NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
21997 | 2ith | 6645 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA MET 1 HA MET 1 15.997 5.920 1.521 2 H1 MET 1 1H MET 1 15.324 6.869 3.865 3 H2 MET 1 2H MET 1 15.024 7.925 2.605 4 H3 MET 1 3H MET 1 13.818 7.109 3.238 5 HB2 MET 1 1HB MET 1 13.733 4.437 3.014 6 HB3 MET 1 2HB MET 1 14.831 3.742 1.866 7 HG2 MET 1 1HG MET 1 16.799 4.305 3.472 8 HG3 MET 1 2HG MET 1 15.565 4.663 4.710 9 HE1 MET 1 3HE MET 1 13.171 2.530 4.213 10 HE2 MET 1 1HE MET 1 13.956 2.844 5.801 11 HE3 MET 1 2HE MET 1 13.778 1.172 5.168 12 H GLU 2 H GLU 2 13.274 4.395 0.723 13 HA GLU 2 HA GLU 2 11.699 6.753 -0.285 14 HB2 GLU 2 2HB GLU 2 11.364 5.787 -2.560 15 HB3 GLU 2 1HB GLU 2 12.937 6.428 -2.217 16 HG2 GLU 2 2HG GLU 2 13.052 3.518 -1.726 17 HG3 GLU 2 1HG GLU 2 12.326 3.781 -3.292 18 H LEU 3 H LEU 3 10.098 4.413 -1.622 19 HA LEU 3 HA LEU 3 8.280 4.389 0.819 20 HG LEU 3 HG LEU 3 8.494 6.189 -2.362 21 HB2 LEU 3 2HB LEU 3 6.356 4.450 -0.978 22 HB3 LEU 3 1HB LEU 3 7.180 5.837 -0.385 23 HD11 LEU 3 1HD1 LEU 3 7.180 3.663 -3.619 24 HD12 LEU 3 2HD1 LEU 3 8.837 3.696 -3.031 25 HD13 LEU 3 3HD1 LEU 3 8.406 4.731 -4.368 26 HD21 LEU 3 3HD2 LEU 3 6.220 7.128 -2.298 27 HD22 LEU 3 1HD2 LEU 3 5.514 5.605 -2.899 28 HD23 LEU 3 2HD2 LEU 3 6.531 6.608 -3.964 29 H VAL 4 H VAL 4 7.009 2.840 1.410 30 HA VAL 4 HA VAL 4 7.380 0.076 0.200 31 HB VAL 4 HB VAL 4 6.967 1.049 3.033 32 HG11 VAL 4 1HG1 VAL 4 5.969 -1.192 2.963 33 HG12 VAL 4 2HG1 VAL 4 7.531 -1.355 3.776 34 HG13 VAL 4 3HG1 VAL 4 7.344 -1.860 2.082 35 HG21 VAL 4 3HG2 VAL 4 9.216 1.635 2.480 36 HG22 VAL 4 1HG2 VAL 4 9.596 0.036 1.865 37 HG23 VAL 4 2HG2 VAL 4 9.267 0.276 3.598 38 H SER 5 H SER 5 5.608 -1.040 -0.511 39 HA SER 5 HA SER 5 2.854 0.150 -0.210 40 HG SER 5 HG SER 5 3.852 -3.135 -1.355 41 HB2 SER 5 2HB SER 5 2.395 -1.436 -2.069 42 HB3 SER 5 1HB SER 5 3.792 -0.455 -2.382 43 H VAL 6 H VAL 6 1.125 -0.619 0.911 44 HA VAL 6 HA VAL 6 1.378 -3.084 2.658 45 HB VAL 6 HB VAL 6 1.089 -2.223 4.647 46 HG11 VAL 6 1HG1 VAL 6 2.554 0.133 3.332 47 HG12 VAL 6 2HG1 VAL 6 3.324 -1.365 3.839 48 HG13 VAL 6 3HG1 VAL 6 2.639 -0.280 5.056 49 HG21 VAL 6 3HG2 VAL 6 0.320 -0.018 5.438 50 HG22 VAL 6 1HG2 VAL 6 -0.939 -0.750 4.465 51 HG23 VAL 6 2HG2 VAL 6 0.097 0.519 3.749 52 H ALA 7 H ALA 7 -0.031 -4.160 1.189 53 HA ALA 7 HA ALA 7 -3.007 -3.350 1.478 54 HB1 ALA 7 3HB ALA 7 -3.440 -4.577 -0.642 55 HB2 ALA 7 1HB ALA 7 -1.724 -5.014 -0.802 56 HB3 ALA 7 2HB ALA 7 -2.250 -3.315 -0.920 57 H ALA 8 H ALA 8 -4.558 -4.976 1.817 58 HA ALA 8 HA ALA 8 -3.521 -7.604 3.003 59 HB1 ALA 8 3HB ALA 8 -5.911 -5.861 3.896 60 HB2 ALA 8 1HB ALA 8 -4.335 -5.884 4.700 61 HB3 ALA 8 2HB ALA 8 -5.331 -7.327 4.699 62 H LEU 9 H LEU 9 -4.358 -9.520 2.229 63 HA LEU 9 HA LEU 9 -6.834 -9.608 0.564 64 HG LEU 9 HG LEU 9 -3.670 -9.462 -2.319 65 HB2 LEU 9 2HB LEU 9 -5.695 -10.170 -1.577 66 HB3 LEU 9 1HB LEU 9 -5.585 -8.547 -1.057 67 HD11 LEU 9 1HD1 LEU 9 -3.496 -7.348 -0.895 68 HD12 LEU 9 2HD1 LEU 9 -1.952 -8.161 -1.097 69 HD13 LEU 9 3HD1 LEU 9 -2.827 -8.318 0.422 70 HD21 LEU 9 3HD2 LEU 9 -2.700 -10.821 0.269 71 HD22 LEU 9 1HD2 LEU 9 -2.006 -10.938 -1.374 72 HD23 LEU 9 2HD2 LEU 9 -3.559 -11.716 -1.018 73 H ALA 10 H ALA 10 -7.408 -11.542 -0.507 74 HA ALA 10 HA ALA 10 -6.500 -14.050 1.026 75 HB1 ALA 10 3HB ALA 10 -9.334 -13.265 0.065 76 HB2 ALA 10 1HB ALA 10 -8.681 -12.780 1.645 77 HB3 ALA 10 2HB ALA 10 -8.905 -14.489 1.273 78 H GLU 11 H GLU 11 -8.856 -15.241 -0.815 79 HA GLU 11 HA GLU 11 -7.102 -16.795 -2.611 80 HB2 GLU 11 2HB GLU 11 -9.148 -17.725 -1.605 81 HB3 GLU 11 1HB GLU 11 -10.149 -16.571 -2.468 82 HG2 GLU 11 2HG GLU 11 -10.305 -18.838 -3.443 83 HG3 GLU 11 1HG GLU 11 -9.756 -17.677 -4.626 84 H ASN 12 H ASN 12 -7.238 -16.884 -4.854 85 HA ASN 12 HA ASN 12 -6.293 -15.772 -6.743 86 HB2 ASN 12 2HB ASN 12 -9.171 -15.152 -6.566 87 HB3 ASN 12 1HB ASN 12 -8.392 -13.772 -7.275 88 HD21 ASN 12 1HD2 ASN 12 -10.223 -15.341 -8.560 89 HD22 ASN 12 2HD2 ASN 12 -9.352 -16.057 -10.015 90 H ARG 13 H ARG 13 -5.742 -14.379 -4.146 91 HA ARG 13 HA ARG 13 -4.891 -12.471 -3.200 92 HE ARG 13 HE ARG 13 -1.087 -11.677 -8.659 93 HB2 ARG 13 2HB ARG 13 -2.988 -11.321 -4.143 94 HB3 ARG 13 1HB ARG 13 -2.872 -13.057 -4.282 95 HG2 ARG 13 2HG ARG 13 -3.602 -12.898 -6.719 96 HG3 ARG 13 1HG ARG 13 -3.582 -11.158 -6.638 97 HD2 ARG 13 2HD ARG 13 -1.235 -11.057 -6.445 98 HD3 ARG 13 1HD ARG 13 -0.989 -12.705 -5.891 99 HH11 ARG 13 2HH1 ARG 13 -2.049 -14.457 -6.902 100 HH12 ARG 13 1HH1 ARG 13 -2.180 -15.504 -8.403 101 HH21 ARG 13 1HH2 ARG 13 -1.224 -12.796 -10.328 102 HH22 ARG 13 2HH2 ARG 13 -1.732 -14.553 -10.298 103 H VAL 14 H VAL 14 -7.340 -12.125 -3.604 104 HA VAL 14 HA VAL 14 -7.974 -9.566 -4.948 105 HB VAL 14 HB VAL 14 -9.630 -11.365 -3.131 106 HG11 VAL 14 1HG1 VAL 14 -10.674 -8.870 -4.655 107 HG12 VAL 14 2HG1 VAL 14 -10.620 -9.055 -2.895 108 HG13 VAL 14 3HG1 VAL 14 -11.684 -10.093 -3.850 109 HG21 VAL 14 3HG2 VAL 14 -10.839 -11.975 -5.230 110 HG22 VAL 14 1HG2 VAL 14 -9.102 -12.237 -5.476 111 HG23 VAL 14 2HG2 VAL 14 -9.874 -10.802 -6.180 112 H ILE 15 H ILE 15 -7.304 -7.710 -4.228 113 HA ILE 15 HA ILE 15 -6.660 -6.800 -1.455 114 HB ILE 15 HB ILE 15 -7.314 -5.177 -3.966 115 HG12 ILE 15 2HG1 ILE 15 -4.547 -5.830 -2.765 116 HG13 ILE 15 1HG1 ILE 15 -5.270 -6.659 -4.128 117 HG21 ILE 15 1HG2 ILE 15 -7.653 -3.638 -2.117 118 HG22 ILE 15 2HG2 ILE 15 -6.087 -3.247 -2.783 119 HG23 ILE 15 3HG2 ILE 15 -6.178 -4.173 -1.266 120 HD11 ILE 15 3HD1 ILE 15 -5.433 -4.216 -5.246 121 HD12 ILE 15 1HD1 ILE 15 -3.903 -5.107 -5.275 122 HD13 ILE 15 2HD1 ILE 15 -4.161 -3.860 -4.049 123 H GLY 16 H GLY 16 -9.480 -5.681 -3.359 124 HA2 GLY 16 2HA GLY 16 -11.291 -6.898 -1.407 125 HA3 GLY 16 1HA GLY 16 -11.237 -5.143 -1.121 126 H ARG 17 H ARG 17 -13.336 -5.034 -1.452 127 HA ARG 17 HA ARG 17 -14.551 -5.620 -4.217 128 HE ARG 17 HE ARG 17 -14.857 -9.291 -1.048 129 HB2 ARG 17 2HB ARG 17 -15.776 -6.250 -1.456 130 HB3 ARG 17 1HB ARG 17 -16.759 -5.979 -2.868 131 HG2 ARG 17 2HG ARG 17 -15.802 -7.768 -4.131 132 HG3 ARG 17 1HG ARG 17 -14.518 -8.109 -3.017 133 HD2 ARG 17 2HD ARG 17 -17.476 -8.361 -2.132 134 HD3 ARG 17 1HD ARG 17 -16.771 -9.582 -3.198 135 HH11 ARG 17 2HH1 ARG 17 -18.099 -10.387 -1.385 136 HH12 ARG 17 1HH1 ARG 17 -18.002 -11.464 0.090 137 HH21 ARG 17 1HH2 ARG 17 -14.709 -10.576 0.571 138 HH22 ARG 17 2HH2 ARG 17 -16.140 -11.538 1.142 139 H ASP 18 H ASP 18 -15.637 -3.740 -1.322 140 HA ASP 18 HA ASP 18 -16.459 -1.504 -2.951 141 HB2 ASP 18 2HB ASP 18 -15.984 -1.676 0.086 142 HB3 ASP 18 1HB ASP 18 -16.772 -0.344 -0.730 143 H GLY 19 H GLY 19 -13.620 -1.417 -0.730 144 HA2 GLY 19 2HA GLY 19 -12.367 0.738 -2.559 145 HA3 GLY 19 1HA GLY 19 -12.543 1.009 -0.853 146 H GLU 20 H GLU 20 -10.793 0.383 0.443 147 HA GLU 20 HA GLU 20 -8.561 -1.228 -0.711 148 HB2 GLU 20 2HB GLU 20 -7.560 -1.272 1.527 149 HB3 GLU 20 1HB GLU 20 -7.770 0.308 0.843 150 HG2 GLU 20 2HG GLU 20 -9.856 -0.653 2.882 151 HG3 GLU 20 1HG GLU 20 -8.284 -0.121 3.445 152 H LEU 21 H LEU 21 -10.943 -2.156 1.799 153 HA LEU 21 HA LEU 21 -10.470 -5.031 1.006 154 HG LEU 21 HG LEU 21 -9.225 -2.597 3.427 155 HB2 LEU 21 2HB LEU 21 -9.911 -5.579 3.475 156 HB3 LEU 21 1HB LEU 21 -8.747 -4.965 2.342 157 HD11 LEU 21 1HD1 LEU 21 -9.613 -2.873 5.985 158 HD12 LEU 21 2HD1 LEU 21 -10.319 -4.455 5.601 159 HD13 LEU 21 3HD1 LEU 21 -11.041 -2.981 4.939 160 HD21 LEU 21 3HD2 LEU 21 -7.363 -2.788 4.896 161 HD22 LEU 21 1HD2 LEU 21 -7.031 -3.745 3.446 162 HD23 LEU 21 2HD2 LEU 21 -7.485 -4.544 4.973 163 HA PRO 22 HA PRO 22 -14.824 -5.464 1.886 164 HB2 PRO 22 2HB PRO 22 -14.919 -8.367 1.744 165 HB3 PRO 22 1HB PRO 22 -15.160 -7.185 0.462 166 HG2 PRO 22 2HG PRO 22 -12.901 -8.995 0.648 167 HG3 PRO 22 1HG PRO 22 -13.089 -7.612 -0.444 168 HD2 PRO 22 2HD PRO 22 -11.615 -7.718 2.242 169 HD3 PRO 22 1HD PRO 22 -11.140 -6.923 0.752 170 H TRP 23 H TRP 23 -12.782 -6.820 4.166 171 HA TRP 23 HA TRP 23 -14.980 -7.345 6.193 172 HD1 TRP 23 HD1 TRP 23 -11.432 -6.329 8.398 173 HE1 TRP 23 HE1 TRP 23 -8.953 -5.721 7.553 174 HE3 TRP 23 HE3 TRP 23 -11.442 -9.268 4.259 175 HZ2 TRP 23 HZ2 TRP 23 -7.369 -6.641 5.500 176 HZ3 TRP 23 HZ3 TRP 23 -9.471 -9.181 2.762 177 HH2 TRP 23 HH2 TRP 23 -7.491 -7.878 3.338 178 HB2 TRP 23 2HB TRP 23 -13.310 -8.229 7.696 179 HB3 TRP 23 1HB TRP 23 -13.118 -9.036 6.166 180 HA PRO 24 HA PRO 24 -14.752 -3.054 7.312 181 HB2 PRO 24 2HB PRO 24 -15.214 -2.974 10.072 182 HB3 PRO 24 1HB PRO 24 -16.440 -3.398 8.863 183 HG2 PRO 24 2HG PRO 24 -14.654 -5.346 10.466 184 HG3 PRO 24 1HG PRO 24 -16.426 -5.397 10.331 185 HD2 PRO 24 2HD PRO 24 -14.931 -6.973 8.704 186 HD3 PRO 24 1HD PRO 24 -16.315 -6.107 7.982 187 H SER 25 H SER 25 -12.770 -4.750 9.574 188 HA SER 25 HA SER 25 -10.274 -4.327 8.994 189 HG SER 25 HG SER 25 -8.839 -2.492 8.234 190 HB2 SER 25 2HB SER 25 -10.873 -1.568 10.059 191 HB3 SER 25 1HB SER 25 -9.305 -2.305 10.412 192 H ILE 26 H ILE 26 -9.533 -5.760 10.341 193 HA ILE 26 HA ILE 26 -10.359 -6.112 13.186 194 HB ILE 26 HB ILE 26 -8.156 -7.594 13.258 195 HG12 ILE 26 2HG1 ILE 26 -7.415 -6.675 10.935 196 HG13 ILE 26 1HG1 ILE 26 -6.995 -8.239 11.445 197 HG21 ILE 26 1HG2 ILE 26 -9.339 -9.581 12.502 198 HG22 ILE 26 2HG2 ILE 26 -10.605 -8.589 11.735 199 HG23 ILE 26 3HG2 ILE 26 -10.375 -8.543 13.506 200 HD11 ILE 26 3HD1 ILE 26 -9.430 -7.814 9.616 201 HD12 ILE 26 1HD1 ILE 26 -8.591 -9.335 9.930 202 HD13 ILE 26 2HD1 ILE 26 -7.782 -8.061 8.992 203 HA PRO 27 HA PRO 27 -7.522 -3.204 15.228 204 HB2 PRO 27 2HB PRO 27 -7.074 -5.435 17.273 205 HB3 PRO 27 1HB PRO 27 -7.369 -3.711 17.544 206 HG2 PRO 27 2HG PRO 27 -9.474 -5.405 17.790 207 HG3 PRO 27 1HG PRO 27 -9.719 -3.930 16.829 208 HD2 PRO 27 2HD PRO 27 -9.102 -6.747 15.732 209 HD3 PRO 27 1HD PRO 27 -10.387 -5.590 15.259 210 H ALA 28 H ALA 28 -5.839 -6.454 15.233 211 HA ALA 28 HA ALA 28 -3.262 -5.468 14.726 212 HB1 ALA 28 3HB ALA 28 -4.497 -7.953 13.402 213 HB2 ALA 28 1HB ALA 28 -3.815 -7.853 15.048 214 HB3 ALA 28 2HB ALA 28 -2.772 -7.642 13.643 215 H ASP 29 H ASP 29 -5.699 -5.541 12.121 216 HA ASP 29 HA ASP 29 -3.904 -4.628 9.914 217 HB2 ASP 29 2HB ASP 29 -5.981 -5.793 9.451 218 HB3 ASP 29 1HB ASP 29 -6.949 -4.637 10.378 219 H LYS 30 H LYS 30 -6.450 -2.742 11.565 220 HA LYS 30 HA LYS 30 -5.249 -0.235 10.979 221 HB2 LYS 30 2HB LYS 30 -7.701 -0.925 11.834 222 HB3 LYS 30 1HB LYS 30 -7.056 -0.495 13.393 223 HG2 LYS 30 2HG LYS 30 -8.105 1.497 12.689 224 HG3 LYS 30 1HG LYS 30 -6.434 1.830 12.315 225 HD2 LYS 30 2HD LYS 30 -7.766 2.678 10.495 226 HD3 LYS 30 1HD LYS 30 -6.878 1.312 9.859 227 HE2 LYS 30 2HE LYS 30 -8.883 -0.110 9.911 228 HE3 LYS 30 1HE LYS 30 -9.835 1.109 10.762 229 HZ1 LYS 30 3HZ LYS 30 -9.041 1.123 7.870 230 HZ2 LYS 30 1HZ LYS 30 -9.277 2.595 8.621 231 HZ3 LYS 30 2HZ LYS 30 -10.465 1.534 8.548 232 H LYS 31 H LYS 31 -4.257 -2.190 13.677 233 HA LYS 31 HA LYS 31 -2.475 -0.045 14.900 234 HB2 LYS 31 2HB LYS 31 -3.477 -1.771 16.405 235 HB3 LYS 31 1HB LYS 31 -2.740 -3.046 15.464 236 HG2 LYS 31 2HG LYS 31 -1.527 -2.868 17.503 237 HG3 LYS 31 1HG LYS 31 -0.463 -2.442 16.184 238 HD2 LYS 31 2HD LYS 31 -0.904 0.068 16.760 239 HD3 LYS 31 1HD LYS 31 -1.858 -0.479 18.111 240 HE2 LYS 31 2HE LYS 31 0.080 -0.388 19.368 241 HE3 LYS 31 1HE LYS 31 0.444 -1.949 18.663 242 HZ1 LYS 31 3HZ LYS 31 2.368 -0.571 18.062 243 HZ2 LYS 31 1HZ LYS 31 1.460 0.737 17.679 244 HZ3 LYS 31 2HZ LYS 31 1.478 -0.518 16.690 245 H GLN 32 H GLN 32 -1.916 -2.906 12.726 246 HA GLN 32 HA GLN 32 1.029 -2.407 12.583 247 HB2 GLN 32 2HB GLN 32 0.133 -4.649 12.302 248 HB3 GLN 32 1HB GLN 32 -0.783 -4.192 10.881 249 HG2 GLN 32 2HG GLN 32 2.262 -3.734 10.851 250 HG3 GLN 32 1HG GLN 32 1.712 -5.385 10.794 251 HE21 GLN 32 1HE2 GLN 32 -0.194 -5.622 9.077 252 HE22 GLN 32 2HE2 GLN 32 0.326 -4.972 7.434 253 H TYR 33 H TYR 33 -1.662 -1.826 10.180 254 HA TYR 33 HA TYR 33 -0.307 0.139 8.580 255 HD1 TYR 33 HD1 TYR 33 -4.001 1.341 10.454 256 HD2 TYR 33 HD2 TYR 33 -2.717 1.687 6.391 257 HE1 TYR 33 HE1 TYR 33 -5.359 3.367 10.212 258 HE2 TYR 33 HE2 TYR 33 -4.151 3.699 6.133 259 HH TYR 33 HH TYR 33 -5.689 5.234 8.831 260 HB2 TYR 33 2HB TYR 33 -2.233 -0.354 7.573 261 HB3 TYR 33 1HB TYR 33 -3.129 -0.696 8.982 262 H ARG 34 H ARG 34 -1.748 0.904 11.823 263 HA ARG 34 HA ARG 34 -0.758 3.736 11.420 264 HE ARG 34 HE ARG 34 -5.753 5.656 12.428 265 HB2 ARG 34 2HB ARG 34 -2.112 2.460 13.856 266 HB3 ARG 34 1HB ARG 34 -1.456 4.088 13.868 267 HG2 ARG 34 2HG ARG 34 -2.908 4.580 11.723 268 HG3 ARG 34 1HG ARG 34 -3.656 3.055 11.997 269 HD2 ARG 34 2HD ARG 34 -4.972 3.730 13.746 270 HD3 ARG 34 1HD ARG 34 -3.746 4.720 14.506 271 HH11 ARG 34 2HH1 ARG 34 -2.684 6.423 13.800 272 HH12 ARG 34 1HH1 ARG 34 -2.763 8.143 13.202 273 HH21 ARG 34 1HH2 ARG 34 -5.773 7.586 11.685 274 HH22 ARG 34 2HH2 ARG 34 -4.427 8.736 12.061 275 H SER 35 H SER 35 0.733 1.026 13.139 276 HA SER 35 HA SER 35 3.068 2.863 13.909 277 HG SER 35 HG SER 35 2.999 2.376 15.811 278 HB2 SER 35 2HB SER 35 2.549 -0.112 14.476 279 HB3 SER 35 1HB SER 35 4.153 0.610 14.650 280 H ARG 36 H ARG 36 2.198 1.040 11.215 281 HA ARG 36 HA ARG 36 4.869 1.417 9.860 282 HE ARG 36 HE ARG 36 4.131 -2.611 8.620 283 HB2 ARG 36 2HB ARG 36 3.118 -0.589 9.646 284 HB3 ARG 36 1HB ARG 36 2.108 0.551 8.790 285 HG2 ARG 36 2HG ARG 36 3.122 -0.812 7.175 286 HG3 ARG 36 1HG ARG 36 3.907 0.741 7.032 287 HD2 ARG 36 2HD ARG 36 5.581 -1.062 6.848 288 HD3 ARG 36 1HD ARG 36 5.901 -0.144 8.312 289 HH11 ARG 36 2HH1 ARG 36 7.420 -1.582 8.501 290 HH12 ARG 36 1HH1 ARG 36 7.916 -3.267 8.969 291 HH21 ARG 36 1HH2 ARG 36 4.833 -4.306 9.361 292 HH22 ARG 36 2HH2 ARG 36 6.620 -4.612 9.562 293 H VAL 37 H VAL 37 1.512 2.577 9.019 294 HA VAL 37 HA VAL 37 2.812 4.858 7.548 295 HB VAL 37 HB VAL 37 1.251 4.831 6.016 296 HG11 VAL 37 1HG1 VAL 37 0.649 1.917 6.758 297 HG12 VAL 37 2HG1 VAL 37 2.203 2.421 6.067 298 HG13 VAL 37 3HG1 VAL 37 0.702 2.636 5.117 299 HG21 VAL 37 3HG2 VAL 37 -1.165 3.939 6.096 300 HG22 VAL 37 1HG2 VAL 37 -0.869 5.316 7.180 301 HG23 VAL 37 2HG2 VAL 37 -0.951 3.678 7.826 302 H ALA 38 H ALA 38 1.388 4.966 10.598 303 HA ALA 38 HA ALA 38 -0.342 7.367 10.044 304 HB1 ALA 38 3HB ALA 38 -0.674 7.561 12.461 305 HB2 ALA 38 1HB ALA 38 0.481 6.281 12.777 306 HB3 ALA 38 2HB ALA 38 -1.029 5.922 11.873 307 H ASP 39 H ASP 39 2.956 7.054 11.120 308 HA ASP 39 HA ASP 39 3.345 10.039 11.351 309 HB2 ASP 39 2HB ASP 39 4.818 7.610 12.303 310 HB3 ASP 39 1HB ASP 39 5.867 8.626 11.368 311 H ASP 40 H ASP 40 4.355 7.394 9.090 312 HA ASP 40 HA ASP 40 5.468 9.154 7.192 313 HB2 ASP 40 2HB ASP 40 4.749 6.196 7.302 314 HB3 ASP 40 1HB ASP 40 5.389 6.841 5.823 315 HA PRO 41 HA PRO 41 2.033 10.136 4.294 316 HB2 PRO 41 2HB PRO 41 4.229 10.260 2.158 317 HB3 PRO 41 1HB PRO 41 2.970 11.465 2.524 318 HG2 PRO 41 2HG PRO 41 5.522 11.868 3.383 319 HG3 PRO 41 1HG PRO 41 4.217 12.179 4.540 320 HD2 PRO 41 2HD PRO 41 5.961 9.664 4.381 321 HD3 PRO 41 1HD PRO 41 5.522 10.671 5.776 322 H VAL 42 H VAL 42 0.637 9.015 2.932 323 HA VAL 42 HA VAL 42 1.651 6.379 1.732 324 HB VAL 42 HB VAL 42 -1.123 7.249 2.680 325 HG11 VAL 42 1HG1 VAL 42 -0.274 4.377 1.859 326 HG12 VAL 42 2HG1 VAL 42 -1.250 5.437 0.813 327 HG13 VAL 42 3HG1 VAL 42 -1.874 4.949 2.392 328 HG21 VAL 42 3HG2 VAL 42 0.237 6.809 4.660 329 HG22 VAL 42 1HG2 VAL 42 1.139 5.522 3.870 330 HG23 VAL 42 2HG2 VAL 42 -0.527 5.226 4.375 331 H VAL 43 H VAL 43 1.681 5.978 -0.370 332 HA VAL 43 HA VAL 43 0.157 7.732 -2.338 333 HB VAL 43 HB VAL 43 1.659 7.188 -4.052 334 HG11 VAL 43 1HG1 VAL 43 3.390 7.456 -1.503 335 HG12 VAL 43 2HG1 VAL 43 2.662 8.803 -2.377 336 HG13 VAL 43 3HG1 VAL 43 3.931 7.828 -3.140 337 HG21 VAL 43 3HG2 VAL 43 3.584 5.570 -3.800 338 HG22 VAL 43 1HG2 VAL 43 2.024 4.756 -3.779 339 HG23 VAL 43 2HG2 VAL 43 2.926 5.074 -2.250 340 H LEU 44 H LEU 44 -1.708 7.147 -3.074 341 HA LEU 44 HA LEU 44 -2.418 4.200 -3.471 342 HG LEU 44 HG LEU 44 -4.362 7.102 -2.188 343 HB2 LEU 44 2HB LEU 44 -4.242 4.304 -1.942 344 HB3 LEU 44 1HB LEU 44 -2.791 4.710 -1.121 345 HD11 LEU 44 1HD1 LEU 44 -5.403 5.304 0.097 346 HD12 LEU 44 2HD1 LEU 44 -6.234 5.755 -1.386 347 HD13 LEU 44 3HD1 LEU 44 -5.938 6.988 -0.143 348 HD21 LEU 44 3HD2 LEU 44 -3.582 8.216 -0.236 349 HD22 LEU 44 1HD2 LEU 44 -2.234 7.197 -0.717 350 HD23 LEU 44 2HD2 LEU 44 -3.252 6.712 0.664 351 H GLY 45 H GLY 45 -4.997 4.073 -3.951 352 HA2 GLY 45 2HA GLY 45 -5.036 5.290 -6.789 353 HA3 GLY 45 1HA GLY 45 -5.816 3.800 -6.339 354 H ARG 46 H ARG 46 -7.522 5.036 -7.579 355 HA ARG 46 HA ARG 46 -9.259 6.656 -5.651 356 HE ARG 46 HE ARG 46 -11.958 9.001 -7.235 357 HB2 ARG 46 2HB ARG 46 -9.703 6.195 -8.619 358 HB3 ARG 46 1HB ARG 46 -10.989 6.711 -7.567 359 HG2 ARG 46 2HG ARG 46 -8.334 8.231 -7.904 360 HG3 ARG 46 1HG ARG 46 -9.812 8.633 -8.756 361 HD2 ARG 46 2HD ARG 46 -9.647 8.723 -5.648 362 HD3 ARG 46 1HD ARG 46 -9.177 10.066 -6.670 363 HH11 ARG 46 2HH1 ARG 46 -10.318 10.777 -4.818 364 HH12 ARG 46 1HH1 ARG 46 -11.867 11.592 -4.298 365 HH21 ARG 46 1HH2 ARG 46 -13.597 9.842 -6.624 366 HH22 ARG 46 2HH2 ARG 46 -13.655 11.148 -5.360 367 H THR 47 H THR 47 -9.283 3.326 -6.972 368 HA THR 47 HA THR 47 -11.524 2.395 -5.488 369 HB THR 47 HB THR 47 -8.898 0.793 -5.461 370 HG1 THR 47 HG1 THR 47 -10.787 0.672 -7.526 371 HG21 THR 47 3HG2 THR 47 -10.240 -1.154 -5.383 372 HG22 THR 47 1HG2 THR 47 -11.630 -0.417 -6.198 373 HG23 THR 47 2HG2 THR 47 -11.310 -0.077 -4.487 374 H THR 48 H THR 48 -8.293 1.970 -3.905 375 HA THR 48 HA THR 48 -9.101 2.146 -1.220 376 HB THR 48 HB THR 48 -6.740 2.764 -0.683 377 HG1 THR 48 HG1 THR 48 -6.578 4.214 -2.433 378 HG21 THR 48 3HG2 THR 48 -6.834 0.660 -2.958 379 HG22 THR 48 1HG2 THR 48 -7.030 0.351 -1.227 380 HG23 THR 48 2HG2 THR 48 -5.495 0.951 -1.828 381 H PHE 49 H PHE 49 -8.646 5.088 -3.182 382 HA PHE 49 HA PHE 49 -8.658 6.842 -0.693 383 HD1 PHE 49 HD2 PHE 49 -10.287 9.636 -2.546 384 HD2 PHE 49 HD1 PHE 49 -6.160 9.192 -1.452 385 HE1 PHE 49 HE2 PHE 49 -10.323 11.853 -1.488 386 HE2 PHE 49 HE1 PHE 49 -6.155 11.491 -0.582 387 HZ PHE 49 HZ PHE 49 -8.255 12.765 -0.466 388 HB2 PHE 49 2HB PHE 49 -7.205 7.444 -2.658 389 HB3 PHE 49 1HB PHE 49 -8.637 7.784 -3.616 390 H GLU 50 H GLU 50 -11.032 5.913 -3.164 391 HA GLU 50 HA GLU 50 -13.097 7.874 -2.281 392 HB2 GLU 50 2HB GLU 50 -13.311 5.363 -4.033 393 HB3 GLU 50 1HB GLU 50 -14.683 6.384 -3.627 394 HG2 GLU 50 2HG GLU 50 -13.523 8.401 -4.565 395 HG3 GLU 50 1HG GLU 50 -12.104 7.458 -4.966 396 H SER 51 H SER 51 -12.270 4.641 -1.229 397 HA SER 51 HA SER 51 -13.892 4.735 1.264 398 HG SER 51 HG SER 51 -11.835 2.341 2.636 399 HB2 SER 51 2HB SER 51 -12.529 2.733 0.182 400 HB3 SER 51 1HB SER 51 -11.121 3.403 1.007 401 H MET 52 H MET 52 -10.324 5.283 1.330 402 HA MET 52 HA MET 52 -10.239 6.543 3.769 403 HB2 MET 52 2HB MET 52 -8.356 7.235 1.419 404 HB3 MET 52 1HB MET 52 -7.998 7.525 3.113 405 HG2 MET 52 2HG MET 52 -8.667 4.699 2.935 406 HG3 MET 52 1HG MET 52 -7.555 5.064 1.637 407 HE1 MET 52 3HE MET 52 -4.403 4.820 3.454 408 HE2 MET 52 1HE MET 52 -4.920 6.017 2.233 409 HE3 MET 52 2HE MET 52 -5.473 4.314 2.135 410 H ARG 53 H ARG 53 -11.474 8.288 1.268 411 HA ARG 53 HA ARG 53 -11.459 11.056 2.257 412 HE ARG 53 HE ARG 53 -16.481 12.896 0.085 413 HB2 ARG 53 2HB ARG 53 -12.424 10.097 0.052 414 HB3 ARG 53 1HB ARG 53 -13.726 9.375 1.007 415 HG2 ARG 53 2HG ARG 53 -14.302 11.808 1.796 416 HG3 ARG 53 1HG ARG 53 -13.115 12.386 0.653 417 HD2 ARG 53 2HD ARG 53 -14.438 11.108 -1.221 418 HD3 ARG 53 1HD ARG 53 -15.603 10.653 0.000 419 HH11 ARG 53 2HH1 ARG 53 -13.452 12.998 -1.466 420 HH12 ARG 53 1HH1 ARG 53 -13.544 14.804 -1.751 421 HH21 ARG 53 1HH2 ARG 53 -16.635 14.895 -0.363 422 HH22 ARG 53 2HH2 ARG 53 -15.347 15.771 -1.329 423 H ASP 54 H ASP 54 -13.095 8.171 3.524 424 HA ASP 54 HA ASP 54 -14.232 9.682 5.866 425 HB2 ASP 54 2HB ASP 54 -15.092 7.352 4.432 426 HB3 ASP 54 1HB ASP 54 -14.386 6.685 5.869 427 H ASP 55 H ASP 55 -12.192 6.653 5.986 428 HA ASP 55 HA ASP 55 -10.641 7.822 8.295 429 HB2 ASP 55 2HB ASP 55 -11.001 5.035 7.132 430 HB3 ASP 55 1HB ASP 55 -9.425 5.349 7.802 431 H LEU 56 H LEU 56 -9.096 9.272 7.708 432 HA LEU 56 HA LEU 56 -7.296 8.964 5.480 433 HG LEU 56 HG LEU 56 -7.497 12.672 6.516 434 HB2 LEU 56 2HB LEU 56 -6.338 10.740 7.741 435 HB3 LEU 56 1HB LEU 56 -6.177 10.899 6.031 436 HD11 LEU 56 1HD1 LEU 56 -8.790 11.303 4.763 437 HD12 LEU 56 2HD1 LEU 56 -9.788 12.437 5.685 438 HD13 LEU 56 3HD1 LEU 56 -9.830 10.706 6.060 439 HD21 LEU 56 3HD2 LEU 56 -8.938 11.029 8.654 440 HD22 LEU 56 1HD2 LEU 56 -9.451 12.664 8.167 441 HD23 LEU 56 2HD2 LEU 56 -7.834 12.415 8.861 442 HA PRO 57 HA PRO 57 -4.006 6.345 7.324 443 HB2 PRO 57 2HB PRO 57 -2.104 6.384 5.415 444 HB3 PRO 57 1HB PRO 57 -3.727 5.791 5.142 445 HG2 PRO 57 2HG PRO 57 -2.616 8.567 4.375 446 HG3 PRO 57 1HG PRO 57 -3.500 7.443 3.332 447 HD2 PRO 57 2HD PRO 57 -4.712 9.538 4.758 448 HD3 PRO 57 1HD PRO 57 -5.600 8.061 4.271 449 H GLY 58 H GLY 58 -1.744 8.709 6.083 450 HA2 GLY 58 2HA GLY 58 -0.674 9.196 8.935 451 HA3 GLY 58 1HA GLY 58 0.347 8.889 7.539 452 H SER 59 H SER 59 1.484 10.726 8.037 453 HA SER 59 HA SER 59 0.359 13.401 8.117 454 HG SER 59 HG SER 59 3.386 14.460 9.042 455 HB2 SER 59 2HB SER 59 2.716 12.422 8.868 456 HB3 SER 59 1HB SER 59 3.254 12.911 7.259 457 H ALA 60 H ALA 60 0.895 11.589 5.267 458 HA ALA 60 HA ALA 60 -0.942 13.517 4.067 459 HB1 ALA 60 3HB ALA 60 1.637 13.212 2.429 460 HB2 ALA 60 1HB ALA 60 1.129 14.654 3.345 461 HB3 ALA 60 2HB ALA 60 0.176 14.105 1.953 462 H GLN 61 H GLN 61 -1.903 13.022 2.073 463 HA GLN 61 HA GLN 61 -2.151 10.028 1.457 464 HB2 GLN 61 2HB GLN 61 -3.861 11.354 3.007 465 HB3 GLN 61 1HB GLN 61 -4.383 12.156 1.530 466 HG2 GLN 61 2HG GLN 61 -4.983 9.847 0.569 467 HG3 GLN 61 1HG GLN 61 -4.529 9.120 2.062 468 HE21 GLN 61 1HE2 GLN 61 -5.882 11.403 3.660 469 HE22 GLN 61 2HE2 GLN 61 -7.620 10.787 3.520 470 H ILE 62 H ILE 62 -1.039 9.972 -0.380 471 HA ILE 62 HA ILE 62 -1.341 11.982 -2.632 472 HB ILE 62 HB ILE 62 0.550 9.677 -1.934 473 HG12 ILE 62 2HG1 ILE 62 1.439 12.480 -2.503 474 HG13 ILE 62 1HG1 ILE 62 0.700 12.181 -0.931 475 HG21 ILE 62 1HG2 ILE 62 0.547 11.243 -4.562 476 HG22 ILE 62 2HG2 ILE 62 0.507 9.461 -4.378 477 HG23 ILE 62 3HG2 ILE 62 1.987 10.369 -3.956 478 HD11 ILE 62 3HD1 ILE 62 3.137 12.056 -0.716 479 HD12 ILE 62 1HD1 ILE 62 3.286 10.908 -2.038 480 HD13 ILE 62 2HD1 ILE 62 2.539 10.403 -0.495 481 H VAL 63 H VAL 63 -2.777 11.558 -4.307 482 HA VAL 63 HA VAL 63 -3.303 8.645 -5.045 483 HB VAL 63 HB VAL 63 -4.930 11.089 -5.746 484 HG11 VAL 63 1HG1 VAL 63 -5.071 9.584 -7.774 485 HG12 VAL 63 2HG1 VAL 63 -6.583 9.460 -6.859 486 HG13 VAL 63 3HG1 VAL 63 -5.360 8.170 -6.743 487 HG21 VAL 63 3HG2 VAL 63 -5.510 8.459 -4.188 488 HG22 VAL 63 1HG2 VAL 63 -6.681 9.780 -4.425 489 HG23 VAL 63 2HG2 VAL 63 -5.204 10.052 -3.471 490 H MET 64 H MET 64 -2.010 7.720 -6.377 491 HA MET 64 HA MET 64 -0.719 8.979 -8.763 492 HB2 MET 64 2HB MET 64 -1.051 6.134 -7.668 493 HB3 MET 64 1HB MET 64 -0.519 6.351 -9.288 494 HG2 MET 64 2HG MET 64 1.170 8.162 -7.752 495 HG3 MET 64 1HG MET 64 0.956 6.708 -6.783 496 HE1 MET 64 3HE MET 64 1.706 8.175 -10.329 497 HE2 MET 64 1HE MET 64 0.902 6.708 -10.971 498 HE3 MET 64 2HE MET 64 2.674 6.884 -11.114 499 H SER 65 H SER 65 -2.305 9.950 -9.844 500 HA SER 65 HA SER 65 -3.759 8.298 -11.858 501 HG SER 65 HG SER 65 -6.593 8.099 -11.512 502 HB2 SER 65 2HB SER 65 -5.368 8.413 -9.813 503 HB3 SER 65 1HB SER 65 -5.444 10.161 -10.045 504 H ARG 66 H ARG 66 -5.295 10.220 -12.999 505 HA ARG 66 HA ARG 66 -3.667 12.810 -13.208 506 HE ARG 66 HE ARG 66 -1.563 9.227 -17.268 507 HB2 ARG 66 2HB ARG 66 -4.643 11.312 -15.714 508 HB3 ARG 66 1HB ARG 66 -4.188 12.985 -15.665 509 HG2 ARG 66 2HG ARG 66 -2.258 12.054 -16.486 510 HG3 ARG 66 1HG ARG 66 -1.834 12.307 -14.822 511 HD2 ARG 66 2HD ARG 66 -1.586 9.996 -14.361 512 HD3 ARG 66 1HD ARG 66 -2.949 9.560 -15.335 513 HH11 ARG 66 2HH1 ARG 66 0.409 10.702 -14.795 514 HH12 ARG 66 1HH1 ARG 66 1.873 10.611 -15.845 515 HH21 ARG 66 1HH2 ARG 66 0.178 9.061 -18.365 516 HH22 ARG 66 2HH2 ARG 66 1.745 9.727 -17.713 517 H SER 67 H SER 67 -5.720 12.473 -11.478 518 HA SER 67 HA SER 67 -8.021 14.072 -12.557 519 HG SER 67 HG SER 67 -7.883 13.627 -8.574 520 HB2 SER 67 2HB SER 67 -8.978 13.908 -10.397 521 HB3 SER 67 1HB SER 67 -8.220 12.348 -10.674 522 H GLU 68 H GLU 68 -8.666 16.175 -11.455 523 HA GLU 68 HA GLU 68 -6.677 18.239 -11.835 524 HB2 GLU 68 2HB GLU 68 -9.517 18.220 -10.653 525 HB3 GLU 68 1HB GLU 68 -8.634 19.702 -10.900 526 HG2 GLU 68 2HG GLU 68 -9.096 17.792 -13.292 527 HG3 GLU 68 1HG GLU 68 -10.286 18.990 -12.797 528 H ARG 69 H ARG 69 -6.711 16.477 -9.095 529 HA ARG 69 HA ARG 69 -5.764 16.636 -6.953 530 HE ARG 69 HE ARG 69 -1.727 20.720 -8.269 531 HB2 ARG 69 2HB ARG 69 -4.927 19.537 -7.115 532 HB3 ARG 69 1HB ARG 69 -4.305 18.267 -6.120 533 HG2 ARG 69 2HG ARG 69 -2.530 18.079 -7.513 534 HG3 ARG 69 1HG ARG 69 -3.609 17.289 -8.641 535 HD2 ARG 69 2HD ARG 69 -2.381 18.952 -9.847 536 HD3 ARG 69 1HD ARG 69 -4.031 19.457 -9.850 537 HH11 ARG 69 2HH1 ARG 69 -5.151 20.900 -9.008 538 HH12 ARG 69 1HH1 ARG 69 -5.226 22.619 -8.413 539 HH21 ARG 69 1HH2 ARG 69 -1.882 22.619 -7.584 540 HH22 ARG 69 2HH2 ARG 69 -3.459 23.529 -7.627 541 H SER 70 H SER 70 -5.997 18.387 -4.867 542 HA SER 70 HA SER 70 -7.506 19.062 -3.235 543 HG SER 70 HG SER 70 -7.476 21.491 -3.463 544 HB2 SER 70 2HB SER 70 -8.937 20.302 -5.615 545 HB3 SER 70 1HB SER 70 -9.452 20.565 -3.953 546 H PHE 71 H PHE 71 -8.305 17.477 -2.112 547 HA PHE 71 HA PHE 71 -10.669 15.839 -3.196 548 HD1 PHE 71 HD1 PHE 71 -10.171 13.913 -4.610 549 HD2 PHE 71 HD2 PHE 71 -6.318 14.425 -2.757 550 HE1 PHE 71 HE1 PHE 71 -9.090 12.756 -6.501 551 HE2 PHE 71 HE2 PHE 71 -5.272 13.269 -4.651 552 HZ PHE 71 HZ PHE 71 -6.644 12.425 -6.518 553 HB2 PHE 71 2HB PHE 71 -8.262 14.990 -1.479 554 HB3 PHE 71 1HB PHE 71 -9.614 13.991 -1.880 555 H SER 72 H SER 72 -9.404 16.219 0.194 556 HA SER 72 HA SER 72 -12.006 17.104 1.185 557 HG SER 72 HG SER 72 -13.868 15.732 1.671 558 HB2 SER 72 2HB SER 72 -11.549 14.108 1.435 559 HB3 SER 72 1HB SER 72 -12.213 14.923 2.832 560 H VAL 73 H VAL 73 -9.268 15.251 2.693 561 HA VAL 73 HA VAL 73 -9.158 17.287 4.926 562 HB VAL 73 HB VAL 73 -8.886 14.792 5.319 563 HG11 VAL 73 1HG1 VAL 73 -6.211 15.093 3.844 564 HG12 VAL 73 2HG1 VAL 73 -7.533 13.952 3.509 565 HG13 VAL 73 3HG1 VAL 73 -6.537 13.774 4.956 566 HG21 VAL 73 3HG2 VAL 73 -6.635 16.611 6.343 567 HG22 VAL 73 1HG2 VAL 73 -6.890 14.951 6.902 568 HG23 VAL 73 2HG2 VAL 73 -8.165 16.153 7.134 569 H ASP 74 H ASP 74 -7.529 18.871 5.191 570 HA ASP 74 HA ASP 74 -5.843 19.820 3.134 571 HB2 ASP 74 2HB ASP 74 -5.533 20.027 6.182 572 HB3 ASP 74 1HB ASP 74 -4.533 20.901 5.033 573 H THR 75 H THR 75 -4.821 17.243 5.460 574 HA THR 75 HA THR 75 -2.208 16.819 4.040 575 HB THR 75 HB THR 75 -2.017 14.767 5.371 576 HG1 THR 75 HG1 THR 75 -3.486 14.246 6.881 577 HG21 THR 75 3HG2 THR 75 -1.769 15.615 7.625 578 HG22 THR 75 1HG2 THR 75 -2.769 17.044 7.268 579 HG23 THR 75 2HG2 THR 75 -1.183 16.825 6.475 580 H ALA 76 H ALA 76 -4.271 16.881 2.102 581 HA ALA 76 HA ALA 76 -3.869 14.146 0.866 582 HB1 ALA 76 3HB ALA 76 -6.682 15.340 1.149 583 HB2 ALA 76 1HB ALA 76 -6.038 13.835 1.863 584 HB3 ALA 76 2HB ALA 76 -6.262 13.949 0.112 585 H HIS 77 H HIS 77 -3.404 14.119 -1.087 586 HA HIS 77 HA HIS 77 -3.298 16.637 -2.841 587 HD1 HIS 77 HD1 HIS 77 -0.792 15.835 0.954 588 HD2 HIS 77 HD2 HIS 77 -1.588 19.029 -1.768 589 HE1 HIS 77 HE1 HIS 77 -0.645 18.101 2.177 590 HB2 HIS 77 2HB HIS 77 -0.924 15.137 -1.544 591 HB3 HIS 77 1HB HIS 77 -0.761 16.459 -2.710 592 H ARG 78 H ARG 78 -1.682 15.937 -4.859 593 HA ARG 78 HA ARG 78 -2.570 13.134 -5.766 594 HE ARG 78 HE ARG 78 -4.323 14.679 -10.713 595 HB2 ARG 78 2HB ARG 78 -4.255 15.036 -6.338 596 HB3 ARG 78 1HB ARG 78 -3.092 15.548 -7.545 597 HG2 ARG 78 2HG ARG 78 -4.276 12.700 -7.392 598 HG3 ARG 78 1HG ARG 78 -5.114 13.997 -8.196 599 HD2 ARG 78 2HD ARG 78 -2.344 12.964 -9.035 600 HD3 ARG 78 1HD ARG 78 -3.841 12.428 -9.716 601 HH11 ARG 78 2HH1 ARG 78 -1.101 14.439 -9.409 602 HH12 ARG 78 1HH1 ARG 78 -0.490 15.721 -10.533 603 HH21 ARG 78 1HH2 ARG 78 -3.641 16.096 -11.897 604 HH22 ARG 78 2HH2 ARG 78 -1.874 16.614 -11.912 605 H ALA 79 H ALA 79 -0.957 12.044 -6.561 606 HA ALA 79 HA ALA 79 1.466 13.336 -7.868 607 HB1 ALA 79 3HB ALA 79 0.702 10.417 -7.133 608 HB2 ALA 79 1HB ALA 79 1.854 11.503 -6.288 609 HB3 ALA 79 2HB ALA 79 2.236 10.909 -7.898 610 H ALA 80 H ALA 80 1.863 13.228 -9.945 611 HA ALA 80 HA ALA 80 -0.022 11.925 -11.968 612 HB1 ALA 80 3HB ALA 80 0.300 14.162 -12.532 613 HB2 ALA 80 1HB ALA 80 1.421 13.294 -13.630 614 HB3 ALA 80 2HB ALA 80 2.052 14.186 -12.227 615 H SER 81 H SER 81 3.293 11.517 -10.754 616 HA SER 81 HA SER 81 3.425 8.847 -12.216 617 HG SER 81 HG SER 81 5.902 12.020 -12.488 618 HB2 SER 81 2HB SER 81 5.740 9.403 -12.938 619 HB3 SER 81 1HB SER 81 4.631 10.638 -13.542 620 H VAL 82 H VAL 82 5.877 7.969 -11.302 621 HA VAL 82 HA VAL 82 5.590 7.644 -8.304 622 HB VAL 82 HB VAL 82 7.693 6.413 -10.161 623 HG11 VAL 82 1HG1 VAL 82 8.944 6.568 -8.141 624 HG12 VAL 82 2HG1 VAL 82 8.114 5.037 -7.847 625 HG13 VAL 82 3HG1 VAL 82 7.517 6.523 -7.105 626 HG21 VAL 82 3HG2 VAL 82 5.815 5.024 -10.498 627 HG22 VAL 82 1HG2 VAL 82 5.116 5.319 -8.888 628 HG23 VAL 82 2HG2 VAL 82 6.479 4.222 -9.076 629 H GLU 83 H GLU 83 8.123 8.958 -10.528 630 HA GLU 83 HA GLU 83 9.583 10.592 -8.748 631 HB2 GLU 83 2HB GLU 83 8.654 11.058 -11.631 632 HB3 GLU 83 1HB GLU 83 9.850 12.056 -10.841 633 HG2 GLU 83 2HG GLU 83 11.525 10.328 -10.774 634 HG3 GLU 83 1HG GLU 83 10.383 9.029 -10.897 635 H GLU 84 H GLU 84 6.487 11.887 -10.287 636 HA GLU 84 HA GLU 84 6.319 14.091 -8.347 637 HB2 GLU 84 2HB GLU 84 4.198 12.776 -10.120 638 HB3 GLU 84 1HB GLU 84 3.739 13.979 -8.946 639 HG2 GLU 84 2HG GLU 84 3.989 15.436 -10.661 640 HG3 GLU 84 1HG GLU 84 5.647 15.492 -10.124 641 H ALA 85 H ALA 85 5.356 10.796 -7.789 642 HA ALA 85 HA ALA 85 3.827 11.403 -5.262 643 HB1 ALA 85 3HB ALA 85 4.942 8.705 -6.232 644 HB2 ALA 85 1HB ALA 85 3.336 9.303 -6.675 645 HB3 ALA 85 2HB ALA 85 3.706 8.959 -4.983 646 H VAL 86 H VAL 86 7.102 10.224 -5.954 647 HA VAL 86 HA VAL 86 8.083 10.389 -3.127 648 HB VAL 86 HB VAL 86 9.326 9.900 -5.870 649 HG11 VAL 86 1HG1 VAL 86 10.992 10.268 -3.303 650 HG12 VAL 86 2HG1 VAL 86 11.085 11.238 -4.794 651 HG13 VAL 86 3HG1 VAL 86 11.571 9.538 -4.822 652 HG21 VAL 86 3HG2 VAL 86 8.236 7.956 -4.610 653 HG22 VAL 86 1HG2 VAL 86 9.334 8.236 -3.244 654 HG23 VAL 86 2HG2 VAL 86 9.969 7.689 -4.807 655 H ASP 87 H ASP 87 8.680 12.720 -5.950 656 HA ASP 87 HA ASP 87 9.721 14.761 -4.250 657 HB2 ASP 87 2HB ASP 87 8.457 14.860 -7.029 658 HB3 ASP 87 1HB ASP 87 8.613 16.367 -6.165 659 H ILE 88 H ILE 88 6.182 14.228 -4.755 660 HA ILE 88 HA ILE 88 5.692 16.552 -2.954 661 HB ILE 88 HB ILE 88 3.603 16.552 -2.875 662 HG12 ILE 88 2HG1 ILE 88 2.813 13.866 -4.115 663 HG13 ILE 88 1HG1 ILE 88 3.286 13.904 -2.443 664 HG21 ILE 88 1HG2 ILE 88 2.670 16.677 -5.105 665 HG22 ILE 88 2HG2 ILE 88 3.730 15.403 -5.711 666 HG23 ILE 88 3HG2 ILE 88 4.421 16.971 -5.292 667 HD11 ILE 88 3HD1 ILE 88 1.135 14.491 -1.956 668 HD12 ILE 88 1HD1 ILE 88 0.803 15.088 -3.603 669 HD13 ILE 88 2HD1 ILE 88 1.578 16.117 -2.384 670 H ALA 89 H ALA 89 5.948 13.089 -2.212 671 HA ALA 89 HA ALA 89 5.310 13.368 0.678 672 HB1 ALA 89 3HB ALA 89 5.222 11.123 -0.150 673 HB2 ALA 89 1HB ALA 89 6.715 11.161 0.795 674 HB3 ALA 89 2HB ALA 89 6.794 11.250 -0.969 675 H ALA 90 H ALA 90 8.503 13.370 -0.959 676 HA ALA 90 HA ALA 90 10.002 14.284 1.423 677 HB1 ALA 90 3HB ALA 90 11.810 14.661 -0.342 678 HB2 ALA 90 1HB ALA 90 10.611 14.359 -1.612 679 HB3 ALA 90 2HB ALA 90 11.046 13.071 -0.473 680 H SER 91 H SER 91 8.215 16.183 -0.964 681 HA SER 91 HA SER 91 9.197 18.838 -0.043 682 HG SER 91 HG SER 91 8.450 17.845 -2.790 683 HB2 SER 91 2HB SER 91 6.620 18.027 -1.517 684 HB3 SER 91 1HB SER 91 7.045 19.707 -1.120 685 H LEU 92 H LEU 92 6.670 16.794 1.305 686 HA LEU 92 HA LEU 92 5.691 19.034 3.048 687 HG LEU 92 HG LEU 92 5.124 15.649 1.791 688 HB2 LEU 92 2HB LEU 92 4.180 17.263 4.146 689 HB3 LEU 92 1HB LEU 92 3.818 18.051 2.655 690 HD11 LEU 92 1HD1 LEU 92 3.279 14.980 4.146 691 HD12 LEU 92 2HD1 LEU 92 5.012 14.628 3.988 692 HD13 LEU 92 3HD1 LEU 92 3.857 13.847 2.892 693 HD21 LEU 92 3HD2 LEU 92 2.888 15.014 0.927 694 HD22 LEU 92 1HD2 LEU 92 3.188 16.732 0.647 695 HD23 LEU 92 2HD2 LEU 92 2.106 16.237 1.961 696 H ASP 93 H ASP 93 7.065 15.887 4.018 697 HA ASP 93 HA ASP 93 9.375 16.687 5.191 698 HB2 ASP 93 2HB ASP 93 7.297 17.454 7.268 699 HB3 ASP 93 1HB ASP 93 8.650 16.556 7.880 700 H ALA 94 H ALA 94 9.715 14.519 4.372 701 HA ALA 94 HA ALA 94 9.446 12.424 6.532 702 HB1 ALA 94 3HB ALA 94 7.273 12.279 5.311 703 HB2 ALA 94 1HB ALA 94 8.216 10.792 5.146 704 HB3 ALA 94 2HB ALA 94 8.126 11.930 3.776 705 H GLU 95 H GLU 95 10.917 10.879 6.571 706 HA GLU 95 HA GLU 95 13.086 10.678 4.496 707 HB2 GLU 95 2HB GLU 95 13.019 8.595 6.700 708 HB3 GLU 95 1HB GLU 95 14.345 9.311 5.821 709 HG2 GLU 95 2HG GLU 95 13.905 11.499 7.238 710 HG3 GLU 95 1HG GLU 95 12.798 10.504 8.186 711 H THR 96 H THR 96 10.631 8.413 5.775 712 HA THR 96 HA THR 96 10.683 6.801 3.178 713 HB THR 96 HB THR 96 9.352 5.042 4.635 714 HG1 THR 96 HG1 THR 96 9.035 6.027 6.535 715 HG21 THR 96 3HG2 THR 96 12.357 5.415 5.154 716 HG22 THR 96 1HG2 THR 96 11.593 4.457 3.836 717 HG23 THR 96 2HG2 THR 96 11.408 3.961 5.532 718 H ALA 97 H ALA 97 8.722 6.167 2.380 719 HA ALA 97 HA ALA 97 6.155 7.310 3.557 720 HB1 ALA 97 3HB ALA 97 6.370 8.854 1.761 721 HB2 ALA 97 1HB ALA 97 5.371 7.602 0.994 722 HB3 ALA 97 2HB ALA 97 7.109 7.706 0.639 723 H TYR 98 H TYR 98 4.252 6.179 2.517 724 HA TYR 98 HA TYR 98 4.812 3.240 1.947 725 HD1 TYR 98 HD1 TYR 98 4.632 0.963 3.825 726 HD2 TYR 98 HD2 TYR 98 4.527 4.749 5.778 727 HE1 TYR 98 HE1 TYR 98 6.476 0.255 5.274 728 HE2 TYR 98 HE2 TYR 98 6.353 4.018 7.278 729 HH TYR 98 HH TYR 98 8.236 2.539 7.101 730 HB2 TYR 98 2HB TYR 98 2.865 4.263 4.111 731 HB3 TYR 98 1HB TYR 98 2.740 2.642 3.463 732 H VAL 99 H VAL 99 2.696 2.103 1.314 733 HA VAL 99 HA VAL 99 0.817 3.815 -0.368 734 HB VAL 99 HB VAL 99 1.619 3.316 -2.307 735 HG11 VAL 99 1HG1 VAL 99 3.911 3.293 -1.534 736 HG12 VAL 99 2HG1 VAL 99 3.651 2.405 -3.006 737 HG13 VAL 99 3HG1 VAL 99 3.910 1.558 -1.486 738 HG21 VAL 99 3HG2 VAL 99 1.742 1.047 -3.443 739 HG22 VAL 99 1HG2 VAL 99 0.175 1.590 -2.807 740 HG23 VAL 99 2HG2 VAL 99 1.141 0.380 -1.911 741 H ILE 100 H ILE 100 -1.329 3.225 0.467 742 HA ILE 100 HA ILE 100 -1.763 0.424 1.338 743 HB ILE 100 HB ILE 100 -4.102 2.215 0.474 744 HG12 ILE 100 2HG1 ILE 100 -3.215 3.375 2.265 745 HG13 ILE 100 1HG1 ILE 100 -4.531 2.464 2.955 746 HG21 ILE 100 1HG2 ILE 100 -4.176 -0.316 2.241 747 HG22 ILE 100 2HG2 ILE 100 -4.788 -0.223 0.573 748 HG23 ILE 100 3HG2 ILE 100 -5.548 0.730 1.844 749 HD11 ILE 100 3HD1 ILE 100 -1.576 1.716 3.308 750 HD12 ILE 100 1HD1 ILE 100 -2.959 0.906 4.104 751 HD13 ILE 100 2HD1 ILE 100 -2.553 2.629 4.453 752 H GLY 101 H GLY 101 -3.137 1.750 -1.535 753 HA2 GLY 101 2HA GLY 101 -2.835 0.981 -3.854 754 HA3 GLY 101 1HA GLY 101 -1.585 -0.036 -3.297 755 H GLY 102 H GLY 102 -2.385 -2.059 -4.720 756 HA2 GLY 102 2HA GLY 102 -4.841 -0.311 -5.561 757 HA3 GLY 102 1HA GLY 102 -3.266 -0.219 -6.280 758 H ALA 103 H ALA 103 -6.247 -1.585 -6.761 759 HA ALA 103 HA ALA 103 -6.041 -3.018 -9.121 760 HB1 ALA 103 3HB ALA 103 -7.758 -1.344 -10.054 761 HB2 ALA 103 1HB ALA 103 -7.301 -0.193 -8.826 762 HB3 ALA 103 2HB ALA 103 -8.073 -1.690 -8.373 763 H ALA 104 H ALA 104 -5.034 0.404 -9.361 764 HA ALA 104 HA ALA 104 -2.993 -0.467 -11.527 765 HB1 ALA 104 3HB ALA 104 -3.888 2.370 -10.787 766 HB2 ALA 104 1HB ALA 104 -4.467 1.428 -12.191 767 HB3 ALA 104 2HB ALA 104 -2.766 1.910 -12.087 768 H ILE 105 H ILE 105 -3.019 0.606 -8.178 769 HA ILE 105 HA ILE 105 -0.434 2.026 -8.312 770 HB ILE 105 HB ILE 105 -1.591 1.100 -5.660 771 HG12 ILE 105 2HG1 ILE 105 -3.536 2.062 -6.751 772 HG13 ILE 105 1HG1 ILE 105 -2.962 3.058 -5.483 773 HG21 ILE 105 1HG2 ILE 105 -0.616 3.125 -4.694 774 HG22 ILE 105 2HG2 ILE 105 -0.052 3.672 -6.270 775 HG23 ILE 105 3HG2 ILE 105 0.643 2.232 -5.531 776 HD11 ILE 105 3HD1 ILE 105 -2.493 4.830 -6.996 777 HD12 ILE 105 1HD1 ILE 105 -3.637 3.920 -8.035 778 HD13 ILE 105 2HD1 ILE 105 -1.890 3.732 -8.275 779 H TYR 106 H TYR 106 -1.021 -0.929 -6.401 780 HA TYR 106 HA TYR 106 1.816 -1.702 -6.155 781 HD1 TYR 106 HD1 TYR 106 2.474 -4.446 -5.104 782 HD2 TYR 106 HD2 TYR 106 -0.747 -2.314 -3.210 783 HE1 TYR 106 HE1 TYR 106 3.297 -5.102 -2.920 784 HE2 TYR 106 HE2 TYR 106 0.093 -3.005 -1.020 785 HH TYR 106 HH TYR 106 2.095 -4.112 0.109 786 HB2 TYR 106 2HB TYR 106 -0.889 -3.008 -5.649 787 HB3 TYR 106 1HB TYR 106 0.309 -4.103 -6.213 788 H ALA 107 H ALA 107 -0.500 -2.477 -8.816 789 HA ALA 107 HA ALA 107 1.497 -3.938 -10.434 790 HB1 ALA 107 3HB ALA 107 -0.989 -4.166 -10.638 791 HB2 ALA 107 1HB ALA 107 -0.302 -3.668 -12.188 792 HB3 ALA 107 2HB ALA 107 -1.126 -2.470 -11.165 793 H LEU 108 H LEU 108 1.105 -0.471 -10.130 794 HA LEU 108 HA LEU 108 3.143 -0.069 -12.370 795 HG LEU 108 HG LEU 108 2.087 2.400 -9.788 796 HB2 LEU 108 2HB LEU 108 2.365 1.973 -12.791 797 HB3 LEU 108 1HB LEU 108 0.906 1.363 -12.087 798 HD11 LEU 108 1HD1 LEU 108 2.918 4.373 -12.031 799 HD12 LEU 108 2HD1 LEU 108 4.074 3.265 -11.268 800 HD13 LEU 108 3HD1 LEU 108 3.265 4.481 -10.289 801 HD21 LEU 108 3HD2 LEU 108 0.480 4.118 -11.759 802 HD22 LEU 108 1HD2 LEU 108 0.618 4.311 -9.978 803 HD23 LEU 108 2HD2 LEU 108 -0.233 2.912 -10.654 804 H PHE 109 H PHE 109 2.825 0.373 -8.867 805 HA PHE 109 HA PHE 109 5.562 1.447 -8.540 806 HD1 PHE 109 HD2 PHE 109 6.528 2.537 -6.162 807 HD2 PHE 109 HD1 PHE 109 2.331 3.017 -6.974 808 HE1 PHE 109 HE2 PHE 109 6.735 4.917 -5.758 809 HE2 PHE 109 HE1 PHE 109 2.584 5.438 -6.526 810 HZ PHE 109 HZ PHE 109 4.782 6.394 -5.951 811 HB2 PHE 109 2HB PHE 109 3.268 0.728 -6.629 812 HB3 PHE 109 1HB PHE 109 4.856 0.616 -5.960 813 H GLN 110 H GLN 110 4.421 -1.891 -8.395 814 HA GLN 110 HA GLN 110 6.266 -3.259 -6.914 815 HB2 GLN 110 2HB GLN 110 6.268 -5.164 -8.622 816 HB3 GLN 110 1HB GLN 110 4.839 -4.660 -7.777 817 HG2 GLN 110 2HG GLN 110 3.690 -4.717 -9.657 818 HG3 GLN 110 1HG GLN 110 4.423 -3.252 -10.157 819 HE21 GLN 110 1HE2 GLN 110 4.416 -6.753 -10.559 820 HE22 GLN 110 2HE2 GLN 110 5.277 -6.656 -12.182 821 HA PRO 111 HA PRO 111 10.442 -3.012 -9.220 822 HB2 PRO 111 2HB PRO 111 10.450 -0.979 -11.344 823 HB3 PRO 111 1HB PRO 111 10.694 -2.729 -11.473 824 HG2 PRO 111 2HG PRO 111 8.419 -1.397 -12.516 825 HG3 PRO 111 1HG PRO 111 8.513 -3.134 -12.153 826 HD2 PRO 111 2HD PRO 111 7.327 -0.918 -10.404 827 HD3 PRO 111 1HD PRO 111 6.673 -2.523 -10.749 828 H HIS 112 H HIS 112 8.613 -0.208 -8.464 829 HA HIS 112 HA HIS 112 11.073 1.538 -7.911 830 HD1 HIS 112 HD1 HIS 112 11.225 3.292 -10.225 831 HD2 HIS 112 HD2 HIS 112 7.099 2.219 -10.377 832 HE1 HIS 112 HE1 HIS 112 10.344 3.435 -12.675 833 HB2 HIS 112 2HB HIS 112 8.134 2.442 -7.962 834 HB3 HIS 112 1HB HIS 112 9.567 3.449 -7.867 835 H LEU 113 H LEU 113 8.959 -0.422 -6.059 836 HA LEU 113 HA LEU 113 8.965 1.201 -3.578 837 HG LEU 113 HG LEU 113 6.486 -1.085 -2.487 838 HB2 LEU 113 2HB LEU 113 8.617 -1.823 -4.110 839 HB3 LEU 113 1HB LEU 113 8.649 -1.178 -2.491 840 HD11 LEU 113 1HD1 LEU 113 6.658 1.349 -2.684 841 HD12 LEU 113 2HD1 LEU 113 5.231 0.829 -3.610 842 HD13 LEU 113 3HD1 LEU 113 6.715 1.230 -4.456 843 HD21 LEU 113 3HD2 LEU 113 6.526 -1.391 -5.510 844 HD22 LEU 113 1HD2 LEU 113 5.007 -1.359 -4.549 845 HD23 LEU 113 2HD2 LEU 113 6.212 -2.625 -4.297 846 H ASP 114 H ASP 114 10.300 1.350 -1.946 847 HA ASP 114 HA ASP 114 12.912 0.067 -1.482 848 HB2 ASP 114 2HB ASP 114 11.965 2.188 -0.424 849 HB3 ASP 114 1HB ASP 114 10.734 1.270 0.367 850 H ARG 115 H ARG 115 9.700 -0.733 -0.072 851 HA ARG 115 HA ARG 115 10.328 -3.718 -0.264 852 HE ARG 115 HE ARG 115 13.804 -3.057 2.970 853 HB2 ARG 115 2HB ARG 115 9.508 -2.134 2.261 854 HB3 ARG 115 1HB ARG 115 9.216 -3.851 2.161 855 HG2 ARG 115 2HG ARG 115 11.377 -4.430 2.542 856 HG3 ARG 115 1HG ARG 115 12.041 -3.214 1.455 857 HD2 ARG 115 2HD ARG 115 11.636 -1.432 3.290 858 HD3 ARG 115 1HD ARG 115 11.081 -2.750 4.335 859 HH11 ARG 115 2HH1 ARG 115 12.219 -2.478 5.920 860 HH12 ARG 115 1HH1 ARG 115 13.283 -3.670 6.786 861 HH21 ARG 115 1HH2 ARG 115 14.937 -4.380 4.001 862 HH22 ARG 115 2HH2 ARG 115 14.729 -4.621 5.752 863 H MET 116 H MET 116 8.555 -5.121 -0.143 864 HA MET 116 HA MET 116 5.774 -3.922 -0.796 865 HB2 MET 116 2HB MET 116 7.096 -6.472 -1.891 866 HB3 MET 116 1HB MET 116 5.346 -6.331 -1.800 867 HG2 MET 116 2HG MET 116 5.369 -4.430 -3.373 868 HG3 MET 116 1HG MET 116 7.120 -4.264 -3.218 869 HE1 MET 116 3HE MET 116 4.284 -5.965 -5.347 870 HE2 MET 116 1HE MET 116 4.421 -7.137 -3.995 871 HE3 MET 116 2HE MET 116 4.939 -7.600 -5.639 872 H VAL 117 H VAL 117 5.485 -3.660 1.512 873 HA VAL 117 HA VAL 117 5.148 -6.020 3.298 874 HB VAL 117 HB VAL 117 4.312 -3.117 3.528 875 HG11 VAL 117 1HG1 VAL 117 3.737 -3.484 5.968 876 HG12 VAL 117 2HG1 VAL 117 3.957 -5.242 5.751 877 HG13 VAL 117 3HG1 VAL 117 2.638 -4.390 4.927 878 HG21 VAL 117 3HG2 VAL 117 6.061 -2.920 5.287 879 HG22 VAL 117 1HG2 VAL 117 6.801 -3.657 3.849 880 HG23 VAL 117 2HG2 VAL 117 6.375 -4.669 5.233 881 H LEU 118 H LEU 118 3.501 -7.388 3.349 882 HA LEU 118 HA LEU 118 0.740 -6.595 2.319 883 HG LEU 118 HG LEU 118 -0.399 -8.906 1.158 884 HB2 LEU 118 2HB LEU 118 1.700 -7.469 0.416 885 HB3 LEU 118 1HB LEU 118 2.669 -8.677 1.205 886 HD11 LEU 118 1HD1 LEU 118 -0.014 -10.539 -0.783 887 HD12 LEU 118 2HD1 LEU 118 1.587 -9.783 -1.030 888 HD13 LEU 118 3HD1 LEU 118 0.075 -8.832 -1.151 889 HD21 LEU 118 3HD2 LEU 118 1.088 -10.455 2.685 890 HD22 LEU 118 1HD2 LEU 118 1.735 -11.154 1.187 891 HD23 LEU 118 2HD2 LEU 118 -0.032 -11.197 1.556 892 H SER 119 H SER 119 -0.931 -7.930 2.938 893 HA SER 119 HA SER 119 -0.568 -9.404 5.614 894 HG SER 119 HG SER 119 -1.824 -6.425 4.271 895 HB2 SER 119 2HB SER 119 -3.157 -8.005 5.479 896 HB3 SER 119 1HB SER 119 -1.892 -7.942 6.651 897 H ARG 120 H ARG 120 -0.959 -11.477 5.234 898 HA ARG 120 HA ARG 120 -2.713 -12.397 2.953 899 HE ARG 120 HE ARG 120 -1.227 -15.656 0.952 900 HB2 ARG 120 2HB ARG 120 -1.035 -13.963 5.007 901 HB3 ARG 120 1HB ARG 120 -1.870 -14.713 3.663 902 HG2 ARG 120 2HG ARG 120 0.370 -12.629 3.317 903 HG3 ARG 120 1HG ARG 120 0.671 -14.328 3.442 904 HD2 ARG 120 2HD ARG 120 -1.218 -13.242 1.228 905 HD3 ARG 120 1HD ARG 120 0.502 -13.229 1.001 906 HH11 ARG 120 2HH1 ARG 120 2.061 -14.566 1.351 907 HH12 ARG 120 1HH1 ARG 120 2.743 -16.120 0.708 908 HH21 ARG 120 1HH2 ARG 120 -0.425 -17.376 0.186 909 HH22 ARG 120 2HH2 ARG 120 1.388 -17.618 0.074 910 H VAL 121 H VAL 121 -4.867 -12.113 3.481 911 HA VAL 121 HA VAL 121 -5.899 -12.917 6.233 912 HB VAL 121 HB VAL 121 -7.397 -11.262 4.151 913 HG11 VAL 121 1HG1 VAL 121 -8.653 -10.375 6.097 914 HG12 VAL 121 2HG1 VAL 121 -7.642 -11.270 7.247 915 HG13 VAL 121 3HG1 VAL 121 -8.736 -12.141 6.141 916 HG21 VAL 121 3HG2 VAL 121 -5.025 -10.256 5.670 917 HG22 VAL 121 1HG2 VAL 121 -6.479 -9.307 5.992 918 HG23 VAL 121 2HG2 VAL 121 -5.927 -9.565 4.334 919 HA PRO 122 HA PRO 122 -7.906 -16.327 3.798 920 HB2 PRO 122 2HB PRO 122 -8.784 -17.382 6.506 921 HB3 PRO 122 1HB PRO 122 -7.962 -18.231 5.191 922 HG2 PRO 122 2HG PRO 122 -6.511 -17.486 7.371 923 HG3 PRO 122 1HG PRO 122 -5.813 -17.206 5.756 924 HD2 PRO 122 2HD PRO 122 -7.275 -15.122 7.491 925 HD3 PRO 122 1HD PRO 122 -5.676 -15.021 6.693 926 H GLY 123 H GLY 123 -10.215 -17.628 4.249 927 HA2 GLY 123 2HA GLY 123 -12.709 -17.117 4.651 928 HA3 GLY 123 1HA GLY 123 -12.418 -15.441 4.278 929 H GLU 124 H GLU 124 -10.788 -16.209 1.916 930 HA GLU 124 HA GLU 124 -10.936 -16.598 -0.355 931 HB2 GLU 124 2HB GLU 124 -12.878 -18.774 0.508 932 HB3 GLU 124 1HB GLU 124 -12.187 -18.659 -1.094 933 HG2 GLU 124 2HG GLU 124 -10.156 -19.570 -0.463 934 HG3 GLU 124 1HG GLU 124 -10.014 -18.568 0.959 935 H TYR 125 H TYR 125 -11.600 -15.324 -1.963 936 HA TYR 125 HA TYR 125 -14.431 -14.130 -1.750 937 HD1 TYR 125 HD2 TYR 125 -13.737 -13.700 0.617 938 HD2 TYR 125 HD1 TYR 125 -11.011 -10.818 -1.062 939 HE1 TYR 125 HE2 TYR 125 -12.776 -13.292 2.837 940 HE2 TYR 125 HE1 TYR 125 -10.063 -10.449 1.154 941 HH TYR 125 HH TYR 125 -10.526 -12.644 3.655 942 HB2 TYR 125 2HB TYR 125 -11.902 -12.587 -2.496 943 HB3 TYR 125 1HB TYR 125 -13.486 -11.910 -2.231 944 H GLU 126 H GLU 126 -15.264 -12.960 -3.614 945 HA GLU 126 HA GLU 126 -15.351 -14.775 -5.800 946 HB2 GLU 126 2HB GLU 126 -16.602 -11.990 -6.023 947 HB3 GLU 126 1HB GLU 126 -17.121 -13.497 -6.730 948 HG2 GLU 126 2HG GLU 126 -17.481 -14.247 -4.132 949 HG3 GLU 126 1HG GLU 126 -17.459 -12.501 -3.867 950 H GLY 127 H GLY 127 -14.411 -11.337 -6.334 951 HA2 GLY 127 2HA GLY 127 -11.884 -11.600 -7.624 952 HA3 GLY 127 1HA GLY 127 -12.963 -12.153 -8.881 953 H ASP 128 H ASP 128 -13.046 -9.438 -6.654 954 HA ASP 128 HA ASP 128 -13.728 -7.532 -8.877 955 HB2 ASP 128 2HB ASP 128 -13.831 -7.297 -5.801 956 HB3 ASP 128 1HB ASP 128 -14.312 -6.024 -6.907 957 H THR 129 H THR 129 -11.694 -6.637 -6.069 958 HA THR 129 HA THR 129 -9.836 -5.165 -7.971 959 HB THR 129 HB THR 129 -9.521 -5.213 -4.941 960 HG1 THR 129 HG1 THR 129 -11.598 -4.576 -5.251 961 HG21 THR 129 3HG2 THR 129 -8.541 -3.007 -5.182 962 HG22 THR 129 1HG2 THR 129 -9.057 -2.881 -6.874 963 HG23 THR 129 2HG2 THR 129 -7.727 -3.992 -6.426 964 H TYR 130 H TYR 130 -7.864 -6.002 -8.579 965 HA TYR 130 HA TYR 130 -6.859 -8.564 -7.205 966 HD1 TYR 130 HD1 TYR 130 -9.304 -8.079 -10.054 967 HD2 TYR 130 HD2 TYR 130 -6.426 -11.128 -9.094 968 HE1 TYR 130 HE1 TYR 130 -10.952 -9.810 -10.579 969 HE2 TYR 130 HE2 TYR 130 -8.099 -12.859 -9.610 970 HH TYR 130 HH TYR 130 -11.429 -11.968 -10.485 971 HB2 TYR 130 2HB TYR 130 -6.752 -7.598 -10.114 972 HB3 TYR 130 1HB TYR 130 -5.674 -8.836 -9.546 973 H TYR 131 H TYR 131 -4.925 -8.795 -6.436 974 HA TYR 131 HA TYR 131 -2.862 -6.627 -6.485 975 HD1 TYR 131 HD1 TYR 131 -2.191 -6.255 -3.432 976 HD2 TYR 131 HD2 TYR 131 -0.505 -9.829 -5.066 977 HE1 TYR 131 HE1 TYR 131 -0.128 -5.912 -2.178 978 HE2 TYR 131 HE2 TYR 131 1.626 -9.323 -4.050 979 HH TYR 131 HH TYR 131 2.057 -6.570 -1.852 980 HB2 TYR 131 2HB TYR 131 -3.630 -8.009 -4.449 981 HB3 TYR 131 1HB TYR 131 -2.964 -9.411 -5.181 982 HA PRO 132 HA PRO 132 -0.225 -8.639 -9.704 983 HB2 PRO 132 2HB PRO 132 2.288 -7.618 -8.462 984 HB3 PRO 132 1HB PRO 132 1.549 -7.172 -9.997 985 HG2 PRO 132 2HG PRO 132 1.609 -5.479 -7.788 986 HG3 PRO 132 1HG PRO 132 0.299 -5.427 -8.984 987 HD2 PRO 132 2HD PRO 132 0.271 -6.775 -6.259 988 HD3 PRO 132 1HD PRO 132 -0.989 -5.766 -7.029 989 H GLU 133 H GLU 133 1.648 -10.089 -9.989 990 HA GLU 133 HA GLU 133 1.796 -12.311 -8.026 991 HB2 GLU 133 2HB GLU 133 3.370 -13.307 -9.684 992 HB3 GLU 133 1HB GLU 133 1.785 -12.949 -10.326 993 HG2 GLU 133 2HG GLU 133 4.209 -11.073 -10.840 994 HG3 GLU 133 1HG GLU 133 3.823 -12.439 -11.881 995 H TRP 134 H TRP 134 3.808 -13.142 -7.280 996 HA TRP 134 HA TRP 134 5.903 -11.073 -6.482 997 HD1 TRP 134 HD1 TRP 134 5.321 -15.248 -5.245 998 HE1 TRP 134 HE1 TRP 134 3.075 -16.469 -4.599 999 HE3 TRP 134 HE3 TRP 134 2.984 -11.184 -3.282 1000 HZ2 TRP 134 HZ2 TRP 134 0.690 -15.626 -3.334 1001 HZ3 TRP 134 HZ3 TRP 134 0.620 -11.391 -2.652 1002 HH2 TRP 134 HH2 TRP 134 -0.509 -13.581 -2.581 1003 HB2 TRP 134 2HB TRP 134 6.337 -12.424 -4.354 1004 HB3 TRP 134 1HB TRP 134 4.975 -11.361 -4.406 1005 H ASP 135 H ASP 135 8.055 -11.694 -6.576 1006 HA ASP 135 HA ASP 135 8.614 -14.305 -8.056 1007 HB2 ASP 135 2HB ASP 135 8.611 -11.796 -9.271 1008 HB3 ASP 135 1HB ASP 135 10.251 -11.802 -8.643 1009 H ALA 136 H ALA 136 11.285 -14.024 -8.194 1010 HA ALA 136 HA ALA 136 12.284 -14.165 -5.255 1011 HB1 ALA 136 3HB ALA 136 13.532 -16.248 -5.837 1012 HB2 ALA 136 1HB ALA 136 13.006 -16.138 -7.544 1013 HB3 ALA 136 2HB ALA 136 11.814 -16.452 -6.254 1014 H ALA 137 H ALA 137 13.347 -13.330 -8.491 1015 HA ALA 137 HA ALA 137 15.962 -12.236 -7.298 1016 HB1 ALA 137 3HB ALA 137 16.744 -11.943 -9.638 1017 HB2 ALA 137 1HB ALA 137 15.208 -12.593 -10.262 1018 HB3 ALA 137 2HB ALA 137 16.310 -13.634 -9.315 1019 H GLU 138 H GLU 138 12.921 -11.011 -8.714 1020 HA GLU 138 HA GLU 138 13.686 -8.169 -8.634 1021 HB2 GLU 138 2HB GLU 138 10.956 -9.524 -8.289 1022 HB3 GLU 138 1HB GLU 138 11.222 -7.819 -8.492 1023 HG2 GLU 138 2HG GLU 138 11.929 -9.843 -10.695 1024 HG3 GLU 138 1HG GLU 138 10.418 -8.991 -10.565 1025 H TRP 139 H TRP 139 11.972 -10.134 -6.155 1026 HA TRP 139 HA TRP 139 13.104 -8.406 -3.929 1027 HD1 TRP 139 HD1 TRP 139 8.964 -10.438 -4.359 1028 HE1 TRP 139 HE1 TRP 139 7.387 -10.057 -6.525 1029 HE3 TRP 139 HE3 TRP 139 10.839 -5.951 -5.766 1030 HZ2 TRP 139 HZ2 TRP 139 7.279 -8.162 -8.491 1031 HZ3 TRP 139 HZ3 TRP 139 10.168 -5.032 -7.964 1032 HH2 TRP 139 HH2 TRP 139 8.400 -6.103 -9.303 1033 HB2 TRP 139 2HB TRP 139 10.629 -8.555 -2.849 1034 HB3 TRP 139 1HB TRP 139 11.210 -7.235 -3.796 1035 H GLU 140 H GLU 140 13.521 -9.324 -2.046 1036 HA GLU 140 HA GLU 140 13.090 -12.319 -1.689 1037 HB2 GLU 140 2HB GLU 140 15.170 -12.561 -0.889 1038 HB3 GLU 140 1HB GLU 140 15.522 -11.098 -1.758 1039 HG2 GLU 140 2HG GLU 140 15.100 -9.857 0.562 1040 HG3 GLU 140 1HG GLU 140 15.109 -11.448 1.287 1041 H LEU 141 H LEU 141 13.132 -12.707 0.932 1042 HA LEU 141 HA LEU 141 10.592 -11.346 1.955 1043 HG LEU 141 HG LEU 141 9.490 -14.663 3.229 1044 HB2 LEU 141 2HB LEU 141 11.403 -14.116 1.911 1045 HB3 LEU 141 1HB LEU 141 11.617 -13.634 3.553 1046 HD11 LEU 141 1HD1 LEU 141 8.802 -11.682 3.641 1047 HD12 LEU 141 2HD1 LEU 141 9.512 -12.726 4.889 1048 HD13 LEU 141 3HD1 LEU 141 7.913 -13.102 4.223 1049 HD21 LEU 141 3HD2 LEU 141 8.599 -12.509 1.208 1050 HD22 LEU 141 1HD2 LEU 141 7.721 -13.952 1.734 1051 HD23 LEU 141 2HD2 LEU 141 9.180 -14.124 0.749 1052 H ASP 142 H ASP 142 10.967 -9.651 3.297 1053 HA ASP 142 HA ASP 142 13.493 -9.219 4.882 1054 HB2 ASP 142 2HB ASP 142 12.127 -7.399 3.608 1055 HB3 ASP 142 1HB ASP 142 10.908 -7.551 4.836 1056 H ALA 143 H ALA 143 9.990 -9.569 5.663 1057 HA ALA 143 HA ALA 143 10.680 -11.175 8.154 1058 HB1 ALA 143 3HB ALA 143 8.981 -8.576 8.282 1059 HB2 ALA 143 1HB ALA 143 10.655 -8.708 8.844 1060 HB3 ALA 143 2HB ALA 143 9.362 -9.628 9.658 1061 H GLU 144 H GLU 144 9.202 -12.755 8.633 1062 HA GLU 144 HA GLU 144 6.352 -12.547 7.485 1063 HB2 GLU 144 2HB GLU 144 7.907 -14.311 6.356 1064 HB3 GLU 144 1HB GLU 144 7.789 -15.239 7.849 1065 HG2 GLU 144 2HG GLU 144 5.223 -15.265 7.568 1066 HG3 GLU 144 1HG GLU 144 5.394 -14.299 6.111 1067 H THR 145 H THR 145 4.854 -12.395 9.085 1068 HA THR 145 HA THR 145 5.232 -13.909 11.652 1069 HB THR 145 HB THR 145 6.445 -11.642 11.910 1070 HG1 THR 145 HG1 THR 145 5.602 -11.633 14.094 1071 HG21 THR 145 3HG2 THR 145 3.785 -10.440 11.638 1072 HG22 THR 145 1HG2 THR 145 5.319 -9.639 12.004 1073 HG23 THR 145 2HG2 THR 145 4.290 -10.267 13.312 1074 H ASP 146 H ASP 146 3.414 -14.178 13.044 1075 HA ASP 146 HA ASP 146 0.844 -14.191 11.536 1076 HB2 ASP 146 2HB ASP 146 0.013 -15.630 13.254 1077 HB3 ASP 146 1HB ASP 146 1.551 -16.208 12.656 1078 H HIS 147 H HIS 147 -1.023 -13.072 11.972 1079 HA HIS 147 HA HIS 147 -1.103 -11.003 14.211 1080 HD1 HIS 147 HD1 HIS 147 1.447 -10.410 13.382 1081 HD2 HIS 147 HD2 HIS 147 -1.001 -7.117 12.245 1082 HE1 HIS 147 HE1 HIS 147 2.715 -8.175 13.769 1083 HB2 HIS 147 2HB HIS 147 -1.020 -10.389 11.204 1084 HB3 HIS 147 1HB HIS 147 -2.136 -9.465 12.156 1085 H GLU 148 H GLU 148 -3.334 -9.908 14.286 1086 HA GLU 148 HA GLU 148 -5.178 -12.102 14.924 1087 HB2 GLU 148 2HB GLU 148 -5.802 -9.106 14.916 1088 HB3 GLU 148 1HB GLU 148 -6.749 -10.341 15.691 1089 HG2 GLU 148 2HG GLU 148 -4.942 -10.768 17.389 1090 HG3 GLU 148 1HG GLU 148 -3.859 -9.659 16.566 1091 H GLY 149 H GLY 149 -5.944 -13.134 13.093 1092 HA2 GLY 149 2HA GLY 149 -8.034 -13.296 11.475 1093 HA3 GLY 149 1HA GLY 149 -7.812 -11.617 11.139 1094 H PHE 150 H PHE 150 -4.704 -12.295 10.989 1095 HA PHE 150 HA PHE 150 -4.599 -13.522 8.213 1096 HD1 PHE 150 HD1 PHE 150 -1.852 -10.291 7.960 1097 HD2 PHE 150 HD2 PHE 150 -5.694 -9.559 9.692 1098 HE1 PHE 150 HE1 PHE 150 -0.984 -8.234 8.993 1099 HE2 PHE 150 HE2 PHE 150 -4.846 -7.523 10.713 1100 HZ PHE 150 HZ PHE 150 -2.486 -6.827 10.382 1101 HB2 PHE 150 2HB PHE 150 -3.893 -11.464 7.123 1102 HB3 PHE 150 1HB PHE 150 -5.429 -11.210 7.866 1103 H THR 151 H THR 151 -2.316 -13.080 7.218 1104 HA THR 151 HA THR 151 -0.149 -13.264 9.391 1105 HB THR 151 HB THR 151 1.037 -14.894 8.502 1106 HG1 THR 151 HG1 THR 151 1.621 -13.891 6.636 1107 HG21 THR 151 3HG2 THR 151 -0.128 -16.746 7.364 1108 HG22 THR 151 1HG2 THR 151 -1.446 -15.661 6.866 1109 HG23 THR 151 2HG2 THR 151 -1.230 -16.052 8.586 1110 H LEU 152 H LEU 152 1.148 -11.599 9.467 1111 HA LEU 152 HA LEU 152 1.323 -9.488 7.334 1112 HG LEU 152 HG LEU 152 3.231 -7.478 10.079 1113 HB2 LEU 152 2HB LEU 152 1.310 -8.633 9.497 1114 HB3 LEU 152 1HB LEU 152 2.442 -9.763 10.126 1115 HD11 LEU 152 1HD1 LEU 152 5.516 -7.881 9.541 1116 HD12 LEU 152 2HD1 LEU 152 5.149 -8.910 8.157 1117 HD13 LEU 152 3HD1 LEU 152 4.904 -9.533 9.779 1118 HD21 LEU 152 3HD2 LEU 152 3.580 -7.459 7.013 1119 HD22 LEU 152 1HD2 LEU 152 3.816 -6.160 8.165 1120 HD23 LEU 152 2HD2 LEU 152 2.179 -6.751 7.810 1121 H GLN 153 H GLN 153 2.934 -9.137 6.088 1122 HA GLN 153 HA GLN 153 5.207 -11.120 5.594 1123 HB2 GLN 153 2HB GLN 153 2.556 -10.901 4.219 1124 HB3 GLN 153 1HB GLN 153 3.777 -10.410 3.093 1125 HG2 GLN 153 2HG GLN 153 4.164 -13.025 4.693 1126 HG3 GLN 153 1HG GLN 153 2.967 -12.971 3.405 1127 HE21 GLN 153 1HE2 GLN 153 4.861 -14.689 2.751 1128 HE22 GLN 153 2HE2 GLN 153 5.766 -13.878 1.420 1129 H GLU 154 H GLU 154 7.006 -9.767 5.542 1130 HA GLU 154 HA GLU 154 6.762 -7.042 4.124 1131 HB2 GLU 154 2HB GLU 154 8.968 -7.678 6.109 1132 HB3 GLU 154 1HB GLU 154 8.585 -6.173 5.352 1133 HG2 GLU 154 2HG GLU 154 6.252 -6.309 6.639 1134 HG3 GLU 154 1HG GLU 154 6.976 -7.649 7.493 1135 H TRP 155 H TRP 155 7.409 -7.291 2.043 1136 HA TRP 155 HA TRP 155 9.722 -9.180 1.316 1137 HD1 TRP 155 HD1 TRP 155 5.541 -9.087 0.468 1138 HE1 TRP 155 HE1 TRP 155 4.679 -11.460 -0.297 1139 HE3 TRP 155 HE3 TRP 155 9.908 -10.614 -1.671 1140 HZ2 TRP 155 HZ2 TRP 155 5.890 -13.619 -1.670 1141 HZ3 TRP 155 HZ3 TRP 155 10.021 -12.886 -2.669 1142 HH2 TRP 155 HH2 TRP 155 8.046 -14.360 -2.679 1143 HB2 TRP 155 2HB TRP 155 7.695 -7.563 -0.306 1144 HB3 TRP 155 1HB TRP 155 9.032 -8.384 -1.088 1145 H VAL 156 H VAL 156 11.831 -8.356 0.835 1146 HA VAL 156 HA VAL 156 12.120 -5.324 0.387 1147 HB VAL 156 HB VAL 156 13.181 -5.872 2.469 1148 HG11 VAL 156 1HG1 VAL 156 15.202 -7.665 0.983 1149 HG12 VAL 156 2HG1 VAL 156 13.922 -8.240 2.084 1150 HG13 VAL 156 3HG1 VAL 156 15.225 -7.240 2.716 1151 HG21 VAL 156 3HG2 VAL 156 14.186 -3.983 1.045 1152 HG22 VAL 156 1HG2 VAL 156 15.351 -5.145 0.403 1153 HG23 VAL 156 2HG2 VAL 156 15.372 -4.753 2.123 1154 H ARG 157 H ARG 157 13.062 -4.542 -1.398 1155 HA ARG 157 HA ARG 157 13.497 -6.143 -3.815 1156 HE ARG 157 HE ARG 157 14.071 -3.275 -7.540 1157 HB2 ARG 157 2HB ARG 157 14.032 -3.265 -2.963 1158 HB3 ARG 157 1HB ARG 157 15.036 -3.883 -4.241 1159 HG2 ARG 157 2HG ARG 157 12.810 -4.650 -5.474 1160 HG3 ARG 157 1HG ARG 157 11.983 -3.657 -4.281 1161 HD2 ARG 157 2HD ARG 157 12.268 -2.259 -6.214 1162 HD3 ARG 157 1HD ARG 157 13.381 -1.632 -5.035 1163 HH11 ARG 157 2HH1 ARG 157 15.292 -1.409 -4.899 1164 HH12 ARG 157 1HH1 ARG 157 17.028 -1.587 -5.429 1165 HH21 ARG 157 1HH2 ARG 157 15.992 -3.543 -8.096 1166 HH22 ARG 157 2HH2 ARG 157 17.402 -2.798 -7.197 1167 H SER 158 H SER 158 15.208 -6.829 -4.881 1168 HA SER 158 HA SER 158 16.985 -8.444 -3.780 1169 HG SER 158 HG SER 158 17.430 -9.753 -6.111 1170 HB2 SER 158 2HB SER 158 16.345 -7.998 -6.295 1171 HB3 SER 158 1HB SER 158 17.810 -7.027 -6.383 1172 H ALA 159 H ALA 159 18.396 -8.098 -2.122 1173 HA ALA 159 HA ALA 159 20.360 -5.895 -2.085 1174 HB1 ALA 159 3HB ALA 159 19.826 -8.261 -0.164 1175 HB2 ALA 159 1HB ALA 159 19.051 -6.660 -0.123 1176 HB3 ALA 159 2HB ALA 159 20.794 -6.810 0.218 1177 H SER 160 H SER 160 22.457 -5.879 -2.657 1178 HA SER 160 HA SER 160 23.764 -8.281 -3.811 1179 HG SER 160 HG SER 160 26.550 -6.678 -3.795 1180 HB2 SER 160 2HB SER 160 24.002 -6.114 -4.892 1181 HB3 SER 160 1HB SER 160 24.798 -5.420 -3.467 1182 H SER 161 H SER 161 24.840 -9.716 -2.801 1183 HA SER 161 HA SER 161 26.548 -9.102 -0.301 1184 HG SER 161 HG SER 161 26.438 -10.415 1.289 1185 HB2 SER 161 2HB SER 161 24.314 -10.811 -0.476 1186 HB3 SER 161 1HB SER 161 25.618 -11.954 -0.688 1187 H ARG 162 H ARG 162 26.587 -11.302 -3.113 1188 HA ARG 162 HA ARG 162 29.596 -11.138 -3.181 1189 HE ARG 162 HE ARG 162 32.614 -15.280 -2.971 1190 HB2 ARG 162 1HB ARG 162 28.889 -13.078 -1.586 1191 HB3 ARG 162 2HB ARG 162 28.192 -13.898 -2.968 1192 HG2 ARG 162 1HG ARG 162 30.444 -14.101 -4.034 1193 HG3 ARG 162 2HG ARG 162 31.177 -13.065 -2.788 1194 HD2 ARG 162 1HD ARG 162 30.508 -14.767 -1.000 1195 HD3 ARG 162 2HD ARG 162 29.806 -15.803 -2.246 1196 HH11 ARG 162 2HH1 ARG 162 30.839 -17.099 -0.536 1197 HH12 ARG 162 1HH1 ARG 162 32.242 -18.262 -0.386 1198 HH21 ARG 162 1HH2 ARG 162 34.179 -16.713 -2.707 1199 HH22 ARG 162 2HH2 ARG 162 33.911 -18.038 -1.494 Start of MODEL 2 1 HA MET 1 HA MET 1 16.074 5.795 2.262 2 H1 MET 1 1H MET 1 15.381 7.002 4.387 3 H2 MET 1 2H MET 1 14.868 7.863 3.063 4 H3 MET 1 3H MET 1 13.807 7.002 3.883 5 HB2 MET 1 1HB MET 1 13.823 4.476 3.908 6 HB3 MET 1 2HB MET 1 14.628 3.641 2.633 7 HG2 MET 1 1HG MET 1 16.591 3.297 3.767 8 HG3 MET 1 2HG MET 1 16.589 4.840 4.631 9 HE1 MET 1 3HE MET 1 14.296 5.387 6.146 10 HE2 MET 1 1HE MET 1 15.767 5.120 7.126 11 HE3 MET 1 2HE MET 1 14.210 4.368 7.599 12 H GLU 2 H GLU 2 13.324 4.285 1.281 13 HA GLU 2 HA GLU 2 11.892 6.681 0.276 14 HB2 GLU 2 2HB GLU 2 11.787 6.206 -2.085 15 HB3 GLU 2 1HB GLU 2 13.421 6.457 -1.558 16 HG2 GLU 2 2HG GLU 2 13.446 3.705 -1.473 17 HG3 GLU 2 1HG GLU 2 12.172 3.895 -2.672 18 H LEU 3 H LEU 3 10.239 4.631 -1.437 19 HA LEU 3 HA LEU 3 8.374 4.500 0.937 20 HG LEU 3 HG LEU 3 8.635 6.428 -2.109 21 HB2 LEU 3 2HB LEU 3 6.495 4.520 -0.975 22 HB3 LEU 3 1HB LEU 3 7.202 5.899 -0.219 23 HD11 LEU 3 1HD1 LEU 3 8.545 5.110 -4.232 24 HD12 LEU 3 2HD1 LEU 3 7.440 3.908 -3.491 25 HD13 LEU 3 3HD1 LEU 3 9.124 4.073 -2.961 26 HD21 LEU 3 3HD2 LEU 3 6.423 7.418 -2.159 27 HD22 LEU 3 1HD2 LEU 3 5.657 5.906 -2.700 28 HD23 LEU 3 2HD2 LEU 3 6.697 6.825 -3.808 29 H VAL 4 H VAL 4 7.007 2.987 1.488 30 HA VAL 4 HA VAL 4 7.522 0.180 0.409 31 HB VAL 4 HB VAL 4 7.095 1.207 3.230 32 HG11 VAL 4 1HG1 VAL 4 7.580 -1.692 2.330 33 HG12 VAL 4 2HG1 VAL 4 6.204 -1.079 3.218 34 HG13 VAL 4 3HG1 VAL 4 7.806 -1.169 4.008 35 HG21 VAL 4 3HG2 VAL 4 9.351 1.840 2.524 36 HG22 VAL 4 1HG2 VAL 4 9.763 0.170 2.141 37 HG23 VAL 4 2HG2 VAL 4 9.394 0.650 3.816 38 H SER 5 H SER 5 5.823 -1.154 -0.074 39 HA SER 5 HA SER 5 3.050 0.058 0.068 40 HG SER 5 HG SER 5 4.468 -2.580 -2.664 41 HB2 SER 5 2HB SER 5 2.641 -1.452 -1.833 42 HB3 SER 5 1HB SER 5 4.028 -0.448 -2.074 43 H VAL 6 H VAL 6 1.238 -0.747 0.944 44 HA VAL 6 HA VAL 6 1.378 -3.252 2.618 45 HB VAL 6 HB VAL 6 1.294 -2.471 4.653 46 HG11 VAL 6 1HG1 VAL 6 2.789 -0.578 5.155 47 HG12 VAL 6 2HG1 VAL 6 2.525 0.121 3.545 48 HG13 VAL 6 3HG1 VAL 6 3.405 -1.391 3.705 49 HG21 VAL 6 3HG2 VAL 6 -0.818 -1.110 4.704 50 HG22 VAL 6 1HG2 VAL 6 0.120 0.278 4.086 51 HG23 VAL 6 2HG2 VAL 6 0.474 -0.403 5.669 52 H ALA 7 H ALA 7 0.002 -4.041 0.967 53 HA ALA 7 HA ALA 7 -2.987 -3.491 1.483 54 HB1 ALA 7 3HB ALA 7 -1.641 -5.160 -0.746 55 HB2 ALA 7 1HB ALA 7 -2.203 -3.492 -0.920 56 HB3 ALA 7 2HB ALA 7 -3.373 -4.771 -0.611 57 H ALA 8 H ALA 8 -4.212 -4.926 2.703 58 HA ALA 8 HA ALA 8 -3.230 -7.710 3.283 59 HB1 ALA 8 3HB ALA 8 -3.904 -6.305 5.160 60 HB2 ALA 8 1HB ALA 8 -5.083 -7.614 5.024 61 HB3 ALA 8 2HB ALA 8 -5.500 -5.999 4.478 62 H LEU 9 H LEU 9 -3.831 -9.441 2.119 63 HA LEU 9 HA LEU 9 -6.543 -9.566 0.740 64 HG LEU 9 HG LEU 9 -3.397 -9.516 -2.170 65 HB2 LEU 9 2HB LEU 9 -5.459 -10.032 -1.406 66 HB3 LEU 9 1HB LEU 9 -5.210 -8.447 -0.801 67 HD11 LEU 9 1HD1 LEU 9 -1.530 -8.417 -0.907 68 HD12 LEU 9 2HD1 LEU 9 -2.527 -8.374 0.544 69 HD13 LEU 9 3HD1 LEU 9 -2.977 -7.434 -0.900 70 HD21 LEU 9 3HD2 LEU 9 -1.705 -10.993 -1.164 71 HD22 LEU 9 1HD2 LEU 9 -3.287 -11.783 -1.154 72 HD23 LEU 9 2HD2 LEU 9 -2.607 -11.075 0.357 73 H ALA 10 H ALA 10 -7.213 -11.413 -0.349 74 HA ALA 10 HA ALA 10 -6.459 -13.977 1.160 75 HB1 ALA 10 3HB ALA 10 -8.601 -12.647 1.700 76 HB2 ALA 10 1HB ALA 10 -8.900 -14.329 1.245 77 HB3 ALA 10 2HB ALA 10 -9.221 -13.032 0.075 78 H GLU 11 H GLU 11 -8.574 -15.387 -0.592 79 HA GLU 11 HA GLU 11 -6.680 -16.642 -2.480 80 HB2 GLU 11 2HB GLU 11 -8.422 -17.934 -1.297 81 HB3 GLU 11 1HB GLU 11 -9.698 -17.029 -2.110 82 HG2 GLU 11 2HG GLU 11 -9.400 -19.338 -3.034 83 HG3 GLU 11 1HG GLU 11 -9.247 -18.088 -4.256 84 H ASN 12 H ASN 12 -7.089 -16.885 -4.787 85 HA ASN 12 HA ASN 12 -6.387 -15.695 -6.670 86 HB2 ASN 12 2HB ASN 12 -9.289 -15.161 -6.280 87 HB3 ASN 12 1HB ASN 12 -8.591 -13.787 -7.034 88 HD21 ASN 12 1HD2 ASN 12 -10.292 -16.195 -7.956 89 HD22 ASN 12 2HD2 ASN 12 -9.477 -16.543 -9.566 90 H ARG 13 H ARG 13 -5.564 -14.398 -4.132 91 HA ARG 13 HA ARG 13 -4.613 -12.482 -3.254 92 HE ARG 13 HE ARG 13 -1.405 -11.495 -9.031 93 HB2 ARG 13 2HB ARG 13 -2.855 -11.343 -4.468 94 HB3 ARG 13 1HB ARG 13 -2.754 -13.082 -4.547 95 HG2 ARG 13 2HG ARG 13 -3.615 -13.079 -6.898 96 HG3 ARG 13 1HG ARG 13 -3.782 -11.325 -6.894 97 HD2 ARG 13 2HD ARG 13 -1.416 -10.961 -6.729 98 HD3 ARG 13 1HD ARG 13 -1.006 -12.589 -6.287 99 HH11 ARG 13 2HH1 ARG 13 -1.731 -14.437 -7.271 100 HH12 ARG 13 1HH1 ARG 13 -1.392 -15.468 -8.744 101 HH21 ARG 13 1HH2 ARG 13 -0.857 -12.666 -10.669 102 HH22 ARG 13 2HH2 ARG 13 -0.927 -14.467 -10.578 103 H VAL 14 H VAL 14 -6.976 -12.080 -3.281 104 HA VAL 14 HA VAL 14 -7.891 -9.591 -4.693 105 HB VAL 14 HB VAL 14 -9.182 -11.685 -2.856 106 HG11 VAL 14 1HG1 VAL 14 -11.383 -10.634 -3.010 107 HG12 VAL 14 2HG1 VAL 14 -10.691 -9.138 -3.721 108 HG13 VAL 14 3HG1 VAL 14 -10.308 -9.626 -2.051 109 HG21 VAL 14 3HG2 VAL 14 -8.908 -12.178 -5.288 110 HG22 VAL 14 1HG2 VAL 14 -9.717 -10.670 -5.752 111 HG23 VAL 14 2HG2 VAL 14 -10.632 -11.963 -4.923 112 H ILE 15 H ILE 15 -7.148 -7.704 -4.053 113 HA ILE 15 HA ILE 15 -6.555 -6.802 -1.268 114 HB ILE 15 HB ILE 15 -7.369 -5.048 -3.633 115 HG12 ILE 15 2HG1 ILE 15 -4.411 -5.218 -2.874 116 HG13 ILE 15 1HG1 ILE 15 -5.066 -6.568 -3.755 117 HG21 ILE 15 1HG2 ILE 15 -6.267 -3.150 -2.452 118 HG22 ILE 15 2HG2 ILE 15 -5.717 -4.210 -1.135 119 HG23 ILE 15 3HG2 ILE 15 -7.441 -3.864 -1.369 120 HD11 ILE 15 3HD1 ILE 15 -5.796 -5.168 -5.656 121 HD12 ILE 15 1HD1 ILE 15 -4.097 -4.821 -5.316 122 HD13 ILE 15 2HD1 ILE 15 -5.359 -3.682 -4.793 123 H GLY 16 H GLY 16 -9.309 -5.581 -3.207 124 HA2 GLY 16 2HA GLY 16 -11.234 -6.906 -1.414 125 HA3 GLY 16 1HA GLY 16 -11.123 -5.193 -0.991 126 H ARG 17 H ARG 17 -12.961 -4.414 -1.668 127 HA ARG 17 HA ARG 17 -14.352 -5.256 -4.202 128 HE ARG 17 HE ARG 17 -16.794 -9.025 -5.037 129 HB2 ARG 17 2HB ARG 17 -14.695 -6.831 -1.786 130 HB3 ARG 17 1HB ARG 17 -16.146 -5.864 -1.859 131 HG2 ARG 17 2HG ARG 17 -16.609 -6.707 -4.189 132 HG3 ARG 17 1HG ARG 17 -15.026 -7.500 -4.226 133 HD2 ARG 17 2HD ARG 17 -15.782 -8.932 -2.205 134 HD3 ARG 17 1HD ARG 17 -17.413 -8.220 -2.390 135 HH11 ARG 17 2HH1 ARG 17 -16.720 -10.836 -2.091 136 HH12 ARG 17 1HH1 ARG 17 -16.779 -12.427 -2.978 137 HH21 ARG 17 1HH2 ARG 17 -16.715 -10.778 -5.999 138 HH22 ARG 17 2HH2 ARG 17 -16.784 -12.381 -5.142 139 H ASP 18 H ASP 18 -15.551 -3.720 -1.128 140 HA ASP 18 HA ASP 18 -16.480 -1.383 -2.627 141 HB2 ASP 18 2HB ASP 18 -16.170 -1.867 0.401 142 HB3 ASP 18 1HB ASP 18 -16.943 -0.470 -0.334 143 H GLY 19 H GLY 19 -13.463 -1.757 -0.728 144 HA2 GLY 19 2HA GLY 19 -12.261 0.660 -2.131 145 HA3 GLY 19 1HA GLY 19 -12.575 0.904 -0.434 146 H GLU 20 H GLU 20 -11.059 0.027 1.063 147 HA GLU 20 HA GLU 20 -8.631 -1.400 -0.032 148 HB2 GLU 20 2HB GLU 20 -7.647 -1.421 2.160 149 HB3 GLU 20 1HB GLU 20 -7.935 0.162 1.536 150 HG2 GLU 20 2HG GLU 20 -9.677 -1.139 3.747 151 HG3 GLU 20 1HG GLU 20 -8.326 -0.078 4.053 152 H LEU 21 H LEU 21 -11.118 -2.439 2.327 153 HA LEU 21 HA LEU 21 -10.256 -5.286 1.518 154 HG LEU 21 HG LEU 21 -9.016 -3.382 3.709 155 HB2 LEU 21 2HB LEU 21 -11.433 -4.705 4.192 156 HB3 LEU 21 1HB LEU 21 -10.455 -6.057 3.732 157 HD11 LEU 21 1HD1 LEU 21 -10.672 -3.185 5.671 158 HD12 LEU 21 2HD1 LEU 21 -8.954 -3.023 6.078 159 HD13 LEU 21 3HD1 LEU 21 -9.826 -4.553 6.428 160 HD21 LEU 21 3HD2 LEU 21 -7.808 -5.610 3.428 161 HD22 LEU 21 1HD2 LEU 21 -8.178 -5.964 5.132 162 HD23 LEU 21 2HD2 LEU 21 -7.210 -4.537 4.727 163 HA PRO 22 HA PRO 22 -14.770 -6.363 0.984 164 HB2 PRO 22 2HB PRO 22 -14.087 -9.143 1.966 165 HB3 PRO 22 1HB PRO 22 -14.744 -8.606 0.400 166 HG2 PRO 22 2HG PRO 22 -12.131 -9.536 0.666 167 HG3 PRO 22 1HG PRO 22 -12.575 -8.285 -0.510 168 HD2 PRO 22 2HD PRO 22 -11.350 -7.848 2.278 169 HD3 PRO 22 1HD PRO 22 -10.864 -7.169 0.719 170 H TRP 23 H TRP 23 -13.075 -6.690 3.909 171 HA TRP 23 HA TRP 23 -15.618 -6.756 5.595 172 HD1 TRP 23 HD1 TRP 23 -11.526 -6.301 7.235 173 HE1 TRP 23 HE1 TRP 23 -9.362 -6.920 5.929 174 HE3 TRP 23 HE3 TRP 23 -13.471 -10.154 4.595 175 HZ2 TRP 23 HZ2 TRP 23 -8.675 -8.856 4.070 176 HZ3 TRP 23 HZ3 TRP 23 -12.058 -11.122 2.809 177 HH2 TRP 23 HH2 TRP 23 -9.699 -10.503 2.564 178 HB2 TRP 23 2HB TRP 23 -14.123 -7.590 7.544 179 HB3 TRP 23 1HB TRP 23 -14.467 -8.745 6.282 180 HA PRO 24 HA PRO 24 -14.848 -2.560 6.386 181 HB2 PRO 24 2HB PRO 24 -15.240 -2.746 9.384 182 HB3 PRO 24 1HB PRO 24 -16.124 -1.790 8.179 183 HG2 PRO 24 2HG PRO 24 -17.244 -4.071 9.252 184 HG3 PRO 24 1HG PRO 24 -17.474 -3.683 7.531 185 HD2 PRO 24 2HD PRO 24 -15.494 -5.689 8.725 186 HD3 PRO 24 1HD PRO 24 -16.566 -5.836 7.298 187 H SER 25 H SER 25 -13.014 -4.023 9.023 188 HA SER 25 HA SER 25 -10.439 -3.355 8.361 189 HG SER 25 HG SER 25 -11.166 -1.086 7.461 190 HB2 SER 25 2HB SER 25 -11.435 -0.888 9.889 191 HB3 SER 25 1HB SER 25 -9.738 -1.401 9.891 192 H ILE 26 H ILE 26 -9.987 -5.204 9.468 193 HA ILE 26 HA ILE 26 -10.846 -5.771 12.218 194 HB ILE 26 HB ILE 26 -9.067 -7.574 12.275 195 HG12 ILE 26 2HG1 ILE 26 -8.123 -6.317 9.795 196 HG13 ILE 26 1HG1 ILE 26 -7.322 -7.363 10.907 197 HG21 ILE 26 1HG2 ILE 26 -11.413 -8.065 11.844 198 HG22 ILE 26 2HG2 ILE 26 -10.367 -9.144 10.915 199 HG23 ILE 26 3HG2 ILE 26 -11.201 -7.816 10.089 200 HD11 ILE 26 3HD1 ILE 26 -7.356 -8.232 8.564 201 HD12 ILE 26 1HD1 ILE 26 -9.120 -8.298 8.569 202 HD13 ILE 26 2HD1 ILE 26 -8.195 -9.375 9.652 203 HA PRO 27 HA PRO 27 -8.002 -3.100 14.503 204 HB2 PRO 27 2HB PRO 27 -8.199 -5.227 16.699 205 HB3 PRO 27 1HB PRO 27 -8.287 -3.451 16.835 206 HG2 PRO 27 2HG PRO 27 -10.621 -4.838 16.789 207 HG3 PRO 27 1HG PRO 27 -10.486 -3.402 15.742 208 HD2 PRO 27 2HD PRO 27 -10.124 -6.340 14.894 209 HD3 PRO 27 1HD PRO 27 -11.103 -5.031 14.148 210 H ALA 28 H ALA 28 -6.748 -6.473 14.594 211 HA ALA 28 HA ALA 28 -3.969 -5.795 14.815 212 HB1 ALA 28 3HB ALA 28 -4.583 -8.058 14.898 213 HB2 ALA 28 1HB ALA 28 -3.558 -7.941 13.456 214 HB3 ALA 28 2HB ALA 28 -5.319 -8.063 13.268 215 H ASP 29 H ASP 29 -5.909 -5.465 11.850 216 HA ASP 29 HA ASP 29 -3.615 -4.925 9.997 217 HB2 ASP 29 2HB ASP 29 -5.696 -5.972 9.171 218 HB3 ASP 29 1HB ASP 29 -6.680 -4.630 9.740 219 H LYS 30 H LYS 30 -6.298 -2.738 10.831 220 HA LYS 30 HA LYS 30 -4.988 -0.372 10.872 221 HB2 LYS 30 2HB LYS 30 -6.868 0.554 11.543 222 HB3 LYS 30 1HB LYS 30 -7.523 -1.066 11.523 223 HG2 LYS 30 2HG LYS 30 -6.928 -1.221 14.044 224 HG3 LYS 30 1HG LYS 30 -6.588 0.495 14.011 225 HD2 LYS 30 2HD LYS 30 -9.278 -0.863 13.271 226 HD3 LYS 30 1HD LYS 30 -8.917 -0.116 14.818 227 HE2 LYS 30 2HE LYS 30 -8.537 2.154 13.572 228 HE3 LYS 30 1HE LYS 30 -9.025 1.362 12.079 229 HZ1 LYS 30 3HZ LYS 30 -10.841 1.550 14.508 230 HZ2 LYS 30 1HZ LYS 30 -11.263 0.965 13.027 231 HZ3 LYS 30 2HZ LYS 30 -10.935 2.551 13.187 232 H LYS 31 H LYS 31 -4.048 -2.556 13.183 233 HA LYS 31 HA LYS 31 -2.513 -0.584 14.927 234 HB2 LYS 31 2HB LYS 31 -3.716 -2.539 16.037 235 HB3 LYS 31 1HB LYS 31 -2.783 -3.636 15.079 236 HG2 LYS 31 2HG LYS 31 -1.757 -3.731 17.153 237 HG3 LYS 31 1HG LYS 31 -0.627 -2.804 16.237 238 HD2 LYS 31 2HD LYS 31 -2.799 -1.521 18.040 239 HD3 LYS 31 1HD LYS 31 -1.315 -2.082 18.735 240 HE2 LYS 31 2HE LYS 31 -1.568 0.212 16.660 241 HE3 LYS 31 1HE LYS 31 -1.292 0.402 18.374 242 HZ1 LYS 31 3HZ LYS 31 0.864 0.463 17.070 243 HZ2 LYS 31 1HZ LYS 31 0.581 -1.025 16.478 244 HZ3 LYS 31 2HZ LYS 31 0.912 -0.845 18.069 245 H GLN 32 H GLN 32 -1.851 -3.107 12.467 246 HA GLN 32 HA GLN 32 1.112 -2.583 12.544 247 HB2 GLN 32 2HB GLN 32 0.287 -4.846 12.151 248 HB3 GLN 32 1HB GLN 32 -0.571 -4.380 10.702 249 HG2 GLN 32 2HG GLN 32 2.501 -4.142 11.097 250 HG3 GLN 32 1HG GLN 32 1.753 -5.581 10.466 251 HE21 GLN 32 1HE2 GLN 32 0.165 -4.935 8.449 252 HE22 GLN 32 2HE2 GLN 32 1.119 -3.933 7.241 253 H TYR 33 H TYR 33 -1.618 -1.909 10.204 254 HA TYR 33 HA TYR 33 -0.364 0.155 8.651 255 HD1 TYR 33 HD1 TYR 33 -3.970 1.346 10.415 256 HD2 TYR 33 HD2 TYR 33 -3.052 1.452 6.268 257 HE1 TYR 33 HE1 TYR 33 -5.667 3.088 10.119 258 HE2 TYR 33 HE2 TYR 33 -4.666 3.339 5.965 259 HH TYR 33 HH TYR 33 -6.470 4.521 7.046 260 HB2 TYR 33 2HB TYR 33 -2.357 -0.544 7.741 261 HB3 TYR 33 1HB TYR 33 -3.183 -0.667 9.209 262 H ARG 34 H ARG 34 -1.882 0.890 11.956 263 HA ARG 34 HA ARG 34 -0.819 3.717 11.501 264 HE ARG 34 HE ARG 34 -5.499 4.801 10.979 265 HB2 ARG 34 2HB ARG 34 -2.528 2.673 13.808 266 HB3 ARG 34 1HB ARG 34 -1.861 4.301 13.699 267 HG2 ARG 34 2HG ARG 34 -3.048 4.364 11.277 268 HG3 ARG 34 1HG ARG 34 -3.959 3.004 11.911 269 HD2 ARG 34 2HD ARG 34 -4.846 4.389 13.794 270 HD3 ARG 34 1HD ARG 34 -3.843 5.767 13.273 271 HH11 ARG 34 2HH1 ARG 34 -5.582 6.906 13.680 272 HH12 ARG 34 1HH1 ARG 34 -6.982 7.849 12.972 273 HH21 ARG 34 1HH2 ARG 34 -7.130 5.837 10.225 274 HH22 ARG 34 2HH2 ARG 34 -7.929 7.135 11.145 275 H SER 35 H SER 35 0.549 1.051 13.038 276 HA SER 35 HA SER 35 2.630 2.789 14.452 277 HG SER 35 HG SER 35 4.350 1.669 15.128 278 HB2 SER 35 2HB SER 35 1.815 0.506 15.397 279 HB3 SER 35 1HB SER 35 2.861 -0.247 14.181 280 H ARG 36 H ARG 36 2.055 1.219 11.470 281 HA ARG 36 HA ARG 36 4.844 1.644 10.344 282 HE ARG 36 HE ARG 36 4.271 -2.291 8.988 283 HB2 ARG 36 2HB ARG 36 3.224 -0.418 9.969 284 HB3 ARG 36 1HB ARG 36 2.214 0.652 9.040 285 HG2 ARG 36 2HG ARG 36 3.408 -0.562 7.435 286 HG3 ARG 36 1HG ARG 36 4.140 1.012 7.423 287 HD2 ARG 36 2HD ARG 36 5.896 -0.710 7.285 288 HD3 ARG 36 1HD ARG 36 6.094 0.102 8.827 289 HH11 ARG 36 2HH1 ARG 36 7.625 -1.659 8.525 290 HH12 ARG 36 1HH1 ARG 36 7.938 -3.426 8.790 291 HH21 ARG 36 1HH2 ARG 36 4.835 -4.174 9.550 292 HH22 ARG 36 2HH2 ARG 36 6.614 -4.636 9.617 293 H VAL 37 H VAL 37 1.476 2.662 9.282 294 HA VAL 37 HA VAL 37 2.734 4.900 7.709 295 HB VAL 37 HB VAL 37 1.111 4.884 6.216 296 HG11 VAL 37 1HG1 VAL 37 2.149 2.543 6.177 297 HG12 VAL 37 2HG1 VAL 37 0.619 2.698 5.287 298 HG13 VAL 37 3HG1 VAL 37 0.654 1.932 6.902 299 HG21 VAL 37 3HG2 VAL 37 -1.026 3.651 8.034 300 HG22 VAL 37 1HG2 VAL 37 -1.252 3.934 6.300 301 HG23 VAL 37 2HG2 VAL 37 -0.983 5.294 7.399 302 H ALA 38 H ALA 38 1.086 4.990 10.739 303 HA ALA 38 HA ALA 38 -0.542 7.403 10.033 304 HB1 ALA 38 3HB ALA 38 -1.311 7.561 12.271 305 HB2 ALA 38 1HB ALA 38 -0.138 6.351 12.840 306 HB3 ALA 38 2HB ALA 38 -1.437 5.893 11.703 307 H ASP 39 H ASP 39 2.678 7.058 11.292 308 HA ASP 39 HA ASP 39 3.121 10.023 11.562 309 HB2 ASP 39 2HB ASP 39 4.742 7.496 12.067 310 HB3 ASP 39 1HB ASP 39 5.635 8.841 11.431 311 H ASP 40 H ASP 40 4.142 7.537 9.102 312 HA ASP 40 HA ASP 40 5.095 9.572 7.313 313 HB2 ASP 40 2HB ASP 40 4.942 6.550 7.423 314 HB3 ASP 40 1HB ASP 40 5.113 7.204 5.821 315 HA PRO 41 HA PRO 41 1.760 10.351 4.178 316 HB2 PRO 41 2HB PRO 41 4.126 10.149 2.210 317 HB3 PRO 41 1HB PRO 41 2.843 11.357 2.240 318 HG2 PRO 41 2HG PRO 41 5.248 12.023 3.285 319 HG3 PRO 41 1HG PRO 41 3.843 12.385 4.305 320 HD2 PRO 41 2HD PRO 41 5.679 9.933 4.533 321 HD3 PRO 41 1HD PRO 41 5.109 11.052 5.797 322 H VAL 42 H VAL 42 0.441 9.193 2.748 323 HA VAL 42 HA VAL 42 1.491 6.488 1.731 324 HB VAL 42 HB VAL 42 -1.324 7.237 2.685 325 HG11 VAL 42 1HG1 VAL 42 -1.394 5.405 0.940 326 HG12 VAL 42 2HG1 VAL 42 -1.801 4.799 2.553 327 HG13 VAL 42 3HG1 VAL 42 -0.183 4.470 1.859 328 HG21 VAL 42 3HG2 VAL 42 0.134 7.011 4.669 329 HG22 VAL 42 1HG2 VAL 42 0.969 5.602 3.992 330 HG23 VAL 42 2HG2 VAL 42 -0.714 5.459 4.529 331 H VAL 43 H VAL 43 1.486 5.964 -0.310 332 HA VAL 43 HA VAL 43 0.056 7.703 -2.379 333 HB VAL 43 HB VAL 43 1.652 7.080 -4.026 334 HG11 VAL 43 1HG1 VAL 43 3.371 7.547 -1.492 335 HG12 VAL 43 2HG1 VAL 43 2.573 8.826 -2.388 336 HG13 VAL 43 3HG1 VAL 43 3.837 7.845 -3.168 337 HG21 VAL 43 3HG2 VAL 43 2.895 5.095 -2.041 338 HG22 VAL 43 1HG2 VAL 43 3.639 5.546 -3.574 339 HG23 VAL 43 2HG2 VAL 43 2.105 4.695 -3.598 340 H LEU 44 H LEU 44 -1.925 7.018 -2.892 341 HA LEU 44 HA LEU 44 -2.441 4.031 -3.406 342 HG LEU 44 HG LEU 44 -4.438 6.879 -2.120 343 HB2 LEU 44 2HB LEU 44 -4.216 4.011 -1.855 344 HB3 LEU 44 1HB LEU 44 -2.797 4.548 -1.058 345 HD11 LEU 44 1HD1 LEU 44 -5.720 4.946 -0.065 346 HD12 LEU 44 2HD1 LEU 44 -6.329 5.352 -1.665 347 HD13 LEU 44 3HD1 LEU 44 -6.306 6.594 -0.399 348 HD21 LEU 44 3HD2 LEU 44 -4.153 7.804 0.098 349 HD22 LEU 44 1HD2 LEU 44 -2.595 7.155 -0.421 350 HD23 LEU 44 2HD2 LEU 44 -3.551 6.247 0.757 351 H GLY 45 H GLY 45 -5.129 3.883 -3.677 352 HA2 GLY 45 2HA GLY 45 -5.289 4.796 -6.622 353 HA3 GLY 45 1HA GLY 45 -6.036 3.339 -5.964 354 H ARG 46 H ARG 46 -7.704 4.487 -7.368 355 HA ARG 46 HA ARG 46 -9.552 6.175 -5.588 356 HE ARG 46 HE ARG 46 -12.029 8.495 -7.301 357 HB2 ARG 46 2HB ARG 46 -9.810 5.723 -8.593 358 HB3 ARG 46 1HB ARG 46 -11.112 6.330 -7.614 359 HG2 ARG 46 2HG ARG 46 -8.359 7.686 -7.844 360 HG3 ARG 46 1HG ARG 46 -9.719 8.128 -8.845 361 HD2 ARG 46 2HD ARG 46 -9.599 8.467 -5.759 362 HD3 ARG 46 1HD ARG 46 -9.324 9.726 -6.956 363 HH11 ARG 46 2HH1 ARG 46 -10.401 10.531 -5.055 364 HH12 ARG 46 1HH1 ARG 46 -11.951 11.384 -4.614 365 HH21 ARG 46 1HH2 ARG 46 -13.716 9.359 -6.671 366 HH22 ARG 46 2HH2 ARG 46 -13.725 10.770 -5.514 367 H THR 47 H THR 47 -9.294 2.748 -6.769 368 HA THR 47 HA THR 47 -11.635 1.979 -5.302 369 HB THR 47 HB THR 47 -9.032 0.346 -5.246 370 HG1 THR 47 HG1 THR 47 -11.034 0.113 -7.198 371 HG21 THR 47 3HG2 THR 47 -11.276 -1.378 -5.723 372 HG22 THR 47 1HG2 THR 47 -11.846 -0.259 -4.459 373 HG23 THR 47 2HG2 THR 47 -10.350 -1.184 -4.233 374 H THR 48 H THR 48 -8.577 1.337 -3.521 375 HA THR 48 HA THR 48 -9.226 1.940 -0.956 376 HB THR 48 HB THR 48 -6.791 2.544 -0.543 377 HG1 THR 48 HG1 THR 48 -7.063 3.146 -3.128 378 HG21 THR 48 3HG2 THR 48 -5.820 0.473 -1.170 379 HG22 THR 48 1HG2 THR 48 -6.966 0.167 -2.486 380 HG23 THR 48 2HG2 THR 48 -7.518 0.125 -0.804 381 H PHE 49 H PHE 49 -8.874 4.775 -3.110 382 HA PHE 49 HA PHE 49 -8.827 6.651 -0.698 383 HD1 PHE 49 HD2 PHE 49 -10.380 9.370 -3.050 384 HD2 PHE 49 HD1 PHE 49 -6.647 8.945 -0.996 385 HE1 PHE 49 HE2 PHE 49 -10.611 11.673 -2.151 386 HE2 PHE 49 HE1 PHE 49 -6.874 11.251 -0.139 387 HZ PHE 49 HZ PHE 49 -8.872 12.581 -0.654 388 HB2 PHE 49 2HB PHE 49 -7.365 7.244 -2.618 389 HB3 PHE 49 1HB PHE 49 -8.765 7.495 -3.633 390 H GLU 50 H GLU 50 -11.210 5.636 -3.118 391 HA GLU 50 HA GLU 50 -13.296 7.552 -2.170 392 HB2 GLU 50 2HB GLU 50 -13.531 5.051 -3.938 393 HB3 GLU 50 1HB GLU 50 -14.896 6.035 -3.456 394 HG2 GLU 50 2HG GLU 50 -13.857 8.060 -4.537 395 HG3 GLU 50 1HG GLU 50 -12.425 7.139 -4.974 396 H SER 51 H SER 51 -12.251 4.309 -1.134 397 HA SER 51 HA SER 51 -13.809 4.358 1.383 398 HG SER 51 HG SER 51 -12.192 1.700 2.535 399 HB2 SER 51 2HB SER 51 -11.665 2.690 0.295 400 HB3 SER 51 1HB SER 51 -11.090 3.335 1.801 401 H MET 52 H MET 52 -10.326 5.168 1.546 402 HA MET 52 HA MET 52 -10.438 6.452 3.936 403 HB2 MET 52 2HB MET 52 -8.551 7.227 1.631 404 HB3 MET 52 1HB MET 52 -8.259 7.586 3.360 405 HG2 MET 52 2HG MET 52 -7.998 5.295 3.970 406 HG3 MET 52 1HG MET 52 -8.346 4.734 2.300 407 HE1 MET 52 3HE MET 52 -4.509 4.631 2.247 408 HE2 MET 52 1HE MET 52 -6.062 3.734 2.128 409 HE3 MET 52 2HE MET 52 -5.483 4.316 3.723 410 H ARG 53 H ARG 53 -11.647 8.118 1.361 411 HA ARG 53 HA ARG 53 -11.609 10.886 2.456 412 HE ARG 53 HE ARG 53 -15.413 10.156 -0.862 413 HB2 ARG 53 2HB ARG 53 -12.016 10.287 0.058 414 HB3 ARG 53 1HB ARG 53 -13.451 9.374 0.501 415 HG2 ARG 53 2HG ARG 53 -13.234 12.358 1.211 416 HG3 ARG 53 1HG ARG 53 -13.550 11.951 -0.450 417 HD2 ARG 53 2HD ARG 53 -15.274 10.787 1.838 418 HD3 ARG 53 1HD ARG 53 -15.547 12.398 1.169 419 HH11 ARG 53 2HH1 ARG 53 -17.521 11.561 1.403 420 HH12 ARG 53 1HH1 ARG 53 -19.021 11.259 0.402 421 HH21 ARG 53 1HH2 ARG 53 -17.104 9.849 -2.077 422 HH22 ARG 53 2HH2 ARG 53 -18.762 10.347 -1.524 423 H ASP 54 H ASP 54 -13.142 7.988 3.583 424 HA ASP 54 HA ASP 54 -14.462 9.634 5.767 425 HB2 ASP 54 2HB ASP 54 -15.326 7.186 4.460 426 HB3 ASP 54 1HB ASP 54 -14.812 6.711 6.048 427 H ASP 55 H ASP 55 -12.630 6.511 6.273 428 HA ASP 55 HA ASP 55 -11.075 7.882 8.427 429 HB2 ASP 55 2HB ASP 55 -11.748 5.079 7.874 430 HB3 ASP 55 1HB ASP 55 -10.030 5.183 8.020 431 H LEU 56 H LEU 56 -9.491 9.251 7.794 432 HA LEU 56 HA LEU 56 -7.655 8.861 5.683 433 HG LEU 56 HG LEU 56 -7.477 12.529 6.878 434 HB2 LEU 56 2HB LEU 56 -6.663 10.457 8.074 435 HB3 LEU 56 1HB LEU 56 -6.324 10.656 6.398 436 HD11 LEU 56 1HD1 LEU 56 -9.692 10.723 5.762 437 HD12 LEU 56 2HD1 LEU 56 -8.492 11.659 4.820 438 HD13 LEU 56 3HD1 LEU 56 -9.719 12.493 5.774 439 HD21 LEU 56 3HD2 LEU 56 -8.583 12.776 8.805 440 HD22 LEU 56 1HD2 LEU 56 -8.796 11.029 9.018 441 HD23 LEU 56 2HD2 LEU 56 -10.011 11.963 8.126 442 HA PRO 57 HA PRO 57 -4.422 6.049 7.420 443 HB2 PRO 57 2HB PRO 57 -2.405 6.358 5.611 444 HB3 PRO 57 1HB PRO 57 -3.941 5.597 5.206 445 HG2 PRO 57 2HG PRO 57 -3.080 8.480 4.605 446 HG3 PRO 57 1HG PRO 57 -3.864 7.326 3.505 447 HD2 PRO 57 2HD PRO 57 -5.242 9.264 4.938 448 HD3 PRO 57 1HD PRO 57 -6.015 7.726 4.454 449 H GLY 58 H GLY 58 -2.438 8.908 6.532 450 HA2 GLY 58 2HA GLY 58 -1.592 9.306 9.463 451 HA3 GLY 58 1HA GLY 58 -0.342 8.785 8.320 452 H SER 59 H SER 59 0.895 10.677 8.693 453 HA SER 59 HA SER 59 0.005 13.344 8.413 454 HG SER 59 HG SER 59 3.301 14.529 7.977 455 HB2 SER 59 2HB SER 59 2.257 12.628 9.270 456 HB3 SER 59 1HB SER 59 2.812 12.412 7.604 457 H ALA 60 H ALA 60 0.150 11.283 5.612 458 HA ALA 60 HA ALA 60 -1.218 13.456 4.216 459 HB1 ALA 60 3HB ALA 60 0.443 13.484 2.112 460 HB2 ALA 60 1HB ALA 60 1.647 12.873 3.271 461 HB3 ALA 60 2HB ALA 60 0.848 14.424 3.566 462 H GLN 61 H GLN 61 -2.174 13.100 2.280 463 HA GLN 61 HA GLN 61 -2.442 10.190 1.332 464 HB2 GLN 61 2HB GLN 61 -4.446 12.367 1.917 465 HB3 GLN 61 1HB GLN 61 -4.739 11.573 0.380 466 HG2 GLN 61 2HG GLN 61 -4.983 9.388 1.473 467 HG3 GLN 61 1HG GLN 61 -4.295 9.994 2.964 468 HE21 GLN 61 1HE2 GLN 61 -7.216 9.073 1.859 469 HE22 GLN 61 2HE2 GLN 61 -8.160 10.116 3.032 470 H ILE 62 H ILE 62 -1.598 9.834 -0.508 471 HA ILE 62 HA ILE 62 -1.537 11.893 -2.801 472 HB ILE 62 HB ILE 62 0.383 9.656 -1.949 473 HG12 ILE 62 2HG1 ILE 62 1.220 12.496 -2.444 474 HG13 ILE 62 1HG1 ILE 62 0.439 12.153 -0.916 475 HG21 ILE 62 1HG2 ILE 62 1.814 10.519 -3.970 476 HG22 ILE 62 2HG2 ILE 62 0.277 11.237 -4.572 477 HG23 ILE 62 3HG2 ILE 62 0.437 9.466 -4.365 478 HD11 ILE 62 3HD1 ILE 62 2.288 10.361 -0.493 479 HD12 ILE 62 1HD1 ILE 62 2.815 12.047 -0.547 480 HD13 ILE 62 2HD1 ILE 62 3.093 11.016 -1.967 481 H VAL 63 H VAL 63 -2.776 11.253 -4.554 482 HA VAL 63 HA VAL 63 -3.234 8.245 -4.945 483 HB VAL 63 HB VAL 63 -5.057 10.421 -5.936 484 HG11 VAL 63 1HG1 VAL 63 -6.498 8.582 -6.934 485 HG12 VAL 63 2HG1 VAL 63 -5.261 7.389 -6.504 486 HG13 VAL 63 3HG1 VAL 63 -4.907 8.607 -7.726 487 HG21 VAL 63 3HG2 VAL 63 -6.798 9.142 -4.551 488 HG22 VAL 63 1HG2 VAL 63 -5.471 9.755 -3.560 489 HG23 VAL 63 2HG2 VAL 63 -5.506 8.045 -3.992 490 H MET 64 H MET 64 -2.091 7.308 -6.399 491 HA MET 64 HA MET 64 -0.737 8.645 -8.703 492 HB2 MET 64 2HB MET 64 -0.995 5.834 -7.439 493 HB3 MET 64 1HB MET 64 -0.482 5.921 -9.080 494 HG2 MET 64 2HG MET 64 1.166 7.917 -7.697 495 HG3 MET 64 1HG MET 64 1.078 6.488 -6.682 496 HE1 MET 64 3HE MET 64 0.790 6.517 -10.835 497 HE2 MET 64 1HE MET 64 2.543 6.653 -11.110 498 HE3 MET 64 2HE MET 64 1.664 7.957 -10.249 499 H SER 65 H SER 65 -2.010 9.432 -10.237 500 HA SER 65 HA SER 65 -3.333 7.539 -12.121 501 HG SER 65 HG SER 65 -5.925 7.562 -12.599 502 HB2 SER 65 2HB SER 65 -5.161 7.621 -10.500 503 HB3 SER 65 1HB SER 65 -5.175 9.386 -10.520 504 H ARG 66 H ARG 66 -3.352 11.075 -11.496 505 HA ARG 66 HA ARG 66 -1.865 11.913 -13.609 506 HE ARG 66 HE ARG 66 -1.951 11.797 -19.032 507 HB2 ARG 66 2HB ARG 66 -4.255 11.035 -14.926 508 HB3 ARG 66 1HB ARG 66 -4.488 12.759 -14.877 509 HG2 ARG 66 2HG ARG 66 -2.251 13.121 -16.038 510 HG3 ARG 66 1HG ARG 66 -1.889 11.416 -15.859 511 HD2 ARG 66 2HD ARG 66 -4.310 11.226 -17.282 512 HD3 ARG 66 1HD ARG 66 -3.793 12.804 -17.802 513 HH11 ARG 66 2HH1 ARG 66 -3.074 9.465 -16.710 514 HH12 ARG 66 1HH1 ARG 66 -2.137 8.121 -17.490 515 HH21 ARG 66 1HH2 ARG 66 -0.853 10.270 -19.828 516 HH22 ARG 66 2HH2 ARG 66 -0.927 8.573 -19.170 517 H SER 67 H SER 67 -2.567 14.537 -14.313 518 HA SER 67 HA SER 67 -3.413 16.656 -13.675 519 HG SER 67 HG SER 67 -5.329 17.846 -12.188 520 HB2 SER 67 2HB SER 67 -5.445 15.046 -12.915 521 HB3 SER 67 1HB SER 67 -4.954 15.501 -11.308 522 H GLU 68 H GLU 68 -3.423 18.210 -11.719 523 HA GLU 68 HA GLU 68 -0.938 17.903 -10.098 524 HB2 GLU 68 2HB GLU 68 -1.302 20.252 -9.701 525 HB3 GLU 68 1HB GLU 68 -1.330 19.846 -11.375 526 HG2 GLU 68 2HG GLU 68 -3.927 20.467 -9.765 527 HG3 GLU 68 1HG GLU 68 -2.962 21.676 -10.590 528 H ARG 69 H ARG 69 -3.240 19.477 -8.112 529 HA ARG 69 HA ARG 69 -3.647 16.981 -6.433 530 HE ARG 69 HE ARG 69 0.390 21.265 -4.955 531 HB2 ARG 69 2HB ARG 69 -2.274 17.656 -4.519 532 HB3 ARG 69 1HB ARG 69 -1.388 17.197 -5.939 533 HG2 ARG 69 2HG ARG 69 -0.193 19.094 -5.950 534 HG3 ARG 69 1HG ARG 69 -1.629 20.089 -6.119 535 HD2 ARG 69 2HD ARG 69 -2.000 20.132 -3.679 536 HD3 ARG 69 1HD ARG 69 -0.610 19.035 -3.397 537 HH11 ARG 69 2HH1 ARG 69 -0.766 20.686 -1.688 538 HH12 ARG 69 1HH1 ARG 69 0.132 22.117 -1.067 539 HH21 ARG 69 1HH2 ARG 69 1.391 22.853 -4.184 540 HH22 ARG 69 2HH2 ARG 69 1.316 23.285 -2.417 541 H SER 70 H SER 70 -5.767 17.218 -6.197 542 HA SER 70 HA SER 70 -6.653 19.019 -3.927 543 HG SER 70 HG SER 70 -6.808 20.994 -4.628 544 HB2 SER 70 2HB SER 70 -7.583 19.375 -6.833 545 HB3 SER 70 1HB SER 70 -8.735 19.676 -5.567 546 H PHE 71 H PHE 71 -7.805 17.740 -2.526 547 HA PHE 71 HA PHE 71 -10.099 16.094 -3.691 548 HD1 PHE 71 HD1 PHE 71 -10.163 14.041 -4.808 549 HD2 PHE 71 HD2 PHE 71 -6.421 13.556 -2.740 550 HE1 PHE 71 HE1 PHE 71 -9.419 12.392 -6.494 551 HE2 PHE 71 HE2 PHE 71 -5.723 11.912 -4.373 552 HZ PHE 71 HZ PHE 71 -7.225 11.275 -6.249 553 HB2 PHE 71 2HB PHE 71 -8.047 14.944 -1.730 554 HB3 PHE 71 1HB PHE 71 -9.616 14.233 -2.011 555 H SER 72 H SER 72 -9.171 16.553 -0.182 556 HA SER 72 HA SER 72 -12.020 17.277 0.426 557 HG SER 72 HG SER 72 -12.358 15.537 -1.107 558 HB2 SER 72 2HB SER 72 -11.165 14.351 0.887 559 HB3 SER 72 1HB SER 72 -12.588 15.090 1.614 560 H VAL 73 H VAL 73 -9.348 15.607 2.180 561 HA VAL 73 HA VAL 73 -9.724 17.519 4.533 562 HB VAL 73 HB VAL 73 -9.468 15.190 5.203 563 HG11 VAL 73 1HG1 VAL 73 -8.060 14.169 3.450 564 HG12 VAL 73 2HG1 VAL 73 -7.335 13.897 5.025 565 HG13 VAL 73 3HG1 VAL 73 -6.648 15.140 3.961 566 HG21 VAL 73 3HG2 VAL 73 -8.555 16.895 6.806 567 HG22 VAL 73 1HG2 VAL 73 -6.956 16.785 6.045 568 HG23 VAL 73 2HG2 VAL 73 -7.623 15.385 6.876 569 H ASP 74 H ASP 74 -7.796 18.731 5.233 570 HA ASP 74 HA ASP 74 -6.445 20.122 3.049 571 HB2 ASP 74 2HB ASP 74 -6.835 20.644 5.850 572 HB3 ASP 74 1HB ASP 74 -5.099 20.440 5.726 573 H THR 75 H THR 75 -5.026 17.655 5.324 574 HA THR 75 HA THR 75 -2.629 17.343 3.562 575 HB THR 75 HB THR 75 -2.618 16.939 6.077 576 HG1 THR 75 HG1 THR 75 -0.966 15.343 5.633 577 HG21 THR 75 3HG2 THR 75 -2.819 14.627 6.905 578 HG22 THR 75 1HG2 THR 75 -3.323 13.999 5.343 579 HG23 THR 75 2HG2 THR 75 -4.422 15.045 6.267 580 H ALA 76 H ALA 76 -4.947 17.032 1.949 581 HA ALA 76 HA ALA 76 -4.360 14.242 0.856 582 HB1 ALA 76 3HB ALA 76 -6.417 13.868 1.928 583 HB2 ALA 76 1HB ALA 76 -6.778 13.908 0.189 584 HB3 ALA 76 2HB ALA 76 -7.203 15.307 1.221 585 H HIS 77 H HIS 77 -3.892 14.066 -1.031 586 HA HIS 77 HA HIS 77 -3.971 16.337 -3.083 587 HD1 HIS 77 HD1 HIS 77 -0.812 15.897 0.454 588 HD2 HIS 77 HD2 HIS 77 -2.899 18.693 -1.986 589 HE1 HIS 77 HE1 HIS 77 -0.638 18.238 1.481 590 HB2 HIS 77 2HB HIS 77 -1.522 14.947 -1.771 591 HB3 HIS 77 1HB HIS 77 -1.424 16.140 -3.038 592 H ARG 78 H ARG 78 -2.394 15.563 -4.996 593 HA ARG 78 HA ARG 78 -3.067 12.748 -5.786 594 HE ARG 78 HE ARG 78 -4.997 13.162 -10.659 595 HB2 ARG 78 2HB ARG 78 -4.557 14.980 -6.920 596 HB3 ARG 78 1HB ARG 78 -3.480 14.504 -8.172 597 HG2 ARG 78 2HG ARG 78 -5.033 12.354 -6.703 598 HG3 ARG 78 1HG ARG 78 -5.947 13.417 -7.696 599 HD2 ARG 78 2HD ARG 78 -3.488 12.256 -9.074 600 HD3 ARG 78 1HD ARG 78 -4.591 11.031 -8.580 601 HH11 ARG 78 2HH1 ARG 78 -6.685 10.851 -8.753 602 HH12 ARG 78 1HH1 ARG 78 -8.051 10.640 -9.948 603 HH21 ARG 78 1HH2 ARG 78 -6.555 12.987 -12.009 604 HH22 ARG 78 2HH2 ARG 78 -7.969 11.855 -11.752 605 H ALA 79 H ALA 79 -1.698 11.777 -7.218 606 HA ALA 79 HA ALA 79 0.795 13.335 -8.084 607 HB1 ALA 79 3HB ALA 79 0.539 10.366 -7.187 608 HB2 ALA 79 1HB ALA 79 1.469 11.679 -6.391 609 HB3 ALA 79 2HB ALA 79 1.969 11.059 -7.976 610 H ALA 80 H ALA 80 1.381 13.101 -10.141 611 HA ALA 80 HA ALA 80 -0.286 11.511 -12.102 612 HB1 ALA 80 3HB ALA 80 1.046 12.938 -13.795 613 HB2 ALA 80 1HB ALA 80 1.750 13.755 -12.406 614 HB3 ALA 80 2HB ALA 80 0.009 13.836 -12.642 615 H SER 81 H SER 81 3.327 11.520 -11.377 616 HA SER 81 HA SER 81 3.294 8.571 -12.233 617 HG SER 81 HG SER 81 6.530 9.270 -13.661 618 HB2 SER 81 2HB SER 81 4.500 10.389 -13.641 619 HB3 SER 81 1HB SER 81 5.551 10.691 -12.254 620 H VAL 82 H VAL 82 5.876 8.128 -11.307 621 HA VAL 82 HA VAL 82 5.593 7.719 -8.286 622 HB VAL 82 HB VAL 82 7.708 6.480 -10.146 623 HG11 VAL 82 1HG1 VAL 82 7.529 6.624 -7.091 624 HG12 VAL 82 2HG1 VAL 82 8.942 6.819 -8.142 625 HG13 VAL 82 3HG1 VAL 82 8.272 5.211 -7.884 626 HG21 VAL 82 3HG2 VAL 82 5.157 5.355 -8.873 627 HG22 VAL 82 1HG2 VAL 82 6.554 4.292 -9.007 628 HG23 VAL 82 2HG2 VAL 82 5.892 5.041 -10.467 629 H GLU 83 H GLU 83 8.166 9.050 -10.559 630 HA GLU 83 HA GLU 83 9.414 10.742 -8.782 631 HB2 GLU 83 2HB GLU 83 8.736 11.674 -11.603 632 HB3 GLU 83 1HB GLU 83 10.061 12.195 -10.598 633 HG2 GLU 83 2HG GLU 83 10.032 9.207 -11.316 634 HG3 GLU 83 1HG GLU 83 10.338 10.332 -12.606 635 H GLU 84 H GLU 84 6.420 12.212 -10.474 636 HA GLU 84 HA GLU 84 6.029 14.250 -8.493 637 HB2 GLU 84 2HB GLU 84 3.860 12.644 -9.999 638 HB3 GLU 84 1HB GLU 84 3.556 14.111 -9.117 639 HG2 GLU 84 2HG GLU 84 3.682 15.177 -11.059 640 HG3 GLU 84 1HG GLU 84 5.412 15.154 -10.835 641 H ALA 85 H ALA 85 5.400 10.926 -7.831 642 HA ALA 85 HA ALA 85 3.731 11.498 -5.362 643 HB1 ALA 85 3HB ALA 85 3.200 9.383 -6.684 644 HB2 ALA 85 1HB ALA 85 3.617 9.096 -4.981 645 HB3 ALA 85 2HB ALA 85 4.810 8.763 -6.236 646 H VAL 86 H VAL 86 7.100 10.750 -6.170 647 HA VAL 86 HA VAL 86 7.951 10.721 -3.258 648 HB VAL 86 HB VAL 86 9.425 10.285 -5.898 649 HG11 VAL 86 1HG1 VAL 86 11.008 11.712 -4.654 650 HG12 VAL 86 2HG1 VAL 86 11.580 10.038 -4.659 651 HG13 VAL 86 3HG1 VAL 86 10.821 10.714 -3.185 652 HG21 VAL 86 3HG2 VAL 86 9.241 8.607 -3.291 653 HG22 VAL 86 1HG2 VAL 86 10.079 8.109 -4.774 654 HG23 VAL 86 2HG2 VAL 86 8.318 8.273 -4.770 655 H ASP 87 H ASP 87 8.326 13.077 -6.016 656 HA ASP 87 HA ASP 87 9.359 15.198 -4.376 657 HB2 ASP 87 2HB ASP 87 8.164 14.984 -7.134 658 HB3 ASP 87 1HB ASP 87 7.801 16.506 -6.390 659 H ILE 88 H ILE 88 5.826 14.432 -4.829 660 HA ILE 88 HA ILE 88 5.224 16.753 -3.072 661 HB ILE 88 HB ILE 88 3.123 16.658 -2.923 662 HG12 ILE 88 2HG1 ILE 88 2.450 14.035 -4.317 663 HG13 ILE 88 1HG1 ILE 88 2.907 13.986 -2.648 664 HG21 ILE 88 1HG2 ILE 88 3.437 15.717 -5.825 665 HG22 ILE 88 2HG2 ILE 88 3.955 17.305 -5.254 666 HG23 ILE 88 3HG2 ILE 88 2.229 16.853 -5.184 667 HD11 ILE 88 3HD1 ILE 88 0.732 14.486 -2.120 668 HD12 ILE 88 1HD1 ILE 88 0.367 15.030 -3.771 669 HD13 ILE 88 2HD1 ILE 88 1.054 16.145 -2.558 670 H ALA 89 H ALA 89 5.702 13.373 -2.258 671 HA ALA 89 HA ALA 89 4.971 13.682 0.624 672 HB1 ALA 89 3HB ALA 89 5.081 11.420 -0.254 673 HB2 ALA 89 1HB ALA 89 6.414 11.592 0.885 674 HB3 ALA 89 2HB ALA 89 6.739 11.639 -0.859 675 H ALA 90 H ALA 90 8.179 13.961 -1.020 676 HA ALA 90 HA ALA 90 9.545 14.945 1.443 677 HB1 ALA 90 3HB ALA 90 10.287 14.974 -1.553 678 HB2 ALA 90 1HB ALA 90 10.763 13.765 -0.337 679 HB3 ALA 90 2HB ALA 90 11.409 15.422 -0.258 680 H SER 91 H SER 91 7.811 16.651 -1.085 681 HA SER 91 HA SER 91 8.573 19.418 -0.283 682 HG SER 91 HG SER 91 6.216 20.484 -0.616 683 HB2 SER 91 2HB SER 91 7.586 18.959 -2.528 684 HB3 SER 91 1HB SER 91 6.183 18.220 -1.790 685 H LEU 92 H LEU 92 6.294 17.150 1.173 686 HA LEU 92 HA LEU 92 5.175 19.385 2.914 687 HG LEU 92 HG LEU 92 4.554 15.997 1.553 688 HB2 LEU 92 2HB LEU 92 3.497 17.800 3.789 689 HB3 LEU 92 1HB LEU 92 3.362 18.376 2.156 690 HD11 LEU 92 1HD1 LEU 92 3.025 15.389 4.154 691 HD12 LEU 92 2HD1 LEU 92 4.769 15.182 3.865 692 HD13 LEU 92 3HD1 LEU 92 3.636 14.197 2.972 693 HD21 LEU 92 3HD2 LEU 92 2.334 15.044 1.078 694 HD22 LEU 92 1HD2 LEU 92 2.314 16.746 0.630 695 HD23 LEU 92 2HD2 LEU 92 1.525 16.208 2.144 696 H ASP 93 H ASP 93 5.633 16.370 4.630 697 HA ASP 93 HA ASP 93 8.372 17.247 5.590 698 HB2 ASP 93 2HB ASP 93 7.482 17.319 7.961 699 HB3 ASP 93 1HB ASP 93 7.035 18.598 6.888 700 H ALA 94 H ALA 94 8.460 14.903 4.266 701 HA ALA 94 HA ALA 94 9.010 12.897 6.535 702 HB1 ALA 94 3HB ALA 94 7.676 12.331 3.810 703 HB2 ALA 94 1HB ALA 94 6.838 12.561 5.363 704 HB3 ALA 94 2HB ALA 94 7.917 11.173 5.156 705 H GLU 95 H GLU 95 10.565 11.435 6.464 706 HA GLU 95 HA GLU 95 12.646 11.452 4.244 707 HB2 GLU 95 2HB GLU 95 13.008 9.477 6.507 708 HB3 GLU 95 1HB GLU 95 14.161 10.215 5.409 709 HG2 GLU 95 2HG GLU 95 13.991 12.384 6.834 710 HG3 GLU 95 1HG GLU 95 12.952 11.469 7.933 711 H THR 96 H THR 96 10.252 9.116 5.627 712 HA THR 96 HA THR 96 10.661 7.324 3.182 713 HB THR 96 HB THR 96 9.227 5.640 4.662 714 HG1 THR 96 HG1 THR 96 8.758 6.868 6.455 715 HG21 THR 96 3HG2 THR 96 12.178 6.151 5.408 716 HG22 THR 96 1HG2 THR 96 11.603 5.121 4.066 717 HG23 THR 96 2HG2 THR 96 11.242 4.680 5.743 718 H ALA 97 H ALA 97 8.536 6.167 2.721 719 HA ALA 97 HA ALA 97 6.069 7.415 3.642 720 HB1 ALA 97 3HB ALA 97 6.261 9.037 1.855 721 HB2 ALA 97 1HB ALA 97 5.015 7.906 1.295 722 HB3 ALA 97 2HB ALA 97 6.671 7.827 0.624 723 H TYR 98 H TYR 98 4.079 6.238 2.643 724 HA TYR 98 HA TYR 98 4.701 3.292 2.113 725 HD1 TYR 98 HD1 TYR 98 4.591 1.075 4.089 726 HD2 TYR 98 HD2 TYR 98 4.574 4.979 5.827 727 HE1 TYR 98 HE1 TYR 98 6.520 0.461 5.475 728 HE2 TYR 98 HE2 TYR 98 6.403 4.315 7.326 729 HH TYR 98 HH TYR 98 8.244 2.880 7.281 730 HB2 TYR 98 2HB TYR 98 2.828 4.412 4.291 731 HB3 TYR 98 1HB TYR 98 2.668 2.765 3.719 732 H VAL 99 H VAL 99 2.595 2.062 1.535 733 HA VAL 99 HA VAL 99 0.688 3.683 -0.216 734 HB VAL 99 HB VAL 99 1.562 3.245 -2.148 735 HG11 VAL 99 1HG1 VAL 99 3.687 2.357 -2.734 736 HG12 VAL 99 2HG1 VAL 99 3.873 1.583 -1.164 737 HG13 VAL 99 3HG1 VAL 99 3.798 3.309 -1.261 738 HG21 VAL 99 3HG2 VAL 99 1.723 1.127 -3.399 739 HG22 VAL 99 1HG2 VAL 99 0.175 1.327 -2.535 740 HG23 VAL 99 2HG2 VAL 99 1.412 0.264 -1.881 741 H ILE 100 H ILE 100 -1.344 3.005 0.747 742 HA ILE 100 HA ILE 100 -1.797 0.206 1.307 743 HB ILE 100 HB ILE 100 -4.141 2.052 0.693 744 HG12 ILE 100 2HG1 ILE 100 -2.982 3.154 2.404 745 HG13 ILE 100 1HG1 ILE 100 -4.242 2.303 3.232 746 HG21 ILE 100 1HG2 ILE 100 -4.133 -0.429 2.510 747 HG22 ILE 100 2HG2 ILE 100 -4.733 -0.461 0.830 748 HG23 ILE 100 3HG2 ILE 100 -5.514 0.572 2.030 749 HD11 ILE 100 3HD1 ILE 100 -2.676 0.688 4.164 750 HD12 ILE 100 1HD1 ILE 100 -1.975 2.333 4.428 751 HD13 ILE 100 2HD1 ILE 100 -1.350 1.291 3.137 752 H GLY 101 H GLY 101 -2.892 1.674 -1.574 753 HA2 GLY 101 2HA GLY 101 -2.667 0.820 -3.786 754 HA3 GLY 101 1HA GLY 101 -1.650 -0.407 -3.189 755 H GLY 102 H GLY 102 -2.688 -2.406 -4.573 756 HA2 GLY 102 2HA GLY 102 -4.827 -0.425 -5.647 757 HA3 GLY 102 1HA GLY 102 -3.185 -0.371 -6.172 758 H ALA 103 H ALA 103 -6.167 -1.842 -6.874 759 HA ALA 103 HA ALA 103 -5.846 -3.216 -9.199 760 HB1 ALA 103 3HB ALA 103 -7.242 -0.391 -9.125 761 HB2 ALA 103 1HB ALA 103 -7.895 -1.785 -8.324 762 HB3 ALA 103 2HB ALA 103 -7.747 -1.770 -10.060 763 H ALA 104 H ALA 104 -4.831 0.197 -9.277 764 HA ALA 104 HA ALA 104 -2.937 -0.475 -11.598 765 HB1 ALA 104 3HB ALA 104 -3.846 2.321 -10.731 766 HB2 ALA 104 1HB ALA 104 -4.398 1.425 -12.179 767 HB3 ALA 104 2HB ALA 104 -2.694 1.935 -12.029 768 H ILE 105 H ILE 105 -2.995 0.379 -8.172 769 HA ILE 105 HA ILE 105 -0.464 1.871 -8.259 770 HB ILE 105 HB ILE 105 -1.531 0.979 -5.627 771 HG12 ILE 105 2HG1 ILE 105 -3.596 1.851 -6.470 772 HG13 ILE 105 1HG1 ILE 105 -2.879 3.036 -5.469 773 HG21 ILE 105 1HG2 ILE 105 -0.607 2.977 -4.730 774 HG22 ILE 105 2HG2 ILE 105 -0.156 3.617 -6.317 775 HG23 ILE 105 3HG2 ILE 105 0.672 2.187 -5.656 776 HD11 ILE 105 3HD1 ILE 105 -2.070 3.508 -8.339 777 HD12 ILE 105 1HD1 ILE 105 -3.003 4.569 -7.258 778 HD13 ILE 105 2HD1 ILE 105 -3.832 3.271 -8.166 779 H TYR 106 H TYR 106 -0.815 -1.094 -6.160 780 HA TYR 106 HA TYR 106 2.035 -1.715 -6.073 781 HD1 TYR 106 HD1 TYR 106 2.787 -4.583 -4.670 782 HD2 TYR 106 HD2 TYR 106 -0.585 -2.282 -3.331 783 HE1 TYR 106 HE1 TYR 106 3.346 -5.100 -2.355 784 HE2 TYR 106 HE2 TYR 106 -0.039 -2.844 -1.015 785 HH TYR 106 HH TYR 106 2.813 -4.330 -0.020 786 HB2 TYR 106 2HB TYR 106 -0.540 -3.293 -5.615 787 HB3 TYR 106 1HB TYR 106 0.828 -4.246 -6.062 788 H ALA 107 H ALA 107 -0.202 -2.416 -8.723 789 HA ALA 107 HA ALA 107 1.687 -4.110 -10.292 790 HB1 ALA 107 3HB ALA 107 -0.779 -4.287 -10.570 791 HB2 ALA 107 1HB ALA 107 -0.070 -3.746 -12.103 792 HB3 ALA 107 2HB ALA 107 -0.883 -2.579 -11.041 793 H LEU 108 H LEU 108 1.028 -0.582 -10.340 794 HA LEU 108 HA LEU 108 3.276 -0.222 -12.344 795 HG LEU 108 HG LEU 108 1.958 2.255 -9.873 