 8 11.981 -10.046 -0.696 44 HA ARG 8 HA ARG 8 9.911 -8.248 0.105 45 1HB ARG 8 1HB ARG 8 11.134 -9.135 -2.393 46 2HB ARG 8 2HB ARG 8 9.399 -8.886 -2.540 47 1HG ARG 8 1HG ARG 8 9.590 -6.671 -2.419 48 2HG ARG 8 2HG ARG 8 10.768 -6.751 -1.107 49 1HD ARG 8 1HD ARG 8 12.370 -7.579 -3.007 50 2HD ARG 8 2HD ARG 8 11.201 -6.779 -4.058 51 HE ARG 8 HE ARG 8 12.914 -5.491 -2.049 52 1HH1 ARG 8 2HH1 ARG 8 10.601 -5.251 -4.667 53 2HH1 ARG 8 1HH1 ARG 8 10.770 -3.526 -4.835 54 1HH2 ARG 8 2HH2 ARG 8 13.166 -3.224 -2.272 55 2HH2 ARG 8 1HH2 ARG 8 12.213 -2.367 -3.455 56 H ALA 9 H ALA 9 10.046 -11.567 -1.036 57 HA ALA 9 HA ALA 9 7.275 -12.030 -1.259 58 1HB ALA 9 1HB ALA 9 8.041 -14.472 -0.864 59 2HB ALA 9 2HB ALA 9 8.589 -13.623 -2.310 60 3HB ALA 9 3HB ALA 9 9.669 -13.795 -0.925 61 H ALA 10 H ALA 10 9.413 -11.894 1.452 62 HA ALA 10 HA ALA 10 7.836 -13.294 3.334 63 1HB ALA 10 1HB ALA 10 10.280 -11.838 3.330 64 2HB ALA 10 2HB ALA 10 9.281 -11.259 4.665 65 3HB ALA 10 3HB ALA 10 9.672 -12.974 4.534 66 H ALA 11 H ALA 11 7.577 -10.161 1.944 67 HA ALA 11 HA ALA 11 5.634 -9.330 3.992 68 1HB ALA 11 1HB ALA 11 6.271 -7.254 2.111 69 2HB ALA 11 2HB ALA 11 6.517 -7.297 3.857 70 3HB ALA 11 3HB ALA 11 7.747 -7.951 2.777 71 H LYS 12 H LYS 12 5.479 -11.064 1.399 72 HA LYS 12 HA LYS 12 3.955 -9.806 -0.542 73 1HB LYS 12 1HB LYS 12 4.726 -11.894 -1.167 74 2HB LYS 12 2HB LYS 12 4.229 -12.650 0.339 75 1HG LYS 12 1HG LYS 12 2.479 -13.454 -0.756 76 2HG LYS 12 2HG LYS 12 1.857 -11.805 -0.830 77 1HD LYS 12 1HD LYS 12 3.700 -11.913 -2.890 78 2HD LYS 12 2HD LYS 12 2.912 -13.491 -2.941 79 1HE LYS 12 2HE LYS 12 1.404 -10.889 -2.814 80 2HE LYS 12 1HE LYS 12 1.835 -11.681 -4.328 81 1HZ LYS 12 1HZ LYS 12 -0.320 -12.231 -2.574 82 2HZ LYS 12 2HZ LYS 12 0.639 -13.618 -2.753 83 3HZ LYS 12 3HZ LYS 12 -0.014 -12.858 -4.122 84 H THR 13 H THR 13 2.766 -11.635 2.280 85 HA THR 13 HA THR 13 0.029 -11.300 1.699 86 HB THR 13 HB THR 13 0.540 -11.641 4.513 87 HG1 THR 13 1HG THR 13 1.872 -13.518 4.321 88 1HG2 THR 13 1HG2 THR 13 -1.136 -13.069 4.189 89 2HG2 THR 13 2HG2 THR 13 -0.135 -14.056 3.121 90 3HG2 THR 13 3HG2 THR 13 -1.061 -12.706 2.463 91 H ALA 14 H ALA 14 2.366 -9.394 3.409 92 HA ALA 14 HA ALA 14 0.537 -7.729 4.827 93 1HB ALA 14 1HB ALA 14 2.377 -6.783 5.715 94 2HB ALA 14 2HB ALA 14 3.223 -8.136 4.965 95 3HB ALA 14 3HB ALA 14 3.150 -6.579 4.144 96 H ALA 15 H ALA 15 2.446 -7.316 1.856 97 HA ALA 15 HA ALA 15 1.250 -4.841 1.135 98 1HB ALA 15 1HB ALA 15 3.456 -5.881 0.297 99 2HB ALA 15 2HB ALA 15 2.436 -6.749 -0.851 100 3HB ALA 15 3HB ALA 15 2.459 -4.986 -0.851 101 H ASP 16 H ASP 16 0.424 -8.189 0.658 102 HA ASP 16 HA ASP 16 -1.502 -7.911 -1.378 103 1HB ASP 16 1HB ASP 16 -0.468 -10.011 0.099 104 2HB ASP 16 2HB ASP 16 -2.138 -9.925 0.660 105 H ALA 17 H ALA 17 -1.716 -7.776 2.130 106 HA ALA 17 HA ALA 17 -4.508 -7.291 2.269 107 1HB ALA 17 1HB ALA 17 -3.209 -6.112 4.501 108 2HB ALA 17 2HB ALA 17 -4.094 -7.637 4.423 109 3HB ALA 17 3HB ALA 17 -2.360 -7.606 4.103 110 H LEU 18 H LEU 18 -1.658 -5.179 2.271 111 HA LEU 18 HA LEU 18 -2.985 -2.754 2.699 112 1HB LEU 18 1HB LEU 18 -0.410 -3.377 1.270 113 2HB LEU 18 2HB LEU 18 -0.960 -1.741 1.576 114 HG LEU 18 HG LEU 18 -0.094 -3.813 3.570 115 1HD1 LEU 18 1HD1 LEU 18 0.794 -1.024 2.885 116 2HD1 LEU 18 2HD1 LEU 18 1.351 -1.911 4.305 117 3HD1 LEU 18 3HD1 LEU 18 1.698 -2.526 2.690 118 1HD2 LEU 18 1HD2 LEU 18 -1.949 -1.538 3.935 119 2HD2 LEU 18 2HD2 LEU 18 -1.827 -3.059 4.819 120 3HD2 LEU 18 3HD2 LEU 18 -0.692 -1.750 5.152 121 H ALA 19 H ALA 19 -2.060 -4.325 -0.362 122 HA ALA 19 HA ALA 19 -2.941 -2.389 -2.139 123 1HB ALA 19 1HB ALA 19 -3.312 -4.342 -3.720 124 2HB ALA 19 2HB ALA 19 -1.706 -4.202 -3.007 125 3HB ALA 19 3HB ALA 19 -2.849 -5.389 -2.377 126 H ALA 20 H ALA 20 -4.765 -5.040 -0.683 127 HA ALA 20 HA ALA 20 -7.231 -4.391 -1.943 128 1HB ALA 20 1HB ALA 20 -7.166 -6.586 -1.273 129 2HB ALA 20 2HB ALA 20 -6.399 -6.210 0.270 130 3HB ALA 20 3HB ALA 20 -8.113 -5.868 0.030 131 H ALA 21 H ALA 21 -5.931 -3.784 1.305 132 HA ALA 21 HA ALA 21 -8.222 -2.608 2.403 133 1HB ALA 21 1HB ALA 21 -6.784 -1.775 4.151 134 2HB ALA 21 2HB ALA 21 -6.295 -3.414 3.717 135 3HB ALA 21 3HB ALA 21 -5.356 -2.031 3.148 136 H LYS 22 H LYS 22 -5.509 -1.142 0.641 137 HA LYS 22 HA LYS 22 -6.350 1.536 1.093 138 1HB LYS 22 1HB LYS 22 -4.280 0.166 -0.487 139 2HB LYS 22 2HB LYS 22 -4.872 1.656 -1.214 140 1HG LYS 22 1HG LYS 22 -3.161 2.473 0.044 141 2HG LYS 22 2HG LYS 22 -4.482 2.598 1.214 142 1HD LYS 22 1HD LYS 22 -3.261 1.358 2.608 143 2HD LYS 22 2HD LYS 22 -3.472 0.002 1.498 144 1HE LYS 22 2HE LYS 22 -1.262 0.010 1.241 145 2HE LYS 22 1HE LYS 22 -1.454 1.523 0.358 146 1HZ LYS 22 1HZ LYS 22 -1.168 2.737 2.414 147 2HZ LYS 22 2HZ LYS 22 0.167 1.727 2.143 148 3HZ LYS 22 3HZ LYS 22 -1.011 1.293 3.285 149 H LYS 23 H LYS 23 -6.834 -0.801 -1.494 150 HA LYS 23 HA LYS 23 -8.229 0.870 -3.281 151 1HB LYS 23 1HB LYS 23 -7.248 -1.477 -3.659 152 2HB LYS 23 2HB LYS 23 -8.743 -2.077 -2.957 153 1HG LYS 23 1HG LYS 23 -9.834 -0.508 -4.757 154 2HG LYS 23 2HG LYS 23 -8.275 -0.725 -5.556 155 1HD LYS 23 1HD LYS 23 -9.040 -3.270 -4.679 156 2HD LYS 23 2HD LYS 23 -10.496 -2.545 -5.366 157 1HE LYS 23 2HE LYS 23 -9.728 -3.002 -7.395 158 2HE LYS 23 1HE LYS 23 -8.390 -1.892 -7.105 159 1HZ LYS 23 1HZ LYS 23 -7.683 -4.145 -7.768 160 2HZ LYS 23 2HZ LYS 23 -8.375 -4.767 -6.352 161 3HZ LYS 23 3HZ LYS 23 -7.073 -3.685 -6.253 162 H THR 24 H THR 24 -9.317 -1.265 -0.682 163 HA THR 24 HA THR 24 -12.076 -0.874 -1.100 164 HB THR 24 HB THR 24 -10.373 -2.280 0.750 165 HG1 THR 24 1HG THR 24 -13.019 -2.991 0.675 166 1HG2 THR 24 1HG2 THR 24 -11.736 -2.293 2.724 167 2HG2 THR 24 2HG2 THR 24 -12.909 -1.206 1.979 168 3HG2 THR 24 3HG2 THR 24 -11.291 -0.624 2.371 169 H ALA 25 H ALA 25 -9.734 0.766 1.015 170 HA ALA 25 HA ALA 25 -11.541 2.496 2.284 171 1HB ALA 25 1HB ALA 25 -9.718 3.429 3.216 172 2HB ALA 25 2HB ALA 25 -8.880 2.056 2.488 173 3HB ALA 25 3HB ALA 25 -8.894 3.617 1.667 174 H ALA 26 H ALA 26 -9.582 2.967 -0.644 175 HA ALA 26 HA ALA 26 -10.546 5.519 -1.300 176 1HB ALA 26 1HB ALA 26 -9.699 5.056 -3.562 177 2HB ALA 26 2HB ALA 26 -8.541 4.608 -2.309 178 3HB ALA 26 3HB ALA 26 -9.489 3.362 -3.120 179 H ASP 27 H ASP 27 -11.734 2.306 -2.117 180 HA ASP 27 HA ASP 27 -13.705 3.001 -3.972 181 1HB ASP 27 1HB ASP 27 -12.825 0.666 -3.095 182 2HB ASP 27 2HB ASP 27 -14.213 0.789 -2.024 183 H ALA 28 H ALA 28 -14.049 2.411 -0.490 184 HA ALA 28 HA ALA 28 -16.753 3.098 -0.282 185 1HB ALA 28 1HB ALA 28 -14.595 2.469 1.509 186 2HB ALA 28 2HB ALA 28 -15.575 3.783 2.160 187 3HB ALA 28 3HB ALA 28 -16.332 2.251 1.724 188 H ALA 29 H ALA 29 -13.854 5.089 -0.088 189 HA ALA 29 HA ALA 29 -15.162 7.439 0.848 190 1HB ALA 29 1HB ALA 29 -12.500 6.625 0.313 191 2HB ALA 29 2HB ALA 29 -12.796 8.125 -0.568 192 3HB ALA 29 3HB ALA 29 -13.059 8.058 1.175 193 H ALA 30 H ALA 30 -14.383 6.167 -2.340 194 HA ALA 30 HA ALA 30 -14.912 8.524 -3.805 195 1HB ALA 30 1HB ALA 30 -14.104 5.888 -4.382 196 2HB ALA 30 2HB ALA 30 -15.533 6.210 -5.365 197 3HB ALA 30 3HB ALA 30 -14.131 7.279 -5.466 198 H ALA 31 H ALA 31 -16.958 5.867 -2.728 199 HA ALA 31 HA ALA 31 -19.246 6.904 -4.170 200 1HB ALA 31 1HB ALA 31 -18.535 4.388 -3.436 201 2HB ALA 31 2HB ALA 31 -19.720 4.791 -2.194 202 3HB ALA 31 3HB ALA 31 -20.167 4.871 -3.899 203 H ALA 32 H ALA 32 -17.765 7.870 -1.482 204 HA ALA 32 HA ALA 32 -20.204 8.345 0.078 205 1HB ALA 32 1HB ALA 32 -18.956 8.325 1.954 206 2HB ALA 32 2HB ALA 32 -17.797 7.468 0.938 207 3HB ALA 32 3HB ALA 32 -17.623 9.203 1.204 208 H ALA 33 H ALA 33 -20.077 9.802 -2.228 209 HA ALA 33 HA ALA 33 -18.792 12.289 -2.068 210 1HB ALA 33 1HB ALA 33 -20.951 12.852 -3.595 211 2HB ALA 33 2HB ALA 33 -19.505 12.033 -4.186 212 3HB ALA 33 3HB ALA 33 -20.918 11.092 -3.708 213 H ALA 34 H ALA 34 -22.232 11.549 -1.481 214 HA ALA 34 HA ALA 34 -22.368 13.962 0.198 215 1HB ALA 34 1HB ALA 34 -24.265 14.526 -0.821 216 2HB ALA 34 2HB ALA 34 -23.910 13.264 -2.000 217 3HB ALA 34 3HB ALA 34 -24.939 12.910 -0.614 218 H ALA 35 H ALA 35 -21.336 11.791 1.403 219 HA ALA 35 HA ALA 35 -23.469 10.945 3.215 220 1HB ALA 35 1HB ALA 35 -21.741 8.729 2.941 221 2HB ALA 35 2HB ALA 35 -23.445 8.842 2.501 222 3HB ALA 35 3HB ALA 35 -22.201 9.231 1.314 Start of MODEL 10 1 1H GLY 1 1H GLY 1 11.580 -0.933 6.935 2 2H GLY 1 2H GLY 1 11.854 -0.752 5.271 3 3H GLY 1 3H GLY 1 12.954 -1.622 6.220 4 1HA GLY 1 2HA GLY 1 10.994 -3.150 6.751 5 2HA GLY 1 1HA GLY 1 10.239 -2.390 5.358 6 H SER 2 H SER 2 12.240 -2.120 3.571 7 HA SER 2 HA SER 2 12.623 -4.847 2.745 8 1HB SER 2 1HB SER 2 13.979 -3.174 0.963 9 2HB SER 2 2HB SER 2 12.339 -3.801 0.787 10 HG SER 2 HG SER 2 12.724 -1.397 0.731 11 H MET 3 H MET 3 14.035 -4.826 4.939 12 HA MET 3 HA MET 3 16.695 -3.885 4.806 13 1HB MET 3 1HB MET 3 15.298 -4.784 6.831 14 2HB MET 3 2HB MET 3 15.954 -6.345 6.357 15 1HG MET 3 1HG MET 3 17.783 -4.024 6.776 16 2HG MET 3 2HG MET 3 17.159 -4.924 8.156 17 1HE MET 3 1HE MET 3 17.453 -7.159 8.687 18 2HE MET 3 2HE MET 3 18.749 -8.229 8.155 19 3HE MET 3 3HE MET 3 19.126 -6.804 9.124 20 H ASN 4 H ASN 4 15.457 -7.198 4.415 21 HA ASN 4 HA ASN 4 17.947 -7.905 3.027 22 1HB ASN 4 1HB ASN 4 16.028 -9.389 4.739 23 2HB ASN 4 2HB ASN 4 16.729 -10.287 3.400 24 1HD2 ASN 4 1HD2 ASN 4 19.273 -9.425 3.274 25 2HD2 ASN 4 2HD2 ASN 4 20.103 -9.745 4.762 26 H ALA 5 H ALA 5 17.821 -9.271 1.147 27 HA ALA 5 HA ALA 5 16.029 -8.329 -0.787 28 1HB ALA 5 1HB ALA 5 18.286 -10.082 -0.728 29 2HB ALA 5 2HB ALA 5 17.010 -10.793 -1.717 30 3HB ALA 5 3HB ALA 5 17.610 -9.178 -2.081 31 HA PRO 6 HA PRO 6 13.590 -12.477 -0.500 32 1HB PRO 6 1HB PRO 6 13.924 -14.026 1.710 33 2HB PRO 6 2HB PRO 6 14.874 -14.234 0.234 34 1HG PRO 6 1HG PRO 6 15.595 -12.823 2.768 35 2HG PRO 6 2HG PRO 6 16.578 -13.916 1.775 36 1HD PRO 6 1HD PRO 6 16.828 -11.235 1.661 37 2HD PRO 6 2HD PRO 6 17.092 -12.269 0.251 38 H ALA 7 H ALA 7 14.270 -10.416 2.145 39 HA ALA 7 HA ALA 7 11.885 -10.848 3.644 40 1HB ALA 7 1HB ALA 7 14.164 -9.648 4.265 41 2HB ALA 7 2HB ALA 7 13.257 -8.220 3.765 42 3HB ALA 7 3HB ALA 7 12.646 -9.240 5.066 43 H ARG 8 H ARG 8 12.540 -9.289 0.724 44 HA ARG 8 HA ARG 8 10.294 -7.467 0.834 45 1HB ARG 8 1HB ARG 8 12.137 -8.308 -1.407 46 2HB ARG 8 2HB ARG 8 10.804 -7.181 -1.625 47 1HG ARG 8 1HG ARG 8 12.019 -5.499 -0.873 48 2HG ARG 8 2HG ARG 8 12.407 -6.377 0.606 49 1HD ARG 8 1HD ARG 8 14.123 -7.639 -0.806 50 2HD ARG 8 2HD ARG 8 13.878 -6.373 -2.008 51 HE ARG 8 HE ARG 8 14.614 -5.595 0.714 52 1HH1 ARG 8 2HH1 ARG 8 15.534 -6.043 -2.615 53 2HH1 ARG 8 1HH1 ARG 8 16.891 -4.955 -2.535 54 1HH2 ARG 8 2HH2 ARG 8 16.402 -4.183 0.871 55 2HH2 ARG 8 1HH2 ARG 8 17.394 -3.894 -0.533 56 H ALA 9 H ALA 9 10.986 -10.684 -0.266 57 HA ALA 9 HA ALA 9 8.496 -10.985 -1.701 58 1HB ALA 9 1HB ALA 9 10.920 -12.241 -1.854 59 2HB ALA 9 2HB ALA 9 9.943 -13.427 -0.987 60 3HB ALA 9 3HB ALA 9 9.422 -12.838 -2.565 61 H ALA 10 H ALA 10 9.830 -11.687 1.434 62 HA ALA 10 HA ALA 10 7.780 -13.417 2.362 63 1HB ALA 10 1HB ALA 10 10.092 -12.015 3.512 64 2HB ALA 10 2HB ALA 10 8.772 -12.331 4.638 65 3HB ALA 10 3HB ALA 10 9.523 -13.665 3.763 66 H ALA 11 H ALA 11 7.721 -10.168 1.634 67 HA ALA 11 HA ALA 11 5.756 -9.450 3.672 68 1HB ALA 11 1HB ALA 11 7.804 -8.032 2.570 69 2HB ALA 11 2HB ALA 11 6.427 -7.462 1.629 70 3HB ALA 11 3HB ALA 11 6.411 -7.323 3.387 71 H LYS 12 H LYS 12 5.494 -11.193 1.077 72 HA LYS 12 HA LYS 12 3.958 -10.023 -0.857 73 1HB LYS 12 1HB LYS 12 4.756 -12.578 -0.304 74 2HB LYS 12 2HB LYS 12 3.008 -12.700 -0.138 75 1HG LYS 12 1HG LYS 12 2.960 -11.451 -2.409 76 2HG LYS 12 2HG LYS 12 4.632 -12.000 -2.542 77 1HD LYS 12 1HD LYS 12 4.009 -14.258 -2.506 78 2HD LYS 12 2HD LYS 12 2.402 -13.893 -1.879 79 1HE LYS 12 2HE LYS 12 3.236 -12.829 -4.545 80 2HE LYS 12 1HE LYS 12 2.710 -14.504 -4.394 81 1HZ LYS 12 1HZ LYS 12 0.892 -12.980 -4.987 82 2HZ LYS 12 2HZ LYS 12 1.116 -12.151 -3.525 83 3HZ LYS 12 3HZ LYS 12 0.614 -13.772 -3.510 84 H THR 13 H THR 13 2.370 -12.094 1.581 85 HA THR 13 HA THR 13 -0.193 -11.170 1.137 86 HB THR 13 HB THR 13 0.304 -11.974 3.902 87 HG1 THR 13 1HG THR 13 1.084 -14.057 3.344 88 1HG2 THR 13 1HG2 THR 13 -1.693 -12.210 1.975 89 2HG2 THR 13 2HG2 THR 13 -1.687 -12.932 3.583 90 3HG2 THR 13 3HG2 THR 13 -1.095 -13.852 2.200 91 H ALA 14 H ALA 14 2.313 -9.874 3.205 92 HA ALA 14 HA ALA 14 0.719 -8.228 4.845 93 1HB ALA 14 1HB ALA 14 3.494 -7.449 4.037 94 2HB ALA 14 2HB ALA 14 2.695 -7.288 5.601 95 3HB ALA 14 3HB ALA 14 3.225 -8.874 5.043 96 H ALA 15 H ALA 15 2.498 -7.523 1.848 97 HA ALA 15 HA ALA 15 1.396 -4.873 1.641 98 1HB ALA 15 1HB ALA 15 3.607 -5.319 0.755 99 2HB ALA 15 2HB ALA 15 2.945 -6.517 -0.357 100 3HB ALA 15 3HB ALA 15 2.528 -4.814 -0.545 101 H ASP 16 H ASP 16 0.534 -8.045 0.556 102 HA ASP 16 HA ASP 16 -1.169 -7.351 -1.593 103 1HB ASP 16 1HB ASP 16 -0.258 -9.705 -0.698 104 2HB ASP 16 2HB ASP 16 -1.826 -9.709 0.105 105 H ALA 17 H ALA 17 -1.755 -7.917 1.844 106 HA ALA 17 HA ALA 17 -4.542 -7.430 1.781 107 1HB ALA 17 1HB ALA 17 -4.269 -7.108 4.251 108 2HB ALA 17 2HB ALA 17 -3.621 -8.626 3.627 109 3HB ALA 17 3HB ALA 17 -2.531 -7.295 4.017 110 H LEU 18 H LEU 18 -1.735 -5.366 2.149 111 HA LEU 18 HA LEU 18 -3.108 -3.034 2.973 112 1HB LEU 18 1HB LEU 18 -0.462 -3.455 1.607 113 2HB LEU 18 2HB LEU 18 -1.046 -1.865 2.052 114 HG LEU 18 HG LEU 18 -0.336 -4.135 3.903 115 1HD1 LEU 18 1HD1 LEU 18 1.090 -2.143 4.803 116 2HD1 LEU 18 2HD1 LEU 18 1.630 -3.055 3.393 117 3HD1 LEU 18 3HD1 LEU 18 0.843 -1.491 3.181 118 1HD2 LEU 18 1HD2 LEU 18 -2.259 -3.191 4.891 119 2HD2 LEU 18 2HD2 LEU 18 -0.889 -2.430 5.701 120 3HD2 LEU 18 3HD2 LEU 18 -1.776 -1.552 4.454 121 H ALA 19 H ALA 19 -2.075 -4.211 -0.210 122 HA ALA 19 HA ALA 19 -2.997 -2.088 -1.762 123 1HB ALA 19 1HB ALA 19 -3.373 -4.781 -2.901 124 2HB ALA 19 2HB ALA 19 -2.497 -3.389 -3.539 125 3HB ALA 19 3HB ALA 19 -1.752 -4.413 -2.310 126 H ALA 20 H ALA 20 -4.693 -4.923 -0.531 127 HA ALA 20 HA ALA 20 -7.181 -4.357 -1.779 128 1HB ALA 20 1HB ALA 20 -6.116 -6.424 -0.216 129 2HB ALA 20 2HB ALA 20 -7.494 -5.797 0.689 130 3HB ALA 20 3HB ALA 20 -7.710 -6.360 -0.968 131 H ALA 21 H ALA 21 -5.902 -3.767 1.480 132 HA ALA 21 HA ALA 21 -8.164 -2.579 2.596 133 1HB ALA 21 1HB ALA 21 -6.725 -1.741 4.308 134 2HB ALA 21 2HB ALA 21 -6.127 -3.331 3.831 135 3HB ALA 21 3HB ALA 21 -5.312 -1.874 3.260 136 H LYS 22 H LYS 22 -5.444 -1.081 0.833 137 HA LYS 22 HA LYS 22 -6.358 1.579 1.178 138 1HB LYS 22 1HB LYS 22 -4.211 0.207 -0.219 139 2HB LYS 22 2HB LYS 22 -4.868 1.525 -1.178 140 1HG LYS 22 1HG LYS 22 -3.415 2.784 -0.040 141 2HG LYS 22 2HG LYS 22 -4.627 2.715 1.247 142 1HD LYS 22 1HD LYS 22 -3.442 0.625 2.056 143 2HD LYS 22 2HD LYS 22 -2.142 1.041 0.938 144 1HE LYS 22 2HE LYS 22 -3.067 3.187 2.742 145 2HE LYS 22 1HE LYS 22 -2.216 1.841 3.500 146 1HZ LYS 22 1HZ LYS 22 -0.292 2.597 2.741 147 2HZ LYS 22 2HZ LYS 22 -1.088 3.999 2.215 148 3HZ LYS 22 3HZ LYS 22 -0.869 2.698 1.149 149 H LYS 23 H LYS 23 -6.931 -0.918 -1.213 150 HA LYS 23 HA LYS 23 -8.268 