796 HB2 LEU 108 2HB LEU 108 2.620 1.835 -12.804 797 HB3 LEU 108 1HB LEU 108 1.085 1.213 -12.310 798 HD11 LEU 108 1HD1 LEU 108 3.267 4.264 -10.155 799 HD12 LEU 108 2HD1 LEU 108 3.041 4.317 -11.909 800 HD13 LEU 108 3HD1 LEU 108 4.111 3.112 -11.180 801 HD21 LEU 108 3HD2 LEU 108 0.513 3.792 -12.088 802 HD22 LEU 108 1HD2 LEU 108 0.618 4.293 -10.395 803 HD23 LEU 108 2HD2 LEU 108 -0.236 2.803 -10.791 804 H PHE 109 H PHE 109 2.828 0.465 -8.850 805 HA PHE 109 HA PHE 109 5.500 1.556 -8.522 806 HD1 PHE 109 HD2 PHE 109 6.665 2.370 -6.129 807 HD2 PHE 109 HD1 PHE 109 2.497 3.227 -6.699 808 HE1 PHE 109 HE2 PHE 109 7.111 4.721 -5.767 809 HE2 PHE 109 HE1 PHE 109 2.984 5.634 -6.313 810 HZ PHE 109 HZ PHE 109 5.299 6.377 -5.901 811 HB2 PHE 109 2HB PHE 109 3.202 0.905 -6.668 812 HB3 PHE 109 1HB PHE 109 4.702 0.547 -5.908 813 H GLN 110 H GLN 110 4.664 -1.812 -8.480 814 HA GLN 110 HA GLN 110 6.517 -3.028 -6.840 815 HB2 GLN 110 2HB GLN 110 6.608 -4.991 -8.464 816 HB3 GLN 110 1HB GLN 110 5.148 -4.510 -7.698 817 HG2 GLN 110 2HG GLN 110 4.033 -4.553 -9.602 818 HG3 GLN 110 1HG GLN 110 4.870 -3.158 -10.149 819 HE21 GLN 110 1HE2 GLN 110 4.497 -6.532 -10.592 820 HE22 GLN 110 2HE2 GLN 110 5.646 -6.614 -12.021 821 HA PRO 111 HA PRO 111 10.712 -2.835 -9.159 822 HB2 PRO 111 2HB PRO 111 10.622 -0.727 -11.244 823 HB3 PRO 111 1HB PRO 111 11.033 -2.441 -11.397 824 HG2 PRO 111 2HG PRO 111 8.692 -1.351 -12.489 825 HG3 PRO 111 1HG PRO 111 8.850 -3.059 -11.997 826 HD2 PRO 111 2HD PRO 111 7.630 -0.750 -10.369 827 HD3 PRO 111 1HD PRO 111 6.948 -2.349 -10.674 828 H HIS 112 H HIS 112 8.862 -0.132 -8.220 829 HA HIS 112 HA HIS 112 11.283 1.700 -7.755 830 HD1 HIS 112 HD1 HIS 112 11.192 3.615 -10.129 831 HD2 HIS 112 HD2 HIS 112 7.240 2.009 -10.129 832 HE1 HIS 112 HE1 HIS 112 10.193 3.685 -12.528 833 HB2 HIS 112 2HB HIS 112 8.324 2.507 -7.744 834 HB3 HIS 112 1HB HIS 112 9.726 3.552 -7.749 835 H LEU 113 H LEU 113 9.331 -0.333 -5.802 836 HA LEU 113 HA LEU 113 9.221 1.432 -3.396 837 HG LEU 113 HG LEU 113 6.712 -1.060 -2.348 838 HB2 LEU 113 2HB LEU 113 9.003 -1.660 -3.588 839 HB3 LEU 113 1HB LEU 113 8.819 -0.759 -2.099 840 HD11 LEU 113 1HD1 LEU 113 6.949 1.336 -4.239 841 HD12 LEU 113 2HD1 LEU 113 6.815 1.408 -2.483 842 HD13 LEU 113 3HD1 LEU 113 5.434 0.862 -3.446 843 HD21 LEU 113 3HD2 LEU 113 5.456 -1.541 -4.425 844 HD22 LEU 113 1HD2 LEU 113 6.926 -2.536 -4.316 845 HD23 LEU 113 2HD2 LEU 113 6.905 -1.128 -5.403 846 H ASP 114 H ASP 114 10.503 1.523 -1.568 847 HA ASP 114 HA ASP 114 13.093 0.085 -1.183 848 HB2 ASP 114 2HB ASP 114 12.547 2.205 -0.021 849 HB3 ASP 114 1HB ASP 114 11.163 1.481 0.771 850 H ARG 115 H ARG 115 9.863 -0.590 0.345 851 HA ARG 115 HA ARG 115 10.430 -3.581 0.015 852 HE ARG 115 HE ARG 115 13.900 -3.298 3.301 853 HB2 ARG 115 2HB ARG 115 9.727 -2.015 2.580 854 HB3 ARG 115 1HB ARG 115 9.389 -3.732 2.477 855 HG2 ARG 115 2HG ARG 115 11.593 -4.375 2.626 856 HG3 ARG 115 1HG ARG 115 12.208 -2.971 1.743 857 HD2 ARG 115 2HD ARG 115 11.809 -1.507 3.777 858 HD3 ARG 115 1HD ARG 115 11.208 -2.902 4.655 859 HH11 ARG 115 2HH1 ARG 115 12.426 -2.384 6.214 860 HH12 ARG 115 1HH1 ARG 115 13.556 -3.444 7.175 861 HH21 ARG 115 1HH2 ARG 115 14.975 -4.543 4.453 862 HH22 ARG 115 2HH2 ARG 115 15.008 -4.432 6.210 863 H MET 116 H MET 116 8.694 -5.030 0.158 864 HA MET 116 HA MET 116 5.857 -3.889 -0.337 865 HB2 MET 116 2HB MET 116 7.122 -6.421 -1.478 866 HB3 MET 116 1HB MET 116 5.391 -6.163 -1.458 867 HG2 MET 116 2HG MET 116 5.605 -4.319 -3.068 868 HG3 MET 116 1HG MET 116 7.340 -4.155 -2.744 869 HE1 MET 116 3HE MET 116 4.561 -6.637 -4.005 870 HE2 MET 116 1HE MET 116 5.364 -7.267 -5.480 871 HE3 MET 116 2HE MET 116 4.972 -5.527 -5.358 872 H VAL 117 H VAL 117 5.434 -3.672 1.790 873 HA VAL 117 HA VAL 117 5.275 -5.969 3.722 874 HB VAL 117 HB VAL 117 4.712 -2.991 3.906 875 HG11 VAL 117 1HG1 VAL 117 3.176 -4.073 5.603 876 HG12 VAL 117 2HG1 VAL 117 4.482 -3.234 6.405 877 HG13 VAL 117 3HG1 VAL 117 4.541 -5.008 6.236 878 HG21 VAL 117 3HG2 VAL 117 6.726 -2.926 5.393 879 HG22 VAL 117 1HG2 VAL 117 7.164 -3.676 3.843 880 HG23 VAL 117 2HG2 VAL 117 6.910 -4.679 5.278 881 H LEU 118 H LEU 118 3.915 -6.996 1.926 882 HA LEU 118 HA LEU 118 0.970 -6.618 1.895 883 HG LEU 118 HG LEU 118 -0.089 -9.109 0.877 884 HB2 LEU 118 2HB LEU 118 1.965 -7.679 0.045 885 HB3 LEU 118 1HB LEU 118 2.965 -8.760 0.972 886 HD11 LEU 118 1HD1 LEU 118 0.566 -11.057 -0.864 887 HD12 LEU 118 2HD1 LEU 118 2.015 -10.088 -1.185 888 HD13 LEU 118 3HD1 LEU 118 0.372 -9.429 -1.441 889 HD21 LEU 118 3HD2 LEU 118 2.137 -11.191 1.219 890 HD22 LEU 118 1HD2 LEU 118 0.379 -11.412 1.477 891 HD23 LEU 118 2HD2 LEU 118 1.331 -10.467 2.618 892 H SER 119 H SER 119 -0.673 -7.927 2.792 893 HA SER 119 HA SER 119 0.057 -9.663 5.224 894 HG SER 119 HG SER 119 -0.997 -6.659 4.608 895 HB2 SER 119 2HB SER 119 -2.567 -8.349 5.670 896 HB3 SER 119 1HB SER 119 -1.161 -8.507 6.689 897 H ARG 120 H ARG 120 -0.921 -11.605 5.356 898 HA ARG 120 HA ARG 120 -2.604 -12.502 2.996 899 HE ARG 120 HE ARG 120 -1.084 -16.156 1.304 900 HB2 ARG 120 2HB ARG 120 -0.984 -14.047 5.090 901 HB3 ARG 120 1HB ARG 120 -1.821 -14.825 3.778 902 HG2 ARG 120 2HG ARG 120 0.366 -12.721 3.247 903 HG3 ARG 120 1HG ARG 120 0.775 -14.340 3.670 904 HD2 ARG 120 2HD ARG 120 -1.139 -13.763 1.294 905 HD3 ARG 120 1HD ARG 120 0.584 -13.733 1.072 906 HH11 ARG 120 2HH1 ARG 120 2.161 -15.115 2.159 907 HH12 ARG 120 1HH1 ARG 120 2.828 -16.768 1.982 908 HH21 ARG 120 1HH2 ARG 120 -0.250 -18.006 1.020 909 HH22 ARG 120 2HH2 ARG 120 1.529 -18.309 1.316 910 H VAL 121 H VAL 121 -4.798 -12.174 3.532 911 HA VAL 121 HA VAL 121 -5.815 -13.023 6.242 912 HB VAL 121 HB VAL 121 -7.593 -11.663 4.209 913 HG11 VAL 121 1HG1 VAL 121 -8.869 -10.953 6.172 914 HG12 VAL 121 2HG1 VAL 121 -7.597 -11.440 7.292 915 HG13 VAL 121 3HG1 VAL 121 -8.552 -12.667 6.429 916 HG21 VAL 121 3HG2 VAL 121 -7.083 -9.448 5.347 917 HG22 VAL 121 1HG2 VAL 121 -5.777 -10.041 4.338 918 HG23 VAL 121 2HG2 VAL 121 -5.664 -10.160 6.102 919 HA PRO 122 HA PRO 122 -7.695 -16.756 4.148 920 HB2 PRO 122 2HB PRO 122 -8.518 -17.431 7.007 921 HB3 PRO 122 1HB PRO 122 -7.693 -18.447 5.812 922 HG2 PRO 122 2HG PRO 122 -6.267 -17.393 7.882 923 HG3 PRO 122 1HG PRO 122 -5.554 -17.335 6.248 924 HD2 PRO 122 2HD PRO 122 -7.087 -15.057 7.646 925 HD3 PRO 122 1HD PRO 122 -5.466 -15.047 6.872 926 H GLY 123 H GLY 123 -9.795 -18.034 4.397 927 HA2 GLY 123 2HA GLY 123 -12.272 -17.928 4.838 928 HA3 GLY 123 1HA GLY 123 -12.256 -16.185 4.706 929 H GLU 124 H GLU 124 -10.435 -16.752 2.296 930 HA GLU 124 HA GLU 124 -10.471 -17.076 -0.017 931 HB2 GLU 124 2HB GLU 124 -12.283 -19.349 0.844 932 HB3 GLU 124 1HB GLU 124 -11.531 -19.247 -0.725 933 HG2 GLU 124 2HG GLU 124 -9.548 -20.130 0.069 934 HG3 GLU 124 1HG GLU 124 -9.386 -18.866 1.264 935 H TYR 125 H TYR 125 -11.135 -15.595 -1.377 936 HA TYR 125 HA TYR 125 -14.133 -15.071 -1.827 937 HD1 TYR 125 HD1 TYR 125 -15.465 -13.077 0.198 938 HD2 TYR 125 HD2 TYR 125 -11.358 -13.876 1.154 939 HE1 TYR 125 HE1 TYR 125 -16.014 -13.070 2.610 940 HE2 TYR 125 HE2 TYR 125 -11.923 -13.899 3.554 941 HH TYR 125 HH TYR 125 -13.452 -13.544 5.036 942 HB2 TYR 125 2HB TYR 125 -11.928 -13.035 -1.067 943 HB3 TYR 125 1HB TYR 125 -13.569 -12.605 -1.467 944 H GLU 126 H GLU 126 -14.289 -15.335 -4.137 945 HA GLU 126 HA GLU 126 -12.810 -14.670 -6.132 946 HB2 GLU 126 2HB GLU 126 -15.625 -13.619 -6.602 947 HB3 GLU 126 1HB GLU 126 -14.557 -14.502 -7.649 948 HG2 GLU 126 2HG GLU 126 -16.057 -15.812 -5.273 949 HG3 GLU 126 1HG GLU 126 -16.587 -15.784 -6.946 950 H GLY 127 H GLY 127 -14.057 -11.934 -4.457 951 HA2 GLY 127 2HA GLY 127 -13.244 -9.635 -4.477 952 HA3 GLY 127 1HA GLY 127 -12.118 -10.122 -5.718 953 H ASP 128 H ASP 128 -12.691 -7.833 -5.868 954 HA ASP 128 HA ASP 128 -13.523 -7.861 -8.679 955 HB2 ASP 128 2HB ASP 128 -15.425 -6.506 -7.457 956 HB3 ASP 128 1HB ASP 128 -14.230 -5.230 -7.217 957 H THR 129 H THR 129 -11.868 -5.969 -6.127 958 HA THR 129 HA THR 129 -9.761 -4.963 -7.914 959 HB THR 129 HB THR 129 -9.411 -5.203 -4.879 960 HG1 THR 129 HG1 THR 129 -11.365 -4.372 -4.875 961 HG21 THR 129 3HG2 THR 129 -7.629 -4.005 -6.405 962 HG22 THR 129 1HG2 THR 129 -8.294 -3.052 -5.042 963 HG23 THR 129 2HG2 THR 129 -8.899 -2.785 -6.690 964 H TYR 130 H TYR 130 -8.110 -6.213 -8.716 965 HA TYR 130 HA TYR 130 -6.954 -8.529 -7.137 966 HD1 TYR 130 HD1 TYR 130 -9.562 -7.975 -9.817 967 HD2 TYR 130 HD2 TYR 130 -6.959 -11.253 -8.891 968 HE1 TYR 130 HE1 TYR 130 -11.485 -9.528 -9.889 969 HE2 TYR 130 HE2 TYR 130 -8.855 -12.810 -9.120 970 HH TYR 130 HH TYR 130 -11.794 -12.139 -8.703 971 HB2 TYR 130 2HB TYR 130 -6.977 -7.794 -10.116 972 HB3 TYR 130 1HB TYR 130 -5.996 -9.091 -9.482 973 H TYR 131 H TYR 131 -4.965 -8.803 -6.500 974 HA TYR 131 HA TYR 131 -2.931 -6.600 -6.568 975 HD1 TYR 131 HD1 TYR 131 -2.113 -6.268 -3.451 976 HD2 TYR 131 HD2 TYR 131 -0.615 -9.917 -5.122 977 HE1 TYR 131 HE1 TYR 131 0.030 -5.969 -2.280 978 HE2 TYR 131 HE2 TYR 131 1.582 -9.443 -4.230 979 HH TYR 131 HH TYR 131 2.782 -8.156 -3.021 980 HB2 TYR 131 2HB TYR 131 -3.671 -7.995 -4.519 981 HB3 TYR 131 1HB TYR 131 -3.005 -9.393 -5.256 982 HA PRO 132 HA PRO 132 -0.318 -8.840 -9.671 983 HB2 PRO 132 2HB PRO 132 2.218 -7.621 -8.905 984 HB3 PRO 132 1HB PRO 132 1.105 -7.151 -10.195 985 HG2 PRO 132 2HG PRO 132 1.589 -5.607 -7.882 986 HG3 PRO 132 1HG PRO 132 0.173 -5.446 -8.937 987 HD2 PRO 132 2HD PRO 132 0.339 -6.894 -6.294 988 HD3 PRO 132 1HD PRO 132 -0.975 -5.876 -6.962 989 H GLU 133 H GLU 133 1.606 -10.196 -10.015 990 HA GLU 133 HA GLU 133 1.966 -12.225 -7.852 991 HB2 GLU 133 2HB GLU 133 3.285 -13.505 -9.549 992 HB3 GLU 133 1HB GLU 133 1.621 -13.170 -9.898 993 HG2 GLU 133 2HG GLU 133 2.978 -11.074 -11.310 994 HG3 GLU 133 1HG GLU 133 4.092 -12.427 -11.417 995 H TRP 134 H TRP 134 4.057 -13.142 -7.366 996 HA TRP 134 HA TRP 134 6.195 -11.046 -6.742 997 HD1 TRP 134 HD1 TRP 134 6.171 -14.888 -4.641 998 HE1 TRP 134 HE1 TRP 134 4.181 -16.542 -4.214 999 HE3 TRP 134 HE3 TRP 134 2.573 -11.335 -4.197 1000 HZ2 TRP 134 HZ2 TRP 134 1.412 -16.169 -3.657 1001 HZ3 TRP 134 HZ3 TRP 134 0.227 -12.040 -3.732 1002 HH2 TRP 134 HH2 TRP 134 -0.348 -14.431 -3.547 1003 HB2 TRP 134 2HB TRP 134 6.437 -11.993 -4.415 1004 HB3 TRP 134 1HB TRP 134 4.944 -11.137 -4.695 1005 H ASP 135 H ASP 135 8.300 -11.636 -6.936 1006 HA ASP 135 HA ASP 135 8.893 -14.500 -7.850 1007 HB2 ASP 135 2HB ASP 135 8.702 -12.600 -9.621 1008 HB3 ASP 135 1HB ASP 135 10.132 -11.869 -8.895 1009 H ALA 136 H ALA 136 11.643 -13.678 -8.007 1010 HA ALA 136 HA ALA 136 12.606 -13.742 -5.085 1011 HB1 ALA 136 3HB ALA 136 13.229 -15.905 -7.240 1012 HB2 ALA 136 1HB ALA 136 11.941 -16.098 -6.019 1013 HB3 ALA 136 2HB ALA 136 13.650 -15.991 -5.504 1014 H ALA 137 H ALA 137 13.404 -12.894 -8.314 1015 HA ALA 137 HA ALA 137 16.231 -12.051 -7.475 1016 HB1 ALA 137 3HB ALA 137 15.080 -12.179 -10.341 1017 HB2 ALA 137 1HB ALA 137 16.185 -13.368 -9.602 1018 HB3 ALA 137 2HB ALA 137 16.718 -11.689 -9.878 1019 H GLU 138 H GLU 138 13.411 -10.421 -9.202 1020 HA GLU 138 HA GLU 138 14.062 -7.830 -8.510 1021 HB2 GLU 138 2HB GLU 138 11.393 -9.337 -8.793 1022 HB3 GLU 138 1HB GLU 138 11.430 -7.667 -8.375 1023 HG2 GLU 138 2HG GLU 138 11.062 -7.740 -10.707 1024 HG3 GLU 138 1HG GLU 138 12.616 -6.989 -10.438 1025 H TRP 139 H TRP 139 12.196 -9.884 -6.178 1026 HA TRP 139 HA TRP 139 13.248 -8.199 -3.865 1027 HD1 TRP 139 HD1 TRP 139 9.068 -10.257 -4.265 1028 HE1 TRP 139 HE1 TRP 139 7.487 -9.902 -6.413 1029 HE3 TRP 139 HE3 TRP 139 11.007 -5.804 -5.717 1030 HZ2 TRP 139 HZ2 TRP 139 7.529 -8.051 -8.517 1031 HZ3 TRP 139 HZ3 TRP 139 10.269 -4.813 -7.859 1032 HH2 TRP 139 HH2 TRP 139 8.572 -5.926 -9.252 1033 HB2 TRP 139 2HB TRP 139 10.777 -8.403 -2.811 1034 HB3 TRP 139 1HB TRP 139 11.324 -7.053 -3.746 1035 H GLU 140 H GLU 140 13.721 -9.187 -2.055 1036 HA GLU 140 HA GLU 140 13.089 -12.161 -1.740 1037 HB2 GLU 140 2HB GLU 140 15.153 -12.565 -0.929 1038 HB3 GLU 140 1HB GLU 140 15.544 -11.268 -2.002 1039 HG2 GLU 140 2HG GLU 140 15.562 -9.702 0.144 1040 HG3 GLU 140 1HG GLU 140 15.391 -11.189 1.081 1041 H LEU 141 H LEU 141 13.382 -12.519 0.979 1042 HA LEU 141 HA LEU 141 10.820 -11.171 1.986 1043 HG LEU 141 HG LEU 141 9.623 -14.399 3.456 1044 HB2 LEU 141 2HB LEU 141 11.236 -13.858 1.654 1045 HB3 LEU 141 1HB LEU 141 11.876 -13.699 3.256 1046 HD11 LEU 141 1HD1 LEU 141 10.034 -12.508 5.098 1047 HD12 LEU 141 2HD1 LEU 141 8.322 -12.665 4.629 1048 HD13 LEU 141 3HD1 LEU 141 9.316 -11.386 3.945 1049 HD21 LEU 141 3HD2 LEU 141 8.920 -13.833 1.079 1050 HD22 LEU 141 1HD2 LEU 141 8.629 -12.161 1.600 1051 HD23 LEU 141 2HD2 LEU 141 7.681 -13.488 2.296 1052 H ASP 142 H ASP 142 11.192 -9.627 3.538 1053 HA ASP 142 HA ASP 142 13.783 -9.432 5.070 1054 HB2 ASP 142 2HB ASP 142 12.495 -7.474 3.843 1055 HB3 ASP 142 1HB ASP 142 11.406 -7.497 5.211 1056 H ALA 143 H ALA 143 10.238 -9.620 5.856 1057 HA ALA 143 HA ALA 143 10.897 -11.331 8.278 1058 HB1 ALA 143 3HB ALA 143 9.336 -8.659 8.552 1059 HB2 ALA 143 1HB ALA 143 11.022 -8.909 9.059 1060 HB3 ALA 143 2HB ALA 143 9.709 -9.797 9.874 1061 H GLU 144 H GLU 144 9.543 -13.047 8.284 1062 HA GLU 144 HA GLU 144 6.584 -12.630 7.608 1063 HB2 GLU 144 2HB GLU 144 7.991 -14.262 6.223 1064 HB3 GLU 144 1HB GLU 144 7.980 -15.351 7.606 1065 HG2 GLU 144 2HG GLU 144 5.440 -15.401 7.545 1066 HG3 GLU 144 1HG GLU 144 5.435 -14.152 6.308 1067 H THR 145 H THR 145 5.186 -12.518 9.191 1068 HA THR 145 HA THR 145 5.457 -14.213 11.684 1069 HB THR 145 HB THR 145 6.692 -11.968 12.031 1070 HG1 THR 145 HG1 THR 145 4.651 -12.820 13.810 1071 HG21 THR 145 3HG2 THR 145 4.486 -10.573 13.338 1072 HG22 THR 145 1HG2 THR 145 4.100 -10.683 11.617 1073 HG23 THR 145 2HG2 THR 145 5.626 -9.952 12.138 1074 H ASP 146 H ASP 146 3.560 -14.695 12.869 1075 HA ASP 146 HA ASP 146 1.027 -14.282 11.475 1076 HB2 ASP 146 2HB ASP 146 0.094 -15.782 13.162 1077 HB3 ASP 146 1HB ASP 146 1.538 -16.406 12.403 1078 H HIS 147 H HIS 147 -0.872 -13.378 12.113 1079 HA HIS 147 HA HIS 147 -0.978 -11.309 14.343 1080 HD1 HIS 147 HD1 HIS 147 1.584 -10.632 12.996 1081 HD2 HIS 147 HD2 HIS 147 -1.238 -7.480 12.793 1082 HE1 HIS 147 HE1 HIS 147 2.806 -8.360 13.174 1083 HB2 HIS 147 2HB HIS 147 -1.014 -10.767 11.319 1084 HB3 HIS 147 1HB HIS 147 -2.177 -9.885 12.270 1085 H GLU 148 H GLU 148 -3.385 -10.324 14.287 1086 HA GLU 148 HA GLU 148 -4.885 -12.555 15.331 1087 HB2 GLU 148 2HB GLU 148 -6.002 -9.759 14.767 1088 HB3 GLU 148 1HB GLU 148 -6.762 -10.949 15.764 1089 HG2 GLU 148 2HG GLU 148 -4.887 -10.817 17.452 1090 HG3 GLU 148 1HG GLU 148 -4.049 -9.635 16.470 1091 H GLY 149 H GLY 149 -5.713 -10.790 12.312 1092 HA2 GLY 149 2HA GLY 149 -7.676 -13.070 11.527 1093 HA3 GLY 149 1HA GLY 149 -7.715 -11.477 10.839 1094 H PHE 150 H PHE 150 -4.460 -12.873 11.050 1095 HA PHE 150 HA PHE 150 -4.270 -13.687 8.227 1096 HD1 PHE 150 HD1 PHE 150 -1.567 -10.432 8.167 1097 HD2 PHE 150 HD2 PHE 150 -5.581 -9.728 9.465 1098 HE1 PHE 150 HE1 PHE 150 -0.821 -8.389 9.325 1099 HE2 PHE 150 HE2 PHE 150 -4.842 -7.722 10.667 1100 HZ PHE 150 HZ PHE 150 -2.476 -7.030 10.609 1101 HB2 PHE 150 2HB PHE 150 -3.551 -11.605 7.119 1102 HB3 PHE 150 1HB PHE 150 -5.126 -11.416 7.768 1103 H THR 151 H THR 151 -2.091 -13.420 7.196 1104 HA THR 151 HA THR 151 0.172 -13.477 9.279 1105 HB THR 151 HB THR 151 1.397 -15.039 8.325 1106 HG1 THR 151 HG1 THR 151 1.923 -14.293 6.405 1107 HG21 THR 151 3HG2 THR 151 -0.962 -16.124 8.573 1108 HG22 THR 151 1HG2 THR 151 0.183 -16.956 7.491 1109 HG23 THR 151 2HG2 THR 151 -1.115 -15.953 6.814 1110 H LEU 152 H LEU 152 1.563 -11.900 9.296 1111 HA LEU 152 HA LEU 152 1.551 -9.650 7.284 1112 HG LEU 152 HG LEU 152 3.279 -7.730 10.159 1113 HB2 LEU 152 2HB LEU 152 1.489 -9.070 9.605 1114 HB3 LEU 152 1HB LEU 152 2.774 -10.153 10.032 1115 HD11 LEU 152 1HD1 LEU 152 5.114 -9.572 9.848 1116 HD12 LEU 152 2HD1 LEU 152 5.583 -7.899 9.505 1117 HD13 LEU 152 3HD1 LEU 152 5.238 -9.018 8.179 1118 HD21 LEU 152 3HD2 LEU 152 3.844 -6.429 8.099 1119 HD22 LEU 152 1HD2 LEU 152 2.126 -6.873 8.135 1120 HD23 LEU 152 2HD2 LEU 152 3.244 -7.736 7.065 1121 H GLN 153 H GLN 153 2.885 -9.638 5.596 1122 HA GLN 153 HA GLN 153 5.631 -11.060 5.699 1123 HB2 GLN 153 2HB GLN 153 3.570 -10.932 3.452 1124 HB3 GLN 153 1HB GLN 153 5.238 -10.699 2.976 1125 HG2 GLN 153 2HG GLN 153 5.925 -12.908 3.957 1126 HG3 GLN 153 1HG GLN 153 4.286 -13.200 4.534 1127 HE21 GLN 153 1HE2 GLN 153 2.784 -12.564 2.502 1128 HE22 GLN 153 2HE2 GLN 153 3.288 -13.419 0.967 1129 H GLU 154 H GLU 154 7.195 -9.606 5.817 1130 HA GLU 154 HA GLU 154 7.020 -6.908 4.364 1131 HB2 GLU 154 2HB GLU 154 9.261 -7.689 6.273 1132 HB3 GLU 154 1HB GLU 154 8.920 -6.135 5.584 1133 HG2 GLU 154 2HG GLU 154 6.623 -6.257 6.892 1134 HG3 GLU 154 1HG GLU 154 7.344 -7.581 7.784 1135 H TRP 155 H TRP 155 7.697 -7.168 2.242 1136 HA TRP 155 HA TRP 155 10.037 -9.017 1.558 1137 HD1 TRP 155 HD1 TRP 155 5.957 -9.148 1.088 1138 HE1 TRP 155 HE1 TRP 155 5.040 -11.532 0.361 1139 HE3 TRP 155 HE3 TRP 155 10.014 -10.505 -1.674 1140 HZ2 TRP 155 HZ2 TRP 155 6.024 -13.530 -1.371 1141 HZ3 TRP 155 HZ3 TRP 155 9.959 -12.664 -2.894 1142 HH2 TRP 155 HH2 TRP 155 7.984 -14.125 -2.775 1143 HB2 TRP 155 2HB TRP 155 7.885 -7.568 -0.048 1144 HB3 TRP 155 1HB TRP 155 9.198 -8.351 -0.873 1145 H VAL 156 H VAL 156 12.132 -8.198 1.116 1146 HA VAL 156 HA VAL 156 12.396 -5.184 0.578 1147 HB VAL 156 HB VAL 156 13.504 -5.910 2.646 1148 HG11 VAL 156 1HG1 VAL 156 15.415 -7.499 0.831 1149 HG12 VAL 156 2HG1 VAL 156 14.331 -8.168 2.064 1150 HG13 VAL 156 3HG1 VAL 156 15.705 -7.152 2.557 1151 HG21 VAL 156 3HG2 VAL 156 15.572 -4.612 2.352 1152 HG22 VAL 156 1HG2 VAL 156 14.298 -3.834 1.382 1153 HG23 VAL 156 2HG2 VAL 156 15.520 -4.829 0.585 1154 H ARG 157 H ARG 157 13.093 -4.410 -1.272 1155 HA ARG 157 HA ARG 157 13.688 -5.864 -3.687 1156 HE ARG 157 HE ARG 157 14.725 -2.771 -7.049 1157 HB2 ARG 157 2HB ARG 157 13.961 -3.025 -2.695 1158 HB3 ARG 157 1HB ARG 157 15.189 -3.439 -3.856 1159 HG2 ARG 157 2HG ARG 157 13.232 -4.394 -5.385 1160 HG3 ARG 157 1HG ARG 157 12.149 -3.596 -4.251 1161 HD2 ARG 157 2HD ARG 157 12.477 -2.105 -6.155 1162 HD3 ARG 157 1HD ARG 157 13.248 -1.371 -4.790 1163 HH11 ARG 157 2HH1 ARG 157 14.850 -0.548 -4.337 1164 HH12 ARG 157 1HH1 ARG 157 16.578 -0.141 -4.631 1165 HH21 ARG 157 1HH2 ARG 157 16.702 -2.439 -7.236 1166 HH22 ARG 157 2HH2 ARG 157 17.634 -1.258 -6.189 1167 H SER 158 H SER 158 15.427 -6.308 -4.894 1168 HA SER 158 HA SER 158 17.163 -8.089 -3.868 1169 HG SER 158 HG SER 158 18.356 -5.619 -5.865 1170 HB2 SER 158 2HB SER 158 18.269 -8.100 -6.085 1171 HB3 SER 158 1HB SER 158 16.556 -7.759 -6.271 1172 H ALA 159 H ALA 159 18.712 -7.978 -2.354 1173 HA ALA 159 HA ALA 159 20.528 -5.715 -1.916 1174 HB1 ALA 159 3HB ALA 159 20.444 -8.594 -0.788 1175 HB2 ALA 159 1HB ALA 159 19.673 -7.137 -0.115 1176 HB3 ALA 159 2HB ALA 159 21.453 -7.279 -0.136 1177 H SER 160 H SER 160 21.223 -5.702 -4.117 1178 HA SER 160 HA SER 160 23.003 -5.561 -5.663 1179 HG SER 160 HG SER 160 23.946 -7.859 -3.393 1180 HB2 SER 160 2HB SER 160 25.291 -6.312 -5.307 1181 HB3 SER 160 1HB SER 160 24.657 -5.487 -3.877 1182 H SER 161 H SER 161 22.319 -8.832 -4.613 1183 HA SER 161 HA SER 161 21.433 -9.984 -6.927 1184 HG SER 161 HG SER 161 23.248 -8.650 -8.182 1185 HB2 SER 161 2HB SER 161 24.490 -10.504 -6.991 1186 HB3 SER 161 1HB SER 161 23.298 -11.447 -7.885 1187 H ARG 162 H ARG 162 23.722 -10.747 -4.335 1188 HA ARG 162 HA ARG 162 21.814 -12.778 -3.248 1189 HE ARG 162 HE ARG 162 22.639 -17.644 -2.516 1190 HB2 ARG 162 1HB ARG 162 23.283 -14.010 -5.019 1191 HB3 ARG 162 2HB ARG 162 24.670 -13.742 -3.965 1192 HG2 ARG 162 1HG ARG 162 23.642 -15.129 -2.172 1193 HG3 ARG 162 2HG ARG 162 22.109 -15.221 -3.050 1194 HD2 ARG 162 1HD ARG 162 23.321 -16.373 -5.010 1195 HD3 ARG 162 2HD ARG 162 24.819 -16.343 -4.062 1196 HH11 ARG 162 2HH1 ARG 162 24.787 -18.343 -5.232 1197 HH12 ARG 162 1HH1 ARG 162 24.683 -20.129 -4.859 1198 HH21 ARG 162 1HH2 ARG 162 22.635 -19.758 -2.181 1199 HH22 ARG 162 2HH2 ARG 162 23.589 -20.825 -3.303 Start of MODEL 3 1 HA MET 1 HA MET 1 15.898 5.284 2.646 2 H1 MET 1 1H MET 1 15.152 5.816 4.977 3 H2 MET 1 2H MET 1 14.515 6.978 3.968 4 H3 MET 1 3H MET 1 13.579 5.792 4.490 5 HB2 MET 1 1HB MET 1 13.520 3.494 3.510 6 HB3 MET 1 2HB MET 1 14.693 3.057 2.339 7 HG2 MET 1 1HG MET 1 15.285 3.426 5.356 8 HG3 MET 1 2HG MET 1 15.204 1.926 4.437 9 HE1 MET 1 3HE MET 1 17.514 1.250 5.480 10 HE2 MET 1 1HE MET 1 17.685 2.831 6.307 11 HE3 MET 1 2HE MET 1 19.018 2.198 5.293 12 H GLU 2 H GLU 2 14.315 4.190 0.503 13 HA GLU 2 HA GLU 2 12.207 6.313 -0.053 14 HB2 GLU 2 2HB GLU 2 12.030 5.339 -2.262 15 HB3 GLU 2 1HB GLU 2 13.582 6.010 -1.893 16 HG2 GLU 2 2HG GLU 2 13.432 2.999 -1.529 17 HG3 GLU 2 1HG GLU 2 13.182 3.560 -3.175 18 H LEU 3 H LEU 3 10.577 4.061 -1.429 19 HA LEU 3 HA LEU 3 8.824 3.997 1.065 20 HG LEU 3 HG LEU 3 8.905 6.008 -2.098 21 HB2 LEU 3 2HB LEU 3 6.844 4.345 -0.548 22 HB3 LEU 3 1HB LEU 3 7.871 5.634 -0.030 23 HD11 LEU 3 1HD1 LEU 3 7.517 3.521 -3.356 24 HD12 LEU 3 2HD1 LEU 3 9.221 3.543 -2.862 25 HD13 LEU 3 3HD1 LEU 3 8.684 4.631 -4.126 26 HD21 LEU 3 3HD2 LEU 3 6.810 6.418 -3.560 27 HD22 LEU 3 1HD2 LEU 3 6.632 6.935 -1.873 28 HD23 LEU 3 2HD2 LEU 3 5.889 5.412 -2.421 29 H VAL 4 H VAL 4 7.290 2.608 1.530 30 HA VAL 4 HA VAL 4 7.647 -0.203 0.378 31 HB VAL 4 HB VAL 4 7.208 0.775 3.215 32 HG11 VAL 4 1HG1 VAL 4 6.192 -1.484 3.052 33 HG12 VAL 4 2HG1 VAL 4 7.702 -1.604 4.000 34 HG13 VAL 4 3HG1 VAL 4 7.643 -2.129 2.314 35 HG21 VAL 4 3HG2 VAL 4 9.825 -0.391 2.129 36 HG22 VAL 4 1HG2 VAL 4 9.470 0.017 3.827 37 HG23 VAL 4 2HG2 VAL 4 9.519 1.280 2.602 38 H SER 5 H SER 5 5.852 -1.353 -0.250 39 HA SER 5 HA SER 5 3.161 0.008 -0.094 40 HG SER 5 HG SER 5 3.834 -3.310 -1.087 41 HB2 SER 5 2HB SER 5 2.634 -1.525 -1.944 42 HB3 SER 5 1HB SER 5 4.172 -0.716 -2.223 43 H VAL 6 H VAL 6 1.371 -0.603 0.988 44 HA VAL 6 HA VAL 6 1.478 -3.097 2.697 45 HB VAL 6 HB VAL 6 1.400 -2.249 4.712 46 HG11 VAL 6 1HG1 VAL 6 3.517 -1.202 3.793 47 HG12 VAL 6 2HG1 VAL 6 2.838 -0.272 5.138 48 HG13 VAL 6 3HG1 VAL 6 2.632 0.282 3.480 49 HG21 VAL 6 3HG2 VAL 6 0.539 -0.142 5.629 50 HG22 VAL 6 1HG2 VAL 6 -0.729 -0.967 4.735 51 HG23 VAL 6 2HG2 VAL 6 0.108 0.422 4.006 52 H ALA 7 H ALA 7 0.123 -3.980 1.036 53 HA ALA 7 HA ALA 7 -2.854 -3.235 1.272 54 HB1 ALA 7 3HB ALA 7 -2.001 -3.450 -1.050 55 HB2 ALA 7 1HB ALA 7 -3.135 -4.759 -0.735 56 HB3 ALA 7 2HB ALA 7 -1.386 -5.091 -0.728 57 H ALA 8 H ALA 8 -4.455 -4.672 2.017 58 HA ALA 8 HA ALA 8 -3.588 -7.435 3.040 59 HB1 ALA 8 3HB ALA 8 -4.402 -5.828 4.810 60 HB2 ALA 8 1HB ALA 8 -5.409 -7.267 4.640 61 HB3 ALA 8 2HB ALA 8 -5.970 -5.720 3.984 62 H LEU 9 H LEU 9 -4.501 -9.278 2.303 63 HA LEU 9 HA LEU 9 -6.869 -9.307 0.515 64 HG LEU 9 HG LEU 9 -3.621 -9.397 -2.289 65 HB2 LEU 9 2HB LEU 9 -5.768 -9.846 -1.579 66 HB3 LEU 9 1HB LEU 9 -5.476 -8.252 -1.040 67 HD11 LEU 9 1HD1 LEU 9 -1.767 -8.356 -0.946 68 HD12 LEU 9 2HD1 LEU 9 -2.818 -8.239 0.457 69 HD13 LEU 9 3HD1 LEU 9 -3.170 -7.309 -1.015 70 HD21 LEU 9 3HD2 LEU 9 -2.987 -10.906 0.313 71 HD22 LEU 9 1HD2 LEU 9 -2.079 -10.948 -1.212 72 HD23 LEU 9 2HD2 LEU 9 -3.709 -11.648 -1.154 73 H ALA 10 H ALA 10 -7.480 -11.264 -0.487 74 HA ALA 10 HA ALA 10 -6.681 -13.768 1.132 75 HB1 ALA 10 3HB ALA 10 -8.718 -12.443 1.901 76 HB2 ALA 10 1HB ALA 10 -9.167 -14.050 1.357 77 HB3 ALA 10 2HB ALA 10 -9.448 -12.669 0.287 78 H GLU 11 H GLU 11 -9.084 -15.074 -0.463 79 HA GLU 11 HA GLU 11 -7.602 -16.450 -2.556 80 HB2 GLU 11 2HB GLU 11 -9.591 -17.480 -1.568 81 HB3 GLU 11 1HB GLU 11 -10.650 -16.260 -2.258 82 HG2 GLU 11 2HG GLU 11 -10.142 -17.070 -4.585 83 HG3 GLU 11 1HG GLU 11 -8.949 -18.208 -3.959 84 H ASN 12 H ASN 12 -8.133 -16.383 -4.851 85 HA ASN 12 HA ASN 12 -7.165 -15.214 -6.707 86 HB2 ASN 12 2HB ASN 12 -9.950 -14.161 -6.116 87 HB3 ASN 12 1HB ASN 12 -9.037 -13.073 -7.084 88 HD21 ASN 12 1HD2 ASN 12 -11.278 -15.102 -7.594 89 HD22 ASN 12 2HD2 ASN 12 -10.719 -15.758 -9.214 90 H ARG 13 H ARG 13 -6.226 -13.993 -4.056 91 HA ARG 13 HA ARG 13 -5.114 -12.157 -3.207 92 HE ARG 13 HE ARG 13 -2.638 -11.822 -8.960 93 HB2 ARG 13 2HB ARG 13 -3.238 -11.206 -4.462 94 HB3 ARG 13 1HB ARG 13 -3.276 -12.955 -4.397 95 HG2 ARG 13 2HG ARG 13 -4.123 -13.066 -6.760 96 HG3 ARG 13 1HG ARG 13 -4.127 -11.302 -6.881 97 HD2 ARG 13 2HD ARG 13 -1.646 -11.283 -6.649 98 HD3 ARG 13 1HD ARG 13 -1.604 -12.992 -6.283 99 HH11 ARG 13 2HH1 ARG 13 -0.455 -13.947 -7.337 100 HH12 ARG 13 1HH1 ARG 13 0.114 -14.693 -8.914 101 HH21 ARG 13 1HH2 ARG 13 -1.967 -12.665 -10.725 102 HH22 ARG 13 2HH2 ARG 13 -0.645 -13.877 -10.769 103 H VAL 14 H VAL 14 -7.475 -11.554 -3.377 104 HA VAL 14 HA VAL 14 -8.058 -9.025 -4.834 105 HB VAL 14 HB VAL 14 -9.604 -11.038 -3.111 106 HG11 VAL 14 1HG1 VAL 14 -11.710 -9.880 -3.347 107 HG12 VAL 14 2HG1 VAL 14 -10.936 -8.421 -4.051 108 HG13 VAL 14 3HG1 VAL 14 -10.635 -8.899 -2.358 109 HG21 VAL 14 3HG2 VAL 14 -9.145 -11.390 -5.603 110 HG22 VAL 14 1HG2 VAL 14 -10.069 -9.924 -5.985 111 HG23 VAL 14 2HG2 VAL 14 -10.879 -11.328 -5.212 112 H ILE 15 H ILE 15 -7.209 -7.156 -4.144 113 HA ILE 15 HA ILE 15 -6.679 -6.350 -1.341 114 HB ILE 15 HB ILE 15 -7.267 -4.403 -3.623 115 HG12 ILE 15 2HG1 ILE 15 -4.326 -4.726 -3.030 116 HG13 ILE 15 1HG1 ILE 15 -5.026 -6.182 -3.651 117 HG21 ILE 15 1HG2 ILE 15 -6.177 -2.642 -2.416 118 HG22 ILE 15 2HG2 ILE 15 -5.394 -3.731 -1.258 119 HG23 ILE 15 3HG2 ILE 15 -7.122 -3.422 -1.169 120 HD11 ILE 15 3HD1 ILE 15 -5.360 -3.439 -5.043 121 HD12 ILE 15 1HD1 ILE 15 -5.887 -4.998 -5.690 122 HD13 ILE 15 2HD1 ILE 15 -4.164 -4.656 -5.509 123 H GLY 16 H GLY 16 -9.538 -5.682 -3.385 124 HA2 GLY 16 2HA GLY 16 -11.074 -4.669 -0.976 125 HA3 GLY 16 1HA GLY 16 -10.752 -3.441 -2.193 126 H ARG 17 H ARG 17 -13.219 -4.164 -1.466 127 HA ARG 17 HA ARG 17 -14.427 -5.356 -3.986 128 HE ARG 17 HE ARG 17 -16.416 -9.936 -4.343 129 HB2 ARG 17 2HB ARG 17 -14.092 -7.177 -2.236 130 HB3 ARG 17 1HB ARG 17 -15.279 -6.380 -1.197 131 HG2 ARG 17 2HG ARG 17 -17.061 -6.769 -2.862 132 HG3 ARG 17 1HG ARG 17 -15.905 -7.251 -4.097 133 HD2 ARG 17 2HD ARG 17 -15.191 -9.201 -2.387 134 HD3 ARG 17 1HD ARG 17 -16.655 -8.823 -1.500 135 HH11 ARG 17 2HH1 ARG 17 -18.640 -8.547 -2.109 136 HH12 ARG 17 1HH1 ARG 17 -20.085 -9.131 -3.056 137 HH21 ARG 17 1HH2 ARG 17 -17.978 -10.585 -5.364 138 HH22 ARG 17 2HH2 ARG 17 -19.702 -10.260 -4.873 139 H ASP 18 H ASP 18 -15.361 -3.720 -0.922 140 HA ASP 18 HA ASP 18 -17.242 -1.964 -2.566 141 HB2 ASP 18 2HB ASP 18 -17.885 -3.062 -0.255 142 HB3 ASP 18 1HB ASP 18 -16.921 -1.800 0.477 143 H GLY 19 H GLY 19 -14.748 -1.220 -0.060 144 HA2 GLY 19 2HA GLY 19 -13.442 0.734 -2.080 145 HA3 GLY 19 1HA GLY 19 -13.854 1.279 -0.479 146 H GLU 20 H GLU 20 -12.361 0.654 1.260 147 HA GLU 20 HA GLU 20 -9.636 0.088 0.493 148 HB2 GLU 20 2HB GLU 20 -9.047 -0.026 2.852 149 HB3 GLU 20 1HB GLU 20 -9.969 1.397 2.473 150 HG2 GLU 20 2HG GLU 20 -11.961 0.583 3.677 151 HG3 GLU 20 1HG GLU 20 -11.350 -1.068 3.745 152 H LEU 21 H LEU 21 -11.762 -2.205 2.212 153 HA LEU 21 HA LEU 21 -10.340 -4.517 1.039 154 HG LEU 21 HG LEU 21 -9.628 -2.415 3.980 155 HB2 LEU 21 2HB LEU 21 -9.545 -5.426 3.295 156 HB3 LEU 21 1HB LEU 21 -8.670 -4.181 2.442 157 HD11 LEU 21 1HD1 LEU 21 -10.631 -4.897 5.510 158 HD12 LEU 21 2HD1 LEU 21 -11.609 -3.538 4.932 159 HD13 LEU 21 3HD1 LEU 21 -10.461 -3.291 6.264 160 HD21 LEU 21 3HD2 LEU 21 -7.913 -4.473 5.437 161 HD22 LEU 21 1HD2 LEU 21 -7.964 -2.715 5.656 162 HD23 LEU 21 2HD2 LEU 21 -7.298 -3.393 4.166 163 HA PRO 22 HA PRO 22 -14.351 -6.222 1.259 164 HB2 PRO 22 2HB PRO 22 -13.320 -9.060 1.447 165 HB3 PRO 22 1HB PRO 22 -14.239 -8.282 0.154 166 HG2 PRO 22 2HG PRO 22 -11.538 -8.873 -0.097 167 HG3 PRO 22 1HG PRO 22 -12.214 -7.423 -0.867 168 HD2 PRO 22 2HD PRO 22 -10.674 -7.572 1.761 169 HD3 PRO 22 1HD PRO 22 -10.554 -6.447 0.414 170 H TRP 23 H TRP 23 -12.526 -7.178 3.950 171 HA TRP 23 HA TRP 23 -14.969 -7.998 5.592 172 HD1 TRP 23 HD1 TRP 23 -11.635 -6.768 8.207 173 HE1 TRP 23 HE1 TRP 23 -9.204 -5.975 7.413 174 HE3 TRP 23 HE3 TRP 23 -11.324 -9.671 4.088 175 HZ2 TRP 23 HZ2 TRP 23 -7.518 -6.712 5.398 176 HZ3 TRP 23 HZ3 TRP 23 -9.317 -9.488 2.638 177 HH2 TRP 23 HH2 TRP 23 -7.499 -7.954 3.238 178 HB2 TRP 23 2HB TRP 23 -13.421 -8.816 7.336 179 HB3 TRP 23 1HB TRP 23 -13.034 -9.570 5.822 180 HA PRO 24 HA PRO 24 -15.217 -3.941 7.319 181 HB2 PRO 24 2HB PRO 24 -15.162 -4.743 10.227 182 HB3 PRO 24 1HB PRO 24 -16.456 -4.009 9.274 183 HG2 PRO 24 2HG PRO 24 -16.582 -6.667 10.033 184 HG3 PRO 24 1HG PRO 24 -17.203 -6.148 8.450 185 HD2 PRO 24 2HD PRO 24 -14.480 -7.417 9.039 186 HD3 PRO 24 1HD PRO 24 -15.660 -7.821 7.759 187 H SER 25 H SER 25 -12.796 -5.418 9.398 188 HA SER 25 HA SER 25 -10.472 -4.309 8.990 189 HG SER 25 HG SER 25 -11.617 -1.799 7.997 190 HB2 SER 25 2HB SER 25 -11.894 -1.905 10.269 191 HB3 SER 25 1HB SER 25 -10.147 -2.120 10.424 192 H ILE 26 H ILE 26 -9.552 -5.823 10.269 193 HA ILE 26 HA ILE 26 -10.375 -6.212 13.095 194 HB ILE 26 HB ILE 26 -8.166 -7.613 13.319 195 HG12 ILE 26 2HG1 ILE 26 -7.294 -6.901 11.019 196 HG13 ILE 26 1HG1 ILE 26 -7.083 -8.548 11.576 197 HG21 ILE 26 1HG2 ILE 26 -10.381 -8.608 13.614 198 HG22 ILE 26 2HG2 ILE 26 -9.291 -9.673 12.720 199 HG23 ILE 26 3HG2 ILE 26 -10.561 -8.786 11.852 200 HD11 ILE 26 3HD1 ILE 26 -9.281 -7.718 9.590 201 HD12 ILE 26 1HD1 ILE 26 -8.882 -9.377 10.060 202 HD13 ILE 26 2HD1 ILE 26 -7.722 -8.421 9.127 203 HA PRO 27 HA PRO 27 -7.604 -3.270 15.203 204 HB2 PRO 27 2HB PRO 27 -7.295 -5.493 17.289 205 HB3 PRO 27 1HB PRO 27 -7.623 -3.757 17.515 206 HG2 PRO 27 2HG PRO 27 -9.714 -5.485 17.689 207 HG3 PRO 27 1HG PRO 27 -9.931 -4.022 16.692 208 HD2 PRO 27 2HD PRO 27 -9.178 -6.824 15.665 209 HD3 PRO 27 1HD PRO 27 -10.496 -5.730 15.124 210 H ALA 28 H ALA 28 -6.188 -6.479 14.604 211 HA ALA 28 HA ALA 28 -3.372 -5.450 14.836 212 HB1 ALA 28 3HB ALA 28 -3.599 -7.837 15.207 213 HB2 ALA 28 1HB ALA 28 -2.742 -7.611 13.686 214 HB3 ALA 28 2HB ALA 28 -4.448 -8.056 13.634 215 H ASP 29 H ASP 29 -5.724 -5.459 12.234 216 HA ASP 29 HA ASP 29 -3.800 -4.632 10.062 217 HB2 ASP 29 2HB ASP 29 -5.828 -5.905 9.517 218 HB3 ASP 29 1HB ASP 29 -6.884 -4.747 10.318 219 H LYS 30 H LYS 30 -6.561 -2.778 11.225 220 HA LYS 30 HA LYS 30 -5.377 -0.303 10.926 221 HB2 LYS 30 2HB LYS 30 -7.895 -1.142 11.398 222 HB3 LYS 30 1HB LYS 30 -7.550 -0.518 12.983 223 HG2 LYS 30 2HG LYS 30 -8.650 1.236 11.864 224 HG3 LYS 30 1HG LYS 30 -6.976 1.747 11.822 225 HD2 LYS 30 2HD LYS 30 -8.089 2.314 9.773 226 HD3 LYS 30 1HD LYS 30 -6.850 1.149 9.371 227 HE2 LYS 30 2HE LYS 30 -8.391 -0.588 8.813 228 HE3 LYS 30 1HE LYS 30 -9.738 0.140 9.659 229 HZ1 LYS 30 3HZ LYS 30 -10.073 1.742 7.876 230 HZ2 LYS 30 1HZ LYS 30 -9.384 0.598 7.005 231 HZ3 LYS 30 2HZ LYS 30 -8.481 1.803 7.491 232 H LYS 31 H LYS 31 -4.298 -2.195 13.350 233 HA LYS 31 HA LYS 31 -2.740 0.044 14.755 234 HB2 LYS 31 2HB LYS 31 -3.637 -1.585 16.417 235 HB3 LYS 31 1HB LYS 31 -2.946 -2.902 15.501 236 HG2 LYS 31 2HG LYS 31 -1.618 -2.634 17.475 237 HG3 LYS 31 1HG LYS 31 -0.692 -2.408 16.015 238 HD2 LYS 31 2HD LYS 31 -0.893 0.159 16.372 239 HD3 LYS 31 1HD LYS 31 -1.623 -0.184 17.947 240 HE2 LYS 31 2HE LYS 31 0.417 -1.457 18.690 241 HE3 LYS 31 1HE LYS 31 1.134 -1.336 17.078 242 HZ1 LYS 31 3HZ LYS 31 1.966 0.446 18.712 243 HZ2 LYS 31 1HZ LYS 31 0.480 1.183 18.633 244 HZ3 LYS 31 2HZ LYS 31 1.418 1.017 17.288 245 H GLN 32 H GLN 32 -2.131 -2.882 12.624 246 HA GLN 32 HA GLN 32 0.829 -2.475 12.736 247 HB2 GLN 32 2HB GLN 32 0.040 -4.727 12.385 248 HB3 GLN 32 1HB GLN 32 -0.846 -4.286 10.941 249 HG2 GLN 32 2HG GLN 32 2.204 -3.800 11.021 250 HG3 GLN 32 1HG GLN 32 1.636 -5.442 10.853 251 HE21 GLN 32 1HE2 GLN 32 -0.139 -5.637 9.031 252 HE22 GLN 32 2HE2 GLN 32 0.386 -4.838 7.470 253 H TYR 33 H TYR 33 -1.736 -1.778 10.297 254 HA TYR 33 HA TYR 33 -0.133 -0.029 8.625 255 HD1 TYR 33 HD1 TYR 33 -3.823 0.876 10.405 256 HD2 TYR 33 HD2 TYR 33 -2.591 2.017 6.486 257 HE1 TYR 33 HE1 TYR 33 -5.297 2.822 10.531 258 HE2 TYR 33 HE2 TYR 33 -3.991 4.048 6.642 259 HH TYR 33 HH TYR 33 -5.412 5.371 8.110 260 HB2 TYR 33 2HB TYR 33 -2.004 -0.295 7.439 261 HB3 TYR 33 1HB TYR 33 -2.933 -0.834 8.780 262 H ARG 34 H ARG 34 -1.797 0.933 11.717 263 HA ARG 34 HA ARG 34 -0.763 3.728 11.343 264 HE ARG 34 HE ARG 34 -5.579 4.565 11.979 265 HB2 ARG 34 2HB ARG 34 -2.032 2.470 13.840 266 HB3 ARG 34 1HB ARG 34 -1.402 4.122 13.798 267 HG2 ARG 34 2HG ARG 34 -2.954 4.669 11.817 268 HG3 ARG 34 1HG ARG 34 -3.591 3.038 11.983 269 HD2 ARG 34 2HD ARG 34 -4.170 3.584 14.434 270 HD3 ARG 34 1HD ARG 34 -3.759 5.290 14.075 271 HH11 ARG 34 2HH1 ARG 34 -5.793 4.605 15.424 272 HH12 ARG 34 1HH1 ARG 34 -7.618 4.611 15.408 273 HH21 ARG 34 1HH2 ARG 34 -7.641 4.581 11.953 274 HH22 ARG 34 2HH2 ARG 34 -8.624 4.580 13.469 275 H SER 35 H SER 35 0.703 1.039 13.082 276 HA SER 35 HA SER 35 3.006 2.923 13.915 277 HG SER 35 HG SER 35 1.670 2.492 15.492 278 HB2 SER 35 2HB SER 35 2.495 0.044 14.777 279 HB3 SER 35 1HB SER 35 3.909 1.026 15.206 280 H ARG 36 H ARG 36 2.176 1.213 11.342 281 HA ARG 36 HA ARG 36 4.974 1.315 10.112 282 HE ARG 36 HE ARG 36 3.798 -2.640 8.636 283 HB2 ARG 36 2HB ARG 36 3.134 -0.599 9.782 284 HB3 ARG 36 1HB ARG 36 2.215 0.598 8.902 285 HG2 ARG 36 2HG ARG 36 3.268 -0.618 7.230 286 HG3 ARG 36 1HG ARG 36 4.248 0.818 7.352 287 HD2 ARG 36 2HD ARG 36 5.727 -1.132 7.176 288 HD3 ARG 36 1HD ARG 36 5.927 -0.486 8.800 289 HH11 ARG 36 2HH1 ARG 36 7.179 -2.314 8.541 290 HH12 ARG 36 1HH1 ARG 36 7.402 -4.085 8.878 291 HH21 ARG 36 1HH2 ARG 36 4.132 -4.592 9.102 292 HH22 ARG 36 2HH2 ARG 36 5.869 -5.225 9.259 293 H VAL 37 H VAL 37 1.655 2.658 9.268 294 HA VAL 37 HA VAL 37 3.062 4.866 7.779 295 HB VAL 37 HB VAL 37 1.527 4.855 6.203 296 HG11 VAL 37 1HG1 VAL 37 0.909 1.950 6.978 297 HG12 VAL 37 2HG1 VAL 37 2.436 2.463 6.248 298 HG13 VAL 37 3HG1 VAL 37 0.923 2.639 5.326 299 HG21 VAL 37 3HG2 VAL 37 -0.725 3.860 8.018 300 HG22 VAL 37 1HG2 VAL 37 -0.907 3.969 6.256 301 HG23 VAL 37 2HG2 VAL 37 -0.576 5.421 7.216 302 H ALA 38 H ALA 38 1.381 5.003 10.769 303 HA ALA 38 HA ALA 38 -0.259 7.412 10.174 304 HB1 ALA 38 3HB ALA 38 -0.679 7.635 12.539 305 HB2 ALA 38 1HB ALA 38 0.569 6.431 12.921 306 HB3 ALA 38 2HB ALA 38 -0.896 5.951 12.024 307 H ASP 39 H ASP 39 3.048 7.071 11.193 308 HA ASP 39 HA ASP 39 3.574 10.035 11.386 309 HB2 ASP 39 2HB ASP 39 4.968 7.534 12.281 310 HB3 ASP 39 1HB ASP 39 6.030 8.534 11.358 311 H ASP 40 H ASP 40 4.483 7.365 9.095 312 HA ASP 40 HA ASP 40 5.640 9.227 7.187 313 HB2 ASP 40 2HB ASP 40 5.210 6.227 7.415 314 HB3 ASP 40 1HB ASP 40 5.600 6.844 5.846 315 HA PRO 41 HA PRO 41 2.172 10.196 4.212 316 HB2 PRO 41 2HB PRO 41 4.522 10.056 2.216 317 HB3 PRO 41 1HB PRO 41 3.206 11.222 2.262 318 HG2 PRO 41 2HG PRO 41 5.553 11.961 3.344 319 HG3 PRO 41 1HG PRO 41 4.129 12.208 4.376 320 HD2 PRO 41 2HD PRO 41 6.085 9.824 4.528 321 HD3 PRO 41 1HD PRO 41 5.458 10.883 5.831 322 H VAL 42 H VAL 42 0.791 9.062 2.840 323 HA VAL 42 HA VAL 42 1.764 6.369 1.762 324 HB VAL 42 HB VAL 42 -0.995 7.233 2.730 325 HG11 VAL 42 1HG1 VAL 42 -1.720 4.934 2.546 326 HG12 VAL 42 2HG1 VAL 42 -0.111 4.350 2.019 327 HG13 VAL 42 3HG1 VAL 42 -1.102 5.362 0.936 328 HG21 VAL 42 3HG2 VAL 42 1.325 5.638 3.999 329 HG22 VAL 42 1HG2 VAL 42 -0.340 5.291 4.501 330 HG23 VAL 42 2HG2 VAL 42 0.344 6.915 4.727 331 H VAL 43 H VAL 43 1.813 5.916 -0.312 332 HA VAL 43 HA VAL 43 0.368 7.660 -2.339 333 HB VAL 43 HB VAL 43 1.948 7.080 -3.998 334 HG11 VAL 43 1HG1 VAL 43 4.161 7.792 -3.075 335 HG12 VAL 43 2HG1 VAL 43 3.632 7.464 -1.422 336 HG13 VAL 43 3HG1 VAL 43 2.891 8.776 -2.314 337 HG21 VAL 43 3HG2 VAL 43 2.401 4.687 -3.646 338 HG22 VAL 43 1HG2 VAL 43 3.224 5.049 -2.082 339 HG23 VAL 43 2HG2 VAL 43 3.929 5.553 -3.615 340 H LEU 44 H LEU 44 -1.567 7.037 -3.048 341 HA LEU 44 HA LEU 44 -2.175 4.074 -3.486 342 HG LEU 44 HG LEU 44 -4.091 6.991 -2.130 343 HB2 LEU 44 2HB LEU 44 -4.068 4.112 -2.047 344 HB3 LEU 44 1HB LEU 44 -2.646 4.490 -1.163 345 HD11 LEU 44 1HD1 LEU 44 -5.494 5.002 -0.212 346 HD12 LEU 44 2HD1 LEU 44 -6.091 5.659 -1.747 347 HD13 LEU 44 3HD1 LEU 44 -5.936 6.724 -0.342 348 HD21 LEU 44 3HD2 LEU 44 -3.765 7.749 0.170 349 HD22 LEU 44 1HD2 LEU 44 -2.258 7.077 -0.469 350 HD23 LEU 44 2HD2 LEU 44 -3.246 6.151 0.719 351 H GLY 45 H GLY 45 -4.751 3.855 -3.978 352 HA2 GLY 45 2HA GLY 45 -4.848 5.066 -6.814 353 HA3 GLY 45 1HA GLY 45 -5.478 3.479 -6.373 354 H ARG 46 H ARG 46 -7.319 4.577 -7.637 355 HA ARG 46 HA ARG 46 -9.047 6.360 -5.862 356 HE ARG 46 HE ARG 46 -11.675 8.404 -7.509 357 HB2 ARG 46 2HB ARG 46 -9.449 5.739 -8.809 358 HB3 ARG 46 1HB ARG 46 -10.732 6.334 -7.813 359 HG2 ARG 46 2HG ARG 46 -8.028 7.790 -8.139 360 HG3 ARG 46 1HG ARG 46 -9.457 8.166 -9.076 361 HD2 ARG 46 2HD ARG 46 -9.248 8.511 -5.990 362 HD3 ARG 46 1HD ARG 46 -9.028 9.780 -7.193 363 HH11 ARG 46 2HH1 ARG 46 -10.097 10.826 -5.508 364 HH12 ARG 46 1HH1 ARG 46 -11.726 11.544 -5.113 365 HH21 ARG 46 1HH2 ARG 46 -13.423 9.177 -6.853 366 HH22 ARG 46 2HH2 ARG 46 -13.476 10.668 -5.811 367 H THR 47 H THR 47 -9.243 2.911 -7.011 368 HA THR 47 HA THR 47 -11.505 2.345 -5.406 369 HB THR 47 HB THR 47 -9.097 0.452 -5.702 370 HG1 THR 47 HG1 THR 47 -11.318 -0.024 -7.138 371 HG21 THR 47 3HG2 THR 47 -12.006 0.020 -4.736 372 HG22 THR 47 1HG2 THR 47 -10.502 -0.678 -4.108 373 HG23 THR 47 2HG2 THR 47 -11.180 -1.238 -5.651 374 H THR 48 H THR 48 -8.253 1.676 -3.965 375 HA THR 48 HA THR 48 -8.921 1.856 -1.218 376 HB THR 48 HB THR 48 -6.533 2.531 -0.794 377 HG1 THR 48 HG1 THR 48 -6.430 3.882 -2.609 378 HG21 THR 48 3HG2 THR 48 -6.633 0.321 -2.933 379 HG22 THR 48 1HG2 THR 48 -6.939 0.093 -1.191 380 HG23 THR 48 2HG2 THR 48 -5.361 0.658 -1.743 381 H PHE 49 H PHE 49 -8.478 4.748 -3.276 382 HA PHE 49 HA PHE 49 -8.474 6.628 -0.905 383 HD1 PHE 49 HD2 PHE 49 -10.193 9.342 -3.015 384 HD2 PHE 49 HD1 PHE 49 -6.165 8.898 -1.606 385 HE1 PHE 49 HE2 PHE 49 -10.296 11.589 -1.988 386 HE2 PHE 49 HE1 PHE 49 -6.212 11.226 -0.780 387 HZ PHE 49 HZ PHE 49 -8.295 12.501 -0.827 388 HB2 PHE 49 2HB PHE 49 -7.126 7.183 -2.978 389 HB3 PHE 49 1HB PHE 49 -8.615 7.443 -3.857 390 H GLU 50 H GLU 50 -10.826 5.620 -3.371 391 HA GLU 50 HA GLU 50 -12.954 7.453 -2.378 392 HB2 GLU 50 2HB GLU 50 -13.059 4.973 -4.200 393 HB3 GLU 50 1HB GLU 50 -14.487 5.859 -3.714 394 HG2 GLU 50 2HG GLU 50 -13.668 7.951 -4.761 395 HG3 GLU 50 1HG GLU 50 -12.068 7.269 -5.054 396 H SER 51 H SER 51 -11.826 4.297 -1.126 397 HA SER 51 HA SER 51 -13.650 4.692 1.248 398 HG SER 51 HG SER 51 -12.149 3.224 3.300 399 HB2 SER 51 2HB SER 51 -12.517 2.503 0.560 400 HB3 SER 51 1HB SER 51 -11.050 3.096 1.317 401 H MET 52 H MET 52 -10.101 5.312 0.816 402 HA MET 52 HA MET 52 -9.614 6.309 3.415 403 HB2 MET 52 2HB MET 52 -7.957 5.733 1.408 404 HB3 MET 52 1HB MET 52 -8.095 7.460 1.009 405 HG2 MET 52 2HG MET 52 -6.182 7.406 2.387 406 HG3 MET 52 1HG MET 52 -7.416 7.875 3.539 407 HE1 MET 52 3HE MET 52 -5.229 5.433 2.017 408 HE2 MET 52 1HE MET 52 -6.081 3.894 2.357 409 HE3 MET 52 2HE MET 52 -4.753 4.487 3.439 410 H ARG 53 H ARG 53 -10.909 8.233 0.931 411 HA ARG 53 HA ARG 53 -11.190 10.936 1.972 412 HE ARG 53 HE ARG 53 -16.585 11.316 0.121 413 HB2 ARG 53 2HB ARG 53 -11.970 9.860 -0.230 414 HB3 ARG 53 1HB ARG 53 -13.171 8.978 0.713 415 HG2 ARG 53 2HG ARG 53 -14.094 11.340 1.422 416 HG3 ARG 53 1HG ARG 53 -12.987 12.015 0.263 417 HD2 ARG 53 2HD ARG 53 -14.653 11.781 -1.296 418 HD3 ARG 53 1HD ARG 53 -14.234 10.093 -1.377 419 HH11 ARG 53 2HH1 ARG 53 -14.895 8.200 -0.222 420 HH12 ARG 53 1HH1 ARG 53 -15.985 7.573 1.084 421 HH21 ARG 53 1HH2 ARG 53 -17.651 10.393 1.588 422 HH22 ARG 53 2HH2 ARG 53 -17.244 8.680 2.012 423 H ASP 54 H ASP 54 -12.707 7.952 3.209 424 HA ASP 54 HA ASP 54 -14.291 9.449 5.298 425 HB2 ASP 54 2HB ASP 54 -14.488 6.568 4.252 426 HB3 ASP 54 1HB ASP 54 -15.276 7.093 5.724 427 H ASP 55 H ASP 55 -11.680 6.856 5.262 428 HA ASP 55 HA ASP 55 -10.813 8.141 7.866 429 HB2 ASP 55 2HB ASP 55 -10.419 6.439 9.145 430 HB3 ASP 55 1HB ASP 55 -11.899 5.963 8.364 431 H LEU 56 H LEU 56 -8.900 9.030 7.991 432 HA LEU 56 HA LEU 56 -7.211 8.990 5.618 433 HG LEU 56 HG LEU 56 -7.595 12.547 6.664 434 HB2 LEU 56 2HB LEU 56 -6.526 10.584 8.119 435 HB3 LEU 56 1HB LEU 56 -6.096 10.894 6.482 436 HD11 LEU 56 1HD1 LEU 56 -9.743 10.406 6.049 437 HD12 LEU 56 2HD1 LEU 56 -8.752 11.238 4.844 438 HD13 LEU 56 3HD1 LEU 56 -9.894 12.148 5.822 439 HD21 LEU 56 3HD2 LEU 56 -9.566 12.628 8.190 440 HD22 LEU 56 1HD2 LEU 56 -8.046 12.262 9.026 441 HD23 LEU 56 2HD2 LEU 56 -9.222 10.960 8.717 442 HA PRO 57 HA PRO 57 -3.919 6.266 7.223 443 HB2 PRO 57 2HB PRO 57 -2.174 6.266 5.197 444 HB3 PRO 57 1HB PRO 57 -3.855 5.811 4.983 445 HG2 PRO 57 2HG PRO 57 -2.531 8.446 4.196 446 HG3 PRO 57 1HG PRO 57 -3.750 7.503 3.299 447 HD2 PRO 57 2HD PRO 57 -4.256 9.720 5.070 448 HD3 PRO 57 1HD PRO 57 -5.482 8.593 4.417 449 H GLY 58 H GLY 58 -1.772 8.842 6.023 450 HA2 GLY 58 2HA GLY 58 -0.361 8.933 8.785 451 HA3 GLY 58 1HA GLY 58 0.540 8.966 7.285 452 H SER 59 H SER 59 1.358 10.986 8.513 453 HA SER 59 HA SER 59 0.177 13.502 8.217 454 HG SER 59 HG SER 59 3.411 14.984 7.594 455 HB2 SER 59 2HB SER 59 2.565 13.058 8.899 456 HB3 SER 59 1HB SER 59 3.002 12.801 7.208 457 H ALA 60 H ALA 60 0.575 11.464 5.399 458 HA ALA 60 HA ALA 60 -0.984 13.498 3.872 459 HB1 ALA 60 3HB ALA 60 1.202 14.373 3.384 460 HB2 ALA 60 1HB ALA 60 0.686 13.569 1.882 461 HB3 ALA 60 2HB ALA 60 1.878 12.795 2.959 462 H GLN 61 H GLN 61 -1.806 12.993 1.895 463 HA GLN 61 HA GLN 61 -2.324 10.014 1.329 464 HB2 GLN 61 2HB GLN 61 -4.028 11.860 2.599 465 HB3 GLN 61 1HB GLN 61 -4.480 12.135 0.939 466 HG2 GLN 61 2HG GLN 61 -5.102 9.718 0.660 467 HG3 GLN 61 1HG GLN 61 -4.535 9.369 2.260 468 HE21 GLN 61 1HE2 GLN 61 -5.656 11.079 3.959 469 HE22 GLN 61 2HE2 GLN 61 -7.468 10.789 3.807 470 H ILE 62 H ILE 62 -1.066 9.836 -0.474 471 HA ILE 62 HA ILE 62 -1.228 11.849 -2.760 472 HB ILE 62 HB ILE 62 0.692 9.613 -1.944 473 HG12 ILE 62 2HG1 ILE 62 1.500 12.439 -2.556 474 HG13 ILE 62 1HG1 ILE 62 0.704 12.149 -1.013 475 HG21 ILE 62 1HG2 ILE 62 2.141 10.163 -3.923 476 HG22 ILE 62 2HG2 ILE 62 0.815 11.192 -4.570 477 HG23 ILE 62 3HG2 ILE 62 0.616 9.425 -4.436 478 HD11 ILE 62 3HD1 ILE 62 3.104 12.112 -0.651 479 HD12 ILE 62 1HD1 ILE 62 3.386 10.995 -1.990 480 HD13 ILE 62 2HD1 ILE 62 2.577 10.433 -0.483 481 H VAL 63 H VAL 63 -2.758 11.388 -4.363 482 HA VAL 63 HA VAL 63 -3.179 8.502 -5.152 483 HB VAL 63 HB VAL 63 -4.697 10.942 -6.067 484 HG11 VAL 63 1HG1 VAL 63 -4.711 9.239 -7.959 485 HG12 VAL 63 2HG1 VAL 63 -6.300 9.245 -7.170 486 HG13 VAL 63 3HG1 VAL 63 -5.123 7.956 -6.812 487 HG21 VAL 63 3HG2 VAL 63 -5.190 10.166 -3.743 488 HG22 VAL 63 1HG2 VAL 63 -5.372 8.486 -4.284 489 HG23 VAL 63 2HG2 VAL 63 -6.575 9.723 -4.756 490 H MET 64 H MET 64 -1.922 7.494 -6.473 491 HA MET 64 HA MET 64 -0.448 8.830 -8.745 492 HB2 MET 64 2HB MET 64 -0.449 6.080 -7.388 493 HB3 MET 64 1HB MET 64 -0.023 6.116 -9.061 494 HG2 MET 64 2HG MET 64 1.545 8.289 -8.040 495 HG3 MET 64 1HG MET 64 1.558 7.105 -6.736 496 HE1 MET 64 3HE MET 64 2.183 7.982 -10.441 497 HE2 MET 64 1HE MET 64 1.394 6.431 -10.866 498 HE3 MET 64 2HE MET 64 3.161 6.611 -11.060 499 H SER 65 H SER 65 -2.023 9.670 -9.966 500 HA SER 65 HA SER 65 -3.245 7.852 -12.016 501 HG SER 65 HG SER 65 -6.079 7.361 -11.684 502 HB2 SER 65 2HB SER 65 -4.961 7.983 -10.017 503 HB3 SER 65 1HB SER 65 -5.214 9.663 -10.466 504 H ARG 66 H ARG 66 -4.942 9.729 -13.288 505 HA ARG 66 HA ARG 66 -3.212 12.235 -13.771 506 HE ARG 66 HE ARG 66 -0.660 8.451 -17.550 507 HB2 ARG 66 2HB ARG 66 -4.227 10.568 -16.145 508 HB3 ARG 66 1HB ARG 66 -3.461 12.144 -16.214 509 HG2 ARG 66 2HG ARG 66 -1.399 11.061 -14.990 510 HG3 ARG 66 1HG ARG 66 -2.186 9.516 -15.233 511 HD2 ARG 66 2HD ARG 66 -2.258 10.211 -17.815 512 HD3 ARG 66 1HD ARG 66 -1.064 11.422 -17.404 513 HH11 ARG 66 2HH1 ARG 66 0.688 11.198 -15.882 514 HH12 ARG 66 1HH1 ARG 66 2.275 10.358 -15.683 515 HH21 ARG 66 1HH2 ARG 66 1.173 7.599 -17.370 516 HH22 ARG 66 2HH2 ARG 66 2.554 8.463 -16.561 517 H SER 67 H SER 67 -4.814 12.949 -12.294 518 HA SER 67 HA SER 67 -7.167 14.273 -13.772 519 HG SER 67 HG SER 67 -9.610 13.330 -11.407 520 HB2 SER 67 2HB SER 67 -7.917 12.203 -12.515 521 HB3 SER 67 1HB SER 67 -7.336 12.925 -10.990 522 H GLU 68 H GLU 68 -8.147 15.690 -11.556 523 HA GLU 68 HA GLU 68 -6.342 18.018 -11.316 524 HB2 GLU 68 2HB GLU 68 -8.205 18.965 -10.013 525 HB3 GLU 68 1HB GLU 68 -8.763 18.214 -11.485 526 HG2 GLU 68 2HG GLU 68 -9.419 16.130 -9.970 527 HG3 GLU 68 1HG GLU 68 -9.132 17.182 -8.586 528 H ARG 69 H ARG 69 -6.962 18.633 -8.469 529 HA ARG 69 HA ARG 69 -5.253 16.823 -6.879 530 HE ARG 69 HE ARG 69 -2.183 19.990 -3.988 531 HB2 ARG 69 2HB ARG 69 -3.542 18.253 -8.252 532 HB3 ARG 69 1HB ARG 69 -4.097 19.646 -7.322 533 HG2 ARG 69 2HG ARG 69 -3.482 18.013 -5.189 534 HG3 ARG 69 1HG ARG 69 -2.590 17.130 -6.409 535 HD2 ARG 69 2HD ARG 69 -0.930 18.508 -5.505 536 HD3 ARG 69 1HD ARG 69 -1.364 19.438 -6.925 537 HH11 ARG 69 2HH1 ARG 69 -2.272 21.201 -7.227 538 HH12 ARG 69 1HH1 ARG 69 -2.762 22.862 -6.645 539 HH21 ARG 69 1HH2 ARG 69 -2.740 21.809 -3.383 540 HH22 ARG 69 2HH2 ARG 69 -3.037 23.174 -4.538 541 H SER 70 H SER 70 -5.959 16.904 -4.908 542 HA SER 70 HA SER 70 -6.448 17.826 -2.716 543 HG SER 70 HG SER 70 -5.704 20.699 -2.059 544 HB2 SER 70 2HB SER 70 -7.519 20.383 -3.976 545 HB3 SER 70 1HB SER 70 -7.637 19.950 -2.287 546 H PHE 71 H PHE 71 -7.943 16.502 -2.030 547 HA PHE 71 HA PHE 71 -10.548 16.177 -3.661 548 HD1 PHE 71 HD2 PHE 71 -10.102 14.021 -5.744 549 HD2 PHE 71 HD1 PHE 71 -6.877 13.764 -2.903 550 HE1 PHE 71 HE2 PHE 71 -8.638 13.033 -7.471 551 HE2 PHE 71 HE1 PHE 71 -5.460 12.747 -4.634 552 HZ PHE 71 HZ PHE 71 -6.339 12.368 -6.904 553 HB2 PHE 71 2HB PHE 71 -9.152 13.989 -2.089 554 HB3 PHE 71 1HB PHE 71 -10.487 13.801 -3.165 555 H SER 72 H SER 72 -9.548 16.118 -0.186 556 HA SER 72 HA SER 72 -12.203 16.801 0.672 557 HG SER 72 HG SER 72 -12.845 14.917 -0.756 558 HB2 SER 72 2HB SER 72 -11.669 13.827 1.243 559 HB3 SER 72 1HB SER 72 -12.904 14.793 2.038 560 H VAL 73 H VAL 73 -9.445 14.986 2.206 561 HA VAL 73 HA VAL 73 -9.528 16.956 4.527 562 HB VAL 73 HB VAL 73 -9.153 14.527 5.020 563 HG11 VAL 73 1HG1 VAL 73 -6.375 14.882 3.747 564 HG12 VAL 73 2HG1 VAL 73 -7.672 13.758 3.239 565 HG13 VAL 73 3HG1 VAL 73 -6.859 13.532 4.789 566 HG21 VAL 73 3HG2 VAL 73 -8.566 15.958 6.814 567 HG22 VAL 73 1HG2 VAL 73 -7.073 16.561 6.046 568 HG23 VAL 73 2HG2 VAL 73 -7.153 14.909 6.639 569 H ASP 74 H ASP 74 -7.616 18.261 5.012 570 HA ASP 74 HA ASP 74 -6.485 19.598 2.629 571 HB2 ASP 74 2HB ASP 74 -7.157 20.571 5.092 572 HB3 ASP 74 1HB ASP 74 -5.475 20.201 5.445 573 H THR 75 H THR 75 -5.042 17.392 5.076 574 HA THR 75 HA THR 75 -2.435 17.059 3.666 575 HB THR 75 HB THR 75 -2.228 14.965 5.025 576 HG1 THR 75 HG1 THR 75 -3.724 14.455 6.495 577 HG21 THR 75 3HG2 THR 75 -1.463 17.166 6.016 578 HG22 THR 75 1HG2 THR 75 -1.875 15.898 7.179 579 HG23 THR 75 2HG2 THR 75 -3.004 17.250 6.905 580 H ALA 76 H ALA 76 -4.523 16.899 1.693 581 HA ALA 76 HA ALA 76 -3.909 14.147 0.574 582 HB1 ALA 76 3HB ALA 76 -6.078 13.831 1.620 583 HB2 ALA 76 