0.665 -3.129 151 1HB LYS 23 1HB LYS 23 -7.395 -1.748 -3.367 152 2HB LYS 23 2HB LYS 23 -8.901 -2.232 -2.599 153 1HG LYS 23 1HG LYS 23 -9.782 -0.560 -4.562 154 2HG LYS 23 2HG LYS 23 -8.390 -1.329 -5.327 155 1HD LYS 23 1HD LYS 23 -9.801 -3.001 -5.805 156 2HD LYS 23 2HD LYS 23 -9.646 -3.439 -4.102 157 1HE LYS 23 2HE LYS 23 -11.977 -3.334 -4.659 158 2HE LYS 23 1HE LYS 23 -11.590 -1.973 -3.606 159 1HZ LYS 23 1HZ LYS 23 -12.884 -1.039 -5.275 160 2HZ LYS 23 2HZ LYS 23 -12.168 -1.959 -6.508 161 3HZ LYS 23 3HZ LYS 23 -11.307 -0.686 -5.791 162 H THR 24 H THR 24 -9.375 -1.226 -0.376 163 HA THR 24 HA THR 24 -12.102 -0.766 -0.602 164 HB THR 24 HB THR 24 -10.632 -1.019 1.994 165 HG1 THR 24 1HG THR 24 -9.882 -2.620 0.436 166 1HG2 THR 24 1HG2 THR 24 -13.130 -0.626 1.781 167 2HG2 THR 24 2HG2 THR 24 -12.589 -1.967 2.795 168 3HG2 THR 24 3HG2 THR 24 -13.196 -2.273 1.168 169 H ALA 25 H ALA 25 -9.636 0.976 1.281 170 HA ALA 25 HA ALA 25 -11.208 2.948 2.419 171 1HB ALA 25 1HB ALA 25 -8.361 2.665 1.738 172 2HB ALA 25 2HB ALA 25 -8.927 4.325 1.931 173 3HB ALA 25 3HB ALA 25 -9.125 3.166 3.247 174 H ALA 26 H ALA 26 -9.787 2.834 -0.800 175 HA ALA 26 HA ALA 26 -10.684 5.461 -1.539 176 1HB ALA 26 1HB ALA 26 -10.119 4.466 -3.903 177 2HB ALA 26 2HB ALA 26 -8.838 4.870 -2.760 178 3HB ALA 26 3HB ALA 26 -9.357 3.194 -2.944 179 H ASP 27 H ASP 27 -11.808 2.174 -2.033 180 HA ASP 27 HA ASP 27 -13.871 2.663 -3.855 181 1HB ASP 27 1HB ASP 27 -12.831 0.439 -2.846 182 2HB ASP 27 2HB ASP 27 -14.229 0.554 -1.782 183 H ALA 28 H ALA 28 -13.857 2.696 -0.319 184 HA ALA 28 HA ALA 28 -16.614 3.107 0.057 185 1HB ALA 28 1HB ALA 28 -14.204 3.243 1.682 186 2HB ALA 28 2HB ALA 28 -15.432 4.409 2.170 187 3HB ALA 28 3HB ALA 28 -15.825 2.691 2.105 188 H ALA 29 H ALA 29 -13.947 5.342 -0.486 189 HA ALA 29 HA ALA 29 -15.470 7.716 -0.116 190 1HB ALA 29 1HB ALA 29 -13.559 8.852 -1.164 191 2HB ALA 29 2HB ALA 29 -13.052 7.738 0.105 192 3HB ALA 29 3HB ALA 29 -12.874 7.285 -1.592 193 H ALA 30 H ALA 30 -14.884 5.570 -2.796 194 HA ALA 30 HA ALA 30 -15.802 7.290 -4.860 195 1HB ALA 30 1HB ALA 30 -15.644 5.460 -6.284 196 2HB ALA 30 2HB ALA 30 -14.443 5.107 -5.042 197 3HB ALA 30 3HB ALA 30 -16.012 4.303 -5.003 198 H ALA 31 H ALA 31 -17.394 5.433 -2.447 199 HA ALA 31 HA ALA 31 -19.935 5.344 -3.796 200 1HB ALA 31 1HB ALA 31 -20.211 4.963 -0.983 201 2HB ALA 31 2HB ALA 31 -20.372 3.777 -2.277 202 3HB ALA 31 3HB ALA 31 -18.795 4.077 -1.546 203 H ALA 32 H ALA 32 -18.193 7.678 -2.288 204 HA ALA 32 HA ALA 32 -20.543 9.214 -1.437 205 1HB ALA 32 1HB ALA 32 -19.021 10.669 -0.271 206 2HB ALA 32 2HB ALA 32 -18.631 8.998 0.144 207 3HB ALA 32 3HB ALA 32 -17.629 9.876 -1.012 208 H ALA 33 H ALA 33 -21.128 9.420 -3.712 209 HA ALA 33 HA ALA 33 -19.427 11.122 -5.350 210 1HB ALA 33 1HB ALA 33 -21.877 9.494 -5.831 211 2HB ALA 33 2HB ALA 33 -21.511 10.830 -6.924 212 3HB ALA 33 3HB ALA 33 -20.348 9.521 -6.710 213 H ALA 34 H ALA 34 -22.509 11.219 -3.661 214 HA ALA 34 HA ALA 34 -22.680 14.110 -4.243 215 1HB ALA 34 1HB ALA 34 -25.074 13.955 -3.985 216 2HB ALA 34 2HB ALA 34 -24.543 12.750 -5.160 217 3HB ALA 34 3HB ALA 34 -24.950 12.261 -3.515 218 H ALA 35 H ALA 35 -21.144 12.785 -2.144 219 HA ALA 35 HA ALA 35 -22.303 14.167 0.154 220 1HB ALA 35 1HB ALA 35 -21.827 12.289 1.641 221 2HB ALA 35 2HB ALA 35 -22.993 11.837 0.397 222 3HB ALA 35 3HB ALA 35 -21.314 11.317 0.260 Start of MODEL 11 1 1H GLY 1 1H GLY 1 12.115 -24.239 -13.175 2 2H GLY 1 2H GLY 1 12.190 -22.702 -13.882 3 3H GLY 1 3H GLY 1 11.244 -22.956 -12.492 4 1HA GLY 1 2HA GLY 1 13.796 -23.792 -11.835 5 2HA GLY 1 1HA GLY 1 13.980 -22.266 -12.693 6 H SER 2 H SER 2 14.491 -20.963 -11.003 7 HA SER 2 HA SER 2 13.015 -21.045 -8.530 8 1HB SER 2 1HB SER 2 14.765 -18.725 -9.069 9 2HB SER 2 2HB SER 2 14.739 -19.821 -7.686 10 HG SER 2 HG SER 2 15.946 -21.296 -8.819 11 H MET 3 H MET 3 10.933 -20.674 -9.636 12 HA MET 3 HA MET 3 10.242 -17.855 -9.531 13 1HB MET 3 1HB MET 3 8.965 -18.041 -11.692 14 2HB MET 3 2HB MET 3 10.714 -17.983 -11.862 15 1HG MET 3 1HG MET 3 9.777 -20.700 -11.645 16 2HG MET 3 2HG MET 3 8.964 -19.847 -12.955 17 1HE MET 3 1HE MET 3 10.174 -20.335 -15.449 18 2HE MET 3 2HE MET 3 9.962 -18.714 -14.788 19 3HE MET 3 3HE MET 3 11.485 -19.161 -15.555 20 H ASN 4 H ASN 4 9.690 -19.926 -7.809 21 HA ASN 4 HA ASN 4 7.256 -21.263 -8.310 22 1HB ASN 4 1HB ASN 4 8.427 -20.642 -5.598 23 2HB ASN 4 2HB ASN 4 7.368 -21.975 -6.029 24 1HD2 ASN 4 1HD2 ASN 4 8.295 -23.858 -6.365 25 2HD2 ASN 4 2HD2 ASN 4 9.962 -24.118 -6.763 26 H ALA 5 H ALA 5 5.251 -20.579 -8.177 27 HA ALA 5 HA ALA 5 4.608 -17.885 -7.664 28 1HB ALA 5 1HB ALA 5 2.589 -20.105 -7.658 29 2HB ALA 5 2HB ALA 5 2.389 -18.430 -8.174 30 3HB ALA 5 3HB ALA 5 3.362 -19.541 -9.141 31 HA PRO 6 HA PRO 6 2.608 -19.364 -3.508 32 1HB PRO 6 1HB PRO 6 3.574 -21.670 -2.417 33 2HB PRO 6 2HB PRO 6 2.138 -21.602 -3.441 34 1HG PRO 6 1HG PRO 6 4.930 -22.384 -4.150 35 2HG PRO 6 2HG PRO 6 3.393 -23.122 -4.642 36 1HD PRO 6 1HD PRO 6 4.785 -21.468 -6.250 37 2HD PRO 6 2HD PRO 6 3.022 -21.553 -6.280 38 H ALA 7 H ALA 7 5.935 -19.893 -4.320 39 HA ALA 7 HA ALA 7 6.946 -19.218 -1.716 40 1HB ALA 7 1HB ALA 7 8.183 -19.767 -4.367 41 2HB ALA 7 2HB ALA 7 9.135 -18.956 -3.122 42 3HB ALA 7 3HB ALA 7 8.459 -20.556 -2.813 43 H ARG 8 H ARG 8 6.377 -17.601 -4.733 44 HA ARG 8 HA ARG 8 7.530 -15.110 -3.960 45 1HB ARG 8 1HB ARG 8 6.123 -16.198 -6.284 46 2HB ARG 8 2HB ARG 8 5.711 -14.520 -5.956 47 1HG ARG 8 1HG ARG 8 7.653 -13.803 -6.746 48 2HG ARG 8 2HG ARG 8 8.545 -14.939 -5.732 49 1HD ARG 8 1HD ARG 8 7.774 -16.691 -7.507 50 2HD ARG 8 2HD ARG 8 7.552 -15.271 -8.529 51 HE ARG 8 HE ARG 8 10.129 -15.790 -7.193 52 1HH1 ARG 8 2HH1 ARG 8 8.266 -15.376 -10.144 53 2HH1 ARG 8 1HH1 ARG 8 9.671 -15.134 -11.139 54 1HH2 ARG 8 2HH2 ARG 8 11.957 -15.430 -8.481 55 2HH2 ARG 8 1HH2 ARG 8 11.776 -15.153 -10.185 56 H ALA 9 H ALA 9 4.395 -16.603 -3.671 57 HA ALA 9 HA ALA 9 2.856 -14.336 -3.043 58 1HB ALA 9 1HB ALA 9 1.762 -16.386 -3.594 59 2HB ALA 9 2HB ALA 9 2.533 -17.224 -2.249 60 3HB ALA 9 3HB ALA 9 1.324 -15.978 -1.936 61 H ALA 10 H ALA 10 5.225 -16.048 -1.240 62 HA ALA 10 HA ALA 10 4.381 -15.426 1.383 63 1HB ALA 10 1HB ALA 10 6.197 -17.089 0.539 64 2HB ALA 10 2HB ALA 10 7.269 -15.699 0.687 65 3HB ALA 10 3HB ALA 10 6.395 -16.292 2.100 66 H ALA 11 H ALA 11 5.903 -13.548 -1.082 67 HA ALA 11 HA ALA 11 6.587 -11.443 0.852 68 1HB ALA 11 1HB ALA 11 8.450 -11.392 -0.376 69 2HB ALA 11 2HB ALA 11 7.712 -12.311 -1.689 70 3HB ALA 11 3HB ALA 11 7.478 -10.565 -1.593 71 H LYS 12 H LYS 12 3.978 -12.341 -0.705 72 HA LYS 12 HA LYS 12 3.215 -9.716 -1.762 73 1HB LYS 12 1HB LYS 12 2.868 -11.794 -3.135 74 2HB LYS 12 2HB LYS 12 1.701 -12.327 -1.932 75 1HG LYS 12 1HG LYS 12 0.710 -9.893 -2.466 76 2HG LYS 12 2HG LYS 12 1.465 -10.264 -4.019 77 1HD LYS 12 1HD LYS 12 0.230 -12.607 -3.505 78 2HD LYS 12 2HD LYS 12 -0.866 -11.487 -2.696 79 1HE LYS 12 2HE LYS 12 -0.085 -10.503 -5.300 80 2HE LYS 12 1HE LYS 12 -0.789 -12.114 -5.413 81 1HZ LYS 12 1HZ LYS 12 -2.807 -11.280 -5.063 82 2HZ LYS 12 2HZ LYS 12 -2.145 -9.727 -5.192 83 3HZ LYS 12 3HZ LYS 12 -2.311 -10.453 -3.669 84 H THR 13 H THR 13 2.206 -12.181 0.531 85 HA THR 13 HA THR 13 -0.215 -11.560 1.384 86 HB THR 13 HB THR 13 1.225 -11.885 3.792 87 HG1 THR 13 1HG THR 13 3.075 -12.321 2.524 88 1HG2 THR 13 1HG2 THR 13 -0.007 -13.977 1.996 89 2HG2 THR 13 2HG2 THR 13 -0.921 -12.940 3.090 90 3HG2 THR 13 3HG2 THR 13 0.248 -14.093 3.737 91 H ALA 14 H ALA 14 2.608 -9.875 2.858 92 HA ALA 14 HA ALA 14 0.966 -8.344 4.593 93 1HB ALA 14 1HB ALA 14 3.005 -8.327 5.516 94 2HB ALA 14 2HB ALA 14 3.821 -8.520 3.964 95 3HB ALA 14 3HB ALA 14 3.286 -6.923 4.488 96 H ALA 15 H ALA 15 2.586 -7.558 1.542 97 HA ALA 15 HA ALA 15 1.678 -4.862 1.475 98 1HB ALA 15 1HB ALA 15 2.443 -6.374 -0.991 99 2HB ALA 15 2HB ALA 15 2.748 -4.690 -0.568 100 3HB ALA 15 3HB ALA 15 3.661 -5.975 0.221 101 H ASP 16 H ASP 16 0.282 -7.888 0.658 102 HA ASP 16 HA ASP 16 -1.588 -6.935 -1.291 103 1HB ASP 16 1HB ASP 16 -0.670 -9.420 -0.582 104 2HB ASP 16 2HB ASP 16 -2.270 -9.402 0.154 105 H ALA 17 H ALA 17 -1.645 -7.673 2.159 106 HA ALA 17 HA ALA 17 -4.352 -7.240 2.672 107 1HB ALA 17 1HB ALA 17 -2.235 -7.897 4.199 108 2HB ALA 17 2HB ALA 17 -2.448 -6.214 4.681 109 3HB ALA 17 3HB ALA 17 -3.780 -7.357 4.861 110 H LEU 18 H LEU 18 -1.647 -4.973 2.545 111 HA LEU 18 HA LEU 18 -3.160 -2.660 3.160 112 1HB LEU 18 1HB LEU 18 -0.559 -2.899 1.647 113 2HB LEU 18 2HB LEU 18 -1.226 -1.412 2.294 114 HG LEU 18 HG LEU 18 -0.292 -3.782 3.914 115 1HD1 LEU 18 1HD1 LEU 18 0.901 -1.137 3.204 116 2HD1 LEU 18 2HD1 LEU 18 1.318 -1.922 4.730 117 3HD1 LEU 18 3HD1 LEU 18 1.641 -2.740 3.195 118 1HD2 LEU 18 1HD2 LEU 18 -2.071 -1.618 4.563 119 2HD2 LEU 18 2HD2 LEU 18 -1.562 -2.984 5.557 120 3HD2 LEU 18 3HD2 LEU 18 -0.596 -1.509 5.524 121 H ALA 19 H ALA 19 -2.216 -4.205 0.130 122 HA ALA 19 HA ALA 19 -3.112 -2.244 -1.646 123 1HB ALA 19 1HB ALA 19 -2.364 -3.681 -3.170 124 2HB ALA 19 2HB ALA 19 -1.997 -4.787 -1.844 125 3HB ALA 19 3HB ALA 19 -3.546 -4.900 -2.685 126 H ALA 20 H ALA 20 -4.825 -5.063 -0.319 127 HA ALA 20 HA ALA 20 -7.259 -4.548 -1.690 128 1HB ALA 20 1HB ALA 20 -6.878 -6.117 0.856 129 2HB ALA 20 2HB ALA 20 -8.224 -6.239 -0.277 130 3HB ALA 20 3HB ALA 20 -6.609 -6.759 -0.766 131 H ALA 21 H ALA 21 -6.115 -3.829 1.578 132 HA ALA 21 HA ALA 21 -8.402 -2.588 2.573 133 1HB ALA 21 1HB ALA 21 -6.809 -1.360 4.084 134 2HB ALA 21 2HB ALA 21 -6.642 -3.116 4.074 135 3HB ALA 21 3HB ALA 21 -5.492 -2.117 3.185 136 H LYS 22 H LYS 22 -5.522 -0.937 1.206 137 HA LYS 22 HA LYS 22 -6.546 1.595 1.012 138 1HB LYS 22 1HB LYS 22 -4.429 0.082 -0.352 139 2HB LYS 22 2HB LYS 22 -5.031 1.465 -1.253 140 1HG LYS 22 1HG LYS 22 -3.212 2.268 -0.016 141 2HG LYS 22 2HG LYS 22 -4.643 2.828 0.854 142 1HD LYS 22 1HD LYS 22 -4.342 1.301 2.579 143 2HD LYS 22 2HD LYS 22 -3.332 0.240 1.595 144 1HE LYS 22 2HE LYS 22 -1.649 1.183 2.750 145 2HE LYS 22 1HE LYS 22 -1.841 2.488 1.578 146 1HZ LYS 22 1HZ LYS 22 -2.382 2.460 4.403 147 2HZ LYS 22 2HZ LYS 22 -3.654 3.111 3.486 148 3HZ LYS 22 3HZ LYS 22 -2.094 3.770 3.365 149 H LYS 23 H LYS 23 -7.009 -1.057 -1.277 150 HA LYS 23 HA LYS 23 -8.284 0.427 -3.305 151 1HB LYS 23 1HB LYS 23 -7.401 -1.973 -3.427 152 2HB LYS 23 2HB LYS 23 -8.897 -2.450 -2.638 153 1HG LYS 23 1HG LYS 23 -9.898 -2.517 -4.608 154 2HG LYS 23 2HG LYS 23 -9.597 -0.790 -4.809 155 1HD LYS 23 1HD LYS 23 -8.590 -1.704 -6.684 156 2HD LYS 23 2HD LYS 23 -7.236 -1.532 -5.566 157 1HE LYS 23 2HE LYS 23 -7.080 -3.797 -5.196 158 2HE LYS 23 1HE LYS 23 -8.773 -4.089 -5.593 159 1HZ LYS 23 1HZ LYS 23 -8.153 -3.516 -7.948 160 2HZ LYS 23 2HZ LYS 23 -7.514 -4.967 -7.355 161 3HZ LYS 23 3HZ LYS 23 -6.528 -3.589 -7.462 162 H THR 24 H THR 24 -9.551 -1.412 -0.573 163 HA THR 24 HA THR 24 -12.269 -0.906 -0.980 164 HB THR 24 HB THR 24 -10.611 -1.645 1.404 165 HG1 THR 24 1HG THR 24 -10.857 -3.248 -0.172 166 1HG2 THR 24 1HG2 THR 24 -12.393 -1.737 2.794 167 2HG2 THR 24 2HG2 THR 24 -13.547 -1.959 1.480 168 3HG2 THR 24 3HG2 THR 24 -12.868 -0.363 1.799 169 H ALA 25 H ALA 25 -9.812 0.725 0.967 170 HA ALA 25 HA ALA 25 -11.416 2.669 2.178 171 1HB ALA 25 1HB ALA 25 -9.432 2.956 3.146 172 2HB ALA 25 2HB ALA 25 -8.585 2.215 1.788 173 3HB ALA 25 3HB ALA 25 -8.986 3.932 1.746 174 H ALA 26 H ALA 26 -9.592 2.845 -0.870 175 HA ALA 26 HA ALA 26 -10.444 5.463 -1.555 176 1HB ALA 26 1HB ALA 26 -9.192 5.203 -3.428 177 2HB ALA 26 2HB ALA 26 -8.553 3.830 -2.527 178 3HB ALA 26 3HB ALA 26 -9.806 3.581 -3.745 179 H ASP 27 H ASP 27 -11.702 2.258 -2.203 180 HA ASP 27 HA ASP 27 -13.704 2.912 -4.054 181 1HB ASP 27 1HB ASP 27 -12.839 0.595 -3.258 182 2HB ASP 27 2HB ASP 27 -14.056 0.751 -1.995 183 H ALA 28 H ALA 28 -13.892 2.544 -0.520 184 HA ALA 28 HA ALA 28 -16.615 3.173 -0.253 185 1HB ALA 28 1HB ALA 28 -15.690 2.163 1.616 186 2HB ALA 28 2HB ALA 28 -14.278 3.217 1.615 187 3HB ALA 28 3HB ALA 28 -15.842 3.842 2.138 188 H ALA 29 H ALA 29 -13.726 5.218 -0.175 189 HA ALA 29 HA ALA 29 -15.006 7.627 0.497 190 1HB ALA 29 1HB ALA 29 -12.804 8.204 -1.182 191 2HB ALA 29 2HB ALA 29 -12.881 8.260 0.580 192 3HB ALA 29 3HB ALA 29 -12.388 6.774 -0.234 193 H ALA 30 H ALA 30 -14.491 6.003 -2.576 194 HA ALA 30 HA ALA 30 -15.353 8.229 -4.173 195 1HB ALA 30 1HB ALA 30 -14.983 6.866 -6.044 196 2HB ALA 30 2HB ALA 30 -13.752 6.372 -4.882 197 3HB ALA 30 3HB ALA 30 -15.193 5.382 -5.118 198 H ALA 31 H ALA 31 -16.838 5.326 -2.862 199 HA ALA 31 HA ALA 31 -19.217 5.537 -4.428 200 1HB ALA 31 1HB ALA 31 -18.657 3.364 -3.690 201 2HB ALA 31 2HB ALA 31 -18.510 3.897 -2.015 202 3HB ALA 31 3HB ALA 31 -20.096 3.831 -2.782 203 H ALA 32 H ALA 32 -18.104 7.345 -1.945 204 HA ALA 32 HA ALA 32 -20.633 7.803 -0.600 205 1HB ALA 32 1HB ALA 32 -17.917 9.075 -0.270 206 2HB ALA 32 2HB ALA 32 -19.334 9.507 0.684 207 3HB ALA 32 3HB ALA 32 -18.672 7.876 0.778 208 H ALA 33 H ALA 33 -21.434 8.325 -2.898 209 HA ALA 33 HA ALA 33 -20.867 11.075 -3.713 210 1HB ALA 33 1HB ALA 33 -22.172 10.535 -5.714 211 2HB ALA 33 2HB ALA 33 -20.883 9.361 -5.450 212 3HB ALA 33 3HB ALA 33 -22.549 8.949 -5.043 213 H ALA 34 H ALA 34 -22.258 12.715 -3.495 214 HA ALA 34 HA ALA 34 -23.923 13.964 -2.594 215 1HB ALA 34 1HB ALA 34 -25.415 13.311 -4.221 216 2HB ALA 34 2HB ALA 34 -25.403 11.622 -3.711 217 3HB ALA 34 3HB ALA 34 -26.274 12.826 -2.760 218 H ALA 35 H ALA 35 -22.383 12.440 -0.807 219 HA ALA 35 HA ALA 35 -24.304 12.106 1.384 220 1HB ALA 35 1HB ALA 35 -21.984 10.356 1.615 221 2HB ALA 35 2HB ALA 35 -23.697 9.998 1.831 222 3HB ALA 35 3HB ALA 35 -22.991 9.981 0.218 Start of MODEL 12 1 1H GLY 1 1H GLY 1 9.631 -24.798 3.945 2 2H GLY 1 2H GLY 1 11.064 -25.679 4.163 3 3H GLY 1 3H GLY 1 9.610 -26.486 3.827 4 1HA GLY 1 2HA GLY 1 11.004 -26.399 1.865 5 2HA GLY 1 1HA GLY 1 9.511 -25.498 1.642 6 H SER 2 H SER 2 12.902 -25.120 2.600 7 HA SER 2 HA SER 2 12.947 -22.298 2.368 8 1HB SER 2 1HB SER 2 15.551 -23.316 1.945 9 2HB SER 2 2HB SER 2 14.868 -22.698 3.450 10 HG SER 2 HG SER 2 15.310 -25.308 2.631 11 H MET 3 H MET 3 13.175 -24.859 0.089 12 HA MET 3 HA MET 3 14.336 -23.153 -1.980 13 1HB MET 3 1HB MET 3 14.798 -25.716 -1.482 14 2HB MET 3 2HB MET 3 13.391 -25.935 -2.513 15 1HG MET 3 1HG MET 3 15.401 -24.101 -3.587 16 2HG MET 3 2HG MET 3 15.961 -25.757 -3.376 17 1HE MET 3 1HE MET 3 14.630 -27.912 -5.473 18 2HE MET 3 2HE MET 3 14.337 -27.613 -3.759 19 3HE MET 3 3HE MET 3 12.989 -27.614 -4.895 20 H ASN 4 H ASN 4 11.331 -23.654 -0.736 21 HA ASN 4 HA ASN 4 9.866 -24.084 -3.172 22 1HB ASN 4 1HB ASN 4 9.143 -23.706 -0.299 23 2HB ASN 4 2HB ASN 4 7.902 -23.473 -1.524 24 1HD2 ASN 4 1HD2 ASN 4 6.996 -25.214 -2.476 25 2HD2 ASN 4 2HD2 ASN 4 7.422 -26.852 -2.112 26 H ALA 5 H ALA 5 8.568 -22.685 -4.249 27 HA ALA 5 HA ALA 5 9.306 -19.926 -4.199 28 1HB ALA 5 1HB ALA 5 7.740 -19.671 -6.056 29 2HB ALA 5 2HB ALA 5 8.825 -21.041 -6.301 30 3HB ALA 5 3HB ALA 5 7.161 -21.316 -5.786 31 HA PRO 6 HA PRO 6 4.718 -19.235 -2.863 32 1HB PRO 6 1HB PRO 6 3.414 -21.314 -1.672 33 2HB PRO 6 2HB PRO 6 3.338 -20.972 -3.403 34 1HG PRO 6 1HG PRO 6 4.986 -22.979 -1.935 35 2HG PRO 6 2HG PRO 6 4.136 -23.140 -3.483 36 1HD PRO 6 1HD PRO 6 6.806 -22.718 -3.303 37 2HD PRO 6 2HD PRO 6 5.836 -22.123 -4.659 38 H ALA 7 H ALA 7 7.061 -20.954 -1.055 39 HA ALA 7 HA ALA 7 6.060 -20.511 1.554 40 1HB ALA 7 1HB ALA 7 8.504 -21.509 0.363 41 2HB ALA 7 2HB ALA 7 8.821 -20.525 1.792 42 3HB ALA 7 3HB ALA 7 7.752 -21.924 1.904 43 H ARG 8 H ARG 8 7.754 -18.572 -0.721 44 HA ARG 8 HA ARG 8 8.299 -16.467 1.224 45 1HB ARG 8 1HB ARG 8 8.983 -16.780 -1.697 46 2HB ARG 8 2HB ARG 8 9.338 -15.325 -0.777 47 1HG ARG 8 1HG ARG 8 11.196 -16.227 0.005 48 2HG ARG 8 2HG ARG 8 10.304 -17.604 0.649 49 1HD ARG 8 1HD ARG 8 10.704 -18.905 -1.196 50 2HD ARG 8 2HD ARG 8 10.864 -17.517 -2.274 51 HE ARG 8 HE ARG 8 13.017 -17.212 -0.751 52 1HH1 ARG 8 2HH1 ARG 8 11.751 -20.106 -2.279 53 2HH1 ARG 8 1HH1 ARG 8 13.324 -20.819 -2.479 54 1HH2 ARG 8 2HH2 ARG 8 15.047 -18.157 -0.993 55 2HH2 ARG 8 1HH2 ARG 8 15.194 -19.728 -1.727 56 H ALA 9 H ALA 9 5.842 -17.438 -0.811 57 HA ALA 9 HA ALA 9 4.922 -14.892 -1.736 58 1HB ALA 9 1HB ALA 9 3.256 -17.383 -1.525 59 2HB ALA 9 2HB ALA 9 3.093 -16.046 -2.667 60 3HB ALA 9 3HB ALA 9 4.460 -17.157 -2.797 61 H ALA 10 H ALA 10 4.754 -16.538 1.225 62 HA ALA 10 HA ALA 10 2.275 -15.569 2.196 63 1HB ALA 10 1HB ALA 10 3.796 -17.441 3.124 64 2HB ALA 10 2HB ALA 10 4.603 -16.132 3.989 65 3HB ALA 10 3HB ALA 10 2.887 -16.438 4.256 66 H ALA 11 H ALA 11 5.407 -14.152 1.840 67 HA ALA 11 HA ALA 11 4.960 -11.980 3.670 68 1HB ALA 11 1HB ALA 11 7.151 -13.010 2.169 69 2HB ALA 11 2HB ALA 11 6.964 -11.297 1.785 70 3HB ALA 11 3HB ALA 11 7.163 -11.810 3.462 71 H LYS 12 H LYS 12 4.180 -12.698 0.407 72 HA LYS 12 HA LYS 12 3.920 -10.044 -0.582 73 1HB LYS 12 1HB LYS 12 3.933 -12.458 -1.767 74 2HB LYS 12 2HB LYS 12 2.196 -12.198 -1.689 75 1HG LYS 12 1HG LYS 12 3.450 -9.822 -2.646 76 2HG LYS 12 2HG LYS 12 4.020 -11.205 -3.580 77 1HD LYS 12 1HD LYS 12 1.665 -11.876 -3.941 78 2HD LYS 12 2HD LYS 12 1.149 -10.411 -3.102 79 1HE LYS 12 2HE LYS 12 2.884 -9.411 -4.949 80 2HE LYS 12 1HE LYS 12 2.190 -10.774 -5.823 81 1HZ LYS 12 1HZ LYS 12 0.350 -9.613 -6.164 82 2HZ LYS 12 2HZ LYS 12 1.065 -8.271 -5.421 83 3HZ LYS 12 3HZ LYS 12 0.139 -9.350 -4.499 84 H THR 13 H THR 13 1.719 -12.343 0.917 85 HA THR 13 HA THR 13 -0.694 -11.036 0.566 86 HB THR 13 HB THR 13 -0.416 -12.343 3.165 87 HG1 THR 13 1HG THR 13 -0.114 -14.441 1.922 88 1HG2 THR 13 1HG2 THR 13 -2.042 -12.889 0.679 89 2HG2 THR 13 2HG2 THR 13 -2.571 -12.009 2.111 90 3HG2 THR 13 3HG2 THR 13 -2.235 -13.737 2.215 91 H ALA 14 H ALA 14 1.854 -10.403 2.872 92 HA ALA 14 HA ALA 14 0.406 -8.815 4.693 93 1HB ALA 14 1HB ALA 14 2.418 -8.320 5.656 94 2HB ALA 14 2HB ALA 14 2.885 -9.748 4.730 95 3HB ALA 14 3HB ALA 14 3.242 -8.136 4.108 96 H ALA 15 H ALA 15 2.582 -7.759 2.078 97 HA ALA 15 HA ALA 15 1.704 -5.083 2.051 98 1HB ALA 15 1HB ALA 15 3.368 -4.827 0.604 99 2HB ALA 15 2HB ALA 15 3.669 -6.557 0.755 100 3HB ALA 15 3HB ALA 15 2.636 -5.953 -0.539 101 H ASP 16 H ASP 16 0.494 -7.960 0.496 102 HA ASP 16 HA ASP 16 -1.149 -6.709 -1.450 103 1HB ASP 16 1HB ASP 16 -0.440 -9.310 -0.882 104 2HB ASP 16 2HB ASP 16 -2.135 -9.268 -0.405 105 H ALA 17 H ALA 17 -1.622 -7.651 1.903 106 HA ALA 17 HA ALA 17 -4.393 -7.158 2.059 107 1HB ALA 17 1HB ALA 17 -2.228 -7.682 3.912 108 2HB ALA 17 2HB ALA 17 -3.371 -6.505 4.558 109 3HB ALA 17 3HB ALA 17 -3.939 -8.089 4.035 110 H LEU 18 H LEU 18 -1.581 -5.074 2.288 111 HA LEU 18 HA LEU 18 -2.975 -2.745 3.137 112 1HB LEU 18 1HB LEU 18 -0.347 -3.085 1.698 113 2HB LEU 18 2HB LEU 18 -0.946 -1.548 2.290 114 HG LEU 18 HG LEU 18 0.018 -3.914 3.863 115 1HD1 LEU 18 1HD1 LEU 18 1.151 -1.894 5.036 116 2HD1 LEU 18 2HD1 LEU 18 1.765 -2.451 3.478 117 3HD1 LEU 18 3HD1 LEU 18 0.726 -1.029 3.558 118 1HD2 LEU 18 1HD2 LEU 18 -2.097 -2.016 4.595 119 2HD2 LEU 18 2HD2 LEU 18 -1.685 -3.583 5.291 120 3HD2 LEU 18 3HD2 LEU 18 -0.785 -2.141 5.768 121 H ALA 19 H ALA 19 -1.874 -3.921 -0.024 122 HA ALA 19 HA ALA 19 -2.877 -1.897 -1.635 123 1HB ALA 19 1HB ALA 19 -2.746 -3.412 -3.448 124 2HB ALA 19 2HB ALA 19 -1.462 -3.880 -2.332 125 3HB ALA 19 3HB ALA 19 -2.961 -4.809 -2.394 126 H ALA 20 H ALA 20 -4.500 -4.790 -0.402 127 HA ALA 20 HA ALA 20 -7.008 -4.327 -1.597 128 1HB ALA 20 1HB ALA 20 -6.281 -6.481 -0.602 129 2HB ALA 20 2HB ALA 20 -6.466 -5.764 0.999 130 3HB ALA 20 3HB ALA 20 -7.872 -5.956 -0.048 131 H ALA 21 H ALA 21 -5.724 -3.457 1.597 132 HA ALA 21 HA ALA 21 -8.054 -2.286 2.632 133 1HB ALA 21 1HB ALA 21 -5.152 -2.095 3.275 134 2HB ALA 21 2HB ALA 21 -6.277 -0.969 4.036 135 3HB ALA 21 3HB ALA 21 -6.485 -2.708 4.252 136 H LYS 22 H LYS 22 -5.392 -0.887 0.746 137 HA LYS 22 HA LYS 22 -6.289 1.800 0.971 138 1HB LYS 22 1HB LYS 22 -4.225 0.332 -0.535 139 2HB LYS 22 2HB LYS 22 -4.827 1.782 -1.328 140 1HG LYS 22 1HG LYS 22 -3.026 2.574 -0.117 141 2HG LYS 22 2HG LYS 22 -4.392 2.923 0.946 142 1HD LYS 22 1HD LYS 22 -3.878 1.145 2.385 143 2HD LYS 22 2HD LYS 22 -2.836 0.367 1.193 144 1HE LYS 22 2HE LYS 22 -1.405 1.321 2.818 145 2HE LYS 22 1HE LYS 22 -1.308 2.358 1.397 146 1HZ LYS 22 1HZ LYS 22 -1.706 3.281 3.849 147 2HZ LYS 22 2HZ LYS 22 -3.323 3.083 3.370 148 3HZ LYS 22 3HZ LYS 22 -2.279 4.065 2.461 149 H LYS 23 H LYS 23 -6.827 -0.804 -1.317 150 HA LYS 23 HA LYS 23 -8.298 0.694 -3.215 151 1HB LYS 23 1HB LYS 23 -7.275 -1.686 -3.400 152 2HB LYS 23 2HB LYS 23 -8.786 -2.220 -2.678 153 1HG LYS 23 1HG LYS 23 -9.942 -0.955 -4.553 154 2HG LYS 23 2HG LYS 23 -8.355 -0.870 -5.318 155 1HD LYS 23 1HD LYS 23 -9.248 -3.526 -4.353 156 2HD LYS 23 2HD LYS 23 -10.074 -2.868 -5.767 157 1HE LYS 23 2HE LYS 23 -8.260 -3.100 -7.091 158 2HE LYS 23 1HE LYS 23 -7.143 -2.641 -5.807 159 1HZ LYS 23 1HZ LYS 23 -7.743 -4.949 -4.850 160 2HZ LYS 23 2HZ LYS 23 -6.640 -4.849 -6.137 161 3HZ LYS 23 3HZ LYS 23 -8.252 -5.298 -6.430 162 H THR 24 H THR 24 -9.225 -1.229 -0.407 163 HA THR 24 HA THR 24 -11.984 -1.011 -0.620 164 HB THR 24 HB THR 24 -10.095 -1.471 1.653 165 HG1 THR 24 1HG THR 24 -11.790 -3.013 0.000 166 1HG2 THR 24 1HG2 THR 24 -11.650 -1.090 3.168 167 2HG2 THR 24 2HG2 THR 24 -12.720 -2.247 2.374 168 3HG2 THR 24 3HG2 THR 24 -12.747 -0.548 1.902 169 H ALA 25 H ALA 25 -9.613 1.047 1.031 170 HA ALA 25 HA ALA 25 -11.401 2.909 2.115 171 1HB ALA 25 1HB ALA 25 -9.140 2.931 2.835 172 2HB ALA 25 2HB ALA 25 -8.550 3.214 1.198 173 3HB ALA 25 3HB ALA 25 -9.443 4.477 2.045 174 H ALA 26 H ALA 26 -9.777 2.857 -1.033 175 HA ALA 26 HA ALA 26 -10.874 5.255 -2.031 176 1HB ALA 26 1HB ALA 26 -9.529 2.891 -3.191 177 2HB ALA 26 2HB ALA 26 -10.479 3.887 -4.294 178 3HB ALA 26 3HB ALA 26 -9.161 4.606 -3.368 179 H ASP 27 H ASP 27 -11.974 1.911 -2.165 180 HA ASP 27 HA ASP 27 -14.233 2.203 -3.764 181 1HB ASP 27 1HB ASP 27 -13.148 0.081 -2.728 182 2HB ASP 27 2HB ASP 27 -14.204 0.393 -1.357 183 H ALA 28 H ALA 28 -13.944 2.443 -0.230 184 HA ALA 28 HA ALA 28 -16.638 3.127 0.252 185 1HB ALA 28 1HB ALA 28 -14.133 3.078 1.791 186 2HB ALA 28 2HB ALA 28 -15.338 4.233 2.359 187 3HB ALA 28 3HB ALA 28 -15.749 2.523 2.227 188 H ALA 29 H ALA 29 -13.795 5.053 -0.491 189 HA ALA 29 HA ALA 29 -14.916 7.590 0.090 190 1HB ALA 29 1HB ALA 29 -12.501 6.572 -1.224 191 2HB ALA 29 2HB ALA 29 -13.062 8.130 -1.830 192 3HB ALA 29 3HB ALA 29 -12.706 7.927 -0.114 193 H ALA 30 H ALA 30 -14.805 5.607 -2.836 194 HA ALA 30 HA ALA 30 -16.064 7.589 -4.483 195 1HB ALA 30 1HB ALA 30 -14.826 5.048 -4.851 196 2HB ALA 30 2HB ALA 30 -16.408 5.036 -5.631 197 3HB ALA 30 3HB ALA 30 -15.225 6.276 -6.053 198 H ALA 31 H ALA 31 -17.159 5.209 -2.272 199 HA ALA 31 HA ALA 31 -19.806 4.933 -3.286 200 1HB ALA 31 1HB ALA 31 -18.501 4.242 -0.683 201 2HB ALA 31 2HB ALA 31 -20.247 4.098 -0.887 202 3HB ALA 31 3HB ALA 31 -19.158 3.165 -1.915 203 H ALA 32 H ALA 32 -18.184 7.317 -1.625 204 HA ALA 32 HA ALA 32 -20.638 8.556 -0.608 205 1HB ALA 32 1HB ALA 32 -18.308 8.257 0.669 206 2HB ALA 32 2HB ALA 32 -18.007 9.814 -0.101 207 3HB ALA 32 3HB ALA 32 -19.396 9.612 0.969 208 H ALA 33 H ALA 33 -20.358 8.479 -3.358 209 HA ALA 33 HA ALA 33 -19.156 10.796 -4.462 210 1HB ALA 33 1HB ALA 33 -21.468 9.785 -5.929 211 2HB ALA 33 2HB ALA 33 -19.778 9.904 -6.420 212 3HB ALA 33 3HB ALA 33 -20.325 8.518 -5.476 213 H ALA 34 H ALA 34 -22.508 10.000 -3.607 214 HA ALA 34 HA ALA 34 -23.110 12.885 -3.609 215 1HB ALA 34 1HB ALA 34 -25.362 10.996 -3.484 216 2HB ALA 34 2HB ALA 34 -25.156 12.456 -4.452 217 3HB ALA 34 3HB ALA 34 -24.420 10.944 -4.973 218 H ALA 35 H ALA 35 -21.852 12.565 -1.488 219 HA ALA 35 HA ALA 35 -23.563 11.577 0.668 220 1HB ALA 35 1HB ALA 35 -21.106 12.576 1.675 221 2HB ALA 35 2HB ALA 35 -21.649 10.902 1.569 222 3HB ALA 35 3HB ALA 35 -20.751 11.622 0.235 Start of MODEL 13 1 1H GLY 1 1H GLY 1 9.967 -26.271 -4.178 2 2H GLY 1 2H GLY 1 9.344 -26.157 -2.602 3 3H GLY 1 3H GLY 1 10.773 -27.023 -2.888 4 1HA GLY 1 2HA GLY 1 11.362 -24.940 -1.930 5 2HA GLY 1 1HA GLY 1 11.851 -24.947 -3.621 6 H SER 2 H SER 2 11.824 -22.632 -3.521 7 HA SER 2 HA SER 2 9.417 -21.218 -2.924 8 1HB SER 2 1HB SER 2 11.501 -19.856 -4.515 9 2HB SER 2 2HB SER 2 10.719 -19.356 -3.015 10 HG SER 2 HG SER 2 12.251 -20.274 -1.888 11 H MET 3 H MET 3 8.082 -22.521 -4.427 12 HA MET 3 HA MET 3 8.074 -21.287 -7.101 13 1HB MET 3 1HB MET 3 8.797 -23.611 -7.291 14 2HB MET 3 2HB MET 3 7.379 -24.145 -6.398 15 1HG MET 3 1HG MET 3 6.282 -22.712 -8.461 16 2HG MET 3 2HG MET 3 7.678 -23.479 -9.215 17 1HE MET 3 1HE MET 3 8.264 -25.988 -8.671 18 2HE MET 3 2HE MET 3 7.028 -27.186 -9.064 19 3HE MET 3 3HE MET 3 7.454 -25.942 -10.238 20 H ASN 4 H ASN 4 6.100 -22.937 -4.646 21 HA ASN 4 HA ASN 4 3.633 -22.057 -5.808 22 1HB ASN 4 1HB ASN 4 2.780 -22.842 -3.452 23 2HB ASN 4 2HB ASN 4 3.297 -24.024 -4.649 24 1HD2 ASN 4 1HD2 ASN 4 5.098 -25.226 -4.282 25 2HD2 ASN 4 2HD2 ASN 4 5.945 -25.224 -2.767 26 H ALA 5 H ALA 5 1.993 -20.932 -4.292 27 HA ALA 5 HA ALA 5 2.893 -18.292 -3.934 28 1HB ALA 5 1HB ALA 5 0.370 -19.735 -3.572 29 2HB ALA 5 2HB ALA 5 0.568 -18.330 -2.521 30 3HB ALA 5 3HB ALA 5 0.688 -18.147 -4.272 31 HA PRO 6 HA PRO 6 2.584 -19.225 0.951 32 1HB PRO 6 1HB PRO 6 3.469 -22.064 0.650 33 2HB PRO 6 2HB PRO 6 2.469 -21.327 1.902 34 1HG PRO 6 1HG PRO 6 1.337 -22.770 0.005 35 2HG PRO 6 2HG PRO 6 0.584 -21.252 0.532 36 1HD PRO 6 1HD PRO 6 2.150 -21.832 -1.941 37 2HD PRO 6 2HD PRO 6 0.742 -20.782 -1.715 38 H ALA 7 H ALA 7 4.800 -20.819 -1.269 39 HA ALA 7 HA ALA 7 7.119 -20.622 0.330 40 1HB ALA 7 1HB ALA 7 7.682 -22.047 -1.286 41 2HB ALA 7 2HB ALA 7 6.487 -21.387 -2.402 42 3HB ALA 7 3HB ALA 7 8.065 -20.615 -2.242 43 H ARG 8 H ARG 8 5.410 -18.249 -1.387 44 HA ARG 8 HA ARG 8 7.626 -16.356 -0.982 45 1HB ARG 8 1HB ARG 8 5.736 -15.440 -2.970 46 2HB ARG 8 2HB ARG 8 7.487 -15.581 -3.076 47 1HG ARG 8 1HG ARG 8 7.358 -17.444 -4.277 48 2HG ARG 8 2HG ARG 8 6.135 -18.136 -3.215 49 1HD ARG 8 1HD ARG 8 4.382 -17.039 -4.355 50 2HD ARG 8 2HD ARG 8 5.504 -15.975 -5.200 51 HE ARG 8 HE ARG 8 5.480 -18.872 -5.724 52 1HH1 ARG 8 2HH1 ARG 8 5.247 -15.562 -6.837 53 2HH1 ARG 8 1HH1 ARG 8 5.197 -15.994 -8.515 54 1HH2 ARG 8 2HH2 ARG 8 5.440 -19.443 -7.943 55 2HH2 ARG 8 1HH2 ARG 8 5.316 -18.188 -9.148 56 H ALA 9 H ALA 9 5.208 -17.215 0.617 57 HA ALA 9 HA ALA 9 3.467 -14.889 0.519 58 1HB ALA 9 1HB ALA 9 3.301 -17.606 1.644 59 2HB ALA 9 2HB ALA 9 2.475 -16.343 2.557 60 3HB ALA 9 3HB ALA 9 2.065 -16.617 0.864 61 H ALA 10 H ALA 10 6.328 -14.919 1.606 62 HA ALA 10 HA ALA 10 6.217 -14.504 4.390 63 1HB ALA 10 1HB ALA 10 8.257 -14.894 2.849 64 2HB ALA 10 2HB ALA 10 8.233 -13.142 2.652 65 3HB ALA 10 3HB ALA 10 8.436 -13.847 4.258 66 H ALA 11 H ALA 11 6.759 -12.012 1.889 67 HA ALA 11 HA ALA 11 5.470 -10.084 3.709 68 1HB ALA 11 1HB ALA 11 7.179 -9.129 1.482 69 2HB ALA 11 2HB ALA 11 6.982 -8.492 3.115 70 3HB ALA 11 3HB ALA 11 7.977 -9.924 2.841 71 H LYS 12 H LYS 12 5.214 -11.624 0.685 72 HA LYS 12 HA LYS 12 3.983 -9.721 -0.922 73 1HB LYS 12 1HB LYS 12 4.512 -12.471 -1.069 74 2HB LYS 12 2HB LYS 12 2.776 -12.319 -1.304 75 1HG LYS 12 1HG LYS 12 4.437 -10.425 -2.827 76 2HG LYS 12 2HG LYS 12 4.582 -12.123 -3.285 77 1HD LYS 12 1HD LYS 12 2.740 -11.821 -4.509 78 2HD LYS 12 2HD LYS 12 1.855 -11.739 -2.985 79 1HE LYS 12 2HE LYS 12 2.088 -9.337 -2.930 80 2HE LYS 12 1HE LYS 12 3.096 -9.371 -4.376 81 1HZ LYS 12 1HZ LYS 12 1.077 -10.458 -5.470 82 2HZ LYS 12 2HZ LYS 12 1.001 -8.796 -5.151 83 3HZ LYS 12 3HZ LYS 12 0.195 -9.890 -4.134 84 H THR 13 H THR 13 2.321 -12.222 0.997 85 HA THR 13 HA THR 13 -0.275 -11.340 0.651 86 HB THR 13 HB THR 13 0.069 -12.399 3.298 87 HG1 THR 13 1HG THR 13 1.660 -13.759 3.008 88 1HG2 THR 13 1HG2 THR 13 -0.926 -14.438 1.888 89 2HG2 THR 13 2HG2 THR 13 -1.210 -13.140 0.729 90 3HG2 THR 13 3HG2 THR 13 -1.898 -13.042 2.348 91 H ALA 14 H ALA 14 2.166 -10.274 2.909 92 HA ALA 14 HA ALA 14 0.468 -8.808 4.642 93 1HB ALA 14 1HB ALA 14 2.513 -7.752 5.456 94 2HB ALA 14 2HB ALA 14 2.716 -9.498 5.312 95 3HB ALA 14 3HB ALA 14 3.412 -8.424 4.094 96 H ALA 15 H ALA 15 2.594 -7.776 1.975 97 HA ALA 15 HA ALA 15 1.678 -5.093 1.949 98 1HB ALA 15 1HB ALA 15 3.676 -6.538 0.678 99 2HB ALA 15 2HB ALA 15 2.612 -6.021 -0.630 100 3HB ALA 15 3HB ALA 15 3.314 -4.826 0.460 101 H ASP 16 H ASP 16 0.531 -8.038 0.468 102 HA ASP 16 HA ASP 16 -1.169 -6.856 -1.463 103 1HB ASP 16 1HB ASP 16 -0.426 -9.488 -0.580 104 2HB ASP 16 2HB ASP 16 -2.179 -9.384 -0.676 105 H ALA 17 H ALA 17 -1.405 -7.480 1.921 106 HA ALA 17 HA ALA 17 -4.234 -7.342 2.163 107 1HB ALA 17 1HB ALA 17 -2.224 -8.048 3.847 108 2HB ALA 17 2HB ALA 17 -2.654 -6.457 4.473 109 3HB ALA 17 3HB ALA 17 -3.882 -7.718 4.353 110 H LEU 18 H LEU 18 -1.619 -4.970 2.434 111 HA LEU 18 HA LEU 18 -3.322 -2.804 3.147 112 1HB LEU 18 1HB LEU 18 -0.847 -2.162 1.675 113 2HB LEU 18 2HB LEU 18 -1.474 -1.491 3.164 114 HG LEU 18 HG LEU 18 -0.312 -4.246 3.157 115 1HD1 LEU 18 1HD1 LEU 18 1.093 -1.664 2.818 116 2HD1 LEU 18 2HD1 LEU 18 1.801 -2.854 3.915 117 3HD1 LEU 18 3HD1 LEU 18 1.513 -3.269 2.226 118 1HD2 LEU 18 1HD2 LEU 18 -1.179 -3.856 5.236 119 2HD2 LEU 18 2HD2 LEU 18 0.432 -3.168 5.455 120 3HD2 LEU 18 3HD2 LEU 18 -0.942 -2.110 5.127 121 H ALA 19 H ALA 19 -2.078 -4.082 0.112 122 HA ALA 19 HA ALA 19 -3.020 -2.195 -1.673 123 1HB ALA 19 1HB ALA 19 -2.073 -4.852 -1.829 124 2HB ALA 19 2HB ALA 19 -3.580 -4.784 -2.743 125 3HB ALA 19 3HB ALA 19 -2.260 -3.682 -3.136 126 H ALA 20 H ALA 20 -4.781 -4.949 -0.265 127 HA ALA 20 HA ALA 20 -7.271 -4.353 -1.467 128 1HB ALA 20 1HB ALA 20 -8.210 -5.928 0.095 129 2HB ALA 20 2HB ALA 20 -6.671 -6.552 -0.499 130 3HB ALA 20 3HB ALA 20 -6.770 -5.835 1.108 131 H ALA 21 H ALA 21 -5.853 -3.515 1.675 132 HA ALA 21 HA ALA 21 -8.078 -2.210 2.776 133 1HB ALA 21 1HB ALA 21 -5.725 -0.907 3.675 134 2HB ALA 21 2HB ALA 21 -6.697 -2.118 4.507 135 3HB ALA 21 3HB ALA 21 -5.357 -2.621 3.476 136 H LYS 22 H LYS 22 -5.473 -0.998 0.708 137 HA LYS 22 HA LYS 22 -6.311 1.731 0.849 138 1HB LYS 22 1HB LYS 22 -4.253 0.173 -0.539 139 2HB LYS 22 2HB LYS 22 -4.879 