1HB ALA 76 -6.306 13.764 -0.136 584 HB3 ALA 76 2HB ALA 76 -6.794 15.221 0.779 585 H HIS 77 H HIS 77 -3.660 13.941 -1.442 586 HA HIS 77 HA HIS 77 -3.419 16.359 -3.287 587 HD1 HIS 77 HD1 HIS 77 -0.910 15.721 0.584 588 HD2 HIS 77 HD2 HIS 77 -1.913 18.703 -2.298 589 HE1 HIS 77 HE1 HIS 77 -0.761 18.053 1.644 590 HB2 HIS 77 2HB HIS 77 -1.105 14.846 -1.875 591 HB3 HIS 77 1HB HIS 77 -0.893 16.086 -3.121 592 H ARG 78 H ARG 78 -1.909 15.573 -5.237 593 HA ARG 78 HA ARG 78 -2.665 12.745 -6.076 594 HE ARG 78 HE ARG 78 -4.122 14.802 -10.708 595 HB2 ARG 78 2HB ARG 78 -4.539 14.310 -6.732 596 HB3 ARG 78 1HB ARG 78 -3.462 15.168 -7.802 597 HG2 ARG 78 2HG ARG 78 -4.147 12.156 -8.024 598 HG3 ARG 78 1HG ARG 78 -5.089 13.410 -8.800 599 HD2 ARG 78 2HD ARG 78 -2.155 12.771 -9.410 600 HD3 ARG 78 1HD ARG 78 -3.533 12.250 -10.358 601 HH11 ARG 78 2HH1 ARG 78 -0.806 14.017 -9.939 602 HH12 ARG 78 1HH1 ARG 78 -0.205 15.501 -10.779 603 HH21 ARG 78 1HH2 ARG 78 -3.433 16.289 -11.751 604 HH22 ARG 78 2HH2 ARG 78 -1.648 16.751 -11.823 605 H ALA 79 H ALA 79 -0.926 11.799 -6.827 606 HA ALA 79 HA ALA 79 1.405 13.344 -8.050 607 HB1 ALA 79 3HB ALA 79 2.548 11.058 -7.844 608 HB2 ALA 79 1HB ALA 79 1.085 10.413 -7.088 609 HB3 ALA 79 2HB ALA 79 1.999 11.743 -6.302 610 H ALA 80 H ALA 80 2.180 12.892 -10.071 611 HA ALA 80 HA ALA 80 0.403 11.346 -12.060 612 HB1 ALA 80 3HB ALA 80 2.047 13.901 -12.322 613 HB2 ALA 80 1HB ALA 80 0.353 13.555 -12.836 614 HB3 ALA 80 2HB ALA 80 1.746 12.944 -13.732 615 H SER 81 H SER 81 3.726 11.255 -10.865 616 HA SER 81 HA SER 81 3.976 8.579 -12.293 617 HG SER 81 HG SER 81 6.723 9.424 -14.179 618 HB2 SER 81 2HB SER 81 5.340 10.892 -13.230 619 HB3 SER 81 1HB SER 81 6.503 10.280 -12.091 620 H VAL 82 H VAL 82 6.444 7.823 -11.268 621 HA VAL 82 HA VAL 82 6.001 7.573 -8.253 622 HB VAL 82 HB VAL 82 8.223 6.230 -9.885 623 HG11 VAL 82 1HG1 VAL 82 7.763 6.420 -6.854 624 HG12 VAL 82 2HG1 VAL 82 9.282 6.505 -7.762 625 HG13 VAL 82 3HG1 VAL 82 8.478 4.955 -7.544 626 HG21 VAL 82 3HG2 VAL 82 6.895 4.104 -8.904 627 HG22 VAL 82 1HG2 VAL 82 6.293 4.942 -10.344 628 HG23 VAL 82 2HG2 VAL 82 5.548 5.226 -8.747 629 H GLU 83 H GLU 83 8.555 8.938 -10.439 630 HA GLU 83 HA GLU 83 9.945 10.519 -8.511 631 HB2 GLU 83 2HB GLU 83 9.329 11.021 -11.468 632 HB3 GLU 83 1HB GLU 83 10.484 11.944 -10.548 633 HG2 GLU 83 2HG GLU 83 12.089 10.174 -10.448 634 HG3 GLU 83 1HG GLU 83 10.904 8.907 -10.514 635 H GLU 84 H GLU 84 7.119 12.128 -10.361 636 HA GLU 84 HA GLU 84 6.619 14.039 -8.365 637 HB2 GLU 84 2HB GLU 84 4.596 12.491 -10.092 638 HB3 GLU 84 1HB GLU 84 4.119 13.867 -9.130 639 HG2 GLU 84 2HG GLU 84 4.489 15.165 -10.871 640 HG3 GLU 84 1HG GLU 84 6.207 15.004 -10.640 641 H ALA 85 H ALA 85 5.898 10.737 -7.692 642 HA ALA 85 HA ALA 85 4.111 11.368 -5.315 643 HB1 ALA 85 3HB ALA 85 3.983 8.951 -4.944 644 HB2 ALA 85 1HB ALA 85 5.271 8.638 -6.113 645 HB3 ALA 85 2HB ALA 85 3.687 9.235 -6.673 646 H VAL 86 H VAL 86 7.499 10.483 -5.901 647 HA VAL 86 HA VAL 86 8.189 10.524 -2.946 648 HB VAL 86 HB VAL 86 9.738 9.923 -5.505 649 HG11 VAL 86 1HG1 VAL 86 11.356 11.314 -4.267 650 HG12 VAL 86 2HG1 VAL 86 11.841 9.615 -4.204 651 HG13 VAL 86 3HG1 VAL 86 11.084 10.382 -2.773 652 HG21 VAL 86 3HG2 VAL 86 8.447 8.056 -4.267 653 HG22 VAL 86 1HG2 VAL 86 9.452 8.361 -2.837 654 HG23 VAL 86 2HG2 VAL 86 10.192 7.747 -4.332 655 H ASP 87 H ASP 87 8.871 12.760 -5.757 656 HA ASP 87 HA ASP 87 9.892 14.864 -4.099 657 HB2 ASP 87 2HB ASP 87 8.726 14.767 -6.911 658 HB3 ASP 87 1HB ASP 87 8.752 16.328 -6.139 659 H ILE 88 H ILE 88 6.356 14.191 -4.602 660 HA ILE 88 HA ILE 88 5.789 16.618 -2.943 661 HB ILE 88 HB ILE 88 3.662 16.572 -2.834 662 HG12 ILE 88 2HG1 ILE 88 3.029 13.927 -4.234 663 HG13 ILE 88 1HG1 ILE 88 3.347 13.946 -2.529 664 HG21 ILE 88 1HG2 ILE 88 4.025 15.627 -5.733 665 HG22 ILE 88 2HG2 ILE 88 4.577 17.202 -5.150 666 HG23 ILE 88 3HG2 ILE 88 2.838 16.808 -5.125 667 HD11 ILE 88 3HD1 ILE 88 1.543 16.091 -2.588 668 HD12 ILE 88 1HD1 ILE 88 1.134 14.439 -2.232 669 HD13 ILE 88 2HD1 ILE 88 0.924 15.040 -3.891 670 H ALA 89 H ALA 89 6.070 13.204 -2.122 671 HA ALA 89 HA ALA 89 5.280 13.514 0.732 672 HB1 ALA 89 3HB ALA 89 6.640 11.378 0.999 673 HB2 ALA 89 1HB ALA 89 7.078 11.474 -0.716 674 HB3 ALA 89 2HB ALA 89 5.377 11.269 -0.233 675 H ALA 90 H ALA 90 8.536 13.704 -0.791 676 HA ALA 90 HA ALA 90 9.844 14.676 1.726 677 HB1 ALA 90 3HB ALA 90 11.800 15.052 0.114 678 HB2 ALA 90 1HB ALA 90 10.736 14.610 -1.237 679 HB3 ALA 90 2HB ALA 90 11.102 13.422 0.034 680 H SER 91 H SER 91 8.094 16.371 -0.721 681 HA SER 91 HA SER 91 9.083 19.119 0.021 682 HG SER 91 HG SER 91 8.479 17.714 -2.589 683 HB2 SER 91 2HB SER 91 6.544 18.257 -1.522 684 HB3 SER 91 1HB SER 91 7.116 19.921 -1.327 685 H LEU 92 H LEU 92 6.590 17.036 1.349 686 HA LEU 92 HA LEU 92 5.487 19.280 3.042 687 HG LEU 92 HG LEU 92 4.940 15.910 1.680 688 HB2 LEU 92 2HB LEU 92 3.838 17.626 3.962 689 HB3 LEU 92 1HB LEU 92 3.685 18.268 2.358 690 HD11 LEU 92 1HD1 LEU 92 3.356 15.223 4.232 691 HD12 LEU 92 2HD1 LEU 92 5.107 15.015 3.965 692 HD13 LEU 92 3HD1 LEU 92 3.971 14.068 3.017 693 HD21 LEU 92 3HD2 LEU 92 2.721 14.992 1.120 694 HD22 LEU 92 1HD2 LEU 92 2.740 16.713 0.724 695 HD23 LEU 92 2HD2 LEU 92 1.906 16.154 2.193 696 H ASP 93 H ASP 93 6.000 16.204 4.754 697 HA ASP 93 HA ASP 93 8.522 17.342 6.017 698 HB2 ASP 93 2HB ASP 93 7.438 17.061 8.297 699 HB3 ASP 93 1HB ASP 93 6.957 18.383 7.302 700 H ALA 94 H ALA 94 8.654 14.992 4.431 701 HA ALA 94 HA ALA 94 9.297 12.845 6.550 702 HB1 ALA 94 3HB ALA 94 7.020 12.715 5.523 703 HB2 ALA 94 1HB ALA 94 7.995 11.309 5.044 704 HB3 ALA 94 2HB ALA 94 7.729 12.647 3.889 705 H GLU 95 H GLU 95 10.384 10.915 5.762 706 HA GLU 95 HA GLU 95 12.537 11.399 3.630 707 HB2 GLU 95 2HB GLU 95 13.243 9.512 5.896 708 HB3 GLU 95 1HB GLU 95 14.274 10.336 4.741 709 HG2 GLU 95 2HG GLU 95 13.869 12.505 6.139 710 HG3 GLU 95 1HG GLU 95 12.953 11.500 7.264 711 H THR 96 H THR 96 11.171 8.693 5.471 712 HA THR 96 HA THR 96 11.020 6.765 3.181 713 HB THR 96 HB THR 96 9.332 5.660 5.061 714 HG1 THR 96 HG1 THR 96 9.389 7.137 6.643 715 HG21 THR 96 3HG2 THR 96 11.574 4.631 4.235 716 HG22 THR 96 1HG2 THR 96 10.998 4.245 5.861 717 HG23 THR 96 2HG2 THR 96 12.293 5.424 5.689 718 H ALA 97 H ALA 97 8.882 5.832 2.697 719 HA ALA 97 HA ALA 97 6.462 7.147 3.639 720 HB1 ALA 97 3HB ALA 97 7.115 7.569 0.636 721 HB2 ALA 97 1HB ALA 97 6.714 8.776 1.880 722 HB3 ALA 97 2HB ALA 97 5.454 7.692 1.268 723 H TYR 98 H TYR 98 4.412 6.081 2.612 724 HA TYR 98 HA TYR 98 4.911 3.108 2.072 725 HD1 TYR 98 HD1 TYR 98 4.877 0.928 3.989 726 HD2 TYR 98 HD2 TYR 98 4.745 4.766 5.858 727 HE1 TYR 98 HE1 TYR 98 6.653 0.227 5.527 728 HE2 TYR 98 HE2 TYR 98 6.509 4.055 7.430 729 HH TYR 98 HH TYR 98 8.542 2.047 7.068 730 HB2 TYR 98 2HB TYR 98 3.065 4.252 4.252 731 HB3 TYR 98 1HB TYR 98 2.897 2.616 3.671 732 H VAL 99 H VAL 99 2.802 1.944 1.450 733 HA VAL 99 HA VAL 99 0.985 3.647 -0.302 734 HB VAL 99 HB VAL 99 1.906 3.262 -2.215 735 HG11 VAL 99 1HG1 VAL 99 4.126 1.406 -1.374 736 HG12 VAL 99 2HG1 VAL 99 4.134 3.154 -1.250 737 HG13 VAL 99 3HG1 VAL 99 3.984 2.391 -2.830 738 HG21 VAL 99 3HG2 VAL 99 1.536 0.293 -2.101 739 HG22 VAL 99 1HG2 VAL 99 1.994 1.182 -3.553 740 HG23 VAL 99 2HG2 VAL 99 0.431 1.505 -2.746 741 H ILE 100 H ILE 100 -1.018 3.064 0.783 742 HA ILE 100 HA ILE 100 -1.649 0.329 1.325 743 HB ILE 100 HB ILE 100 -3.980 2.124 0.491 744 HG12 ILE 100 2HG1 ILE 100 -3.121 3.420 2.228 745 HG13 ILE 100 1HG1 ILE 100 -4.316 2.423 3.006 746 HG21 ILE 100 1HG2 ILE 100 -5.355 0.668 1.898 747 HG22 ILE 100 2HG2 ILE 100 -3.933 -0.237 2.464 748 HG23 ILE 100 3HG2 ILE 100 -4.493 -0.411 0.787 749 HD11 ILE 100 3HD1 ILE 100 -1.311 1.728 3.163 750 HD12 ILE 100 1HD1 ILE 100 -2.655 0.979 4.053 751 HD13 ILE 100 2HD1 ILE 100 -2.167 2.692 4.371 752 H GLY 101 H GLY 101 -2.386 1.788 -1.685 753 HA2 GLY 101 2HA GLY 101 -2.284 0.883 -3.846 754 HA3 GLY 101 1HA GLY 101 -1.280 -0.349 -3.192 755 H GLY 102 H GLY 102 -2.226 -2.064 -4.875 756 HA2 GLY 102 2HA GLY 102 -4.712 -0.364 -5.575 757 HA3 GLY 102 1HA GLY 102 -3.131 -0.031 -6.186 758 H ALA 103 H ALA 103 -5.968 -1.503 -7.032 759 HA ALA 103 HA ALA 103 -5.671 -2.873 -9.348 760 HB1 ALA 103 3HB ALA 103 -7.669 -1.335 -8.592 761 HB2 ALA 103 1HB ALA 103 -7.432 -1.313 -10.318 762 HB3 ALA 103 2HB ALA 103 -6.896 0.026 -9.352 763 H ALA 104 H ALA 104 -4.421 0.434 -9.438 764 HA ALA 104 HA ALA 104 -2.520 -0.372 -11.716 765 HB1 ALA 104 3HB ALA 104 -3.862 1.620 -12.323 766 HB2 ALA 104 1HB ALA 104 -2.135 2.036 -12.133 767 HB3 ALA 104 2HB ALA 104 -3.295 2.474 -10.859 768 H ILE 105 H ILE 105 -2.638 0.660 -8.319 769 HA ILE 105 HA ILE 105 -0.022 1.971 -8.357 770 HB ILE 105 HB ILE 105 -1.227 1.128 -5.745 771 HG12 ILE 105 2HG1 ILE 105 -3.204 2.095 -6.688 772 HG13 ILE 105 1HG1 ILE 105 -2.481 3.183 -5.585 773 HG21 ILE 105 1HG2 ILE 105 0.354 3.666 -6.400 774 HG22 ILE 105 2HG2 ILE 105 0.994 2.232 -5.587 775 HG23 ILE 105 3HG2 ILE 105 -0.290 3.168 -4.830 776 HD11 ILE 105 3HD1 ILE 105 -3.320 3.610 -8.299 777 HD12 ILE 105 1HD1 ILE 105 -1.542 3.745 -8.411 778 HD13 ILE 105 2HD1 ILE 105 -2.452 4.819 -7.306 779 H TYR 106 H TYR 106 -0.759 -1.069 -6.578 780 HA TYR 106 HA TYR 106 2.052 -1.737 -5.972 781 HD1 TYR 106 HD1 TYR 106 2.556 -4.848 -4.909 782 HD2 TYR 106 HD2 TYR 106 -0.523 -2.285 -3.375 783 HE1 TYR 106 HE1 TYR 106 3.127 -5.509 -2.651 784 HE2 TYR 106 HE2 TYR 106 0.127 -2.860 -1.091 785 HH TYR 106 HH TYR 106 2.500 -5.429 -0.435 786 HB2 TYR 106 2HB TYR 106 -0.609 -3.135 -5.718 787 HB3 TYR 106 1HB TYR 106 0.624 -4.210 -6.267 788 H ALA 107 H ALA 107 0.077 -2.509 -8.822 789 HA ALA 107 HA ALA 107 2.053 -4.143 -10.286 790 HB1 ALA 107 3HB ALA 107 -0.411 -4.125 -10.782 791 HB2 ALA 107 1HB ALA 107 0.486 -3.652 -12.226 792 HB3 ALA 107 2HB ALA 107 -0.329 -2.425 -11.244 793 H LEU 108 H LEU 108 1.364 -0.611 -10.544 794 HA LEU 108 HA LEU 108 3.736 -0.201 -12.316 795 HG LEU 108 HG LEU 108 2.422 2.190 -9.766 796 HB2 LEU 108 2HB LEU 108 3.041 1.873 -12.717 797 HB3 LEU 108 1HB LEU 108 1.517 1.230 -12.212 798 HD11 LEU 108 1HD1 LEU 108 3.654 4.264 -10.015 799 HD12 LEU 108 2HD1 LEU 108 3.491 4.290 -11.780 800 HD13 LEU 108 3HD1 LEU 108 4.562 3.115 -10.996 801 HD21 LEU 108 3HD2 LEU 108 1.090 4.285 -10.250 802 HD22 LEU 108 1HD2 LEU 108 0.212 2.801 -10.646 803 HD23 LEU 108 2HD2 LEU 108 0.964 3.788 -11.949 804 H PHE 109 H PHE 109 3.289 0.131 -8.790 805 HA PHE 109 HA PHE 109 6.071 1.120 -8.375 806 HD1 PHE 109 HD2 PHE 109 6.851 2.336 -5.946 807 HD2 PHE 109 HD1 PHE 109 2.709 2.570 -7.005 808 HE1 PHE 109 HE2 PHE 109 6.897 4.734 -5.527 809 HE2 PHE 109 HE1 PHE 109 2.747 4.980 -6.582 810 HZ PHE 109 HZ PHE 109 4.872 6.091 -5.873 811 HB2 PHE 109 2HB PHE 109 3.729 0.338 -6.530 812 HB3 PHE 109 1HB PHE 109 5.316 0.306 -5.857 813 H GLN 110 H GLN 110 5.034 -2.181 -8.718 814 HA GLN 110 HA GLN 110 6.753 -3.637 -7.128 815 HB2 GLN 110 2HB GLN 110 6.138 -4.189 -10.101 816 HB3 GLN 110 1HB GLN 110 7.022 -5.268 -9.093 817 HG2 GLN 110 2HG GLN 110 4.805 -4.996 -7.477 818 HG3 GLN 110 1HG GLN 110 4.118 -4.557 -9.025 819 HE21 GLN 110 1HE2 GLN 110 4.902 -7.225 -7.087 820 HE22 GLN 110 2HE2 GLN 110 4.453 -8.468 -8.361 821 HA PRO 111 HA PRO 111 11.070 -3.026 -9.157 822 HB2 PRO 111 2HB PRO 111 11.127 -1.005 -11.289 823 HB3 PRO 111 1HB PRO 111 11.417 -2.745 -11.391 824 HG2 PRO 111 2HG PRO 111 9.161 -1.424 -12.535 825 HG3 PRO 111 1HG PRO 111 9.304 -3.175 -12.217 826 HD2 PRO 111 2HD PRO 111 7.914 -1.077 -10.482 827 HD3 PRO 111 1HD PRO 111 7.394 -2.709 -10.920 828 H HIS 112 H HIS 112 9.072 -0.481 -8.185 829 HA HIS 112 HA HIS 112 11.417 1.460 -7.686 830 HD1 HIS 112 HD1 HIS 112 11.469 3.542 -9.813 831 HD2 HIS 112 HD2 HIS 112 7.558 1.888 -10.206 832 HE1 HIS 112 HE1 HIS 112 10.626 3.798 -12.259 833 HB2 HIS 112 2HB HIS 112 8.445 2.202 -7.714 834 HB3 HIS 112 1HB HIS 112 9.830 3.269 -7.541 835 H LEU 113 H LEU 113 9.218 -0.567 -5.854 836 HA LEU 113 HA LEU 113 9.336 0.918 -3.358 837 HG LEU 113 HG LEU 113 6.898 -1.252 -2.217 838 HB2 LEU 113 2HB LEU 113 8.946 -2.088 -3.968 839 HB3 LEU 113 1HB LEU 113 9.003 -1.528 -2.329 840 HD11 LEU 113 1HD1 LEU 113 7.075 0.918 -4.346 841 HD12 LEU 113 2HD1 LEU 113 7.105 1.117 -2.582 842 HD13 LEU 113 3HD1 LEU 113 5.615 0.600 -3.373 843 HD21 LEU 113 3HD2 LEU 113 5.375 -1.539 -4.394 844 HD22 LEU 113 1HD2 LEU 113 6.240 -2.889 -3.676 845 HD23 LEU 113 2HD2 LEU 113 6.897 -2.114 -5.132 846 H ASP 114 H ASP 114 10.524 0.903 -1.583 847 HA ASP 114 HA ASP 114 13.132 -0.483 -1.147 848 HB2 ASP 114 2HB ASP 114 12.521 1.610 -0.015 849 HB3 ASP 114 1HB ASP 114 11.021 0.936 0.611 850 H ARG 115 H ARG 115 9.857 -1.158 0.198 851 HA ARG 115 HA ARG 115 10.357 -4.151 -0.047 852 HE ARG 115 HE ARG 115 12.452 -1.737 3.067 853 HB2 ARG 115 2HB ARG 115 9.833 -2.591 2.568 854 HB3 ARG 115 1HB ARG 115 9.276 -4.250 2.444 855 HG2 ARG 115 2HG ARG 115 11.385 -5.182 2.362 856 HG3 ARG 115 1HG ARG 115 12.182 -3.747 1.730 857 HD2 ARG 115 2HD ARG 115 11.054 -3.993 4.589 858 HD3 ARG 115 1HD ARG 115 12.728 -4.342 4.136 859 HH11 ARG 115 2HH1 ARG 115 12.329 -3.138 6.187 860 HH12 ARG 115 1HH1 ARG 115 12.681 -1.534 7.007 861 HH21 ARG 115 1HH2 ARG 115 12.646 0.057 3.932 862 HH22 ARG 115 2HH2 ARG 115 12.764 0.266 5.740 863 H MET 116 H MET 116 8.485 -5.487 0.135 864 HA MET 116 HA MET 116 5.801 -4.016 -0.193 865 HB2 MET 116 2HB MET 116 5.969 -6.831 -1.225 866 HB3 MET 116 1HB MET 116 4.963 -5.495 -1.630 867 HG2 MET 116 2HG MET 116 7.364 -4.477 -2.574 868 HG3 MET 116 1HG MET 116 7.643 -6.204 -2.817 869 HE1 MET 116 3HE MET 116 5.084 -7.551 -3.331 870 HE2 MET 116 1HE MET 116 5.963 -7.660 -4.883 871 HE3 MET 116 2HE MET 116 4.266 -7.082 -4.849 872 H VAL 117 H VAL 117 5.034 -3.876 1.767 873 HA VAL 117 HA VAL 117 4.898 -6.123 3.777 874 HB VAL 117 HB VAL 117 4.171 -3.178 3.815 875 HG11 VAL 117 1HG1 VAL 117 3.993 -5.054 6.259 876 HG12 VAL 117 2HG1 VAL 117 2.586 -4.366 5.442 877 HG13 VAL 117 3HG1 VAL 117 3.697 -3.290 6.239 878 HG21 VAL 117 3HG2 VAL 117 6.294 -4.673 5.511 879 HG22 VAL 117 1HG2 VAL 117 6.068 -2.917 5.404 880 HG23 VAL 117 2HG2 VAL 117 6.677 -3.839 4.009 881 H LEU 118 H LEU 118 3.661 -7.391 2.195 882 HA LEU 118 HA LEU 118 0.716 -6.903 1.767 883 HG LEU 118 HG LEU 118 -0.300 -9.185 0.809 884 HB2 LEU 118 2HB LEU 118 2.026 -8.003 0.061 885 HB3 LEU 118 1HB LEU 118 2.734 -9.151 1.167 886 HD11 LEU 118 1HD1 LEU 118 1.732 -10.204 -1.285 887 HD12 LEU 118 2HD1 LEU 118 0.239 -9.226 -1.466 888 HD13 LEU 118 3HD1 LEU 118 0.116 -10.929 -1.083 889 HD21 LEU 118 3HD2 LEU 118 1.713 -11.516 1.075 890 HD22 LEU 118 1HD2 LEU 118 -0.065 -11.543 1.203 891 HD23 LEU 118 2HD2 LEU 118 0.902 -10.771 2.468 892 H SER 119 H SER 119 -0.989 -8.009 2.744 893 HA SER 119 HA SER 119 -0.444 -9.632 5.335 894 HG SER 119 HG SER 119 -0.146 -6.981 5.563 895 HB2 SER 119 2HB SER 119 -2.363 -7.280 4.854 896 HB3 SER 119 1HB SER 119 -2.569 -8.368 6.189 897 H ARG 120 H ARG 120 -1.018 -11.665 4.956 898 HA ARG 120 HA ARG 120 -2.984 -12.312 2.757 899 HE ARG 120 HE ARG 120 0.177 -15.364 1.344 900 HB2 ARG 120 2HB ARG 120 -1.844 -14.722 4.039 901 HB3 ARG 120 1HB ARG 120 -1.941 -14.263 2.370 902 HG2 ARG 120 2HG ARG 120 0.246 -13.136 2.473 903 HG3 ARG 120 1HG ARG 120 0.251 -13.124 4.218 904 HD2 ARG 120 2HD ARG 120 1.834 -14.722 3.575 905 HD3 ARG 120 1HD ARG 120 0.504 -15.602 4.293 906 HH11 ARG 120 2HH1 ARG 120 2.136 -17.073 3.617 907 HH12 ARG 120 1HH1 ARG 120 2.038 -18.635 2.696 908 HH21 ARG 120 1HH2 ARG 120 0.006 -17.142 0.319 909 HH22 ARG 120 2HH2 ARG 120 0.840 -18.660 0.877 910 H VAL 121 H VAL 121 -5.081 -12.567 3.254 911 HA VAL 121 HA VAL 121 -5.923 -13.212 6.075 912 HB VAL 121 HB VAL 121 -7.546 -11.900 3.865 913 HG11 VAL 121 1HG1 VAL 121 -8.938 -12.649 5.826 914 HG12 VAL 121 2HG1 VAL 121 -8.842 -10.884 5.775 915 HG13 VAL 121 3HG1 VAL 121 -7.853 -11.772 6.932 916 HG21 VAL 121 3HG2 VAL 121 -6.815 -9.754 5.567 917 HG22 VAL 121 1HG2 VAL 121 -6.149 -10.108 3.980 918 HG23 VAL 121 2HG2 VAL 121 -5.303 -10.651 5.421 919 HA PRO 122 HA PRO 122 -7.864 -17.110 4.372 920 HB2 PRO 122 2HB PRO 122 -8.425 -17.635 7.318 921 HB3 PRO 122 1HB PRO 122 -7.686 -18.682 6.089 922 HG2 PRO 122 2HG PRO 122 -6.088 -17.518 7.970 923 HG3 PRO 122 1HG PRO 122 -5.544 -17.555 6.272 924 HD2 PRO 122 2HD PRO 122 -6.882 -15.180 7.697 925 HD3 PRO 122 1HD PRO 122 -5.383 -15.247 6.709 926 H GLY 123 H GLY 123 -9.503 -14.715 4.444 927 HA2 GLY 123 2HA GLY 123 -12.294 -15.705 5.274 928 HA3 GLY 123 1HA GLY 123 -11.981 -14.121 4.647 929 H GLU 124 H GLU 124 -10.463 -15.461 2.442 930 HA GLU 124 HA GLU 124 -10.742 -15.878 0.164 931 HB2 GLU 124 2HB GLU 124 -12.572 -18.096 1.078 932 HB3 GLU 124 1HB GLU 124 -11.543 -18.056 -0.317 933 HG2 GLU 124 2HG GLU 124 -9.722 -17.636 1.894 934 HG3 GLU 124 1HG GLU 124 -10.876 -18.798 2.501 935 H TYR 125 H TYR 125 -11.591 -14.726 -1.516 936 HA TYR 125 HA TYR 125 -14.561 -14.111 -1.615 937 HD1 TYR 125 HD1 TYR 125 -15.622 -12.478 0.723 938 HD2 TYR 125 HD2 TYR 125 -11.400 -11.809 0.589 939 HE1 TYR 125 HE1 TYR 125 -15.583 -12.237 3.180 940 HE2 TYR 125 HE2 TYR 125 -11.345 -11.631 3.041 941 HH TYR 125 HH TYR 125 -14.178 -12.273 4.988 942 HB2 TYR 125 2HB TYR 125 -12.598 -11.737 -1.439 943 HB3 TYR 125 1HB TYR 125 -14.328 -11.661 -1.472 944 H GLU 126 H GLU 126 -14.935 -14.453 -3.888 945 HA GLU 126 HA GLU 126 -13.569 -14.049 -6.044 946 HB2 GLU 126 2HB GLU 126 -16.128 -12.550 -6.595 947 HB3 GLU 126 1HB GLU 126 -15.336 -13.823 -7.460 948 HG2 GLU 126 2HG GLU 126 -17.047 -14.313 -4.929 949 HG3 GLU 126 1HG GLU 126 -17.649 -14.329 -6.586 950 H GLY 127 H GLY 127 -14.657 -11.156 -4.560 951 HA2 GLY 127 2HA GLY 127 -13.920 -8.842 -4.674 952 HA3 GLY 127 1HA GLY 127 -12.502 -9.530 -5.434 953 H ASP 128 H ASP 128 -13.288 -7.008 -5.796 954 HA ASP 128 HA ASP 128 -13.682 -6.939 -8.841 955 HB2 ASP 128 2HB ASP 128 -14.548 -4.801 -6.781 956 HB3 ASP 128 1HB ASP 128 -14.444 -4.526 -8.509 957 H THR 129 H THR 129 -11.801 -5.499 -6.136 958 HA THR 129 HA THR 129 -9.700 -4.470 -8.019 959 HB THR 129 HB THR 129 -9.054 -4.818 -5.066 960 HG1 THR 129 HG1 THR 129 -10.361 -3.400 -4.349 961 HG21 THR 129 3HG2 THR 129 -8.814 -2.340 -6.876 962 HG22 THR 129 1HG2 THR 129 -7.490 -3.520 -6.656 963 HG23 THR 129 2HG2 THR 129 -8.090 -2.554 -5.271 964 H TYR 130 H TYR 130 -7.992 -5.706 -8.738 965 HA TYR 130 HA TYR 130 -7.155 -8.235 -7.220 966 HD1 TYR 130 HD1 TYR 130 -9.667 -7.323 -10.043 967 HD2 TYR 130 HD2 TYR 130 -7.538 -10.945 -9.112 968 HE1 TYR 130 HE1 TYR 130 -11.751 -8.621 -10.262 969 HE2 TYR 130 HE2 TYR 130 -9.626 -12.227 -9.407 970 HH TYR 130 HH TYR 130 -12.414 -11.149 -9.084 971 HB2 TYR 130 2HB TYR 130 -6.986 -7.539 -10.208 972 HB3 TYR 130 1HB TYR 130 -6.272 -8.950 -9.477 973 H TYR 131 H TYR 131 -5.202 -8.572 -6.525 974 HA TYR 131 HA TYR 131 -3.043 -6.512 -6.679 975 HD1 TYR 131 HD2 TYR 131 -0.918 -9.887 -5.403 976 HD2 TYR 131 HD1 TYR 131 -2.115 -6.273 -3.440 977 HE1 TYR 131 HE2 TYR 131 1.323 -9.638 -4.563 978 HE2 TYR 131 HE1 TYR 131 0.074 -6.204 -2.340 979 HH TYR 131 HH TYR 131 2.619 -8.578 -3.124 980 HB2 TYR 131 2HB TYR 131 -3.813 -7.770 -4.589 981 HB3 TYR 131 1HB TYR 131 -3.289 -9.253 -5.288 982 HA PRO 132 HA PRO 132 -0.689 -8.859 -9.884 983 HB2 PRO 132 2HB PRO 132 1.864 -7.615 -9.530 984 HB3 PRO 132 1HB PRO 132 0.526 -7.072 -10.538 985 HG2 PRO 132 2HG PRO 132 1.481 -5.761 -8.144 986 HG3 PRO 132 1HG PRO 132 0.070 -5.338 -9.119 987 HD2 PRO 132 2HD PRO 132 0.119 -6.833 -6.537 988 HD3 PRO 132 1HD PRO 132 -1.151 -5.806 -7.266 989 H GLU 133 H GLU 133 1.533 -10.031 -10.291 990 HA GLU 133 HA GLU 133 1.584 -12.199 -8.236 991 HB2 GLU 133 2HB GLU 133 2.827 -13.580 -9.868 992 HB3 GLU 133 1HB GLU 133 1.214 -13.064 -10.219 993 HG2 GLU 133 2HG GLU 133 2.571 -11.192 -11.762 994 HG3 GLU 133 1HG GLU 133 3.717 -12.534 -11.779 995 H TRP 134 H TRP 134 3.375 -13.180 -7.354 996 HA TRP 134 HA TRP 134 5.546 -11.216 -6.492 997 HD1 TRP 134 HD1 TRP 134 4.889 -15.455 -5.277 998 HE1 TRP 134 HE1 TRP 134 2.596 -16.733 -4.875 999 HE3 TRP 134 HE3 TRP 134 2.255 -11.426 -3.636 1000 HZ2 TRP 134 HZ2 TRP 134 0.043 -15.903 -3.957 1001 HZ3 TRP 134 HZ3 TRP 134 -0.162 -11.686 -3.168 1002 HH2 TRP 134 HH2 TRP 134 -1.242 -13.902 -3.279 1003 HB2 TRP 134 2HB TRP 134 5.762 -12.666 -4.378 1004 HB3 TRP 134 1HB TRP 134 4.426 -11.577 -4.500 1005 H ASP 135 H ASP 135 7.666 -11.747 -6.963 1006 HA ASP 135 HA ASP 135 8.182 -14.491 -8.187 1007 HB2 ASP 135 2HB ASP 135 8.271 -12.231 -9.641 1008 HB3 ASP 135 1HB ASP 135 9.811 -11.980 -8.836 1009 H ALA 136 H ALA 136 10.750 -14.564 -8.249 1010 HA ALA 136 HA ALA 136 11.744 -14.590 -5.313 1011 HB1 ALA 136 3HB ALA 136 11.085 -16.871 -6.247 1012 HB2 ALA 136 1HB ALA 136 12.819 -16.789 -5.840 1013 HB3 ALA 136 2HB ALA 136 12.295 -16.689 -7.546 1014 H ALA 137 H ALA 137 12.706 -13.771 -8.558 1015 HA ALA 137 HA ALA 137 15.439 -12.869 -7.463 1016 HB1 ALA 137 3HB ALA 137 14.679 -13.377 -10.410 1017 HB2 ALA 137 1HB ALA 137 15.694 -14.422 -9.379 1018 HB3 ALA 137 2HB ALA 137 16.250 -12.789 -9.821 1019 H GLU 138 H GLU 138 12.414 -11.498 -8.501 1020 HA GLU 138 HA GLU 138 13.597 -8.721 -8.647 1021 HB2 GLU 138 2HB GLU 138 10.688 -9.634 -8.484 1022 HB3 GLU 138 1HB GLU 138 11.275 -7.998 -8.615 1023 HG2 GLU 138 2HG GLU 138 12.361 -9.559 -10.875 1024 HG3 GLU 138 1HG GLU 138 10.622 -9.735 -10.769 1025 H TRP 139 H TRP 139 11.606 -10.498 -6.182 1026 HA TRP 139 HA TRP 139 12.911 -8.853 -3.966 1027 HD1 TRP 139 HD1 TRP 139 8.694 -10.727 -4.265 1028 HE1 TRP 139 HE1 TRP 139 7.157 -10.335 -6.422 1029 HE3 TRP 139 HE3 TRP 139 10.753 -6.354 -5.681 1030 HZ2 TRP 139 HZ2 TRP 139 7.374 -8.602 -8.572 1031 HZ3 TRP 139 HZ3 TRP 139 10.268 -5.504 -7.952 1032 HH2 TRP 139 HH2 TRP 139 8.678 -6.680 -9.407 1033 HB2 TRP 139 2HB TRP 139 10.481 -8.905 -2.794 1034 HB3 TRP 139 1HB TRP 139 11.072 -7.602 -3.758 1035 H GLU 140 H GLU 140 13.385 -9.810 -2.127 1036 HA GLU 140 HA GLU 140 12.650 -12.750 -1.721 1037 HB2 GLU 140 2HB GLU 140 14.676 -13.176 -0.823 1038 HB3 GLU 140 1HB GLU 140 15.137 -11.925 -1.936 1039 HG2 GLU 140 2HG GLU 140 15.060 -10.291 0.167 1040 HG3 GLU 140 1HG GLU 140 14.882 -11.746 1.146 1041 H LEU 141 H LEU 141 12.947 -12.958 1.081 1042 HA LEU 141 HA LEU 141 10.372 -11.543 1.974 1043 HG LEU 141 HG LEU 141 9.056 -14.742 3.427 1044 HB2 LEU 141 2HB LEU 141 10.712 -14.245 1.703 1045 HB3 LEU 141 1HB LEU 141 11.340 -14.074 3.313 1046 HD11 LEU 141 1HD1 LEU 141 8.816 -11.748 4.048 1047 HD12 LEU 141 2HD1 LEU 141 9.578 -12.912 5.128 1048 HD13 LEU 141 3HD1 LEU 141 7.853 -13.064 4.720 1049 HD21 LEU 141 3HD2 LEU 141 8.362 -14.102 1.093 1050 HD22 LEU 141 1HD2 LEU 141 8.206 -12.412 1.604 1051 HD23 LEU 141 2HD2 LEU 141 7.147 -13.652 2.299 1052 H ASP 142 H ASP 142 10.795 -9.925 3.365 1053 HA ASP 142 HA ASP 142 13.349 -9.618 4.936 1054 HB2 ASP 142 2HB ASP 142 12.107 -7.768 3.604 1055 HB3 ASP 142 1HB ASP 142 10.864 -7.799 4.857 1056 H ALA 143 H ALA 143 9.809 -9.791 5.763 1057 HA ALA 143 HA ALA 143 10.490 -11.459 8.205 1058 HB1 ALA 143 3HB ALA 143 10.690 -9.042 8.933 1059 HB2 ALA 143 1HB ALA 143 9.334 -9.840 9.769 1060 HB3 ALA 143 2HB ALA 143 9.024 -8.724 8.412 1061 H GLU 144 H GLU 144 9.115 -13.139 8.312 1062 HA GLU 144 HA GLU 144 6.162 -12.737 7.625 1063 HB2 GLU 144 2HB GLU 144 7.648 -14.596 6.511 1064 HB3 GLU 144 1HB GLU 144 7.395 -15.511 7.995 1065 HG2 GLU 144 2HG GLU 144 4.915 -15.461 7.668 1066 HG3 GLU 144 1HG GLU 144 5.059 -14.256 6.409 1067 H THR 145 H THR 145 4.717 -12.501 9.203 1068 HA THR 145 HA THR 145 4.870 -14.261 11.612 1069 HB THR 145 HB THR 145 6.171 -12.412 12.478 1070 HG1 THR 145 HG1 THR 145 3.618 -12.883 13.602 1071 HG21 THR 145 3HG2 THR 145 5.434 -10.295 11.664 1072 HG22 THR 145 1HG2 THR 145 4.885 -10.305 13.339 1073 HG23 THR 145 2HG2 THR 145 3.721 -10.606 12.016 1074 H ASP 146 H ASP 146 2.919 -15.092 12.180 1075 HA ASP 146 HA ASP 146 0.386 -14.429 11.404 1076 HB2 ASP 146 2HB ASP 146 1.309 -15.458 14.164 1077 HB3 ASP 146 1HB ASP 146 -0.351 -15.538 13.597 1078 H HIS 147 H HIS 147 -1.316 -13.149 11.924 1079 HA HIS 147 HA HIS 147 -1.241 -11.140 14.225 1080 HD1 HIS 147 HD1 HIS 147 1.239 -10.659 13.206 1081 HD2 HIS 147 HD2 HIS 147 -1.104 -7.275 12.137 1082 HE1 HIS 147 HE1 HIS 147 2.702 -8.524 13.225 1083 HB2 HIS 147 2HB HIS 147 -1.389 -10.554 11.207 1084 HB3 HIS 147 1HB HIS 147 -2.380 -9.580 12.253 1085 H GLU 148 H GLU 148 -3.757 -9.961 13.897 1086 HA GLU 148 HA GLU 148 -5.241 -12.030 15.319 1087 HB2 GLU 148 2HB GLU 148 -6.194 -9.268 14.394 1088 HB3 GLU 148 1HB GLU 148 -7.155 -10.295 15.405 1089 HG2 GLU 148 2HG GLU 148 -4.400 -9.752 16.559 1090 HG3 GLU 148 1HG GLU 148 -5.444 -8.345 16.353 1091 H GLY 149 H GLY 149 -6.079 -10.696 12.098 1092 HA2 GLY 149 2HA GLY 149 -7.898 -13.170 11.635 1093 HA3 GLY 149 1HA GLY 149 -8.245 -11.639 10.879 1094 H PHE 150 H PHE 150 -4.854 -12.657 11.002 1095 HA PHE 150 HA PHE 150 -4.705 -13.617 8.195 1096 HD1 PHE 150 HD2 PHE 150 -5.740 -9.641 9.680 1097 HD2 PHE 150 HD1 PHE 150 -1.975 -10.405 7.792 1098 HE1 PHE 150 HE2 PHE 150 -4.836 -7.586 10.656 1099 HE2 PHE 150 HE1 PHE 150 -1.058 -8.344 8.783 1100 HZ PHE 150 HZ PHE 150 -2.503 -6.908 10.208 1101 HB2 PHE 150 2HB PHE 150 -4.015 -11.606 7.057 1102 HB3 PHE 150 1HB PHE 150 -5.539 -11.297 7.788 1103 H THR 151 H THR 151 -2.484 -13.561 7.277 1104 HA THR 151 HA THR 151 -0.273 -13.387 9.411 1105 HB THR 151 HB THR 151 -0.055 -15.542 8.902 1106 HG1 THR 151 HG1 THR 151 1.906 -14.494 8.327 1107 HG21 THR 151 3HG2 THR 151 -1.685 -16.029 7.163 1108 HG22 THR 151 1HG2 THR 151 -0.112 -16.610 6.584 1109 HG23 THR 151 2HG2 THR 151 -0.782 -15.076 5.971 1110 H LEU 152 H LEU 152 1.047 -11.844 9.325 1111 HA LEU 152 HA LEU 152 1.157 -9.727 7.216 1112 HG LEU 152 HG LEU 152 3.017 -7.844 10.044 1113 HB2 LEU 152 2HB LEU 152 1.211 -9.166 9.596 1114 HB3 LEU 152 1HB LEU 152 2.516 -10.259 9.920 1115 HD11 LEU 152 1HD1 LEU 152 5.307 -8.069 9.389 1116 HD12 LEU 152 2HD1 LEU 152 4.933 -9.103 7.999 1117 HD13 LEU 152 3HD1 LEU 152 4.807 -9.758 9.623 1118 HD21 LEU 152 3HD2 LEU 152 3.083 -7.814 6.957 1119 HD22 LEU 152 1HD2 LEU 152 3.438 -6.483 8.074 1120 HD23 LEU 152 2HD2 LEU 152 1.784 -7.120 7.933 1121 H GLN 153 H GLN 153 2.487 -9.804 5.516 1122 HA GLN 153 HA GLN 153 5.181 -11.284 5.622 1123 HB2 GLN 153 2HB GLN 153 2.992 -11.337 3.508 1124 HB3 GLN 153 1HB GLN 153 4.558 -10.905 2.860 1125 HG2 GLN 153 2HG GLN 153 5.607 -12.938 3.839 1126 HG3 GLN 153 1HG GLN 153 4.083 -13.433 4.557 1127 HE21 GLN 153 1HE2 GLN 153 4.828 -15.316 3.202 1128 HE22 GLN 153 2HE2 GLN 153 4.411 -15.308 1.387 1129 H GLU 154 H GLU 154 6.884 -9.967 5.443 1130 HA GLU 154 HA GLU 154 6.657 -7.294 3.933 1131 HB2 GLU 154 2HB GLU 154 8.876 -7.995 5.905 1132 HB3 GLU 154 1HB GLU 154 8.491 -6.453 5.202 1133 HG2 GLU 154 2HG GLU 154 6.153 -6.719 6.490 1134 HG3 GLU 154 1HG GLU 154 6.998 -7.980 7.379 1135 H TRP 155 H TRP 155 7.482 -7.368 1.916 1136 HA TRP 155 HA TRP 155 9.658 -9.389 1.193 1137 HD1 TRP 155 HD1 TRP 155 5.482 -9.285 0.718 1138 HE1 TRP 155 HE1 TRP 155 4.483 -11.700 0.205 1139 HE3 TRP 155 HE3 TRP 155 9.576 -11.107 -1.730 1140 HZ2 TRP 155 HZ2 TRP 155 5.376 -13.832 -1.416 1141 HZ3 TRP 155 HZ3 TRP 155 9.424 -13.329 -2.804 1142 HH2 TRP 155 HH2 TRP 155 7.346 -14.645 -2.690 1143 HB2 TRP 155 2HB TRP 155 7.576 -7.889 -0.458 1144 HB3 TRP 155 1HB TRP 155 8.812 -8.842 -1.208 1145 H VAL 156 H VAL 156 11.797 -8.507 1.274 1146 HA VAL 156 HA VAL 156 12.259 -5.688 0.296 1147 HB VAL 156 HB VAL 156 13.282 -6.376 2.424 1148 HG11 VAL 156 1HG1 VAL 156 15.215 -8.110 0.788 1149 HG12 VAL 156 2HG1 VAL 156 14.016 -8.693 1.968 1150 HG13 VAL 156 3HG1 VAL 156 15.381 -7.704 2.519 1151 HG21 VAL 156 3HG2 VAL 156 14.235 -4.396 1.128 1152 HG22 VAL 156 1HG2 VAL 156 15.459 -5.488 0.459 1153 HG23 VAL 156 2HG2 VAL 156 15.372 -5.199 2.218 1154 H ARG 157 H ARG 157 13.102 -4.982 -1.477 1155 HA ARG 157 HA ARG 157 13.526 -6.582 -3.864 1156 HE ARG 157 HE ARG 157 13.857 -4.250 -7.213 1157 HB2 ARG 157 2HB ARG 157 13.900 -3.660 -3.064 1158 HB3 ARG 157 1HB ARG 157 14.832 -4.162 -4.443 1159 HG2 ARG 157 2HG ARG 157 12.501 -5.214 -5.339 1160 HG3 ARG 157 1HG ARG 157 11.797 -4.178 -4.103 1161 HD2 ARG 157 2HD ARG 157 11.732 -2.894 -6.147 1162 HD3 ARG 157 1HD ARG 157 12.997 -2.203 -5.132 1163 HH11 ARG 157 2HH1 ARG 157 13.696 -0.906 -6.371 1164 HH12 ARG 157 1HH1 ARG 157 15.110 -0.456 -7.403 1165 HH21 ARG 157 1HH2 ARG 157 15.469 -3.766 -8.332 1166 HH22 ARG 157 2HH2 ARG 157 16.125 -2.058 -8.451 1167 H SER 158 H SER 158 15.147 -7.079 -5.166 1168 HA SER 158 HA SER 158 16.850 -8.740 -3.987 1169 HG SER 158 HG SER 158 18.265 -7.405 -6.918 1170 HB2 SER 158 2HB SER 158 17.518 -9.516 -6.152 1171 HB3 SER 158 1HB SER 158 15.897 -8.896 -6.288 1172 H ALA 159 H ALA 159 18.522 -8.534 -2.718 1173 HA ALA 159 HA ALA 159 20.581 -6.453 -2.874 1174 HB1 ALA 159 3HB ALA 159 21.333 -7.491 -0.745 1175 HB2 ALA 159 1HB ALA 159 20.389 -8.952 -1.076 1176 HB3 ALA 159 2HB ALA 159 19.555 -7.413 -0.776 1177 H SER 160 H SER 160 21.360 -7.212 -5.129 1178 HA SER 160 HA SER 160 23.250 -9.281 -5.475 1179 HG SER 160 HG SER 160 22.531 -5.910 -6.638 1180 HB2 SER 160 2HB SER 160 24.122 -8.129 -7.461 1181 HB3 SER 160 1HB SER 160 22.370 -8.071 -7.372 1182 H SER 161 H SER 161 24.361 -6.033 -4.625 1183 HA SER 161 HA SER 161 26.301 -6.888 -2.731 1184 HG SER 161 HG SER 161 27.052 -6.191 -6.102 1185 HB2 SER 161 2HB SER 161 28.542 -6.453 -3.684 1186 HB3 SER 161 1HB SER 161 27.752 -7.775 -4.511 1187 H ARG 162 H ARG 162 26.773 -5.158 -1.382 1188 HA ARG 162 HA ARG 162 26.979 -2.367 -2.567 1189 HE ARG 162 HE ARG 162 24.205 1.666 -1.071 1190 HB2 ARG 162 1HB ARG 162 24.554 -2.863 -1.690 1191 HB3 ARG 162 2HB ARG 162 25.220 -2.822 -0.073 1192 HG2 ARG 162 1HG ARG 162 25.920 -0.397 -0.412 1193 HG3 ARG 162 2HG ARG 162 25.413 -0.482 -2.112 1194 HD2 ARG 162 1HD ARG 162 23.021 -0.988 -1.363 1195 HD3 ARG 162 2HD ARG 162 23.532 -0.879 0.321 1196 HH11 ARG 162 2HH1 ARG 162 21.323 -0.009 0.085 1197 HH12 ARG 162 1HH1 ARG 162 20.504 1.609 0.262 1198 HH21 ARG 162 1HH2 ARG 162 23.139 3.470 -0.760 1199 HH22 ARG 162 2HH2 ARG 162 21.435 3.328 -0.162 Start of MODEL 4 1 HA MET 1 HA MET 1 16.067 6.122 1.412 2 H1 MET 1 1H MET 1 15.259 7.036 3.748 3 H2 MET 1 2H MET 1 15.107 8.097 2.474 4 H3 MET 1 3H MET 1 13.815 7.331 3.007 5 HB2 MET 1 1HB MET 1 13.904 4.592 3.012 6 HB3 MET 1 2HB MET 1 14.927 3.899 1.793 7 HG2 MET 1 1HG MET 1 17.000 4.277 3.189 8 HG3 MET 1 2HG MET 1 15.983 4.932 4.505 9 HE1 MET 1 3HE MET 1 16.724 2.767 6.215 10 HE2 MET 1 1HE MET 1 17.831 2.342 4.862 11 HE3 MET 1 2HE MET 1 16.744 1.104 5.555 12 H GLU 2 H GLU 2 13.379 4.428 0.618 13 HA GLU 2 HA GLU 2 11.735 6.721 -0.399 14 HB2 GLU 2 2HB GLU 2 11.458 5.962 -2.691 15 HB3 GLU 2 1HB GLU 2 13.052 6.507 -2.287 16 HG2 GLU 2 2HG GLU 2 13.236 3.646 -1.968 17 HG3 GLU 2 1HG GLU 2 12.223 3.849 -3.403 18 H LEU 3 H LEU 3 10.277 4.053 -1.751 19 HA LEU 3 HA LEU 3 8.367 4.299 0.609 20 HG LEU 3 HG LEU 3 8.604 6.119 -2.504 21 HB2 LEU 3 2HB LEU 3 6.437 4.354 -1.207 22 HB3 LEU 3 1HB LEU 3 7.248 5.722 -0.542 23 HD11 LEU 3 1HD1 LEU 3 8.371 4.773 -4.580 24 HD12 LEU 3 2HD1 LEU 3 7.145 3.713 -3.828 25 HD13 LEU 3 3HD1 LEU 3 8.838 3.684 -3.290 26 HD21 LEU 3 3HD2 LEU 3 6.580 6.617 -4.094 27 HD22 LEU 3 1HD2 LEU 3 6.449 7.241 -2.439 28 HD23 LEU 3 2HD2 LEU 3 5.567 5.770 -2.910 29 H VAL 4 H VAL 4 7.117 2.824 1.326 30 HA VAL 4 HA VAL 4 7.480 -0.001 0.289 31 HB VAL 4 HB VAL 4 7.112 1.059 3.108 32 HG11 VAL 4 1HG1 VAL 4 7.647 -1.831 2.205 33 HG12 VAL 4 2HG1 VAL 4 6.221 -1.247 3.042 34 HG13 VAL 4 3HG1 VAL 4 7.802 -1.283 3.883 35 HG21 VAL 4 3HG2 VAL 4 9.472 0.373 3.570 36 HG22 VAL 4 1HG2 VAL 4 9.329 1.710 2.429 37 HG23 VAL 4 2HG2 VAL 4 9.713 0.102 1.816 38 H SER 5 H SER 5 5.735 -1.195 -0.339 39 HA SER 5 HA SER 5 2.999 0.059 -0.119 40 HG SER 5 HG SER 5 4.599 -2.470 -2.821 41 HB2 SER 5 2HB SER 5 2.535 -1.500 -1.991 42 HB3 SER 5 1HB SER 5 3.891 -0.488 -2.271 43 H VAL 6 H VAL 6 1.168 -0.731 0.727 44 HA VAL 6 HA VAL 6 1.267 -3.170 2.490 45 HB VAL 6 HB VAL 6 1.217 -2.300 4.497 46 HG11 VAL 6 1HG1 VAL 6 2.675 -0.386 4.937 47 HG12 VAL 6 2HG1 VAL 6 2.417 0.263 3.302 48 HG13 VAL 6 3HG1 VAL 6 3.311 -1.237 3.512 49 HG21 VAL 6 3HG2 VAL 6 0.364 -0.160 5.400 50 HG22 VAL 6 1HG2 VAL 6 -0.908 -1.031 4.552 51 HG23 VAL 6 2HG2 VAL 6 -0.122 0.359 3.767 52 H ALA 7 H ALA 7 -0.160 -4.118 0.994 53 HA ALA 7 HA ALA 7 -3.114 -3.357 1.514 54 HB1 ALA 7 3HB ALA 7 -2.457 -3.300 -0.901 55 HB2 ALA 7 1HB ALA 7 -3.638 -4.576 -0.594 56 HB3 ALA 7 2HB ALA 7 -1.919 -4.989 -0.821 57 H ALA 8 H ALA 8 -4.402 -4.756 2.681 58 HA ALA 8 HA ALA 8 -3.482 -7.543 3.281 59 HB1 ALA 8 3HB ALA 8 -4.114 -6.138 5.151 60 HB2 ALA 8 1HB ALA 8 -5.333 -7.413 5.016 61 HB3 ALA 8 2HB ALA 8 -5.702 -5.779 4.483 62 H LEU 9 H LEU 9 -4.114 -9.274 2.123 63 HA LEU 9 HA LEU 9 -6.803 -9.368 0.688 64 HG LEU 9 HG LEU 9 -3.600 -9.349 -2.162 65 HB2 LEU 9 2HB LEU 9 -5.667 -9.884 -1.435 66 HB3 LEU 9 1HB LEU 9 -5.425 -8.288 -0.860 67 HD11 LEU 9 1HD1 LEU 9 -3.196 -7.312 -0.751 68 HD12 LEU 9 2HD1 LEU 9 -1.755 -8.295 -0.870 69 HD13 LEU 9 3HD1 LEU 9 -2.709 -8.356 0.606 70 HD21 LEU 9 3HD2 LEU 9 -2.016 -10.938 -1.267 71 HD22 LEU 9 1HD2 LEU 9 -3.620 -11.657 -1.100 72 HD23 LEU 9 2HD2 LEU 9 -2.790 -10.938 0.329 73 H ALA 10 H ALA 10 -7.433 -11.266 -0.414 74 HA ALA 10 HA ALA 10 -6.656 -13.782 1.169 75 HB1 ALA 10 3HB ALA 10 -9.088 -14.205 1.220 76 HB2 ALA 10 1HB ALA 10 -9.420 -12.913 0.043 77 HB3 ALA 10 2HB ALA 10 -8.822 -12.518 1.671 78 H GLU 11 H GLU 11 -8.662 -15.308 -0.568 79 HA GLU 11 HA GLU 11 -6.699 -16.553 -2.397 80 HB2 GLU 11 2HB GLU 11 -8.389 -17.860 -1.194 81 HB3 GLU 11 1HB GLU 11 -9.701 -17.003 -1.992 82 HG2 GLU 11 2HG GLU 11 -9.338 -19.358 -2.815 83 HG3 GLU 11 1HG GLU 11 -9.369 -18.140 -4.076 84 H ASN 12 H ASN 12 -7.170 -16.929 -4.734 85 HA ASN 12 HA ASN 12 -6.335 -15.789 -6.590 86 HB2 ASN 12 2HB ASN 12 -9.264 -15.053 -6.304 87 HB3 ASN 12 1HB ASN 12 -8.412 -13.927 -7.265 88 HD21 ASN 12 1HD2 ASN 12 -9.535 -17.164 -7.204 89 HD22 ASN 12 2HD2 ASN 12 -9.090 -17.501 -8.950 90 H ARG 13 H ARG 13 -5.687 -14.367 -4.070 91 HA ARG 13 HA ARG 13 -4.788 -12.470 -3.199 92 HE ARG 13 HE ARG 13 -0.527 -14.076 -6.143 93 HB2 ARG 13 2HB ARG 13 -2.889 -11.421 -4.112 94 HB3 ARG 13 1HB ARG 13 -2.848 -13.145 -4.429 95 HG2 ARG 13 2HG ARG 13 -3.794 -12.454 -6.859 96 HG3 ARG 13 1HG ARG 13 -3.252 -10.870 -6.442 97 HD2 ARG 13 2HD ARG 13 -1.436 -11.808 -7.686 98 HD3 ARG 13 1HD ARG 13 -0.878 -11.769 -6.040 99 HH11 ARG 13 2HH1 ARG 13 -3.087 -13.391 -8.401 100 HH12 ARG 13 1HH1 ARG 13 -3.159 -15.101 -9.001 101 HH21 ARG 13 1HH2 ARG 13 -0.653 -15.991 -6.793 102 HH22 ARG 13 2HH2 ARG 13 -1.818 -16.527 -8.098 103 H VAL 14 H VAL 14 -7.074 -12.097 -3.271 104 HA VAL 14 HA VAL 14 -8.092 -9.710 -4.771 105 HB VAL 14 HB VAL 14 -9.241 -11.756 -2.777 106 HG11 VAL 14 1HG1 VAL 14 -10.876 -9.313 -3.698 107 HG12 VAL 14 2HG1 VAL 14 -10.457 -9.762 -2.023 108 HG13 VAL 14 3HG1 VAL 14 -11.507 -10.818 -2.959 109 HG21 VAL 14 3HG2 VAL 14 -9.028 -12.319 -5.242 110 HG22 VAL 14 1HG2 VAL 14 -10.030 -10.933 -5.676 111 HG23 VAL 14 2HG2 VAL 14 -10.722 -12.273 -4.709 112 H ILE 15 H ILE 15 -7.494 -7.718 -4.175 113 HA ILE 15 HA ILE 15 -6.830 -6.781 -1.399 114 HB ILE 15 HB ILE 15 -7.668 -5.085 -3.783 115 HG12 ILE 15 2HG1 ILE 15 -4.730 -5.279 -2.883 116 HG13 ILE 15 1HG1 ILE 15 -5.399 -6.542 -3.887 117 HG21 ILE 15 1HG2 ILE 15 -7.856 -3.807 -1.613 118 HG22 ILE 15 2HG2 ILE 15 -6.530 -3.157 -2.563 119 HG23 ILE 15 3HG2 ILE 15 -6.189 -4.224 -1.183 120 HD11 ILE 15 3HD1 ILE 15 -5.938 -5.027 -5.730 121 HD12 ILE 15 1HD1 ILE 15 -4.258 -4.756 -5.270 122 HD13 ILE 15 2HD1 ILE 15 -5.513 -3.603 -4.759 123 H GLY 16 H GLY 16 -9.750 -6.216 -3.379 124 HA2 GLY 16 2HA GLY 16 -11.449 -7.306 -1.406 125 HA3 GLY 16 1HA GLY 16 -11.503 -5.563 -1.055 126 H ARG 17 H ARG 17 -13.483 -5.152 -1.548 127 HA ARG 17 HA ARG 17 -14.615 -5.610 -4.325 128 HE ARG 17 HE ARG 17 -17.032 -9.703 -1.246 129 HB2 ARG 17 2HB ARG 17 -16.067 -6.517 -1.749 130 HB3 ARG 17 1HB ARG 17 -16.944 -5.971 -3.141 131 HG2 ARG 17 2HG ARG 17 -16.915 -8.008 -4.002 132 HG3 ARG 17 1HG ARG 17 -15.274 -7.783 -4.435 133 HD2 ARG 17 2HD ARG 17 -14.704 -9.604 -3.113 134 HD3 ARG 17 1HD ARG 17 -14.941 -8.608 -1.731 135 HH11 ARG 17 2HH1 ARG 17 -16.314 -10.325 -4.581 136 HH12 ARG 17 1HH1 ARG 17 -17.429 -11.753 -4.680 137 HH21 ARG 17 1HH2 ARG 17 -18.349 -11.297 -1.391 138 HH22 ARG 17 2HH2 ARG 17 -18.544 -12.259 -2.934 139 H ASP 18 H ASP 18 -15.819 -3.957 -1.361 140 HA ASP 18 HA ASP 18 -16.721 -1.706 -2.891 141 HB2 ASP 18 2HB ASP 18 -16.372 -2.033 0.152 142 HB3 ASP 18 1HB ASP 18 -17.222 -0.724 -0.641 143 H GLY 19 H GLY 19 -13.961 -1.496 -0.544 144 HA2 GLY 19 2HA GLY 19 -12.734 0.722 -2.311 145 HA3 GLY 19 1HA GLY 19 -12.969 1.061 -0.609 146 H GLU 20 H GLU 20 -11.462 0.136 0.864 147 HA GLU 20 HA GLU 20 -9.029 -1.231 -0.265 148 HB2 GLU 20 2HB GLU 20 -8.100 -1.348 1.934 149 HB3 GLU 20 1HB GLU 20 -8.382 0.269 1.393 150 HG2 GLU 20 2HG GLU 20 -10.262 -1.127 3.425 151 HG3 GLU 20 1HG GLU 20 -8.819 -0.259 3.914 152 H LEU 21 H LEU 21 -11.482 -2.401 2.115 153 HA LEU 21 HA LEU 21 -10.541 -5.221 1.297 154 HG LEU 21 HG LEU 21 -9.376 -3.150 3.499 155 HB2 LEU 21 2HB LEU 21 -11.586 -4.723 4.059 156 HB3 LEU 21 1HB LEU 21 -10.531 -5.969 3.516 157 HD11 LEU 21 1HD1 LEU 21 -9.057 -2.983 5.884 158 HD12 LEU 21 2HD1 LEU 21 -9.781 -4.584 6.182 159 HD13 LEU 21 3HD1 LEU 21 -10.797 -3.240 5.617 160 HD21 LEU 21 3HD2 LEU 21 -7.354 -4.219 4.205 161 HD22 LEU 21 1HD2 LEU 21 -8.014 -5.225 2.887 162 HD23 LEU 21 2HD2 LEU 21 -8.180 -5.759 4.576 163 HA PRO 22 HA PRO 22 -15.028 -6.533 1.058 164 HB2 PRO 22 2HB PRO 22 -14.164 -9.176 2.277 165 HB3 PRO 22 1HB PRO 22 -14.969 -8.846 0.735 166 HG2 PRO 22 2HG PRO 22 -12.321 -9.621 0.840 167 HG3 PRO 22 1HG PRO 22 -12.885 -8.437 -0.363 168 HD2 PRO 22 2HD PRO 22 -11.555 -7.820 2.360 169 HD3 PRO 22 1HD PRO 22 -11.088 -7.234 0.754 170 H TRP 23 H TRP 23 -13.253 -6.637 3.963 171 HA TRP 23 HA TRP 23 -15.746 -6.620 5.739 172 HD1 TRP 23 HD1 TRP 23 -11.575 -6.012 7.225 173 HE1 TRP 23 HE1 TRP 23 -9.451 -6.688 5.863 174 HE3 TRP 23 HE3 TRP 23 -13.584 -10.004 4.878 175 HZ2 TRP 23 HZ2 TRP 23 -8.817 -8.723 4.097 176 HZ3 TRP 23 HZ3 TRP 23 -12.239 -11.066 3.099 177 HH2 TRP 23 HH2 TRP 23 -9.891 -10.456 2.728 178 HB2 TRP 23 2HB TRP 23 -14.162 -7.295 7.682 179 HB3 TRP 23 1HB TRP 23 -14.522 -8.542 6.517 180 HA PRO 24 HA PRO 24 -14.843 -2.306 6.321 181 HB2 PRO 24 2HB PRO 24 -15.065 -2.455 9.340 182 HB3 PRO 24 1HB PRO 24 -15.978 -1.468 8.190 183 HG2 PRO 24 2HG PRO 24 -17.135 -3.672 9.369 184 HG3 PRO 24 1HG PRO 24 -17.455 -3.311 7.655 185 HD2 PRO 24 2HD PRO 24 -15.446 -5.334 8.779 186 HD3 PRO 24 1HD PRO 24 -16.639 -5.543 7.455 187 H SER 25 H SER 25 -13.028 -4.001 8.807 188 HA SER 25 HA SER 25 -10.406 -3.423 8.270 189 HG SER 25 HG SER 25 -10.942 -1.060 7.305 190 HB2 SER 25 2HB SER 25 -11.482 -0.872 9.612 191 HB3 SER 25 1HB SER 25 -9.834 -1.413 9.918 192 H ILE 26 H ILE 26 -9.888 -5.141 9.444 193 HA ILE 26 HA ILE 26 -10.836 -5.644 12.197 194 HB ILE 26 HB ILE 26 -9.022 -7.403 12.360 195 HG12 ILE 26 2HG1 ILE 26 -7.983 -6.246 9.940 196 HG13 ILE 26 1HG1 ILE 26 -7.317 -7.462 10.958 197 HG21 ILE 26 1HG2 ILE 26 -11.378 -7.917 11.965 198 HG22 ILE 26 2HG2 ILE 26 -10.317 -9.060 11.116 199 HG23 ILE 26 3HG2 ILE 26 -11.162 -7.783 10.210 200 HD11 ILE 26 3HD1 ILE 26 -7.447 -8.123 8.536 201 HD12 ILE 26 1HD1 ILE 26 -9.207 -8.033 8.573 202 HD13 ILE 26 2HD1 ILE 26 -8.368 -9.264 9.557 203 HA PRO 27 HA PRO 27 -8.012 -2.967 14.517 204 HB2 PRO 27 2HB PRO 27 -8.163 -5.128 16.685 205 HB3 PRO 27 1HB PRO 27 -8.317 -3.357 16.832 206 HG2 PRO 27 2HG PRO 27 -10.607 -4.812 16.771 207 HG3 PRO 27 1HG PRO 27 -10.501 -3.360 15.738 208 HD2 PRO 27 2HD PRO 27 -10.075 -6.266 14.848 209 HD3 PRO 27 1HD PRO 27 -11.091 -4.960 14.137 210 H ALA 28 H ALA 28 -6.686 -6.357 14.647 211 HA ALA 28 HA ALA 28 -3.930 -5.648 14.731 212 HB1 ALA 28 3HB ALA 28 -5.312 -7.885 13.163 213 HB2 ALA 28 1HB ALA 28 -4.546 -7.915 14.781 214 HB3 ALA 28 2HB ALA 28 -3.552 -7.769 13.326 215 H ASP 29 H ASP 29 -5.938 -5.330 11.794 216 HA ASP 29 HA ASP 29 -3.679 -4.431 10.023 217 HB2 ASP 29 2HB ASP 29 -5.620 -5.690 9.123 218 HB3 ASP 29 1HB ASP 29 -6.745 -4.456 9.686 219 H LYS 30 H LYS 30 -6.619 -2.694 11.152 220 HA LYS 30 HA LYS 30 -5.562 -0.098 10.786 221 HB2 LYS 30 2HB LYS 30 -8.026 -1.087 11.586 222 HB3 LYS 30 1HB LYS 30 -7.529 -0.304 13.048 223 HG2 LYS 30 2HG LYS 30 -8.899 1.250 11.809 224 HG3 LYS 30 1HG LYS 30 -7.267 1.897 11.738 225 HD2 LYS 30 2HD LYS 30 -7.021 1.051 9.380 226 HD3 LYS 30 1HD LYS 30 -8.487 0.190 9.448 227 HE2 LYS 30 2HE LYS 30 -8.414 3.307 9.703 228 HE3 LYS 30 1HE LYS 30 -8.397 2.494 8.166 229 HZ1 LYS 30 3HZ LYS 30 -10.739 3.047 8.968 230 HZ2 LYS 30 1HZ LYS 30 -10.624 2.029 10.164 231 HZ3 LYS 30 2HZ LYS 30 -10.574 1.467 8.560 232 H LYS 31 H LYS 31 -4.552 -2.063 13.295 233 HA LYS 31 HA LYS 31 -2.935 0.101 14.746 234 HB2 LYS 31 2HB LYS 31 -4.098 -1.475 16.234 235 HB3 LYS 31 1HB LYS 31 -3.433 -2.834 15.371 236 HG2 LYS 31 2HG LYS 31 -2.414 -2.708 17.496 237 HG3 LYS 31 1HG LYS 31 -1.250 -2.646 16.230 238 HD2 LYS 31 2HD LYS 31 -2.212 0.004 17.490 239 HD3 LYS 31 1HD LYS 31 -1.252 -1.057 18.488 240 HE2 LYS 31 2HE LYS 31 0.416 -1.075 16.286 241 HE3 LYS 31 1HE LYS 31 -0.414 0.429 15.951 242 HZ1 LYS 31 3HZ LYS 31 0.251 1.220 18.254 243 HZ2 LYS 31 1HZ LYS 31 1.548 0.871 17.286 244 HZ3 LYS 31 2HZ LYS 31 1.119 -0.175 18.482 245 H GLN 32 H GLN 32 -2.342 -2.876 12.677 246 HA GLN 32 HA GLN 32 0.609 -2.537 12.674 247 HB2 GLN 32 2HB GLN 32 -0.339 -4.734 12.171 248 HB3 GLN 32 1HB GLN 32 -1.213 -4.078 10.794 249 HG2 GLN 32 2HG GLN 32 1.155 -3.474 9.758 250 HG3 GLN 32 1HG GLN 32 1.852 -4.450 11.041 251 HE21 GLN 32 1HE2 GLN 32 -0.020 -4.552 8.081 252 HE22 GLN 32 2HE2 GLN 32 -0.108 -6.385 8.050 253 H TYR 33 H TYR 33 -1.936 -1.608 10.266 254 HA TYR 33 HA TYR 33 -0.203 0.079 8.624 255 HD1 TYR 33 HD1 TYR 33 -3.952 1.129 10.259 256 HD2 TYR 33 HD2 TYR 33 -2.711 2.048 6.270 257 HE1 TYR 33 HE1 TYR 33 -5.478 3.074 10.224 258 HE2 TYR 33 HE2 TYR 33 -4.216 4.017 6.276 259 HH TYR 33 HH TYR 33 -5.555 5.356 7.480 260 HB2 TYR 33 2HB TYR 33 -2.008 -0.093 7.347 261 HB3 TYR 33 1HB TYR 33 -3.019 -0.655 8.605 262 H ARG 34 H ARG 34 -1.862 0.973 11.699 263 HA ARG 34 HA ARG 34 -0.692 3.745 11.413 264 HE ARG 34 HE ARG 34 -5.490 5.918 11.750 265 HB2 ARG 34 2HB ARG 34 -2.373 2.518 13.657 266 HB3 ARG 34 1HB ARG 34 -1.564 4.077 13.828 267 HG2 ARG 34 2HG ARG 34 -2.701 4.789 11.570 268 HG3 ARG 34 1HG ARG 34 -3.620 3.330 11.674 269 HD2 ARG 34 2HD ARG 34 -5.061 4.051 13.323 270 HD3 ARG 34 1HD ARG 34 -3.870 4.998 14.181 271 HH11 ARG 34 2HH1 ARG 34 -2.739 6.681 13.694 272 HH12 ARG 34 1HH1 ARG 34 -2.663 8.380 13.045 273 HH21 ARG 34 1HH2 ARG 34 -5.333 7.799 10.990 274 HH22 ARG 34 2HH2 ARG 34 -4.081 8.969 11.575 275 H SER 35 H SER 35 0.620 0.922 12.958 276 HA SER 35 HA SER 35 3.028 2.660 13.807 277 HG SER 35 HG SER 35 3.107 2.316 15.864 278 HB2 SER 35 2HB SER 35 2.321 -0.179 14.660 279 HB3 SER 35 1HB SER 35 3.965 0.447 14.761 280 H ARG 36 H ARG 36 2.015 1.119 11.115 281 HA ARG 36 HA ARG 36 4.856 1.131 9.968 282 HE ARG 36 HE ARG 36 5.646 -3.269 8.107 283 HB2 ARG 36 2HB ARG 36 2.886 -0.711 9.475 284 HB3 ARG 36 1HB ARG 36 2.291 0.514 8.405 285 HG2 ARG 36 2HG ARG 36 3.583 -1.058 7.120 286 HG3 ARG 36 1HG ARG 36 4.367 0.484 7.115 287 HD2 ARG 36 2HD ARG 36 6.114 -1.098 7.289 288 HD3 ARG 36 1HD ARG 36 6.080 -0.433 8.877 289 HH11 ARG 36 2HH1 ARG 36 4.892 -1.076 10.676 290 HH12 ARG 36 1HH1 ARG 36 4.679 -2.499 11.808 291 HH21 ARG 36 1HH2 ARG 36 5.388 -4.679 9.307 292 HH22 ARG 36 2HH2 ARG 36 4.840 -4.496 11.046 293 H VAL 37 H VAL 37 1.617 2.629 9.171 294 HA VAL 37 HA VAL 37 3.104 4.782 7.670 295 HB VAL 37 HB VAL 37 1.519 4.887 6.139 296 HG11 VAL 37 1HG1 VAL 37 0.873 1.960 6.798 297 HG12 VAL 37 2HG1 VAL 37 2.381 2.502 6.033 298 HG13 VAL 37 3HG1 VAL 37 0.838 2.733 5.190 299 HG21 VAL 37 3HG2 VAL 37 -0.559 5.454 7.189 300 HG22 VAL 37 1HG2 VAL 37 -0.715 3.886 7.979 301 HG23 VAL 37 2HG2 VAL 37 -0.934 4.011 6.231 302 H ALA 38 H ALA 38 1.596 4.956 10.697 303 HA ALA 38 HA ALA 38 -0.142 7.313 10.177 304 HB1 ALA 38 3HB ALA 38 0.899 6.371 12.879 305 HB2 ALA 38 1HB ALA 38 -0.615 5.867 12.092 306 HB3 ALA 38 2HB ALA 38 -0.379 7.556 12.605 307 H ASP 39 H ASP 39 3.221 7.138 11.209 308 HA ASP 39 HA ASP 39 3.599 10.118 11.292 309 HB2 ASP 39 2HB ASP 39 5.271 7.661 11.945 310 HB3 ASP 39 1HB ASP 39 6.134 9.008 11.280 311 H ASP 40 H ASP 40 4.575 7.472 9.033 312 HA ASP 40 HA ASP 40 5.633 9.300 7.114 313 HB2 ASP 40 2HB ASP 40 5.091 6.302 7.207 314 HB3 ASP 40 1HB ASP 40 5.898 7.018 5.816 315 HA PRO 41 HA PRO 41 2.219 10.203 4.133 316 HB2 PRO 41 2HB PRO 41 4.582 10.097 2.147 317 HB3 PRO 41 1HB PRO 41 3.258 11.262 2.189 318 HG2 PRO 41 2HG PRO 41 5.599 12.005 3.312 319 HG3 PRO 41 1HG PRO 41 4.162 12.227 4.333 320 HD2 PRO 41 2HD PRO 41 6.131 9.882 4.454 321 HD3 PRO 41 1HD PRO 41 5.465 10.895 5.765 322 H VAL 42 H VAL 42 0.774 9.016 2.988 323 HA VAL 42 HA VAL 42 1.676 6.409 1.713 324 HB VAL 42 HB VAL 42 -1.089 7.240 2.706 325 HG11 VAL 42 1HG1 VAL 42 -1.698 4.842 2.530 326 HG12 VAL 42 2HG1 VAL 42 -0.084 4.400 1.933 327 HG13 VAL 42 3HG1 VAL 42 -1.178 5.379 0.922 328 HG21 VAL 42 3HG2 VAL 42 -0.445 5.347 4.486 329 HG22 VAL 42 1HG2 VAL 42 0.325 6.937 4.692 330 HG23 VAL 42 2HG2 VAL 42 1.226 5.612 3.955 331 H VAL 43 H VAL 43 1.656 6.029 -0.392 332 HA VAL 43 HA VAL 43 0.096 7.773 -2.325 333 HB VAL 43 HB VAL 43 1.597 7.219 -4.066 334 HG11 VAL 43 1HG1 VAL 43 3.869 7.850 -3.244 335 HG12 VAL 43 2HG1 VAL 43 3.437 7.467 -1.577 336 HG13 VAL 43 3HG1 VAL 43 2.674 8.829 -2.351 337 HG21 VAL 43 3HG2 VAL 43 2.913 5.122 -2.255 338 HG22 VAL 43 1HG2 VAL 43 3.538 5.606 -3.828 339 HG23 VAL 43 2HG2 VAL 43 1.992 4.776 -3.749 340 H LEU 44 H LEU 44 -1.843 7.179 -3.049 341 HA LEU 44 HA LEU 44 -2.530 4.230 -3.476 342 HG LEU 44 HG LEU 44 -4.461 7.087 -1.993 343 HB2 LEU 44 2HB LEU 44 -4.400 4.270 -1.974 344 HB3 LEU 44 1HB LEU 44 -2.948 4.567 -1.122 345 HD11 LEU 44 1HD1 LEU 44 -6.061 6.930 -0.053 346 HD12 LEU 44 2HD1 LEU 44 -5.504 5.278 0.306 347 HD13 LEU 44 3HD1 LEU 44 -6.370 5.632 -1.209 348 HD21 LEU 44 3HD2 LEU 44 -3.811 7.902 0.229 349 HD22 LEU 44 1HD2 LEU 44 -2.397 7.201 -0.582 350 HD23 LEU 44 2HD2 LEU 44 -3.241 6.306 0.738 351 H GLY 45 H GLY 45 -5.127 4.054 -3.936 352 HA2 GLY 45 2HA GLY 45 -5.231 5.296 -6.742 353 HA3 GLY 45 1HA GLY 45 -5.972 3.778 -6.260 354 H ARG 46 H ARG 46 -7.777 4.806 -7.454 355 HA ARG 46 HA ARG 46 -9.520 6.529 -5.593 356 HE ARG 46 HE ARG 46 -11.974 8.870 -7.220 357 HB2 ARG 46 2HB ARG 46 -9.950 6.112 -8.589 358 HB3 ARG 46 1HB ARG 46 -11.158 6.745 -7.526 359 HG2 ARG 46 2HG ARG 46 -8.373 8.038 -7.862 360 HG3 ARG 46 1HG ARG 46 -9.776 8.532 -8.788 361 HD2 ARG 46 2HD ARG 46 -9.545 8.757 -5.699 362 HD3 ARG 46 1HD ARG 46 -9.258 10.054 -6.864 363 HH11 ARG 46 2HH1 ARG 46 -10.275 10.886 -4.990 364 HH12 ARG 46 1HH1 ARG 46 -11.813 11.741 -4.487 365 HH21 ARG 46 1HH2 ARG 46 -13.654 9.748 -6.548 366 HH22 ARG 46 2HH2 ARG 46 -13.640 11.149 -5.378 367 H THR 47 H THR 47 -9.344 3.208 -6.898 368 HA THR 47 HA THR 47 -11.677 2.256 -5.506 369 HB THR 47 HB THR 47 -9.009 0.729 -5.454 370 HG1 THR 47 HG1 THR 47 -10.976 0.547 -7.462 371 HG21 THR 47 3HG2 THR 47 -10.364 -1.270 -5.457 372 HG22 THR 47 1HG2 THR 47 -11.867 -0.394 -5.859 373 HG23 THR 47 2HG2 THR 47 -11.119 -0.239 -4.250 374 H THR 48 H THR 48 -8.404 2.077 -3.954 375 HA THR 48 HA THR 48 -9.300 2.097 -1.228 376 HB THR 48 HB THR 48 -6.933 2.757 -0.650 377 HG1 THR 48 HG1 THR 48 -6.606 4.089 -2.393 378 HG21 THR 48 3HG2 THR 48 -7.378 0.331 -1.055 379 HG22 THR 48 1HG2 THR 48 -5.740 0.837 -1.496 380 HG23 THR 48 2HG2 THR 48 -6.944 0.526 -2.772 381 H PHE 49 H PHE 49 -8.811 5.043 -3.192 382 HA PHE 49 HA PHE 49 -8.775 6.800 -0.720 383 HD1 PHE 49 HD2 PHE 49 -10.298 9.749 -2.535 384 HD2 PHE 49 HD1 PHE 49 -6.221 9.033 -1.419 385 HE1 PHE 49 HE2 PHE 49 -10.090 12.091 -1.773 386 HE2 PHE 49 HE1 PHE 49 -5.971 11.416 -0.836 387 HZ PHE 49 HZ PHE 49 -7.890 12.919 -0.954 388 HB2 PHE 49 2HB PHE 49 -7.341 7.385 -2.673 389 HB3 PHE 49 1HB PHE 49 -8.772 7.819 -3.590 390 H GLU 50 H GLU 50 -11.184 5.850 -3.069 391 HA GLU 50 HA GLU 50 -13.187 7.863 -2.119 392 HB2 GLU 50 2HB GLU 50 -13.540 5.380 -3.905 393 HB3 GLU 50 1HB GLU 50 -14.848 6.458 -3.422 394 HG2 GLU 50 2HG GLU 50 -13.763 8.421 -4.453 395 HG3 GLU 50 1HG GLU 50 -12.316 7.525 -4.834 396 H SER 51 H SER 51 -12.411 4.506 -1.098 397 HA SER 51 HA SER 51 -13.843 4.773 1.485 398 HG SER 51 HG SER 51 -12.575 1.740 2.294 399 HB2 SER 51 2HB SER 51 -11.769 2.968 0.364 400 HB3 SER 51 1HB SER 51 -11.327 3.466 1.963 401 H MET 52 H MET 52 -10.317 5.400 1.076 402 HA MET 52 HA MET 52 -9.798 6.391 3.599 403 HB2 MET 52 2HB MET 52 -8.176 5.770 1.633 404 HB3 MET 52 1HB MET 52 -8.289 7.488 1.151 405 HG2 MET 52 2HG MET 52 -6.285 7.356 2.408 406 HG3 MET 52 1HG MET 52 -7.433 8.100 3.498 407 HE1 MET 52 3HE MET 52 -5.247 4.242 4.083 408 HE2 MET 52 1HE MET 52 -5.110 5.409 2.729 409 HE3 MET 52 2HE MET 52 -6.368 4.113 2.676 410 H ARG 53 H ARG 53 -11.143 8.417 1.314 411 HA ARG 53 HA ARG 53 -10.944 11.093 2.592 412 HE ARG 53 HE ARG 53 -15.281 11.432 -1.142 413 HB2 ARG 53 2HB ARG 53 -11.467 10.701 0.243 414 HB3 ARG 53 1HB ARG 53 -12.883 9.714 0.653 415 HG2 ARG 53 2HG ARG 53 -14.145 11.542 1.435 416 HG3 ARG 53 1HG ARG 53 -12.784 12.594 1.586 417 HD2 ARG 53 2HD ARG 53 -12.976 13.369 -0.595 418 HD3 ARG 53 1HD ARG 53 -12.859 11.771 -1.241 419 HH11 ARG 53 2HH1 ARG 53 -14.472 14.479 0.315 420 HH12 ARG 53 1HH1 ARG 53 -16.190 15.078 0.217 421 HH21 ARG 53 1HH2 ARG 53 -17.205 12.141 -1.244 422 HH22 ARG 53 2HH2 ARG 53 -17.666 13.785 -0.601 423 H ASP 54 H ASP 54 -12.512 8.272 3.759 424 HA ASP 54 HA ASP 54 -13.887 9.909 5.911 425 HB2 ASP 54 2HB ASP 54 -14.875 7.650 4.529 426 HB3 ASP 54 1HB ASP 54 -14.194 6.920 5.955 427 H ASP 55 H ASP 55 -12.052 6.777 6.245 428 HA ASP 55 HA ASP 55 -10.516 7.972 8.520 429 HB2 ASP 55 2HB ASP 55 -11.001 5.177 7.560 430 HB3 ASP 55 1HB ASP 55 -9.373 5.435 8.017 431 H LEU 56 H LEU 56 -8.861 9.216 8.247 432 HA LEU 56 HA LEU 56 -7.229 9.222 5.806 433 HG LEU 56 HG LEU 56 -7.521 12.812 6.771 434 HB2 LEU 56 2HB LEU 56 -6.438 10.874 8.223 435 HB3 LEU 56 1HB LEU 56 -6.079 11.110 6.545 436 HD11 LEU 56 1HD1 LEU 56 -9.705 10.712 6.194 437 HD12 LEU 56 2HD1 LEU 56 -8.670 11.476 4.968 438 HD13 LEU 56 3HD1 LEU 56 -9.797 12.449 5.914 439 HD21 LEU 56 3HD2 LEU 56 -9.409 13.009 8.319 440 HD22 LEU 56 1HD2 LEU 56 -7.953 12.457 9.167 441 HD23 LEU 56 2HD2 LEU 56 -9.256 11.294 8.788 442 HA PRO 57 HA PRO 57 -3.962 6.401 7.316 443 HB2 PRO 57 2HB PRO 57 -2.173 6.516 5.303 444 HB3 PRO 57 1HB PRO 57 -3.836 6.004 5.049 445 HG2 PRO 57 2HG PRO 57 -2.615 8.732 4.395 446 HG3 PRO 57 1HG PRO 57 -3.740 7.749 3.418 447 HD2 PRO 57 2HD PRO 57 -4.467 9.877 5.172 448 HD3 PRO 57 1HD PRO 57 -5.592 8.633 4.552 449 H GLY 58 H GLY 58 -1.730 8.836 6.162 450 HA2 GLY 58 2HA GLY 58 -0.458 9.017 8.983 451 HA3 GLY 58 1HA GLY 58 0.505 8.903 7.515 452 H SER 59 H SER 59 1.505 10.816 8.492 453 HA SER 59 HA SER 59 0.437 13.457 8.353 454 HG SER 59 HG SER 59 3.801 14.535 8.403 455 HB2 SER 59 2HB SER 59 2.750 12.631 9.135 456 HB3 SER 59 1HB SER 59 3.241 12.570 7.439 457 H ALA 60 H ALA 60 0.518 11.472 5.577 458 HA ALA 60 HA ALA 60 -0.666 13.649 4.016 459 HB1 ALA 60 3HB ALA 60 2.166 12.819 3.186 460 HB2 ALA 60 1HB ALA 60 1.502 14.430 3.468 461 HB3 ALA 60 2HB ALA 60 1.034 13.526 2.007 462 H GLN 61 H GLN 61 -1.514 13.178 1.978 463 HA GLN 61 HA GLN 61 -2.174 10.221 1.463 464 HB2 GLN 61 2HB GLN 61 -3.826 11.947 2.856 465 HB3 GLN 61 1HB GLN 61 -4.294 12.413 1.236 466 HG2 GLN 61 2HG GLN 61 -4.924 10.008 0.726 467 HG3 GLN 61 1HG GLN 61 -4.416 9.538 2.309 468 HE21 GLN 61 1HE2 GLN 61 -5.634 11.476 3.980 469 HE22 GLN 61 2HE2 GLN 61 -7.426 11.059 3.807 470 H ILE 62 H ILE 62 -1.256 9.884 -0.462 471 HA ILE 62 HA ILE 62 -1.303 11.994 -2.687 472 HB ILE 62 HB ILE 62 0.549 9.694 -1.939 473 HG12 ILE 62 2HG1 ILE 62 1.412 12.517 -2.499 474 HG13 ILE 62 1HG1 ILE 62 0.662 12.201 -0.942 475 HG21 ILE 62 1HG2 ILE 62 1.965 10.161 -3.923 476 HG22 ILE 62 2HG2 ILE 62 0.790 11.393 -4.489 477 HG23 ILE 62 3HG2 ILE 62 0.368 9.660 -4.494 478 HD11 ILE 62 3HD1 ILE 62 3.036 12.112 -0.620 479 HD12 ILE 62 1HD1 ILE 62 3.306 11.105 -2.046 480 HD13 ILE 62 2HD1 ILE 62 2.561 10.417 -0.556 481 H VAL 63 H VAL 63 -2.845 11.612 -4.289 482 HA VAL 63 HA VAL 63 -3.375 8.717 -5.066 483 HB VAL 63 HB VAL 63 -4.921 11.179 -5.874 484 HG11 VAL 63 1HG1 VAL 63 -4.988 9.538 -7.819 485 HG12 VAL 63 2HG1 VAL 63 -6.555 9.524 -6.983 486 HG13 VAL 63 3HG1 VAL 63 -5.379 8.217 -6.709 487 HG21 VAL 63 3HG2 VAL 63 -5.292 10.275 -3.557 488 HG22 VAL 63 1HG2 VAL 63 -5.568 8.645 -4.187 489 HG23 VAL 63 2HG2 VAL 63 -6.739 9.958 -4.517 490 H MET 64 H MET 64 -2.168 7.686 -6.392 491 HA MET 64 HA MET 64 -0.791 8.916 -8.753 492 HB2 MET 64 2HB MET 64 -1.042 6.099 -7.530 493 HB3 MET 64 1HB MET 64 -0.584 6.251 -9.192 494 HG2 MET 64 2HG MET 64 1.147 8.181 -7.951 495 HG3 MET 64 1HG MET 64 1.038 6.889 -6.768 496 HE1 MET 64 3HE MET 64 1.727 8.038 -10.375 497 HE2 MET 64 1HE MET 64 0.861 6.577 -10.945 498 HE3 MET 64 2HE MET 64 2.633 6.681 -11.118 499 H SER 65 H SER 65 -2.239 9.884 -9.944 500 HA SER 65 HA SER 65 -3.771 8.281 -11.927 501 HG SER 65 HG SER 65 -6.625 8.205 -11.663 502 HB2 SER 65 2HB SER 65 -5.418 8.449 -9.921 503 HB3 SER 65 1HB SER 65 -5.429 10.196 -10.124 504 H ARG 66 H ARG 66 -5.232 10.146 -13.168 505 HA ARG 66 HA ARG 66 -3.700 12.801 -13.317 506 HE ARG 66 HE ARG 66 -2.864 11.031 -18.066 507 HB2 ARG 66 2HB ARG 66 -4.662 11.179 -15.758 508 HB3 ARG 66 1HB ARG 66 -4.537 12.919 -15.824 509 HG2 ARG 66 2HG ARG 66 -2.039 12.377 -14.727 510 HG3 ARG 66 1HG ARG 66 -2.285 10.883 -15.564 511 HD2 ARG 66 2HD ARG 66 -2.345 13.751 -16.728 512 HD3 ARG 66 1HD ARG 66 -1.010 12.622 -16.904 513 HH11 ARG 66 2HH1 ARG 66 -2.592 14.437 -18.592 514 HH12 ARG 66 1HH1 ARG 66 -3.794 14.413 -19.961 515 HH21 ARG 66 1HH2 ARG 66 -4.256 11.020 -19.571 516 HH22 ARG 66 2HH2 ARG 66 -4.704 12.533 -20.482 517 H SER 67 H SER 67 -5.909 12.073 -11.675 518 HA SER 67 HA SER 67 -8.157 13.885 -12.529 519 HG SER 67 HG SER 67 -9.663 12.917 -9.462 520 HB2 SER 67 2HB SER 67 -8.321 11.798 -11.026 521 HB3 SER 67 1HB SER 67 -7.442 12.695 -9.763 522 H GLU 68 H GLU 68 -8.704 15.406 -10.359 523 HA GLU 68 HA GLU 68 -6.657 17.674 -10.461 524 HB2 GLU 68 2HB GLU 68 -9.594 17.542 -9.518 525 HB3 GLU 68 1HB GLU 68 -8.579 18.889 -9.150 526 HG2 GLU 68 2HG GLU 68 -8.259 18.546 -12.015 527 HG3 GLU 68 1HG GLU 68 -9.960 18.324 -11.663 528 H ARG 69 H ARG 69 -6.970 18.926 -8.220 529 HA ARG 69 HA ARG 69 -5.513 17.259 -6.125 530 HE ARG 69 HE ARG 69 -4.461 23.409 -8.447 531 HB2 ARG 69 2HB ARG 69 -4.032 19.108 -5.619 532 HB3 ARG 69 1HB ARG 69 -3.881 18.741 -7.308 533 HG2 ARG 69 2HG ARG 69 -5.943 20.819 -7.055 534 HG3 ARG 69 1HG ARG 69 -4.689 21.288 -5.944 535 HD2 ARG 69 2HD ARG 69 -3.042 21.612 -7.635 536 HD3 ARG 69 1HD ARG 69 -3.786 20.504 -8.775 537 HH11 ARG 69 2HH1 ARG 69 -5.792 20.368 -9.481 538 HH12 ARG 69 1HH1 ARG 69 -7.149 21.204 -10.359 539 HH21 ARG 69 1HH2 ARG 69 -6.025 24.300 -9.526 540 HH22 ARG 69 2HH2 ARG 69 -7.229 23.261 -10.438 541 H SER 70 H SER 70 -5.972 17.786 -3.972 542 HA SER 70 HA SER 70 -6.912 18.812 -2.089 543 HG SER 70 HG SER 70 -7.500 21.046 -1.065 544 HB2 SER 70 2HB SER 70 -6.594 21.066 -3.117 545 HB3 SER 70 1HB SER 70 -8.211 20.960 -3.824 546 H PHE 71 H PHE 71 -8.196 17.428 -1.236 547 HA PHE 71 HA PHE 71 -10.864 16.674 -2.609 548 HD1 PHE 71 HD2 PHE 71 -6.887 15.413 -2.218 549 HD2 PHE 71 HD1 PHE 71 -10.167 13.774 -4.462 550 HE1 PHE 71 HE2 PHE 71 -5.314 14.481 -3.868 551 HE2 PHE 71 HE1 PHE 71 -8.552 12.807 -6.072 552 HZ PHE 71 HZ PHE 71 -6.145 13.162 -5.772 553 HB2 PHE 71 2HB PHE 71 -9.087 14.711 -1.115 554 HB3 PHE 71 1HB PHE 71 -10.465 14.355 -2.087 555 H SER 72 H SER 72 -9.427 16.624 0.697 556 HA SER 72 HA SER 72 -11.993 17.241 1.925 557 HG SER 72 HG SER 72 -13.724 15.674 2.439 558 HB2 SER 72 2HB SER 72 -11.301 14.290 1.918 559 HB3 SER 72 1HB SER 72 -11.932 14.941 3.414 560 H VAL 73 H VAL 73 -9.028 15.495 3.061 561 HA VAL 73 HA VAL 73 -8.826 17.440 5.388 562 HB VAL 73 HB VAL 73 -8.470 15.013 5.799 563 HG11 VAL 73 1HG1 VAL 73 -5.857 15.265 4.187 564 HG12 VAL 73 2HG1 VAL 73 -7.251 14.211 3.812 565 HG13 VAL 73 3HG1 VAL 73 -6.272 13.904 5.247 566 HG21 VAL 73 3HG2 VAL 73 -7.470 16.712 7.362 567 HG22 VAL 73 1HG2 VAL 73 -5.934 16.638 6.459 568 HG23 VAL 73 2HG2 VAL 73 -6.541 15.198 7.295 569 H ASP 74 H ASP 74 -6.905 18.748 5.711 570 HA ASP 74 HA ASP 74 -5.829 20.092 3.344 571 HB2 ASP 74 2HB ASP 74 -5.879 20.628 6.204 572 HB3 ASP 74 1HB ASP 74 -4.178 20.480 5.813 573 H THR 75 H THR 75 -4.296 17.668 5.516 574 HA THR 75 HA THR 75 -1.881 17.189 3.848 575 HB THR 75 HB THR 75 -1.701 15.083 5.212 576 HG1 THR 75 HG1 THR 75 -3.158 14.620 6.740 577 HG21 THR 75 3HG2 THR 75 -1.171 15.985 7.338 578 HG22 THR 75 1HG2 THR 75 -2.259 17.382 7.142 579 HG23 THR 75 2HG2 THR 75 -0.779 17.255 6.159 580 H ALA 76 H ALA 76 -3.912 17.211 1.950 581 HA ALA 76 HA ALA 76 -3.644 14.412 0.823 582 HB1 ALA 76 3HB ALA 76 -5.746 14.295 2.043 583 HB2 ALA 76 1HB ALA 76 -6.074 14.149 0.308 584 HB3 ALA 76 2HB ALA 76 -6.429 15.682 1.171 585 H HIS 77 H HIS 77 -3.290 14.293 -1.154 586 HA HIS 77 HA HIS 77 -3.182 16.746 -2.991 587 HD1 HIS 77 HD1 HIS 77 -0.513 16.008 0.760 588 HD2 HIS 77 HD2 HIS 77 -1.587 19.121 -1.965 589 HE1 HIS 77 HE1 HIS 77 -0.322 18.299 1.914 590 HB2 HIS 77 2HB HIS 77 -0.826 15.227 -1.673 591 HB3 HIS 77 1HB HIS 77 -0.648 16.497 -2.897 592 H ARG 78 H ARG 78 -1.917 16.078 -5.093 593 HA ARG 78 HA ARG 78 -2.656 13.196 -5.858 594 HE ARG 78 HE ARG 78 -4.352 14.657 -10.739 595 HB2 ARG 78 2HB ARG 78 -4.436 14.964 -6.489 596 HB3 ARG 78 1HB ARG 78 -3.326 15.572 -7.688 597 HG2 ARG 78 2HG ARG 78 -4.291 12.633 -7.544 598 HG3 ARG 78 1HG ARG 78 -5.194 13.865 -8.390 599 HD2 ARG 78 2HD ARG 78 -2.309 12.978 -9.110 600 HD3 ARG 78 1HD ARG 78 -3.765 12.379 -9.863 601 HH11 ARG 78 2HH1 ARG 78 -1.059 14.412 -9.612 602 HH12 ARG 78 1HH1 ARG 78 -0.482 15.713 -10.702 603 HH21 ARG 78 1HH2 ARG 78 -3.755 16.058 -11.895 604 HH22 ARG 78 2HH2 ARG 78 -2.012 16.674 -11.977 605 H ALA 79 H ALA 79 -0.984 12.125 -6.663 606 HA ALA 79 HA ALA 79 1.360 13.534 -8.014 607 HB1 ALA 79 3HB ALA 79 2.317 11.148 -7.881 608 HB2 ALA 79 1HB ALA 79 0.826 10.613 -7.094 609 HB3 ALA 79 2HB ALA 79 1.878 11.841 -6.306 610 H ALA 80 H ALA 80 1.775 13.375 -10.221 611 HA ALA 80 HA ALA 80 -0.092 11.742 -12.002 612 HB1 ALA 80 3HB ALA 80 2.011 13.826 -12.754 613 HB2 ALA 80 1HB ALA 80 0.255 14.090 -12.643 614 HB3 ALA 80 2HB ALA 80 0.929 13.024 -13.897 615 H SER 81 H SER 81 3.242 11.373 -10.915 616 HA SER 81 HA SER 81 3.239 8.696 -12.286 617 HG SER 81 HG SER 81 6.117 8.966 -14.188 618 HB2 SER 81 2HB SER 81 4.576 10.728 -13.632 619 HB3 SER 81 1HB SER 81 5.848 10.314 -12.486 620 H VAL 82 H VAL 82 5.832 7.905 -11.534 621 HA VAL 82 HA VAL 82 5.572 7.624 -8.507 622 HB VAL 82 HB VAL 82 7.612 6.238 -10.332 623 HG11 VAL 82 1HG1 VAL 82 7.364 6.383 -7.278 624 HG12 VAL 82 2HG1 VAL 82 8.818 6.381 -8.283 625 HG13 VAL 82 3HG1 VAL 82 7.925 4.882 -8.027 626 HG21 VAL 82 3HG2 VAL 82 5.599 5.039 -10.698 627 HG22 VAL 82 1HG2 VAL 82 4.969 5.309 -9.046 628 HG23 VAL 82 2HG2 VAL 82 6.260 4.139 -9.327 629 H GLU 83 H GLU 83 8.176 8.835 -10.762 630 HA GLU 83 HA GLU 83 9.626 10.443 -8.919 631 HB2 GLU 83 2HB GLU 83 8.831 11.034 -11.831 632 HB3 GLU 83 1HB GLU 83 10.048 11.916 -10.947 633 HG2 GLU 83 2HG GLU 83 11.669 10.218 -11.084 634 HG3 GLU 83 1HG GLU 83 10.524 8.912 -11.017 635 H GLU 84 H GLU 84 6.462 11.582 -10.394 636 HA GLU 84 HA GLU 84 6.359 14.022 -8.703 637 HB2 GLU 84 2HB GLU 84 4.066 12.362 -9.869 638 HB3 GLU 84 1HB GLU 84 3.863 13.958 -9.193 639 HG2 GLU 84 2HG GLU 84 5.803 14.174 -11.429 640 HG3 GLU 84 1HG GLU 84 4.442 13.240 -11.959 641 H ALA 85 H ALA 85 5.626 10.749 -7.885 642 HA ALA 85 HA ALA 85 4.026 11.443 -5.401 643 HB1 ALA 85 3HB ALA 85 4.986 8.662 -6.318 644 HB2 ALA 85 1HB ALA 85 3.407 9.350 -6.778 645 HB3 ALA 85 2HB ALA 85 3.786 9.013 -5.075 646 H VAL 86 H VAL 86 7.329 10.455 -6.231 647 HA VAL 86 HA VAL 86 8.213 10.331 -3.332 648 HB VAL 86 HB VAL 86 9.621 9.874 -6.005 649 HG11 VAL 86 1HG1 VAL 86 11.800 9.535 -4.830 650 HG12 VAL 86 2HG1 VAL 86 11.113 10.241 -3.334 651 HG13 VAL 86 3HG1 VAL 86 11.294 11.231 -4.810 652 HG21 VAL 86 3HG2 VAL 86 10.205 7.661 -4.938 653 HG22 VAL 86 1HG2 VAL 86 8.456 7.911 -4.835 654 HG23 VAL 86 2HG2 VAL 86 9.476 8.185 -3.407 655 H ASP 87 H ASP 87 8.787 12.712 -6.040 656 HA ASP 87 HA ASP 87 9.909 14.726 -4.338 657 HB2 ASP 87 2HB ASP 87 8.632 14.714 -7.111 658 HB3 ASP 87 1HB ASP 87 8.723 16.259 -6.313 659 H ILE 88 H ILE 88 6.328 14.238 -4.850 660 HA ILE 88 HA ILE 88 5.883 16.587 -3.066 661 HB ILE 88 HB ILE 88 3.773 16.574 -2.892 662 HG12 ILE 88 2HG1 ILE 88 3.012 13.954 -4.274 663 HG13 ILE 88 1HG1 ILE 88 3.404 13.948 -2.580 664 HG21 ILE 88 1HG2 ILE 88 2.861 16.855 -5.129 665 HG22 ILE 88 2HG2 ILE 88 3.981 15.651 -5.810 666 HG23 ILE 88 3HG2 ILE 88 4.606 17.202 -5.232 667 HD11 ILE 88 3HD1 ILE 88 0.984 15.214 -3.833 668 HD12 ILE 88 1HD1 ILE 88 1.706 16.145 -2.502 669 HD13 ILE 88 2HD1 ILE 88 1.208 14.505 -2.219 670 H ALA 89 H ALA 89 6.158 13.164 -2.303 671 HA ALA 89 HA ALA 89 5.421 13.463 0.576 672 HB1 ALA 89 3HB ALA 89 6.604 11.260 0.823 673 HB2 ALA 89 1HB ALA 89 7.108 11.333 -0.881 674 HB3 ALA 89 2HB ALA 89 5.387 11.225 -0.456 675 H ALA 90 H ALA 90 8.633 13.528 -1.063 676 HA ALA 90 HA ALA 90 10.107 14.347 1.392 677 HB1 ALA 90 3HB ALA 90 10.785 14.431 -1.622 678 HB2 ALA 90 1HB ALA 90 11.193 13.146 -0.459 679 HB3 ALA 90 2HB ALA 90 11.965 14.748 -0.339 680 H SER 91 H SER 91 8.408 16.274 -0.981 681 HA SER 91 HA SER 91 9.509 18.931 -0.157 682 HG SER 91 HG SER 91 6.682 20.159 -1.220 683 HB2 SER 91 2HB SER 91 8.516 18.386 -2.413 684 HB3 SER 91 1HB SER 91 6.960 18.059 -1.656 685 H LEU 92 H LEU 92 7.021 16.913 1.244 686 HA LEU 92 HA LEU 92 5.905 19.236 2.842 687 HG LEU 92 HG LEU 92 5.170 15.862 1.532 688 HB2 LEU 92 2HB LEU 92 4.102 17.765 3.692 689 HB3 LEU 92 1HB LEU 92 4.114 18.283 2.039 690 HD11 LEU 92 1HD1 LEU 92 4.262 14.110 2.994 691 HD12 LEU 92 2HD1 LEU 92 3.670 15.321 4.167 692 HD13 LEU 92 3HD1 LEU 92 5.413 15.105 3.866 693 HD21 LEU 92 3HD2 LEU 92 2.900 15.002 1.077 694 HD22 LEU 92 1HD2 LEU 92 2.956 16.710 0.645 695 HD23 LEU 92 2HD2 LEU 92 2.160 16.201 2.161 696 H ASP 93 H ASP 93 7.133 15.989 3.854 697 HA ASP 93 HA ASP 93 9.416 16.775 5.098 698 HB2 ASP 93 2HB ASP 93 7.271 17.546 7.103 699 HB3 ASP 93 1HB ASP 93 8.581 16.624 7.763 700 H ALA 94 H ALA 94 9.986 14.666 4.482 701 HA ALA 94 HA ALA 94 9.495 12.510 6.496 702 HB1 ALA 94 3HB ALA 94 7.384 12.359 5.153 703 HB2 ALA 94 1HB ALA 94 8.349 10.893 4.968 704 HB3 ALA 94 2HB ALA 94 8.312 12.109 3.659 705 H GLU 95 H GLU 95 10.933 10.908 6.567 706 HA GLU 95 HA GLU 95 13.096 10.694 4.464 707 HB2 GLU 95 2HB GLU 95 13.309 8.668 6.660 708 HB3 GLU 95 1HB GLU 95 14.514 9.510 5.712 709 HG2 GLU 95 2HG GLU 95 14.037 11.599 7.241 710 HG3 GLU 95 1HG GLU 95 13.081 10.490 8.231 711 H THR 96 H THR 96 10.765 8.324 5.918 712 HA THR 96 HA THR 96 10.816 6.760 3.290 713 HB THR 96 HB THR 96 9.294 5.061 4.560 714 HG1 THR 96 HG1 THR 96 9.213 6.569 6.473 715 HG21 THR 96 3HG2 THR 96 11.646 4.501 3.887 716 HG22 THR 96 1HG2 THR 96 11.268 3.854 5.504 717 HG23 THR 96 2HG2 THR 96 12.258 5.328 5.357 718 H ALA 97 H ALA 97 8.875 6.060 2.362 719 HA ALA 97 HA ALA 97 6.276 7.244 3.397 720 HB1 ALA 97 3HB ALA 97 7.258 7.625 0.474 721 HB2 ALA 97 1HB ALA 97 6.771 8.841 1.667 722 HB3 ALA 97 2HB ALA 97 5.544 7.789 0.936 723 H TYR 98 H TYR 98 4.366 6.149 2.258 724 HA TYR 98 HA TYR 98 4.858 3.179 1.807 725 HD1 TYR 98 HD1 TYR 98 4.832 0.998 3.997 726 HD2 TYR 98 HD2 TYR 98 4.634 4.994 5.481 727 HE1 TYR 98 HE1 TYR 98 6.636 0.485 5.618 728 HE2 TYR 98 HE2 TYR 98 6.411 4.465 7.121 729 HH TYR 98 HH TYR 98 7.934 3.065 7.712 730 HB2 TYR 98 2HB TYR 98 2.945 4.254 3.980 731 HB3 TYR 98 1HB TYR 98 2.916 2.600 3.420 732 H VAL 99 H VAL 99 2.717 2.034 1.229 733 HA VAL 99 HA VAL 99 0.823 3.761 -0.433 734 HB VAL 99 HB VAL 99 1.539 3.225 -2.429 735 HG11 VAL 99 1HG1 VAL 99 3.874 1.562 -1.460 736 HG12 VAL 99 2HG1 VAL 99 3.837 3.291 -1.667 737 HG13 VAL 99 3HG1 VAL 99 3.632 2.235 -3.072 738 HG21 VAL 99 3HG2 VAL 99 0.125 1.347 -2.710 739 HG22 VAL 99 1HG2 VAL 99 1.336 0.275 -2.020 740 HG23 VAL 99 2HG2 VAL 99 1.647 1.051 -3.589 741 H ILE 100 H ILE 100 -1.236 3.220 0.468 742 HA ILE 100 HA ILE 100 -1.810 0.471 1.217 743 HB ILE 100 HB ILE 100 -4.147 2.236 0.395 744 HG12 ILE 100 2HG1 ILE 100 -3.322 3.577 2.101 745 HG13 ILE 100 1HG1 ILE 100 -4.404 2.541 2.939 746 HG21 ILE 100 1HG2 ILE 100 -4.081 -0.118 2.376 747 HG22 ILE 100 2HG2 ILE 100 -4.650 -0.276 0.697 748 HG23 ILE 100 3HG2 ILE 100 -5.506 0.780 1.822 749 HD11 ILE 100 3HD1 ILE 100 -2.206 2.938 4.194 750 HD12 ILE 100 1HD1 ILE 100 -1.339 2.023 2.959 751 HD13 ILE 100 2HD1 ILE 100 -2.585 1.196 3.920 752 H GLY 101 H GLY 101 -3.028 1.801 -1.694 753 HA2 GLY 101 2HA GLY 101 -2.911 0.894 -3.908 754 HA3 GLY 101 1HA GLY 101 -1.777 -0.255 -3.378 755 H GLY 102 H GLY 102 -2.906 -2.393 -4.599 756 HA2 GLY 102 2HA GLY 102 -5.025 -0.395 -5.628 757 HA3 GLY 102 1HA GLY 102 -3.366 -0.295 -6.146 758 H ALA 103 H ALA 103 -6.337 -1.776 -6.870 759 HA ALA 103 HA ALA 103 -6.046 -3.229 -9.166 760 HB1 ALA 103 3HB ALA 103 -8.084 -1.793 -8.298 761 HB2 ALA 103 1HB ALA 103 -7.939 -1.778 -10.041 762 HB3 ALA 103 2HB ALA 103 -7.435 -0.386 -9.106 763 H ALA 104 H ALA 104 -4.935 0.148 -9.279 764 HA ALA 104 HA ALA 104 -3.063 -0.614 -11.587 765 HB1 ALA 104 3HB ALA 104 -3.976 2.223 -10.879 766 HB2 ALA 104 1HB ALA 104 -4.515 1.253 -12.279 767 HB3 ALA 104 2HB ALA 104 -2.817 1.777 -12.150 768 H ILE 105 H ILE 105 -3.129 0.507 -8.235 769 HA ILE 105 HA ILE 105 -0.598 1.988 -8.368 770 HB ILE 105 HB ILE 105 -1.703 1.088 -5.724 771 HG12 ILE 105 2HG1 ILE 105 -3.718 2.004 -6.737 772 HG13 ILE 105 1HG1 ILE 105 -3.103 3.064 -5.546 773 HG21 ILE 105 1HG2 ILE 105 0.470 2.250 -5.582 774 HG22 ILE 105 2HG2 ILE 105 -0.830 3.141 -4.802 775 HG23 ILE 105 3HG2 ILE 105 -0.233 3.680 -6.375 776 HD11 ILE 105 3HD1 ILE 105 -2.965 4.790 -7.163 777 HD12 ILE 105 1HD1 ILE 105 -3.839 3.639 -8.232 778 HD13 ILE 105 2HD1 ILE 105 -2.072 3.772 -8.329 779 H TYR 106 H TYR 106 -1.048 -1.077 -6.487 780 HA TYR 106 HA TYR 106 1.839 -1.566 -6.099 781 HD1 TYR 106 HD1 TYR 106 2.657 -4.475 -4.779 782 HD2 TYR 106 HD2 TYR 106 -0.763 -2.248 -3.421 783 HE1 TYR 106 HE1 TYR 106 3.210 -5.027 -2.462 784 HE2 TYR 106 HE2 TYR 106 -0.211 -2.846 -1.106 785 HH TYR 106 HH TYR 106 2.668 -4.383 -0.144 786 HB2 TYR 106 2HB TYR 106 -0.693 -3.203 -5.717 787 HB3 TYR 106 1HB TYR 106 0.678 -4.142 -6.184 788 H ALA 107 H ALA 107 -0.272 -2.563 -8.796 789 HA ALA 107 HA ALA 107 1.692 -4.136 -10.328 790 HB1 ALA 107 3HB ALA 107 -0.786 -4.223 -10.664 791 HB2 ALA 107 1HB ALA 107 -0.021 -3.725 -12.177 792 HB3 ALA 107 2HB ALA 107 -0.813 -2.526 -11.141 793 H LEU 108 H LEU 108 0.879 -0.640 -10.598 794 HA LEU 108 HA LEU 108 3.124 -0.162 -12.523 795 HG LEU 108 HG LEU 108 1.874 2.255 -9.951 796 HB2 LEU 108 2HB LEU 108 2.305 1.867 -12.933 797 HB3 LEU 108 1HB LEU 108 0.845 1.206 -12.283 798 HD11 LEU 108 1HD1 LEU 108 3.961 3.153 -11.270 799 HD12 LEU 108 2HD1 LEU 108 3.071 4.350 -10.337 800 HD13 LEU 108 3HD1 LEU 108 2.857 4.270 -12.093 801 HD21 LEU 108 3HD2 LEU 108 0.526 4.311 -10.370 802 HD22 LEU 108 1HD2 LEU 108 -0.377 2.846 -10.792 803 HD23 LEU 108 2HD2 LEU 108 0.363 3.877 -12.078 804 H PHE 109 H PHE 109 2.783 0.226 -8.993 805 HA PHE 109 HA PHE 109 5.491 1.298 -8.660 806 HD1 PHE 109 HD2 PHE 109 6.468 2.319 -6.305 807 HD2 PHE 109 HD1 PHE 109 2.238 2.553 -6.932 808 HE1 PHE 109 HE2 PHE 109 6.570 4.725 -5.977 809 HE2 PHE 109 HE1 PHE 109 2.332 4.975 -6.593 810 HZ PHE 109 HZ PHE 109 4.527 6.090 -6.165 811 HB2 PHE 109 2HB PHE 109 3.302 0.315 -6.730 812 HB3 PHE 109 1HB PHE 109 4.927 0.259 -6.134 813 H GLN 110 H GLN 110 4.589 -2.106 -8.783 814 HA GLN 110 HA GLN 110 6.429 -3.460 -7.311 815 HB2 GLN 110 2HB GLN 110 5.698 -4.093 -10.238 816 HB3 GLN 110 1HB GLN 110 6.759 -5.089 -9.309 817 HG2 GLN 110 2HG GLN 110 4.591 -4.915 -7.553 818 HG3 GLN 110 1HG GLN 110 3.790 -4.748 -9.094 819 HE21 GLN 110 1HE2 GLN 110 4.602 -6.545 -10.758 820 HE22 GLN 110 2HE2 GLN 110 4.452 -8.210 -9.982 821 HA PRO 111 HA PRO 111 10.703 -2.904 -9.490 822 HB2 PRO 111 2HB PRO 111 10.679 -0.916 -11.652 823 HB3 PRO 111 1HB PRO 111 10.966 -2.655 -11.743 824 HG2 PRO 111 2HG PRO 111 8.673 -1.356 -12.824 825 HG3 PRO 111 1HG PRO 111 8.823 -3.100 -12.478 826 HD2 PRO 111 2HD PRO 111 7.537 -0.951 -10.727 827 HD3 PRO 111 1HD PRO 111 6.954 -2.575 -11.121 828 H HIS 112 H HIS 112 8.758 -0.367 -8.425 829 HA HIS 112 HA HIS 112 11.112 1.584 -8.005 830 HD1 HIS 112 HD1 HIS 112 11.050 3.655 -10.248 831 HD2 HIS 112 HD2 HIS 112 7.143 1.956 -10.441 832 HE1 HIS 112 HE1 HIS 112 10.113 3.830 -12.669 833 HB2 HIS 112 2HB HIS 112 8.139 2.356 -8.009 834 HB3 HIS 112 1HB HIS 112 9.548 3.402 -7.934 835 H LEU 113 H LEU 113 9.126 -0.532 -6.124 836 HA LEU 113 HA LEU 113 9.070 1.136 -3.695 837 HG LEU 113 HG LEU 113 6.663 -1.347 -2.636 838 HB2 LEU 113 2HB LEU 113 8.915 -1.945 -3.980 839 HB3 LEU 113 1HB LEU 113 8.779 -1.109 -2.455 840 HD11 LEU 113 1HD1 LEU 113 5.360 0.591 -3.600 841 HD12 LEU 113 2HD1 LEU 113 6.779 1.037 -4.564 842 HD13 LEU 113 3HD1 LEU 113 6.840 1.140 -2.798 843 HD21 LEU 113 3HD2 LEU 113 6.852 -1.463 -5.698 844 HD22 LEU 113 1HD2 LEU 113 5.337 -1.704 -4.764 845 HD23 LEU 113 2HD2 LEU 113 6.707 -2.826 -4.579 846 H ASP 114 H ASP 114 10.275 1.221 -1.891 847 HA ASP 114 HA ASP 114 12.969 -0.039 -1.528 848 HB2 ASP 114 2HB ASP 114 12.388 2.099 -0.486 849 HB3 ASP 114 1HB ASP 114 10.933 1.455 0.245 850 H ARG 115 H ARG 115 9.738 -0.741 -0.031 851 HA ARG 115 HA ARG 115 10.327 -3.735 -0.244 852 HE ARG 115 HE ARG 115 12.106 -1.382 2.967 853 HB2 ARG 115 2HB ARG 115 9.925 -2.106 2.326 854 HB3 ARG 115 1HB ARG 115 9.257 -3.724 2.313 855 HG2 ARG 115 2HG ARG 115 11.356 -4.784 1.988 856 HG3 ARG 115 1HG ARG 115 12.168 -3.305 1.489 857 HD2 ARG 115 2HD ARG 115 11.115 -3.840 4.342 858 HD3 ARG 115 1HD ARG 115 12.786 -4.081 3.796 859 HH11 ARG 115 2HH1 ARG 115 12.597 -3.051 5.971 860 HH12 ARG 115 1HH1 ARG 115 12.984 -1.469 6.817 861 HH21 ARG 115 1HH2 ARG 115 12.532 0.207 3.829 862 HH22 ARG 115 2HH2 ARG 115 12.925 0.418 5.613 863 H MET 116 H MET 116 8.567 -5.153 0.025 864 HA MET 116 HA MET 116 5.744 -3.963 -0.348 865 HB2 MET 116 2HB MET 116 7.182 -6.365 -1.525 866 HB3 MET 116 1HB MET 116 5.421 -6.352 -1.430 867 HG2 MET 116 2HG MET 116 5.404 -4.431 -3.029 868 HG3 MET 116 1HG MET 116 7.146 -4.192 -2.808 869 HE1 MET 116 3HE MET 116 5.190 -7.729 -5.096 870 HE2 MET 116 1HE MET 116 4.444 -6.122 -4.884 871 HE3 MET 116 2HE MET 116 4.659 -7.207 -3.466 872 H VAL 117 H VAL 117 5.277 -3.737 1.751 873 HA VAL 117 HA VAL 117 5.041 -5.996 3.770 874 HB VAL 117 HB VAL 117 4.436 -3.003 3.806 875 HG11 VAL 117 1HG1 VAL 117 4.052 -3.085 6.215 876 HG12 VAL 117 2HG1 VAL 117 4.495 -4.817 6.303 877 HG13 VAL 117 3HG1 VAL 117 2.984 -4.295 5.568 878 HG21 VAL 117 3HG2 VAL 117 6.426 -2.767 5.280 879 HG22 VAL 117 1HG2 VAL 117 6.940 -3.666 3.830 880 HG23 VAL 117 2HG2 VAL 117 6.636 -4.517 5.336 881 H LEU 118 H LEU 118 3.727 -7.067 1.988 882 HA LEU 118 HA LEU 118 0.763 -6.602 1.850 883 HG LEU 118 HG LEU 118 -0.296 -8.998 0.937 884 HB2 LEU 118 2HB LEU 118 1.820 -7.669 0.028 885 HB3 LEU 118 1HB LEU 118 2.765 -8.775 0.986 886 HD11 LEU 118 1HD1 LEU 118 1.705 -10.077 -1.167 887 HD12 LEU 118 2HD1 LEU 118 0.214 -9.130 -1.411 888 HD13 LEU 118 3HD1 LEU 118 0.101 -10.800 -0.885 889 HD21 LEU 118 3HD2 LEU 118 0.169 -11.385 1.382 890 HD22 LEU 118 1HD2 LEU 118 1.051 -10.464 2.608 891 HD23 LEU 118 2HD2 LEU 118 1.929 -11.105 1.212 892 H SER 119 H SER 119 -0.867 -7.846 2.788 893 HA SER 119 HA SER 119 -0.165 -9.582 5.227 894 HG SER 119 HG SER 119 -1.050 -6.575 4.623 895 HB2 SER 119 2HB SER 119 -2.773 -8.194 5.613 896 HB3 SER 119 1HB SER 119 -1.402 -8.397 6.678 897 H ARG 120 H ARG 120 -1.019 -11.594 5.085 898 HA ARG 120 HA ARG 120 -2.983 -12.164 2.844 899 HE ARG 120 HE ARG 120 -0.170 -14.868 1.070 900 HB2 ARG 120 2HB ARG 120 -2.034 -14.662 3.969 901 HB3 ARG 120 1HB ARG 120 -2.013 -14.047 2.345 902 HG2 ARG 120 2HG ARG 120 0.245 -12.894 2.887 903 HG3 ARG 120 1HG ARG 120 0.100 -13.526 4.508 904 HD2 ARG 120 2HD ARG 120 1.659 -14.868 3.268 905 HD3 ARG 120 1HD ARG 120 0.308 -15.826 3.843 906 HH11 ARG 120 2HH1 ARG 120 1.717 -17.176 2.780 907 HH12 ARG 120 1HH1 ARG 120 1.581 -18.447 1.483 908 HH21 ARG 120 1HH2 ARG 120 -0.371 -16.313 -0.417 909 HH22 ARG 120 2HH2 ARG 120 0.407 -17.951 -0.263 910 H VAL 121 H VAL 121 -5.060 -12.045 3.448 911 HA VAL 121 HA VAL 121 -5.926 -12.918 6.214 912 HB VAL 121 HB VAL 121 -7.803 -11.524 4.277 913 HG11 VAL 121 1HG1 VAL 121 -8.707 -12.477 6.500 914 HG12 VAL 121 2HG1 VAL 121 -8.901 -10.727 6.356 915 HG13 VAL 121 3HG1 VAL 121 -7.604 -11.379 7.364 916 HG21 VAL 121 3HG2 VAL 121 -5.993 -9.894 4.301 917 HG22 VAL 121 1HG2 VAL 121 -5.759 -10.027 6.051 918 HG23 VAL 121 2HG2 VAL 121 -7.228 -9.309 5.398 919 HA PRO 122 HA PRO 122 -7.816 -16.630 4.083 920 HB2 PRO 122 2HB PRO 122 -8.704 -17.252 6.935 921 HB3 PRO 122 1HB PRO 122 -7.916 -18.318 5.757 922 HG2 PRO 122 2HG PRO 122 -6.431 -17.318 7.791 923 HG3 PRO 122 1HG PRO 122 -5.740 -17.250 6.149 924 HD2 PRO 122 2HD PRO 122 -7.223 -14.967 7.595 925 HD3 PRO 122 1HD PRO 122 -5.605 -14.959 6.812 926 H GLY 123 H GLY 123 -10.063 -17.922 4.724 927 HA2 GLY 123 2HA GLY 123 -12.522 -17.626 4.934 928 HA3 GLY 123 1HA GLY 123 -12.408 -15.914 4.614 929 H GLU 124 H GLU 124 -10.625 -16.729 2.261 930 HA GLU 124 HA GLU 124 -10.693 -17.349 -0.007 931 HB2 GLU 124 2HB GLU 124 -12.601 -19.413 1.116 932 HB3 GLU 124 1HB GLU 124 -11.937 -19.511 -0.492 933 HG2 GLU 124 2HG GLU 124 -9.786 -20.137 0.233 934 HG3 GLU 124 1HG GLU 124 -9.839 -19.134 1.667 935 H TYR 125 H TYR 125 -11.282 -15.729 -1.252 936 HA TYR 125 HA TYR 125 -14.247 -15.249 -1.913 937 HD1 TYR 125 HD1 TYR 125 -15.603 -13.076 -0.044 938 HD2 TYR 125 HD2 TYR 125 -11.507 -13.845 0.982 939 HE1 TYR 125 HE1 TYR 125 -16.172 -12.972 2.365 940 HE2 TYR 125 HE2 TYR 125 -12.087 -13.740 3.378 941 HH TYR 125 HH TYR 125 -13.708 -13.506 4.851 942 HB2 TYR 125 2HB TYR 125 -12.079 -13.133 -1.327 943 HB3 TYR 125 1HB TYR 125 -13.720 -12.787 -1.762 944 H GLU 126 H GLU 126 -14.704 -15.096 -4.049 945 HA GLU 126 HA GLU 126 -12.815 -15.098 -6.179 946 HB2 GLU 126 2HB GLU 126 -15.718 -14.145 -6.459 947 HB3 GLU 126 1HB GLU 126 -14.689 -14.816 -7.713 948 HG2 GLU 126 2HG GLU 126 -14.830 -17.101 -6.713 949 HG3 GLU 126 1HG GLU 126 -15.683 -16.487 -5.300 950 H GLY 127 H GLY 127 -14.784 -12.202 -5.472 951 HA2 GLY 127 2HA GLY 127 -13.830 -9.948 -5.095 952 HA3 GLY 127 1HA GLY 127 -12.302 -10.503 -5.694 953 H ASP 128 H ASP 128 -13.435 -8.042 -6.021 954 HA ASP 128 HA ASP 128 -13.535 -7.786 -9.078 955 HB2 ASP 128 2HB ASP 128 -14.524 -5.764 -6.959 956 HB3 ASP 128 1HB ASP 128 -14.532 -5.527 -8.695 957 H THR 129 H THR 129 -11.995 -6.332 -6.147 958 HA THR 129 HA THR 129 -9.898 -4.995 -7.847 959 HB THR 129 HB THR 129 -9.805 -5.197 -4.815 960 HG1 THR 129 HG1 THR 129 -11.056 -3.445 -4.644 961 HG21 THR 129 3HG2 THR 129 -9.039 -2.835 -6.630 962 HG22 THR 129 1HG2 THR 129 -7.845 -4.088 -6.229 963 HG23 THR 129 2HG2 THR 129 -8.560 -3.094 -4.926 964 H TYR 130 H TYR 130 -8.347 -6.282 -8.658 965 HA TYR 130 HA TYR 130 -7.156 -8.613 -7.105 966 HD1 TYR 130 HD1 TYR 130 -9.757 -8.188 -9.833 967 HD2 TYR 130 HD2 TYR 130 -6.920 -11.292 -8.943 968 HE1 TYR 130 HE1 TYR 130 -11.539 -9.880 -9.987 969 HE2 TYR 130 HE2 TYR 130 -8.693 -12.982 -9.239 970 HH TYR 130 HH TYR 130 -11.917 -12.125 -8.982 971 HB2 TYR 130 2HB TYR 130 -7.147 -7.811 -10.073 972 HB3 TYR 130 1HB TYR 130 -6.105 -9.060 -9.454 973 H TYR 131 H TYR 131 -5.154 -8.804 -6.440 974 HA TYR 131 HA TYR 131 -3.157 -6.553 -6.609 975 HD1 TYR 131 HD2 TYR 131 -0.882 -9.720 -5.352 976 HD2 TYR 131 HD1 TYR 131 -2.171 -6.245 -3.224 977 HE1 TYR 131 HE2 TYR 131 1.425 -9.366 -4.551 978 HE2 TYR 131 HE1 TYR 131 0.055 -6.088 -2.203 979 HH TYR 131 HH TYR 131 2.803 -7.573 -3.644 980 HB2 TYR 131 2HB TYR 131 -3.777 -7.672 -4.444 981 HB3 TYR 131 1HB TYR 131 -3.295 -9.212 -5.013 982 HA PRO 132 HA PRO 132 -0.522 -8.738 -9.707 983 HB2 PRO 132 2HB PRO 132 1.981 -7.683 -8.419 984 HB3 PRO 132 1HB PRO 132 1.343 -7.380 -10.044 985 HG2 PRO 132 2HG PRO 132 1.263 -5.453 -8.111 986 HG3 PRO 132 1HG PRO 132 -0.093 -5.632 -9.245 987 HD2 PRO 132 2HD PRO 132 0.059 -6.689 -6.381 988 HD3 PRO 132 1HD PRO 132 -1.255 -5.775 -7.192 989 H GLU 133 H GLU 133 1.315 -10.123 -10.125 990 HA GLU 133 HA GLU 133 1.603 -12.450 -8.330 991 HB2 GLU 133 2HB GLU 133 3.098 -13.322 -10.103 992 HB3 GLU 133 1HB GLU 133 1.534 -12.845 -10.711 993 HG2 GLU 133 2HG GLU 133 4.039 -11.036 -11.035 994 HG3 GLU 133 1HG GLU 133 3.601 -12.284 -12.196 995 H TRP 134 H TRP 134 3.573 -13.268 -7.529 996 HA TRP 134 HA TRP 134 5.748 -11.248 -6.791 997 HD1 TRP 134 HD1 TRP 134 5.188 -15.383 -5.358 998 HE1 TRP 134 HE1 TRP 134 2.971 -16.641 -4.675 999 HE3 TRP 134 HE3 TRP 134 2.706 -11.271 -3.656 1000 HZ2 TRP 134 HZ2 TRP 134 0.487 -15.756 -3.593 1001 HZ3 TRP 134 HZ3 TRP 134 0.346 -11.506 -3.012 1002 HH2 TRP 134 HH2 TRP 134 -0.751 -13.712 -2.943 1003 HB2 TRP 134 2HB TRP 134 6.146 -12.535 -4.627 1004 HB3 TRP 134 1HB TRP 134 4.777 -11.478 -4.704 1005 H ASP 135 H ASP 135 7.851 -11.852 -7.135 1006 HA ASP 135 HA ASP 135 8.335 -14.555 -8.491 1007 HB2 ASP 135 2HB ASP 135 8.313 -12.362 -9.880 1008 HB3 ASP 135 1HB ASP 135 9.745 -11.858 -9.001 1009 H ALA 136 H ALA 136 11.103 -14.085 -8.486 1010 HA ALA 136 HA ALA 136 12.013 -14.327 -5.546 1011 HB1 ALA 136 3HB ALA 136 12.606 -16.329 -7.869 1012 HB2 ALA 136 1HB ALA 136 11.506 -16.614 -6.478 1013 HB3 ALA 136 2HB ALA 136 13.263 -16.462 -6.203 1014 H ALA 137 H ALA 137 13.047 -13.398 -8.776 1015 HA ALA 137 HA ALA 137 15.715 -12.469 -7.541 1016 HB1 ALA 137 3HB ALA 137 16.663 -12.308 -9.831 1017 HB2 ALA 137 1HB ALA 137 15.168 -12.970 -10.528 1018 HB3 ALA 137 2HB ALA 137 16.158 -13.961 -9.424 1019 H GLU 138 H GLU 138 12.758 -11.152 -8.820 1020 HA GLU 138 HA GLU 138 13.745 -8.322 -8.842 1021 HB2 GLU 138 2HB GLU 138 10.938 -9.544 -8.706 1022 HB3 GLU 138 1HB GLU 138 11.273 -7.848 -8.661 1023 HG2 GLU 138 2HG GLU 138 12.105 -9.507 -11.094 1024 HG3 GLU 138 1HG GLU 138 10.546 -8.749 -10.910 1025 H TRP 139 H TRP 139 11.848 -10.202 -6.407 1026 HA TRP 139 HA TRP 139 13.046 -8.531 -4.147 1027 HD1 TRP 139 HD1 TRP 139 8.902 -10.551 -4.593 1028 HE1 TRP 139 HE1 TRP 139 7.311 -10.186 -6.749 1029 HE3 TRP 139 HE3 TRP 139 10.784 -6.095 -5.999 1030 HZ2 TRP 139 HZ2 TRP 139 7.445 -8.397 -8.891 1031 HZ3 TRP 139 HZ3 TRP 139 10.166 -5.150 -8.201 1032 HH2 TRP 139 HH2 TRP 139 8.568 -6.321 -9.651 1033 HB2 TRP 139 2HB TRP 139 10.565 -8.633 -3.095 1034 HB3 TRP 139 1HB TRP 139 11.155 -7.335 -4.072 1035 H GLU 140 H GLU 140 13.546 -9.502 -2.323 1036 HA GLU 140 HA GLU 140 12.858 -12.454 -1.954 1037 HB2 GLU 140 2HB GLU 140 14.867 -12.902 -1.085 1038 HB3 GLU 140 1HB GLU 140 15.341 -11.617 -2.151 1039 HG2 GLU 140 2HG GLU 140 15.391 -10.052 -0.043 1040 HG3 GLU 140 1HG GLU 140 15.025 -11.475 0.933 1041 H LEU 141 H LEU 141 13.182 -12.667 0.845 1042 HA LEU 141 HA LEU 141 10.562 -11.353 1.758 1043 HG LEU 141 HG LEU 141 9.327 -14.589 3.209 1044 HB2 LEU 141 2HB LEU 141 10.959 -14.049 1.461 1045 HB3 LEU 141 1HB LEU 141 11.598 -13.878 3.064 1046 HD11 LEU 141 1HD1 LEU 141 9.057 -11.589 3.829 1047 HD12 LEU 141 2HD1 LEU 141 9.796 -12.762 4.913 1048 HD13 LEU 141 3HD1 LEU 141 8.077 -12.906 4.483 1049 HD21 LEU 141 3HD2 LEU 141 8.415 -12.271 1.418 1050 HD22 LEU 141 1HD2 LEU 141 7.382 -13.547 2.090 1051 HD23 LEU 141 2HD2 LEU 141 8.607 -13.948 0.873 1052 H ASP 142 H ASP 142 10.980 -9.753 3.192 1053 HA ASP 142 HA ASP 142 13.567 -9.473 4.711 1054 HB2 ASP 142 2HB ASP 142 12.291 -7.582 3.430 1055 HB3 ASP 142 1HB ASP 142 11.129 -7.606 4.767 1056 H ALA 143 H ALA 143 10.030 -9.575 5.583 1057 HA ALA 143 HA ALA 143 10.716 -11.289 8.000 1058 HB1 ALA 143 3HB ALA 143 9.191 -8.581 8.187 1059 HB2 ALA 143 1HB ALA 143 10.847 -8.880 8.754 1060 HB3 ALA 143 2HB ALA 143 9.483 -9.704 9.546 1061 H GLU 144 H GLU 144 9.321 -12.930 8.255 1062 HA GLU 144 HA GLU 144 6.391 -12.579 7.443 1063 HB2 GLU 144 2HB GLU 144 7.964 -14.523 6.385 1064 HB3 GLU 144 1HB GLU 144 7.545 -15.365 7.866 1065 HG2 GLU 144 2HG GLU 144 5.024 -14.288 6.874 1066 HG3 GLU 144 1HG GLU 144 5.905 -14.762 5.440 1067 H THR 145 H THR 145 4.918 -12.520 8.995 1068 HA THR 145 HA THR 145 5.236 -14.158 11.456 1069 HB THR 145 HB THR 145 6.517 -12.032 12.006 1070 HG1 THR 145 HG1 THR 145 4.352 -12.901 13.615 1071 HG21 THR 145 3HG2 THR 145 5.459 -10.001 11.751 1072 HG22 THR 145 1HG2 THR 145 4.772 -10.382 13.321 1073 HG23 THR 145 2HG2 THR 145 3.810 -10.661 11.848 1074 H ASP 146 H ASP 146 3.418 -14.701 12.627 1075 HA ASP 146 HA ASP 146 0.836 -14.309 11.389 1076 HB2 ASP 146 2HB ASP 146 0.048 -15.813 13.157 1077 HB3 ASP 146 1HB ASP 146 1.450 -16.411 12.307 1078 H HIS 147 H HIS 147 -0.984 -13.266 11.933 1079 HA HIS 147 HA HIS 147 -1.098 -11.313 14.277 1080 HD1 HIS 147 HD1 HIS 147 1.548 -10.536 12.995 1081 HD2 HIS 147 HD2 HIS 147 -1.371 -7.445 12.999 1082 HE1 HIS 147 HE1 HIS 147 2.664 -8.266 13.505 1083 HB2 HIS 147 2HB HIS 147 -0.925 -10.648 11.301 1084 HB3 HIS 147 1HB HIS 147 -2.197 -9.814 12.157 1085 H GLU 148 H GLU 148 -3.434 -10.220 14.214 1086 HA GLU 148 HA GLU 148 -4.976 -12.382 15.288 1087 HB2 GLU 148 2HB GLU 148 -6.017 -9.564 14.691 1088 HB3 GLU 148 1HB GLU 148 -6.805 -10.710 15.724 1089 HG2 GLU 148 2HG GLU 148 -4.932 -10.632 17.380 1090 HG3 GLU 148 1HG GLU 148 -3.998 -9.561 16.361 1091 H GLY 149 H GLY 149 -5.812 -10.673 12.262 1092 HA2 GLY 149 2HA GLY 149 -7.809 -12.935 11.525 1093 HA3 GLY 149 1HA GLY 149 -7.824 -11.361 10.791 1094 H PHE 150 H PHE 150 -4.548 -12.630 11.019 1095 HA PHE 150 HA PHE 150 -4.447 -13.532 8.185 1096 HD1 PHE 150 HD1 PHE 150 -1.606 -10.434 8.259 1097 HD2 PHE 150 HD2 PHE 150 -5.626 -9.485 9.387 1098 HE1 PHE 150 HE1 PHE 150 -0.804 -8.388 9.363 1099 HE2 PHE 150 HE2 PHE 150 -4.826 -7.447 10.504 1100 HZ PHE 150 HZ PHE 150 -2.429 -6.870 10.487 1101 HB2 PHE 150 2HB PHE 150 -3.663 -11.472 7.099 1102 HB3 PHE 150 1HB PHE 150 -5.222 -11.246 7.785 1103 H THR 151 H THR 151 -2.245 -13.354 7.174 1104 HA THR 151 HA THR 151 0.035 -13.374 9.239 1105 HB THR 151 HB THR 151 0.400 -15.470 8.719 1106 HG1 THR 151 HG1 THR 151 2.263 -14.785 7.856 1107 HG21 THR 151 3HG2 THR 151 -0.705 -15.246 5.868 1108 HG22 THR 151 1HG2 THR 151 -1.509 -16.027 7.246 1109 HG23 THR 151 2HG2 THR 151 -0.008 -16.710 6.598 1110 H LEU 152 H LEU 152 1.512 -11.944 9.075 1111 HA LEU 152 HA LEU 152 1.456 -9.722 7.040 1112 HG LEU 152 HG LEU 152 3.369 -7.869 9.820 1113 HB2 LEU 152 2HB LEU 152 1.571 -9.202 9.405 1114 HB3 LEU 152 1HB LEU 152 2.870 -10.305 9.702 1115 HD11 LEU 152 1HD1 LEU 152 5.138 -9.747 9.538 1116 HD12 LEU 152 2HD1 LEU 152 5.639 -8.096 9.109 1117 HD13 LEU 152 3HD1 LEU 152 5.240 -9.270 7.838 1118 HD21 LEU 152 3HD2 LEU 152 2.196 -7.075 7.725 1119 HD22 LEU 152 1HD2 LEU 152 3.428 -7.858 6.729 1120 HD23 LEU 152 2HD2 LEU 152 3.881 -6.544 7.830 1121 H GLN 153 H GLN 153 2.815 -9.642 5.335 1122 HA GLN 153 HA GLN 153 5.473 -11.201 5.297 1123 HB2 GLN 153 2HB GLN 153 3.277 -11.193 3.192 1124 HB3 GLN 153 1HB GLN 153 4.908 -10.996 2.591 1125 HG2 GLN 153 2HG GLN 153 5.646 -13.124 3.701 1126 HG3 GLN 153 1HG GLN 153 4.022 -13.394 4.322 1127 HE21 GLN 153 1HE2 GLN 153 2.833 -12.432 1.733 1128 HE22 GLN 153 2HE2 GLN 153 3.235 -13.761 0.532 1129 H GLU 154 H GLU 154 7.048 -9.774 5.284 1130 HA GLU 154 HA GLU 154 6.814 -7.118 3.774 1131 HB2 GLU 154 2HB GLU 154 8.990 -7.742 5.814 1132 HB3 GLU 154 1HB GLU 154 8.575 -6.212 5.107 1133 HG2 GLU 154 2HG GLU 154 6.147 -6.773 6.252 1134 HG3 GLU 154 1HG GLU 154 7.132 -7.770 7.281 1135 H TRP 155 H TRP 155 7.654 -7.158 1.820 1136 HA TRP 155 HA TRP 155 9.838 -9.156 1.039 1137 HD1 TRP 155 HD1 TRP 155 5.712 -9.379 0.805 1138 HE1 TRP 155 HE1 TRP 155 4.730 -11.737 0.080 1139 HE3 TRP 155 HE3 TRP 155 9.696 -10.819 -2.022 1140 HZ2 TRP 155 HZ2 TRP 155 5.721 -13.838 -1.516 1141 HZ3 TRP 155 HZ3 TRP 155 9.567 -12.989 -3.240 1142 HH2 TRP 155 HH2 TRP 155 7.610 -14.443 -3.008 1143 HB2 TRP 155 2HB TRP 155 7.470 -7.888 -0.351 1144 HB3 TRP 155 1HB TRP 155 8.726 -8.562 -1.355 1145 H VAL 156 H VAL 156 11.877 -8.215 1.038 1146 HA VAL 156 HA VAL 156 12.239 -5.367 0.081 1147 HB VAL 156 HB VAL 156 13.290 -6.063 2.216 1148 HG11 VAL 156 1HG1 VAL 156 15.226 -7.762 0.539 1149 HG12 VAL 156 2HG1 VAL 156 14.047 -8.377 1.715 1150 HG13 VAL 156 3HG1 VAL 156 15.404 -7.375 2.275 1151 HG21 VAL 156 3HG2 VAL 156 15.434 -5.133 0.225 1152 HG22 VAL 156 1HG2 VAL 156 15.359 -4.841 1.988 1153 HG23 VAL 156 2HG2 VAL 156 14.192 -4.067 0.905 1154 H ARG 157 H ARG 157 13.073 -4.659 -1.729 1155 HA ARG 157 HA ARG 157 13.561 -6.308 -4.055 1156 HE ARG 157 HE ARG 157 13.343 -3.980 -7.453 1157 HB2 ARG 157 2HB ARG 157 14.281 -3.396 -3.433 1158 HB3 ARG 157 1HB ARG 157 14.787 -4.134 -4.943 1159 HG2 ARG 157 2HG ARG 157 12.250 -4.830 -5.288 1160 HG3 ARG 157 1HG ARG 157 11.921 -3.709 -3.970 1161 HD2 ARG 157 2HD ARG 157 11.640 -2.399 -5.960 1162 HD3 ARG 157 1HD ARG 157 13.165 -1.917 -5.208 1163 HH11 ARG 157 2HH1 ARG 157 13.720 -0.684 -6.511 1164 HH12 ARG 157 1HH1 ARG 157 14.647 -0.243 -7.998 1165 HH21 ARG 157 1HH2 ARG 157 14.383 -3.491 -9.150 1166 HH22 ARG 157 2HH2 ARG 157 15.043 -1.812 -9.428 1167 H SER 158 H SER 158 15.133 -6.837 -5.220 1168 HA SER 158 HA SER 158 16.915 -8.521 -4.393 1169 HG SER 158 HG SER 158 17.094 -9.646 -7.062 1170 HB2 SER 158 2HB SER 158 16.061 -7.939 -6.792 1171 HB3 SER 158 1HB SER 158 17.528 -6.982 -6.991 1172 H ALA 159 H ALA 159 18.341 -8.204 -2.759 1173 HA ALA 159 HA ALA 159 20.404 -6.157 -2.648 1174 HB1 ALA 159 3HB ALA 159 19.303 -7.214 -0.663 1175 HB2 ALA 159 1HB ALA 159 21.072 -7.429 -0.547 1176 HB3 ALA 159 2HB ALA 159 20.031 -8.787 -1.052 1177 H SER 160 H SER 160 22.533 -6.093 -3.008 1178 HA SER 160 HA SER 160 24.040 -8.597 -3.942 1179 HG SER 160 HG SER 160 25.265 -7.180 -6.764 1180 HB2 SER 160 2HB SER 160 23.346 -7.043 -5.782 1181 HB3 SER 160 1HB SER 160 24.301 -5.734 -5.055 1182 H SER 161 H SER 161 26.142 -8.813 -3.590 1183 HA SER 161 HA SER 161 28.118 -8.927 -2.346 1184 HG SER 161 HG SER 161 30.150 -6.508 -1.660 1185 HB2 SER 161 2HB SER 161 28.291 -6.370 -2.681 1186 HB3 SER 161 1HB SER 161 27.732 -6.225 -1.010 1187 H ARG 162 H ARG 162 28.915 -8.893 0.077 1188 HA ARG 162 HA ARG 162 26.769 -9.298 2.077 1189 HE ARG 162 HE ARG 162 24.623 -13.172 4.208 1190 HB2 ARG 162 1HB ARG 162 26.778 -11.504 0.665 1191 HB3 ARG 162 2HB ARG 162 28.292 -11.911 1.455 1192 HG2 ARG 162 1HG ARG 162 27.154 -11.943 3.694 1193 HG3 ARG 162 2HG ARG 162 25.705 -11.189 3.013 1194 HD2 ARG 162 1HD ARG 162 25.368 -13.205 1.477 1195 HD3 ARG 162 2HD ARG 162 26.770 -13.981 2.226 1196 HH11 ARG 162 2HH1 ARG 162 25.416 -15.747 1.937 1197 HH12 ARG 162 1HH1 ARG 162 24.505 -16.925 2.988 1198 HH21 ARG 162 1HH2 ARG 162 23.675 -14.667 5.369 1199 HH22 ARG 162 2HH2 ARG 162 23.636 -16.358 4.725 Start of MODEL 5 1 HA MET 1 HA MET 1 16.008 5.503 1.461 2 H1 MET 1 1H MET 1 15.331 6.754 3.655 3 H2 MET 1 2H MET 1 15.132 7.664 2.276 4 H3 MET 1 3H MET 1 13.859 7.027 2.968 5 HB2 MET 1 1HB MET 1 13.770 4.441 3.276 6 HB3 MET 1 2HB MET 1 14.451 3.456 2.036 7 HG2 MET 1 1HG MET 1 16.656 4.590 3.715 8 HG3 MET 1 2HG MET 1 15.463 3.743 4.688 9 HE1 MET 1 3HE MET 1 14.753 1.228 4.377 10 HE2 MET 1 1HE MET 1 16.236 1.372 5.377 11 HE3 MET 1 2HE MET 1 16.085 0.091 4.121 12 H GLU 2 H GLU 2 13.202 4.078 0.638 13 HA GLU 2 HA GLU 2 11.816 6.484 -0.433 14 HB2 GLU 2 2HB GLU 2 11.485 5.779 -2.736 15 HB3 GLU 2 1HB GLU 2 13.107 6.200 -2.330 16 HG2 GLU 2 2HG GLU 2 13.221 3.386 -2.038 17 HG3 GLU 2 1HG GLU 2 12.078 3.559 -3.369 18 H LEU 3 H LEU 3 10.172 3.968 -1.854 19 HA LEU 3 HA LEU 3 8.283 4.212 0.530 20 HG LEU 3 HG LEU 3 8.548 6.029 -2.573 21 HB2 LEU 3 2HB LEU 3 6.358 4.273 -1.301 22 HB3 LEU 3 1HB LEU 3 7.154 5.642 -0.622 23 HD11 LEU 3 1HD1 LEU 3 7.065 3.626 -3.894 24 HD12 LEU 3 2HD1 LEU 3 8.756 3.589 -3.365 25 HD13 LEU 3 3HD1 LEU 3 8.290 4.676 -4.660 26 HD21 LEU 3 3HD2 LEU 3 5.507 5.751 -2.928 27 HD22 LEU 3 1HD2 LEU 3 6.507 6.512 -4.181 28 HD23 LEU 3 2HD2 LEU 3 6.453 7.205 -2.546 29 H VAL 4 H VAL 4 6.894 2.755 1.157 30 HA VAL 4 HA VAL 4 7.296 -0.087 0.148 31 HB VAL 4 HB VAL 4 6.980 1.035 2.967 32 HG11 VAL 4 1HG1 VAL 4 7.375 -1.865 2.053 33 HG12 VAL 4 2HG1 VAL 4 6.063 -1.202 3.001 34 HG13 VAL 4 3HG1 VAL 4 7.690 -1.348 3.727 35 HG21 VAL 4 3HG2 VAL 4 9.218 1.648 2.220 36 HG22 VAL 4 1HG2 VAL 4 9.605 -0.014 1.765 37 HG23 VAL 4 2HG2 VAL 4 9.307 0.424 3.474 38 H SER 5 H SER 5 5.509 -1.236 -0.471 39 HA SER 5 HA SER 5 2.796 0.017 -0.115 40 HG SER 5 HG SER 5 3.845 -3.143 -1.218 41 HB2 SER 5 2HB SER 5 2.284 -1.573 -2.013 42 HB3 SER 5 1HB SER 5 3.674 -0.536 -2.325 43 H VAL 6 H VAL 6 0.968 -0.775 0.768 44 HA VAL 6 HA VAL 6 1.126 -3.255 2.487 45 HB VAL 6 HB VAL 6 1.049 -2.336 4.464 46 HG11 VAL 6 1HG1 VAL 6 2.101 0.289 3.286 47 HG12 VAL 6 2HG1 VAL 6 3.083 -1.174 3.397 48 HG13 VAL 6 3HG1 VAL 6 2.451 -0.426 4.880 49 HG21 VAL 6 3HG2 VAL 6 -0.429 0.233 3.692 50 HG22 VAL 6 1HG2 VAL 6 0.095 -0.215 5.331 51 HG23 VAL 6 2HG2 VAL 6 -1.133 -1.180 4.516 52 H ALA 7 H ALA 7 -0.303 -4.404 1.268 53 HA ALA 7 HA ALA 7 -3.258 -3.548 1.587 54 HB1 ALA 7 3HB ALA 7 -3.750 -4.619 -0.614 55 HB2 ALA 7 1HB ALA 7 -2.016 -4.987 -0.848 56 HB3 ALA 7 2HB ALA 7 -2.580 -3.299 -0.789 57 H ALA 8 H ALA 8 -4.504 -4.966 2.709 58 HA ALA 8 HA ALA 8 -3.676 -7.755 3.236 59 HB1 ALA 8 3HB ALA 8 -5.633 -7.578 4.875 60 HB2 ALA 8 1HB ALA 8 -5.931 -5.936 4.293 61 HB3 ALA 8 2HB ALA 8 -4.397 -6.328 5.057 62 H LEU 9 H LEU 9 -4.274 -9.512 2.106 63 HA LEU 9 HA LEU 9 -6.862 -9.630 0.503 64 HG LEU 9 HG LEU 9 -3.487 -9.724 -2.145 65 HB2 LEU 9 2HB LEU 9 -5.584 -10.289 -1.532 66 HB3 LEU 9 1HB LEU 9 -5.382 -8.662 -1.019 67 HD11 LEU 9 1HD1 LEU 9 -2.798 -8.554 0.613 68 HD12 LEU 9 2HD1 LEU 9 -3.278 -7.591 -0.800 69 HD13 LEU 9 3HD1 LEU 9 -1.770 -8.496 -0.807 70 HD21 LEU 9 3HD2 LEU 9 -3.476 -11.964 -0.940 71 HD22 LEU 9 1HD2 LEU 9 -2.773 -11.124 0.490 72 HD23 LEU 9 2HD2 LEU 9 -1.892 -11.177 -1.046 73 H ALA 10 H ALA 10 -7.603 -11.570 -0.349 74 HA ALA 10 HA ALA 10 -6.810 -13.996 1.305 75 HB1 ALA 10 3HB ALA 10 -9.175 -14.592 1.015 76 HB2 ALA 10 1HB ALA 10 -9.409 -13.437 -0.314 77 HB3 ALA 10 2HB ALA 10 -9.119 -12.866 1.341 78 H GLU 11 H GLU 11 -8.230 -15.913 -0.362 79 HA GLU 11 HA GLU 11 -6.027 -16.939 -2.055 80 HB2 GLU 11 2HB GLU 11 -7.509 -18.415 -0.775 81 HB3 GLU 11 1HB GLU 11 -8.924 -17.869 -1.657 82 HG2 GLU 11 2HG GLU 11 -8.295 -20.098 -2.404 83 HG3 GLU 11 1HG GLU 11 -8.237 -18.961 -3.729 84 H ASN 12 H ASN 12 -6.225 -17.481 -4.228 85 HA ASN 12 HA ASN 12 -5.827 -16.549 -6.333 86 HB2 ASN 12 2HB ASN 12 -8.728 -16.289 -6.039 87 HB3 ASN 12 1HB ASN 12 -8.225 -14.815 -6.772 88 HD21 ASN 12 1HD2 ASN 12 -6.609 -15.268 -8.711 89 HD22 ASN 12 2HD2 ASN 12 -7.354 -16.518 -9.857 90 H ARG 13 H ARG 13 -5.283 -14.822 -3.809 91 HA ARG 13 HA ARG 13 -4.467 -12.735 -3.215 92 HE ARG 13 HE ARG 13 -2.038 -11.778 -8.831 93 HB2 ARG 13 2HB ARG 13 -2.776 -11.644 -4.528 94 HB3 ARG 13 1HB ARG 13 -2.536 -13.383 -4.411 95 HG2 ARG 13 2HG ARG 13 -3.371 -13.679 -6.761 96 HG3 ARG 13 1HG ARG 13 -3.657 -11.939 -6.915 97 HD2 ARG 13 2HD ARG 13 -1.131 -11.613 -6.486 98 HD3 ARG 13 1HD ARG 13 -0.935 -13.341 -6.389 99 HH11 ARG 13 2HH1 ARG 13 -0.043 -14.292 -7.637 100 HH12 ARG 13 1HH1 ARG 13 0.514 -14.798 -9.308 101 HH21 ARG 13 1HH2 ARG 13 -1.443 -12.357 -10.716 102 HH22 ARG 13 2HH2 ARG 13 -0.244 -13.693 -10.981 103 H VAL 14 H VAL 14 -6.854 -12.487 -3.269 104 HA VAL 14 HA VAL 14 -7.807 -10.124 -4.937 105 HB VAL 14 HB VAL 14 -9.157 -12.295 -3.255 106 HG11 VAL 14 1HG1 VAL 14 -10.399 -10.293 -2.453 107 HG12 VAL 14 2HG1 VAL 14 -11.389 -11.314 -3.477 108 HG13 VAL 14 3HG1 VAL 14 -10.734 -9.783 -4.122 109 HG21 VAL 14 3HG2 VAL 14 -9.712 -11.174 -6.099 110 HG22 VAL 14 1HG2 VAL 14 -10.456 -12.630 -5.368 111 HG23 VAL 14 2HG2 VAL 14 -8.713 -12.606 -5.748 112 H ILE 15 H ILE 15 -7.428 -8.137 -4.166 113 HA ILE 15 HA ILE 15 -6.985 -7.426 -1.294 114 HB ILE 15 HB ILE 15 -7.801 -5.398 -3.418 115 HG12 ILE 15 2HG1 ILE 15 -4.881 -5.269 -2.904 116 HG13 ILE 15 1HG1 ILE 15 -5.248 -6.889 -3.387 117 HG21 ILE 15 1HG2 ILE 15 -6.286 -5.125 -0.738 118 HG22 ILE 15 2HG2 ILE 15 -7.895 -4.478 -1.131 119 HG23 ILE 15 3HG2 ILE 15 -6.455 -3.801 -1.915 120 HD11 ILE 15 3HD1 ILE 15 -6.337 -6.043 -5.529 121 HD12 ILE 15 1HD1 ILE 15 -4.686 -5.419 -5.379 122 HD13 ILE 15 2HD1 ILE 15 -6.054 -4.369 -5.017 123 H GLY 16 H GLY 16 -9.851 -6.987 -3.342 124 HA2 GLY 16 2HA GLY 16 -11.673 -7.969 -1.316 125 HA3 GLY 16 1HA GLY 16 -11.623 -6.208 -1.093 126 H ARG 17 H ARG 17 -13.576 -5.706 -1.739 127 HA ARG 17 HA ARG 17 -14.663 -6.769 -4.407 128 HE ARG 17 HE ARG 17 -19.685 -7.140 -3.813 129 HB2 ARG 17 2HB ARG 17 -15.463 -7.984 -2.360 130 HB3 ARG 17 1HB ARG 17 -16.207 -6.500 -1.775 131 HG2 ARG 17 2HG ARG 17 -17.622 -6.376 -3.851 132 HG3 ARG 17 1HG ARG 17 -16.925 -7.888 -4.470 133 HD2 ARG 17 2HD ARG 17 -17.922 -9.238 -2.835 134 HD3 ARG 17 1HD ARG 17 -18.004 -7.978 -1.601 135 HH11 ARG 17 2HH1 ARG 17 -19.555 -9.458 -1.293 136 HH12 ARG 17 1HH1 ARG 17 -21.365 -9.591 -1.085 137 HH21 ARG 17 1HH2 ARG 17 -21.727 -7.217 -3.658 138 HH22 ARG 17 2HH2 ARG 17 -22.584 -8.302 -2.448 139 H ASP 18 H ASP 18 -16.153 -4.327 -2.148 140 HA ASP 18 HA ASP 18 -17.234 -2.995 -4.495 141 HB2 ASP 18 2HB ASP 18 -18.227 -1.345 -2.939 142 HB3 ASP 18 1HB ASP 18 -18.618 -3.010 -2.590 143 H GLY 19 H GLY 19 -14.507 -2.011 -2.519 144 HA2 GLY 19 2HA GLY 19 -13.337 -0.819 -5.060 145 HA3 GLY 19 1HA GLY 19 -13.344 0.300 -3.706 146 H GLU 20 H GLU 20 -12.223 -0.622 -1.690 147 HA GLU 20 HA GLU 20 -9.597 -1.959 -2.537 148 HB2 GLU 20 2HB GLU 20 -8.492 -0.937 -0.648 149 HB3 GLU 20 1HB GLU 20 -9.160 0.188 -1.800 150 HG2 GLU 20 2HG GLU 20 -10.889 0.968 -0.251 151 HG3 GLU 20 1HG GLU 20 -10.671 -0.372 0.835 152 H LEU 21 H LEU 21 -10.507 -1.940 0.765 153 HA LEU 21 HA LEU 21 -10.229 -4.920 0.948 154 HG LEU 21 HG LEU 21 -8.590 -2.304 1.984 155 HB2 LEU 21 2HB LEU 21 -10.784 -2.799 3.114 156 HB3 LEU 21 1HB LEU 21 -10.277 -4.449 