1.504 -1.497 140 1HG LYS 22 1HG LYS 22 -2.815 1.829 0.070 141 2HG LYS 22 2HG LYS 22 -4.027 3.100 -0.101 142 1HD LYS 22 1HD LYS 22 -4.039 3.070 2.150 143 2HD LYS 22 2HD LYS 22 -5.061 1.648 1.952 144 1HE LYS 22 2HE LYS 22 -3.179 1.339 3.550 145 2HE LYS 22 1HE LYS 22 -3.201 0.180 2.222 146 1HZ LYS 22 1HZ LYS 22 -1.019 1.436 2.936 147 2HZ LYS 22 2HZ LYS 22 -1.619 2.616 1.874 148 3HZ LYS 22 3HZ LYS 22 -1.326 1.041 1.315 149 H LYS 23 H LYS 23 -6.828 -0.931 -1.368 150 HA LYS 23 HA LYS 23 -8.253 0.400 -3.378 151 1HB LYS 23 1HB LYS 23 -7.359 -2.018 -3.332 152 2HB LYS 23 2HB LYS 23 -8.848 -2.418 -2.491 153 1HG LYS 23 1HG LYS 23 -10.036 -1.322 -4.484 154 2HG LYS 23 2HG LYS 23 -8.479 -1.465 -5.302 155 1HD LYS 23 1HD LYS 23 -9.231 -3.502 -5.890 156 2HD LYS 23 2HD LYS 23 -8.746 -3.956 -4.254 157 1HE LYS 23 2HE LYS 23 -11.186 -3.058 -3.707 158 2HE LYS 23 1HE LYS 23 -11.452 -3.507 -5.391 159 1HZ LYS 23 1HZ LYS 23 -11.167 -5.709 -4.950 160 2HZ LYS 23 2HZ LYS 23 -11.797 -5.218 -3.453 161 3HZ LYS 23 3HZ LYS 23 -10.125 -5.450 -3.636 162 H THR 24 H THR 24 -9.292 -1.147 -0.397 163 HA THR 24 HA THR 24 -12.038 -0.764 -0.650 164 HB THR 24 HB THR 24 -10.292 -0.991 1.773 165 HG1 THR 24 1HG THR 24 -10.059 -2.851 0.621 166 1HG2 THR 24 1HG2 THR 24 -12.627 -0.071 2.059 167 2HG2 THR 24 2HG2 THR 24 -12.176 -1.463 3.043 168 3HG2 THR 24 3HG2 THR 24 -13.185 -1.680 1.614 169 H ALA 25 H ALA 25 -9.529 1.154 0.992 170 HA ALA 25 HA ALA 25 -11.114 3.117 2.135 171 1HB ALA 25 1HB ALA 25 -9.172 4.131 2.657 172 2HB ALA 25 2HB ALA 25 -8.445 2.658 2.014 173 3HB ALA 25 3HB ALA 25 -8.585 4.091 0.995 174 H ALA 26 H ALA 26 -9.620 3.089 -1.069 175 HA ALA 26 HA ALA 26 -10.704 5.547 -1.945 176 1HB ALA 26 1HB ALA 26 -10.220 4.545 -4.259 177 2HB ALA 26 2HB ALA 26 -8.863 4.789 -3.160 178 3HB ALA 26 3HB ALA 26 -9.548 3.178 -3.371 179 H ASP 27 H ASP 27 -11.804 2.214 -2.227 180 HA ASP 27 HA ASP 27 -13.979 2.630 -3.948 181 1HB ASP 27 1HB ASP 27 -12.902 0.413 -3.087 182 2HB ASP 27 2HB ASP 27 -14.064 0.566 -1.775 183 H ALA 28 H ALA 28 -13.815 2.547 -0.415 184 HA ALA 28 HA ALA 28 -16.575 2.793 0.053 185 1HB ALA 28 1HB ALA 28 -14.697 3.939 2.036 186 2HB ALA 28 2HB ALA 28 -16.047 2.828 2.261 187 3HB ALA 28 3HB ALA 28 -14.512 2.233 1.631 188 H ALA 29 H ALA 29 -14.056 5.195 -0.413 189 HA ALA 29 HA ALA 29 -15.665 7.427 0.355 190 1HB ALA 29 1HB ALA 29 -12.956 6.974 -0.571 191 2HB ALA 29 2HB ALA 29 -13.673 8.411 -1.298 192 3HB ALA 29 3HB ALA 29 -13.599 8.254 0.457 193 H ALA 30 H ALA 30 -14.911 5.825 -2.692 194 HA ALA 30 HA ALA 30 -16.141 7.856 -4.306 195 1HB ALA 30 1HB ALA 30 -15.921 5.832 -6.019 196 2HB ALA 30 2HB ALA 30 -14.547 6.832 -5.550 197 3HB ALA 30 3HB ALA 30 -14.797 5.264 -4.786 198 H ALA 31 H ALA 31 -17.077 4.723 -3.021 199 HA ALA 31 HA ALA 31 -19.620 4.802 -4.436 200 1HB ALA 31 1HB ALA 31 -17.952 2.756 -3.415 201 2HB ALA 31 2HB ALA 31 -19.501 2.655 -2.575 202 3HB ALA 31 3HB ALA 31 -19.447 2.593 -4.337 203 H ALA 32 H ALA 32 -18.742 6.602 -2.079 204 HA ALA 32 HA ALA 32 -20.915 6.005 -0.219 205 1HB ALA 32 1HB ALA 32 -19.947 7.719 1.203 206 2HB ALA 32 2HB ALA 32 -18.703 6.572 0.704 207 3HB ALA 32 3HB ALA 32 -18.803 8.157 -0.065 208 H ALA 33 H ALA 33 -22.193 6.527 -2.375 209 HA ALA 33 HA ALA 33 -22.610 9.212 -3.102 210 1HB ALA 33 1HB ALA 33 -24.774 7.140 -3.230 211 2HB ALA 33 2HB ALA 33 -24.442 8.466 -4.342 212 3HB ALA 33 3HB ALA 33 -23.372 7.063 -4.296 213 H ALA 34 H ALA 34 -24.749 7.131 -1.179 214 HA ALA 34 HA ALA 34 -25.293 9.414 0.587 215 1HB ALA 34 1HB ALA 34 -27.166 9.066 -1.035 216 2HB ALA 34 2HB ALA 34 -27.408 7.474 -0.322 217 3HB ALA 34 3HB ALA 34 -27.629 8.920 0.660 218 H ALA 35 H ALA 35 -23.438 7.949 1.464 219 HA ALA 35 HA ALA 35 -24.534 5.692 2.985 220 1HB ALA 35 1HB ALA 35 -21.647 6.117 3.132 221 2HB ALA 35 2HB ALA 35 -22.564 4.656 2.767 222 3HB ALA 35 3HB ALA 35 -22.243 5.836 1.497 Start of MODEL 14 1 1H GLY 1 1H GLY 1 24.050 -10.138 11.215 2 2H GLY 1 2H GLY 1 24.069 -10.637 9.594 3 3H GLY 1 3H GLY 1 22.620 -10.643 10.466 4 1HA GLY 1 2HA GLY 1 23.568 -8.065 10.667 5 2HA GLY 1 1HA GLY 1 23.801 -8.536 8.988 6 H SER 2 H SER 2 22.116 -6.590 9.208 7 HA SER 2 HA SER 2 19.413 -7.422 9.708 8 1HB SER 2 1HB SER 2 19.686 -4.934 8.227 9 2HB SER 2 2HB SER 2 19.074 -5.207 9.862 10 HG SER 2 HG SER 2 21.241 -3.979 9.325 11 H MET 3 H MET 3 20.161 -9.211 7.934 12 HA MET 3 HA MET 3 18.667 -8.450 5.545 13 1HB MET 3 1HB MET 3 21.486 -8.854 5.573 14 2HB MET 3 2HB MET 3 20.758 -10.214 4.729 15 1HG MET 3 1HG MET 3 19.447 -8.437 3.426 16 2HG MET 3 2HG MET 3 20.647 -7.307 4.049 17 1HE MET 3 1HE MET 3 20.994 -9.536 0.286 18 2HE MET 3 2HE MET 3 19.830 -10.086 1.493 19 3HE MET 3 3HE MET 3 19.813 -8.406 0.951 20 H ASN 4 H ASN 4 17.220 -9.704 7.110 21 HA ASN 4 HA ASN 4 17.635 -12.586 6.993 22 1HB ASN 4 1HB ASN 4 15.165 -12.173 8.186 23 2HB ASN 4 2HB ASN 4 16.686 -12.451 9.023 24 1HD2 ASN 4 1HD2 ASN 4 16.670 -11.174 10.719 25 2HD2 ASN 4 2HD2 ASN 4 16.317 -9.475 10.703 26 H ALA 5 H ALA 5 17.059 -13.529 5.182 27 HA ALA 5 HA ALA 5 15.340 -12.494 3.253 28 1HB ALA 5 1HB ALA 5 17.113 -14.389 3.107 29 2HB ALA 5 2HB ALA 5 15.746 -15.439 3.477 30 3HB ALA 5 3HB ALA 5 15.706 -14.415 2.041 31 HA PRO 6 HA PRO 6 11.927 -15.596 4.817 32 1HB PRO 6 1HB PRO 6 11.988 -16.163 7.496 33 2HB PRO 6 2HB PRO 6 12.687 -17.200 6.252 34 1HG PRO 6 1HG PRO 6 14.026 -15.211 8.031 35 2HG PRO 6 2HG PRO 6 14.561 -16.835 7.557 36 1HD PRO 6 1HD PRO 6 15.560 -14.628 6.406 37 2HD PRO 6 2HD PRO 6 15.310 -16.116 5.488 38 H ALA 7 H ALA 7 13.237 -13.058 6.796 39 HA ALA 7 HA ALA 7 10.764 -12.321 8.029 40 1HB ALA 7 1HB ALA 7 11.970 -10.832 9.227 41 2HB ALA 7 2HB ALA 7 13.327 -11.792 8.634 42 3HB ALA 7 3HB ALA 7 12.889 -10.288 7.822 43 H ARG 8 H ARG 8 12.240 -11.700 5.025 44 HA ARG 8 HA ARG 8 10.539 -9.386 4.494 45 1HB ARG 8 1HB ARG 8 13.031 -10.484 3.305 46 2HB ARG 8 2HB ARG 8 11.943 -9.593 2.241 47 1HG ARG 8 1HG ARG 8 12.726 -7.682 3.032 48 2HG ARG 8 2HG ARG 8 12.203 -8.138 4.653 49 1HD ARG 8 1HD ARG 8 14.508 -9.611 4.261 50 2HD ARG 8 2HD ARG 8 14.873 -8.050 3.524 51 HE ARG 8 HE ARG 8 13.808 -8.219 6.262 52 1HH1 ARG 8 2HH1 ARG 8 16.354 -7.257 4.050 53 2HH1 ARG 8 1HH1 ARG 8 17.140 -6.249 5.225 54 1HH2 ARG 8 2HH2 ARG 8 14.825 -6.902 7.783 55 2HH2 ARG 8 1HH2 ARG 8 16.265 -6.021 7.343 56 H ALA 9 H ALA 9 10.155 -12.590 4.373 57 HA ALA 9 HA ALA 9 9.036 -12.854 1.727 58 1HB ALA 9 1HB ALA 9 9.784 -14.903 2.302 59 2HB ALA 9 2HB ALA 9 9.522 -14.637 4.024 60 3HB ALA 9 3HB ALA 9 8.163 -15.059 2.982 61 H ALA 10 H ALA 10 7.912 -12.111 4.923 62 HA ALA 10 HA ALA 10 5.151 -12.662 4.474 63 1HB ALA 10 1HB ALA 10 4.773 -11.834 6.612 64 2HB ALA 10 2HB ALA 10 6.426 -12.440 6.712 65 3HB ALA 10 3HB ALA 10 6.131 -10.711 6.525 66 H ALA 11 H ALA 11 7.211 -10.204 3.430 67 HA ALA 11 HA ALA 11 5.567 -7.942 3.415 68 1HB ALA 11 1HB ALA 11 8.066 -8.193 2.839 69 2HB ALA 11 2HB ALA 11 7.497 -8.533 1.205 70 3HB ALA 11 3HB ALA 11 7.115 -6.989 1.967 71 H LYS 12 H LYS 12 5.580 -10.782 1.417 72 HA LYS 12 HA LYS 12 4.121 -9.801 -0.782 73 1HB LYS 12 1HB LYS 12 5.269 -12.207 -0.113 74 2HB LYS 12 2HB LYS 12 3.554 -12.579 -0.027 75 1HG LYS 12 1HG LYS 12 4.333 -11.074 -2.413 76 2HG LYS 12 2HG LYS 12 5.063 -12.675 -2.284 77 1HD LYS 12 1HD LYS 12 3.156 -13.618 -2.916 78 2HD LYS 12 2HD LYS 12 2.310 -12.861 -1.566 79 1HE LYS 12 2HE LYS 12 1.290 -11.428 -2.928 80 2HE LYS 12 1HE LYS 12 2.827 -10.935 -3.637 81 1HZ LYS 12 1HZ LYS 12 1.269 -13.333 -4.446 82 2HZ LYS 12 2HZ LYS 12 2.712 -12.787 -5.155 83 3HZ LYS 12 3HZ LYS 12 1.300 -11.857 -5.283 84 H THR 13 H THR 13 3.058 -11.407 2.190 85 HA THR 13 HA THR 13 0.285 -11.216 1.601 86 HB THR 13 HB THR 13 1.146 -11.565 4.413 87 HG1 THR 13 1HG THR 13 1.768 -13.521 2.418 88 1HG2 THR 13 1HG2 THR 13 -1.125 -12.077 2.996 89 2HG2 THR 13 2HG2 THR 13 -0.704 -12.854 4.524 90 3HG2 THR 13 3HG2 THR 13 -0.353 -13.662 2.996 91 H ALA 14 H ALA 14 2.628 -9.286 3.360 92 HA ALA 14 HA ALA 14 0.811 -7.561 4.665 93 1HB ALA 14 1HB ALA 14 3.655 -7.730 4.291 94 2HB ALA 14 2HB ALA 14 3.110 -6.066 4.077 95 3HB ALA 14 3HB ALA 14 2.741 -6.929 5.571 96 H ALA 15 H ALA 15 2.661 -7.121 1.638 97 HA ALA 15 HA ALA 15 1.292 -4.764 0.852 98 1HB ALA 15 1HB ALA 15 2.961 -4.749 -0.619 99 2HB ALA 15 2HB ALA 15 3.384 -6.405 -0.187 100 3HB ALA 15 3HB ALA 15 2.209 -6.100 -1.465 101 H ASP 16 H ASP 16 0.584 -8.121 0.637 102 HA ASP 16 HA ASP 16 -1.405 -8.136 -1.357 103 1HB ASP 16 1HB ASP 16 -0.304 -10.142 -0.169 104 2HB ASP 16 2HB ASP 16 -1.420 -9.818 1.149 105 H ALA 17 H ALA 17 -1.678 -7.993 2.165 106 HA ALA 17 HA ALA 17 -4.454 -7.521 2.235 107 1HB ALA 17 1HB ALA 17 -3.134 -8.395 4.132 108 2HB ALA 17 2HB ALA 17 -2.410 -6.800 4.328 109 3HB ALA 17 3HB ALA 17 -4.142 -7.017 4.576 110 H LEU 18 H LEU 18 -1.670 -5.365 2.193 111 HA LEU 18 HA LEU 18 -3.036 -2.971 2.746 112 1HB LEU 18 1HB LEU 18 -0.464 -3.515 1.275 113 2HB LEU 18 2HB LEU 18 -1.051 -1.894 1.596 114 HG LEU 18 HG LEU 18 -0.196 -3.962 3.613 115 1HD1 LEU 18 1HD1 LEU 18 0.920 -1.436 2.525 116 2HD1 LEU 18 2HD1 LEU 18 1.214 -1.821 4.221 117 3HD1 LEU 18 3HD1 LEU 18 1.733 -2.940 2.959 118 1HD2 LEU 18 1HD2 LEU 18 -1.739 -1.420 3.959 119 2HD2 LEU 18 2HD2 LEU 18 -2.000 -2.996 4.706 120 3HD2 LEU 18 3HD2 LEU 18 -0.646 -1.989 5.221 121 H ALA 19 H ALA 19 -2.194 -4.518 -0.343 122 HA ALA 19 HA ALA 19 -3.073 -2.527 -2.067 123 1HB ALA 19 1HB ALA 19 -2.272 -4.016 -3.504 124 2HB ALA 19 2HB ALA 19 -2.317 -5.279 -2.274 125 3HB ALA 19 3HB ALA 19 -3.733 -4.979 -3.281 126 H ALA 20 H ALA 20 -4.881 -5.219 -0.644 127 HA ALA 20 HA ALA 20 -7.348 -4.556 -1.888 128 1HB ALA 20 1HB ALA 20 -7.978 -6.526 -1.070 129 2HB ALA 20 2HB ALA 20 -6.357 -6.683 -0.396 130 3HB ALA 20 3HB ALA 20 -7.659 -6.013 0.586 131 H ALA 21 H ALA 21 -6.073 -4.034 1.396 132 HA ALA 21 HA ALA 21 -8.400 -2.907 2.477 133 1HB ALA 21 1HB ALA 21 -5.878 -1.913 3.597 134 2HB ALA 21 2HB ALA 21 -7.220 -2.750 4.378 135 3HB ALA 21 3HB ALA 21 -6.007 -3.668 3.487 136 H LYS 22 H LYS 22 -5.598 -1.345 0.934 137 HA LYS 22 HA LYS 22 -6.466 1.298 1.529 138 1HB LYS 22 1HB LYS 22 -4.299 0.042 -0.030 139 2HB LYS 22 2HB LYS 22 -4.806 1.630 -0.591 140 1HG LYS 22 1HG LYS 22 -3.222 2.277 0.887 141 2HG LYS 22 2HG LYS 22 -4.595 2.190 1.996 142 1HD LYS 22 1HD LYS 22 -3.799 -0.306 2.258 143 2HD LYS 22 2HD LYS 22 -2.263 0.355 1.695 144 1HE LYS 22 2HE LYS 22 -3.811 1.536 3.988 145 2HE LYS 22 1HE LYS 22 -2.595 0.276 4.201 146 1HZ LYS 22 1HZ LYS 22 -1.152 1.947 4.336 147 2HZ LYS 22 2HZ LYS 22 -2.253 3.083 3.718 148 3HZ LYS 22 3HZ LYS 22 -1.335 2.127 2.660 149 H LYS 23 H LYS 23 -7.051 -0.968 -1.026 150 HA LYS 23 HA LYS 23 -8.051 0.845 -2.962 151 1HB LYS 23 1HB LYS 23 -7.302 -1.441 -3.515 152 2HB LYS 23 2HB LYS 23 -8.636 -2.104 -2.588 153 1HG LYS 23 1HG LYS 23 -8.971 -2.089 -5.059 154 2HG LYS 23 2HG LYS 23 -10.236 -1.278 -4.135 155 1HD LYS 23 1HD LYS 23 -9.180 0.890 -4.629 156 2HD LYS 23 2HD LYS 23 -7.952 0.058 -5.587 157 1HE LYS 23 2HE LYS 23 -9.353 0.508 -7.291 158 2HE LYS 23 1HE LYS 23 -10.180 -0.937 -6.714 159 1HZ LYS 23 1HZ LYS 23 -11.756 0.373 -5.552 160 2HZ LYS 23 2HZ LYS 23 -11.636 1.033 -7.105 161 3HZ LYS 23 3HZ LYS 23 -10.874 1.802 -5.800 162 H THR 24 H THR 24 -9.640 -1.351 -0.678 163 HA THR 24 HA THR 24 -12.251 -0.590 -1.138 164 HB THR 24 HB THR 24 -11.244 -1.368 1.556 165 HG1 THR 24 1HG THR 24 -10.760 -3.345 0.837 166 1HG2 THR 24 1HG2 THR 24 -13.398 -2.872 0.940 167 2HG2 THR 24 2HG2 THR 24 -13.731 -1.382 0.059 168 3HG2 THR 24 3HG2 THR 24 -13.454 -1.332 1.798 169 H ALA 25 H ALA 25 -9.962 0.660 1.287 170 HA ALA 25 HA ALA 25 -11.587 2.528 2.530 171 1HB ALA 25 1HB ALA 25 -9.396 3.840 2.831 172 2HB ALA 25 2HB ALA 25 -9.486 2.208 3.497 173 3HB ALA 25 3HB ALA 25 -8.638 2.495 1.976 174 H ALA 26 H ALA 26 -9.805 2.778 -0.474 175 HA ALA 26 HA ALA 26 -10.517 5.525 -0.946 176 1HB ALA 26 1HB ALA 26 -9.703 4.862 -3.336 177 2HB ALA 26 2HB ALA 26 -8.544 4.983 -2.012 178 3HB ALA 26 3HB ALA 26 -9.134 3.404 -2.527 179 H ASP 27 H ASP 27 -11.670 2.384 -1.959 180 HA ASP 27 HA ASP 27 -13.484 3.086 -3.941 181 1HB ASP 27 1HB ASP 27 -12.701 0.776 -2.604 182 2HB ASP 27 2HB ASP 27 -14.422 0.900 -2.268 183 H ALA 28 H ALA 28 -13.918 2.855 -0.441 184 HA ALA 28 HA ALA 28 -16.683 3.309 -0.356 185 1HB ALA 28 1HB ALA 28 -14.607 4.026 1.715 186 2HB ALA 28 2HB ALA 28 -16.344 3.906 1.989 187 3HB ALA 28 3HB ALA 28 -15.421 2.468 1.553 188 H ALA 29 H ALA 29 -13.988 5.551 -0.542 189 HA ALA 29 HA ALA 29 -15.640 7.880 -0.155 190 1HB ALA 29 1HB ALA 29 -13.236 8.690 -1.315 191 2HB ALA 29 2HB ALA 29 -13.646 8.688 0.401 192 3HB ALA 29 3HB ALA 29 -12.821 7.299 -0.309 193 H ALA 30 H ALA 30 -14.355 6.051 -2.840 194 HA ALA 30 HA ALA 30 -14.835 8.041 -4.830 195 1HB ALA 30 1HB ALA 30 -13.907 5.235 -4.794 196 2HB ALA 30 2HB ALA 30 -14.607 5.830 -6.301 197 3HB ALA 30 3HB ALA 30 -13.218 6.651 -5.590 198 H ALA 31 H ALA 31 -16.627 5.229 -3.660 199 HA ALA 31 HA ALA 31 -18.605 5.431 -5.749 200 1HB ALA 31 1HB ALA 31 -18.255 3.637 -3.377 201 2HB ALA 31 2HB ALA 31 -19.744 3.628 -4.323 202 3HB ALA 31 3HB ALA 31 -18.208 3.235 -5.095 203 H ALA 32 H ALA 32 -18.083 7.259 -3.156 204 HA ALA 32 HA ALA 32 -20.841 7.451 -2.238 205 1HB ALA 32 1HB ALA 32 -18.278 7.976 -1.089 206 2HB ALA 32 2HB ALA 32 -19.263 9.440 -1.017 207 3HB ALA 32 3HB ALA 32 -19.861 7.937 -0.310 208 H ALA 33 H ALA 33 -22.187 8.686 -3.336 209 HA ALA 33 HA ALA 33 -21.196 10.865 -4.984 210 1HB ALA 33 1HB ALA 33 -23.853 9.518 -4.672 211 2HB ALA 33 2HB ALA 33 -23.722 11.072 -5.496 212 3HB ALA 33 3HB ALA 33 -22.844 9.671 -6.110 213 H ALA 34 H ALA 34 -21.135 12.906 -4.377 214 HA ALA 34 HA ALA 34 -21.436 14.842 -3.250 215 1HB ALA 34 1HB ALA 34 -24.076 13.611 -3.180 216 2HB ALA 34 2HB ALA 34 -23.791 14.726 -1.844 217 3HB ALA 34 3HB ALA 34 -23.611 15.279 -3.509 218 H ALA 35 H ALA 35 -20.082 12.610 -2.023 219 HA ALA 35 HA ALA 35 -20.303 13.449 0.778 220 1HB ALA 35 1HB ALA 35 -20.214 10.618 -0.241 221 2HB ALA 35 2HB ALA 35 -19.834 11.056 1.426 222 3HB ALA 35 3HB ALA 35 -21.444 11.370 0.778 Start of MODEL 15 1 1H GLY 1 1H GLY 1 12.561 -18.182 5.071 2 2H GLY 1 2H GLY 1 14.007 -18.408 4.214 3 3H GLY 1 3H GLY 1 13.261 -19.725 4.971 4 1HA GLY 1 2HA GLY 1 11.361 -18.618 3.288 5 2HA GLY 1 1HA GLY 1 12.861 -18.709 2.374 6 H SER 2 H SER 2 11.036 -20.231 1.364 7 HA SER 2 HA SER 2 11.964 -22.906 1.871 8 1HB SER 2 1HB SER 2 9.020 -22.285 2.241 9 2HB SER 2 2HB SER 2 9.760 -23.884 2.291 10 HG SER 2 HG SER 2 11.098 -22.423 4.002 11 H MET 3 H MET 3 11.046 -24.438 0.250 12 HA MET 3 HA MET 3 11.067 -23.250 -2.337 13 1HB MET 3 1HB MET 3 10.808 -26.018 -1.260 14 2HB MET 3 2HB MET 3 10.311 -25.730 -2.922 15 1HG MET 3 1HG MET 3 12.409 -25.760 -3.610 16 2HG MET 3 2HG MET 3 12.854 -24.508 -2.450 17 1HE MET 3 1HE MET 3 11.614 -27.957 -2.685 18 2HE MET 3 2HE MET 3 13.070 -28.915 -2.419 19 3HE MET 3 3HE MET 3 11.979 -28.578 -1.074 20 H ASN 4 H ASN 4 8.573 -24.082 -0.121 21 HA ASN 4 HA ASN 4 6.475 -24.494 -1.991 22 1HB ASN 4 1HB ASN 4 6.621 -25.184 0.505 23 2HB ASN 4 2HB ASN 4 6.030 -23.557 0.826 24 1HD2 ASN 4 1HD2 ASN 4 4.233 -24.711 1.784 25 2HD2 ASN 4 2HD2 ASN 4 2.924 -25.224 0.765 26 H ALA 5 H ALA 5 4.830 -23.142 -2.615 27 HA ALA 5 HA ALA 5 5.598 -20.532 -3.259 28 1HB ALA 5 1HB ALA 5 4.124 -21.177 -4.811 29 2HB ALA 5 2HB ALA 5 3.221 -22.190 -3.686 30 3HB ALA 5 3HB ALA 5 2.944 -20.449 -3.722 31 HA PRO 6 HA PRO 6 2.326 -18.867 -0.134 32 1HB PRO 6 1HB PRO 6 1.645 -20.511 1.951 33 2HB PRO 6 2HB PRO 6 0.704 -20.345 0.466 34 1HG PRO 6 1HG PRO 6 2.615 -22.478 1.278 35 2HG PRO 6 2HG PRO 6 1.102 -22.610 0.365 36 1HD PRO 6 1HD PRO 6 3.567 -22.698 -0.791 37 2HD PRO 6 2HD PRO 6 2.128 -22.098 -1.632 38 H ALA 7 H ALA 7 5.002 -20.851 0.774 39 HA ALA 7 HA ALA 7 5.546 -19.596 3.278 40 1HB ALA 7 1HB ALA 7 6.612 -21.616 3.173 41 2HB ALA 7 2HB ALA 7 6.988 -21.442 1.458 42 3HB ALA 7 3HB ALA 7 7.928 -20.559 2.660 43 H ARG 8 H ARG 8 6.204 -18.927 -0.014 44 HA ARG 8 HA ARG 8 8.045 -16.745 0.582 45 1HB ARG 8 1HB ARG 8 6.951 -17.892 -1.980 46 2HB ARG 8 2HB ARG 8 7.930 -16.432 -1.943 47 1HG ARG 8 1HG ARG 8 9.811 -17.599 -1.813 48 2HG ARG 8 2HG ARG 8 9.188 -18.590 -0.493 49 1HD ARG 8 1HD ARG 8 9.826 -19.716 -2.740 50 2HD ARG 8 2HD ARG 8 8.345 -20.199 -1.918 51 HE ARG 8 HE ARG 8 7.623 -18.173 -3.650 52 1HH1 ARG 8 2HH1 ARG 8 9.047 -21.350 -3.928 53 2HH1 ARG 8 1HH1 ARG 8 8.404 -21.642 -5.513 54 1HH2 ARG 8 2HH2 ARG 8 6.726 -18.557 -5.691 55 2HH2 ARG 8 1HH2 ARG 8 7.077 -20.050 -6.520 56 H ALA 9 H ALA 9 4.810 -17.343 -0.663 57 HA ALA 9 HA ALA 9 4.103 -14.661 -1.186 58 1HB ALA 9 1HB ALA 9 1.742 -15.584 -1.019 59 2HB ALA 9 2HB ALA 9 2.801 -16.326 -2.217 60 3HB ALA 9 3HB ALA 9 2.490 -17.146 -0.687 61 H ALA 10 H ALA 10 4.556 -16.333 1.731 62 HA ALA 10 HA ALA 10 2.793 -15.035 3.471 63 1HB ALA 10 1HB ALA 10 4.773 -15.425 5.135 64 2HB ALA 10 2HB ALA 10 3.906 -16.802 4.453 65 3HB ALA 10 3HB ALA 10 5.467 -16.326 3.786 66 H ALA 11 H ALA 11 5.710 -13.945 1.915 67 HA ALA 11 HA ALA 11 5.954 -11.561 3.525 68 1HB ALA 11 1HB ALA 11 7.323 -11.368 1.005 69 2HB ALA 11 2HB ALA 11 7.991 -11.479 2.633 70 3HB ALA 11 3HB ALA 11 7.614 -12.947 1.734 71 H LYS 12 H LYS 12 4.434 -12.534 0.563 72 HA LYS 12 HA LYS 12 3.988 -9.969 -0.543 73 1HB LYS 12 1HB LYS 12 3.900 -11.821 -2.009 74 2HB LYS 12 2HB LYS 12 2.773 -12.689 -0.978 75 1HG LYS 12 1HG LYS 12 1.598 -10.215 -1.785 76 2HG LYS 12 2HG LYS 12 2.214 -11.074 -3.196 77 1HD LYS 12 1HD LYS 12 1.014 -13.073 -1.735 78 2HD LYS 12 2HD LYS 12 -0.056 -11.695 -1.473 79 1HE LYS 12 2HE LYS 12 0.595 -11.688 -4.206 80 2HE LYS 12 1HE LYS 12 0.233 -13.362 -3.789 81 1HZ LYS 12 1HZ LYS 12 -1.513 -11.018 -3.766 82 2HZ LYS 12 2HZ LYS 12 -1.788 -12.211 -2.589 83 3HZ LYS 12 3HZ LYS 12 -1.845 -12.616 -4.233 84 H THR 13 H THR 13 2.053 -12.104 1.514 85 HA THR 13 HA THR 13 -0.396 -10.987 1.555 86 HB THR 13 HB THR 13 0.435 -11.493 4.286 87 HG1 THR 13 1HG THR 13 1.923 -12.923 3.786 88 1HG2 THR 13 1HG2 THR 13 -1.628 -12.321 4.267 89 2HG2 THR 13 2HG2 THR 13 -1.130 -13.582 3.140 90 3HG2 THR 13 3HG2 THR 13 -1.720 -12.036 2.531 91 H ALA 14 H ALA 14 2.438 -9.602 3.091 92 HA ALA 14 HA ALA 14 1.176 -7.725 4.749 93 1HB ALA 14 1HB ALA 14 3.420 -6.423 4.195 94 2HB ALA 14 2HB ALA 14 3.400 -7.850 5.229 95 3HB ALA 14 3HB ALA 14 3.872 -7.996 3.537 96 H ALA 15 H ALA 15 2.724 -7.089 1.606 97 HA ALA 15 HA ALA 15 1.447 -4.581 1.262 98 1HB ALA 15 1HB ALA 15 2.661 -4.377 -0.656 99 2HB ALA 15 2HB ALA 15 3.614 -5.610 0.170 100 3HB ALA 15 3HB ALA 15 2.471 -6.075 -1.091 101 H ASP 16 H ASP 16 0.539 -7.825 0.525 102 HA ASP 16 HA ASP 16 -1.328 -7.293 -1.560 103 1HB ASP 16 1HB ASP 16 -0.399 -9.518 -1.228 104 2HB ASP 16 2HB ASP 16 -1.127 -9.622 0.365 105 H ALA 17 H ALA 17 -1.663 -7.910 1.900 106 HA ALA 17 HA ALA 17 -4.448 -7.547 2.065 107 1HB ALA 17 1HB ALA 17 -2.573 -8.338 3.829 108 2HB ALA 17 2HB ALA 17 -2.844 -6.689 4.392 109 3HB ALA 17 3HB ALA 17 -4.194 -7.820 4.298 110 H LEU 18 H LEU 18 -1.751 -5.293 2.350 111 HA LEU 18 HA LEU 18 -3.265 -3.020 3.063 112 1HB LEU 18 1HB LEU 18 -0.610 -3.285 1.665 113 2HB LEU 18 2HB LEU 18 -1.287 -1.752 2.179 114 HG LEU 18 HG LEU 18 -0.432 -4.040 3.943 115 1HD1 LEU 18 1HD1 LEU 18 1.049 -2.195 4.852 116 2HD1 LEU 18 2HD1 LEU 18 1.446 -2.810 3.247 117 3HD1 LEU 18 3HD1 LEU 18 0.601 -1.273 3.417 118 1HD2 LEU 18 1HD2 LEU 18 -0.961 -2.139 5.706 119 2HD2 LEU 18 2HD2 LEU 18 -2.138 -1.664 4.482 120 3HD2 LEU 18 3HD2 LEU 18 -2.196 -3.284 5.181 121 H ALA 19 H ALA 19 -2.223 -4.296 -0.074 122 HA ALA 19 HA ALA 19 -3.138 -2.258 -1.720 123 1HB ALA 19 1HB ALA 19 -1.911 -4.568 -2.194 124 2HB ALA 19 2HB ALA 19 -3.547 -5.042 -2.651 125 3HB ALA 19 3HB ALA 19 -2.768 -3.678 -3.452 126 H ALA 20 H ALA 20 -4.907 -5.044 -0.421 127 HA ALA 20 HA ALA 20 -7.371 -4.406 -1.701 128 1HB ALA 20 1HB ALA 20 -8.325 -6.145 -0.406 129 2HB ALA 20 2HB ALA 20 -6.688 -6.662 -0.812 130 3HB ALA 20 3HB ALA 20 -7.042 -6.045 0.801 131 H ALA 21 H ALA 21 -6.107 -3.880 1.573 132 HA ALA 21 HA ALA 21 -8.364 -2.649 2.678 133 1HB ALA 21 1HB ALA 21 -6.172 -3.470 3.790 134 2HB ALA 21 2HB ALA 21 -5.597 -1.833 3.470 135 3HB ALA 21 3HB ALA 21 -7.021 -2.086 4.479 136 H LYS 22 H LYS 22 -5.668 -1.294 0.829 137 HA LYS 22 HA LYS 22 -6.524 1.417 1.158 138 1HB LYS 22 1HB LYS 22 -4.356 -0.006 -0.202 139 2HB LYS 22 2HB LYS 22 -4.925 1.405 -1.081 140 1HG LYS 22 1HG LYS 22 -3.003 1.491 0.790 141 2HG LYS 22 2HG LYS 22 -4.065 2.854 0.415 142 1HD LYS 22 1HD LYS 22 -4.907 2.819 2.473 143 2HD LYS 22 2HD LYS 22 -5.328 1.114 2.322 144 1HE LYS 22 2HE LYS 22 -3.413 0.405 3.342 145 2HE LYS 22 1HE LYS 22 -2.486 1.810 2.820 146 1HZ LYS 22 1HZ LYS 22 -2.757 2.530 4.891 147 2HZ LYS 22 2HZ LYS 22 -3.981 1.408 5.237 148 3HZ LYS 22 3HZ LYS 22 -4.364 2.875 4.470 149 H LYS 23 H LYS 23 -7.021 -1.108 -1.216 150 HA LYS 23 HA LYS 23 -8.236 0.460 -3.221 151 1HB LYS 23 1HB LYS 23 -7.389 -1.938 -3.408 152 2HB LYS 23 2HB LYS 23 -8.883 -2.428 -2.625 153 1HG LYS 23 1HG LYS 23 -9.434 -2.692 -4.829 154 2HG LYS 23 2HG LYS 23 -9.997 -1.044 -4.541 155 1HD LYS 23 1HD LYS 23 -8.828 -0.723 -6.472 156 2HD LYS 23 2HD LYS 23 -7.538 -0.448 -5.297 157 1HE LYS 23 2HE LYS 23 -7.349 -3.123 -5.616 158 2HE LYS 23 1HE LYS 23 -7.931 -2.656 -7.214 159 1HZ LYS 23 1HZ LYS 23 -5.501 -1.623 -5.849 160 2HZ LYS 23 2HZ LYS 23 -6.090 -1.045 -7.332 161 3HZ LYS 23 3HZ LYS 23 -5.548 -2.645 -7.204 162 H THR 24 H THR 24 -9.592 -1.450 -0.565 163 HA THR 24 HA THR 24 -12.279 -0.858 -1.050 164 HB THR 24 HB THR 24 -10.696 -1.946 1.214 165 HG1 THR 24 1HG THR 24 -12.426 -2.825 -0.728 166 1HG2 THR 24 1HG2 THR 24 -12.074 -1.082 2.735 167 2HG2 THR 24 2HG2 THR 24 -13.267 -2.222 2.110 168 3HG2 THR 24 3HG2 THR 24 -13.233 -0.560 1.518 169 H ALA 25 H ALA 25 -9.861 0.702 1.048 170 HA ALA 25 HA ALA 25 -11.560 2.616 2.197 171 1HB ALA 25 1HB ALA 25 -9.518 2.504 3.250 172 2HB ALA 25 2HB ALA 25 -8.616 2.464 1.735 173 3HB ALA 25 3HB ALA 25 -9.330 3.976 2.297 174 H ALA 26 H ALA 26 -9.564 2.759 -0.728 175 HA ALA 26 HA ALA 26 -10.306 5.327 -1.572 176 1HB ALA 26 1HB ALA 26 -9.893 3.889 -3.901 177 2HB ALA 26 2HB ALA 26 -8.670 4.758 -2.976 178 3HB ALA 26 3HB ALA 26 -8.930 3.037 -2.694 179 H ASP 27 H ASP 27 -11.735 2.166 -2.214 180 HA ASP 27 HA ASP 27 -13.677 2.906 -4.073 181 1HB ASP 27 1HB ASP 27 -12.913 0.568 -3.051 182 2HB ASP 27 2HB ASP 27 -14.327 0.825 -2.040 183 H ALA 28 H ALA 28 -13.998 2.502 -0.563 184 HA ALA 28 HA ALA 28 -16.671 3.322 -0.394 185 1HB ALA 28 1HB ALA 28 -15.600 2.065 1.373 186 2HB ALA 28 2HB ALA 28 -14.504 3.408 1.700 187 3HB ALA 28 3HB ALA 28 -16.231 3.583 2.012 188 H ALA 29 H ALA 29 -13.664 5.155 -0.245 189 HA ALA 29 HA ALA 29 -14.885 7.580 0.635 190 1HB ALA 29 1HB ALA 29 -12.181 6.809 -0.346 191 2HB ALA 29 2HB ALA 29 -12.618 8.517 -0.303 192 3HB ALA 29 3HB ALA 29 -12.660 7.559 1.177 193 H ALA 30 H ALA 30 -14.002 6.260 -2.520 194 HA ALA 30 HA ALA 30 -14.475 8.663 -3.971 195 1HB ALA 30 1HB ALA 30 -13.191 7.314 -5.254 196 2HB ALA 30 2HB ALA 30 -13.929 5.836 -4.636 197 3HB ALA 30 3HB ALA 30 -14.759 6.787 -5.869 198 H ALA 31 H ALA 31 -16.490 6.020 -2.915 199 HA ALA 31 HA ALA 31 -18.762 7.074 -4.442 200 1HB ALA 31 1HB ALA 31 -18.349 4.685 -4.672 201 2HB ALA 31 2HB ALA 31 -18.474 4.486 -2.923 202 3HB ALA 31 3HB ALA 31 -19.887 4.977 -3.857 203 H ALA 32 H ALA 32 -17.500 8.158 -1.877 204 HA ALA 32 HA ALA 32 -19.655 7.765 0.043 205 1HB ALA 32 1HB ALA 32 -16.869 8.714 0.187 206 2HB ALA 32 2HB ALA 32 -18.004 9.444 1.323 207 3HB ALA 32 3HB ALA 32 -17.784 7.694 1.296 208 H ALA 33 H ALA 33 -21.311 8.903 -1.060 209 HA ALA 33 HA ALA 33 -21.025 11.793 -1.258 210 1HB ALA 33 1HB ALA 33 -22.496 10.123 -2.729 211 2HB ALA 33 2HB ALA 33 -23.687 10.497 -1.482 212 3HB ALA 33 3HB ALA 33 -22.975 11.795 -2.439 213 H ALA 34 H ALA 34 -22.511 9.342 0.742 214 HA ALA 34 HA ALA 34 -22.477 11.102 3.015 215 1HB ALA 34 1HB ALA 34 -24.871 10.824 3.561 216 2HB ALA 34 2HB ALA 34 -24.617 11.749 2.079 217 3HB ALA 34 3HB ALA 34 -25.118 10.061 1.989 218 H ALA 35 H ALA 35 -20.905 9.298 3.289 219 HA ALA 35 HA ALA 35 -22.205 6.815 4.180 220 1HB ALA 35 1HB ALA 35 -19.787 7.332 2.626 221 2HB ALA 35 2HB ALA 35 -19.546 6.203 3.959 222 3HB ALA 35 3HB ALA 35 -20.775 5.876 2.737 Start of MODEL 16 1 1H GLY 1 1H GLY 1 19.541 -13.426 12.606 2 2H GLY 1 2H GLY 1 19.262 -12.578 14.047 3 3H GLY 1 3H GLY 1 20.308 -11.939 12.880 4 1HA GLY 1 2HA GLY 1 17.629 -11.400 13.161 5 2HA GLY 1 1HA GLY 1 18.667 -10.934 11.816 6 H SER 2 H SER 2 16.567 -11.122 10.649 7 HA SER 2 HA SER 2 15.677 -13.852 10.178 8 1HB SER 2 1HB SER 2 14.559 -11.433 8.791 9 2HB SER 2 2HB SER 2 13.749 -12.939 9.226 10 HG SER 2 HG SER 2 13.461 -12.253 11.228 11 H MET 3 H MET 3 17.466 -14.685 9.064 12 HA MET 3 HA MET 3 17.860 -13.633 6.347 13 1HB MET 3 1HB MET 3 19.851 -14.192 7.786 14 2HB MET 3 2HB MET 3 19.344 -15.875 7.737 15 1HG MET 3 1HG MET 3 19.797 -16.060 5.443 16 2HG MET 3 2HG MET 3 19.890 -14.311 5.234 17 1HE MET 3 1HE MET 3 21.775 -16.214 8.309 18 2HE MET 3 2HE MET 3 21.338 -17.345 7.028 19 3HE MET 3 3HE MET 3 23.031 -16.945 7.310 20 H ASN 4 H ASN 4 16.030 -15.791 8.066 21 HA ASN 4 HA ASN 4 15.887 -18.006 6.306 22 1HB ASN 4 1HB ASN 4 13.445 -17.444 7.836 23 2HB ASN 4 2HB ASN 4 14.459 -18.880 7.827 24 1HD2 ASN 4 1HD2 ASN 4 15.893 -19.194 9.432 25 2HD2 ASN 4 2HD2 ASN 4 16.131 -18.103 10.757 26 H ALA 5 H ALA 5 14.855 -18.268 4.477 27 HA ALA 5 HA ALA 5 13.718 -16.118 3.091 28 1HB ALA 5 1HB ALA 5 14.768 -18.039 1.999 29 2HB ALA 5 2HB ALA 5 13.408 -19.050 2.490 30 3HB ALA 5 3HB ALA 5 13.153 -17.715 1.368 31 HA PRO 6 HA PRO 6 9.367 -18.108 3.837 32 1HB PRO 6 1HB PRO 6 9.536 -19.567 6.331 33 2HB PRO 6 2HB PRO 6 8.932 -20.097 4.769 34 1HG PRO 6 1HG PRO 6 11.249 -21.002 5.895 35 2HG PRO 6 2HG PRO 6 10.908 -21.008 4.157 36 1HD PRO 6 1HD PRO 6 12.647 -19.207 5.740 37 2HD PRO 6 2HD PRO 6 12.773 -19.727 4.052 38 H ALA 7 H ALA 7 11.470 -16.872 6.262 39 HA ALA 7 HA ALA 7 9.391 -15.863 7.979 40 1HB ALA 7 1HB ALA 7 11.465 -16.328 9.022 41 2HB ALA 7 2HB ALA 7 12.356 -15.360 7.844 42 3HB ALA 7 3HB ALA 7 11.296 -14.573 9.012 43 H ARG 8 H ARG 8 10.627 -14.968 5.014 44 HA ARG 8 HA ARG 8 9.941 -12.137 5.369 45 1HB ARG 8 1HB ARG 8 11.353 -13.517 3.081 46 2HB ARG 8 2HB ARG 8 11.082 -11.786 3.223 47 1HG ARG 8 1HG ARG 8 12.387 -12.028 5.453 48 2HG ARG 8 2HG ARG 8 12.961 -13.537 4.734 49 1HD ARG 8 1HD ARG 8 13.136 -11.520 2.754 50 2HD ARG 8 2HD ARG 8 13.840 -10.874 4.237 51 HE ARG 8 HE ARG 8 14.725 -13.337 2.882 52 1HH1 ARG 8 2HH1 ARG 8 15.309 -10.632 5.015 53 2HH1 ARG 8 1HH1 ARG 8 17.011 -10.953 5.161 54 1HH2 ARG 8 2HH2 ARG 8 16.981 -13.758 3.064 55 2HH2 ARG 8 1HH2 ARG 8 17.965 -12.704 4.043 56 H ALA 9 H ALA 9 8.405 -14.872 4.613 57 HA ALA 9 HA ALA 9 7.154 -14.254 2.133 58 1HB ALA 9 1HB ALA 9 5.515 -16.036 3.561 59 2HB ALA 9 2HB ALA 9 6.680 -16.413 2.290 60 3HB ALA 9 3HB ALA 9 7.181 -16.431 3.983 61 H ALA 10 H ALA 10 6.368 -13.674 5.500 62 HA ALA 10 HA ALA 10 3.682 -12.925 5.218 63 1HB ALA 10 1HB ALA 10 5.806 -12.538 7.230 64 2HB ALA 10 2HB ALA 10 4.464 -11.396 7.289 65 3HB ALA 10 3HB ALA 10 4.154 -13.125 7.421 66 H ALA 11 H ALA 11 6.619 -11.209 4.476 67 HA ALA 11 HA ALA 11 5.666 -8.564 4.563 68 1HB ALA 11 1HB ALA 11 7.735 -9.505 2.598 69 2HB ALA 11 2HB ALA 11 7.618 -7.950 3.425 70 3HB ALA 11 3HB ALA 11 8.079 -9.395 4.327 71 H LYS 12 H LYS 12 5.514 -11.032 2.055 72 HA LYS 12 HA LYS 12 4.594 -9.314 -0.009 73 1HB LYS 12 1HB LYS 12 5.314 -12.030 0.241 74 2HB LYS 12 2HB LYS 12 3.658 -12.013 -0.348 75 1HG LYS 12 1HG LYS 12 6.050 -10.695 -1.614 76 2HG LYS 12 2HG LYS 12 5.137 -12.076 -2.223 77 1HD LYS 12 1HD LYS 12 3.778 -9.455 -1.731 78 2HD LYS 12 2HD LYS 12 4.688 -9.725 -3.218 79 1HE LYS 12 2HE LYS 12 2.477 -11.519 -2.227 80 2HE LYS 12 1HE LYS 12 2.247 -10.220 -3.397 81 1HZ LYS 12 1HZ LYS 12 2.568 -11.996 -4.775 82 2HZ LYS 12 2HZ LYS 12 3.626 -12.792 -3.718 83 3HZ LYS 12 3HZ LYS 12 4.169 -11.467 -4.627 84 H THR 13 H THR 13 2.963 -11.450 2.273 85 HA THR 13 HA THR 13 0.336 -10.983 1.333 86 HB THR 13 HB THR 13 0.873 -11.794 4.158 87 HG1 THR 13 1HG THR 13 1.317 -13.460 1.876 88 1HG2 THR 13 1HG2 THR 13 -1.131 -12.847 4.003 89 2HG2 THR 13 2HG2 THR 13 -0.850 -13.363 2.342 90 3HG2 THR 13 3HG2 THR 13 -1.386 -11.718 2.672 91 H ALA 14 H ALA 14 2.449 -9.340 3.578 92 HA ALA 14 HA ALA 14 0.526 -7.755 4.893 93 1HB ALA 14 1HB ALA 14 3.441 -7.718 4.541 94 2HB ALA 14 2HB ALA 14 2.708 -6.137 4.821 95 3HB ALA 14 3HB ALA 14 2.467 -7.439 5.985 96 H ALA 15 H ALA 15 2.680 -6.870 2.191 97 HA ALA 15 HA ALA 15 1.323 -4.494 1.517 98 1HB ALA 15 1HB ALA 15 3.670 -5.563 0.768 99 2HB ALA 15 2HB ALA 15 2.701 -5.951 -0.653 100 3HB ALA 15 3HB ALA 15 2.864 -4.275 -0.129 101 H ASP 16 H ASP 16 0.799 -7.819 0.715 102 HA ASP 16 HA ASP 16 -0.930 -7.553 -1.483 103 1HB ASP 16 1HB ASP 16 0.154 -9.688 -0.426 104 2HB ASP 16 2HB ASP 16 -1.273 -9.680 0.610 105 H ALA 17 H ALA 17 -1.750 -8.139 1.924 106 HA ALA 17 HA ALA 17 -4.487 -7.639 1.716 107 1HB ALA 17 1HB ALA 17 -4.462 -8.221 3.858 108 2HB ALA 17 2HB ALA 17 -2.703 -8.300 3.759 109 3HB ALA 17 3HB ALA 17 -3.491 -6.813 4.288 110 H LEU 18 H LEU 18 -1.804 -5.427 2.167 111 HA LEU 18 HA LEU 18 -3.305 -3.142 2.864 112 1HB LEU 18 1HB LEU 18 -0.626 -3.457 1.524 113 2HB LEU 18 2HB LEU 18 -1.293 -1.897 1.975 114 HG LEU 18 HG LEU 18 -0.707 -4.144 3.908 115 1HD1 LEU 18 1HD1 LEU 18 0.970 -2.140 4.587 116 2HD1 LEU 18 2HD1 LEU 18 1.419 -3.487 3.541 117 3HD1 LEU 18 3HD1 LEU 18 0.937 -1.943 2.835 118 1HD2 LEU 18 1HD2 LEU 18 -1.821 -2.974 5.430 119 2HD2 LEU 18 2HD2 LEU 18 -0.902 -1.519 5.049 120 3HD2 LEU 18 3HD2 LEU 18 -2.369 -1.895 4.148 121 H ALA 19 H ALA 19 -2.379 -4.536 -0.224 122 HA ALA 19 HA ALA 19 -3.230 -2.464 -1.908 123 1HB ALA 19 1HB ALA 19 -2.026 -4.041 -3.048 124 2HB ALA 19 2HB ALA 19 -2.826 -5.396 -2.249 125 3HB ALA 19 3HB ALA 19 -3.665 -4.495 -3.513 126 H ALA 20 H ALA 20 -4.993 -5.219 -0.550 127 HA ALA 20 HA ALA 20 -7.477 -4.606 -1.809 128 1HB ALA 20 1HB ALA 20 -7.217 -6.136 0.761 129 2HB ALA 20 2HB ALA 20 -8.384 -6.346 -0.545 130 3HB ALA 20 3HB ALA 20 -6.705 -6.829 -0.778 