3.428 157 HD11 LEU 21 1HD1 LEU 21 -9.051 -1.789 4.412 158 HD12 LEU 21 2HD1 LEU 21 -7.334 -2.028 4.048 159 HD13 LEU 21 3HD1 LEU 21 -8.252 -3.311 4.878 160 HD21 LEU 21 3HD2 LEU 21 -7.701 -5.095 2.973 161 HD22 LEU 21 1HD2 LEU 21 -6.668 -3.868 2.182 162 HD23 LEU 21 2HD2 LEU 21 -7.972 -4.667 1.282 163 HA PRO 22 HA PRO 22 -14.855 -5.268 1.303 164 HB2 PRO 22 2HB PRO 22 -15.138 -7.957 1.622 165 HB3 PRO 22 1HB PRO 22 -14.424 -7.235 0.172 166 HG2 PRO 22 2HG PRO 22 -13.007 -8.607 2.494 167 HG3 PRO 22 1HG PRO 22 -12.624 -8.730 0.771 168 HD2 PRO 22 2HD PRO 22 -11.402 -6.934 2.704 169 HD3 PRO 22 1HD PRO 22 -11.147 -6.913 0.954 170 H TRP 23 H TRP 23 -13.021 -6.517 4.001 171 HA TRP 23 HA TRP 23 -15.175 -6.003 6.054 172 HD1 TRP 23 HD1 TRP 23 -11.311 -4.981 7.516 173 HE1 TRP 23 HE1 TRP 23 -8.971 -5.074 6.240 174 HE3 TRP 23 HE3 TRP 23 -12.223 -9.255 4.996 175 HZ2 TRP 23 HZ2 TRP 23 -7.857 -6.887 4.465 176 HZ3 TRP 23 HZ3 TRP 23 -10.519 -10.069 3.381 177 HH2 TRP 23 HH2 TRP 23 -8.385 -8.838 3.073 178 HB2 TRP 23 2HB TRP 23 -13.513 -6.674 7.750 179 HB3 TRP 23 1HB TRP 23 -13.647 -7.897 6.511 180 HA PRO 24 HA PRO 24 -14.049 -1.579 6.176 181 HB2 PRO 24 2HB PRO 24 -14.444 -1.468 9.175 182 HB3 PRO 24 1HB PRO 24 -15.251 -0.562 7.891 183 HG2 PRO 24 2HG PRO 24 -16.538 -2.618 9.231 184 HG3 PRO 24 1HG PRO 24 -16.834 -2.319 7.510 185 HD2 PRO 24 2HD PRO 24 -15.051 -4.476 8.718 186 HD3 PRO 24 1HD PRO 24 -16.187 -4.555 7.335 187 H SER 25 H SER 25 -12.560 -3.343 8.731 188 HA SER 25 HA SER 25 -9.972 -3.396 8.037 189 HG SER 25 HG SER 25 -10.323 -0.796 7.358 190 HB2 SER 25 2HB SER 25 -10.008 -0.914 9.819 191 HB3 SER 25 1HB SER 25 -8.562 -1.827 9.306 192 H ILE 26 H ILE 26 -9.634 -5.186 9.317 193 HA ILE 26 HA ILE 26 -10.735 -5.484 12.014 194 HB ILE 26 HB ILE 26 -9.137 -7.452 12.298 195 HG12 ILE 26 2HG1 ILE 26 -7.632 -6.467 10.195 196 HG13 ILE 26 1HG1 ILE 26 -7.482 -8.022 10.942 197 HG21 ILE 26 1HG2 ILE 26 -11.209 -7.608 10.051 198 HG22 ILE 26 2HG2 ILE 26 -11.473 -7.791 11.805 199 HG23 ILE 26 3HG2 ILE 26 -10.503 -8.971 10.915 200 HD11 ILE 26 3HD1 ILE 26 -8.717 -9.139 9.127 201 HD12 ILE 26 1HD1 ILE 26 -7.560 -8.021 8.362 202 HD13 ILE 26 2HD1 ILE 26 -9.268 -7.595 8.453 203 HA PRO 27 HA PRO 27 -7.813 -3.275 14.677 204 HB2 PRO 27 2HB PRO 27 -8.008 -5.693 16.564 205 HB3 PRO 27 1HB PRO 27 -8.118 -3.957 16.939 206 HG2 PRO 27 2HG PRO 27 -10.441 -5.340 16.725 207 HG3 PRO 27 1HG PRO 27 -10.313 -3.790 15.845 208 HD2 PRO 27 2HD PRO 27 -9.905 -6.595 14.652 209 HD3 PRO 27 1HD PRO 27 -10.939 -5.238 14.085 210 H ALA 28 H ALA 28 -6.768 -6.455 13.855 211 HA ALA 28 HA ALA 28 -3.855 -6.076 14.448 212 HB1 ALA 28 3HB ALA 28 -4.693 -8.317 14.260 213 HB2 ALA 28 1HB ALA 28 -3.647 -8.082 12.863 214 HB3 ALA 28 2HB ALA 28 -5.391 -8.055 12.637 215 H ASP 29 H ASP 29 -5.890 -5.449 11.559 216 HA ASP 29 HA ASP 29 -3.683 -4.235 9.951 217 HB2 ASP 29 2HB ASP 29 -5.631 -5.366 8.898 218 HB3 ASP 29 1HB ASP 29 -6.756 -4.215 9.612 219 H LYS 30 H LYS 30 -6.635 -2.649 11.332 220 HA LYS 30 HA LYS 30 -5.472 -0.052 11.144 221 HB2 LYS 30 2HB LYS 30 -8.022 -0.910 11.760 222 HB3 LYS 30 1HB LYS 30 -7.555 -0.248 13.300 223 HG2 LYS 30 2HG LYS 30 -8.663 1.542 12.130 224 HG3 LYS 30 1HG LYS 30 -6.954 1.984 12.080 225 HD2 LYS 30 2HD LYS 30 -6.793 1.160 9.690 226 HD3 LYS 30 1HD LYS 30 -8.312 0.437 9.806 227 HE2 LYS 30 2HE LYS 30 -8.433 3.445 10.266 228 HE3 LYS 30 1HE LYS 30 -7.768 2.993 8.732 229 HZ1 LYS 30 3HZ LYS 30 -10.414 1.870 9.658 230 HZ2 LYS 30 1HZ LYS 30 -9.770 1.772 8.150 231 HZ3 LYS 30 2HZ LYS 30 -10.284 3.221 8.772 232 H LYS 31 H LYS 31 -4.459 -2.158 13.353 233 HA LYS 31 HA LYS 31 -2.886 -0.100 14.957 234 HB2 LYS 31 2HB LYS 31 -3.888 -1.878 16.396 235 HB3 LYS 31 1HB LYS 31 -3.184 -3.112 15.374 236 HG2 LYS 31 2HG LYS 31 -1.903 -2.936 17.456 237 HG3 LYS 31 1HG LYS 31 -0.975 -2.732 15.991 238 HD2 LYS 31 2HD LYS 31 -1.201 -0.111 16.392 239 HD3 LYS 31 1HD LYS 31 -1.800 -0.529 17.999 240 HE2 LYS 31 2HE LYS 31 0.314 -1.735 18.537 241 HE3 LYS 31 1HE LYS 31 0.864 -1.651 16.852 242 HZ1 LYS 31 3HZ LYS 31 1.207 0.696 16.974 243 HZ2 LYS 31 1HZ LYS 31 1.785 0.209 18.417 244 HZ3 LYS 31 2HZ LYS 31 0.293 0.925 18.319 245 H GLN 32 H GLN 32 -2.304 -2.892 12.661 246 HA GLN 32 HA GLN 32 0.658 -2.566 12.725 247 HB2 GLN 32 2HB GLN 32 -0.212 -4.759 12.197 248 HB3 GLN 32 1HB GLN 32 -1.137 -4.138 10.828 249 HG2 GLN 32 2HG GLN 32 1.076 -3.477 9.673 250 HG3 GLN 32 1HG GLN 32 1.954 -4.235 10.995 251 HE21 GLN 32 1HE2 GLN 32 -0.014 -4.857 8.172 252 HE22 GLN 32 2HE2 GLN 32 0.173 -6.685 8.301 253 H TYR 33 H TYR 33 -1.905 -1.647 10.341 254 HA TYR 33 HA TYR 33 -0.202 0.077 8.692 255 HD1 TYR 33 HD1 TYR 33 -3.832 1.008 10.366 256 HD2 TYR 33 HD2 TYR 33 -3.015 1.851 6.269 257 HE1 TYR 33 HE1 TYR 33 -5.291 2.994 10.490 258 HE2 TYR 33 HE2 TYR 33 -4.486 3.856 6.397 259 HH TYR 33 HH TYR 33 -5.414 5.469 8.184 260 HB2 TYR 33 2HB TYR 33 -2.027 -0.203 7.410 261 HB3 TYR 33 1HB TYR 33 -3.008 -0.762 8.690 262 H ARG 34 H ARG 34 -1.700 0.865 11.843 263 HA ARG 34 HA ARG 34 -0.736 3.737 11.507 264 HE ARG 34 HE ARG 34 -5.305 5.191 11.950 265 HB2 ARG 34 2HB ARG 34 -2.169 2.347 13.824 266 HB3 ARG 34 1HB ARG 34 -1.433 3.951 14.004 267 HG2 ARG 34 2HG ARG 34 -2.835 4.785 11.994 268 HG3 ARG 34 1HG ARG 34 -3.570 3.197 11.941 269 HD2 ARG 34 2HD ARG 34 -4.473 3.458 14.246 270 HD3 ARG 34 1HD ARG 34 -3.713 5.074 14.370 271 HH11 ARG 34 2HH1 ARG 34 -5.955 4.727 15.304 272 HH12 ARG 34 1HH1 ARG 34 -7.648 5.400 15.158 273 HH21 ARG 34 1HH2 ARG 34 -7.284 5.905 11.770 274 HH22 ARG 34 2HH2 ARG 34 -8.363 6.006 13.180 275 H SER 35 H SER 35 0.720 0.922 12.886 276 HA SER 35 HA SER 35 3.131 2.677 13.706 277 HG SER 35 HG SER 35 2.574 2.541 15.727 278 HB2 SER 35 2HB SER 35 2.474 -0.124 14.725 279 HB3 SER 35 1HB SER 35 4.015 0.712 14.972 280 H ARG 36 H ARG 36 2.091 1.064 11.151 281 HA ARG 36 HA ARG 36 4.909 1.067 9.965 282 HE ARG 36 HE ARG 36 5.987 -3.246 7.931 283 HB2 ARG 36 2HB ARG 36 2.993 -0.854 9.560 284 HB3 ARG 36 1HB ARG 36 2.312 0.334 8.504 285 HG2 ARG 36 2HG ARG 36 3.602 -1.228 7.200 286 HG3 ARG 36 1HG ARG 36 4.275 0.352 7.111 287 HD2 ARG 36 2HD ARG 36 6.174 -1.002 7.254 288 HD3 ARG 36 1HD ARG 36 6.111 -0.441 8.885 289 HH11 ARG 36 2HH1 ARG 36 4.814 -1.347 10.563 290 HH12 ARG 36 1HH1 ARG 36 4.856 -2.828 11.648 291 HH21 ARG 36 1HH2 ARG 36 6.094 -4.732 9.099 292 HH22 ARG 36 2HH2 ARG 36 5.464 -4.748 10.801 293 H VAL 37 H VAL 37 1.570 2.482 9.231 294 HA VAL 37 HA VAL 37 2.992 4.647 7.710 295 HB VAL 37 HB VAL 37 1.427 4.765 6.206 296 HG11 VAL 37 1HG1 VAL 37 0.651 1.869 6.854 297 HG12 VAL 37 2HG1 VAL 37 2.205 2.337 6.119 298 HG13 VAL 37 3HG1 VAL 37 0.688 2.651 5.251 299 HG21 VAL 37 3HG2 VAL 37 -0.851 3.904 8.056 300 HG22 VAL 37 1HG2 VAL 37 -1.049 3.978 6.303 301 HG23 VAL 37 2HG2 VAL 37 -0.621 5.430 7.226 302 H ALA 38 H ALA 38 1.418 4.864 10.781 303 HA ALA 38 HA ALA 38 -0.126 7.326 10.102 304 HB1 ALA 38 3HB ALA 38 0.513 6.319 12.899 305 HB2 ALA 38 1HB ALA 38 -0.920 5.916 11.928 306 HB3 ALA 38 2HB ALA 38 -0.649 7.583 12.462 307 H ASP 39 H ASP 39 3.139 6.941 11.240 308 HA ASP 39 HA ASP 39 3.704 9.888 11.383 309 HB2 ASP 39 2HB ASP 39 5.287 7.326 11.849 310 HB3 ASP 39 1HB ASP 39 6.173 8.673 11.203 311 H ASP 40 H ASP 40 4.519 7.302 8.972 312 HA ASP 40 HA ASP 40 5.511 9.213 7.130 313 HB2 ASP 40 2HB ASP 40 5.020 6.213 7.196 314 HB3 ASP 40 1HB ASP 40 5.548 6.932 5.701 315 HA PRO 41 HA PRO 41 2.195 10.181 4.092 316 HB2 PRO 41 2HB PRO 41 4.543 9.917 2.102 317 HB3 PRO 41 1HB PRO 41 3.287 11.159 2.134 318 HG2 PRO 41 2HG PRO 41 5.684 11.778 3.216 319 HG3 PRO 41 1HG PRO 41 4.277 12.107 4.253 320 HD2 PRO 41 2HD PRO 41 6.090 9.631 4.389 321 HD3 PRO 41 1HD PRO 41 5.533 10.720 5.689 322 H VAL 42 H VAL 42 0.703 8.926 3.060 323 HA VAL 42 HA VAL 42 1.583 6.328 1.762 324 HB VAL 42 HB VAL 42 -1.180 7.159 2.742 325 HG11 VAL 42 1HG1 VAL 42 -1.256 5.300 0.963 326 HG12 VAL 42 2HG1 VAL 42 -1.764 4.732 2.562 327 HG13 VAL 42 3HG1 VAL 42 -0.148 4.332 1.962 328 HG21 VAL 42 3HG2 VAL 42 0.226 6.861 4.737 329 HG22 VAL 42 1HG2 VAL 42 1.154 5.558 3.992 330 HG23 VAL 42 2HG2 VAL 42 -0.512 5.253 4.523 331 H VAL 43 H VAL 43 1.618 5.984 -0.343 332 HA VAL 43 HA VAL 43 0.093 7.743 -2.275 333 HB VAL 43 HB VAL 43 1.593 7.206 -4.007 334 HG11 VAL 43 1HG1 VAL 43 3.425 7.428 -1.519 335 HG12 VAL 43 2HG1 VAL 43 2.642 8.798 -2.287 336 HG13 VAL 43 3HG1 VAL 43 3.854 7.846 -3.183 337 HG21 VAL 43 3HG2 VAL 43 3.499 5.600 -3.850 338 HG22 VAL 43 1HG2 VAL 43 1.978 4.739 -3.699 339 HG23 VAL 43 2HG2 VAL 43 2.961 5.090 -2.247 340 H LEU 44 H LEU 44 -1.857 7.162 -2.958 341 HA LEU 44 HA LEU 44 -2.547 4.206 -3.429 342 HG LEU 44 HG LEU 44 -4.465 7.097 -1.996 343 HB2 LEU 44 2HB LEU 44 -4.416 4.276 -1.943 344 HB3 LEU 44 1HB LEU 44 -2.974 4.589 -1.094 345 HD11 LEU 44 1HD1 LEU 44 -6.064 6.983 -0.041 346 HD12 LEU 44 2HD1 LEU 44 -5.538 5.320 0.321 347 HD13 LEU 44 3HD1 LEU 44 -6.424 5.692 -1.186 348 HD21 LEU 44 3HD2 LEU 44 -3.848 7.906 0.260 349 HD22 LEU 44 1HD2 LEU 44 -2.420 7.208 -0.532 350 HD23 LEU 44 2HD2 LEU 44 -3.292 6.303 0.761 351 H GLY 45 H GLY 45 -5.180 4.176 -3.957 352 HA2 GLY 45 2HA GLY 45 -5.145 5.213 -6.825 353 HA3 GLY 45 1HA GLY 45 -6.142 3.921 -6.172 354 H ARG 46 H ARG 46 -7.692 5.047 -7.453 355 HA ARG 46 HA ARG 46 -9.268 6.891 -5.630 356 HE ARG 46 HE ARG 46 -12.372 9.106 -6.486 357 HB2 ARG 46 2HB ARG 46 -9.562 6.688 -8.644 358 HB3 ARG 46 1HB ARG 46 -11.014 6.924 -7.720 359 HG2 ARG 46 2HG ARG 46 -8.516 8.732 -7.650 360 HG3 ARG 46 1HG ARG 46 -9.976 9.092 -8.556 361 HD2 ARG 46 2HD ARG 46 -10.265 8.677 -5.492 362 HD3 ARG 46 1HD ARG 46 -9.553 10.147 -6.003 363 HH11 ARG 46 2HH1 ARG 46 -10.178 11.795 -7.033 364 HH12 ARG 46 1HH1 ARG 46 -11.565 12.941 -7.316 365 HH21 ARG 46 1HH2 ARG 46 -13.818 10.350 -6.699 366 HH22 ARG 46 2HH2 ARG 46 -13.625 12.152 -7.013 367 H THR 47 H THR 47 -9.627 3.785 -7.387 368 HA THR 47 HA THR 47 -11.516 2.414 -5.905 369 HB THR 47 HB THR 47 -8.579 1.739 -6.575 370 HG1 THR 47 HG1 THR 47 -10.985 0.735 -7.683 371 HG21 THR 47 3HG2 THR 47 -9.193 -0.010 -4.909 372 HG22 THR 47 1HG2 THR 47 -9.208 -0.704 -6.552 373 HG23 THR 47 2HG2 THR 47 -10.743 -0.305 -5.736 374 H THR 48 H THR 48 -8.311 2.291 -4.285 375 HA THR 48 HA THR 48 -9.276 2.246 -1.600 376 HB THR 48 HB THR 48 -6.945 2.885 -0.933 377 HG1 THR 48 HG1 THR 48 -6.448 4.354 -2.342 378 HG21 THR 48 3HG2 THR 48 -6.892 0.596 -1.356 379 HG22 THR 48 1HG2 THR 48 -5.529 1.271 -2.248 380 HG23 THR 48 2HG2 THR 48 -7.006 0.752 -3.126 381 H PHE 49 H PHE 49 -8.875 5.278 -3.358 382 HA PHE 49 HA PHE 49 -8.760 6.873 -0.781 383 HD1 PHE 49 HD2 PHE 49 -10.456 9.876 -2.472 384 HD2 PHE 49 HD1 PHE 49 -6.351 9.190 -1.411 385 HE1 PHE 49 HE2 PHE 49 -10.360 12.089 -1.371 386 HE2 PHE 49 HE1 PHE 49 -6.222 11.475 -0.494 387 HZ PHE 49 HZ PHE 49 -8.235 12.848 -0.322 388 HB2 PHE 49 2HB PHE 49 -7.462 7.584 -2.760 389 HB3 PHE 49 1HB PHE 49 -8.928 8.011 -3.615 390 H GLU 50 H GLU 50 -11.311 5.843 -2.950 391 HA GLU 50 HA GLU 50 -13.272 7.787 -1.707 392 HB2 GLU 50 2HB GLU 50 -13.599 5.721 -3.946 393 HB3 GLU 50 1HB GLU 50 -14.915 6.679 -3.291 394 HG2 GLU 50 2HG GLU 50 -13.597 8.846 -3.849 395 HG3 GLU 50 1HG GLU 50 -12.360 7.846 -4.588 396 H SER 51 H SER 51 -12.205 4.615 -0.882 397 HA SER 51 HA SER 51 -13.909 4.522 1.597 398 HG SER 51 HG SER 51 -12.167 1.796 2.648 399 HB2 SER 51 2HB SER 51 -12.721 2.478 0.552 400 HB3 SER 51 1HB SER 51 -11.198 3.237 1.057 401 H MET 52 H MET 52 -10.400 5.134 1.290 402 HA MET 52 HA MET 52 -9.850 6.294 3.727 403 HB2 MET 52 2HB MET 52 -8.315 5.733 1.596 404 HB3 MET 52 1HB MET 52 -8.536 7.454 1.204 405 HG2 MET 52 2HG MET 52 -6.433 7.280 2.373 406 HG3 MET 52 1HG MET 52 -7.560 8.063 3.466 407 HE1 MET 52 3HE MET 52 -5.207 5.294 2.809 408 HE2 MET 52 1HE MET 52 -6.520 4.055 2.757 409 HE3 MET 52 2HE MET 52 -5.415 4.152 4.172 410 H ARG 53 H ARG 53 -11.295 8.215 1.330 411 HA ARG 53 HA ARG 53 -11.312 10.881 2.591 412 HE ARG 53 HE ARG 53 -15.561 11.126 3.354 413 HB2 ARG 53 2HB ARG 53 -11.827 10.428 0.262 414 HB3 ARG 53 1HB ARG 53 -13.096 9.296 0.647 415 HG2 ARG 53 2HG ARG 53 -13.273 12.225 1.572 416 HG3 ARG 53 1HG ARG 53 -13.601 11.846 -0.089 417 HD2 ARG 53 2HD ARG 53 -15.766 11.101 0.379 418 HD3 ARG 53 1HD ARG 53 -15.141 9.870 1.419 419 HH11 ARG 53 2HH1 ARG 53 -15.510 13.303 0.715 420 HH12 ARG 53 1HH1 ARG 53 -16.160 14.715 1.689 421 HH21 ARG 53 1HH2 ARG 53 -16.304 12.627 4.442 422 HH22 ARG 53 2HH2 ARG 53 -16.612 14.321 3.802 423 H ASP 54 H ASP 54 -12.650 8.010 3.936 424 HA ASP 54 HA ASP 54 -13.931 9.777 6.068 425 HB2 ASP 54 2HB ASP 54 -14.933 7.225 4.951 426 HB3 ASP 54 1HB ASP 54 -14.630 7.031 6.669 427 H ASP 55 H ASP 55 -12.188 6.596 6.506 428 HA ASP 55 HA ASP 55 -10.568 7.905 8.637 429 HB2 ASP 55 2HB ASP 55 -11.037 5.100 7.796 430 HB3 ASP 55 1HB ASP 55 -9.334 5.367 8.009 431 H LEU 56 H LEU 56 -8.843 9.120 8.381 432 HA LEU 56 HA LEU 56 -7.293 9.170 5.863 433 HG LEU 56 HG LEU 56 -7.493 12.720 6.835 434 HB2 LEU 56 2HB LEU 56 -6.539 10.731 8.365 435 HB3 LEU 56 1HB LEU 56 -6.063 11.018 6.730 436 HD11 LEU 56 1HD1 LEU 56 -9.756 10.689 6.283 437 HD12 LEU 56 2HD1 LEU 56 -8.670 11.348 5.046 438 HD13 LEU 56 3HD1 LEU 56 -9.761 12.420 5.928 439 HD21 LEU 56 3HD2 LEU 56 -9.409 11.356 8.790 440 HD22 LEU 56 1HD2 LEU 56 -9.293 13.091 8.374 441 HD23 LEU 56 2HD2 LEU 56 -7.974 12.312 9.268 442 HA PRO 57 HA PRO 57 -4.051 6.248 7.265 443 HB2 PRO 57 2HB PRO 57 -2.184 6.483 5.316 444 HB3 PRO 57 1HB PRO 57 -3.816 5.875 5.029 445 HG2 PRO 57 2HG PRO 57 -2.698 8.634 4.365 446 HG3 PRO 57 1HG PRO 57 -3.843 7.628 3.427 447 HD2 PRO 57 2HD PRO 57 -4.551 9.761 5.190 448 HD3 PRO 57 1HD PRO 57 -5.674 8.512 4.577 449 H GLY 58 H GLY 58 -1.870 8.910 6.309 450 HA2 GLY 58 2HA GLY 58 -0.830 9.132 9.211 451 HA3 GLY 58 1HA GLY 58 0.305 8.754 7.914 452 H SER 59 H SER 59 1.464 10.634 8.610 453 HA SER 59 HA SER 59 0.631 13.350 8.308 454 HG SER 59 HG SER 59 4.085 14.122 8.476 455 HB2 SER 59 2HB SER 59 2.750 12.458 9.311 456 HB3 SER 59 1HB SER 59 3.377 12.121 7.684 457 H ALA 60 H ALA 60 0.513 11.302 5.623 458 HA ALA 60 HA ALA 60 -0.617 13.539 4.168 459 HB1 ALA 60 3HB ALA 60 1.455 14.340 3.402 460 HB2 ALA 60 1HB ALA 60 0.986 13.337 2.014 461 HB3 ALA 60 2HB ALA 60 2.174 12.746 3.196 462 H GLN 61 H GLN 61 -1.404 13.106 2.004 463 HA GLN 61 HA GLN 61 -2.184 10.186 1.491 464 HB2 GLN 61 2HB GLN 61 -3.814 11.927 2.918 465 HB3 GLN 61 1HB GLN 61 -4.297 12.370 1.302 466 HG2 GLN 61 2HG GLN 61 -4.975 10.003 0.806 467 HG3 GLN 61 1HG GLN 61 -4.405 9.498 2.363 468 HE21 GLN 61 1HE2 GLN 61 -5.509 11.381 4.099 469 HE22 GLN 61 2HE2 GLN 61 -7.310 11.001 4.018 470 H ILE 62 H ILE 62 -1.282 9.880 -0.429 471 HA ILE 62 HA ILE 62 -1.419 12.000 -2.659 472 HB ILE 62 HB ILE 62 0.487 9.697 -1.964 473 HG12 ILE 62 2HG1 ILE 62 1.332 12.553 -2.430 474 HG13 ILE 62 1HG1 ILE 62 0.613 12.149 -0.875 475 HG21 ILE 62 1HG2 ILE 62 1.898 10.345 -3.946 476 HG22 ILE 62 2HG2 ILE 62 0.542 11.379 -4.534 477 HG23 ILE 62 3HG2 ILE 62 0.363 9.601 -4.432 478 HD11 ILE 62 3HD1 ILE 62 3.254 11.101 -2.054 479 HD12 ILE 62 1HD1 ILE 62 2.521 10.394 -0.570 480 HD13 ILE 62 2HD1 ILE 62 3.000 12.084 -0.614 481 H VAL 63 H VAL 63 -2.876 11.590 -4.272 482 HA VAL 63 HA VAL 63 -3.522 8.682 -4.944 483 HB VAL 63 HB VAL 63 -4.915 11.194 -5.847 484 HG11 VAL 63 1HG1 VAL 63 -5.433 8.248 -6.655 485 HG12 VAL 63 2HG1 VAL 63 -4.950 9.516 -7.788 486 HG13 VAL 63 3HG1 VAL 63 -6.563 9.573 -7.012 487 HG21 VAL 63 3HG2 VAL 63 -5.502 10.462 -3.563 488 HG22 VAL 63 1HG2 VAL 63 -5.760 8.799 -4.097 489 HG23 VAL 63 2HG2 VAL 63 -6.881 10.101 -4.599 490 H MET 64 H MET 64 -2.360 7.614 -6.298 491 HA MET 64 HA MET 64 -0.839 8.884 -8.592 492 HB2 MET 64 2HB MET 64 -0.995 6.114 -7.279 493 HB3 MET 64 1HB MET 64 -0.685 6.139 -8.979 494 HG2 MET 64 2HG MET 64 1.148 8.154 -7.999 495 HG3 MET 64 1HG MET 64 1.154 6.877 -6.789 496 HE1 MET 64 3HE MET 64 0.493 6.447 -10.895 497 HE2 MET 64 1HE MET 64 2.227 6.548 -11.307 498 HE3 MET 64 2HE MET 64 1.418 7.928 -10.504 499 H SER 65 H SER 65 -2.070 9.630 -10.151 500 HA SER 65 HA SER 65 -3.594 7.681 -11.830 501 HG SER 65 HG SER 65 -5.948 8.091 -12.512 502 HB2 SER 65 2HB SER 65 -5.376 8.219 -10.179 503 HB3 SER 65 1HB SER 65 -5.146 9.934 -10.496 504 H ARG 66 H ARG 66 -3.585 11.234 -11.621 505 HA ARG 66 HA ARG 66 -1.768 12.079 -13.358 506 HE ARG 66 HE ARG 66 -3.104 11.480 -18.206 507 HB2 ARG 66 2HB ARG 66 -2.497 10.727 -15.335 508 HB3 ARG 66 1HB ARG 66 -4.020 11.555 -15.352 509 HG2 ARG 66 2HG ARG 66 -1.866 13.575 -15.461 510 HG3 ARG 66 1HG ARG 66 -1.393 12.325 -16.560 511 HD2 ARG 66 2HD ARG 66 -4.126 13.787 -16.581 512 HD3 ARG 66 1HD ARG 66 -2.727 14.229 -17.574 513 HH11 ARG 66 2HH1 ARG 66 -5.215 14.219 -18.335 514 HH12 ARG 66 1HH1 ARG 66 -6.042 13.628 -19.850 515 HH21 ARG 66 1HH2 ARG 66 -4.004 10.850 -19.962 516 HH22 ARG 66 2HH2 ARG 66 -5.358 11.785 -20.739 517 H SER 67 H SER 67 -2.165 13.751 -11.698 518 HA SER 67 HA SER 67 -2.873 16.197 -12.745 519 HG SER 67 HG SER 67 -4.300 17.835 -12.045 520 HB2 SER 67 2HB SER 67 -5.471 15.269 -12.426 521 HB3 SER 67 1HB SER 67 -5.216 15.843 -10.806 522 H GLU 68 H GLU 68 -2.432 18.059 -11.057 523 HA GLU 68 HA GLU 68 -1.715 17.222 -8.349 524 HB2 GLU 68 2HB GLU 68 -0.499 19.261 -8.477 525 HB3 GLU 68 1HB GLU 68 -0.213 18.369 -9.930 526 HG2 GLU 68 2HG GLU 68 -2.173 20.775 -9.855 527 HG3 GLU 68 1HG GLU 68 -0.471 20.954 -10.147 528 H ARG 69 H ARG 69 -3.493 17.189 -6.763 529 HA ARG 69 HA ARG 69 -4.302 19.679 -5.695 530 HE ARG 69 HE ARG 69 -8.135 18.258 -10.680 531 HB2 ARG 69 2HB ARG 69 -6.777 19.895 -6.119 532 HB3 ARG 69 1HB ARG 69 -5.778 20.295 -7.451 533 HG2 ARG 69 2HG ARG 69 -7.012 17.479 -7.212 534 HG3 ARG 69 1HG ARG 69 -8.036 18.816 -7.667 535 HD2 ARG 69 2HD ARG 69 -5.513 18.688 -9.345 536 HD3 ARG 69 1HD ARG 69 -6.381 17.206 -9.402 537 HH11 ARG 69 2HH1 ARG 69 -6.003 20.720 -9.441 538 HH12 ARG 69 1HH1 ARG 69 -6.729 21.991 -10.507 539 HH21 ARG 69 1HH2 ARG 69 -8.866 19.684 -11.918 540 HH22 ARG 69 2HH2 ARG 69 -8.283 21.415 -11.847 541 H SER 70 H SER 70 -5.405 19.791 -3.798 542 HA SER 70 HA SER 70 -5.869 17.427 -2.201 543 HG SER 70 HG SER 70 -4.516 19.101 -0.573 544 HB2 SER 70 2HB SER 70 -6.732 20.385 -1.793 545 HB3 SER 70 1HB SER 70 -6.712 19.184 -0.513 546 H PHE 71 H PHE 71 -7.760 16.916 -0.925 547 HA PHE 71 HA PHE 71 -10.352 16.960 -2.605 548 HD1 PHE 71 HD2 PHE 71 -10.315 15.103 -4.924 549 HD2 PHE 71 HD1 PHE 71 -7.014 14.005 -2.397 550 HE1 PHE 71 HE2 PHE 71 -9.160 14.067 -6.853 551 HE2 PHE 71 HE1 PHE 71 -5.964 12.857 -4.292 552 HZ PHE 71 HZ PHE 71 -7.074 12.812 -6.485 553 HB2 PHE 71 2HB PHE 71 -9.214 14.399 -1.413 554 HB3 PHE 71 1HB PHE 71 -10.601 14.523 -2.418 555 H SER 72 H SER 72 -9.262 16.259 0.767 556 HA SER 72 HA SER 72 -11.963 17.031 1.723 557 HG SER 72 HG SER 72 -12.509 15.357 0.153 558 HB2 SER 72 2HB SER 72 -11.293 14.051 2.140 559 HB3 SER 72 1HB SER 72 -12.657 14.925 2.833 560 H VAL 73 H VAL 73 -9.099 15.283 3.037 561 HA VAL 73 HA VAL 73 -9.067 17.223 5.397 562 HB VAL 73 HB VAL 73 -8.576 14.858 5.892 563 HG11 VAL 73 1HG1 VAL 73 -6.312 13.842 5.334 564 HG12 VAL 73 2HG1 VAL 73 -6.016 15.163 4.194 565 HG13 VAL 73 3HG1 VAL 73 -7.358 14.021 3.921 566 HG21 VAL 73 3HG2 VAL 73 -6.734 15.190 7.410 567 HG22 VAL 73 1HG2 VAL 73 -7.560 16.762 7.313 568 HG23 VAL 73 2HG2 VAL 73 -6.034 16.503 6.447 569 H ASP 74 H ASP 74 -7.266 18.620 5.768 570 HA ASP 74 HA ASP 74 -6.097 19.973 3.484 571 HB2 ASP 74 2HB ASP 74 -6.280 20.446 6.339 572 HB3 ASP 74 1HB ASP 74 -4.563 20.338 6.039 573 H THR 75 H THR 75 -4.400 17.672 5.724 574 HA THR 75 HA THR 75 -2.090 17.366 3.866 575 HB THR 75 HB THR 75 -2.028 17.068 6.385 576 HG1 THR 75 HG1 THR 75 -0.509 15.131 5.954 577 HG21 THR 75 3HG2 THR 75 -2.668 14.077 5.844 578 HG22 THR 75 1HG2 THR 75 -3.732 15.164 6.767 579 HG23 THR 75 2HG2 THR 75 -2.087 14.776 7.339 580 H ALA 76 H ALA 76 -4.227 17.062 2.281 581 HA ALA 76 HA ALA 76 -3.670 14.354 1.083 582 HB1 ALA 76 3HB ALA 76 -6.096 14.050 0.357 583 HB2 ALA 76 1HB ALA 76 -6.549 15.477 1.340 584 HB3 ALA 76 2HB ALA 76 -5.880 14.024 2.114 585 H HIS 77 H HIS 77 -3.485 14.290 -0.983 586 HA HIS 77 HA HIS 77 -3.329 16.808 -2.733 587 HD1 HIS 77 HD1 HIS 77 -0.385 15.849 0.773 588 HD2 HIS 77 HD2 HIS 77 -1.706 18.937 -1.879 589 HE1 HIS 77 HE1 HIS 77 -0.181 18.145 1.912 590 HB2 HIS 77 2HB HIS 77 -1.046 15.026 -1.605 591 HB3 HIS 77 1HB HIS 77 -0.819 16.273 -2.829 592 H ARG 78 H ARG 78 -1.599 15.739 -4.743 593 HA ARG 78 HA ARG 78 -2.785 13.185 -5.721 594 HE ARG 78 HE ARG 78 -4.768 13.644 -10.747 595 HB2 ARG 78 2HB ARG 78 -4.441 15.290 -6.216 596 HB3 ARG 78 1HB ARG 78 -3.447 15.493 -7.637 597 HG2 ARG 78 2HG ARG 78 -4.940 12.996 -6.759 598 HG3 ARG 78 1HG ARG 78 -5.653 14.207 -7.788 599 HD2 ARG 78 2HD ARG 78 -3.167 13.324 -9.061 600 HD3 ARG 78 1HD ARG 78 -3.924 11.878 -8.541 601 HH11 ARG 78 2HH1 ARG 78 -6.177 11.603 -8.397 602 HH12 ARG 78 1HH1 ARG 78 -7.457 10.949 -9.527 603 HH21 ARG 78 1HH2 ARG 78 -6.178 12.846 -12.080 604 HH22 ARG 78 2HH2 ARG 78 -7.472 11.690 -11.533 605 H ALA 79 H ALA 79 -1.222 12.127 -6.777 606 HA ALA 79 HA ALA 79 1.107 13.625 -8.072 607 HB1 ALA 79 3HB ALA 79 0.566 10.657 -7.268 608 HB2 ALA 79 1HB ALA 79 1.629 11.831 -6.430 609 HB3 ALA 79 2HB ALA 79 2.057 11.223 -8.043 610 H ALA 80 H ALA 80 1.618 13.318 -10.288 611 HA ALA 80 HA ALA 80 -0.263 11.618 -11.973 612 HB1 ALA 80 3HB ALA 80 1.853 13.578 -12.966 613 HB2 ALA 80 1HB ALA 80 0.192 14.049 -12.620 614 HB3 ALA 80 2HB ALA 80 0.573 12.872 -13.920 615 H SER 81 H SER 81 3.088 11.369 -10.967 616 HA SER 81 HA SER 81 3.187 8.628 -12.362 617 HG SER 81 HG SER 81 6.584 9.384 -13.431 618 HB2 SER 81 2HB SER 81 4.337 10.409 -13.699 619 HB3 SER 81 1HB SER 81 5.383 10.836 -12.326 620 H VAL 82 H VAL 82 5.651 7.850 -11.498 621 HA VAL 82 HA VAL 82 5.433 7.469 -8.465 622 HB VAL 82 HB VAL 82 7.426 6.117 -10.365 623 HG11 VAL 82 1HG1 VAL 82 7.298 6.256 -7.312 624 HG12 VAL 82 2HG1 VAL 82 8.706 6.150 -8.381 625 HG13 VAL 82 3HG1 VAL 82 7.739 4.713 -8.054 626 HG21 VAL 82 3HG2 VAL 82 6.108 3.976 -9.357 627 HG22 VAL 82 1HG2 VAL 82 5.478 4.874 -10.740 628 HG23 VAL 82 2HG2 VAL 82 4.805 5.135 -9.106 629 H GLU 83 H GLU 83 7.926 8.690 -10.826 630 HA GLU 83 HA GLU 83 9.506 10.268 -9.018 631 HB2 GLU 83 2HB GLU 83 8.619 10.868 -11.893 632 HB3 GLU 83 1HB GLU 83 9.877 11.730 -11.046 633 HG2 GLU 83 2HG GLU 83 11.482 10.017 -11.280 634 HG3 GLU 83 1HG GLU 83 10.322 8.723 -11.163 635 H GLU 84 H GLU 84 6.320 11.435 -10.442 636 HA GLU 84 HA GLU 84 6.304 13.863 -8.738 637 HB2 GLU 84 2HB GLU 84 3.841 12.437 -9.878 638 HB3 GLU 84 1HB GLU 84 3.907 14.094 -9.320 639 HG2 GLU 84 2HG GLU 84 5.801 14.188 -11.425 640 HG3 GLU 84 1HG GLU 84 4.710 12.942 -11.989 641 H ALA 85 H ALA 85 5.415 10.622 -7.939 642 HA ALA 85 HA ALA 85 3.946 11.402 -5.401 643 HB1 ALA 85 3HB ALA 85 4.723 8.566 -6.337 644 HB2 ALA 85 1HB ALA 85 3.149 9.341 -6.676 645 HB3 ALA 85 2HB ALA 85 3.650 8.989 -5.008 646 H VAL 86 H VAL 86 7.214 10.423 -6.321 647 HA VAL 86 HA VAL 86 8.154 10.240 -3.438 648 HB VAL 86 HB VAL 86 9.534 9.769 -6.117 649 HG11 VAL 86 1HG1 VAL 86 11.713 9.411 -4.914 650 HG12 VAL 86 2HG1 VAL 86 11.005 10.122 -3.425 651 HG13 VAL 86 3HG1 VAL 86 11.213 11.112 -4.897 652 HG21 VAL 86 3HG2 VAL 86 8.365 7.799 -4.965 653 HG22 VAL 86 1HG2 VAL 86 9.359 8.079 -3.515 654 HG23 VAL 86 2HG2 VAL 86 10.120 7.548 -5.031 655 H ASP 87 H ASP 87 8.636 12.625 -6.166 656 HA ASP 87 HA ASP 87 9.856 14.610 -4.485 657 HB2 ASP 87 2HB ASP 87 8.452 14.677 -7.202 658 HB3 ASP 87 1HB ASP 87 8.747 16.201 -6.407 659 H ILE 88 H ILE 88 6.260 14.164 -4.921 660 HA ILE 88 HA ILE 88 5.873 16.502 -3.104 661 HB ILE 88 HB ILE 88 3.767 16.544 -2.918 662 HG12 ILE 88 2HG1 ILE 88 2.926 13.923 -4.248 663 HG13 ILE 88 1HG1 ILE 88 3.306 13.961 -2.552 664 HG21 ILE 88 1HG2 ILE 88 3.954 15.597 -5.833 665 HG22 ILE 88 2HG2 ILE 88 4.563 17.158 -5.258 666 HG23 ILE 88 3HG2 ILE 88 2.821 16.794 -5.166 667 HD11 ILE 88 3HD1 ILE 88 1.666 16.188 -2.527 668 HD12 ILE 88 1HD1 ILE 88 1.095 14.559 -2.259 669 HD13 ILE 88 2HD1 ILE 88 0.943 15.286 -3.879 670 H ALA 89 H ALA 89 6.110 13.059 -2.373 671 HA ALA 89 HA ALA 89 5.429 13.376 0.520 672 HB1 ALA 89 3HB ALA 89 6.594 11.159 0.755 673 HB2 ALA 89 1HB ALA 89 7.082 11.232 -0.961 674 HB3 ALA 89 2HB ALA 89 5.357 11.134 -0.516 675 H ALA 90 H ALA 90 8.619 13.429 -1.162 676 HA ALA 90 HA ALA 90 10.119 14.229 1.285 677 HB1 ALA 90 3HB ALA 90 10.769 14.327 -1.732 678 HB2 ALA 90 1HB ALA 90 11.207 13.046 -0.571 679 HB3 ALA 90 2HB ALA 90 11.959 14.659 -0.460 680 H SER 91 H SER 91 8.396 16.184 -1.074 681 HA SER 91 HA SER 91 9.464 18.834 -0.206 682 HG SER 91 HG SER 91 7.215 20.235 -0.586 683 HB2 SER 91 2HB SER 91 8.286 18.344 -2.425 684 HB3 SER 91 1HB SER 91 6.798 18.037 -1.528 685 H LEU 92 H LEU 92 7.061 16.722 1.280 686 HA LEU 92 HA LEU 92 5.922 19.071 2.826 687 HG LEU 92 HG LEU 92 5.132 15.733 1.451 688 HB2 LEU 92 2HB LEU 92 4.032 17.694 3.551 689 HB3 LEU 92 1HB LEU 92 4.187 18.150 1.880 690 HD11 LEU 92 1HD1 LEU 92 5.381 15.017 3.822 691 HD12 LEU 92 2HD1 LEU 92 4.267 13.991 2.942 692 HD13 LEU 92 3HD1 LEU 92 3.632 15.202 4.095 693 HD21 LEU 92 3HD2 LEU 92 2.838 14.864 1.076 694 HD22 LEU 92 1HD2 LEU 92 2.893 16.562 0.593 695 HD23 LEU 92 2HD2 LEU 92 2.138 16.103 2.143 696 H ASP 93 H ASP 93 7.054 15.834 3.927 697 HA ASP 93 HA ASP 93 9.327 16.721 5.100 698 HB2 ASP 93 2HB ASP 93 7.348 17.790 6.977 699 HB3 ASP 93 1HB ASP 93 8.105 16.491 7.804 700 H ALA 94 H ALA 94 9.961 14.631 4.385 701 HA ALA 94 HA ALA 94 9.627 12.375 6.357 702 HB1 ALA 94 3HB ALA 94 8.343 12.112 3.550 703 HB2 ALA 94 1HB ALA 94 7.476 12.281 5.091 704 HB3 ALA 94 2HB ALA 94 8.432 10.832 4.794 705 H GLU 95 H GLU 95 11.111 10.852 6.370 706 HA GLU 95 HA GLU 95 13.167 10.612 4.153 707 HB2 GLU 95 2HB GLU 95 13.518 8.604 6.332 708 HB3 GLU 95 1HB GLU 95 14.665 9.445 5.321 709 HG2 GLU 95 2HG GLU 95 14.339 11.505 6.937 710 HG3 GLU 95 1HG GLU 95 13.427 10.390 7.953 711 H THR 96 H THR 96 10.706 8.409 5.667 712 HA THR 96 HA THR 96 10.844 6.667 3.147 713 HB THR 96 HB THR 96 9.412 4.998 4.600 714 HG1 THR 96 HG1 THR 96 9.042 6.192 6.410 715 HG21 THR 96 3HG2 THR 96 11.395 3.910 5.685 716 HG22 THR 96 1HG2 THR 96 12.388 5.338 5.296 717 HG23 THR 96 2HG2 THR 96 11.745 4.287 4.006 718 H ALA 97 H ALA 97 8.853 5.830 2.452 719 HA ALA 97 HA ALA 97 6.305 7.067 3.497 720 HB1 ALA 97 3HB ALA 97 7.204 7.443 0.549 721 HB2 ALA 97 1HB ALA 97 6.763 8.673 1.743 722 HB3 ALA 97 2HB ALA 97 5.502 7.626 1.053 723 H TYR 98 H TYR 98 4.341 6.042 2.450 724 HA TYR 98 HA TYR 98 4.759 3.081 1.868 725 HD1 TYR 98 HD1 TYR 98 4.695 0.877 3.929 726 HD2 TYR 98 HD2 TYR 98 4.494 4.796 5.615 727 HE1 TYR 98 HE1 TYR 98 6.546 0.308 5.460 728 HE2 TYR 98 HE2 TYR 98 6.185 4.159 7.280 729 HH TYR 98 HH TYR 98 7.858 2.760 7.670 730 HB2 TYR 98 2HB TYR 98 2.821 4.140 4.028 731 HB3 TYR 98 1HB TYR 98 2.775 2.510 3.412 732 H VAL 99 H VAL 99 2.645 2.035 1.279 733 HA VAL 99 HA VAL 99 0.773 3.780 -0.376 734 HB VAL 99 HB VAL 99 1.456 3.184 -2.370 735 HG11 VAL 99 1HG1 VAL 99 3.742 1.471 -1.432 736 HG12 VAL 99 2HG1 VAL 99 3.740 3.203 -1.618 737 HG13 VAL 99 3HG1 VAL 99 3.482 2.169 -3.030 738 HG21 VAL 99 3HG2 VAL 99 1.461 0.945 -3.431 739 HG22 VAL 99 1HG2 VAL 99 -0.045 1.343 -2.576 740 HG23 VAL 99 2HG2 VAL 99 1.115 0.256 -1.823 741 H ILE 100 H ILE 100 -1.408 3.204 0.226 742 HA ILE 100 HA ILE 100 -1.862 0.455 1.266 743 HB ILE 100 HB ILE 100 -4.243 2.094 0.310 744 HG12 ILE 100 2HG1 ILE 100 -3.434 3.512 1.982 745 HG13 ILE 100 1HG1 ILE 100 -4.593 2.521 2.776 746 HG21 ILE 100 1HG2 ILE 100 -5.518 0.583 1.879 747 HG22 ILE 100 2HG2 ILE 100 -4.047 -0.330 2.217 748 HG23 ILE 100 3HG2 ILE 100 -4.757 -0.340 0.587 749 HD11 ILE 100 3HD1 ILE 100 -2.497 2.899 4.181 750 HD12 ILE 100 1HD1 ILE 100 -1.524 2.042 2.986 751 HD13 ILE 100 2HD1 ILE 100 -2.780 1.149 3.862 752 H GLY 101 H GLY 101 -3.559 1.364 -1.558 753 HA2 GLY 101 2HA GLY 101 -3.008 0.671 -3.825 754 HA3 GLY 101 1HA GLY 101 -1.925 -0.517 -3.334 755 H GLY 102 H GLY 102 -2.936 -2.510 -4.552 756 HA2 GLY 102 2HA GLY 102 -5.131 -0.635 -5.626 757 HA3 GLY 102 1HA GLY 102 -3.508 -0.693 -6.206 758 H ALA 103 H ALA 103 -6.568 -2.193 -6.831 759 HA ALA 103 HA ALA 103 -6.191 -3.581 -9.091 760 HB1 ALA 103 3HB ALA 103 -8.248 -2.193 -8.303 761 HB2 ALA 103 1HB ALA 103 -8.049 -2.127 -10.033 762 HB3 ALA 103 2HB ALA 103 -7.598 -0.752 -9.052 763 H ALA 104 H ALA 104 -5.184 -0.165 -9.288 764 HA ALA 104 HA ALA 104 -3.254 -0.915 -11.562 765 HB1 ALA 104 3HB ALA 104 -4.792 0.908 -12.239 766 HB2 ALA 104 1HB ALA 104 -3.119 1.501 -12.141 767 HB3 ALA 104 2HB ALA 104 -4.268 1.887 -10.850 768 H ILE 105 H ILE 105 -3.318 0.292 -8.232 769 HA ILE 105 HA ILE 105 -0.852 1.827 -8.424 770 HB ILE 105 HB ILE 105 -1.988 0.932 -5.783 771 HG12 ILE 105 2HG1 ILE 105 -3.948 1.866 -6.859 772 HG13 ILE 105 1HG1 ILE 105 -3.357 2.943 -5.677 773 HG21 ILE 105 1HG2 ILE 105 0.231 2.128 -5.587 774 HG22 ILE 105 2HG2 ILE 105 -1.105 2.965 -4.813 775 HG23 ILE 105 3HG2 ILE 105 -0.511 3.545 -6.364 776 HD11 ILE 105 3HD1 ILE 105 -3.082 4.626 -7.299 777 HD12 ILE 105 1HD1 ILE 105 -3.985 3.496 -8.378 778 HD13 ILE 105 2HD1 ILE 105 -2.205 3.580 -8.428 779 H TYR 106 H TYR 106 -1.116 -1.100 -6.337 780 HA TYR 106 HA TYR 106 1.735 -1.652 -6.103 781 HD1 TYR 106 HD1 TYR 106 2.596 -4.472 -4.880 782 HD2 TYR 106 HD2 TYR 106 -0.885 -2.472 -3.344 783 HE1 TYR 106 HE1 TYR 106 3.190 -5.151 -2.592 784 HE2 TYR 106 HE2 TYR 106 -0.243 -3.122 -1.069 785 HH TYR 106 HH TYR 106 2.531 -5.234 -0.405 786 HB2 TYR 106 2HB TYR 106 -0.821 -3.238 -5.699 787 HB3 TYR 106 1HB TYR 106 0.500 -4.215 -6.209 788 H ALA 107 H ALA 107 -0.373 -2.538 -8.825 789 HA ALA 107 HA ALA 107 1.584 -4.224 -10.305 790 HB1 ALA 107 3HB ALA 107 -0.909 -4.356 -10.621 791 HB2 ALA 107 1HB ALA 107 -0.160 -3.897 -12.157 792 HB3 ALA 107 2HB ALA 107 -0.960 -2.677 -11.150 793 H LEU 108 H LEU 108 0.748 -0.758 -10.603 794 HA LEU 108 HA LEU 108 2.951 -0.270 -12.577 795 HG LEU 108 HG LEU 108 1.673 2.131 -10.000 796 HB2 LEU 108 2HB LEU 108 2.111 1.744 -12.987 797 HB3 LEU 108 1HB LEU 108 0.665 1.075 -12.326 798 HD11 LEU 108 1HD1 LEU 108 2.677 4.151 -12.131 799 HD12 LEU 108 2HD1 LEU 108 3.774 3.028 -11.308 800 HD13 LEU 108 3HD1 LEU 108 2.878 4.218 -10.372 801 HD21 LEU 108 3HD2 LEU 108 -0.559 2.743 -10.812 802 HD22 LEU 108 1HD2 LEU 108 0.158 3.704 -12.164 803 HD23 LEU 108 2HD2 LEU 108 0.359 4.224 -10.480 804 H PHE 109 H PHE 109 2.603 0.191 -9.039 805 HA PHE 109 HA PHE 109 5.295 1.229 -8.705 806 HD1 PHE 109 HD2 PHE 109 6.307 2.184 -6.329 807 HD2 PHE 109 HD1 PHE 109 2.061 2.428 -6.897 808 HE1 PHE 109 HE2 PHE 109 6.419 4.587 -6.026 809 HE2 PHE 109 HE1 PHE 109 2.181 4.864 -6.629 810 HZ PHE 109 HZ PHE 109 4.388 5.967 -6.238 811 HB2 PHE 109 2HB PHE 109 3.125 0.200 -6.792 812 HB3 PHE 109 1HB PHE 109 4.750 0.103 -6.189 813 H GLN 110 H GLN 110 4.475 -2.206 -8.769 814 HA GLN 110 HA GLN 110 6.319 -3.479 -7.299 815 HB2 GLN 110 2HB GLN 110 5.683 -4.230 -10.212 816 HB3 GLN 110 1HB GLN 110 6.747 -5.172 -9.205 817 HG2 GLN 110 2HG GLN 110 4.534 -4.988 -7.513 818 HG3 GLN 110 1HG GLN 110 3.758 -4.912 -9.073 819 HE21 GLN 110 1HE2 GLN 110 5.149 -6.751 -10.583 820 HE22 GLN 110 2HE2 GLN 110 4.898 -8.379 -9.755 821 HA PRO 111 HA PRO 111 10.651 -3.016 -9.438 822 HB2 PRO 111 2HB PRO 111 10.634 -0.913 -11.507 823 HB3 PRO 111 1HB PRO 111 11.001 -2.632 -11.658 824 HG2 PRO 111 2HG PRO 111 8.692 -1.427 -12.776 825 HG3 PRO 111 1HG PRO 111 8.878 -3.163 -12.417 826 HD2 PRO 111 2HD PRO 111 7.508 -1.036 -10.698 827 HD3 PRO 111 1HD PRO 111 6.947 -2.662 -11.111 828 H HIS 112 H HIS 112 8.666 -0.367 -8.552 829 HA HIS 112 HA HIS 112 11.018 1.526 -7.981 830 HD1 HIS 112 HD1 HIS 112 10.836 3.733 -10.281 831 HD2 HIS 112 HD2 HIS 112 7.095 1.689 -10.455 832 HE1 HIS 112 HE1 HIS 112 9.834 3.895 -12.679 833 HB2 HIS 112 2HB HIS 112 8.045 2.266 -8.027 834 HB3 HIS 112 1HB HIS 112 9.431 3.331 -7.955 835 H LEU 113 H LEU 113 9.147 -0.670 -6.138 836 HA LEU 113 HA LEU 113 8.983 1.032 -3.682 837 HG LEU 113 HG LEU 113 6.518 -1.456 -2.668 838 HB2 LEU 113 2HB LEU 113 8.776 -2.045 -3.963 839 HB3 LEU 113 1HB LEU 113 8.623 -1.180 -2.448 840 HD11 LEU 113 1HD1 LEU 113 5.244 0.526 -3.565 841 HD12 LEU 113 2HD1 LEU 113 6.673 0.989 -4.514 842 HD13 LEU 113 3HD1 LEU 113 6.727 1.025 -2.748 843 HD21 LEU 113 3HD2 LEU 113 6.653 -2.866 -4.711 844 HD22 LEU 113 1HD2 LEU 113 6.596 -1.418 -5.737 845 HD23 LEU 113 2HD2 LEU 113 5.197 -1.855 -4.691 846 H ASP 114 H ASP 114 10.230 1.057 -1.844 847 HA ASP 114 HA ASP 114 12.865 -0.383 -1.626 848 HB2 ASP 114 2HB ASP 114 12.450 1.813 -0.544 849 HB3 ASP 114 1HB ASP 114 11.169 1.145 0.442 850 H ARG 115 H ARG 115 9.615 -0.919 -0.084 851 HA ARG 115 HA ARG 115 10.145 -3.930 -0.218 852 HE ARG 115 HE ARG 115 13.532 -3.727 3.000 853 HB2 ARG 115 2HB ARG 115 9.515 -2.247 2.279 854 HB3 ARG 115 1HB ARG 115 9.069 -3.946 2.268 855 HG2 ARG 115 2HG ARG 115 11.260 -4.726 2.323 856 HG3 ARG 115 1HG ARG 115 11.915 -3.303 1.501 857 HD2 ARG 115 2HD ARG 115 11.498 -1.874 3.530 858 HD3 ARG 115 1HD ARG 115 10.915 -3.333 4.414 859 HH11 ARG 115 2HH1 ARG 115 12.181 -2.779 5.940 860 HH12 ARG 115 1HH1 ARG 115 13.418 -3.736 6.879 861 HH21 ARG 115 1HH2 ARG 115 14.689 -4.844 4.146 862 HH22 ARG 115 2HH2 ARG 115 14.862 -4.639 5.886 863 H MET 116 H MET 116 8.383 -5.301 -0.003 864 HA MET 116 HA MET 116 5.564 -4.086 -0.373 865 HB2 MET 116 2HB MET 116 6.908 -6.535 -1.583 866 HB3 MET 116 1HB MET 116 5.157 -6.428 -1.486 867 HG2 MET 116 2HG MET 116 5.187 -4.523 -3.093 868 HG3 MET 116 1HG MET 116 6.889 -4.241 -2.785 869 HE1 MET 116 3HE MET 116 4.614 -7.439 -3.586 870 HE2 MET 116 1HE MET 116 5.246 -7.872 -5.198 871 HE3 MET 116 2HE MET 116 4.322 -6.365 -4.999 872 H VAL 117 H VAL 117 5.007 -3.841 1.679 873 HA VAL 117 HA VAL 117 4.827 -6.055 3.733 874 HB VAL 117 HB VAL 117 4.157 -3.069 3.705 875 HG11 VAL 117 1HG1 VAL 117 2.735 -4.196 5.489 876 HG12 VAL 117 2HG1 VAL 117 3.931 -3.143 6.176 877 HG13 VAL 117 3HG1 VAL 117 4.192 -4.914 6.196 878 HG21 VAL 117 3HG2 VAL 117 6.629 -3.485 3.694 879 HG22 VAL 117 1HG2 VAL 117 6.473 -4.583 5.069 880 HG23 VAL 117 2HG2 VAL 117 6.146 -2.862 5.282 881 H LEU 118 H LEU 118 3.515 -7.197 1.991 882 HA LEU 118 HA LEU 118 0.551 -6.818 1.827 883 HG LEU 118 HG LEU 118 -0.382 -9.257 0.874 884 HB2 LEU 118 2HB LEU 118 1.706 -7.859 0.066 885 HB3 LEU 118 1HB LEU 118 2.654 -8.934 1.058 886 HD11 LEU 118 1HD1 LEU 118 0.165 -9.388 -1.433 887 HD12 LEU 118 2HD1 LEU 118 0.256 -11.072 -0.940 888 HD13 LEU 118 3HD1 LEU 118 1.758 -10.152 -1.159 889 HD21 LEU 118 3HD2 LEU 118 0.816 -10.657 2.614 890 HD22 LEU 118 1HD2 LEU 118 1.865 -11.323 1.348 891 HD23 LEU 118 2HD2 LEU 118 0.079 -11.561 1.324 892 H SER 119 H SER 119 -1.055 -8.058 2.748 893 HA SER 119 HA SER 119 -0.415 -9.792 5.203 894 HG SER 119 HG SER 119 -1.189 -6.723 4.696 895 HB2 SER 119 2HB SER 119 -2.953 -8.643 5.815 896 HB3 SER 119 1HB SER 119 -1.413 -8.344 6.582 897 H ARG 120 H ARG 120 -1.123 -11.830 4.949 898 HA ARG 120 HA ARG 120 -3.092 -12.456 2.711 899 HE ARG 120 HE ARG 120 -1.333 -15.864 0.230 900 HB2 ARG 120 2HB ARG 120 -1.639 -14.564 4.335 901 HB3 ARG 120 1HB ARG 120 -2.462 -14.788 2.814 902 HG2 ARG 120 2HG ARG 120 0.024 -13.004 2.990 903 HG3 ARG 120 1HG ARG 120 0.215 -14.700 3.110 904 HD2 ARG 120 2HD ARG 120 -1.309 -13.493 0.686 905 HD3 ARG 120 1HD ARG 120 0.430 -13.549 0.714 906 HH11 ARG 120 2HH1 ARG 120 1.805 -15.037 1.514 907 HH12 ARG 120 1HH1 ARG 120 2.544 -16.611 1.029 908 HH21 ARG 120 1HH2 ARG 120 -0.469 -17.667 -0.313 909 HH22 ARG 120 2HH2 ARG 120 1.283 -18.048 0.039 910 H VAL 121 H VAL 121 -5.235 -12.527 3.315 911 HA VAL 121 HA VAL 121 -6.003 -13.089 6.208 912 HB VAL 121 HB VAL 121 -7.776 -11.740 4.149 913 HG11 VAL 121 1HG1 VAL 121 -8.806 -10.650 6.194 914 HG12 VAL 121 2HG1 VAL 121 -7.759 -11.626 7.246 915 HG13 VAL 121 3HG1 VAL 121 -8.986 -12.387 6.212 916 HG21 VAL 121 3HG2 VAL 121 -6.046 -10.171 4.050 917 HG22 VAL 121 1HG2 VAL 121 -5.479 -10.417 5.702 918 HG23 VAL 121 2HG2 VAL 121 -6.979 -9.508 5.377 919 HA PRO 122 HA PRO 122 -7.050 -17.004 4.183 920 HB2 PRO 122 2HB PRO 122 -7.950 -17.990 6.922 921 HB3 PRO 122 1HB PRO 122 -6.949 -18.794 5.688 922 HG2 PRO 122 2HG PRO 122 -5.628 -17.560 7.709 923 HG3 PRO 122 1HG PRO 122 -5.086 -17.263 6.047 924 HD2 PRO 122 2HD PRO 122 -6.919 -15.449 7.719 925 HD3 PRO 122 1HD PRO 122 -5.427 -15.057 6.831 926 H GLY 123 H GLY 123 -9.961 -16.125 6.165 927 HA2 GLY 123 2HA GLY 123 -11.625 -17.970 4.277 928 HA3 GLY 123 1HA GLY 123 -12.166 -17.462 5.847 929 H GLU 124 H GLU 124 -10.896 -14.796 4.178 930 HA GLU 124 HA GLU 124 -13.749 -13.841 3.642 931 HB2 GLU 124 2HB GLU 124 -11.185 -12.275 4.224 932 HB3 GLU 124 1HB GLU 124 -12.816 -11.625 4.147 933 HG2 GLU 124 2HG GLU 124 -13.451 -13.180 6.146 934 HG3 GLU 124 1HG GLU 124 -11.741 -13.564 6.309 935 H TYR 125 H TYR 125 -13.661 -14.952 1.536 936 HA TYR 125 HA TYR 125 -11.961 -13.585 -0.582 937 HD1 TYR 125 HD2 TYR 125 -14.082 -17.346 0.456 938 HD2 TYR 125 HD1 TYR 125 -9.917 -16.491 -0.045 939 HE1 TYR 125 HE2 TYR 125 -13.491 -19.414 1.710 940 HE2 TYR 125 HE1 TYR 125 -9.343 -18.549 1.128 941 HH TYR 125 HH TYR 125 -10.114 -20.051 2.497 942 HB2 TYR 125 2HB TYR 125 -13.170 -16.070 -1.575 943 HB3 TYR 125 1HB TYR 125 -11.557 -15.528 -1.617 944 H GLU 126 H GLU 126 -12.763 -12.576 -2.264 945 HA GLU 126 HA GLU 126 -15.800 -12.503 -2.675 946 HB2 GLU 126 2HB GLU 126 -13.726 -10.240 -2.777 947 HB3 GLU 126 1HB GLU 126 -15.446 -10.070 -3.056 948 HG2 GLU 126 2HG GLU 126 -14.180 -10.962 -0.361 949 HG3 GLU 126 1HG GLU 126 -14.684 -9.342 -0.713 950 H GLY 127 H GLY 127 -13.111 -11.249 -4.641 951 HA2 GLY 127 2HA GLY 127 -12.645 -12.368 -6.946 952 HA3 GLY 127 1HA GLY 127 -14.355 -12.675 -7.087 953 H ASP 128 H ASP 128 -13.198 -9.491 -6.256 954 HA ASP 128 HA ASP 128 -13.803 -8.500 -9.115 955 HB2 ASP 128 2HB ASP 128 -14.945 -7.605 -6.445 956 HB3 ASP 128 1HB ASP 128 -14.483 -6.304 -7.507 957 H THR 129 H THR 129 -12.044 -7.247 -6.196 958 HA THR 129 HA THR 129 -10.110 -5.869 -8.024 959 HB THR 129 HB THR 129 -9.891 -6.008 -4.976 960 HG1 THR 129 HG1 THR 129 -11.640 -4.937 -4.864 961 HG21 THR 129 3HG2 THR 129 -8.047 -4.741 -6.396 962 HG22 THR 129 1HG2 THR 129 -8.893 -3.782 -5.142 963 HG23 THR 129 2HG2 THR 129 -9.357 -3.621 -6.850 964 H TYR 130 H TYR 130 -8.105 -6.661 -8.621 965 HA TYR 130 HA TYR 130 -6.978 -9.152 -7.211 966 HD1 TYR 130 HD1 TYR 130 -9.704 -8.773 -9.903 967 HD2 TYR 130 HD2 TYR 130 -6.874 -11.798 -8.747 968 HE1 TYR 130 HE1 TYR 130 -11.495 -10.468 -9.916 969 HE2 TYR 130 HE2 TYR 130 -8.653 -13.486 -8.827 970 HH TYR 130 HH TYR 130 -10.893 -13.765 -8.848 971 HB2 TYR 130 2HB TYR 130 -7.165 -8.384 -10.174 972 HB3 TYR 130 1HB TYR 130 -6.072 -9.623 -9.623 973 H TYR 131 H TYR 131 -5.023 -9.261 -6.502 974 HA TYR 131 HA TYR 131 -3.137 -6.964 -6.684 975 HD1 TYR 131 HD2 TYR 131 -0.689 -10.049 -5.303 976 HD2 TYR 131 HD1 TYR 131 -2.257 -6.496 -3.455 977 HE1 TYR 131 HE2 TYR 131 1.504 -9.582 -4.359 978 HE2 TYR 131 HE1 TYR 131 -0.090 -6.153 -2.383 979 HH TYR 131 HH TYR 131 2.419 -6.720 -3.115 980 HB2 TYR 131 2HB TYR 131 -3.766 -8.103 -4.566 981 HB3 TYR 131 1HB TYR 131 -3.174 -9.625 -5.127 982 HA PRO 132 HA PRO 132 -0.363 -8.761 -9.829 983 HB2 PRO 132 2HB PRO 132 2.041 -7.541 -8.485 984 HB3 PRO 132 1HB PRO 132 1.364 -7.185 -10.089 985 HG2 PRO 132 2HG PRO 132 1.118 -5.430 -8.036 986 HG3 PRO 132 1HG PRO 132 -0.264 -5.674 -9.129 987 HD2 PRO 132 2HD PRO 132 0.135 -6.917 -6.377 988 HD3 PRO 132 1HD PRO 132 -1.286 -6.061 -7.053 989 H GLU 133 H GLU 133 1.802 -9.882 -10.313 990 HA GLU 133 HA GLU 133 1.981 -12.253 -8.483 991 HB2 GLU 133 2HB GLU 133 3.088 -13.531 -10.176 992 HB3 GLU 133 1HB GLU 133 1.533 -12.911 -10.593 993 HG2 GLU 133 2HG GLU 133 3.091 -11.078 -11.971 994 HG3 GLU 133 1HG GLU 133 4.157 -12.486 -11.948 995 H TRP 134 H TRP 134 3.517 -12.832 -7.259 996 HA TRP 134 HA TRP 134 5.985 -11.135 -6.885 997 HD1 TRP 134 HD1 TRP 134 5.381 -15.347 -5.635 998 HE1 TRP 134 HE1 TRP 134 3.183 -16.656 -4.961 999 HE3 TRP 134 HE3 TRP 134 2.844 -11.340 -3.774 1000 HZ2 TRP 134 HZ2 TRP 134 0.766 -15.892 -3.690 1001 HZ3 TRP 134 HZ3 TRP 134 0.519 -11.664 -3.022 1002 HH2 TRP 134 HH2 TRP 134 -0.490 -13.909 -2.909 1003 HB2 TRP 134 2HB TRP 134 6.271 -12.471 -4.741 1004 HB3 TRP 134 1HB TRP 134 4.885 -11.448 -4.851 1005 H ASP 135 H ASP 135 8.116 -11.818 -7.187 1006 HA ASP 135 HA ASP 135 8.484 -14.468 -8.657 1007 HB2 ASP 135 2HB ASP 135 8.681 -12.072 -9.834 1008 HB3 ASP 135 1HB ASP 135 10.201 -11.945 -8.964 1009 H ALA 136 H ALA 136 11.206 -14.428 -8.656 1010 HA ALA 136 HA ALA 136 12.061 -14.773 -5.690 1011 HB1 ALA 136 3HB ALA 136 11.667 -16.956 -7.003 1012 HB2 ALA 136 1HB ALA 136 13.306 -16.791 -6.323 1013 HB3 ALA 136 2HB ALA 136 13.034 -16.512 -8.067 1014 H ALA 137 H ALA 137 13.196 -13.581 -8.793 1015 HA ALA 137 HA ALA 137 15.773 -12.619 -7.418 1016 HB1 ALA 137 3HB ALA 137 15.311 -12.946 -10.447 1017 HB2 ALA 137 1HB ALA 137 16.290 -14.002 -9.386 1018 HB3 ALA 137 2HB ALA 137 16.778 -12.312 -9.663 1019 H GLU 138 H GLU 138 12.807 -11.245 -8.735 1020 HA GLU 138 HA GLU 138 13.837 -8.448 -8.655 1021 HB2 GLU 138 2HB GLU 138 11.020 -9.657 -8.604 1022 HB3 GLU 138 1HB GLU 138 11.354 -7.956 -8.511 1023 HG2 GLU 138 2HG GLU 138 12.339 -9.564 -10.935 1024 HG3 GLU 138 1HG GLU 138 10.738 -8.844 -10.837 1025 H TRP 139 H TRP 139 11.908 -10.337 -6.283 1026 HA TRP 139 HA TRP 139 12.955 -8.626 -3.989 1027 HD1 TRP 139 HD1 TRP 139 8.901 -10.671 -4.766 1028 HE1 TRP 139 HE1 TRP 139 7.550 -10.251 -7.078 1029 HE3 TRP 139 HE3 TRP 139 10.746 -6.097 -5.750 1030 HZ2 TRP 139 HZ2 TRP 139 7.762 -8.331 -9.057 1031 HZ3 TRP 139 HZ3 TRP 139 10.311 -5.058 -7.980 1032 HH2 TRP 139 HH2 TRP 139 8.860 -6.176 -9.603 1033 HB2 TRP 139 2HB TRP 139 10.389 -8.846 -3.061 1034 HB3 TRP 139 1HB TRP 139 11.040 -7.476 -3.877 1035 H GLU 140 H GLU 140 13.563 -9.668 -2.245 1036 HA GLU 140 HA GLU 140 12.783 -12.582 -1.828 1037 HB2 GLU 140 2HB GLU 140 14.730 -12.977 -0.715 1038 HB3 GLU 140 1HB GLU 140 15.242 -11.838 -1.925 1039 HG2 GLU 140 2HG GLU 140 15.017 -10.046 0.113 1040 HG3 GLU 140 1HG GLU 140 14.962 -11.486 1.127 1041 H LEU 141 H LEU 141 13.086 -12.688 1.033 1042 HA LEU 141 HA LEU 141 10.406 -11.441 1.874 1043 HG LEU 141 HG LEU 141 9.154 -14.663 3.318 1044 HB2 LEU 141 2HB LEU 141 10.820 -14.134 1.582 1045 HB3 LEU 141 1HB LEU 141 11.433 -13.968 3.195 1046 HD11 LEU 141 1HD1 LEU 141 7.890 -13.006 4.549 1047 HD12 LEU 141 2HD1 LEU 141 8.846 -11.660 3.905 1048 HD13 LEU 141 3HD1 LEU 141 9.595 -12.822 5.007 1049 HD21 LEU 141 3HD2 LEU 141 7.237 -13.567 2.163 1050 HD22 LEU 141 1HD2 LEU 141 8.452 -14.118 0.992 1051 HD23 LEU 141 2HD2 LEU 141 8.343 -12.399 1.406 1052 H ASP 142 H ASP 142 10.831 -9.823 3.292 1053 HA ASP 142 HA ASP 142 13.397 -9.578 4.848 1054 HB2 ASP 142 2HB ASP 142 12.119 -7.673 3.528 1055 HB3 ASP 142 1HB ASP 142 11.018 -7.632 4.904 1056 H ALA 143 H ALA 143 9.849 -9.713 5.629 1057 HA ALA 143 HA ALA 143 10.516 -11.260 8.154 1058 HB1 ALA 143 3HB ALA 143 8.844 -8.632 8.206 1059 HB2 ALA 143 1HB ALA 143 10.513 -8.793 8.799 1060 HB3 ALA 143 2HB ALA 143 9.194 -9.673 9.611 1061 H GLU 144 H GLU 144 9.173 -12.925 8.447 1062 HA GLU 144 HA GLU 144 6.241 -12.733 7.564 1063 HB2 GLU 144 2HB GLU 144 7.923 -14.391 6.501 1064 HB3 GLU 144 1HB GLU 144 7.820 -15.328 7.994 1065 HG2 GLU 144 2HG GLU 144 5.379 -15.718 7.619 1066 HG3 GLU 144 1HG GLU 144 5.325 -14.490 6.363 1067 H THR 145 H THR 145 4.795 -12.491 9.121 1068 HA THR 145 HA THR 145 5.192 -13.747 11.858 1069 HB THR 145 HB THR 145 4.820 -11.860 13.213 1070 HG1 THR 145 HG1 THR 145 4.329 -10.450 10.831 1071 HG21 THR 145 3HG2 THR 145 6.873 -10.865 11.136 1072 HG22 THR 145 1HG2 THR 145 7.236 -11.927 12.520 1073 HG23 THR 145 2HG2 THR 145 6.683 -10.255 12.786 1074 H ASP 146 H ASP 146 3.349 -14.342 12.997 1075 HA ASP 146 HA ASP 146 0.772 -14.271 11.562 1076 HB2 ASP 146 2HB ASP 146 0.022 -15.756 13.377 1077 HB3 ASP 146 1HB ASP 146 1.436 -16.309 12.517 1078 H HIS 147 H HIS 147 -1.159 -13.334 12.096 1079 HA HIS 147 HA HIS 147 -1.356 -11.282 14.325 1080 HD1 HIS 147 HD1 HIS 147 1.302 -10.514 13.238 1081 HD2 HIS 147 HD2 HIS 147 -1.564 -7.404 12.801 1082 HE1 HIS 147 HE1 HIS 147 2.399 -8.229 13.699 1083 HB2 HIS 147 2HB HIS 147 -1.025 -10.681 11.352 1084 HB3 HIS 147 1HB HIS 147 -2.358 -9.851 12.093 1085 H GLU 148 H GLU 148 -3.698 -10.239 14.140 1086 HA GLU 148 HA GLU 148 -5.217 -12.412 15.144 1087 HB2 GLU 148 2HB GLU 148 -6.369 -9.654 14.506 1088 HB3 GLU 148 1HB GLU 148 -7.106 -10.809 15.542 1089 HG2 GLU 148 2HG GLU 148 -4.318 -10.150 16.508 1090 HG3 GLU 148 1HG GLU 148 -5.380 -8.751 16.373 1091 H GLY 149 H GLY 149 -6.098 -10.706 12.132 1092 HA2 GLY 149 2HA GLY 149 -8.065 -12.966 11.367 1093 HA3 GLY 149 1HA GLY 149 -7.987 -11.434 10.553 1094 H PHE 150 H PHE 150 -4.765 -12.324 10.916 1095 HA PHE 150 HA PHE 150 -4.556 -13.648 8.216 1096 HD1 PHE 150 HD1 PHE 150 -1.672 -10.653 8.405 1097 HD2 PHE 150 HD2 PHE 150 -5.748 -9.386 8.830 1098 HE1 PHE 150 HE1 PHE 150 -0.905 -8.541 9.423 1099 HE2 PHE 150 HE2 PHE 150 -4.981 -7.268 9.795 1100 HZ PHE 150 HZ PHE 150 -2.569 -6.814 10.078 1101 HB2 PHE 150 2HB PHE 150 -3.715 -11.667 7.034 1102 HB3 PHE 150 1HB PHE 150 -5.305 -11.397 7.661 1103 H THR 151 H THR 151 -2.333 -13.514 7.221 1104 HA THR 151 HA THR 151 -0.115 -13.426 9.341 1105 HB THR 151 HB THR 151 -0.247 -15.689 8.611 1106 HG1 THR 151 HG1 THR 151 2.103 -14.527 7.578 1107 HG21 THR 151 3HG2 THR 151 0.754 -14.851 5.799 1108 HG22 THR 151 1HG2 THR 151 -0.887 -15.463 6.156 1109 HG23 THR 151 2HG2 THR 151 0.521 -16.503 6.432 1110 H LEU 152 H LEU 152 1.312 -12.003 9.150 1111 HA LEU 152 HA LEU 152 1.354 -9.860 7.049 1112 HG LEU 152 HG LEU 152 3.441 -8.113 9.846 1113 HB2 LEU 152 2HB LEU 152 1.515 -9.266 9.381 1114 HB3 LEU 152 1HB LEU 152 2.733 -10.441 9.730 1115 HD11 LEU 152 1HD1 LEU 152 5.182 -9.487 7.732 1116 HD12 LEU 152 2HD1 LEU 152 5.079 -10.093 9.381 1117 HD13 LEU 152 3HD1 LEU 152 5.669 -8.446 9.085 1118 HD21 LEU 152 3HD2 LEU 152 3.497 -7.957 6.758 1119 HD22 LEU 152 1HD2 LEU 152 3.851 -6.687 7.955 1120 HD23 LEU 152 2HD2 LEU 152 2.198 -7.278 7.743 1121 H GLN 153 H GLN 153 2.670 -9.741 5.419 1122 HA GLN 153 HA GLN 153 5.288 -11.333 5.257 1123 HB2 GLN 153 2HB GLN 153 3.052 -11.101 3.190 1124 HB3 GLN 153 1HB GLN 153 4.681 -10.928 2.596 1125 HG2 GLN 153 2HG GLN 153 4.494 -13.163 2.249 1126 HG3 GLN 153 1HG GLN 153 5.325 -13.153 3.798 1127 HE21 GLN 153 1HE2 GLN 153 4.531 -15.316 3.957 1128 HE22 GLN 153 2HE2 GLN 153 2.831 -15.528 4.539 1129 H GLU 154 H GLU 154 6.881 -9.896 5.269 1130 HA GLU 154 HA GLU 154 6.599 -7.219 3.780 1131 HB2 GLU 154 2HB GLU 154 8.763 -7.742 5.863 1132 HB3 GLU 154 1HB GLU 154 8.307 -6.241 5.103 1133 HG2 GLU 154 2HG GLU 154 5.944 -6.572 6.218 1134 HG3 GLU 154 1HG GLU 154 6.696 -7.848 7.143 1135 H TRP 155 H TRP 155 7.469 -7.282 1.835 1136 HA TRP 155 HA TRP 155 9.671 -9.276 1.106 1137 HD1 TRP 155 HD1 TRP 155 5.578 -9.478 1.002 1138 HE1 TRP 155 HE1 TRP 155 4.494 -11.775 0.218 1139 HE3 TRP 155 HE3 TRP 155 9.417 -10.934 -1.984 1140 HZ2 TRP 155 HZ2 TRP 155 5.445 -13.927 -1.334 1141 HZ3 TRP 155 HZ3 TRP 155 9.217 -13.051 -3.244 1142 HH2 TRP 155 HH2 TRP 155 7.249 -14.535 -2.919 1143 HB2 TRP 155 2HB TRP 155 7.304 -7.995 -0.333 1144 HB3 TRP 155 1HB TRP 155 8.555 -8.729 -1.288 1145 H VAL 156 H VAL 156 11.730 -8.340 1.037 1146 HA VAL 156 HA VAL 156 12.050 -5.494 0.061 1147 HB VAL 156 HB VAL 156 13.083 -6.178 2.199 1148 HG11 VAL 156 1HG1 VAL 156 15.074 -7.814 0.517 1149 HG12 VAL 156 2HG1 VAL 156 13.961 -8.431 1.759 1150 HG13 VAL 156 3HG1 VAL 156 15.306 -7.373 2.227 1151 HG21 VAL 156 3HG2 VAL 156 15.151 -4.878 1.953 1152 HG22 VAL 156 1HG2 VAL 156 13.905 -4.122 0.937 1153 HG23 VAL 156 2HG2 VAL 156 15.155 -5.120 0.187 1154 H ARG 157 H ARG 157 12.773 -4.832 -1.826 1155 HA ARG 157 HA ARG 157 13.501 -6.417 -4.114 1156 HE ARG 157 HE ARG 157 13.920 -3.871 -7.427 1157 HB2 ARG 157 2HB ARG 157 13.782 -3.481 -3.322 1158 HB3 ARG 157 1HB ARG 157 14.766 -3.999 -4.668 1159 HG2 ARG 157 2HG ARG 157 12.587 -5.094 -5.693 1160 HG3 ARG 157 1HG ARG 157 11.715 -4.209 -4.433 1161 HD2 ARG 157 2HD ARG 157 11.606 -2.798 -6.383 1162 HD3 ARG 157 1HD ARG 157 12.777 -2.092 -5.260 1163 HH11 ARG 157 2HH1 ARG 157 13.272 -0.621 -6.461 1164 HH12 ARG 157 1HH1 ARG 157 14.743 0.065 -7.250 1165 HH21 ARG 157 1HH2 ARG 157 15.614 -3.148 -8.289 1166 HH22 ARG 157 2HH2 ARG 157 16.053 -1.361 -8.256 1167 H SER 158 H SER 158 15.222 -6.871 -5.266 1168 HA SER 158 HA SER 158 16.830 -8.559 -4.073 1169 HG SER 158 HG SER 158 18.370 -6.489 -6.244 1170 HB2 SER 158 2HB SER 158 17.744 -9.122 -6.164 1171 HB3 SER 158 1HB SER 158 16.343 -8.207 -6.637 1172 H ALA 159 H ALA 159 18.314 -8.415 -2.497 1173 HA ALA 159 HA ALA 159 20.140 -6.274 -1.966 1174 HB1 ALA 159 3HB ALA 159 19.168 -7.898 -0.330 1175 HB2 ALA 159 1HB ALA 159 20.947 -7.942 -0.224 1176 HB3 ALA 159 2HB ALA 159 20.067 -9.232 -1.066 1177 H SER 160 H SER 160 21.033 -6.215 -4.277 1178 HA SER 160 HA SER 160 23.225 -7.828 -5.136 1179 HG SER 160 HG SER 160 23.543 -5.706 -7.844 1180 HB2 SER 160 2HB SER 160 21.910 -6.354 -6.559 1181 HB3 SER 160 1HB SER 160 22.542 -4.894 -5.788 1182 H SER 161 H SER 161 23.685 -4.722 -3.446 1183 HA SER 161 HA SER 161 25.797 -5.893 -1.834 1184 HG SER 161 HG SER 161 28.098 -5.835 -2.153 1185 HB2 SER 161 2HB SER 161 27.082 -5.194 -4.071 1186 HB3 SER 161 1HB SER 161 26.974 -3.543 -3.444 1187 H ARG 162 H ARG 162 26.443 -4.640 -0.010 1188 HA ARG 162 HA ARG 162 25.269 -1.892 0.330 1189 HE ARG 162 HE ARG 162 21.841 -0.267 3.556 1190 HB2 ARG 162 1HB ARG 162 23.552 -3.719 1.173 1191 HB3 ARG 162 2HB ARG 162 24.649 -3.960 2.523 1192 HG2 ARG 162 1HG ARG 162 24.348 -1.546 3.228 1193 HG3 ARG 162 2HG ARG 162 23.437 -1.203 1.745 1194 HD2 ARG 162 1HD ARG 162 21.659 -2.908 2.461 1195 HD3 ARG 162 2HD ARG 162 22.552 -3.176 3.960 1196 HH11 ARG 162 2HH1 ARG 162 20.360 -3.280 4.629 1197 HH12 ARG 162 1HH1 ARG 162 19.225 -2.303 5.670 1198 HH21 ARG 162 1HH2 ARG 162 20.502 0.718 4.859 1199 HH22 ARG 162 2HH2 ARG 162 19.316 -0.300 5.768 Start of MODEL 6 1 HA MET 1 HA MET 1 16.087 5.774 2.959 2 H1 MET 1 1H MET 1 15.253 6.903 5.067 3 H2 MET 1 2H MET 1 14.738 7.773 3.753 4 H3 MET 1 3H MET 1 13.703 6.830 4.510 5 HB2 MET 1 1HB MET 1 13.741 4.292 4.299 6 HB3 MET 1 2HB MET 1 14.844 3.557 3.187 7 HG2 MET 1 1HG MET 1 16.805 3.939 4.695 8 HG3 MET 1 2HG MET 1 15.776 4.695 5.921 9 HE1 MET 1 3HE MET 1 12.939 2.582 5.772 10 HE2 MET 1 1HE MET 1 13.731 3.679 6.933 11 HE3 MET 1 2HE MET 1 13.573 1.950 7.329 12 H GLU 2 H GLU 2 13.412 4.168 1.799 13 HA GLU 2 HA GLU 2 11.960 6.549 0.797 14 HB2 GLU 2 2HB GLU 2 11.938 6.180 -1.562 15 HB3 GLU 2 1HB GLU 2 13.558 6.399 -0.989 16 HG2 GLU 2 2HG GLU 2 13.579 3.653 -1.031 17 HG3 GLU 2 1HG GLU 2 12.295 3.879 -2.228 18 H LEU 3 H LEU 3 10.389 4.544 -1.052 19 HA LEU 3 HA LEU 3 8.433 4.430 1.245 20 HG LEU 3 HG LEU 3 8.798 6.351 -1.773 21 HB2 LEU 3 2HB LEU 3 6.618 4.439 -0.722 22 HB3 LEU 3 1HB LEU 3 7.303 5.815 0.050 23 HD11 LEU 3 1HD1 LEU 3 8.706 5.050 -3.943 24 HD12 LEU 3 2HD1 LEU 3 7.683 3.802 -3.165 25 HD13 LEU 3 3HD1 LEU 3 9.363 4.065 -2.655 26 HD21 LEU 3 3HD2 LEU 3 6.900 6.756 -3.535 27 HD22 LEU 3 1HD2 LEU 3 6.613 7.357 -1.885 28 HD23 LEU 3 2HD2 LEU 3 5.831 5.857 -2.431 29 H VAL 4 H VAL 4 7.041 2.905 1.764 30 HA VAL 4 HA VAL 4 7.572 0.098 0.678 31 HB VAL 4 HB VAL 4 7.127 1.077 3.514 32 HG11 VAL 4 1HG1 VAL 4 7.741 -1.303 4.284 33 HG12 VAL 4 2HG1 VAL 4 7.625 -1.812 2.589 34 HG13 VAL 4 3HG1 VAL 4 6.191 -1.211 3.388 35 HG21 VAL 4 3HG2 VAL 4 9.363 1.717 2.901 36 HG22 VAL 4 1HG2 VAL 4 9.775 0.097 2.347 37 HG23 VAL 4 2HG2 VAL 4 9.443 0.407 4.074 38 H SER 5 H SER 5 5.846 -1.142 0.053 39 HA SER 5 HA SER 5 3.084 0.085 0.210 40 HG SER 5 HG SER 5 3.866 -3.154 -1.865 41 HB2 SER 5 2HB SER 5 2.669 -1.450 -1.674 42 HB3 SER 5 1HB SER 5 4.063 -0.481 -1.936 43 H VAL 6 H VAL 6 1.218 -0.805 1.022 44 HA VAL 6 HA VAL 6 1.443 -3.172 2.902 45 HB VAL 6 HB VAL 6 1.132 -2.238 4.879 46 HG11 VAL 6 1HG1 VAL 6 2.597 0.080 3.507 47 HG12 VAL 6 2HG1 VAL 6 3.342 -1.347 4.236 48 HG13 VAL 6 3HG1 VAL 6 2.521 -0.133 5.241 49 HG21 VAL 6 3HG2 VAL 6 0.220 -0.085 5.609 50 HG22 VAL 6 1HG2 VAL 6 -0.962 -0.948 4.644 51 HG23 VAL 6 2HG2 VAL 6 -0.043 0.400 3.925 52 H ALA 7 H ALA 7 0.147 -4.208 1.258 53 HA ALA 7 HA ALA 7 -2.848 -3.422 1.336 54 HB1 ALA 7 3HB ALA 7 -1.995 -3.499 -0.973 55 HB2 ALA 7 1HB ALA 7 -3.108 -4.833 -0.713 56 HB3 ALA 7 2HB ALA 7 -1.349 -5.131 -0.751 57 H ALA 8 H ALA 8 -4.292 -4.777 2.378 58 HA ALA 8 HA ALA 8 -3.488 -7.620 3.024 59 HB1 ALA 8 3HB ALA 8 -5.508 -7.524 4.529 60 HB2 ALA 8 1HB ALA 8 -5.912 -5.909 3.914 61 HB3 ALA 8 2HB ALA 8 -4.455 -6.145 4.856 62 H LEU 9 H LEU 9 -4.317 -9.466 2.170 63 HA LEU 9 HA LEU 9 -6.605 -9.332 0.245 64 HG LEU 9 HG LEU 9 -3.170 -9.634 -2.223 65 HB2 LEU 9 2HB LEU 9 -5.331 -10.090 -1.716 66 HB3 LEU 9 1HB LEU 9 -5.122 -8.481 -1.234 67 HD11 LEU 9 1HD1 LEU 9 -2.966 -7.450 -0.976 68 HD12 LEU 9 2HD1 LEU 9 -1.499 -8.394 -0.833 69 HD13 LEU 9 3HD1 LEU 9 -2.624 -8.340 0.522 70 HD21 LEU 9 3HD2 LEU 9 -1.709 -11.124 -1.043 71 HD22 LEU 9 1HD2 LEU 9 -3.337 -11.821 -0.849 72 HD23 LEU 9 2HD2 LEU 9 -2.559 -10.911 0.500 73 H ALA 10 H ALA 10 -7.589 -11.009 -0.540 74 HA ALA 10 HA ALA 10 -7.383 -13.585 1.020 75 HB1 ALA 10 3HB ALA 10 -9.508 -12.315 -0.915 76 HB2 ALA 10 1HB ALA 10 -9.483 -12.205 0.852 77 HB3 ALA 10 2HB ALA 10 -9.772 -13.751 0.080 78 H GLU 11 H GLU 11 -8.896 -15.109 -1.020 79 HA GLU 11 HA GLU 11 -6.646 -16.371 -2.534 80 HB2 GLU 11 2HB GLU 11 -8.368 -17.799 -1.448 81 HB3 GLU 11 1HB GLU 11 -9.615 -17.131 -2.504 82 HG2 GLU 11 2HG GLU 11 -8.547 -18.136 -4.513 83 HG3 GLU 11 1HG GLU 11 -7.160 -18.715 -3.565 84 H ASN 12 H ASN 12 -6.995 -16.844 -4.884 85 HA ASN 12 HA ASN 12 -6.035 -15.711 -6.711 86 HB2 ASN 12 2HB ASN 12 -8.941 -15.068 -6.600 87 HB3 ASN 12 1HB ASN 12 -8.117 -13.748 -7.325 88 HD21 ASN 12 1HD2 ASN 12 -9.301 -16.851 -7.870 89 HD22 ASN 12 2HD2 ASN 12 -8.664 -16.960 -9.589 90 H ARG 13 H ARG 13 -5.581 -14.256 -4.072 91 HA ARG 13 HA ARG 13 -4.607 -12.390 -3.189 92 HE ARG 13 HE ARG 13 -0.488 -14.129 -6.566 93 HB2 ARG 13 2HB ARG 13 -2.639 -11.441 -4.014 94 HB3 ARG 13 1HB ARG 13 -2.630 -13.162 -4.338 95 HG2 ARG 13 2HG ARG 13 -3.354 -12.587 -6.786 96 HG3 ARG 13 1HG ARG 13 -3.067 -10.921 -6.402 97 HD2 ARG 13 2HD ARG 13 -0.938 -11.256 -7.128 98 HD3 ARG 13 1HD ARG 13 -0.593 -11.948 -5.579 99 HH11 ARG 13 2HH1 ARG 13 -2.054 -11.978 -8.811 100 HH12 ARG 13 1HH1 ARG 13 -2.091 -13.199 -10.145 101 HH21 ARG 13 1HH2 ARG 13 -0.619 -15.540 -8.039 102 HH22 ARG 13 2HH2 ARG 13 -1.328 -15.200 -9.688 103 H VAL 14 H VAL 14 -6.767 -11.756 -3.211 104 HA VAL 14 HA VAL 14 -7.531 -9.445 -5.031 105 HB VAL 14 HB VAL 14 -8.923 -11.783 -3.719 106 HG11 VAL 14 1HG1 VAL 14 -10.031 -10.109 -2.261 107 HG12 VAL 14 2HG1 VAL 14 -11.156 -10.817 -3.433 108 HG13 VAL 14 3HG1 VAL 14 -10.500 -9.173 -3.674 109 HG21 VAL 14 3HG2 VAL 14 -8.711 -11.386 -6.219 110 HG22 VAL 14 1HG2 VAL 14 -9.670 -9.890 -6.057 111 HG23 VAL 14 2HG2 VAL 14 -10.423 -11.470 -5.704 112 H ILE 15 H ILE 15 -7.546 -7.390 -4.390 113 HA ILE 15 HA ILE 15 -6.668 -6.735 -1.559 114 HB ILE 15 HB ILE 15 -7.214 -4.651 -3.718 115 HG12 ILE 15 2HG1 ILE 15 -4.295 -5.017 -3.117 116 HG13 ILE 15 1HG1 ILE 15 -4.985 -6.499 -3.721 117 HG21 ILE 15 1HG2 ILE 15 -5.584 -4.434 -1.090 118 HG22 ILE 15 2HG2 ILE 15 -7.169 -3.692 -1.387 119 HG23 ILE 15 3HG2 ILE 15 -5.760 -3.132 -2.288 120 HD11 ILE 15 3HD1 ILE 15 -5.732 -5.378 -5.820 121 HD12 ILE 15 1HD1 ILE 15 -4.045 -4.929 -5.544 122 HD13 ILE 15 2HD1 ILE 15 -5.335 -3.775 -5.172 123 H GLY 16 H GLY 16 -9.536 -5.727 -3.563 124 HA2 GLY 16 2HA GLY 16 -11.336 -5.770 -1.311 125 HA3 GLY 16 1HA GLY 16 -10.695 -4.110 -1.369 126 H ARG 17 H ARG 17 -13.328 -5.177 -1.601 127 HA ARG 17 HA ARG 17 -14.214 -4.566 -4.401 128 HE ARG 17 HE ARG 17 -19.226 -5.022 -3.902 129 HB2 ARG 17 2HB ARG 17 -15.155 -6.367 -2.886 130 HB3 ARG 17 1HB ARG 17 -15.993 -5.144 -1.946 131 HG2 ARG 17 2HG ARG 17 -17.188 -4.460 -4.103 132 HG3 ARG 17 1HG ARG 17 -16.322 -5.698 -4.994 133 HD2 ARG 17 2HD ARG 17 -17.731 -7.381 -4.376 134 HD3 ARG 17 1HD ARG 17 -17.440 -7.067 -2.671 135 HH11 ARG 17 2HH1 ARG 17 -19.223 -8.085 -2.377 136 HH12 ARG 17 1HH1 ARG 17 -20.822 -7.812 -1.530 137 HH21 ARG 17 1HH2 ARG 17 -20.920 -4.627 -2.851 138 HH22 ARG 17 2HH2 ARG 17 -21.752 -5.881 -1.824 139 H ASP 18 H ASP 18 -15.444 -3.080 -1.349 140 HA ASP 18 HA ASP 18 -16.246 -0.645 -2.780 141 HB2 ASP 18 2HB ASP 18 -16.301 -1.266 0.224 142 HB3 ASP 18 1HB ASP 18 -17.129 0.061 -0.567 143 H GLY 19 H GLY 19 -13.292 -1.278 -1.151 144 HA2 GLY 19 2HA GLY 19 -11.961 0.595 -2.770 145 HA3 GLY 19 1HA GLY 19 -12.224 1.587 -1.391 146 H GLU 20 H GLU 20 -11.330 0.449 0.759 147 HA GLU 20 HA GLU 20 -8.529 -0.456 0.123 148 HB2 GLU 20 2HB GLU 20 -7.931 -0.308 2.407 149 HB3 GLU 20 1HB GLU 20 -8.513 1.217 1.787 150 HG2 GLU 20 2HG GLU 20 -10.708 0.891 3.060 151 HG3 GLU 20 1HG GLU 20 -10.257 -0.737 3.406 152 H LEU 21 H LEU 21 -11.343 -2.055 1.747 153 HA LEU 21 HA LEU 21 -10.265 -4.663 0.907 154 HG LEU 21 HG LEU 21 -9.195 -2.561 3.675 155 HB2 LEU 21 2HB LEU 21 -9.998 -5.527 3.406 156 HB3 LEU 21 1HB LEU 21 -8.722 -4.818 2.443 157 HD11 LEU 21 1HD1 LEU 21 -10.212 -2.814 5.967 158 HD12 LEU 21 2HD1 LEU 21 -10.613 -4.517 5.593 159 HD13 LEU 21 3HD1 LEU 21 -11.403 -3.191 4.700 160 HD21 LEU 21 3HD2 LEU 21 -7.159 -3.873 3.986 161 HD22 LEU 21 1HD2 LEU 21 -7.925 -4.793 5.291 162 HD23 LEU 21 2HD2 LEU 21 -7.665 -3.053 5.471 163 HA PRO 22 HA PRO 22 -14.563 -5.877 1.362 164 HB2 PRO 22 2HB PRO 22 -14.238 -8.706 1.178 165 HB3 PRO 22 1HB PRO 22 -14.281 -7.549 -0.152 166 HG2 PRO 22 2HG PRO 22 -11.960 -9.103 0.782 167 HG3 PRO 22 1HG PRO 22 -12.050 -8.016 -0.614 168 HD2 PRO 22 2HD PRO 22 -10.956 -7.414 2.088 169 HD3 PRO 22 1HD PRO 22 -10.658 -6.660 0.542 170 H TRP 23 H TRP 23 -12.419 -7.262 3.733 171 HA TRP 23 HA TRP 23 -14.637 -8.182 5.587 172 HD1 TRP 23 HD1 TRP 23 -10.865 -6.713 7.346 173 HE1 TRP 23 HE1 TRP 23 -8.628 -6.198 6.090 174 HE3 TRP 23 HE3 TRP 23 -11.397 -10.249 3.747 175 HZ2 TRP 23 HZ2 TRP 23 -7.582 -7.089 3.661 176 HZ3 TRP 23 HZ3 TRP 23 -9.801 -10.260 1.872 177 HH2 TRP 23 HH2 TRP 23 -7.932 -8.644 1.817 178 HB2 TRP 23 2HB TRP 23 -12.788 -8.899 7.153 179 HB3 TRP 23 1HB TRP 23 -12.777 -9.694 5.612 180 HA PRO 24 HA PRO 24 -15.215 -4.207 7.309 181 HB2 PRO 24 2HB PRO 24 -15.667 -4.590 10.061 182 HB3 PRO 24 1HB PRO 24 -16.775 -5.007 8.746 183 HG2 PRO 24 2HG PRO 24 -14.693 -6.859 10.083 184 HG3 PRO 24 1HG PRO 24 -16.440 -7.184 9.918 185 HD2 PRO 24 2HD PRO 24 -14.738 -8.239 8.116 186 HD3 PRO 24 1HD PRO 24 -16.200 -7.466 7.469 187 H SER 25 H SER 25 -12.514 -5.618 8.939 188 HA SER 25 HA SER 25 -10.377 -4.233 9.067 189 HG SER 25 HG SER 25 -11.301 -2.333 7.972 190 HB2 SER 25 2HB SER 25 -12.029 -2.045 10.421 191 HB3 SER 25 1HB SER 25 -10.306 -2.209 10.615 192 H ILE 26 H ILE 26 -9.727 -5.989 10.139 193 HA ILE 26 HA ILE 26 -10.432 -6.563 12.915 194 HB ILE 26 HB ILE 26 -7.907 -7.748 12.713 195 HG12 ILE 26 2HG1 ILE 26 -7.757 -7.061 10.296 196 HG13 ILE 26 1HG1 ILE 26 -7.389 -8.708 10.733 197 HG21 ILE 26 1HG2 ILE 26 -10.474 -9.205 11.965 198 HG22 ILE 26 2HG2 ILE 26 -9.926 -8.885 13.624 199 HG23 ILE 26 3HG2 ILE 26 -8.935 -9.880 12.529 200 HD11 ILE 26 3HD1 ILE 26 -10.028 -7.847 9.361 201 HD12 ILE 26 1HD1 ILE 26 -9.594 -9.510 9.786 202 HD13 ILE 26 2HD1 ILE 26 -8.643 -8.627 8.588 203 HA PRO 27 HA PRO 27 -7.844 -3.612 15.242 204 HB2 PRO 27 2HB PRO 27 -7.369 -5.920 17.195 205 HB3 PRO 27 1HB PRO 27 -7.822 -4.228 17.521 206 HG2 PRO 27 2HG PRO 27 -9.806 -6.071 17.568 207 HG3 PRO 27 1HG PRO 27 -10.093 -4.593 16.605 208 HD2 PRO 27 2HD PRO 27 -9.086 -7.291 15.505 209 HD3 PRO 27 1HD PRO 27 -10.515 -6.317 14.995 210 H ALA 28 H ALA 28 -6.100 -6.777 15.042 211 HA ALA 28 HA ALA 28 -3.476 -5.634 14.917 212 HB1 ALA 28 3HB ALA 28 -2.749 -7.770 14.671 213 HB2 ALA 28 1HB ALA 28 -3.664 -8.036 13.158 214 HB3 ALA 28 2HB ALA 28 -4.447 -8.242 14.718 215 H ASP 29 H ASP 29 -5.744 -5.749 12.164 216 HA ASP 29 HA ASP 29 -3.750 -4.741 10.172 217 HB2 ASP 29 2HB ASP 29 -5.754 -6.071 9.451 218 HB3 ASP 29 1HB ASP 29 -6.838 -4.835 10.065 219 H LYS 30 H LYS 30 -6.685 -3.075 11.371 220 HA LYS 30 HA LYS 30 -5.617 -0.490 10.966 221 HB2 LYS 30 2HB LYS 30 -8.131 -1.516 11.933 222 HB3 LYS 30 1HB LYS 30 -7.599 -0.393 13.144 223 HG2 LYS 30 2HG LYS 30 -8.841 0.989 11.783 224 HG3 LYS 30 1HG LYS 30 -7.202 1.373 11.252 225 HD2 LYS 30 2HD LYS 30 -7.655 -0.207 9.195 226 HD3 LYS 30 1HD LYS 30 -9.279 -0.387 9.840 227 HE2 LYS 30 2HE LYS 30 -9.640 2.143 9.788 228 HE3 LYS 30 1HE LYS 30 -8.019 2.343 9.082 229 HZ1 LYS 30 3HZ LYS 30 -8.779 0.983 7.102 230 HZ2 LYS 30 1HZ LYS 30 -9.800 2.198 7.296 231 HZ3 LYS 30 2HZ LYS 30 -10.156 0.646 7.731 232 H LYS 31 H LYS 31 -4.483 -2.353 13.417 233 HA LYS 31 HA LYS 31 -3.007 -0.075 14.847 234 HB2 LYS 31 2HB LYS 31 -4.024 -1.824 16.348 235 HB3 LYS 31 1HB LYS 31 -3.197 -3.063 15.451 236 HG2 LYS 31 2HG LYS 31 -2.099 -2.910 17.499 237 HG3 LYS 31 1HG LYS 31 -0.988 -2.478 16.256 238 HD2 LYS 31 2HD LYS 31 -2.528 -0.294 17.830 239 HD3 LYS 31 1HD LYS 31 -1.195 -1.136 18.591 240 HE2 LYS 31 2HE LYS 31 0.252 -0.485 16.454 241 HE3 LYS 31 1HE LYS 31 -1.034 0.625 16.052 242 HZ1 LYS 31 3HZ LYS 31 0.781 1.608 17.464 243 HZ2 LYS 31 1HZ LYS 31 0.397 0.637 18.722 244 HZ3 LYS 31 2HZ LYS 31 -0.692 1.783 18.218 245 H GLN 32 H GLN 32 -2.311 -2.906 12.661 246 HA GLN 32 HA GLN 32 0.648 -2.421 12.715 247 HB2 GLN 32 2HB GLN 32 -0.192 -4.692 12.370 248 HB3 GLN 32 1HB GLN 32 -1.018 -4.232 10.899 249 HG2 GLN 32 2HG GLN 32 2.034 -3.815 11.154 250 HG3 GLN 32 1HG GLN 32 1.420 -5.428 10.891 251 HE21 GLN 32 1HE2 GLN 32 -0.276 -5.452 8.955 252 HE22 GLN 32 2HE2 GLN 32 0.427 -4.668 7.451 253 H TYR 33 H TYR 33 -2.005 -1.816 10.339 254 HA TYR 33 HA TYR 33 -0.608 0.058 8.625 255 HD1 TYR 33 HD1 TYR 33 -4.357 1.048 10.456 256 HD2 TYR 33 HD2 TYR 33 -3.156 1.659 6.392 257 HE1 TYR 33 HE1 TYR 33 -5.839 2.996 10.318 258 HE2 TYR 33 HE2 TYR 33 -4.577 3.678 6.297 259 HH TYR 33 HH TYR 33 -6.210 4.947 7.373 260 HB2 TYR 33 2HB TYR 33 -2.581 -0.509 7.646 261 HB3 TYR 33 1HB TYR 33 -3.416 -0.809 9.105 262 H ARG 34 H ARG 34 -2.208 0.902 11.790 263 HA ARG 34 HA ARG 34 -1.253 3.739 11.420 264 HE ARG 34 HE ARG 34 -6.272 4.186 12.218 265 HB2 ARG 34 2HB ARG 34 -2.518 2.364 13.842 266 HB3 ARG 34 1HB ARG 34 -1.974 4.051 13.879 267 HG2 ARG 34 2HG ARG 34 -3.564 4.623 11.946 268 HG3 ARG 34 1HG ARG 34 -4.079 2.943 11.964 269 HD2 ARG 34 2HD ARG 34 -4.575 3.258 14.511 270 HD3 ARG 34 1HD ARG 34 -4.412 5.016 14.211 271 HH11 ARG 34 2HH1 ARG 34 -6.195 3.876 15.649 272 HH12 ARG 34 1HH1 ARG 34 -8.000 3.660 15.788 273 HH21 ARG 34 1HH2 ARG 34 -8.347 4.023 12.366 274 HH22 ARG 34 2HH2 ARG 34 -9.176 3.732 13.945 275 H SER 35 H SER 35 0.401 1.073 12.909 276 HA SER 35 HA SER 35 2.576 3.076 13.819 277 HG SER 35 HG SER 35 1.725 2.831 15.599 278 HB2 SER 35 2HB SER 35 2.192 0.195 14.772 279 HB3 SER 35 1HB SER 35 3.607 1.203 15.097 280 H ARG 36 H ARG 36 1.839 1.122 11.313 281 HA ARG 36 HA ARG 36 4.601 1.393 10.062 282 HE ARG 36 HE ARG 36 3.834 -2.572 8.732 283 HB2 ARG 36 2HB ARG 36 2.840 -0.582 9.724 284 HB3 ARG 36 1HB ARG 36 1.890 0.581 8.827 285 HG2 ARG 36 2HG ARG 36 3.002 -0.690 7.213 286 HG3 ARG 36 1HG ARG 36 3.841 0.840 7.229 287 HD2 ARG 36 2HD ARG 36 5.464 -0.981 7.043 288 HD3 ARG 36 1HD ARG 36 5.714 -0.213 8.609 289 HH11 ARG 36 2HH1 ARG 36 7.153 -1.912 8.263 290 HH12 ARG 36 1HH1 ARG 36 7.650 -3.609 8.690 291 HH21 ARG 36 1HH2 ARG 36 4.421 -4.452 9.451 292 HH22 ARG 36 2HH2 ARG 36 6.211 -4.887 9.488 293 H VAL 37 H VAL 37 1.215 2.693 9.363 294 HA VAL 37 HA VAL 37 2.562 4.908 7.806 295 HB VAL 37 HB VAL 37 1.007 4.888 6.257 296 HG11 VAL 37 1HG1 VAL 37 0.528 2.667 5.309 297 HG12 VAL 37 2HG1 VAL 37 0.598 1.928 6.939 298 HG13 VAL 37 3HG1 VAL 37 2.067 2.586 6.199 299 HG21 VAL 37 3HG2 VAL 37 -1.134 5.290 7.339 300 HG22 VAL 37 1HG2 VAL 37 -1.196 3.662 7.999 301 HG23 VAL 37 2HG2 VAL 37 -1.369 3.911 6.256 302 H ALA 38 H ALA 38 0.943 5.033 10.812 303 HA ALA 38 HA ALA 38 -0.742 7.414 10.067 304 HB1 ALA 38 3HB ALA 38 -1.576 5.881 11.809 305 HB2 ALA 38 1HB ALA 38 -1.494 7.573 12.324 306 HB3 ALA 38 2HB ALA 38 -0.275 6.425 12.898 307 H ASP 39 H ASP 39 2.461 7.114 11.492 308 HA ASP 39 HA ASP 39 2.896 10.079 11.617 309 HB2 ASP 39 2HB ASP 39 4.531 7.613 12.285 310 HB3 ASP 39 1HB ASP 39 5.428 8.927 11.585 311 H ASP 40 H ASP 40 4.097 7.484 9.357 312 HA ASP 40 HA ASP 40 5.048 9.406 7.509 313 HB2 ASP 40 2HB ASP 40 4.731 6.381 7.538 314 HB3 ASP 40 1HB ASP 40 5.394 7.152 6.110 315 HA PRO 41 HA PRO 41 1.739 10.252 4.384 316 HB2 PRO 41 2HB PRO 41 4.199 10.148 2.517 317 HB3 PRO 41 1HB PRO 41 2.870 11.308 2.491 318 HG2 PRO 41 2HG PRO 41 5.199 12.042 3.685 319 HG3 PRO 41 1HG PRO 41 3.723 12.335 4.629 320 HD2 PRO 41 2HD PRO 41 5.652 9.987 4.947 321 HD3 PRO 41 1HD PRO 41 4.892 11.037 6.174 322 H VAL 42 H VAL 42 0.428 9.064 2.994 323 HA VAL 42 HA VAL 42 1.539 6.447 1.858 324 HB VAL 42 HB VAL 42 -1.326 7.141 2.654 325 HG11 VAL 42 1HG1 VAL 42 -0.162 4.350 1.935 326 HG12 VAL 42 2HG1 VAL 42 -1.203 5.293 0.844 327 HG13 VAL 42 3HG1 VAL 42 -1.846 4.713 2.392 328 HG21 VAL 42 3HG2 VAL 42 -0.825 5.372 4.502 329 HG22 VAL 42 1HG2 VAL 42 0.117 6.868 4.683 330 HG23 VAL 42 2HG2 VAL 42 0.883 5.419 4.012 331 H VAL 43 H VAL 43 1.562 5.930 -0.195 332 HA VAL 43 HA VAL 43 0.226 7.713 -2.272 333 HB VAL 43 HB VAL 43 1.855 7.123 -3.882 334 HG11 VAL 43 1HG1 VAL 43 2.741 8.820 -2.152 335 HG12 VAL 43 2HG1 VAL 43 4.029 7.849 -2.912 336 HG13 VAL 43 3HG1 VAL 43 3.479 7.507 -1.269 337 HG21 VAL 43 3HG2 VAL 43 2.296 4.714 -3.471 338 HG22 VAL 43 1HG2 VAL 43 3.058 5.108 -1.899 339 HG23 VAL 43 2HG2 VAL 43 3.824 5.577 -3.413 340 H LEU 44 H LEU 44 -1.684 7.083 -3.059 341 HA LEU 44 HA LEU 44 -2.313 4.109 -3.446 342 HG LEU 44 HG LEU 44 -4.357 7.000 -2.157 343 HB2 LEU 44 2HB LEU 44 -4.251 4.197 -2.039 344 HB3 LEU 44 1HB LEU 44 -2.834 4.527 -1.140 345 HD11 LEU 44 1HD1 LEU 44 -6.257 5.557 -1.335 346 HD12 LEU 44 2HD1 LEU 44 -5.977 6.883 -0.204 347 HD13 LEU 44 3HD1 LEU 44 -5.398 5.244 0.184 348 HD21 LEU 44 3HD2 LEU 44 -3.222 6.412 0.650 349 HD22 LEU 44 1HD2 LEU 44 -3.723 7.960 -0.037 350 HD23 LEU 44 2HD2 LEU 44 -2.280 7.169 -0.686 351 H GLY 45 H GLY 45 -4.889 3.887 -4.015 352 HA2 GLY 45 2HA GLY 45 -4.884 5.016 -6.866 353 HA3 GLY 45 1HA GLY 45 -5.658 3.518 -6.345 354 H ARG 46 H ARG 46 -7.351 4.563 -7.673 355 HA ARG 46 HA ARG 46 -9.214 6.289 -5.952 356 HE ARG 46 HE ARG 46 -11.666 8.632 -7.777 357 HB2 ARG 46 2HB ARG 46 -9.371 5.846 -8.977 358 HB3 ARG 46 1HB ARG 46 -10.737 6.391 -8.063 359 HG2 ARG 46 2HG ARG 46 -8.022 7.845 -8.160 360 HG3 ARG 46 1HG ARG 46 -9.406 8.294 -9.144 361 HD2 ARG 46 2HD ARG 46 -9.369 8.420 -6.040 362 HD3 ARG 46 1HD ARG 46 -8.991 9.754 -7.107 363 HH11 ARG 46 2HH1 ARG 46 -10.128 10.489 -5.244 364 HH12 ARG 46 1HH1 ARG 46 -11.675 11.340 -4.838 365 HH21 ARG 46 1HH2 ARG 46 -13.480 9.499 -7.058 366 HH22 ARG 46 2HH2 ARG 46 -13.421 10.913 -5.931 367 H THR 47 H THR 47 -8.864 2.968 -7.085 368 HA THR 47 HA THR 47 -11.292 2.067 -5.796 369 HB THR 47 HB THR 47 -8.585 0.588 -5.752 370 HG1 THR 47 HG1 THR 47 -10.568 0.024 -7.591 371 HG21 THR 47 3HG2 THR 47 -9.743 -1.175 -4.853 372 HG22 THR 47 1HG2 THR 47 -10.846 -1.199 -6.233 373 HG23 THR 47 2HG2 THR 47 -11.235 -0.265 -4.769 374 H THR 48 H THR 48 -8.234 1.534 -3.963 375 HA THR 48 HA THR 48 -9.041 1.969 -1.378 376 HB THR 48 HB THR 48 -6.714 2.723 -0.793 377 HG1 THR 48 HG1 THR 48 -6.472 3.986 -2.619 378 HG21 THR 48 3HG2 THR 48 -6.575 0.441 -2.817 379 HG22 THR 48 1HG2 THR 48 -7.091 0.252 -1.140 380 HG23 THR 48 2HG2 THR 48 -5.458 0.825 -1.473 381 H PHE 49 H PHE 49 -8.505 4.839 -3.422 382 HA PHE 49 HA PHE 49 -8.727 6.664 -1.005 383 HD1 PHE 49 HD2 PHE 49 -10.323 9.429 -2.778 384 HD2 PHE 49 HD1 PHE 49 -6.191 8.936 -1.744 385 HE1 PHE 49 HE2 PHE 49 -10.304 11.680 -1.790 386 HE2 PHE 49 HE1 PHE 49 -6.133 11.256 -0.910 387 HZ PHE 49 HZ PHE 49 -8.222 12.576 -0.812 388 HB2 PHE 49 2HB PHE 49 -7.247 7.231 -2.978 389 HB3 PHE 49 1HB PHE 49 -8.680 7.590 -3.917 390 H GLU 50 H GLU 50 -11.025 5.479 -3.430 391 HA GLU 50 HA GLU 50 -13.114 7.478 -2.566 392 HB2 GLU 50 2HB GLU 50 -13.326 5.104 -4.496 393 HB3 GLU 50 1HB GLU 50 -14.670 6.145 -4.045 394 HG2 GLU 50 2HG GLU 50 -13.377 8.180 -4.833 395 HG3 GLU 50 1HG GLU 50 -12.049 7.166 -5.337 396 H SER 51 H SER 51 -12.340 4.099 -1.579 397 HA SER 51 HA SER 51 -13.790 4.396 0.979 398 HG SER 51 HG SER 51 -10.776 3.193 2.308 399 HB2 SER 51 2HB SER 51 -12.766 2.349 0.519 400 HB3 SER 51 1HB SER 51 -11.168 3.042 0.192 401 H MET 52 H MET 52 -10.310 5.344 0.722 402 HA MET 52 HA MET 52 -10.380 6.498 3.304 403 HB2 MET 52 2HB MET 52 -8.317 7.115 1.090 404 HB3 MET 52 1HB MET 52 -8.094 7.442 2.788 405 HG2 MET 52 2HG MET 52 -8.776 4.598 2.597 406 HG3 MET 52 1HG MET 52 -7.492 4.979 1.459 407 HE1 MET 52 3HE MET 52 -5.786 3.908 2.393 408 HE2 MET 52 1HE MET 52 -4.875 4.221 3.896 409 HE3 MET 52 2HE MET 52 -4.820 5.416 2.556 410 H ARG 53 H ARG 53 -11.365 8.304 0.704 411 HA ARG 53 HA ARG 53 -11.438 11.028 1.831 412 HE ARG 53 HE ARG 53 -16.511 11.728 -1.181 413 HB2 ARG 53 2HB ARG 53 -12.113 10.432 -0.463 414 HB3 ARG 53 1HB ARG 53 -13.275 9.271 0.112 415 HG2 ARG 53 2HG ARG 53 -13.793 12.121 1.051 416 HG3 ARG 53 1HG ARG 53 -13.823 11.944 -0.666 417 HD2 ARG 53 2HD ARG 53 -15.355 9.798 0.869 418 HD3 ARG 53 1HD ARG 53 -15.922 11.371 1.182 419 HH11 ARG 53 2HH1 ARG 53 -15.369 8.467 -0.623 420 HH12 ARG 53 1HH1 ARG 53 -15.871 7.912 -2.259 421 HH21 ARG 53 1HH2 ARG 53 -17.164 11.025 -2.982 422 HH22 ARG 53 2HH2 ARG 53 -16.853 9.296 -3.518 423 H ASP 54 H ASP 54 -13.088 8.109 2.939 424 HA ASP 54 HA ASP 54 -14.560 9.665 5.076 425 HB2 ASP 54 2HB ASP 54 -14.792 6.807 3.980 426 HB3 ASP 54 1HB ASP 54 -15.596 7.323 5.453 427 H ASP 55 H ASP 55 -12.500 6.626 5.357 428 HA ASP 55 HA ASP 55 -11.234 7.851 7.859 429 HB2 ASP 55 2HB ASP 55 -11.625 4.997 6.898 430 HB3 ASP 55 1HB ASP 55 -10.079 5.307 7.626 431 H LEU 56 H LEU 56 -9.495 9.079 7.617 432 HA LEU 56 HA LEU 56 -7.733 8.897 5.273 433 HG LEU 56 HG LEU 56 -7.915 12.577 6.323 434 HB2 LEU 56 2HB LEU 56 -6.915 10.562 7.667 435 HB3 LEU 56 1HB LEU 56 -6.591 10.797 5.975 436 HD11 LEU 56 1HD1 LEU 56 -9.112 11.415 4.472 437 HD12 LEU 56 2HD1 LEU 56 -10.232 12.332 5.484 438 HD13 LEU 56 3HD1 LEU 56 -10.163 10.572 5.643 439 HD21 LEU 56 3HD2 LEU 56 -9.748 11.089 8.280 440 HD22 LEU 56 1HD2 LEU 56 -9.769 12.829 7.886 441 HD23 LEU 56 2HD2 LEU 56 -8.363 12.132 8.712 442 HA PRO 57 HA PRO 57 -4.434 6.268 7.168 443 HB2 PRO 57 2HB PRO 57 -2.361 6.579 5.431 444 HB3 PRO 57 1HB PRO 57 -3.860 5.797 5.000 445 HG2 PRO 57 2HG PRO 57 -3.000 8.664 4.358 446 HG3 PRO 57 1HG PRO 57 -3.778 7.488 3.272 447 HD2 PRO 57 2HD PRO 57 -5.116 9.492 4.696 448 HD3 PRO 57 1HD PRO 57 -5.928 8.005 4.108 449 H GLY 58 H GLY 58 -2.232 8.902 6.247 450 HA2 GLY 58 2HA GLY 58 -1.452 9.265 9.232 451 HA3 GLY 58 1HA GLY 58 -0.237 8.934 7.998 452 H SER 59 H SER 59 0.804 10.860 8.713 453 HA SER 59 HA SER 59 -0.160 13.522 8.432 454 HG SER 59 HG SER 59 3.208 14.509 8.731 455 HB2 SER 59 2HB SER 59 2.016 12.685 9.440 456 HB3 SER 59 1HB SER 59 2.668 12.503 7.804 457 H ALA 60 H ALA 60 -0.074 11.523 5.737 458 HA ALA 60 HA ALA 60 -1.072 13.662 4.097 459 HB1 ALA 60 3HB ALA 60 1.833 12.944 3.472 460 HB2 ALA 60 1HB ALA 60 1.064 14.522 3.603 461 HB3 ALA 60 2HB ALA 60 0.775 13.514 2.161 462 H GLN 61 H GLN 61 -1.652 13.135 1.878 463 HA GLN 61 HA GLN 61 -2.235 10.165 1.390 464 HB2 GLN 61 2HB GLN 61 -3.978 11.610 2.838 465 HB3 GLN 61 1HB GLN 61 -4.437 12.301 1.293 466 HG2 GLN 61 2HG GLN 61 -4.924 9.902 0.461 467 HG3 GLN 61 1HG GLN 61 -4.469 9.291 2.013 468 HE21 GLN 61 1HE2 GLN 61 -6.024 11.400 3.558 469 HE22 GLN 61 2HE2 GLN 61 -7.705 10.671 3.364 470 H ILE 62 H ILE 62 -1.259 9.892 -0.464 471 HA ILE 62 HA ILE 62 -1.331 11.934 -2.733 472 HB ILE 62 HB ILE 62 0.554 9.674 -1.875 473 HG12 ILE 62 2HG1 ILE 62 1.418 12.512 -2.375 474 HG13 ILE 62 1HG1 ILE 62 0.572 12.196 -0.865 475 HG21 ILE 62 1HG2 ILE 62 0.794 11.334 -4.435 476 HG22 ILE 62 2HG2 ILE 62 0.555 9.568 -4.366 477 HG23 ILE 62 3HG2 ILE 62 2.077 10.245 -3.768 478 HD11 ILE 62 3HD1 ILE 62 2.944 12.114 -0.426 479 HD12 ILE 62 1HD1 ILE 62 3.270 11.064 -1.813 480 HD13 ILE 62 2HD1 ILE 62 2.424 10.429 -0.352 481 H VAL 63 H VAL 63 -2.895 11.409 -4.312 482 HA VAL 63 HA VAL 63 -3.174 8.510 -5.110 483 HB VAL 63 HB VAL 63 -4.731 10.927 -5.958 484 HG11 VAL 63 1HG1 VAL 63 -4.988 8.069 -7.112 485 HG12 VAL 63 2HG1 VAL 63 -4.654 9.540 -8.041 486 HG13 VAL 63 3HG1 VAL 63 -6.245 9.319 -7.285 487 HG21 VAL 63 3HG2 VAL 63 -5.439 8.263 -4.518 488 HG22 VAL 63 1HG2 VAL 63 -6.593 9.608 -4.807 489 HG23 VAL 63 2HG2 VAL 63 -5.203 9.838 -3.751 490 H MET 64 H MET 64 -1.848 7.502 -6.300 491 HA MET 64 HA MET 64 -0.397 8.685 -8.650 492 HB2 MET 64 2HB MET 64 -0.552 5.952 -7.223 493 HB3 MET 64 1HB MET 64 -0.063 5.985 -8.879 494 HG2 MET 64 2HG MET 64 1.535 8.110 -7.742 495 HG3 MET 64 1HG MET 64 1.524 6.853 -6.521 496 HE1 MET 64 3HE MET 64 2.218 8.001 -10.131 497 HE2 MET 64 1HE MET 64 1.277 6.571 -10.647 498 HE3 MET 64 2HE MET 64 3.041 6.610 -10.911 499 H SER 65 H SER 65 -1.892 9.535 -9.882 500 HA SER 65 HA SER 65 -3.064 7.749 -11.940 501 HG SER 65 HG SER 65 -6.060 7.553 -11.972 502 HB2 SER 65 2HB SER 65 -4.954 7.785 -10.193 503 HB3 SER 65 1HB SER 65 -5.055 9.528 -10.361 504 H ARG 66 H ARG 66 -4.460 9.334 -13.471 505 HA ARG 66 HA ARG 66 -2.773 11.867 -13.993 506 HE ARG 66 HE ARG 66 -2.767 12.537 -19.535 507 HB2 ARG 66 2HB ARG 66 -2.476 9.826 -15.601 508 HB3 ARG 66 1HB ARG 66 -4.090 10.208 -16.219 509 HG2 ARG 66 2HG ARG 66 -3.287 12.534 -16.807 510 HG3 ARG 66 1HG ARG 66 -1.706 12.168 -16.127 511 HD2 ARG 66 2HD ARG 66 -1.192 10.510 -17.884 512 HD3 ARG 66 1HD ARG 66 -2.873 10.426 -18.389 513 HH11 ARG 66 2HH1 ARG 66 0.265 12.045 -17.867 514 HH12 ARG 66 1HH1 ARG 66 1.025 13.476 -18.672 515 HH21 ARG 66 1HH2 ARG 66 -1.886 14.131 -20.413 516 HH22 ARG 66 2HH2 ARG 66 -0.163 14.616 -20.069 517 H SER 67 H SER 67 -5.308 11.528 -12.416 518 HA SER 67 HA SER 67 -7.270 13.308 -13.869 519 HG SER 67 HG SER 67 -9.500 12.715 -11.255 520 HB2 SER 67 2HB SER 67 -7.831 11.339 -12.273 521 HB3 SER 67 1HB SER 67 -7.304 12.388 -10.925 522 H GLU 68 H GLU 68 -8.171 14.966 -11.779 523 HA GLU 68 HA GLU 68 -6.248 17.228 -11.916 524 HB2 GLU 68 2HB GLU 68 -8.089 18.553 -11.081 525 HB3 GLU 68 1HB GLU 68 -8.594 17.493 -12.377 526 HG2 GLU 68 2HG GLU 68 -9.605 15.944 -10.481 527 HG3 GLU 68 1HG GLU 68 -9.328 17.301 -9.382 528 H ARG 69 H ARG 69 -6.979 18.432 -9.409 529 HA ARG 69 HA ARG 69 -5.248 17.023 -7.371 530 HE ARG 69 HE ARG 69 -0.834 19.547 -10.520 531 HB2 ARG 69 2HB ARG 69 -4.809 19.956 -8.203 532 HB3 ARG 69 1HB ARG 69 -4.184 19.274 -6.714 533 HG2 ARG 69 2HG ARG 69 -2.599 17.830 -7.734 534 HG3 ARG 69 1HG ARG 69 -3.382 17.843 -9.282 535 HD2 ARG 69 2HD ARG 69 -2.635 20.664 -8.555 536 HD3 ARG 69 1HD ARG 69 -1.292 19.637 -8.202 537 HH11 ARG 69 2HH1 ARG 69 -4.280 19.751 -10.238 538 HH12 ARG 69 1HH1 ARG 69 -4.533 20.076 -12.006 539 HH21 ARG 69 1HH2 ARG 69 -1.102 19.976 -12.506 540 HH22 ARG 69 2HH2 ARG 69 -2.756 20.200 -13.247 541 H SER 70 H SER 70 -5.790 17.565 -5.271 542 HA SER 70 HA SER 70 -6.926 18.517 -3.449 543 HG SER 70 HG SER 70 -6.616 20.983 -3.337 544 HB2 SER 70 2HB SER 70 -8.568 20.301 -5.312 545 HB3 SER 70 1HB SER 70 -8.731 20.249 -3.570 546 H PHE 71 H PHE 71 -8.244 17.350 -2.339 547 HA PHE 71 HA PHE 71 -10.446 15.723 -3.767 548 HD1 PHE 71 HD1 PHE 71 -10.107 13.613 -5.069 549 HD2 PHE 71 HD2 PHE 71 -6.212 14.066 -3.287 550 HE1 PHE 71 HE1 PHE 71 -9.071 12.435 -6.978 551 HE2 PHE 71 HE2 PHE 71 -5.214 12.926 -5.214 552 HZ PHE 71 HZ PHE 71 -6.624 12.079 -7.036 553 HB2 PHE 71 2HB PHE 71 -8.173 14.674 -1.974 554 HB3 PHE 71 1HB PHE 71 -9.586 13.762 -2.397 555 H SER 72 H SER 72 -9.468 16.024 -0.267 556 HA SER 72 HA SER 72 -12.242 16.695 0.490 557 HG SER 72 HG SER 72 -12.809 14.964 -0.906 558 HB2 SER 72 2HB SER 72 -11.449 13.759 0.930 559 HB3 SER 72 1HB SER 72 -12.723 14.556 1.843 560 H VAL 73 H VAL 73 -9.476 15.034 2.116 561 HA VAL 73 HA VAL 73 -9.697 16.988 4.441 562 HB VAL 73 HB VAL 73 -9.145 14.665 5.020 563 HG11 VAL 73 1HG1 VAL 73 -6.817 13.730 4.672 564 HG12 VAL 73 2HG1 VAL 73 -6.457 15.060 3.550 565 HG13 VAL 73 3HG1 VAL 73 -7.728 13.868 3.165 566 HG21 VAL 73 3HG2 VAL 73 -7.391 15.099 6.654 567 HG22 VAL 73 1HG2 VAL 73 -8.323 16.605 6.497 568 HG23 VAL 73 2HG2 VAL 73 -6.734 16.455 5.723 569 H ASP 74 H ASP 74 -7.966 18.457 4.980 570 HA ASP 74 HA ASP 74 -6.752 19.872 2.744 571 HB2 ASP 74 2HB ASP 74 -7.467 20.707 5.130 572 HB3 ASP 74 1HB ASP 74 -5.875 20.170 5.676 573 H THR 75 H THR 75 -5.187 17.538 5.021 574 HA THR 75 HA THR 75 -2.715 17.457 3.371 575 HB THR 75 HB THR 75 -2.926 16.928 5.910 576 HG1 THR 75 HG1 THR 75 -0.948 15.790 5.585 577 HG21 THR 75 3HG2 THR 75 -3.050 14.575 6.616 578 HG22 THR 75 1HG2 THR 75 -3.420 14.019 4.967 579 HG23 THR 75 2HG2 THR 75 -4.576 15.037 5.850 580 H ALA 76 H ALA 76 -4.664 17.123 1.535 581 HA ALA 76 HA ALA 76 -4.078 14.340 0.455 582 HB1 ALA 76 3HB ALA 76 -6.945 15.390 0.607 583 HB2 ALA 76 1HB ALA 76 -6.210 13.996 1.434 584 HB3 ALA 76 2HB ALA 76 -6.419 13.953 -0.325 585 H HIS 77 H HIS 77 -3.627 14.161 -1.477 586 HA HIS 77 HA HIS 77 -3.405 16.541 -3.404 587 HD1 HIS 77 HD1 HIS 77 -0.901 15.783 0.491 588 HD2 HIS 77 HD2 HIS 77 -1.896 18.924 -2.232 589 HE1 HIS 77 HE1 HIS 77 -0.692 18.054 1.657 590 HB2 HIS 77 2HB HIS 77 -1.132 15.028 -1.957 591 HB3 HIS 77 1HB HIS 77 -0.905 16.306 -3.167 592 H ARG 78 H ARG 78 -1.870 15.755 -5.295 593 HA ARG 78 HA ARG 78 -2.527 12.877 -6.079 594 HE ARG 78 HE ARG 78 -4.076 13.993 -11.140 595 HB2 ARG 78 2HB ARG 78 -4.372 14.560 -6.860 596 HB3 ARG 78 1HB ARG 78 -3.236 15.138 -8.043 597 HG2 ARG 78 2HG ARG 78 -4.094 12.175 -7.774 598 HG3 ARG 78 1HG ARG 78 -5.015 13.325 -8.712 599 HD2 ARG 78 2HD ARG 78 -2.095 12.485 -9.296 600 HD3 ARG 78 1HD ARG 78 -3.532 11.840 -10.072 601 HH11 ARG 78 2HH1 ARG 78 -0.927 14.039 -9.681 602 HH12 ARG 78 1HH1 ARG 78 -0.223 15.117 -10.932 603 HH21 ARG 78 1HH2 ARG 78 -3.383 15.154 -12.471 604 HH22 ARG 78 2HH2 ARG 78 -1.625 15.765 -12.529 605 H ALA 79 H ALA 79 -0.754 11.928 -6.706 606 HA ALA 79 HA ALA 79 1.589 13.385 -7.993 607 HB1 ALA 79 3HB ALA 79 2.623 11.040 -7.690 608 HB2 ALA 79 1HB ALA 79 1.091 10.472 -7.018 609 HB3 ALA 79 2HB ALA 79 2.022 11.757 -6.176 610 H ALA 80 H ALA 80 2.203 13.117 -10.182 611 HA ALA 80 HA ALA 80 0.499 11.309 -11.990 612 HB1 ALA 80 3HB ALA 80 1.497 12.591 -13.899 613 HB2 ALA 80 1HB ALA 80 2.462 13.517 -12.751 614 HB3 ALA 80 2HB ALA 80 0.692 13.648 -12.713 615 H SER 81 H SER 81 3.728 11.121 -10.688 616 HA SER 81 HA SER 81 4.058 8.476 -12.088 617 HG SER 81 HG SER 81 7.500 9.104 -12.510 618 HB2 SER 81 2HB SER 81 5.267 10.215 -13.514 619 HB3 SER 81 1HB SER 81 6.224 10.711 -12.104 620 H VAL 82 H VAL 82 6.372 7.581 -11.029 621 HA VAL 82 HA VAL 82 6.006 7.544 -8.030 622 HB VAL 82 HB VAL 82 8.241 6.201 -9.650 623 HG11 VAL 82 1HG1 VAL 82 7.736 6.358 -6.626 624 HG12 VAL 82 2HG1 VAL 82 9.263 6.462 -7.514 625 HG13 VAL 82 3HG1 VAL 82 8.467 4.910 -7.334 626 HG21 VAL 82 3HG2 VAL 82 6.304 4.935 -10.168 627 HG22 VAL 82 1HG2 VAL 82 5.557 5.143 -8.558 628 HG23 VAL 82 2HG2 VAL 82 6.923 4.054 -8.770 629 H GLU 83 H GLU 83 8.889 8.673 -9.983 630 HA GLU 83 HA GLU 83 9.968 10.417 -8.155 631 HB2 GLU 83 2HB GLU 83 9.621 11.263 -11.074 632 HB3 GLU 83 1HB GLU 83 10.868 11.734 -9.945 633 HG2 GLU 83 2HG GLU 83 10.886 8.750 -10.305 634 HG3 GLU 83 1HG GLU 83 10.960 9.571 -11.839 635 H GLU 84 H GLU 84 6.864 11.316 -9.761 636 HA GLU 84 HA GLU 84 6.716 13.979 -8.356 637 HB2 GLU 84 2HB GLU 84 4.490 12.309 -9.640 638 HB3 GLU 84 1HB GLU 84 4.277 13.941 -9.027 639 HG2 GLU 84 2HG GLU 84 6.291 14.300 -11.043 640 HG3 GLU 84 1HG GLU 84 5.272 13.029 -11.695 641 H ALA 85 H ALA 85 5.931 10.739 -7.492 642 HA ALA 85 HA ALA 85 4.192 11.493 -5.127 643 HB1 ALA 85 3HB ALA 85 4.012 9.068 -4.716 644 HB2 ALA 85 1HB ALA 85 5.292 8.705 -5.869 645 HB3 ALA 85 2HB ALA 85 3.725 9.311 -6.454 646 H VAL 86 H VAL 86 7.574 10.614 -5.766 647 HA VAL 86 HA VAL 86 8.318 10.617 -2.824 648 HB VAL 86 HB VAL 86 9.891 10.191 -5.411 649 HG11 VAL 86 1HG1 VAL 86 11.438 11.581 -4.087 650 HG12 VAL 86 2HG1 VAL 86 11.986 9.901 -4.086 651 HG13 VAL 86 3HG1 VAL 86 11.174 10.573 -2.636 652 HG21 VAL 86 3HG2 VAL 86 10.481 7.991 -4.287 653 HG22 VAL 86 1HG2 VAL 86 8.722 8.163 -4.366 654 HG23 VAL 86 2HG2 VAL 86 9.575 8.477 -2.841 655 H ASP 87 H ASP 87 8.923 12.935 -5.591 656 HA ASP 87 HA ASP 87 9.840 15.053 -3.911 657 HB2 ASP 87 2HB ASP 87 8.775 14.865 -6.739 658 HB3 ASP 87 1HB ASP 87 8.521 16.422 -6.003 659 H ILE 88 H ILE 88 6.341 14.263 -4.414 660 HA ILE 88 HA ILE 88 5.713 16.681 -2.748 661 HB ILE 88 HB ILE 88 3.593 16.624 -2.703 662 HG12 ILE 88 2HG1 ILE 88 3.034 13.923 -4.033 663 HG13 ILE 88 1HG1 ILE 88 3.226 14.055 -2.308 664 HG21 ILE 88 1HG2 ILE 88 2.812 16.826 -5.012 665 HG22 ILE 88 2HG2 ILE 88 4.012 15.638 -5.583 666 HG23 ILE 88 3HG2 ILE 88 4.550 17.224 -5.013 667 HD11 ILE 88 3HD1 ILE 88 0.974 14.496 -2.285 668 HD12 ILE 88 1HD1 ILE 88 0.943 15.181 -3.922 669 HD13 ILE 88 2HD1 ILE 88 1.466 16.150 -2.527 670 H ALA 89 H ALA 89 5.999 13.245 -1.950 671 HA ALA 89 HA ALA 89 5.161 13.575 0.891 672 HB1 ALA 89 3HB ALA 89 6.971 11.495 -0.477 673 HB2 ALA 89 1HB ALA 89 5.251 11.324 -0.046 674 HB3 ALA 89 2HB ALA 89 6.469 11.444 1.228 675 H ALA 90 H ALA 90 8.424 13.777 -0.611 676 HA ALA 90 HA ALA 90 9.744 14.687 1.917 677 HB1 ALA 90 3HB ALA 90 11.682 15.136 0.278 678 HB2 ALA 90 1HB ALA 90 10.596 14.736 -1.061 679 HB3 ALA 90 2HB ALA 90 10.988 13.501 0.153 680 H SER 91 H SER 91 7.991 16.445 -0.461 681 HA SER 91 HA SER 91 8.977 19.209 0.279 682 HG SER 91 HG SER 91 8.469 17.790 -2.187 683 HB2 SER 91 2HB SER 91 6.436 18.283 -1.187 684 HB3 SER 91 1HB SER 91 6.978 19.965 -1.013 685 H LEU 92 H LEU 92 6.530 17.068 1.604 686 HA LEU 92 HA LEU 92 5.299 19.349 3.145 687 HG LEU 92 HG LEU 92 4.758 15.967 1.756 688 HB2 LEU 92 2HB LEU 92 3.446 17.854 3.801 689 HB3 LEU 92 1HB LEU 92 3.629 18.336 2.144 690 HD11 LEU 92 1HD1 LEU 92 3.904 14.177 3.190 691 HD12 LEU 92 2HD1 LEU 92 3.193 15.352 4.331 692 HD13 LEU 92 3HD1 LEU 92 4.953 15.238 4.102 693 HD21 LEU 92 3HD2 LEU 92 2.546 14.975 1.240 694 HD22 LEU 92 1HD2 LEU 92 2.555 16.668 0.750 695 HD23 LEU 92 2HD2 LEU 92 1.716 16.183 2.245 696 H ASP 93 H ASP 93 6.616 16.186 4.229 697 HA ASP 93 HA ASP 93 8.767 17.068 5.583 698 HB2 ASP 93 2HB ASP 93 6.536 17.752 7.530 699 HB3 ASP 93 1HB ASP 93 7.897 16.924 8.209 700 H ALA 94 H ALA 94 9.377 14.944 4.902 701 HA ALA 94 HA ALA 94 8.982 12.781 6.951 702 HB1 ALA 94 3HB ALA 94 7.840 11.149 5.448 703 HB2 ALA 94 1HB ALA 94 7.816 12.338 4.114 704 HB3 ALA 94 2HB ALA 94 6.866 12.612 5.588 705 H GLU 95 H GLU 95 10.523 11.214 7.000 706 HA GLU 95 HA GLU 95 12.685 11.155 4.882 707 HB2 GLU 95 2HB GLU 95 12.953 9.075 7.021 708 HB3 GLU 95 1HB GLU 95 14.135 9.957 6.080 709 HG2 GLU 95 2HG GLU 95 13.672 11.985 7.693 710 HG3 GLU 95 1HG GLU 95 12.723 10.844 8.650 711 H THR 96 H THR 96 10.216 8.853 6.124 712 HA THR 96 HA THR 96 10.533 7.176 3.586 713 HB THR 96 HB THR 96 9.077 5.409 4.890 714 HG1 THR 96 HG1 THR 96 8.751 6.810 6.796 715 HG21 THR 96 3HG2 THR 96 11.943 5.712 5.898 716 HG22 THR 96 1HG2 THR 96 11.531 5.072 4.279 717 HG23 THR 96 2HG2 THR 96 10.951 4.248 5.742 718 H ALA 97 H ALA 97 8.522 6.194 2.853 719 HA ALA 97 HA ALA 97 5.959 7.374 3.802 720 HB1 ALA 97 3HB ALA 97 5.122 7.894 1.372 721 HB2 ALA 97 1HB ALA 97 6.818 7.780 0.839 722 HB3 ALA 97 2HB ALA 97 6.344 8.992 2.044 723 H TYR 98 H TYR 98 4.066 6.178 2.749 724 HA TYR 98 HA TYR 98 4.753 3.270 2.132 725 HD1 TYR 98 HD1 TYR 98 4.779 1.026 4.326 726 HD2 TYR 98 HD2 TYR 98 4.454 5.007 5.819 727 HE1 TYR 98 HE1 TYR 98 6.605 0.570 5.928 728 HE2 TYR 98 HE2 TYR 98 6.222 4.526 7.478 729 HH TYR 98 HH TYR 98 7.756 3.144 8.118 730 HB2 TYR 98 2HB TYR 98 2.742 4.144 4.306 731 HB3 TYR 98 1HB TYR 98 2.865 2.505 3.696 732 H VAL 99 H VAL 99 2.659 2.010 1.559 733 HA VAL 99 HA VAL 99 0.798 3.649 -0.226 734 HB VAL 99 HB VAL 99 1.708 3.215 -2.152 735 HG11 VAL 99 1HG1 VAL 99 3.969 1.534 -1.080 736 HG12 VAL 99 2HG1 VAL 99 3.931 3.266 -1.234 737 HG13 VAL 99 3HG1 VAL 99 3.841 2.260 -2.679 738 HG21 VAL 99 3HG2 VAL 99 1.505 0.244 -1.859 739 HG22 VAL 99 1HG2 VAL 99 1.912 1.073 -3.375 740 HG23 VAL 99 2HG2 VAL 99 0.329 1.328 -2.587 741 H ILE 100 H ILE 100 -1.249 2.999 0.681 742 HA ILE 100 HA ILE 100 -1.763 0.199 1.246 743 HB ILE 100 HB ILE 100 -4.125 1.906 0.339 744 HG12 ILE 100 2HG1 ILE 100 -3.351 3.205 2.116 745 HG13 ILE 100 1HG1 ILE 100 -4.559 2.179 2.828 746 HG21 ILE 100 1HG2 ILE 100 -4.662 -0.554 0.505 747 HG22 ILE 100 2HG2 ILE 100 -5.463 0.342 1.801 748 HG23 ILE 100 3HG2 ILE 100 -3.999 -0.581 2.157 749 HD11 ILE 100 3HD1 ILE 100 -2.505 2.480 4.296 750 HD12 ILE 100 1HD1 ILE 100 -1.561 1.557 3.123 751 HD13 ILE 100 2HD1 ILE 100 -2.919 0.759 3.945 752 H GLY 101 H GLY 101 -2.702 1.645 -1.692 753 HA2 GLY 101 2HA GLY 101 -2.319 0.812 -3.886 754 HA3 GLY 101 1HA GLY 101 -1.510 -0.538 -3.291 755 H GLY 102 H GLY 102 -2.468 -2.208 -4.855 756 HA2 GLY 102 2HA GLY 102 -4.721 -0.386 -5.968 757 HA3 GLY 102 1HA GLY 102 -3.094 -0.330 -6.502 758 H ALA 103 H ALA 103 -6.042 -1.783 -7.287 759 HA ALA 103 HA ALA 103 -5.640 -3.074 -9.669 760 HB1 ALA 103 3HB ALA 103 -7.650 -1.606 -8.909 761 HB2 ALA 103 1HB ALA 103 -7.264 -1.261 -10.584 762 HB3 ALA 103 2HB ALA 103 -6.783 -0.146 -9.338 763 H ALA 104 H ALA 104 -4.413 0.275 -9.593 764 HA ALA 104 HA ALA 104 -2.397 -0.471 -11.784 765 HB1 ALA 104 3HB ALA 104 -3.305 2.364 -11.046 766 HB2 ALA 104 1HB ALA 104 -3.767 1.429 -12.497 767 HB3 ALA 104 2HB ALA 104 -2.076 1.934 -12.251 768 H ILE 105 H ILE 105 -2.647 0.559 -8.410 769 HA ILE 105 HA ILE 105 -0.087 1.959 -8.334 770 HB ILE 105 HB ILE 105 -1.324 0.969 -5.795 771 HG12 ILE 105 2HG1 ILE 105 -3.292 1.967 -6.698 772 HG13 ILE 105 1HG1 ILE 105 -2.596 3.078 -5.605 773 HG21 ILE 105 1HG2 ILE 105 0.202 3.573 -6.300 774 HG22 ILE 105 2HG2 ILE 105 0.894 2.111 -5.561 775 HG23 ILE 105 3HG2 ILE 105 -0.423 2.972 -4.764 776 HD11 ILE 105 3HD1 ILE 105 -2.654 4.665 -7.351 777 HD12 ILE 105 1HD1 ILE 105 -3.286 3.365 -8.421 778 HD13 ILE 105 2HD1 ILE 105 -1.537 3.688 -8.340 779 H TYR 106 H TYR 106 -0.653 -1.063 -6.372 780 HA TYR 106 HA TYR 106 2.145 -1.664 -5.979 781 HD1 TYR 106 HD1 TYR 106 2.935 -4.521 -4.806 782 HD2 TYR 106 HD2 TYR 106 -0.541 -2.426 -3.410 783 HE1 TYR 106 HE1 TYR 106 3.526 -5.066 -2.520 784 HE2 TYR 106 HE2 TYR 106 0.095 -2.919 -1.086 785 HH TYR 106 HH TYR 106 2.435 -3.717 0.187 786 HB2 TYR 106 2HB TYR 106 -0.428 -3.246 -5.729 787 HB3 TYR 106 1HB TYR 106 0.914 -4.229 -6.185 788 H ALA 107 H ALA 107 0.208 -2.800 -8.754 789 HA ALA 107 HA ALA 107 2.282 -4.239 -10.233 790 HB1 ALA 107 3HB ALA 107 0.625 -3.837 -12.121 791 HB2 ALA 107 1HB ALA 107 -0.222 -2.672 -11.099 792 HB3 ALA 107 2HB ALA 107 -0.159 -4.382 -10.622 793 H LEU 108 H LEU 108 1.429 -0.717 -10.542 794 HA LEU 108 HA LEU 108 3.822 -0.220 -12.272 795 HG LEU 108 HG LEU 108 2.381 2.184 -9.774 796 HB2 LEU 108 2HB LEU 108 3.040 1.817 -12.722 797 HB3 LEU 108 1HB LEU 108 1.535 1.158 -12.184 798 HD11 LEU 108 1HD1 LEU 108 3.659 4.246 -10.018 799 HD12 LEU 108 2HD1 LEU 108 3.557 4.230 -11.785 800 HD13 LEU 108 3HD1 LEU 108 4.586 3.066 -10.940 801 HD21 LEU 108 3HD2 LEU 108 1.050 3.798 -12.008 802 HD22 LEU 108 1HD2 LEU 108 1.139 4.291 -10.311 803 HD23 LEU 108 2HD2 LEU 108 0.224 2.838 -10.720 804 H PHE 109 H PHE 109 3.244 0.251 -8.786 805 HA PHE 109 HA PHE 109 5.883 1.384 -8.313 806 HD1 PHE 109 HD2 PHE 109 6.857 2.158 -5.805 807 HD2 PHE 109 HD1 PHE 109 2.717 2.753 -6.684 808 HE1 PHE 109 HE2 PHE 109 7.118 4.525 -5.333 809 HE2 PHE 109 HE1 PHE 109 2.979 5.159 -6.258 810 HZ PHE 109 HZ PHE 109 5.213 6.067 -5.598 811 HB2 PHE 109 2HB PHE 109 3.564 0.457 -6.554 812 HB3 PHE 109 1HB PHE 109 5.088 0.206 -5.796 813 H GLN 110 H GLN 110 5.044 -2.018 -8.352 814 HA GLN 110 HA GLN 110 6.868 -3.364 -6.877 815 HB2 GLN 110 2HB GLN 110 6.162 -3.911 -9.828 816 HB3 GLN 110 1HB GLN 110 7.208 -4.944 -8.942 817 HG2 GLN 110 2HG GLN 110 4.979 -4.813 -7.214 818 HG3 GLN 110 1HG GLN 110 4.254 -4.623 -8.790 819 HE21 GLN 110 1HE2 GLN 110 4.988 -6.340 -10.442 820 HE22 GLN 110 2HE2 GLN 110 4.966 -8.042 -9.730 821 HA PRO 111 HA PRO 111 11.137 -2.824 -9.083 822 HB2 PRO 111 2HB PRO 111 11.069 -0.632 -11.069 823 HB3 PRO 111 1HB PRO 111 11.502 -2.336 -11.271 824 HG2 PRO 111 2HG PRO 111 9.160 -1.229 -12.370 825 HG3 PRO 111 1HG PRO 111 9.349 -2.954 -11.950 826 HD2 PRO 111 2HD PRO 111 8.028 -0.768 -10.257 827 HD3 PRO 111 1HD PRO 111 7.424 -2.378 -10.671 828 H HIS 112 H HIS 112 9.288 -0.256 -7.816 829 HA HIS 112 HA HIS 112 11.711 1.583 -7.324 830 HD1 HIS 112 HD1 HIS 112 11.395 4.261 -9.232 831 HD2 HIS 112 HD2 HIS 112 8.032 1.729 -9.907 832 HE1 HIS 112 HE1 HIS 112 10.458 4.632 -11.631 833 HB2 HIS 112 2HB HIS 112 8.717 2.312 -7.326 834 HB3 HIS 112 1HB HIS 112 10.068 3.399 -7.109 835 H LEU 113 H LEU 113 9.440 -0.325 -5.417 836 HA LEU 113 HA LEU 113 9.457 1.356 -3.011 837 HG LEU 113 HG LEU 113 6.865 -1.211 -2.188 838 HB2 LEU 113 2HB LEU 113 9.218 -1.751 -3.258 839 HB3 LEU 113 1HB LEU 113 8.963 -0.871 -1.764 840 HD11 LEU 113 1HD1 LEU 113 7.231 1.322 -3.862 841 HD12 LEU 113 2HD1 LEU 113 6.938 1.259 -2.126 842 HD13 LEU 113 3HD1 LEU 113 5.653 0.784 -3.234 843 HD21 LEU 113 3HD2 LEU 113 5.739 -1.647 -4.261 844 HD22 LEU 113 1HD2 LEU 113 7.273 -2.517 -4.284 845 HD23 LEU 113 2HD2 LEU 113 7.117 -1.022 -5.230 846 H ASP 114 H ASP 114 10.664 1.376 -1.081 847 HA ASP 114 HA ASP 114 13.266 -0.081 -0.708 848 HB2 ASP 114 2HB ASP 114 12.949 1.980 0.444 849 HB3 ASP 114 1HB ASP 114 11.382 1.538 1.100 850 H ARG 115 H ARG 115 9.907 -0.726 0.502 851 HA ARG 115 HA ARG 115 10.507 -3.707 0.350 852 HE ARG 115 HE ARG 115 11.971 -1.660 3.773 853 HB2 ARG 115 2HB ARG 115 9.914 -2.140 2.898 854 HB3 ARG 115 1HB ARG 115 9.060 -3.663 2.763 855 HG2 ARG 115 2HG ARG 115 11.023 -4.990 2.682 856 HG3 ARG 115 1HG ARG 115 12.062 -3.649 2.253 857 HD2 ARG 115 2HD ARG 115 10.770 -4.031 5.046 858 HD3 ARG 115 1HD ARG 115 12.418 -4.452 4.517 859 HH11 ARG 115 2HH1 ARG 115 12.907 -3.642 6.481 860 HH12 ARG 115 1HH1 ARG 115 13.746 -2.193 7.238 861 HH21 ARG 115 1HH2 ARG 115 12.876 -0.254 4.549 862 HH22 ARG 115 2HH2 ARG 115 13.665 -0.233 6.208 863 H MET 116 H MET 116 8.791 -5.143 0.182 864 HA MET 116 HA MET 116 5.978 -3.979 -0.313 865 HB2 MET 116 2HB MET 116 7.389 -6.421 -1.481 866 HB3 MET 116 1HB MET 116 5.641 -6.228 -1.515 867 HG2 MET 116 2HG MET 116 5.909 -4.179 -2.957 868 HG3 MET 116 1HG MET 116 7.653 -4.170 -2.650 869 HE1 MET 116 3HE MET 116 5.478 -7.596 -4.889 870 HE2 MET 116 1HE MET 116 4.870 -5.933 -5.090 871 HE3 MET 116 2HE MET 116 4.840 -6.707 -3.486 872 H VAL 117 H VAL 117 5.428 -3.802 1.815 873 HA VAL 117 HA VAL 117 5.082 -6.138 3.652 874 HB VAL 117 HB VAL 117 4.256 -3.207 3.772 875 HG11 VAL 117 1HG1 VAL 117 2.488 -4.439 5.035 876 HG12 VAL 117 2HG1 VAL 117 3.484 -3.453 6.103 877 HG13 VAL 117 3HG1 VAL 117 3.734 -5.224 6.033 878 HG21 VAL 117 3HG2 VAL 117 6.238 -4.764 5.548 879 HG22 VAL 117 1HG2 VAL 117 5.928 -3.014 5.596 880 HG23 VAL 117 2HG2 VAL 117 6.698 -3.745 4.169 881 H LEU 118 H LEU 118 3.498 -7.562 3.583 882 HA LEU 118 HA LEU 118 0.785 -6.889 2.303 883 HG LEU 118 HG LEU 118 -0.132 -9.231 1.040 884 HB2 LEU 118 2HB LEU 118 2.026 -7.741 0.513 885 HB3 LEU 118 1HB LEU 118 2.885 -8.942 1.439 886 HD11 LEU 118 1HD1 LEU 118 2.100 -9.929 -1.021 887 HD12 LEU 118 2HD1 LEU 118 0.582 -9.001 -1.245 888 HD13 LEU 118 3HD1 LEU 118 0.496 -10.730 -1.001 889 HD21 LEU 118 3HD2 LEU 118 0.244 -11.533 1.366 890 HD22 LEU 118 1HD2 LEU 118 1.288 -10.805 2.599 891 HD23 LEU 118 2HD2 LEU 118 2.011 -11.440 1.094 892 H SER 119 H SER 119 -0.955 -7.723 3.276 893 HA SER 119 HA SER 119 -0.593 -9.674 5.640 894 HG SER 119 HG SER 119 -2.049 -6.619 6.565 895 HB2 SER 119 2HB SER 119 -2.876 -7.784 4.959 896 HB3 SER 119 1HB SER 119 -2.870 -8.860 6.304 897 H ARG 120 H ARG 120 -0.952 -11.721 5.294 898 HA ARG 120 HA ARG 120 -2.529 -12.723 2.912 899 HE ARG 120 HE ARG 120 0.032 -16.267 1.314 900 HB2 ARG 120 2HB ARG 120 -0.821 -14.166 5.015 901 HB3 ARG 120 1HB ARG 120 -1.709 -15.029 3.797 902 HG2 ARG 120 2HG ARG 120 0.487 -12.967 3.208 903 HG3 ARG 120 1HG ARG 120 0.766 -14.672 3.335 904 HD2 ARG 120 2HD ARG 120 -1.070 -13.393 1.179 905 HD3 ARG 120 1HD ARG 120 0.584 -13.862 0.945 906 HH11 ARG 120 2HH1 ARG 120 -2.825 -14.272 1.172 907 HH12 ARG 120 1HH1 ARG 120 -3.865 -15.647 0.636 908 HH21 ARG 120 1HH2 ARG 120 -1.137 -17.775 0.638 909 HH22 ARG 120 2HH2 ARG 120 -2.923 -17.570 0.330 910 H VAL 121 H VAL 121 -4.696 -12.486 3.359 911 HA VAL 121 HA VAL 121 -5.833 -13.282 5.955 912 HB VAL 121 HB VAL 121 -7.366 -12.217 3.569 913 HG11 VAL 121 1HG1 VAL 121 -7.993 -12.311 6.608 914 HG12 VAL 121 2HG1 VAL 121 -8.887 -13.111 5.298 915 HG13 VAL 121 3HG1 VAL 121 -8.925 -11.360 5.436 916 HG21 VAL 121 3HG2 VAL 121 -5.849 -10.412 3.913 917 HG22 VAL 121 1HG2 VAL 121 -5.650 -10.716 5.647 918 HG23 VAL 121 2HG2 VAL 121 -7.129 -9.962 5.018 919 HA PRO 122 HA PRO 122 -6.513 -17.593 4.589 920 HB2 PRO 122 2HB PRO 122 -8.408 -17.735 6.995 921 HB3 PRO 122 1HB PRO 122 -7.099 -18.851 6.515 922 HG2 PRO 122 2HG PRO 122 -6.630 -17.067 8.525 923 HG3 PRO 122 1HG PRO 122 -5.381 -17.276 7.274 924 HD2 PRO 122 2HD PRO 122 -7.494 -15.059 7.394 925 HD3 PRO 122 1HD PRO 122 -5.721 -14.963 7.157 926 H GLY 123 H GLY 123 -9.377 -15.626 4.843 927 HA2 GLY 123 2HA GLY 123 -10.486 -17.084 2.534 928 HA3 GLY 123 1HA GLY 123 -11.591 -17.244 3.890 929 H GLU 124 H GLU 124 -12.889 -15.464 4.227 930 HA GLU 124 HA GLU 124 -14.233 -13.551 3.506 931 HB2 GLU 124 2HB GLU 124 -11.472 -12.686 4.477 932 HB3 GLU 124 1HB GLU 124 -12.859 -11.619 4.430 933 HG2 GLU 124 2HG GLU 124 -14.085 -12.847 6.129 934 HG3 GLU 124 1HG GLU 124 -13.039 -14.257 5.986 935 H TYR 125 H TYR 125 -14.154 -14.270 1.224 936 HA TYR 125 HA TYR 125 -12.536 -12.575 -0.626 937 HD1 TYR 125 HD2 TYR 125 -15.009 -16.130 -0.044 938 HD2 TYR 125 HD1 TYR 125 -10.794 -15.774 -0.775 939 HE1 TYR 125 HE2 TYR 125 -14.612 -18.289 1.090 940 HE2 TYR 125 HE1 TYR 125 -10.433 -17.980 0.256 941 HH TYR 125 HH TYR 125 -11.446 -19.813 1.184 942 HB2 TYR 125 2HB TYR 125 -14.037 -14.721 -2.007 943 HB3 TYR 125 1HB TYR 125 -12.368 -14.336 -2.017 944 H GLU 126 H GLU 