131 H ALA 21 H ALA 21 -6.029 -3.859 1.313 132 HA ALA 21 HA ALA 21 -8.185 -2.564 2.521 133 1HB ALA 21 1HB ALA 21 -6.675 -2.428 4.142 134 2HB ALA 21 2HB ALA 21 -5.392 -2.858 3.011 135 3HB ALA 21 3HB ALA 21 -5.832 -1.167 3.241 136 H LYS 22 H LYS 22 -5.438 -0.970 0.888 137 HA LYS 22 HA LYS 22 -6.436 1.549 0.627 138 1HB LYS 22 1HB LYS 22 -4.429 -0.052 -0.728 139 2HB LYS 22 2HB LYS 22 -5.149 1.142 -1.799 140 1HG LYS 22 1HG LYS 22 -3.476 2.400 -0.950 141 2HG LYS 22 2HG LYS 22 -4.698 2.722 0.282 142 1HD LYS 22 1HD LYS 22 -3.528 1.658 1.871 143 2HD LYS 22 2HD LYS 22 -3.132 0.313 0.800 144 1HE LYS 22 2HE LYS 22 -1.048 1.184 1.143 145 2HE LYS 22 1HE LYS 22 -1.533 2.087 -0.294 146 1HZ LYS 22 1HZ LYS 22 -2.353 3.840 1.333 147 2HZ LYS 22 2HZ LYS 22 -0.672 3.676 1.166 148 3HZ LYS 22 3HZ LYS 22 -1.457 3.016 2.517 149 H LYS 23 H LYS 23 -7.224 -1.216 -1.413 150 HA LYS 23 HA LYS 23 -8.584 0.196 -3.436 151 1HB LYS 23 1HB LYS 23 -7.872 -2.150 -3.667 152 2HB LYS 23 2HB LYS 23 -9.048 -2.627 -2.456 153 1HG LYS 23 1HG LYS 23 -9.920 -3.131 -4.629 154 2HG LYS 23 2HG LYS 23 -10.852 -1.804 -3.936 155 1HD LYS 23 1HD LYS 23 -8.621 -0.787 -5.440 156 2HD LYS 23 2HD LYS 23 -9.585 -1.885 -6.431 157 1HE LYS 23 2HE LYS 23 -10.844 0.295 -4.795 158 2HE LYS 23 1HE LYS 23 -10.219 0.598 -6.414 159 1HZ LYS 23 1HZ LYS 23 -11.872 -1.723 -6.373 160 2HZ LYS 23 2HZ LYS 23 -12.018 -0.321 -7.315 161 3HZ LYS 23 3HZ LYS 23 -12.715 -0.378 -5.768 162 H THR 24 H THR 24 -9.826 -1.563 -0.617 163 HA THR 24 HA THR 24 -12.503 -0.832 -0.904 164 HB THR 24 HB THR 24 -10.800 -1.868 1.303 165 HG1 THR 24 1HG THR 24 -12.000 -3.053 -0.557 166 1HG2 THR 24 1HG2 THR 24 -13.712 -1.516 1.767 167 2HG2 THR 24 2HG2 THR 24 -12.595 -0.197 2.117 168 3HG2 THR 24 3HG2 THR 24 -12.408 -1.750 2.930 169 H ALA 25 H ALA 25 -9.844 0.640 0.913 170 HA ALA 25 HA ALA 25 -11.305 2.591 2.301 171 1HB ALA 25 1HB ALA 25 -8.856 3.777 1.829 172 2HB ALA 25 2HB ALA 25 -9.253 2.711 3.175 173 3HB ALA 25 3HB ALA 25 -8.505 2.054 1.721 174 H ALA 26 H ALA 26 -9.522 2.889 -0.768 175 HA ALA 26 HA ALA 26 -10.352 5.541 -1.305 176 1HB ALA 26 1HB ALA 26 -8.428 4.184 -2.358 177 2HB ALA 26 2HB ALA 26 -9.661 3.587 -3.472 178 3HB ALA 26 3HB ALA 26 -9.319 5.316 -3.376 179 H ASP 27 H ASP 27 -11.700 2.398 -2.087 180 HA ASP 27 HA ASP 27 -13.637 3.209 -3.959 181 1HB ASP 27 1HB ASP 27 -12.753 0.826 -3.020 182 2HB ASP 27 2HB ASP 27 -14.289 0.938 -2.177 183 H ALA 28 H ALA 28 -13.821 2.669 -0.461 184 HA ALA 28 HA ALA 28 -16.538 3.330 -0.159 185 1HB ALA 28 1HB ALA 28 -14.563 2.408 1.504 186 2HB ALA 28 2HB ALA 28 -14.866 4.031 2.126 187 3HB ALA 28 3HB ALA 28 -16.190 2.873 2.006 188 H ALA 29 H ALA 29 -13.608 5.311 0.049 189 HA ALA 29 HA ALA 29 -14.899 7.695 0.841 190 1HB ALA 29 1HB ALA 29 -12.220 6.939 -0.144 191 2HB ALA 29 2HB ALA 29 -12.688 8.624 -0.371 192 3HB ALA 29 3HB ALA 29 -12.686 7.921 1.245 193 H ALA 30 H ALA 30 -14.258 6.255 -2.291 194 HA ALA 30 HA ALA 30 -14.966 8.597 -3.797 195 1HB ALA 30 1HB ALA 30 -14.911 5.821 -4.922 196 2HB ALA 30 2HB ALA 30 -14.519 7.351 -5.708 197 3HB ALA 30 3HB ALA 30 -13.417 6.666 -4.512 198 H ALA 31 H ALA 31 -16.727 6.187 -2.194 199 HA ALA 31 HA ALA 31 -18.967 6.130 -3.984 200 1HB ALA 31 1HB ALA 31 -20.081 4.897 -2.104 201 2HB ALA 31 2HB ALA 31 -18.592 4.170 -2.703 202 3HB ALA 31 3HB ALA 31 -18.582 5.083 -1.195 203 H ALA 32 H ALA 32 -17.844 8.412 -1.957 204 HA ALA 32 HA ALA 32 -20.444 9.347 -1.019 205 1HB ALA 32 1HB ALA 32 -19.335 10.696 0.505 206 2HB ALA 32 2HB ALA 32 -18.259 9.304 0.387 207 3HB ALA 32 3HB ALA 32 -17.876 10.790 -0.484 208 H ALA 33 H ALA 33 -19.763 9.344 -3.818 209 HA ALA 33 HA ALA 33 -19.358 12.122 -4.545 210 1HB ALA 33 1HB ALA 33 -20.142 10.026 -6.519 211 2HB ALA 33 2HB ALA 33 -19.045 11.393 -6.707 212 3HB ALA 33 3HB ALA 33 -18.535 9.971 -5.798 213 H ALA 34 H ALA 34 -20.874 13.269 -5.892 214 HA ALA 34 HA ALA 34 -22.888 14.232 -6.246 215 1HB ALA 34 1HB ALA 34 -24.787 12.810 -6.785 216 2HB ALA 34 2HB ALA 34 -23.320 12.213 -7.557 217 3HB ALA 34 3HB ALA 34 -23.948 11.412 -6.118 218 H ALA 35 H ALA 35 -21.898 13.879 -3.543 219 HA ALA 35 HA ALA 35 -24.426 14.313 -2.118 220 1HB ALA 35 1HB ALA 35 -23.187 13.224 -0.106 221 2HB ALA 35 2HB ALA 35 -23.951 12.189 -1.316 222 3HB ALA 35 3HB ALA 35 -22.208 12.452 -1.356 Start of MODEL 17 1 1H GLY 1 1H GLY 1 18.728 -12.698 1.980 2 2H GLY 1 2H GLY 1 17.302 -11.949 1.447 3 3H GLY 1 3H GLY 1 18.747 -11.721 0.594 4 1HA GLY 1 2HA GLY 1 18.677 -13.732 -0.414 5 2HA GLY 1 1HA GLY 1 17.800 -14.462 0.925 6 H SER 2 H SER 2 17.498 -12.280 -1.835 7 HA SER 2 HA SER 2 14.621 -12.177 -1.591 8 1HB SER 2 1HB SER 2 15.456 -11.108 -4.081 9 2HB SER 2 2HB SER 2 14.967 -10.227 -2.634 10 HG SER 2 HG SER 2 17.593 -11.139 -3.269 11 H MET 3 H MET 3 16.855 -14.255 -3.085 12 HA MET 3 HA MET 3 15.028 -14.972 -5.253 13 1HB MET 3 1HB MET 3 17.622 -14.594 -5.443 14 2HB MET 3 2HB MET 3 17.704 -16.255 -4.873 15 1HG MET 3 1HG MET 3 17.505 -15.482 -7.477 16 2HG MET 3 2HG MET 3 17.109 -17.080 -6.849 17 1HE MET 3 1HE MET 3 15.752 -18.018 -8.056 18 2HE MET 3 2HE MET 3 14.028 -17.891 -7.709 19 3HE MET 3 3HE MET 3 14.674 -17.243 -9.218 20 H ASN 4 H ASN 4 14.155 -15.668 -2.680 21 HA ASN 4 HA ASN 4 14.178 -18.582 -2.940 22 1HB ASN 4 1HB ASN 4 15.410 -17.321 -0.879 23 2HB ASN 4 2HB ASN 4 13.793 -17.527 -0.216 24 1HD2 ASN 4 1HD2 ASN 4 14.066 -19.113 1.197 25 2HD2 ASN 4 2HD2 ASN 4 14.642 -20.695 0.792 26 H ALA 5 H ALA 5 12.261 -19.630 -2.302 27 HA ALA 5 HA ALA 5 9.956 -18.335 -3.210 28 1HB ALA 5 1HB ALA 5 8.915 -20.343 -3.055 29 2HB ALA 5 2HB ALA 5 10.591 -20.887 -2.963 30 3HB ALA 5 3HB ALA 5 9.633 -20.725 -1.490 31 HA PRO 6 HA PRO 6 8.443 -18.291 1.504 32 1HB PRO 6 1HB PRO 6 11.132 -17.771 2.679 33 2HB PRO 6 2HB PRO 6 9.752 -18.638 3.358 34 1HG PRO 6 1HG PRO 6 11.844 -19.968 2.422 35 2HG PRO 6 2HG PRO 6 10.197 -20.562 2.136 36 1HD PRO 6 1HD PRO 6 12.064 -19.171 0.271 37 2HD PRO 6 2HD PRO 6 10.901 -20.470 -0.049 38 H ALA 7 H ALA 7 11.260 -16.447 0.433 39 HA ALA 7 HA ALA 7 10.624 -14.029 1.722 40 1HB ALA 7 1HB ALA 7 12.370 -14.740 -0.594 41 2HB ALA 7 2HB ALA 7 12.098 -13.050 -0.168 42 3HB ALA 7 3HB ALA 7 12.827 -14.150 1.005 43 H ARG 8 H ARG 8 9.768 -15.340 -1.380 44 HA ARG 8 HA ARG 8 8.559 -12.983 -2.421 45 1HB ARG 8 1HB ARG 8 7.931 -15.819 -3.250 46 2HB ARG 8 2HB ARG 8 7.758 -14.357 -4.210 47 1HG ARG 8 1HG ARG 8 10.452 -14.465 -3.435 48 2HG ARG 8 2HG ARG 8 10.015 -16.097 -3.943 49 1HD ARG 8 1HD ARG 8 10.004 -15.491 -6.081 50 2HD ARG 8 2HD ARG 8 8.898 -14.160 -5.744 51 HE ARG 8 HE ARG 8 10.830 -12.775 -5.265 52 1HH1 ARG 8 2HH1 ARG 8 11.421 -15.775 -6.995 53 2HH1 ARG 8 1HH1 ARG 8 12.974 -15.257 -7.588 54 1HH2 ARG 8 2HH2 ARG 8 12.821 -12.101 -6.054 55 2HH2 ARG 8 1HH2 ARG 8 13.765 -13.145 -7.074 56 H ALA 9 H ALA 9 7.444 -15.707 -0.543 57 HA ALA 9 HA ALA 9 4.656 -15.088 -0.773 58 1HB ALA 9 1HB ALA 9 5.077 -17.348 -0.377 59 2HB ALA 9 2HB ALA 9 6.250 -17.005 0.896 60 3HB ALA 9 3HB ALA 9 4.528 -16.751 1.190 61 H ALA 10 H ALA 10 7.125 -14.661 1.745 62 HA ALA 10 HA ALA 10 5.390 -13.620 3.711 63 1HB ALA 10 1HB ALA 10 7.652 -12.654 4.597 64 2HB ALA 10 2HB ALA 10 7.364 -14.393 4.596 65 3HB ALA 10 3HB ALA 10 8.347 -13.663 3.327 66 H ALA 11 H ALA 11 7.245 -12.081 1.141 67 HA ALA 11 HA ALA 11 6.637 -9.422 2.098 68 1HB ALA 11 1HB ALA 11 8.737 -9.640 1.031 69 2HB ALA 11 2HB ALA 11 8.026 -10.446 -0.367 70 3HB ALA 11 3HB ALA 11 7.715 -8.732 -0.083 71 H LYS 12 H LYS 12 4.905 -11.739 0.484 72 HA LYS 12 HA LYS 12 3.533 -9.950 -1.336 73 1HB LYS 12 1HB LYS 12 4.015 -12.670 -1.345 74 2HB LYS 12 2HB LYS 12 2.312 -12.564 -0.918 75 1HG LYS 12 1HG LYS 12 3.313 -10.960 -3.213 76 2HG LYS 12 2HG LYS 12 3.076 -12.698 -3.418 77 1HD LYS 12 1HD LYS 12 0.748 -12.320 -2.438 78 2HD LYS 12 2HD LYS 12 1.043 -10.601 -2.708 79 1HE LYS 12 2HE LYS 12 1.703 -11.484 -5.118 80 2HE LYS 12 1HE LYS 12 0.614 -12.793 -4.666 81 1HZ LYS 12 1HZ LYS 12 -0.645 -10.403 -3.986 82 2HZ LYS 12 2HZ LYS 12 -1.074 -11.493 -5.213 83 3HZ LYS 12 3HZ LYS 12 -0.031 -10.201 -5.556 84 H THR 13 H THR 13 2.400 -12.185 1.209 85 HA THR 13 HA THR 13 -0.178 -11.339 1.435 86 HB THR 13 HB THR 13 0.893 -11.880 4.069 87 HG1 THR 13 1HG THR 13 2.260 -13.436 3.607 88 1HG2 THR 13 1HG2 THR 13 -1.424 -12.337 2.951 89 2HG2 THR 13 2HG2 THR 13 -0.771 -13.493 4.113 90 3HG2 THR 13 3HG2 THR 13 -0.647 -13.814 2.382 91 H ALA 14 H ALA 14 2.625 -9.881 3.011 92 HA ALA 14 HA ALA 14 1.274 -8.152 4.754 93 1HB ALA 14 1HB ALA 14 3.375 -6.835 4.745 94 2HB ALA 14 2HB ALA 14 3.633 -8.563 4.995 95 3HB ALA 14 3HB ALA 14 3.959 -7.842 3.419 96 H ALA 15 H ALA 15 2.748 -7.358 1.617 97 HA ALA 15 HA ALA 15 1.497 -4.830 1.399 98 1HB ALA 15 1HB ALA 15 2.327 -6.113 -1.106 99 2HB ALA 15 2HB ALA 15 2.789 -4.557 -0.415 100 3HB ALA 15 3HB ALA 15 3.567 -6.038 0.146 101 H ASP 16 H ASP 16 0.465 -8.030 0.593 102 HA ASP 16 HA ASP 16 -1.406 -7.363 -1.449 103 1HB ASP 16 1HB ASP 16 -0.375 -9.703 -0.557 104 2HB ASP 16 2HB ASP 16 -1.949 -9.741 0.229 105 H ALA 17 H ALA 17 -1.633 -7.853 2.027 106 HA ALA 17 HA ALA 17 -4.417 -7.473 2.259 107 1HB ALA 17 1HB ALA 17 -3.552 -8.386 4.167 108 2HB ALA 17 2HB ALA 17 -2.108 -7.373 4.133 109 3HB ALA 17 3HB ALA 17 -3.650 -6.696 4.660 110 H LEU 18 H LEU 18 -1.698 -5.271 2.195 111 HA LEU 18 HA LEU 18 -3.111 -2.949 3.026 112 1HB LEU 18 1HB LEU 18 -0.517 -3.348 1.557 113 2HB LEU 18 2HB LEU 18 -1.125 -1.761 1.984 114 HG LEU 18 HG LEU 18 -0.218 -3.954 3.837 115 1HD1 LEU 18 1HD1 LEU 18 1.143 -1.933 4.664 116 2HD1 LEU 18 2HD1 LEU 18 1.613 -2.701 3.148 117 3HD1 LEU 18 3HD1 LEU 18 0.696 -1.194 3.124 118 1HD2 LEU 18 1HD2 LEU 18 -1.912 -3.258 5.171 119 2HD2 LEU 18 2HD2 LEU 18 -0.809 -1.922 5.504 120 3HD2 LEU 18 3HD2 LEU 18 -2.100 -1.726 4.318 121 H ALA 19 H ALA 19 -2.040 -4.111 -0.157 122 HA ALA 19 HA ALA 19 -3.019 -2.083 -1.753 123 1HB ALA 19 1HB ALA 19 -2.251 -4.866 -2.126 124 2HB ALA 19 2HB ALA 19 -3.477 -4.327 -3.273 125 3HB ALA 19 3HB ALA 19 -1.947 -3.460 -3.148 126 H ALA 20 H ALA 20 -4.739 -4.909 -0.514 127 HA ALA 20 HA ALA 20 -7.195 -4.290 -1.818 128 1HB ALA 20 1HB ALA 20 -7.142 -6.503 -1.289 129 2HB ALA 20 2HB ALA 20 -6.304 -6.231 0.239 130 3HB ALA 20 3HB ALA 20 -8.030 -5.898 0.108 131 H ALA 21 H ALA 21 -5.992 -3.817 1.495 132 HA ALA 21 HA ALA 21 -8.357 -2.743 2.562 133 1HB ALA 21 1HB ALA 21 -7.117 -3.071 4.368 134 2HB ALA 21 2HB ALA 21 -5.629 -3.105 3.424 135 3HB ALA 21 3HB ALA 21 -6.281 -1.565 3.988 136 H LYS 22 H LYS 22 -5.653 -1.203 0.899 137 HA LYS 22 HA LYS 22 -6.546 1.457 1.394 138 1HB LYS 22 1HB LYS 22 -4.412 0.157 -0.132 139 2HB LYS 22 2HB LYS 22 -5.025 1.621 -0.885 140 1HG LYS 22 1HG LYS 22 -3.035 1.719 0.794 141 2HG LYS 22 2HG LYS 22 -4.278 2.973 0.801 142 1HD LYS 22 1HD LYS 22 -4.782 2.507 2.918 143 2HD LYS 22 2HD LYS 22 -5.080 0.817 2.508 144 1HE LYS 22 2HE LYS 22 -3.218 0.205 3.546 145 2HE LYS 22 1HE LYS 22 -2.266 1.283 2.525 146 1HZ LYS 22 1HZ LYS 22 -2.612 3.068 4.049 147 2HZ LYS 22 2HZ LYS 22 -2.059 1.731 4.940 148 3HZ LYS 22 3HZ LYS 22 -3.701 2.154 4.976 149 H LYS 23 H LYS 23 -6.944 -0.840 -1.247 150 HA LYS 23 HA LYS 23 -8.303 0.885 -3.020 151 1HB LYS 23 1HB LYS 23 -7.276 -1.484 -3.418 152 2HB LYS 23 2HB LYS 23 -8.862 -2.060 -2.921 153 1HG LYS 23 1HG LYS 23 -9.135 -1.957 -5.185 154 2HG LYS 23 2HG LYS 23 -9.711 -0.357 -4.717 155 1HD LYS 23 1HD LYS 23 -6.818 -0.563 -5.246 156 2HD LYS 23 2HD LYS 23 -7.866 -0.799 -6.647 157 1HE LYS 23 2HE LYS 23 -8.244 1.529 -4.793 158 2HE LYS 23 1HE LYS 23 -7.059 1.589 -6.097 159 1HZ LYS 23 1HZ LYS 23 -8.865 2.428 -7.166 160 2HZ LYS 23 2HZ LYS 23 -9.986 1.561 -6.232 161 3HZ LYS 23 3HZ LYS 23 -9.140 0.781 -7.478 162 H THR 24 H THR 24 -9.407 -1.315 -0.506 163 HA THR 24 HA THR 24 -12.142 -1.045 -0.814 164 HB THR 24 HB THR 24 -10.365 -1.615 1.522 165 HG1 THR 24 1HG THR 24 -11.904 -3.109 -0.305 166 1HG2 THR 24 1HG2 THR 24 -12.246 -2.190 2.859 167 2HG2 THR 24 2HG2 THR 24 -13.355 -1.845 1.533 168 3HG2 THR 24 3HG2 THR 24 -12.453 -0.535 2.295 169 H ALA 25 H ALA 25 -9.827 0.899 1.041 170 HA ALA 25 HA ALA 25 -11.711 2.654 2.218 171 1HB ALA 25 1HB ALA 25 -8.978 2.261 2.398 172 2HB ALA 25 2HB ALA 25 -9.127 3.879 1.710 173 3HB ALA 25 3HB ALA 25 -9.914 3.494 3.242 174 H ALA 26 H ALA 26 -9.705 2.922 -0.696 175 HA ALA 26 HA ALA 26 -10.626 5.425 -1.568 176 1HB ALA 26 1HB ALA 26 -9.857 4.693 -3.813 177 2HB ALA 26 2HB ALA 26 -8.662 4.427 -2.544 178 3HB ALA 26 3HB ALA 26 -9.610 3.074 -3.159 179 H ASP 27 H ASP 27 -11.825 2.167 -2.157 180 HA ASP 27 HA ASP 27 -13.886 2.662 -3.945 181 1HB ASP 27 1HB ASP 27 -13.072 0.417 -3.006 182 2HB ASP 27 2HB ASP 27 -14.120 0.732 -1.632 183 H ALA 28 H ALA 28 -13.952 2.711 -0.415 184 HA ALA 28 HA ALA 28 -16.656 3.405 -0.114 185 1HB ALA 28 1HB ALA 28 -14.479 2.898 1.579 186 2HB ALA 28 2HB ALA 28 -15.071 4.502 2.014 187 3HB ALA 28 3HB ALA 28 -16.169 3.122 2.034 188 H ALA 29 H ALA 29 -13.776 5.368 -0.544 189 HA ALA 29 HA ALA 29 -15.052 7.862 0.028 190 1HB ALA 29 1HB ALA 29 -12.544 7.278 0.125 191 2HB ALA 29 2HB ALA 29 -12.559 7.589 -1.612 192 3HB ALA 29 3HB ALA 29 -13.014 8.866 -0.483 193 H ALA 30 H ALA 30 -14.315 6.046 -2.903 194 HA ALA 30 HA ALA 30 -15.192 8.112 -4.684 195 1HB ALA 30 1HB ALA 30 -14.208 6.847 -6.231 196 2HB ALA 30 2HB ALA 30 -13.766 5.728 -4.940 197 3HB ALA 30 3HB ALA 30 -15.252 5.477 -5.856 198 H ALA 31 H ALA 31 -16.785 5.813 -2.767 199 HA ALA 31 HA ALA 31 -19.158 5.720 -4.454 200 1HB ALA 31 1HB ALA 31 -18.610 3.642 -3.426 201 2HB ALA 31 2HB ALA 31 -18.478 4.394 -1.836 202 3HB ALA 31 3HB ALA 31 -20.053 4.255 -2.619 203 H ALA 32 H ALA 32 -17.916 7.952 -2.554 204 HA ALA 32 HA ALA 32 -20.416 8.671 -1.206 205 1HB ALA 32 1HB ALA 32 -19.145 9.453 0.438 206 2HB ALA 32 2HB ALA 32 -17.733 8.835 -0.418 207 3HB ALA 32 3HB ALA 32 -18.263 10.498 -0.677 208 H ALA 33 H ALA 33 -20.436 8.879 -3.962 209 HA ALA 33 HA ALA 33 -19.814 11.571 -4.766 210 1HB ALA 33 1HB ALA 33 -19.915 9.379 -6.197 211 2HB ALA 33 2HB ALA 33 -21.622 9.801 -6.345 212 3HB ALA 33 3HB ALA 33 -20.383 10.928 -6.900 213 H ALA 34 H ALA 34 -22.753 9.689 -4.156 214 HA ALA 34 HA ALA 34 -24.121 12.191 -3.445 215 1HB ALA 34 1HB ALA 34 -24.964 11.821 -5.606 216 2HB ALA 34 2HB ALA 34 -25.097 10.082 -5.348 217 3HB ALA 34 3HB ALA 34 -26.202 11.182 -4.522 218 H ALA 35 H ALA 35 -22.861 9.871 -2.036 219 HA ALA 35 HA ALA 35 -25.045 9.335 -0.209 220 1HB ALA 35 1HB ALA 35 -25.399 7.225 -0.814 221 2HB ALA 35 2HB ALA 35 -24.212 7.387 -2.109 222 3HB ALA 35 3HB ALA 35 -23.703 6.853 -0.505 Start of MODEL 18 1 1H GLY 1 1H GLY 1 21.695 -16.954 3.098 2 2H GLY 1 2H GLY 1 21.359 -18.147 4.257 3 3H GLY 1 3H GLY 1 22.349 -16.829 4.655 4 1HA GLY 1 2HA GLY 1 19.979 -16.764 5.495 5 2HA GLY 1 1HA GLY 1 20.593 -15.329 4.686 6 H SER 2 H SER 2 17.872 -15.840 4.915 7 HA SER 2 HA SER 2 16.888 -17.006 2.476 8 1HB SER 2 1HB SER 2 15.125 -15.263 4.103 9 2HB SER 2 2HB SER 2 14.840 -16.889 3.481 10 HG SER 2 HG SER 2 15.585 -17.718 5.275 11 H MET 3 H MET 3 18.555 -15.313 1.484 12 HA MET 3 HA MET 3 17.332 -12.691 1.082 13 1HB MET 3 1HB MET 3 19.943 -13.503 1.406 14 2HB MET 3 2HB MET 3 19.832 -13.273 -0.333 15 1HG MET 3 1HG MET 3 18.608 -11.076 1.071 16 2HG MET 3 2HG MET 3 20.265 -11.330 1.613 17 1HE MET 3 1HE MET 3 21.590 -11.582 -2.347 18 2HE MET 3 2HE MET 3 21.708 -12.468 -0.824 19 3HE MET 3 3HE MET 3 20.311 -12.704 -1.877 20 H ASN 4 H ASN 4 16.944 -15.595 -0.246 21 HA ASN 4 HA ASN 4 17.304 -15.031 -3.030 22 1HB ASN 4 1HB ASN 4 16.148 -17.317 -1.472 23 2HB ASN 4 2HB ASN 4 15.895 -17.222 -3.212 24 1HD2 ASN 4 1HD2 ASN 4 17.379 -18.124 -4.453 25 2HD2 ASN 4 2HD2 ASN 4 18.997 -18.512 -3.970 26 H ALA 5 H ALA 5 15.480 -15.309 -4.588 27 HA ALA 5 HA ALA 5 13.657 -13.238 -4.254 28 1HB ALA 5 1HB ALA 5 12.677 -13.933 -6.345 29 2HB ALA 5 2HB ALA 5 14.437 -14.033 -6.425 30 3HB ALA 5 3HB ALA 5 13.478 -15.499 -6.217 31 HA PRO 6 HA PRO 6 10.125 -16.462 -3.634 32 1HB PRO 6 1HB PRO 6 10.844 -18.923 -2.679 33 2HB PRO 6 2HB PRO 6 10.609 -18.559 -4.390 34 1HG PRO 6 1HG PRO 6 13.140 -18.766 -2.828 35 2HG PRO 6 2HG PRO 6 12.793 -19.305 -4.481 36 1HD PRO 6 1HD PRO 6 14.158 -17.027 -3.921 37 2HD PRO 6 2HD PRO 6 13.152 -17.205 -5.366 38 H ALA 7 H ALA 7 12.884 -16.158 -1.585 39 HA ALA 7 HA ALA 7 11.496 -16.746 0.861 40 1HB ALA 7 1HB ALA 7 13.502 -16.421 1.939 41 2HB ALA 7 2HB ALA 7 14.049 -16.890 0.331 42 3HB ALA 7 3HB ALA 7 14.035 -15.190 0.796 43 H ARG 8 H ARG 8 11.872 -14.076 -1.196 44 HA ARG 8 HA ARG 8 11.041 -12.135 0.810 45 1HB ARG 8 1HB ARG 8 11.429 -11.739 -2.161 46 2HB ARG 8 2HB ARG 8 11.280 -10.481 -0.943 47 1HG ARG 8 1HG ARG 8 13.403 -10.976 -0.036 48 2HG ARG 8 2HG ARG 8 13.515 -12.486 -0.945 49 1HD ARG 8 1HD ARG 8 13.630 -11.250 -3.030 50 2HD ARG 8 2HD ARG 8 13.440 -9.726 -2.160 51 HE ARG 8 HE ARG 8 15.838 -11.288 -2.431 52 1HH1 ARG 8 2HH1 ARG 8 14.171 -8.962 -0.410 53 2HH1 ARG 8 1HH1 ARG 8 15.634 -8.311 0.267 54 1HH2 ARG 8 2HH2 ARG 8 17.767 -10.417 -1.540 55 2HH2 ARG 8 1HH2 ARG 8 17.670 -9.131 -0.376 56 H ALA 9 H ALA 9 9.764 -14.101 -1.719 57 HA ALA 9 HA ALA 9 7.316 -12.753 -2.154 58 1HB ALA 9 1HB ALA 9 8.247 -15.562 -2.632 59 2HB ALA 9 2HB ALA 9 6.583 -15.078 -2.955 60 3HB ALA 9 3HB ALA 9 7.911 -14.291 -3.806 61 H ALA 10 H ALA 10 8.487 -14.716 0.398 62 HA ALA 10 HA ALA 10 6.017 -15.679 1.407 63 1HB ALA 10 1HB ALA 10 7.316 -16.755 2.865 64 2HB ALA 10 2HB ALA 10 8.693 -16.053 2.016 65 3HB ALA 10 3HB ALA 10 8.037 -15.253 3.444 66 H ALA 11 H ALA 11 7.442 -12.584 1.382 67 HA ALA 11 HA ALA 11 5.863 -11.680 3.685 68 1HB ALA 11 1HB ALA 11 8.271 -10.630 2.282 69 2HB ALA 11 2HB ALA 11 7.201 -9.489 3.096 70 3HB ALA 11 3HB ALA 11 7.951 -10.798 4.009 71 H LYS 12 H LYS 12 5.505 -12.035 0.440 72 HA LYS 12 HA LYS 12 4.617 -9.625 -0.582 73 1HB LYS 12 1HB LYS 12 4.956 -11.444 -2.061 74 2HB LYS 12 2HB LYS 12 3.850 -12.477 -1.170 75 1HG LYS 12 1HG LYS 12 2.516 -10.111 -2.150 76 2HG LYS 12 2HG LYS 12 3.304 -11.008 -3.448 77 1HD LYS 12 1HD LYS 12 2.118 -12.970 -1.891 78 2HD LYS 12 2HD LYS 12 0.932 -11.665 -1.917 79 1HE LYS 12 2HE LYS 12 2.242 -12.523 -4.456 80 2HE LYS 12 1HE LYS 12 0.937 -13.495 -3.782 81 1HZ LYS 12 1HZ LYS 12 -0.370 -11.347 -3.706 82 2HZ LYS 12 2HZ LYS 12 -0.081 -12.001 -5.244 83 3HZ LYS 12 3HZ LYS 12 0.836 -10.684 -4.700 84 H THR 13 H THR 13 2.851 -12.041 1.273 85 HA THR 13 HA THR 13 0.255 -11.268 1.041 86 HB THR 13 HB THR 13 0.799 -11.866 3.795 87 HG1 THR 13 1HG THR 13 2.144 -13.600 3.572 88 1HG2 THR 13 1HG2 THR 13 -0.149 -13.769 1.674 89 2HG2 THR 13 2HG2 THR 13 -1.170 -12.466 2.282 90 3HG2 THR 13 3HG2 THR 13 -0.586 -13.717 3.380 91 H ALA 14 H ALA 14 2.746 -9.654 2.901 92 HA ALA 14 HA ALA 14 1.094 -8.181 4.640 93 1HB ALA 14 1HB ALA 14 3.564 -8.497 4.882 94 2HB ALA 14 2HB ALA 14 3.780 -7.301 3.603 95 3HB ALA 14 3HB ALA 14 3.006 -6.842 5.121 96 H ALA 15 H ALA 15 2.788 -7.016 1.718 97 HA ALA 15 HA ALA 15 1.292 -4.607 1.577 98 1HB ALA 15 1HB ALA 15 2.946 -4.077 0.197 99 2HB ALA 15 2HB ALA 15 3.519 -5.744 0.230 100 3HB ALA 15 3HB ALA 15 2.342 -5.240 -0.983 101 H ASP 16 H ASP 16 0.641 -7.818 0.597 102 HA ASP 16 HA ASP 16 -1.064 -7.254 -1.628 103 1HB ASP 16 1HB ASP 16 0.051 -9.550 -0.435 104 2HB ASP 16 2HB ASP 16 -1.693 -9.744 -0.308 105 H ALA 17 H ALA 17 -1.578 -8.063 1.780 106 HA ALA 17 HA ALA 17 -4.398 -7.808 1.735 107 1HB ALA 17 1HB ALA 17 -4.289 -8.386 3.904 108 2HB ALA 17 2HB ALA 17 -2.584 -8.689 3.568 109 3HB ALA 17 3HB ALA 17 -3.085 -7.153 4.277 110 H LEU 18 H LEU 18 -1.775 -5.537 2.362 111 HA LEU 18 HA LEU 18 -3.351 -3.363 3.219 112 1HB LEU 18 1HB LEU 18 -0.671 -3.400 1.826 113 2HB LEU 18 2HB LEU 18 -1.392 -1.973 2.541 114 HG LEU 18 HG LEU 18 -0.261 -4.389 3.911 115 1HD1 LEU 18 1HD1 LEU 18 0.100 -1.485 4.570 116 2HD1 LEU 18 2HD1 LEU 18 1.129 -2.852 4.998 117 3HD1 LEU 18 3HD1 LEU 18 1.060 -2.285 3.328 118 1HD2 LEU 18 1HD2 LEU 18 -1.169 -3.357 6.040 119 2HD2 LEU 18 2HD2 LEU 18 -2.260 -2.427 5.015 120 3HD2 LEU 18 3HD2 LEU 18 -2.341 -4.189 5.019 121 H ALA 19 H ALA 19 -2.255 -4.389 0.024 122 HA ALA 19 HA ALA 19 -3.134 -2.331 -1.565 123 1HB ALA 19 1HB ALA 19 -2.296 -3.780 -3.030 124 2HB ALA 19 2HB ALA 19 -2.544 -5.137 -1.929 125 3HB ALA 19 3HB ALA 19 -3.851 -4.611 -2.991 126 H ALA 20 H ALA 20 -5.065 -5.149 -0.539 127 HA ALA 20 HA ALA 20 -7.484 -4.262 -1.693 128 1HB ALA 20 1HB ALA 20 -7.006 -6.189 0.579 129 2HB ALA 20 2HB ALA 20 -8.543 -5.970 -0.258 130 3HB ALA 20 3HB ALA 20 -7.142 -6.591 -1.133 131 H ALA 21 H ALA 21 -6.082 -3.860 1.528 132 HA ALA 21 HA ALA 21 -8.342 -2.723 2.770 133 1HB ALA 21 1HB ALA 21 -6.483 -1.687 4.287 134 2HB ALA 21 2HB ALA 21 -6.763 -3.428 4.286 135 3HB ALA 21 3HB ALA 21 -5.419 -2.751 3.367 136 H LYS 22 H LYS 22 -5.667 -1.267 0.967 137 HA LYS 22 HA LYS 22 -6.502 1.417 1.461 138 1HB LYS 22 1HB LYS 22 -4.394 0.054 -0.070 139 2HB LYS 22 2HB LYS 22 -4.948 1.567 -0.776 140 1HG LYS 22 1HG LYS 22 -3.198 2.234 0.578 141 2HG LYS 22 2HG LYS 22 -4.621 2.531 1.583 142 1HD LYS 22 1HD LYS 22 -4.236 0.259 2.602 143 2HD LYS 22 2HD LYS 22 -2.684 0.235 1.758 144 1HE LYS 22 2HE LYS 22 -2.359 0.995 4.023 145 2HE LYS 22 1HE LYS 22 -2.062 2.327 2.910 146 1HZ LYS 22 1HZ LYS 22 -4.534 1.887 4.502 147 2HZ LYS 22 2HZ LYS 22 -4.315 3.141 3.386 148 3HZ LYS 22 3HZ LYS 22 -3.357 3.073 4.784 149 H LYS 23 H LYS 23 -6.886 -0.909 -1.140 150 HA LYS 23 HA LYS 23 -8.232 0.691 -2.991 151 1HB LYS 23 1HB LYS 23 -7.427 -1.897 -2.934 152 2HB LYS 23 2HB LYS 23 -9.163 -2.099 -2.750 153 1HG LYS 23 1HG LYS 23 -9.246 -2.022 -4.959 154 2HG LYS 23 2HG LYS 23 -8.982 -0.286 -4.790 155 1HD LYS 23 1HD LYS 23 -6.461 -0.988 -4.708 156 2HD LYS 23 2HD LYS 23 -7.051 -2.441 -5.517 157 1HE LYS 23 2HE LYS 23 -8.276 -0.405 -6.911 158 2HE LYS 23 1HE LYS 23 -6.684 0.262 -6.547 159 1HZ LYS 23 1HZ LYS 23 -5.626 -1.371 -7.745 160 2HZ LYS 23 2HZ LYS 23 -7.025 -1.143 -8.673 161 3HZ LYS 23 3HZ LYS 23 -6.911 -2.470 -7.622 162 H THR 24 H THR 24 -9.512 -1.319 -0.365 163 HA THR 24 HA THR 24 -12.220 -0.760 -0.778 164 HB THR 24 HB THR 24 -10.550 -1.921 1.358 165 HG1 THR 24 1HG THR 24 -12.536 -3.395 1.175 166 1HG2 THR 24 1HG2 THR 24 -11.687 -0.732 2.939 167 2HG2 THR 24 2HG2 THR 24 -12.798 -2.087 2.723 168 3HG2 THR 24 3HG2 THR 24 -13.121 -0.544 1.931 169 H ALA 25 H ALA 25 -9.734 0.908 1.102 170 HA ALA 25 HA ALA 25 -11.382 2.799 2.364 171 1HB ALA 25 1HB ALA 25 -9.460 3.816 3.040 172 2HB ALA 25 2HB ALA 25 -8.776 2.273 2.532 173 3HB ALA 25 3HB ALA 25 -8.694 3.667 1.458 174 H ALA 26 H ALA 26 -9.631 2.954 -0.715 175 HA ALA 26 HA ALA 26 -10.643 5.449 -1.544 176 1HB ALA 26 1HB ALA 26 -8.735 4.697 -2.664 177 2HB ALA 26 2HB ALA 26 -9.452 3.126 -3.020 178 3HB ALA 26 3HB ALA 26 -10.021 4.567 -3.862 179 H ASP 27 H ASP 27 -11.847 2.167 -1.911 180 HA ASP 27 HA ASP 27 -13.882 2.580 -3.764 181 1HB ASP 27 1HB ASP 27 -13.016 0.406 -2.554 182 2HB ASP 27 2HB ASP 27 -14.339 0.744 -1.448 183 H ALA 28 H ALA 28 -13.930 2.940 -0.251 184 HA ALA 28 HA ALA 28 -16.591 3.660 0.095 185 1HB ALA 28 1HB ALA 28 -14.375 3.499 1.709 186 2HB ALA 28 2HB ALA 28 -14.775 5.216 1.759 187 3HB ALA 28 3HB ALA 28 -15.983 4.015 2.215 188 H ALA 29 H ALA 29 -13.809 5.753 -0.618 189 HA ALA 29 HA ALA 29 -15.325 8.150 -0.773 190 1HB ALA 29 1HB ALA 29 -12.945 8.207 -0.311 191 2HB ALA 29 2HB ALA 29 -12.600 7.499 -1.889 192 3HB ALA 29 3HB ALA 29 -13.299 9.117 -1.782 193 H ALA 30 H ALA 30 -14.567 5.629 -3.031 194 HA ALA 30 HA ALA 30 -15.168 7.008 -5.427 195 1HB ALA 30 1HB ALA 30 -14.441 4.356 -4.654 196 2HB ALA 30 2HB ALA 30 -15.815 4.281 -5.756 197 3HB ALA 30 3HB ALA 30 -14.339 5.114 -6.243 198 H ALA 31 H ALA 31 -17.132 5.693 -2.928 199 HA ALA 31 HA ALA 31 -19.499 5.438 -4.546 200 1HB ALA 31 1HB ALA 31 -20.349 5.402 -1.931 201 2HB ALA 31 2HB ALA 31 -19.896 3.991 -2.889 202 3HB ALA 31 3HB ALA 31 -18.711 4.757 -1.831 203 H ALA 32 H ALA 32 -17.877 8.008 -3.405 204 HA ALA 32 HA ALA 32 -20.243 9.601 -2.737 205 1HB ALA 32 1HB ALA 32 -18.904 10.778 -1.396 206 2HB ALA 32 2HB ALA 32 -17.639 9.598 -1.738 207 3HB ALA 32 3HB ALA 32 -17.753 11.072 -2.700 208 H ALA 33 H ALA 33 -20.925 9.343 -5.027 209 HA ALA 33 HA ALA 33 -19.453 10.432 -7.173 210 1HB ALA 33 1HB ALA 33 -22.387 10.499 -7.391 211 2HB ALA 33 2HB ALA 33 -21.183 9.776 -8.456 212 3HB ALA 33 3HB ALA 33 -21.683 8.932 -6.992 213 H ALA 34 H ALA 34 -22.074 11.781 -5.204 214 HA ALA 34 HA ALA 34 -21.083 14.462 -5.875 215 1HB ALA 34 1HB ALA 34 -22.957 14.430 -7.250 216 2HB ALA 34 2HB ALA 34 -23.892 13.452 -6.120 217 3HB ALA 34 3HB ALA 34 -23.582 15.152 -5.767 218 H ALA 35 H ALA 35 -20.331 13.137 -3.644 219 HA ALA 35 HA ALA 35 -21.805 14.504 -1.508 220 1HB ALA 35 1HB ALA 35 -22.524 12.127 -1.574 221 2HB ALA 35 2HB ALA 35 -20.847 11.648 -1.310 222 3HB ALA 35 3HB ALA 35 -21.708 12.565 -0.074 Start of MODEL 19 1 1H GLY 1 1H GLY 1 20.758 -12.914 2.673 2 2H GLY 1 2H GLY 1 20.326 -11.674 1.604 3 3H GLY 1 3H GLY 1 19.310 -13.019 1.799 4 1HA GLY 1 2HA GLY 1 19.880 -11.663 4.266 5 2HA GLY 1 1HA GLY 1 19.057 -10.648 3.088 6 H SER 2 H SER 2 16.971 -11.221 2.380 7 HA SER 2 HA SER 2 15.539 -12.804 4.370 8 1HB SER 2 1HB SER 2 13.914 -11.482 2.333 9 2HB SER 2 2HB SER 2 13.850 -11.335 4.089 10 HG SER 2 HG SER 2 15.592 -9.971 2.294 11 H MET 3 H MET 3 15.995 -14.902 3.694 12 HA MET 3 HA MET 3 14.662 -15.686 1.175 13 1HB MET 3 1HB MET 3 17.317 -15.889 1.534 14 2HB MET 3 2HB MET 3 16.819 -17.407 2.269 15 1HG MET 3 1HG MET 3 16.765 -18.301 0.250 16 2HG MET 3 2HG MET 3 15.402 -17.247 -0.129 17 1HE MET 3 1HE MET 3 16.370 -14.949 -2.580 18 2HE MET 3 2HE MET 3 15.323 -15.346 -1.215 19 3HE MET 3 3HE MET 3 16.632 -14.181 -1.014 20 H ASN 4 H ASN 4 14.027 -15.543 4.178 21 HA ASN 4 HA ASN 4 13.650 -18.295 4.949 22 1HB ASN 4 1HB ASN 4 13.652 -15.721 6.242 23 2HB ASN 4 2HB ASN 4 12.206 -16.619 6.687 24 1HD2 ASN 4 1HD2 ASN 4 15.630 -16.402 6.936 25 2HD2 ASN 4 2HD2 ASN 4 15.842 -17.685 8.085 26 H ALA 5 H ALA 5 11.631 -19.237 5.461 27 HA ALA 5 HA ALA 5 9.600 -18.907 3.572 28 1HB ALA 5 1HB ALA 5 8.479 -20.614 4.631 29 2HB ALA 5 2HB ALA 5 10.146 -20.897 5.139 30 3HB ALA 5 3HB ALA 5 9.012 -20.110 6.237 31 HA PRO 6 HA PRO 6 7.026 -16.514 6.927 32 1HB PRO 6 1HB PRO 6 8.494 -15.233 8.849 33 2HB PRO 6 2HB PRO 6 7.746 -16.815 9.078 34 1HG PRO 6 1HG PRO 6 10.576 -16.141 8.403 35 2HG PRO 6 2HG PRO 6 9.948 -17.362 9.528 36 1HD PRO 6 1HD PRO 6 10.825 -18.002 7.069 37 2HD PRO 6 2HD PRO 6 9.484 -18.861 7.832 38 H ALA 7 H ALA 7 10.198 -15.594 5.861 39 HA ALA 7 HA ALA 7 9.741 -12.806 5.668 40 1HB ALA 7 1HB ALA 7 11.917 -12.809 5.221 41 2HB ALA 7 2HB ALA 7 11.886 -14.571 5.142 42 3HB ALA 7 3HB ALA 7 11.606 -13.620 3.685 43 H ARG 8 H ARG 8 9.358 -15.481 3.478 44 HA ARG 8 HA ARG 8 8.500 -13.963 1.229 45 1HB ARG 8 1HB ARG 8 8.886 -16.750 1.901 46 2HB ARG 8 2HB ARG 8 7.358 -16.531 1.056 47 1HG ARG 8 1HG ARG 8 8.400 -15.686 -0.855 48 2HG ARG 8 2HG ARG 8 9.903 -15.351 0.007 49 1HD ARG 8 1HD ARG 8 8.828 -18.134 -0.389 50 2HD ARG 8 2HD ARG 8 9.923 -17.355 -1.529 51 HE ARG 8 HE ARG 8 11.485 -17.145 0.431 52 1HH1 ARG 8 2HH1 ARG 8 9.104 -19.717 0.196 53 2HH1 ARG 8 1HH1 ARG 8 10.011 -20.817 1.197 54 1HH2 ARG 8 2HH2 ARG 8 12.669 -18.600 1.751 55 2HH2 ARG 8 1HH2 ARG 8 12.023 -20.178 2.093 56 H ALA 9 H ALA 9 6.824 -15.747 3.787 57 HA ALA 9 HA ALA 9 4.199 -15.362 2.911 58 1HB ALA 9 1HB ALA 9 5.213 -15.632 5.743 59 2HB ALA 9 2HB ALA 9 3.542 -15.844 5.223 60 3HB ALA 9 3HB ALA 9 4.788 -16.956 4.659 61 H ALA 10 H ALA 10 6.206 -13.377 5.066 62 HA ALA 10 HA ALA 10 4.239 -11.437 5.616 63 1HB ALA 10 1HB ALA 10 7.164 -11.657 5.948 64 2HB ALA 10 2HB ALA 10 6.507 -10.020 5.890 65 3HB ALA 10 3HB ALA 10 5.920 -11.161 7.098 66 H ALA 11 H ALA 11 6.880 -11.477 3.229 67 HA ALA 11 HA ALA 11 6.527 -8.921 2.203 68 1HB ALA 11 1HB ALA 11 7.398 -10.414 0.045 69 2HB ALA 11 2HB ALA 11 8.409 -9.627 1.258 70 3HB ALA 11 3HB ALA 11 7.956 -11.320 1.450 71 H LYS 12 H LYS 12 4.920 -11.935 1.277 72 HA LYS 12 HA LYS 12 3.588 -10.756 -0.965 73 1HB LYS 12 1HB LYS 12 4.059 -13.329 -0.192 74 2HB LYS 12 2HB LYS 12 2.356 -13.153 0.214 75 1HG LYS 12 1HG LYS 12 3.368 -12.328 -2.479 76 2HG LYS 12 2HG LYS 12 3.011 -14.020 -2.128 77 1HD LYS 12 1HD LYS 12 0.724 -13.468 -1.582 78 2HD LYS 12 2HD LYS 12 1.062 -11.745 -1.759 79 1HE LYS 12 2HE LYS 12 1.743 -12.313 -4.161 80 2HE LYS 12 1HE LYS 12 0.945 -13.861 -3.891 81 1HZ LYS 12 1HZ LYS 12 -0.901 -12.834 -4.523 82 2HZ LYS 12 2HZ LYS 12 -0.203 -11.295 -4.413 83 3HZ LYS 12 3HZ LYS 12 -0.879 -12.017 -3.033 84 H THR 13 H THR 13 2.346 -11.945 2.166 85 HA THR 13 HA THR 13 -0.274 -11.039 1.653 86 HB THR 13 HB THR 13 0.594 -11.543 4.452 87 HG1 THR 13 1HG THR 13 1.714 -13.203 3.582 88 1HG2 THR 13 1HG2 THR 13 -1.813 -11.243 3.305 89 2HG2 THR 13 2HG2 THR 13 -1.543 -12.255 4.725 90 3HG2 THR 13 3HG2 THR 13 -1.620 -12.987 3.121 91 H ALA 14 H ALA 14 2.458 -9.458 3.186 92 HA ALA 14 HA ALA 14 0.976 -7.536 4.666 93 1HB ALA 14 1HB ALA 14 3.707 -8.092 4.211 94 2HB ALA 14 2HB ALA 14 3.441 -6.407 3.762 95 3HB ALA 14 3HB ALA 14 3.006 -6.970 5.376 96 H ALA 15 H ALA 15 2.528 -7.396 1.474 97 HA ALA 15 HA ALA 15 1.396 -4.865 0.792 98 1HB ALA 15 1HB ALA 15 2.584 -5.025 -1.147 99 2HB ALA 15 2HB ALA 15 3.464 -6.214 -0.188 100 3HB ALA 15 3HB ALA 15 2.242 -6.745 -1.344 101 H ASP 16 H ASP 16 0.398 -8.183 0.510 102 HA ASP 16 HA ASP 16 -1.610 -7.871 -1.458 103 1HB ASP 16 1HB ASP 16 -0.526 -10.018 -0.179 104 2HB ASP 16 2HB ASP 16 -2.078 -9.891 0.650 105 H ALA 17 H ALA 17 -1.664 -7.765 2.076 106 HA ALA 17 HA ALA 17 -4.456 -7.264 2.288 107 1HB ALA 17 1HB ALA 17 -4.129 -7.212 4.542 108 2HB ALA 17 2HB ALA 17 -2.639 -8.033 4.076 109 3HB ALA 17 3HB ALA 17 -2.622 -6.302 4.414 110 H LEU 18 H LEU 18 -1.582 -5.255 2.024 111 HA LEU 18 HA LEU 18 -2.752 -2.761 2.586 112 1HB LEU 18 1HB LEU 18 -0.398 -3.574 0.902 113 2HB LEU 18 2HB LEU 18 -0.879 -1.895 1.068 114 HG LEU 18 HG LEU 18 0.023 -3.729 3.284 115 1HD1 LEU 18 1HD1 LEU 18 1.752 -1.774 3.390 116 2HD1 LEU 18 2HD1 LEU 18 1.956 -3.086 2.228 117 3HD1 LEU 18 3HD1 LEU 18 1.284 -1.541 1.707 118 1HD2 LEU 18 1HD2 LEU 18 -1.444 -2.388 4.422 119 2HD2 LEU 18 2HD2 LEU 18 0.003 -1.383 4.475 120 3HD2 LEU 18 3HD2 LEU 18 -1.261 -1.044 3.295 121 H ALA 19 H ALA 19 -2.262 -4.480 -0.469 122 HA ALA 19 HA ALA 19 -3.306 -2.649 -2.245 123 1HB ALA 19 1HB ALA 19 -3.711 -5.632 -2.421 124 2HB ALA 19 2HB ALA 19 -3.685 -4.478 -3.753 125 3HB ALA 19 3HB ALA 19 -2.214 -4.804 -2.840 126 H ALA 20 H ALA 20 -5.090 -5.213 -0.545 127 HA ALA 20 HA ALA 20 -7.610 -4.474 -1.616 128 1HB ALA 20 1HB ALA 20 -6.575 -6.478 0.205 129 2HB ALA 20 2HB ALA 20 -8.151 -5.866 0.710 130 3HB ALA 20 3HB ALA 20 -7.947 -6.554 -0.900 131 H ALA 21 H ALA 21 -6.086 -3.890 1.547 132 HA ALA 21 HA ALA 21 -8.311 -2.671 2.748 133 1HB ALA 21 1HB ALA 21 -5.627 -1.789 3.609 134 2HB ALA 21 2HB ALA 21 -6.992 -2.376 4.559 135 3HB ALA 21 3HB ALA 21 -5.968 -3.518 3.688 136 H LYS 22 H LYS 22 -5.517 -1.223 1.073 137 HA LYS 22 HA LYS 22 -6.352 1.444 1.610 138 1HB LYS 22 1HB LYS 22 -4.210 0.135 0.036 139 2HB LYS 22 2HB LYS 22 -4.667 1.762 -0.457 140 1HG LYS 22 1HG LYS 22 -2.896 2.051 1.045 141 2HG LYS 22 2HG LYS 22 -4.353 2.424 1.973 142 1HD LYS 22 1HD LYS 22 -4.217 -0.137 2.578 143 2HD LYS 22 2HD LYS 22 -2.514 0.085 2.174 144 1HE LYS 22 2HE LYS 22 -2.141 1.021 4.148 145 2HE LYS 22 1HE LYS 22 -3.354 2.256 3.814 146 1HZ LYS 22 1HZ LYS 22 -3.816 0.990 5.851 147 2HZ LYS 22 2HZ LYS 22 -3.938 -0.434 4.938 148 3HZ LYS 22 3HZ LYS 22 -5.052 0.825 4.703 149 H LYS 23 H LYS 23 -6.718 -0.784 -1.095 150 HA LYS 23 HA LYS 23 -7.905 1.000 -2.907 151 1HB LYS 23 1HB LYS 23 -7.106 -1.317 -3.437 152 2HB LYS 23 2HB LYS 23 -8.531 -1.942 -2.622 153 1HG LYS 23 1HG LYS 23 -9.882 -1.480 -4.357 154 2HG LYS 23 2HG LYS 23 -9.093 0.062 -4.689 155 1HD LYS 23 1HD LYS 23 -7.173 -1.292 -5.639 156 2HD LYS 23 2HD LYS 23 -8.242 -2.691 -5.561 157 1HE LYS 23 2HE LYS 23 -9.206 -2.096 -7.474 158 2HE LYS 23 1HE LYS 23 -9.649 -0.534 -6.785 159 1HZ LYS 23 1HZ LYS 23 -6.913 -0.481 -7.420 160 2HZ LYS 23 2HZ LYS 23 -8.165 0.434 -8.102 161 3HZ LYS 23 3HZ LYS 23 -7.747 -1.066 -8.774 162 H THR 24 H THR 24 -9.383 -1.216 -0.563 163 HA THR 24 HA THR 24 -12.042 -0.586 -1.110 164 HB THR 24 HB THR 24 -10.582 -2.093 0.888 165 HG1 THR 24 1HG THR 24 -12.832 -2.253 -0.688 166 1HG2 THR 24 1HG2 THR 24 -13.160 -0.859 1.839 167 2HG2 THR 24 2HG2 THR 24 -11.558 -0.376 2.396 168 3HG2 THR 24 3HG2 THR 24 -12.141 -2.013 2.703 169 H ALA 25 H ALA 25 -9.753 0.928 1.149 170 HA ALA 25 HA ALA 25 -11.527 2.691 2.397 171 1HB ALA 25 1HB ALA 25 -9.635 3.883 3.137 172 2HB ALA 25 2HB ALA 25 -9.100 2.210 2.987 173 3HB ALA 25 3HB ALA 25 -8.676 3.387 1.744 174 H ALA 26 H ALA 26 -9.514 3.185 -0.493 175 HA ALA 26 HA ALA 26 -10.529 5.767 -1.081 176 1HB ALA 26 1HB ALA 26 -9.008 3.721 -2.649 177 2HB ALA 26 2HB ALA 26 -9.614 5.183 -3.426 178 3HB ALA 26 3HB ALA 26 -8.484 5.305 -2.079 179 H ASP 27 H ASP 27 -11.398 2.530 -2.136 180 HA ASP 27 HA ASP 27 -13.225 3.188 -4.145 181 1HB ASP 27 1HB ASP 27 -12.174 0.914 -3.484 182 2HB ASP 27 2HB ASP 27 -13.547 0.771 -2.393 183 H ALA 28 H ALA 28 -13.835 2.377 -0.736 184 HA ALA 28 HA ALA 28 -16.633 2.691 -0.844 185 1HB ALA 28 1HB ALA 28 -15.685 1.483 0.972 186 2HB ALA 28 2HB ALA 28 -14.709 2.869 1.464 187 3HB ALA 28 3HB ALA 28 -16.463 2.914 1.646 188 H ALA 29 H ALA 29 -14.042 4.967 -0.445 189 HA ALA 29 HA ALA 29 -15.723 7.160 0.348 190 1HB ALA 29 1HB ALA 29 -13.288 8.101 -0.757 191 2HB ALA 29 2HB ALA 29 -13.761 8.008 0.941 192 3HB ALA 29 3HB ALA 29 -12.934 6.649 0.179 193 H ALA 30 H ALA 30 -14.507 5.829 -2.645 194 HA ALA 30 HA ALA 30 -15.155 8.099 -4.274 195 1HB ALA 30 1HB ALA 30 -15.038 5.989 -6.010 196 2HB ALA 30 2HB ALA 30 -13.656 6.953 -5.489 197 3HB ALA 30 3HB ALA 30 -14.025 5.430 -4.680 198 H ALA 31 H ALA 31 -16.693 5.071 -3.388 199 HA ALA 31 HA ALA 31 -19.018 5.598 -5.039 200 1HB ALA 31 1HB ALA 31 -18.031 3.329 -3.418 201 2HB ALA 31 2HB ALA 31 -19.781 3.490 -3.566 202 3HB ALA 31 3HB ALA 31 -18.782 3.344 -5.014 203 H ALA 32 H ALA 32 -18.086 7.185 -2.529 204 HA ALA 32 HA ALA 32 -20.560 7.019 -0.968 205 1HB ALA 32 1HB ALA 32 -18.985 8.858 0.317 206 2HB ALA 32 2HB ALA 32 -19.073 7.141 0.702 207 3HB ALA 32 3HB ALA 32 -17.797 7.744 -0.358 208 H ALA 33 H ALA 33 -20.425 8.181 -3.619 209 HA ALA 33 HA ALA 33 -20.824 11.029 -3.160 210 1HB ALA 33 1HB ALA 33 -19.987 11.044 -5.240 211 2HB ALA 33 2HB ALA 33 -20.333 9.331 -5.483 212 3HB ALA 33 3HB ALA 33 -21.594 10.535 -5.760 213 H ALA 34 H ALA 34 -22.673 8.378 -4.633 214 HA ALA 34 HA ALA 34 -25.191 9.662 -3.961 215 1HB ALA 34 1HB ALA 34 -25.474 6.958 -4.892 216 2HB ALA 34 2HB ALA 34 -25.981 8.462 -5.661 217 3HB ALA 34 3HB ALA 34 -24.351 7.843 -5.925 218 H ALA 35 H ALA 35 -24.415 9.549 -1.653 219 HA ALA 35 HA ALA 35 -24.198 7.098 -0.272 220 1HB ALA 35 1HB ALA 35 -24.908 9.826 0.800 221 2HB ALA 35 2HB ALA 35 -24.356 8.446 1.751 222 3HB ALA 35 3HB ALA 35 -23.272 9.199 0.577 Start of MODEL 20 1 1H GLY 1 1H GLY 1 17.304 -21.644 -7.635 2 2H GLY 1 2H GLY 1 18.057 -20.932 -8.978 3 3H GLY 1 3H GLY 1 16.944 -22.192 -9.196 4 1HA GLY 1 2HA GLY 1 16.441 -19.463 -9.184 5 2HA GLY 1 1HA GLY 1 15.278 -20.773 -9.326 6 H SER 2 H SER 2 14.691 -18.340 -8.085 7 HA SER 2 HA SER 2 14.891 -18.626 -5.240 8 1HB SER 2 1HB SER 2 12.796 -16.832 -5.930 9 2HB SER 2 2HB SER 2 14.421 -16.438 -5.366 10 HG SER 2 HG SER 2 14.051 -15.471 -7.372 11 H MET 3 H MET 3 13.972 -20.610 -4.713 12 HA MET 3 HA MET 3 11.213 -21.094 -5.553 13 1HB MET 3 1HB MET 3 13.187 -22.816 -5.604 14 2HB MET 3 2HB MET 3 12.795 -23.022 -3.903 15 1HG MET 3 1HG MET 3 10.365 -23.340 -4.798 16 2HG MET 3 2HG MET 3 11.183 -23.700 -6.316 17 1HE MET 3 1HE MET 3 12.811 -25.874 -6.660 18 2HE MET 3 2HE MET 3 11.911 -27.277 -6.078 19 3HE MET 3 3HE MET 3 11.069 -25.974 -6.920 20 H ASN 4 H ASN 4 13.026 -20.087 -2.818 21 HA ASN 4 HA ASN 4 11.338 -20.934 -0.735 22 1HB ASN 4 1HB ASN 4 13.673 -19.829 -0.632 23 2HB ASN 4 2HB ASN 4 12.783 -18.312 -0.629 24 1HD2 ASN 4 1HD2 ASN 4 13.532 -17.837 1.468 25 2HD2 ASN 4 2HD2 ASN 4 12.888 -18.651 2.856 26 H ALA 5 H ALA 5 9.501 -20.226 0.065 27 HA ALA 5 HA ALA 5 7.927 -18.426 -1.538 28 1HB ALA 5 1HB ALA 5 6.271 -18.960 0.490 29 2HB ALA 5 2HB ALA 5 6.534 -20.068 -0.857 30 3HB ALA 5 3HB ALA 5 7.388 -20.315 0.667 31 HA PRO 6 HA PRO 6 7.975 -15.870 2.713 32 1HB PRO 6 1HB PRO 6 10.718 -16.538 3.539 33 2HB PRO 6 2HB PRO 6 9.280 -16.285 4.513 34 1HG PRO 6 1HG PRO 6 10.305 -18.726 4.100 35 2HG PRO 6 2HG PRO 6 8.567 -18.439 4.294 36 1HD PRO 6 1HD PRO 6 10.120 -19.069 1.848 37 2HD PRO 6 2HD PRO 6 8.436 -19.427 2.259 38 H ALA 7 H ALA 7 10.360 -16.396 0.310 39 HA ALA 7 HA ALA 7 11.793 -13.960 0.546 40 1HB ALA 7 1HB ALA 7 12.395 -16.091 -0.784 41 2HB ALA 7 2HB ALA 7 11.400 -15.383 -2.057 42 3HB ALA 7 3HB ALA 7 12.819 -14.520 -1.464 43 H ARG 8 H ARG 8 8.693 -14.752 -0.606 44 HA ARG 8 HA ARG 8 8.418 -12.099 -1.870 45 1HB ARG 8 1HB ARG 8 6.952 -14.681 -2.430 46 2HB ARG 8 2HB ARG 8 6.460 -13.125 -3.081 47 1HG ARG 8 1HG ARG 8 8.000 -13.188 -4.686 48 2HG ARG 8 2HG ARG 8 9.262 -13.735 -3.580 49 1HD ARG 8 1HD ARG 8 8.547 -15.299 -5.498 50 2HD ARG 8 2HD ARG 8 8.727 -15.979 -3.881 51 HE ARG 8 HE ARG 8 6.049 -15.101 -4.538 52 1HH1 ARG 8 2HH1 ARG 8 8.317 -17.779 -4.589 53 2HH1 ARG 8 1HH1 ARG 8 7.071 -18.991 -4.655 54 1HH2 ARG 8 2HH2 ARG 8 4.428 -16.672 -4.617 55 2HH2 ARG 8 1HH2 ARG 8 4.843 -18.359 -4.680 56 H ALA 9 H ALA 9 7.941 -13.417 0.961 57 HA ALA 9 HA ALA 9 5.193 -13.434 1.475 58 1HB ALA 9 1HB ALA 9 7.583 -13.783 2.965 59 2HB ALA 9 2HB ALA 9 6.536 -12.671 3.848 60 3HB ALA 9 3HB ALA 9 5.938 -14.262 3.385 61 H ALA 10 H ALA 10 7.525 -10.809 1.604 62 HA ALA 10 HA ALA 10 6.010 -8.891 2.942 63 1HB ALA 10 1HB ALA 10 7.910 -7.785 2.651 64 2HB ALA 10 2HB ALA 10 8.440 -8.961 1.451 65 3HB ALA 10 3HB ALA 10 7.502 -7.554 0.953 66 H ALA 11 H ALA 11 5.952 -9.885 -0.429 67 HA ALA 11 HA ALA 11 4.039 -7.773 -1.081 68 1HB ALA 11 1HB ALA 11 4.520 -9.509 -3.291 69 2HB ALA 11 2HB ALA 11 4.994 -7.821 -3.082 70 3HB ALA 11 3HB ALA 11 6.062 -9.112 -2.531 71 H LYS 12 H LYS 12 4.150 -11.126 -0.337 72 HA LYS 12 HA LYS 12 1.669 -11.755 -1.676 73 1HB LYS 12 1HB LYS 12 3.879 -13.224 -0.655 74 2HB LYS 12 2HB LYS 12 2.423 -13.811 0.140 75 1HG LYS 12 1HG LYS 12 2.816 -13.592 -2.836 76 2HG LYS 12 2HG LYS 12 2.948 -15.074 -1.889 77 1HD LYS 12 1HD LYS 12 0.759 -15.388 -2.138 78 2HD LYS 12 2HD LYS 12 0.469 -13.904 -1.229 79 1HE LYS 12 2HE LYS 12 1.087 -12.875 -3.644 80 2HE LYS 12 1HE LYS 12 0.363 -14.407 -4.135 81 1HZ LYS 12 1HZ LYS 12 -1.482 -13.674 -2.465 82 2HZ LYS 12 2HZ LYS 12 -1.460 -13.063 -4.042 83 3HZ LYS 12 3HZ LYS 12 -0.872 -12.119 -2.760 84 H THR 13 H THR 13 2.740 -11.158 1.641 85 HA THR 13 HA THR 13 -0.065 -11.453 2.472 86 HB THR 13 HB THR 13 2.031 -11.182 4.538 87 HG1 THR 13 1HG THR 13 3.041 -12.996 4.041 88 1HG2 THR 13 1HG2 THR 13 -0.659 -12.124 4.285 89 2HG2 THR 13 2HG2 THR 13 0.301 -11.912 5.749 90 3HG2 THR 13 3HG2 THR 13 0.356 -13.440 4.874 91 H ALA 14 H ALA 14 2.766 -9.386 3.208 92 HA ALA 14 HA ALA 14 1.265 -7.503 4.686 93 1HB ALA 14 1HB ALA 14 3.636 -7.748 5.048 94 2HB ALA 14 2HB ALA 14 3.975 -7.235 3.396 95 3HB ALA 14 3HB ALA 14 3.286 -6.094 4.551 96 H ALA 15 H ALA 15 2.827 -7.084 1.506 97 HA ALA 15 HA ALA 15 1.530 -4.650 0.923 98 1HB ALA 15 1HB ALA 15 2.793 -6.648 -0.948 99 2HB ALA 15 2HB ALA 15 2.332 -5.000 -1.375 100 3HB ALA 15 3HB ALA 15 3.591 -5.280 -0.173 101 H ASP 16 H ASP 16 0.500 -7.927 0.625 102 HA ASP 16 HA ASP 16 -1.498 -7.519 -1.372 103 1HB ASP 16 1HB ASP 16 -0.374 -9.733 -0.228 104 2HB ASP 16 2HB ASP 16 -1.949 -9.690 0.559 105 H ALA 17 H ALA 17 -1.512 -7.678 2.162 106 HA ALA 17 HA ALA 17 -4.265 -7.406 2.575 107 1HB ALA 17 1HB ALA 17 -3.087 -7.993 4.477 108 2HB ALA 17 2HB ALA 17 -1.842 -6.770 4.211 109 3HB ALA 17 3HB ALA 17 -3.443 -6.291 4.780 110 H LEU 18 H LEU 18 -1.717 -4.938 2.458 111 HA LEU 18 HA LEU 18 -3.412 -2.729 2.842 112 1HB LEU 18 1HB LEU 18 -0.788 -2.757 1.365 113 2HB LEU 18 2HB LEU 18 -1.560 -1.370 2.107 114 HG LEU 18 HG LEU 18 -0.554 -3.760 3.650 115 1HD1 LEU 18 1HD1 LEU 18 1.020 -1.587 4.264 116 2HD1 LEU 18 2HD1 LEU 18 1.477 -2.948 3.234 117 3HD1 LEU 18 3HD1 LEU 18 0.824 -1.473 2.515 118 1HD2 LEU 18 1HD2 LEU 18 -2.387 -2.358 4.660 119 2HD2 LEU 18 2HD2 LEU 18 -0.889 -2.424 5.593 120 3HD2 LEU 18 3HD2 LEU 18 -1.263 -0.999 4.624 121 H ALA 19 H ALA 19 -2.394 -4.439 -0.056 122 HA ALA 19 HA ALA 19 -3.187 -2.624 -1.999 123 1HB ALA 19 1HB ALA 19 -2.492 -4.244 -3.346 124 2HB ALA 19 2HB ALA 19 -2.331 -5.300 -1.941 125 3HB ALA 19 3HB ALA 19 -3.839 -5.276 -2.858 126 H ALA 20 H ALA 20 -5.090 -5.287 -0.599 127 HA ALA 20 HA ALA 20 -7.490 -4.537 -1.938 128 1HB ALA 20 1HB ALA 20 -8.321 -6.068 0.164 129 2HB ALA 20 2HB ALA 20 -7.774 -6.690 -1.393 130 3HB ALA 20 3HB ALA 20 -6.649 -6.594 -0.037 131 H ALA 21 H ALA 21 -6.220 -3.992 1.320 132 HA ALA 21 HA ALA 21 -8.566 -2.918 2.444 133 1HB ALA 21 1HB ALA 21 -6.620 -1.724 3.894 134 2HB ALA 21 2HB ALA 21 -7.177 -3.377 4.146 135 3HB ALA 21 3HB ALA 21 -5.733 -3.072 3.184 136 H LYS 22 H LYS 22 -5.791 -1.333 0.871 137 HA LYS 22 HA LYS 22 -6.797 1.297 1.352 138 1HB LYS 22 1HB LYS 22 -4.471 0.105 -0.001 139 2HB LYS 22 2HB LYS 22 -5.036 1.609 -0.714 140 1HG LYS 22 1HG LYS 22 -3.258 1.459 1.307 141 2HG LYS 22 2HG LYS 22 -4.298 2.852 1.000 142 1HD LYS 22 1HD LYS 22 -5.301 2.587 2.967 143 2HD LYS 22 2HD LYS 22 -5.711 0.917 2.580 144 1HE LYS 22 2HE LYS 22 -3.737 0.091 3.524 145 2HE LYS 22 1HE LYS 22 -2.966 1.677 3.514 146 1HZ LYS 22 1HZ LYS 22 -3.930 0.686 5.711 147 2HZ LYS 22 2HZ LYS 22 -5.398 1.297 5.117 148 3HZ LYS 22 3HZ LYS 22 -4.091 2.343 5.376 149 H LYS 23 H LYS 23 -7.018 -1.033 -1.257 150 HA LYS 23 HA LYS 23 -8.174 0.641 -3.201 151 1HB LYS 23 1HB LYS 23 -7.295 -1.739 -3.492 152 2HB LYS 23 2HB LYS 23 -8.839 -2.282 -2.850 153 1HG LYS 23 1HG LYS 23 -9.124 -2.376 -5.152 154 2HG LYS 23 2HG LYS 23 -9.893 -0.856 -4.693 155 1HD LYS 23 1HD LYS 23 -8.646 -0.044 -6.394 156 2HD LYS 23 2HD LYS 23 -7.392 0.016 -5.153 157 1HE LYS 23 2HE LYS 23 -6.993 -2.469 -5.937 158 2HE LYS 23 1HE LYS 23 -7.741 -1.876 -7.419 159 1HZ LYS 23 1HZ LYS 23 -5.301 -0.818 -6.101 160 2HZ LYS 23 2HZ LYS 23 -6.073 -0.068 -7.414 161 3HZ LYS 23 3HZ LYS 23 -5.396 -1.610 -7.600 162 H THR 24 H THR 24 -9.652 -1.449 -0.745 163 HA THR 24 HA THR 24 -12.320 -0.810 -1.349 164 HB THR 24 HB THR 24 -10.858 -2.160 0.837 165 HG1 THR 24 1HG THR 24 -13.078 -2.700 -0.845 166 1HG2 THR 24 1HG2 THR 24 -13.741 -1.425 1.244 167 2HG2 THR 24 2HG2 THR 24 -12.407 -0.541 1.983 168 3HG2 THR 24 3HG2 THR 24 -12.656 -2.244 2.366 169 H ALA 25 H ALA 25 -9.992 0.567 0.957 170 HA ALA 25 HA ALA 25 -11.693 2.418 2.181 171 1HB ALA 25 1HB ALA 25 -9.081 3.548 1.890 172 2HB ALA 25 2HB ALA 25 -9.844 2.861 3.325 173 3HB ALA 25 3HB ALA 25 -8.937 1.821 2.224 174 H ALA 26 H ALA 26 -9.515 2.862 -0.597 175 HA ALA 26 HA ALA 26 -10.271 5.476 -1.248 176 1HB ALA 26 1HB ALA 26 -9.653 3.793 -3.557 177 2HB ALA 26 2HB ALA 26 -8.840 5.237 -2.954 178 3HB ALA 26 3HB ALA 26 -8.482 3.662 -2.243 179 H ASP 27 H ASP 27 -11.622 2.378 -2.237 180 HA ASP 27 HA ASP 27 -13.489 3.271 -4.116 181 1HB ASP 27 1HB ASP 27 -12.790 0.860 -3.491 182 2HB ASP 27 2HB ASP 27 -14.024 0.976 -2.242 183 H ALA 28 H ALA 28 -13.950 2.582 -0.653 184 HA ALA 28 HA ALA 28 -16.638 3.411 -0.553 185 1HB ALA 28 1HB ALA 28 -14.866 2.202 1.177 186 2HB ALA 28 2HB ALA 28 -15.205 3.751 1.951 187 3HB ALA 28 3HB ALA 28 -16.528 2.658 1.540 188 H ALA 29 H ALA 29 -13.610 5.150 -0.096 189 HA ALA 29 HA ALA 29 -14.752 7.533 0.928 190 1HB ALA 29 1HB ALA 29 -12.155 6.583 0.274 191 2HB ALA 29 2HB ALA 29 -12.387 8.155 -0.494 192 3HB ALA 29 3HB ALA 29 -12.604 7.985 1.249 193 H ALA 30 H ALA 30 -14.001 6.399 -2.331 194 HA ALA 30 HA ALA 30 -14.611 8.833 -3.662 195 1HB ALA 30 1HB ALA 30 -14.790 7.309 -5.687 196 2HB ALA 30 2HB ALA 30 -13.250 7.310 -4.830 197 3HB ALA 30 3HB ALA 30 -14.389 5.985 -4.594 198 H ALA 31 H ALA 31 -16.508 6.112 -2.594 199 HA ALA 31 HA ALA 31 -18.877 7.144 -3.979 200 1HB ALA 31 1HB ALA 31 -17.936 4.555 -3.467 201 2HB ALA 31 2HB ALA 31 -19.376 4.759 -2.465 202 3HB ALA 31 3HB ALA 31 -19.470 5.019 -4.208 203 H ALA 32 H ALA 32 -17.541 8.218 -1.430 204 HA ALA 32 HA ALA 32 -19.620 7.761 0.558 205 1HB ALA 32 1HB ALA 32 -17.056 9.343 0.705 206 2HB ALA 32 2HB ALA 32 -18.174 9.094 2.047 207 3HB ALA 32 3HB ALA 32 -17.332 7.720 1.333 208 H ALA 33 H ALA 33 -20.703 9.021 -1.593 209 HA ALA 33 HA ALA 33 -20.757 11.875 -1.189 210 1HB ALA 33 1HB ALA 33 -21.460 11.779 -3.294 211 2HB ALA 33 2HB ALA 33 -21.701 10.035 -3.183 212 3HB ALA 33 3HB ALA 33 -22.996 11.135 -2.706 213 H ALA 34 H ALA 34 -22.952 9.164 -0.606 214 HA ALA 34 HA ALA 34 -24.385 10.852 1.338 215 1HB ALA 34 1HB ALA 34 -25.661 10.234 -0.774 216 2HB ALA 34 2HB ALA 34 -25.657 8.578 -0.166 217 3HB ALA 34 3HB ALA 34 -26.439 9.857 0.762 218 H ALA 35 H ALA 35 -22.958 10.121 2.966 219 HA ALA 35 HA ALA 35 -23.687 7.508 4.031 220 1HB ALA 35 1HB ALA 35 -20.783 8.181 4.076 221 2HB ALA 35 2HB ALA 35 -21.580 6.609 4.119 222 3HB ALA 35 3HB ALA 35 -21.473 7.499 2.601
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