126 -13.236 -11.897 -2.781 945 HA GLU 126 HA GLU 126 -16.170 -11.274 -3.138 946 HB2 GLU 126 2HB GLU 126 -15.837 -8.873 -3.367 947 HB3 GLU 126 1HB GLU 126 -15.373 -9.465 -1.810 948 HG2 GLU 126 2HG GLU 126 -13.647 -7.945 -2.170 949 HG3 GLU 126 1HG GLU 126 -12.856 -9.386 -2.729 950 H GLY 127 H GLY 127 -13.746 -9.797 -5.130 951 HA2 GLY 127 2HA GLY 127 -13.212 -11.401 -7.340 952 HA3 GLY 127 1HA GLY 127 -14.951 -11.233 -7.541 953 H ASP 128 H ASP 128 -13.724 -8.169 -6.554 954 HA ASP 128 HA ASP 128 -13.587 -7.255 -9.462 955 HB2 ASP 128 2HB ASP 128 -14.343 -5.809 -6.871 956 HB3 ASP 128 1HB ASP 128 -13.986 -4.957 -8.359 957 H THR 129 H THR 129 -11.553 -6.655 -6.460 958 HA THR 129 HA THR 129 -9.611 -5.219 -8.351 959 HB THR 129 HB THR 129 -9.575 -4.914 -5.334 960 HG1 THR 129 HG1 THR 129 -11.419 -4.042 -5.827 961 HG21 THR 129 3HG2 THR 129 -8.593 -3.026 -7.566 962 HG22 THR 129 1HG2 THR 129 -7.489 -4.015 -6.539 963 HG23 THR 129 2HG2 THR 129 -8.494 -2.756 -5.803 964 H TYR 130 H TYR 130 -7.981 -6.456 -8.969 965 HA TYR 130 HA TYR 130 -6.727 -8.578 -7.271 966 HD1 TYR 130 HD1 TYR 130 -9.235 -7.893 -10.172 967 HD2 TYR 130 HD2 TYR 130 -7.032 -11.361 -8.890 968 HE1 TYR 130 HE1 TYR 130 -11.247 -9.276 -10.424 969 HE2 TYR 130 HE2 TYR 130 -9.036 -12.748 -9.249 970 HH TYR 130 HH TYR 130 -11.560 -12.335 -9.234 971 HB2 TYR 130 2HB TYR 130 -6.606 -7.983 -10.281 972 HB3 TYR 130 1HB TYR 130 -5.801 -9.326 -9.526 973 H TYR 131 H TYR 131 -4.801 -8.650 -6.466 974 HA TYR 131 HA TYR 131 -2.695 -6.549 -6.822 975 HD1 TYR 131 HD2 TYR 131 -0.371 -9.590 -5.583 976 HD2 TYR 131 HD1 TYR 131 -1.876 -6.335 -3.262 977 HE1 TYR 131 HE2 TYR 131 1.851 -9.277 -4.613 978 HE2 TYR 131 HE1 TYR 131 0.304 -6.162 -2.137 979 HH TYR 131 HH TYR 131 2.938 -8.383 -2.904 980 HB2 TYR 131 2HB TYR 131 -3.404 -7.603 -4.637 981 HB3 TYR 131 1HB TYR 131 -2.917 -9.165 -5.130 982 HA PRO 132 HA PRO 132 -0.232 -8.815 -9.951 983 HB2 PRO 132 2HB PRO 132 2.234 -7.665 -9.761 984 HB3 PRO 132 1HB PRO 132 0.798 -6.709 -10.197 985 HG2 PRO 132 2HG PRO 132 1.883 -7.148 -7.325 986 HG3 PRO 132 1HG PRO 132 1.793 -5.575 -8.149 987 HD2 PRO 132 2HD PRO 132 -0.298 -6.291 -6.599 988 HD3 PRO 132 1HD PRO 132 -0.686 -5.703 -8.248 989 H GLU 133 H GLU 133 1.665 -10.137 -10.349 990 HA GLU 133 HA GLU 133 2.070 -12.378 -8.512 991 HB2 GLU 133 2HB GLU 133 3.664 -13.137 -10.271 992 HB3 GLU 133 1HB GLU 133 2.068 -12.771 -10.866 993 HG2 GLU 133 2HG GLU 133 4.407 -10.752 -11.182 994 HG3 GLU 133 1HG GLU 133 4.106 -12.036 -12.347 995 H TRP 134 H TRP 134 3.845 -13.054 -7.403 996 HA TRP 134 HA TRP 134 5.947 -10.978 -6.600 997 HD1 TRP 134 HD1 TRP 134 5.483 -15.216 -5.402 998 HE1 TRP 134 HE1 TRP 134 3.316 -16.626 -4.830 999 HE3 TRP 134 HE3 TRP 134 2.729 -11.329 -3.592 1000 HZ2 TRP 134 HZ2 TRP 134 0.753 -15.921 -3.828 1001 HZ3 TRP 134 HZ3 TRP 134 0.379 -11.733 -2.947 1002 HH2 TRP 134 HH2 TRP 134 -0.585 -14.004 -3.016 1003 HB2 TRP 134 2HB TRP 134 6.237 -12.351 -4.449 1004 HB3 TRP 134 1HB TRP 134 4.829 -11.358 -4.608 1005 H ASP 135 H ASP 135 8.087 -11.378 -6.982 1006 HA ASP 135 HA ASP 135 8.832 -14.082 -8.181 1007 HB2 ASP 135 2HB ASP 135 8.830 -11.674 -9.506 1008 HB3 ASP 135 1HB ASP 135 10.390 -11.509 -8.711 1009 H ALA 136 H ALA 136 11.390 -14.060 -8.182 1010 HA ALA 136 HA ALA 136 12.283 -14.040 -5.197 1011 HB1 ALA 136 3HB ALA 136 13.087 -16.073 -7.402 1012 HB2 ALA 136 1HB ALA 136 11.763 -16.329 -6.224 1013 HB3 ALA 136 2HB ALA 136 13.448 -16.172 -5.651 1014 H ALA 137 H ALA 137 13.389 -13.157 -8.356 1015 HA ALA 137 HA ALA 137 16.016 -12.170 -7.084 1016 HB1 ALA 137 3HB ALA 137 16.481 -13.775 -8.894 1017 HB2 ALA 137 1HB ALA 137 17.034 -12.144 -9.356 1018 HB3 ALA 137 2HB ALA 137 15.544 -12.808 -10.070 1019 H GLU 138 H GLU 138 13.080 -10.931 -7.989 1020 HA GLU 138 HA GLU 138 14.230 -8.110 -8.207 1021 HB2 GLU 138 2HB GLU 138 11.422 -9.242 -8.614 1022 HB3 GLU 138 1HB GLU 138 11.657 -7.608 -8.145 1023 HG2 GLU 138 2HG GLU 138 12.750 -8.756 -10.755 1024 HG3 GLU 138 1HG GLU 138 11.322 -7.800 -10.546 1025 H TRP 139 H TRP 139 12.090 -9.985 -5.946 1026 HA TRP 139 HA TRP 139 13.244 -8.383 -3.618 1027 HD1 TRP 139 HD1 TRP 139 8.983 -10.277 -4.070 1028 HE1 TRP 139 HE1 TRP 139 7.420 -9.850 -6.221 1029 HE3 TRP 139 HE3 TRP 139 11.102 -5.917 -5.524 1030 HZ2 TRP 139 HZ2 TRP 139 7.746 -8.180 -8.456 1031 HZ3 TRP 139 HZ3 TRP 139 10.489 -4.993 -7.773 1032 HH2 TRP 139 HH2 TRP 139 8.962 -6.162 -9.231 1033 HB2 TRP 139 2HB TRP 139 10.756 -8.500 -2.614 1034 HB3 TRP 139 1HB TRP 139 11.365 -7.175 -3.541 1035 H GLU 140 H GLU 140 13.598 -9.372 -1.774 1036 HA GLU 140 HA GLU 140 12.912 -12.347 -1.516 1037 HB2 GLU 140 2HB GLU 140 14.946 -12.812 -0.649 1038 HB3 GLU 140 1HB GLU 140 15.395 -11.551 -1.755 1039 HG2 GLU 140 2HG GLU 140 15.374 -9.943 0.386 1040 HG3 GLU 140 1HG GLU 140 15.202 -11.420 1.336 1041 H LEU 141 H LEU 141 13.281 -12.624 1.285 1042 HA LEU 141 HA LEU 141 10.692 -11.289 2.240 1043 HG LEU 141 HG LEU 141 9.482 -14.519 3.667 1044 HB2 LEU 141 2HB LEU 141 11.126 -13.972 1.916 1045 HB3 LEU 141 1HB LEU 141 11.740 -13.807 3.530 1046 HD11 LEU 141 1HD1 LEU 141 9.188 -11.518 4.223 1047 HD12 LEU 141 2HD1 LEU 141 9.872 -12.680 5.352 1048 HD13 LEU 141 3HD1 LEU 141 8.169 -12.811 4.854 1049 HD21 LEU 141 3HD2 LEU 141 8.826 -13.948 1.288 1050 HD22 LEU 141 1HD2 LEU 141 8.514 -12.277 1.789 1051 HD23 LEU 141 2HD2 LEU 141 7.565 -13.611 2.475 1052 H ASP 142 H ASP 142 11.020 -9.750 3.769 1053 HA ASP 142 HA ASP 142 13.588 -9.468 5.335 1054 HB2 ASP 142 2HB ASP 142 12.364 -7.569 4.067 1055 HB3 ASP 142 1HB ASP 142 11.144 -7.607 5.295 1056 H ALA 143 H ALA 143 10.041 -9.642 6.111 1057 HA ALA 143 HA ALA 143 10.676 -11.308 8.569 1058 HB1 ALA 143 3HB ALA 143 9.491 -9.678 10.097 1059 HB2 ALA 143 1HB ALA 143 9.190 -8.585 8.717 1060 HB3 ALA 143 2HB ALA 143 10.853 -8.878 9.271 1061 H GLU 144 H GLU 144 9.230 -12.876 8.907 1062 HA GLU 144 HA GLU 144 6.321 -12.509 7.998 1063 HB2 GLU 144 2HB GLU 144 7.813 -14.142 6.722 1064 HB3 GLU 144 1HB GLU 144 7.776 -15.202 8.134 1065 HG2 GLU 144 2HG GLU 144 5.254 -15.346 7.958 1066 HG3 GLU 144 1HG GLU 144 5.266 -14.131 6.680 1067 H THR 145 H THR 145 4.934 -12.220 9.598 1068 HA THR 145 HA THR 145 5.073 -14.015 12.031 1069 HB THR 145 HB THR 145 6.228 -12.034 12.820 1070 HG1 THR 145 HG1 THR 145 3.682 -12.592 13.936 1071 HG21 THR 145 3HG2 THR 145 4.707 -10.039 13.609 1072 HG22 THR 145 1HG2 THR 145 3.665 -10.443 12.210 1073 HG23 THR 145 2HG2 THR 145 5.369 -9.988 11.983 1074 H ASP 146 H ASP 146 3.161 -14.949 12.549 1075 HA ASP 146 HA ASP 146 0.607 -14.407 11.612 1076 HB2 ASP 146 2HB ASP 146 1.441 -15.427 14.404 1077 HB3 ASP 146 1HB ASP 146 -0.197 -15.540 13.768 1078 H HIS 147 H HIS 147 -1.134 -13.158 12.069 1079 HA HIS 147 HA HIS 147 -1.175 -11.208 14.433 1080 HD1 HIS 147 HD1 HIS 147 1.313 -10.520 13.457 1081 HD2 HIS 147 HD2 HIS 147 -1.305 -7.300 12.528 1082 HE1 HIS 147 HE1 HIS 147 2.525 -8.246 13.808 1083 HB2 HIS 147 2HB HIS 147 -1.159 -10.575 11.422 1084 HB3 HIS 147 1HB HIS 147 -2.337 -9.721 12.341 1085 H GLU 148 H GLU 148 -3.501 -10.059 14.380 1086 HA GLU 148 HA GLU 148 -5.503 -12.248 14.817 1087 HB2 GLU 148 2HB GLU 148 -6.252 -9.304 14.745 1088 HB3 GLU 148 1HB GLU 148 -7.131 -10.611 15.476 1089 HG2 GLU 148 2HG GLU 148 -5.635 -10.730 17.414 1090 HG3 GLU 148 1HG GLU 148 -4.414 -9.728 16.618 1091 H GLY 149 H GLY 149 -6.321 -13.161 13.029 1092 HA2 GLY 149 2HA GLY 149 -8.124 -13.145 11.162 1093 HA3 GLY 149 1HA GLY 149 -7.712 -11.509 10.820 1094 H PHE 150 H PHE 150 -4.636 -12.418 10.984 1095 HA PHE 150 HA PHE 150 -4.373 -13.695 8.265 1096 HD1 PHE 150 HD1 PHE 150 -1.704 -10.448 8.120 1097 HD2 PHE 150 HD2 PHE 150 -5.707 -9.700 9.430 1098 HE1 PHE 150 HE1 PHE 150 -0.951 -8.380 9.243 1099 HE2 PHE 150 HE2 PHE 150 -4.946 -7.725 10.652 1100 HZ PHE 150 HZ PHE 150 -2.568 -7.050 10.582 1101 HB2 PHE 150 2HB PHE 150 -3.749 -11.644 7.078 1102 HB3 PHE 150 1HB PHE 150 -5.304 -11.434 7.794 1103 H THR 151 H THR 151 -2.218 -13.599 7.320 1104 HA THR 151 HA THR 151 -0.005 -13.479 9.438 1105 HB THR 151 HB THR 151 1.193 -15.105 8.622 1106 HG1 THR 151 HG1 THR 151 1.919 -14.486 6.749 1107 HG21 THR 151 3HG2 THR 151 0.036 -17.020 7.738 1108 HG22 THR 151 1HG2 THR 151 -1.198 -16.018 6.931 1109 HG23 THR 151 2HG2 THR 151 -1.174 -16.161 8.705 1110 H LEU 152 H LEU 152 1.295 -11.836 9.468 1111 HA LEU 152 HA LEU 152 1.385 -9.672 7.371 1112 HG LEU 152 HG LEU 152 3.082 -7.648 10.188 1113 HB2 LEU 152 2HB LEU 152 1.294 -9.012 9.684 1114 HB3 LEU 152 1HB LEU 152 2.580 -10.082 10.149 1115 HD11 LEU 152 1HD1 LEU 152 5.385 -7.908 9.691 1116 HD12 LEU 152 2HD1 LEU 152 5.098 -8.917 8.265 1117 HD13 LEU 152 3HD1 LEU 152 4.884 -9.602 9.871 1118 HD21 LEU 152 3HD2 LEU 152 3.656 -6.414 8.118 1119 HD22 LEU 152 1HD2 LEU 152 1.957 -6.919 8.079 1120 HD23 LEU 152 2HD2 LEU 152 3.159 -7.776 7.100 1121 H GLN 153 H GLN 153 2.652 -9.912 5.651 1122 HA GLN 153 HA GLN 153 5.473 -11.175 5.858 1123 HB2 GLN 153 2HB GLN 153 3.328 -11.199 3.734 1124 HB3 GLN 153 1HB GLN 153 4.865 -10.677 3.096 1125 HG2 GLN 153 2HG GLN 153 5.993 -12.784 3.884 1126 HG3 GLN 153 1HG GLN 153 4.504 -13.331 4.645 1127 HE21 GLN 153 1HE2 GLN 153 2.654 -12.896 2.799 1128 HE22 GLN 153 2HE2 GLN 153 3.103 -13.754 1.231 1129 H GLU 154 H GLU 154 7.161 -9.813 5.724 1130 HA GLU 154 HA GLU 154 6.889 -7.058 4.356 1131 HB2 GLU 154 2HB GLU 154 9.136 -7.785 6.298 1132 HB3 GLU 154 1HB GLU 154 8.744 -6.241 5.610 1133 HG2 GLU 154 2HG GLU 154 6.424 -6.508 6.866 1134 HG3 GLU 154 1HG GLU 154 7.185 -7.790 7.743 1135 H TRP 155 H TRP 155 7.691 -7.160 2.279 1136 HA TRP 155 HA TRP 155 9.935 -9.111 1.584 1137 HD1 TRP 155 HD1 TRP 155 5.839 -9.239 1.104 1138 HE1 TRP 155 HE1 TRP 155 4.946 -11.644 0.445 1139 HE3 TRP 155 HE3 TRP 155 9.940 -10.685 -1.560 1140 HZ2 TRP 155 HZ2 TRP 155 5.883 -13.625 -1.330 1141 HZ3 TRP 155 HZ3 TRP 155 9.876 -12.855 -2.757 1142 HH2 TRP 155 HH2 TRP 155 7.868 -14.281 -2.665 1143 HB2 TRP 155 2HB TRP 155 7.782 -7.699 -0.017 1144 HB3 TRP 155 1HB TRP 155 9.087 -8.494 -0.847 1145 H VAL 156 H VAL 156 12.050 -8.212 1.643 1146 HA VAL 156 HA VAL 156 12.430 -5.334 0.809 1147 HB VAL 156 HB VAL 156 13.437 -6.086 2.911 1148 HG11 VAL 156 1HG1 VAL 156 14.217 -8.380 2.343 1149 HG12 VAL 156 2HG1 VAL 156 15.584 -7.405 2.930 1150 HG13 VAL 156 3HG1 VAL 156 15.392 -7.730 1.184 1151 HG21 VAL 156 3HG2 VAL 156 15.608 -5.055 1.010 1152 HG22 VAL 156 1HG2 VAL 156 15.498 -4.855 2.783 1153 HG23 VAL 156 2HG2 VAL 156 14.340 -4.035 1.724 1154 H ARG 157 H ARG 157 13.433 -4.496 -0.889 1155 HA ARG 157 HA ARG 157 13.803 -6.024 -3.354 1156 HE ARG 157 HE ARG 157 14.741 -1.925 -6.215 1157 HB2 ARG 157 2HB ARG 157 14.496 -3.141 -2.549 1158 HB3 ARG 157 1HB ARG 157 15.143 -3.777 -4.047 1159 HG2 ARG 157 2HG ARG 157 12.659 -4.555 -4.592 1160 HG3 ARG 157 1HG ARG 157 12.197 -3.477 -3.286 1161 HD2 ARG 157 2HD ARG 157 11.997 -2.186 -5.372 1162 HD3 ARG 157 1HD ARG 157 13.367 -1.563 -4.467 1163 HH11 ARG 157 2HH1 ARG 157 12.087 -4.125 -6.734 1164 HH12 ARG 157 1HH1 ARG 157 12.920 -4.908 -8.161 1165 HH21 ARG 157 1HH2 ARG 157 15.650 -2.990 -7.658 1166 HH22 ARG 157 2HH2 ARG 157 14.756 -4.274 -8.666 1167 H SER 158 H SER 158 15.326 -6.716 -4.525 1168 HA SER 158 HA SER 158 17.157 -8.367 -3.873 1169 HG SER 158 HG SER 158 18.237 -5.710 -5.715 1170 HB2 SER 158 2HB SER 158 18.260 -8.256 -6.051 1171 HB3 SER 158 1HB SER 158 16.566 -7.884 -6.218 1172 H ALA 159 H ALA 159 18.564 -8.280 -2.115 1173 HA ALA 159 HA ALA 159 20.776 -6.212 -2.073 1174 HB1 ALA 159 3HB ALA 159 20.974 -6.762 0.256 1175 HB2 ALA 159 1HB ALA 159 19.987 -8.235 0.092 1176 HB3 ALA 159 2HB ALA 159 19.233 -6.637 -0.122 1177 H SER 160 H SER 160 22.376 -6.827 -3.454 1178 HA SER 160 HA SER 160 24.651 -7.580 -3.630 1179 HG SER 160 HG SER 160 24.228 -8.390 -0.617 1180 HB2 SER 160 2HB SER 160 24.077 -10.084 -1.984 1181 HB3 SER 160 1HB SER 160 25.625 -9.653 -2.700 1182 H SER 161 H SER 161 25.593 -8.633 -5.315 1183 HA SER 161 HA SER 161 25.824 -9.782 -7.350 1184 HG SER 161 HG SER 161 25.455 -11.808 -4.847 1185 HB2 SER 161 2HB SER 161 23.900 -11.897 -6.316 1186 HB3 SER 161 1HB SER 161 25.093 -12.077 -7.610 1187 H ARG 162 H ARG 162 24.972 -8.178 -8.652 1188 HA ARG 162 HA ARG 162 22.351 -8.906 -10.051 1189 HE ARG 162 HE ARG 162 18.292 -5.815 -10.028 1190 HB2 ARG 162 1HB ARG 162 22.165 -7.097 -8.153 1191 HB3 ARG 162 2HB ARG 162 23.051 -6.021 -9.226 1192 HG2 ARG 162 1HG ARG 162 21.184 -6.158 -10.924 1193 HG3 ARG 162 2HG ARG 162 20.398 -7.453 -9.996 1194 HD2 ARG 162 1HD ARG 162 20.118 -5.887 -8.009 1195 HD3 ARG 162 2HD ARG 162 20.924 -4.617 -8.919 1196 HH11 ARG 162 2HH1 ARG 162 19.765 -3.035 -8.427 1197 HH12 ARG 162 1HH1 ARG 162 18.458 -1.966 -9.111 1198 HH21 ARG 162 1HH2 ARG 162 16.886 -4.426 -10.847 1199 HH22 ARG 162 2HH2 ARG 162 17.028 -2.690 -10.345 Start of MODEL 7 1 HA MET 1 HA MET 1 16.333 4.573 1.470 2 H1 MET 1 1H MET 1 16.037 6.875 2.521 3 H2 MET 1 2H MET 1 15.513 6.117 3.844 4 HB2 MET 1 1HB MET 1 14.277 4.031 3.688 5 HB3 MET 1 2HB MET 1 14.575 2.963 2.346 6 HG2 MET 1 1HG MET 1 17.063 2.816 3.113 7 HG3 MET 1 2HG MET 1 16.522 3.547 4.634 8 HE1 MET 1 3HE MET 1 14.969 2.365 6.356 9 HE2 MET 1 1HE MET 1 16.572 1.561 6.444 10 HE3 MET 1 2HE MET 1 15.067 0.588 6.514 11 H GLU 2 H GLU 2 13.634 3.660 0.892 12 HA GLU 2 HA GLU 2 12.076 6.098 0.158 13 HB2 GLU 2 2HB GLU 2 11.944 5.837 -2.207 14 HB3 GLU 2 1HB GLU 2 13.625 5.902 -1.746 15 HG2 GLU 2 2HG GLU 2 13.687 3.305 -1.983 16 HG3 GLU 2 1HG GLU 2 12.062 3.382 -2.679 17 H LEU 3 H LEU 3 10.337 4.411 -1.664 18 HA LEU 3 HA LEU 3 8.515 4.065 0.671 19 HG LEU 3 HG LEU 3 8.820 6.066 -2.295 20 HB2 LEU 3 2HB LEU 3 6.623 4.196 -1.231 21 HB3 LEU 3 1HB LEU 3 7.379 5.525 -0.445 22 HD11 LEU 3 1HD1 LEU 3 8.589 4.833 -4.526 23 HD12 LEU 3 2HD1 LEU 3 7.647 3.547 -3.703 24 HD13 LEU 3 3HD1 LEU 3 9.332 3.846 -3.280 25 HD21 LEU 3 3HD2 LEU 3 6.863 6.547 -3.994 26 HD22 LEU 3 1HD2 LEU 3 6.723 7.168 -2.330 27 HD23 LEU 3 2HD2 LEU 3 5.818 5.720 -2.808 28 H VAL 4 H VAL 4 6.901 2.650 1.003 29 HA VAL 4 HA VAL 4 7.389 -0.199 0.009 30 HB VAL 4 HB VAL 4 7.129 0.881 2.847 31 HG11 VAL 4 1HG1 VAL 4 7.513 -2.031 1.947 32 HG12 VAL 4 2HG1 VAL 4 6.164 -1.393 2.870 33 HG13 VAL 4 3HG1 VAL 4 7.783 -1.507 3.615 34 HG21 VAL 4 3HG2 VAL 4 9.475 0.061 3.211 35 HG22 VAL 4 1HG2 VAL 4 9.325 1.445 2.136 36 HG23 VAL 4 2HG2 VAL 4 9.641 -0.140 1.439 37 H SER 5 H SER 5 5.624 -1.447 -0.465 38 HA SER 5 HA SER 5 2.915 -0.135 -0.185 39 HG SER 5 HG SER 5 4.028 -2.906 -2.966 40 HB2 SER 5 2HB SER 5 2.429 -1.581 -2.159 41 HB3 SER 5 1HB SER 5 3.856 -0.650 -2.388 42 H VAL 6 H VAL 6 1.121 -0.843 0.818 43 HA VAL 6 HA VAL 6 1.267 -3.477 2.292 44 HB VAL 6 HB VAL 6 1.404 -2.725 4.329 45 HG11 VAL 6 1HG1 VAL 6 2.245 0.056 3.320 46 HG12 VAL 6 2HG1 VAL 6 3.302 -1.352 3.199 47 HG13 VAL 6 3HG1 VAL 6 2.771 -0.783 4.799 48 HG21 VAL 6 3HG2 VAL 6 -0.835 -1.618 4.560 49 HG22 VAL 6 1HG2 VAL 6 -0.107 -0.126 3.924 50 HG23 VAL 6 2HG2 VAL 6 0.440 -0.768 5.467 51 H ALA 7 H ALA 7 -0.302 -4.668 1.458 52 HA ALA 7 HA ALA 7 -3.186 -3.630 1.673 53 HB1 ALA 7 3HB ALA 7 -3.737 -4.669 -0.574 54 HB2 ALA 7 1HB ALA 7 -2.000 -5.002 -0.835 55 HB3 ALA 7 2HB ALA 7 -2.585 -3.336 -0.714 56 H ALA 8 H ALA 8 -4.580 -5.081 2.588 57 HA ALA 8 HA ALA 8 -3.654 -7.876 3.106 58 HB1 ALA 8 3HB ALA 8 -4.208 -6.503 5.003 59 HB2 ALA 8 1HB ALA 8 -5.433 -7.766 4.902 60 HB3 ALA 8 2HB ALA 8 -5.811 -6.115 4.408 61 H LEU 9 H LEU 9 -4.288 -9.601 2.003 62 HA LEU 9 HA LEU 9 -6.861 -9.613 0.385 63 HG LEU 9 HG LEU 9 -3.455 -9.650 -2.249 64 HB2 LEU 9 2HB LEU 9 -5.596 -10.189 -1.679 65 HB3 LEU 9 1HB LEU 9 -5.352 -8.603 -1.076 66 HD11 LEU 9 1HD1 LEU 9 -3.154 -7.610 -0.833 67 HD12 LEU 9 2HD1 LEU 9 -1.706 -8.604 -0.752 68 HD13 LEU 9 3HD1 LEU 9 -2.835 -8.638 0.582 69 HD21 LEU 9 3HD2 LEU 9 -2.898 -11.261 0.301 70 HD22 LEU 9 1HD2 LEU 9 -1.894 -11.203 -1.153 71 HD23 LEU 9 2HD2 LEU 9 -3.507 -11.951 -1.242 72 H ALA 10 H ALA 10 -7.699 -11.463 -0.493 73 HA ALA 10 HA ALA 10 -6.985 -14.021 0.993 74 HB1 ALA 10 3HB ALA 10 -9.581 -13.175 -0.519 75 HB2 ALA 10 1HB ALA 10 -9.227 -12.811 1.180 76 HB3 ALA 10 2HB ALA 10 -9.408 -14.486 0.658 77 H GLU 11 H GLU 11 -8.543 -15.798 -0.776 78 HA GLU 11 HA GLU 11 -6.361 -16.760 -2.513 79 HB2 GLU 11 2HB GLU 11 -7.835 -18.366 -1.402 80 HB3 GLU 11 1HB GLU 11 -9.249 -17.767 -2.256 81 HG2 GLU 11 2HG GLU 11 -8.319 -18.585 -4.440 82 HG3 GLU 11 1HG GLU 11 -6.850 -19.176 -3.644 83 H ASN 12 H ASN 12 -6.724 -17.260 -4.838 84 HA ASN 12 HA ASN 12 -6.058 -16.085 -6.781 85 HB2 ASN 12 2HB ASN 12 -9.002 -15.707 -6.415 86 HB3 ASN 12 1HB ASN 12 -8.362 -14.348 -7.237 87 HD21 ASN 12 1HD2 ASN 12 -9.289 -17.597 -7.594 88 HD22 ASN 12 2HD2 ASN 12 -8.821 -17.685 -9.372 89 H ARG 13 H ARG 13 -5.535 -14.580 -4.181 90 HA ARG 13 HA ARG 13 -4.681 -12.618 -3.396 91 HE ARG 13 HE ARG 13 -0.199 -13.778 -6.125 92 HB2 ARG 13 2HB ARG 13 -2.852 -11.533 -4.417 93 HB3 ARG 13 1HB ARG 13 -2.735 -13.275 -4.600 94 HG2 ARG 13 2HG ARG 13 -3.549 -12.982 -7.060 95 HG3 ARG 13 1HG ARG 13 -3.463 -11.251 -6.814 96 HD2 ARG 13 2HD ARG 13 -1.371 -11.698 -7.832 97 HD3 ARG 13 1HD ARG 13 -0.940 -11.577 -6.163 98 HH11 ARG 13 2HH1 ARG 13 -2.424 -13.533 -8.776 99 HH12 ARG 13 1HH1 ARG 13 -1.841 -15.058 -9.569 100 HH21 ARG 13 1HH2 ARG 13 0.483 -15.490 -7.043 101 HH22 ARG 13 2HH2 ARG 13 -0.254 -16.120 -8.594 102 H VAL 14 H VAL 14 -6.968 -12.275 -3.402 103 HA VAL 14 HA VAL 14 -7.967 -9.881 -4.977 104 HB VAL 14 HB VAL 14 -9.238 -12.087 -3.275 105 HG11 VAL 14 1HG1 VAL 14 -10.866 -9.566 -3.985 106 HG12 VAL 14 2HG1 VAL 14 -10.443 -10.118 -2.345 107 HG13 VAL 14 3HG1 VAL 14 -11.473 -11.126 -3.348 108 HG21 VAL 14 3HG2 VAL 14 -9.917 -10.880 -6.056 109 HG22 VAL 14 1HG2 VAL 14 -10.656 -12.341 -5.331 110 HG23 VAL 14 2HG2 VAL 14 -8.930 -12.338 -5.787 111 H ILE 15 H ILE 15 -7.478 -7.909 -4.215 112 HA ILE 15 HA ILE 15 -6.882 -7.215 -1.379 113 HB ILE 15 HB ILE 15 -7.784 -5.201 -3.483 114 HG12 ILE 15 2HG1 ILE 15 -4.805 -5.288 -2.926 115 HG13 ILE 15 1HG1 ILE 15 -5.376 -6.731 -3.694 116 HG21 ILE 15 1HG2 ILE 15 -6.387 -3.565 -2.046 117 HG22 ILE 15 2HG2 ILE 15 -6.177 -4.863 -0.854 118 HG23 ILE 15 3HG2 ILE 15 -7.799 -4.223 -1.188 119 HD11 ILE 15 3HD1 ILE 15 -6.313 -5.492 -5.629 120 HD12 ILE 15 1HD1 ILE 15 -4.626 -5.026 -5.395 121 HD13 ILE 15 2HD1 ILE 15 -5.917 -3.928 -4.885 122 H GLY 16 H GLY 16 -9.845 -6.751 -3.264 123 HA2 GLY 16 2HA GLY 16 -11.574 -7.754 -1.288 124 HA3 GLY 16 1HA GLY 16 -11.480 -6.039 -0.841 125 H ARG 17 H ARG 17 -13.548 -5.637 -1.199 126 HA ARG 17 HA ARG 17 -14.806 -6.378 -3.881 127 HE ARG 17 HE ARG 17 -20.192 -7.253 -2.262 128 HB2 ARG 17 2HB ARG 17 -15.463 -7.669 -1.858 129 HB3 ARG 17 1HB ARG 17 -16.126 -6.218 -1.103 130 HG2 ARG 17 2HG ARG 17 -17.747 -5.948 -2.945 131 HG3 ARG 17 1HG ARG 17 -17.007 -7.261 -3.862 132 HD2 ARG 17 2HD ARG 17 -17.739 -8.953 -2.101 133 HD3 ARG 17 1HD ARG 17 -18.220 -7.678 -1.028 134 HH11 ARG 17 2HH1 ARG 17 -18.113 -9.082 -4.272 135 HH12 ARG 17 1HH1 ARG 17 -19.039 -8.756 -5.742 136 HH21 ARG 17 1HH2 ARG 17 -21.371 -7.065 -3.875 137 HH22 ARG 17 2HH2 ARG 17 -21.032 -7.920 -5.469 138 H ASP 18 H ASP 18 -16.103 -3.951 -1.539 139 HA ASP 18 HA ASP 18 -17.092 -2.370 -3.780 140 HB2 ASP 18 2HB ASP 18 -17.044 -1.874 -0.751 141 HB3 ASP 18 1HB ASP 18 -17.648 -0.669 -1.871 142 H GLY 19 H GLY 19 -14.083 -1.888 -2.103 143 HA2 GLY 19 2HA GLY 19 -13.110 -0.343 -4.480 144 HA3 GLY 19 1HA GLY 19 -13.054 0.673 -3.048 145 H GLU 20 H GLU 20 -11.727 -0.098 -1.284 146 HA GLU 20 HA GLU 20 -9.346 -1.819 -2.113 147 HB2 GLU 20 2HB GLU 20 -8.110 -0.979 -0.296 148 HB3 GLU 20 1HB GLU 20 -8.785 0.283 -1.293 149 HG2 GLU 20 2HG GLU 20 -10.248 1.134 0.414 150 HG3 GLU 20 1HG GLU 20 -10.056 -0.264 1.457 151 H LEU 21 H LEU 21 -10.013 -1.897 1.179 152 HA LEU 21 HA LEU 21 -10.068 -4.827 1.240 153 HG LEU 21 HG LEU 21 -8.496 -2.206 2.583 154 HB2 LEU 21 2HB LEU 21 -10.719 -2.863 3.520 155 HB3 LEU 21 1HB LEU 21 -10.195 -4.524 3.720 156 HD11 LEU 21 1HD1 LEU 21 -8.216 -3.573 5.326 157 HD12 LEU 21 2HD1 LEU 21 -9.057 -2.022 5.040 158 HD13 LEU 21 3HD1 LEU 21 -7.320 -2.169 4.706 159 HD21 LEU 21 3HD2 LEU 21 -7.538 -5.058 3.293 160 HD22 LEU 21 1HD2 LEU 21 -6.547 -3.712 2.649 161 HD23 LEU 21 2HD2 LEU 21 -7.790 -4.482 1.639 162 HA PRO 22 HA PRO 22 -14.719 -5.200 1.427 163 HB2 PRO 22 2HB PRO 22 -14.859 -7.891 2.350 164 HB3 PRO 22 1HB PRO 22 -14.747 -7.328 0.693 165 HG2 PRO 22 2HG PRO 22 -12.707 -8.774 2.223 166 HG3 PRO 22 1HG PRO 22 -12.624 -8.272 0.544 167 HD2 PRO 22 2HD PRO 22 -11.425 -6.886 2.936 168 HD3 PRO 22 1HD PRO 22 -10.947 -6.807 1.235 169 H TRP 23 H TRP 23 -13.070 -6.590 4.228 170 HA TRP 23 HA TRP 23 -15.118 -5.788 6.224 171 HD1 TRP 23 HD1 TRP 23 -11.227 -4.922 7.597 172 HE1 TRP 23 HE1 TRP 23 -8.866 -5.129 6.351 173 HE3 TRP 23 HE3 TRP 23 -12.292 -9.161 5.097 174 HZ2 TRP 23 HZ2 TRP 23 -7.812 -6.995 4.612 175 HZ3 TRP 23 HZ3 TRP 23 -10.617 -10.038 3.484 176 HH2 TRP 23 HH2 TRP 23 -8.427 -8.897 3.191 177 HB2 TRP 23 2HB TRP 23 -13.456 -6.540 7.905 178 HB3 TRP 23 1HB TRP 23 -13.673 -7.739 6.654 179 HA PRO 24 HA PRO 24 -13.960 -1.409 6.453 180 HB2 PRO 24 2HB PRO 24 -14.266 -1.376 9.466 181 HB3 PRO 24 1HB PRO 24 -15.097 -0.423 8.226 182 HG2 PRO 24 2HG PRO 24 -16.387 -2.498 9.528 183 HG3 PRO 24 1HG PRO 24 -16.695 -2.148 7.817 184 HD2 PRO 24 2HD PRO 24 -14.937 -4.378 8.933 185 HD3 PRO 24 1HD PRO 24 -16.092 -4.379 7.568 186 H SER 25 H SER 25 -12.393 -3.268 8.861 187 HA SER 25 HA SER 25 -9.848 -3.391 8.032 188 HG SER 25 HG SER 25 -9.059 -1.400 7.133 189 HB2 SER 25 2HB SER 25 -9.745 -1.005 9.862 190 HB3 SER 25 1HB SER 25 -8.326 -1.965 9.389 191 H ILE 26 H ILE 26 -9.456 -5.217 9.302 192 HA ILE 26 HA ILE 26 -10.514 -5.508 12.026 193 HB ILE 26 HB ILE 26 -8.950 -7.500 12.275 194 HG12 ILE 26 2HG1 ILE 26 -7.497 -6.557 10.111 195 HG13 ILE 26 1HG1 ILE 26 -7.326 -8.080 10.901 196 HG21 ILE 26 1HG2 ILE 26 -10.373 -9.003 10.950 197 HG22 ILE 26 2HG2 ILE 26 -11.079 -7.643 10.082 198 HG23 ILE 26 3HG2 ILE 26 -11.307 -7.784 11.836 199 HD11 ILE 26 3HD1 ILE 26 -7.487 -8.172 8.318 200 HD12 ILE 26 1HD1 ILE 26 -9.183 -7.710 8.454 201 HD13 ILE 26 2HD1 ILE 26 -8.646 -9.244 9.151 202 HA PRO 27 HA PRO 27 -7.531 -3.436 14.719 203 HB2 PRO 27 2HB PRO 27 -7.624 -5.965 16.461 204 HB3 PRO 27 1HB PRO 27 -7.705 -4.254 16.943 205 HG2 PRO 27 2HG PRO 27 -10.050 -5.600 16.755 206 HG3 PRO 27 1HG PRO 27 -9.952 -4.007 15.956 207 HD2 PRO 27 2HD PRO 27 -9.595 -6.750 14.600 208 HD3 PRO 27 1HD PRO 27 -10.656 -5.378 14.132 209 H ALA 28 H ALA 28 -6.362 -6.812 14.273 210 HA ALA 28 HA ALA 28 -3.567 -6.260 14.278 211 HB1 ALA 28 3HB ALA 28 -3.416 -8.229 12.647 212 HB2 ALA 28 1HB ALA 28 -5.173 -8.213 12.514 213 HB3 ALA 28 2HB ALA 28 -4.390 -8.488 14.109 214 H ASP 29 H ASP 29 -5.707 -5.580 11.483 215 HA ASP 29 HA ASP 29 -3.533 -4.535 9.711 216 HB2 ASP 29 2HB ASP 29 -5.496 -5.584 8.732 217 HB3 ASP 29 1HB ASP 29 -6.612 -4.515 9.582 218 H LYS 30 H LYS 30 -6.349 -2.810 11.148 219 HA LYS 30 HA LYS 30 -5.086 -0.276 10.949 220 HB2 LYS 30 2HB LYS 30 -7.650 -0.990 11.717 221 HB3 LYS 30 1HB LYS 30 -7.045 -0.334 13.215 222 HG2 LYS 30 2HG LYS 30 -7.894 1.631 12.325 223 HG3 LYS 30 1HG LYS 30 -6.259 1.789 11.693 224 HD2 LYS 30 2HD LYS 30 -7.160 0.684 9.459 225 HD3 LYS 30 1HD LYS 30 -8.690 0.582 10.334 226 HE2 LYS 30 2HE LYS 30 -8.751 3.148 10.443 227 HE3 LYS 30 1HE LYS 30 -7.479 3.141 9.239 228 HZ1 LYS 30 3HZ LYS 30 -10.182 1.819 8.923 229 HZ2 LYS 30 1HZ LYS 30 -9.045 1.710 7.764 230 HZ3 LYS 30 2HZ LYS 30 -9.720 3.172 8.168 231 H LYS 31 H LYS 31 -4.215 -2.488 13.350 232 HA LYS 31 HA LYS 31 -2.563 -0.453 14.891 233 HB2 LYS 31 2HB LYS 31 -3.669 -2.285 16.208 234 HB3 LYS 31 1HB LYS 31 -2.803 -3.462 15.279 235 HG2 LYS 31 2HG LYS 31 -1.766 -3.304 17.384 236 HG3 LYS 31 1HG LYS 31 -0.611 -2.778 16.215 237 HD2 LYS 31 2HD LYS 31 -2.348 -0.884 17.954 238 HD3 LYS 31 1HD LYS 31 -0.833 -1.500 18.525 239 HE2 LYS 31 2HE LYS 31 -1.219 0.510 16.208 240 HE3 LYS 31 1HE LYS 31 -0.554 0.841 17.787 241 HZ1 LYS 31 3HZ LYS 31 0.668 -0.931 15.690 242 HZ2 LYS 31 1HZ LYS 31 1.366 -0.775 17.177 243 HZ3 LYS 31 2HZ LYS 31 1.273 0.506 16.138 244 H GLN 32 H GLN 32 -2.033 -3.002 12.389 245 HA GLN 32 HA GLN 32 0.950 -2.755 12.496 246 HB2 GLN 32 2HB GLN 32 -0.182 -4.871 11.860 247 HB3 GLN 32 1HB GLN 32 -0.836 -4.131 10.410 248 HG2 GLN 32 2HG GLN 32 1.121 -4.293 9.219 249 HG3 GLN 32 1HG GLN 32 2.130 -3.716 10.526 250 HE21 GLN 32 1HE2 GLN 32 3.103 -5.287 11.838 251 HE22 GLN 32 2HE2 GLN 32 2.946 -7.067 11.414 252 H TYR 33 H TYR 33 -1.514 -1.799 10.053 253 HA TYR 33 HA TYR 33 -0.074 0.271 8.662 254 HD1 TYR 33 HD1 TYR 33 -3.696 1.189 10.392 255 HD2 TYR 33 HD2 TYR 33 -2.926 1.679 6.227 256 HE1 TYR 33 HE1 TYR 33 -5.194 3.150 10.345 257 HE2 TYR 33 HE2 TYR 33 -4.473 3.609 6.187 258 HH TYR 33 HH TYR 33 -5.596 5.226 7.625 259 HB2 TYR 33 2HB TYR 33 -1.967 -0.301 7.535 260 HB3 TYR 33 1HB TYR 33 -2.888 -0.674 8.914 261 H ARG 34 H ARG 34 -1.551 0.765 11.938 262 HA ARG 34 HA ARG 34 -0.833 3.710 11.710 263 HE ARG 34 HE ARG 34 -5.582 5.126 11.718 264 HB2 ARG 34 2HB ARG 34 -1.872 2.192 14.132 265 HB3 ARG 34 1HB ARG 34 -1.502 3.912 14.127 266 HG2 ARG 34 2HG ARG 34 -3.504 2.853 12.060 267 HG3 ARG 34 1HG ARG 34 -3.978 2.907 13.707 268 HD2 ARG 34 2HD ARG 34 -3.327 5.494 13.653 269 HD3 ARG 34 1HD ARG 34 -3.202 5.271 11.918 270 HH11 ARG 34 2HH1 ARG 34 -4.739 4.638 15.011 271 HH12 ARG 34 1HH1 ARG 34 -6.473 4.578 15.593 272 HH21 ARG 34 1HH2 ARG 34 -7.604 5.111 12.372 273 HH22 ARG 34 2HH2 ARG 34 -8.007 4.827 14.119 274 H SER 35 H SER 35 0.931 0.946 12.785 275 HA SER 35 HA SER 35 3.180 2.786 13.830 276 HG SER 35 HG SER 35 3.489 2.144 15.915 277 HB2 SER 35 2HB SER 35 2.614 -0.159 14.409 278 HB3 SER 35 1HB SER 35 4.253 0.462 14.525 279 H ARG 36 H ARG 36 2.224 1.050 11.107 280 HA ARG 36 HA ARG 36 4.996 1.228 9.828 281 HE ARG 36 HE ARG 36 5.873 -3.289 7.681 282 HB2 ARG 36 2HB ARG 36 3.255 -0.816 9.664 283 HB3 ARG 36 1HB ARG 36 2.363 0.223 8.584 284 HG2 ARG 36 2HG ARG 36 3.618 -1.232 7.192 285 HG3 ARG 36 1HG ARG 36 4.325 0.339 7.062 286 HD2 ARG 36 2HD ARG 36 6.206 -1.020 7.154 287 HD3 ARG 36 1HD ARG 36 6.192 -0.519 8.797 288 HH11 ARG 36 2HH1 ARG 36 5.317 -1.466 10.505 289 HH12 ARG 36 1HH1 ARG 36 5.353 -2.982 11.532 290 HH21 ARG 36 1HH2 ARG 36 5.974 -4.846 8.759 291 HH22 ARG 36 2HH2 ARG 36 5.495 -4.932 10.497 292 H VAL 37 H VAL 37 1.626 2.505 9.101 293 HA VAL 37 HA VAL 37 2.948 4.618 7.359 294 HB VAL 37 HB VAL 37 1.347 4.545 5.862 295 HG11 VAL 37 1HG1 VAL 37 0.825 1.638 6.686 296 HG12 VAL 37 2HG1 VAL 37 2.324 2.196 5.932 297 HG13 VAL 37 3HG1 VAL 37 0.792 2.318 5.033 298 HG21 VAL 37 3HG2 VAL 37 -1.065 3.665 6.020 299 HG22 VAL 37 1HG2 VAL 37 -0.728 5.087 7.017 300 HG23 VAL 37 2HG2 VAL 37 -0.816 3.496 7.773 301 H ALA 38 H ALA 38 1.466 4.732 10.399 302 HA ALA 38 HA ALA 38 -0.020 7.303 9.775 303 HB1 ALA 38 3HB ALA 38 -0.766 7.320 12.107 304 HB2 ALA 38 1HB ALA 38 0.183 5.871 12.423 305 HB3 ALA 38 2HB ALA 38 -1.154 5.816 11.247 306 H ASP 39 H ASP 39 3.147 6.686 11.222 307 HA ASP 39 HA ASP 39 3.717 9.618 11.517 308 HB2 ASP 39 2HB ASP 39 5.298 7.010 11.802 309 HB3 ASP 39 1HB ASP 39 6.170 8.466 11.424 310 H ASP 40 H ASP 40 4.795 7.158 9.068 311 HA ASP 40 HA ASP 40 5.713 9.066 7.238 312 HB2 ASP 40 2HB ASP 40 5.129 6.077 7.159 313 HB3 ASP 40 1HB ASP 40 5.771 6.866 5.733 314 HA PRO 41 HA PRO 41 2.363 10.182 4.155 315 HB2 PRO 41 2HB PRO 41 4.721 9.820 2.206 316 HB3 PRO 41 1HB PRO 41 3.520 11.109 2.224 317 HG2 PRO 41 2HG PRO 41 5.927 11.637 3.296 318 HG3 PRO 41 1HG PRO 41 4.535 12.051 4.322 319 HD2 PRO 41 2HD PRO 41 6.238 9.492 4.501 320 HD3 PRO 41 1HD PRO 41 5.741 10.620 5.791 321 H VAL 42 H VAL 42 0.935 9.145 2.729 322 HA VAL 42 HA VAL 42 1.737 6.348 1.737 323 HB VAL 42 HB VAL 42 -1.030 7.272 2.643 324 HG11 VAL 42 1HG1 VAL 42 -1.566 4.803 2.625 325 HG12 VAL 42 2HG1 VAL 42 0.027 4.444 1.911 326 HG13 VAL 42 3HG1 VAL 42 -1.181 5.380 0.990 327 HG21 VAL 42 3HG2 VAL 42 -0.447 5.528 4.558 328 HG22 VAL 42 1HG2 VAL 42 0.390 7.092 4.654 329 HG23 VAL 42 2HG2 VAL 42 1.233 5.669 4.018 330 H VAL 43 H VAL 43 1.666 5.850 -0.296 331 HA VAL 43 HA VAL 43 0.398 7.716 -2.347 332 HB VAL 43 HB VAL 43 1.971 7.026 -3.968 333 HG11 VAL 43 1HG1 VAL 43 2.948 8.631 -2.176 334 HG12 VAL 43 2HG1 VAL 43 4.161 7.660 -3.064 335 HG13 VAL 43 3HG1 VAL 43 3.693 7.241 -1.404 336 HG21 VAL 43 3HG2 VAL 43 3.826 5.325 -3.498 337 HG22 VAL 43 1HG2 VAL 43 2.231 4.596 -3.612 338 HG23 VAL 43 2HG2 VAL 43 2.974 4.892 -2.018 339 H LEU 44 H LEU 44 -1.583 7.214 -2.886 340 HA LEU 44 HA LEU 44 -2.385 4.294 -3.432 341 HG LEU 44 HG LEU 44 -4.039 7.268 -2.042 342 HB2 LEU 44 2HB LEU 44 -4.057 4.343 -1.776 343 HB3 LEU 44 1HB LEU 44 -2.603 4.820 -1.039 344 HD11 LEU 44 1HD1 LEU 44 -6.086 5.872 -1.771 345 HD12 LEU 44 2HD1 LEU 44 -6.035 7.079 -0.459 346 HD13 LEU 44 3HD1 LEU 44 -5.620 5.370 -0.144 347 HD21 LEU 44 3HD2 LEU 44 -2.279 7.191 -0.177 348 HD22 LEU 44 1HD2 LEU 44 -3.474 6.405 0.863 349 HD23 LEU 44 2HD2 LEU 44 -3.777 8.060 0.235 350 H GLY 45 H GLY 45 -5.131 4.511 -3.774 351 HA2 GLY 45 2HA GLY 45 -5.001 5.460 -6.681 352 HA3 GLY 45 1HA GLY 45 -5.993 4.142 -6.043 353 H ARG 46 H ARG 46 -7.452 5.307 -7.445 354 HA ARG 46 HA ARG 46 -9.217 6.943 -5.576 355 HE ARG 46 HE ARG 46 -11.753 9.874 -7.348 356 HB2 ARG 46 2HB ARG 46 -9.492 6.813 -8.616 357 HB3 ARG 46 1HB ARG 46 -10.867 7.187 -7.624 358 HG2 ARG 46 2HG ARG 46 -8.236 8.765 -7.627 359 HG3 ARG 46 1HG ARG 46 -9.642 9.263 -8.525 360 HD2 ARG 46 2HD ARG 46 -9.791 8.898 -5.446 361 HD3 ARG 46 1HD ARG 46 -9.101 10.340 -6.132 362 HH11 ARG 46 2HH1 ARG 46 -10.632 10.261 -4.173 363 HH12 ARG 46 1HH1 ARG 46 -12.288 10.745 -3.612 364 HH21 ARG 46 1HH2 ARG 46 -13.461 10.182 -6.517 365 HH22 ARG 46 2HH2 ARG 46 -13.733 10.987 -4.955 366 H THR 47 H THR 47 -9.180 3.848 -7.352 367 HA THR 47 HA THR 47 -11.306 2.534 -6.008 368 HB THR 47 HB THR 47 -8.397 1.521 -6.387 369 HG1 THR 47 HG1 THR 47 -10.692 1.162 -8.014 370 HG21 THR 47 3HG2 THR 47 -11.010 -0.138 -6.154 371 HG22 THR 47 1HG2 THR 47 -9.634 -0.130 -5.009 372 HG23 THR 47 2HG2 THR 47 -9.419 -0.768 -6.643 373 H THR 48 H THR 48 -8.011 2.751 -4.451 374 HA THR 48 HA THR 48 -9.110 2.322 -1.769 375 HB THR 48 HB THR 48 -6.816 2.964 -0.957 376 HG1 THR 48 HG1 THR 48 -5.268 3.222 -2.372 377 HG21 THR 48 3HG2 THR 48 -5.503 1.095 -2.424 378 HG22 THR 48 1HG2 THR 48 -7.154 0.612 -2.819 379 HG23 THR 48 2HG2 THR 48 -6.619 0.700 -1.139 380 H PHE 49 H PHE 49 -8.251 5.474 -3.277 381 HA PHE 49 HA PHE 49 -8.627 6.927 -0.703 382 HD1 PHE 49 HD2 PHE 49 -10.293 9.942 -1.774 383 HD2 PHE 49 HD1 PHE 49 -6.031 9.383 -1.571 384 HE1 PHE 49 HE2 PHE 49 -10.069 12.053 -0.575 385 HE2 PHE 49 HE1 PHE 49 -5.813 11.598 -0.548 386 HZ PHE 49 HZ PHE 49 -7.824 12.891 0.049 387 HB2 PHE 49 2HB PHE 49 -7.249 7.747 -2.654 388 HB3 PHE 49 1HB PHE 49 -8.697 8.264 -3.470 389 H GLU 50 H GLU 50 -10.953 6.063 -3.211 390 HA GLU 50 HA GLU 50 -13.131 7.782 -2.102 391 HB2 GLU 50 2HB GLU 50 -13.104 5.578 -4.244 392 HB3 GLU 50 1HB GLU 50 -14.600 6.273 -3.673 393 HG2 GLU 50 2HG GLU 50 -13.885 8.563 -4.333 394 HG3 GLU 50 1HG GLU 50 -12.266 8.002 -4.708 395 H SER 51 H SER 51 -11.895 4.734 -1.037 396 HA SER 51 HA SER 51 -13.862 4.615 1.255 397 HG SER 51 HG SER 51 -13.016 1.689 2.002 398 HB2 SER 51 2HB SER 51 -12.291 2.612 0.288 399 HB3 SER 51 1HB SER 51 -11.098 3.315 1.380 400 H MET 52 H MET 52 -10.313 5.195 1.446 401 HA MET 52 HA MET 52 -10.248 6.395 3.917 402 HB2 MET 52 2HB MET 52 -8.461 7.143 1.515 403 HB3 MET 52 1HB MET 52 -8.077 7.469 3.232 404 HG2 MET 52 2HG MET 52 -7.875 5.115 3.775 405 HG3 MET 52 1HG MET 52 -8.078 4.689 2.033 406 HE1 MET 52 3HE MET 52 -5.303 4.272 3.608 407 HE2 MET 52 1HE MET 52 -4.215 4.809 2.291 408 HE3 MET 52 2HE MET 52 -5.693 3.851 1.915 409 H ARG 53 H ARG 53 -11.437 8.212 1.382 410 HA ARG 53 HA ARG 53 -11.174 10.971 2.334 411 HE ARG 53 HE ARG 53 -15.519 13.362 0.520 412 HB2 ARG 53 2HB ARG 53 -12.035 10.204 0.114 413 HB3 ARG 53 1HB ARG 53 -13.403 9.419 0.878 414 HG2 ARG 53 2HG ARG 53 -12.883 12.459 0.971 415 HG3 ARG 53 1HG ARG 53 -13.813 11.673 -0.322 416 HD2 ARG 53 2HD ARG 53 -15.349 10.643 1.475 417 HD3 ARG 53 1HD ARG 53 -14.508 11.645 2.655 418 HH11 ARG 53 2HH1 ARG 53 -16.377 11.695 3.507 419 HH12 ARG 53 1HH1 ARG 53 -17.702 12.855 3.870 420 HH21 ARG 53 1HH2 ARG 53 -17.087 14.652 0.951 421 HH22 ARG 53 2HH2 ARG 53 -18.090 14.456 2.479 422 H ASP 54 H ASP 54 -12.887 8.242 3.756 423 HA ASP 54 HA ASP 54 -13.945 10.006 5.978 424 HB2 ASP 54 2HB ASP 54 -15.041 7.598 4.709 425 HB3 ASP 54 1HB ASP 54 -14.687 7.218 6.368 426 H ASP 55 H ASP 55 -12.292 6.742 6.385 427 HA ASP 55 HA ASP 55 -10.531 7.955 8.469 428 HB2 ASP 55 2HB ASP 55 -11.138 5.176 7.580 429 HB3 ASP 55 1HB ASP 55 -9.440 5.370 7.785 430 H LEU 56 H LEU 56 -8.928 9.347 7.930 431 HA LEU 56 HA LEU 56 -7.270 9.034 5.551 432 HG LEU 56 HG LEU 56 -7.108 12.687 6.469 433 HB2 LEU 56 2HB LEU 56 -6.262 10.666 7.899 434 HB3 LEU 56 1HB LEU 56 -5.902 10.815 6.220 435 HD11 LEU 56 1HD1 LEU 56 -8.308 11.537 4.610 436 HD12 LEU 56 2HD1 LEU 56 -9.412 12.549 5.552 437 HD13 LEU 56 3HD1 LEU 56 -9.442 10.798 5.774 438 HD21 LEU 56 3HD2 LEU 56 -8.970 13.094 7.991 439 HD22 LEU 56 1HD2 LEU 56 -7.645 12.304 8.865 440 HD23 LEU 56 2HD2 LEU 56 -9.088 11.358 8.400 441 HA PRO 57 HA PRO 57 -4.106 6.100 7.158 442 HB2 PRO 57 2HB PRO 57 -2.129 6.370 5.359 443 HB3 PRO 57 1HB PRO 57 -3.698 5.696 4.924 444 HG2 PRO 57 2HG PRO 57 -2.677 8.533 4.418 445 HG3 PRO 57 1HG PRO 57 -3.554 7.473 3.283 446 HD2 PRO 57 2HD PRO 57 -4.781 9.446 4.800 447 HD3 PRO 57 1HD PRO 57 -5.653 7.971 4.273 448 H GLY 58 H GLY 58 -2.150 9.009 6.374 449 HA2 GLY 58 2HA GLY 58 -1.111 9.150 9.256 450 HA3 GLY 58 1HA GLY 58 0.035 8.667 8.010 451 H SER 59 H SER 59 1.303 10.463 8.659 452 HA SER 59 HA SER 59 0.656 13.210 8.456 453 HG SER 59 HG SER 59 4.079 13.900 8.693 454 HB2 SER 59 2HB SER 59 2.772 12.123 9.343 455 HB3 SER 59 1HB SER 59 3.363 11.991 7.676 456 H ALA 60 H ALA 60 0.756 11.212 5.582 457 HA ALA 60 HA ALA 60 -0.421 13.528 4.193 458 HB1 ALA 60 3HB ALA 60 1.274 13.369 2.131 459 HB2 ALA 60 1HB ALA 60 2.387 12.655 3.318 460 HB3 ALA 60 2HB ALA 60 1.736 14.281 3.592 461 H GLN 61 H GLN 61 -1.286 13.188 2.108 462 HA GLN 61 HA GLN 61 -2.020 10.261 1.505 463 HB2 GLN 61 2HB GLN 61 -3.594 11.928 3.017 464 HB3 GLN 61 1HB GLN 61 -4.097 12.498 1.443 465 HG2 GLN 61 2HG GLN 61 -4.702 10.108 0.808 466 HG3 GLN 61 1HG GLN 61 -4.204 9.582 2.395 467 HE21 GLN 61 1HE2 GLN 61 -6.555 8.815 1.853 468 HE22 GLN 61 2HE2 GLN 61 -7.812 9.833 2.740 469 H ILE 62 H ILE 62 -1.013 9.975 -0.349 470 HA ILE 62 HA ILE 62 -1.087 12.028 -2.613 471 HB ILE 62 HB ILE 62 0.691 9.655 -1.866 472 HG12 ILE 62 2HG1 ILE 62 1.648 12.469 -2.243 473 HG13 ILE 62 1HG1 ILE 62 0.893 12.050 -0.719 474 HG21 ILE 62 1HG2 ILE 62 1.267 9.361 -4.067 475 HG22 ILE 62 2HG2 ILE 62 2.115 10.905 -3.943 476 HG23 ILE 62 3HG2 ILE 62 0.456 10.862 -4.581 477 HD11 ILE 62 3HD1 ILE 62 3.470 10.878 -1.952 478 HD12 ILE 62 1HD1 ILE 62 2.743 10.230 -0.442 479 HD13 ILE 62 2HD1 ILE 62 3.335 11.897 -0.511 480 H VAL 63 H VAL 63 -2.614 11.652 -4.218 481 HA VAL 63 HA VAL 63 -3.234 8.781 -4.972 482 HB VAL 63 HB VAL 63 -4.640 11.342 -5.715 483 HG11 VAL 63 1HG1 VAL 63 -6.379 9.794 -6.822 484 HG12 VAL 63 2HG1 VAL 63 -5.221 8.447 -6.667 485 HG13 VAL 63 3HG1 VAL 63 -4.836 9.829 -7.710 486 HG21 VAL 63 3HG2 VAL 63 -5.094 10.487 -3.435 487 HG22 VAL 63 1HG2 VAL 63 -5.351 8.836 -4.020 488 HG23 VAL 63 2HG2 VAL 63 -6.531 10.129 -4.395 489 H MET 64 H MET 64 -1.993 7.715 -6.262 490 HA MET 64 HA MET 64 -0.664 8.882 -8.705 491 HB2 MET 64 2HB MET 64 -0.745 6.172 -7.236 492 HB3 MET 64 1HB MET 64 -0.399 6.168 -8.927 493 HG2 MET 64 2HG MET 64 1.348 8.254 -8.002 494 HG3 MET 64 1HG MET 64 1.354 7.069 -6.699 495 HE1 MET 64 3HE MET 64 2.635 6.522 -11.120 496 HE2 MET 64 1HE MET 64 1.793 7.937 -10.411 497 HE3 MET 64 2HE MET 64 0.881 6.453 -10.802 498 H SER 65 H SER 65 -2.484 9.749 -9.670 499 HA SER 65 HA SER 65 -3.803 7.977 -11.653 500 HG SER 65 HG SER 65 -6.160 7.356 -11.664 501 HB2 SER 65 2HB SER 65 -5.354 7.709 -9.559 502 HB3 SER 65 1HB SER 65 -5.755 9.412 -9.722 503 H ARG 66 H ARG 66 -5.963 10.186 -12.000 504 HA ARG 66 HA ARG 66 -4.251 12.593 -12.706 505 HE ARG 66 HE ARG 66 -5.777 10.747 -17.462 506 HB2 ARG 66 2HB ARG 66 -6.017 11.219 -14.820 507 HB3 ARG 66 1HB ARG 66 -5.539 12.897 -14.929 508 HG2 ARG 66 2HG ARG 66 -3.374 12.464 -15.572 509 HG3 ARG 66 1HG ARG 66 -3.141 11.177 -14.438 510 HD2 ARG 66 2HD ARG 66 -2.934 10.158 -16.602 511 HD3 ARG 66 1HD ARG 66 -4.397 9.554 -15.875 512 HH11 ARG 66 2HH1 ARG 66 -2.461 11.699 -17.917 513 HH12 ARG 66 1HH1 ARG 66 -2.838 12.659 -19.410 514 HH21 ARG 66 1HH2 ARG 66 -6.189 11.858 -19.119 515 HH22 ARG 66 2HH2 ARG 66 -4.900 12.753 -20.049 516 H SER 67 H SER 67 -5.161 14.411 -12.191 517 HA SER 67 HA SER 67 -8.009 14.886 -11.764 518 HG SER 67 HG SER 67 -8.960 13.703 -8.829 519 HB2 SER 67 2HB SER 67 -7.036 13.268 -9.660 520 HB3 SER 67 1HB SER 67 -6.826 14.873 -8.968 521 H GLU 68 H GLU 68 -8.522 16.904 -11.019 522 HA GLU 68 HA GLU 68 -6.328 19.026 -11.145 523 HB2 GLU 68 2HB GLU 68 -9.346 19.285 -11.667 524 HB3 GLU 68 1HB GLU 68 -8.129 20.526 -11.945 525 HG2 GLU 68 2HG GLU 68 -7.126 19.201 -13.825 526 HG3 GLU 68 1HG GLU 68 -8.201 17.848 -13.482 527 H ARG 69 H ARG 69 -9.317 18.488 -9.246 528 HA ARG 69 HA ARG 69 -8.634 20.772 -7.371 529 HE ARG 69 HE ARG 69 -14.118 20.479 -7.030 530 HB2 ARG 69 2HB ARG 69 -11.121 18.992 -7.780 531 HB3 ARG 69 1HB ARG 69 -10.908 19.776 -6.251 532 HG2 ARG 69 2HG ARG 69 -10.449 21.941 -8.006 533 HG3 ARG 69 1HG ARG 69 -11.566 21.001 -8.930 534 HD2 ARG 69 2HD ARG 69 -12.217 21.558 -5.944 535 HD3 ARG 69 1HD ARG 69 -12.286 22.894 -7.028 536 HH11 ARG 69 2HH1 ARG 69 -13.135 23.212 -8.905 537 HH12 ARG 69 1HH1 ARG 69 -14.751 23.402 -9.709 538 HH21 ARG 69 1HH2 ARG 69 -15.983 20.718 -7.915 539 HH22 ARG 69 2HH2 ARG 69 -16.310 22.026 -9.142 540 H SER 70 H SER 70 -8.119 20.657 -5.230 541 HA SER 70 HA SER 70 -7.163 18.380 -3.835 542 HG SER 70 HG SER 70 -5.799 20.422 -2.659 543 HB2 SER 70 2HB SER 70 -8.576 20.893 -2.709 544 HB3 SER 70 1HB SER 70 -7.626 19.771 -1.729 545 H PHE 71 H PHE 71 -7.918 17.194 -2.069 546 HA PHE 71 HA PHE 71 -10.514 15.885 -2.762 547 HD1 PHE 71 HD1 PHE 71 -10.094 13.509 -3.964 548 HD2 PHE 71 HD2 PHE 71 -6.210 14.793 -2.626 549 HE1 PHE 71 HE1 PHE 71 -9.051 12.455 -5.925 550 HE2 PHE 71 HE2 PHE 71 -5.186 13.655 -4.553 551 HZ PHE 71 HZ PHE 71 -6.592 12.504 -6.211 552 HB2 PHE 71 2HB PHE 71 -8.098 14.964 -1.109 553 HB3 PHE 71 1HB PHE 71 -9.494 14.007 -1.468 554 H SER 72 H SER 72 -9.158 16.280 0.597 555 HA SER 72 HA SER 72 -11.740 17.207 1.638 556 HG SER 72 HG SER 72 -12.447 15.276 0.378 557 HB2 SER 72 2HB SER 72 -11.167 14.284 2.394 558 HB3 SER 72 1HB SER 72 -12.349 15.333 3.160 559 H VAL 73 H VAL 73 -8.803 15.516 2.936 560 HA VAL 73 HA VAL 73 -8.730 17.476 5.268 561 HB VAL 73 HB VAL 73 -8.272 15.059 5.705 562 HG11 VAL 73 1HG1 VAL 73 -5.988 14.066 5.183 563 HG12 VAL 73 2HG1 VAL 73 -5.685 15.397 4.054 564 HG13 VAL 73 3HG1 VAL 73 -7.015 14.247 3.768 565 HG21 VAL 73 3HG2 VAL 73 -6.432 15.363 7.252 566 HG22 VAL 73 1HG2 VAL 73 -7.313 16.904 7.212 567 HG23 VAL 73 2HG2 VAL 73 -5.773 16.741 6.355 568 H ASP 74 H ASP 74 -7.051 19.093 5.507 569 HA ASP 74 HA ASP 74 -5.752 20.189 3.246 570 HB2 ASP 74 2HB ASP 74 -4.993 20.435 6.215 571 HB3 ASP 74 1HB ASP 74 -4.331 21.420 4.923 572 H THR 75 H THR 75 -4.331 17.553 5.217 573 HA THR 75 HA THR 75 -1.724 17.655 3.670 574 HB THR 75 HB THR 75 -1.739 17.073 6.099 575 HG1 THR 75 HG1 THR 75 -0.292 15.137 5.402 576 HG21 THR 75 3HG2 THR 75 -1.823 14.625 6.707 577 HG22 THR 75 1HG2 THR 75 -2.529 14.225 5.148 578 HG23 THR 75 2HG2 THR 75 -3.464 15.200 6.314 579 H ALA 76 H ALA 76 -4.252 17.178 2.174 580 HA ALA 76 HA ALA 76 -3.607 14.482 0.879 581 HB1 ALA 76 3HB ALA 76 -6.367 15.772 1.132 582 HB2 ALA 76 1HB ALA 76 -5.752 14.271 1.867 583 HB3 ALA 76 2HB ALA 76 -5.995 14.353 0.110 584 H HIS 77 H HIS 77 -3.088 14.392 -1.076 585 HA HIS 77 HA HIS 77 -2.907 16.835 -2.935 586 HD1 HIS 77 HD1 HIS 77 -0.213 15.899 0.777 587 HD2 HIS 77 HD2 HIS 77 -1.210 19.131 -1.833 588 HE1 HIS 77 HE1 HIS 77 0.238 18.131 1.944 589 HB2 HIS 77 2HB HIS 77 -0.605 15.208 -1.673 590 HB3 HIS 77 1HB HIS 77 -0.409 16.501 -2.860 591 H ARG 78 H ARG 78 -1.559 16.054 -4.991 592 HA ARG 78 HA ARG 78 -2.519 13.251 -5.788 593 HE ARG 78 HE ARG 78 -4.019 15.143 -10.523 594 HB2 ARG 78 2HB ARG 78 -4.177 15.122 -6.430 595 HB3 ARG 78 1HB ARG 78 -3.017 15.691 -7.592 596 HG2 ARG 78 2HG ARG 78 -4.054 12.768 -7.534 597 HG3 ARG 78 1HG ARG 78 -4.960 14.019 -8.316 598 HD2 ARG 78 2HD ARG 78 -2.143 13.102 -9.121 599 HD3 ARG 78 1HD ARG 78 -3.630 12.667 -9.942 600 HH11 ARG 78 2HH1 ARG 78 -0.766 14.345 -9.593 601 HH12 ARG 78 1HH1 ARG 78 -0.049 15.621 -10.633 602 HH21 ARG 78 1HH2 ARG 78 -3.247 16.568 -11.642 603 HH22 ARG 78 2HH2 ARG 78 -1.428 16.837 -11.788 604 H ALA 79 H ALA 79 -0.904 12.088 -6.540 605 HA ALA 79 HA ALA 79 1.522 13.325 -7.917 606 HB1 ALA 79 3HB ALA 79 0.853 10.439 -6.987 607 HB2 ALA 79 1HB ALA 79 1.928 11.629 -6.174 608 HB3 ALA 79 2HB ALA 79 2.380 10.924 -7.743 609 H ALA 80 H ALA 80 2.057 12.941 -10.063 610 HA ALA 80 HA ALA 80 0.074 11.408 -11.847 611 HB1 ALA 80 3HB ALA 80 0.267 13.653 -12.635 612 HB2 ALA 80 1HB ALA 80 1.246 12.682 -13.758 613 HB3 ALA 80 2HB ALA 80 2.037 13.634 -12.503 614 H SER 81 H SER 81 3.493 11.203 -10.879 615 HA SER 81 HA SER 81 3.551 8.466 -12.231 616 HG SER 81 HG SER 81 5.500 8.515 -14.189 617 HB2 SER 81 2HB SER 81 4.787 10.364 -13.554 618 HB3 SER 81 1HB SER 81 5.975 10.401 -12.234 619 H VAL 82 H VAL 82 6.062 7.712 -11.338 620 HA VAL 82 HA VAL 82 5.714 7.443 -8.306 621 HB VAL 82 HB VAL 82 7.725 5.907 -10.031 622 HG11 VAL 82 1HG1 VAL 82 8.807 6.062 -7.876 623 HG12 VAL 82 2HG1 VAL 82 7.880 4.572 -7.730 624 HG13 VAL 82 3HG1 VAL 82 7.277 6.062 -6.985 625 HG21 VAL 82 3HG2 VAL 82 5.608 4.858 -10.463 626 HG22 VAL 82 1HG2 VAL 82 5.021 5.068 -8.786 627 HG23 VAL 82 2HG2 VAL 82 6.271 3.878 -9.153 628 H GLU 83 H GLU 83 8.350 8.505 -10.595 629 HA GLU 83 HA GLU 83 9.843 10.137 -8.773 630 HB2 GLU 83 2HB GLU 83 9.100 10.613 -11.716 631 HB3 GLU 83 1HB GLU 83 10.326 11.514 -10.858 632 HG2 GLU 83 2HG GLU 83 11.891 9.714 -10.820 633 HG3 GLU 83 1HG GLU 83 10.673 8.475 -10.863 634 H GLU 84 H GLU 84 6.703 11.239 -10.294 635 HA GLU 84 HA GLU 84 6.685 13.738 -8.656 636 HB2 GLU 84 2HB GLU 84 4.262 12.315 -9.870 637 HB3 GLU 84 1HB GLU 84 4.278 13.950 -9.243 638 HG2 GLU 84 2HG GLU 84 6.259 14.078 -11.300 639 HG3 GLU 84 1HG GLU 84 5.071 12.971 -11.954 640 H ALA 85 H ALA 85 5.837 10.517 -7.797 641 HA ALA 85 HA ALA 85 4.266 11.343 -5.333 642 HB1 ALA 85 3HB ALA 85 3.937 8.958 -4.877 643 HB2 ALA 85 1HB ALA 85 5.096 8.481 -6.119 644 HB3 ALA 85 2HB ALA 85 3.544 9.212 -6.593 645 H VAL 86 H VAL 86 7.557 10.247 -6.139 646 HA VAL 86 HA VAL 86 8.447 10.159 -3.245 647 HB VAL 86 HB VAL 86 9.908 9.803 -5.904 648 HG11 VAL 86 1HG1 VAL 86 12.045 9.405 -4.644 649 HG12 VAL 86 2HG1 VAL 86 11.297 10.053 -3.156 650 HG13 VAL 86 3HG1 VAL 86 11.550 11.103 -4.580 651 HG21 VAL 86 3HG2 VAL 86 9.666 8.009 -3.382 652 HG22 VAL 86 1HG2 VAL 86 10.525 7.559 -4.863 653 HG23 VAL 86 2HG2 VAL 86 8.762 7.745 -4.893 654 H ASP 87 H ASP 87 9.070 12.533 -5.953 655 HA ASP 87 HA ASP 87 10.136 14.555 -4.254 656 HB2 ASP 87 2HB ASP 87 8.869 14.557 -7.043 657 HB3 ASP 87 1HB ASP 87 9.037 16.102 -6.264 658 H ILE 88 H ILE 88 6.602 14.025 -4.719 659 HA ILE 88 HA ILE 88 6.114 16.436 -3.003 660 HB ILE 88 HB ILE 88 4.017 16.456 -2.882 661 HG12 ILE 88 2HG1 ILE 88 3.186 13.843 -4.237 662 HG13 ILE 88 1HG1 ILE 88 3.580 13.843 -2.544 663 HG21 ILE 88 1HG2 ILE 88 4.248 15.489 -5.784 664 HG22 ILE 88 2HG2 ILE 88 4.868 17.044 -5.214 665 HG23 ILE 88 3HG2 ILE 88 3.122 16.699 -5.130 666 HD11 ILE 88 3HD1 ILE 88 1.932 16.094 -2.508 667 HD12 ILE 88 1HD1 ILE 88 1.401 14.471 -2.198 668 HD13 ILE 88 2HD1 ILE 88 1.191 15.152 -3.825 669 H ALA 89 H ALA 89 6.371 13.013 -2.241 670 HA ALA 89 HA ALA 89 5.622 13.317 0.632 671 HB1 ALA 89 3HB ALA 89 5.619 11.074 -0.316 672 HB2 ALA 89 1HB ALA 89 6.921 11.144 0.882 673 HB3 ALA 89 2HB ALA 89 7.314 11.212 -0.852 674 H ALA 90 H ALA 90 8.866 13.380 -0.943 675 HA ALA 90 HA ALA 90 10.279 14.203 1.541 676 HB1 ALA 90 3HB ALA 90 11.424 12.989 -0.231 677 HB2 ALA 90 1HB ALA 90 12.185 14.596 -0.165 678 HB3 ALA 90 2HB ALA 90 11.027 14.220 -1.453 679 H SER 91 H SER 91 8.530 16.133 -0.711 680 HA SER 91 HA SER 91 9.766 18.794 0.094 681 HG SER 91 HG SER 91 9.226 17.747 -2.872 682 HB2 SER 91 2HB SER 91 7.380 18.028 -1.689 683 HB3 SER 91 1HB SER 91 7.843 19.693 -1.336 684 H LEU 92 H LEU 92 7.159 16.793 1.384 685 HA LEU 92 HA LEU 92 5.952 19.144 2.864 686 HG LEU 92 HG LEU 92 5.317 15.747 1.562 687 HB2 LEU 92 2HB LEU 92 4.136 17.656 3.659 688 HB3 LEU 92 1HB LEU 92 4.247 18.110 1.992 689 HD11 LEU 92 1HD1 LEU 92 4.473 13.972 3.055 690 HD12 LEU 92 2HD1 LEU 92 3.879 15.175 4.234 691 HD13 LEU 92 3HD1 LEU 92 5.623 14.980 3.892 692 HD21 LEU 92 3HD2 LEU 92 3.045 14.755 1.261 693 HD22 LEU 92 1HD2 LEU 92 3.066 16.418 0.676 694 HD23 LEU 92 2HD2 LEU 92 2.312 16.040 2.246 695 H ASP 93 H ASP 93 6.641 15.994 4.511 696 HA ASP 93 HA ASP 93 9.070 17.104 5.723 697 HB2 ASP 93 2HB ASP 93 6.994 18.195 7.100 698 HB3 ASP 93 1HB ASP 93 6.981 16.676 7.931 699 H ALA 94 H ALA 94 9.874 15.013 4.817 700 HA ALA 94 HA ALA 94 9.476 12.584 6.521 701 HB1 ALA 94 3HB ALA 94 8.245 11.243 4.739 702 HB2 ALA 94 1HB ALA 94 8.171 12.703 3.716 703 HB3 ALA 94 2HB ALA 94 7.312 12.646 5.269 704 H GLU 95 H GLU 95 10.629 10.725 5.967 705 HA GLU 95 HA GLU 95 12.840 11.035 3.871 706 HB2 GLU 95 2HB GLU 95 13.432 9.053 6.030 707 HB3 GLU 95 1HB GLU 95 14.478 10.033 5.013 708 HG2 GLU 95 2HG GLU 95 13.922 12.064 6.520 709 HG3 GLU 95 1HG GLU 95 13.013 10.964 7.555 710 H THR 96 H THR 96 11.397 8.146 5.485 711 HA THR 96 HA THR 96 11.090 6.603 2.919 712 HB THR 96 HB THR 96 9.584 5.097 4.574 713 HG1 THR 96 HG1 THR 96 9.468 6.504 6.328 714 HG21 THR 96 3HG2 THR 96 11.805 4.329 3.727 715 HG22 THR 96 1HG2 THR 96 11.451 3.856 5.404 716 HG23 THR 96 2HG2 THR 96 12.590 5.180 5.085 717 H ALA 97 H ALA 97 8.940 5.658 2.450 718 HA ALA 97 HA ALA 97 6.533 6.923 3.564 719 HB1 ALA 97 3HB ALA 97 6.923 8.616 1.856 720 HB2 ALA 97 1HB ALA 97 5.511 7.690 1.310 721 HB3 ALA 97 2HB ALA 97 7.112 7.433 0.552 722 H TYR 98 H TYR 98 4.463 5.971 2.483 723 HA TYR 98 HA TYR 98 4.879 3.008 1.864 724 HD1 TYR 98 HD1 TYR 98 4.644 0.792 3.820 725 HD2 TYR 98 HD2 TYR 98 5.032 4.681 5.537 726 HE1 TYR 98 HE1 TYR 98 6.465 -0.024 5.230 727 HE2 TYR 98 HE2 TYR 98 6.821 3.843 7.032 728 HH TYR 98 HH TYR 98 8.234 0.726 6.583 729 HB2 TYR 98 2HB TYR 98 3.114 4.200 4.101 730 HB3 TYR 98 1HB TYR 98 2.883 2.565 3.506 731 H VAL 99 H VAL 99 2.759 1.930 1.335 732 HA VAL 99 HA VAL 99 0.864 3.652 -0.324 733 HB VAL 99 HB VAL 99 1.501 3.032 -2.316 734 HG11 VAL 99 1HG1 VAL 99 3.809 1.319 -1.412 735 HG12 VAL 99 2HG1 VAL 99 3.838 3.034 -1.574 736 HG13 VAL 99 3HG1 VAL 99 3.546 2.023 -3.000 737 HG21 VAL 99 3HG2 VAL 99 0.044 1.204 -2.521 738 HG22 VAL 99 1HG2 VAL 99 1.185 0.113 -1.720 739 HG23 VAL 99 2HG2 VAL 99 1.556 0.772 -3.341 740 H ILE 100 H ILE 100 -1.267 3.056 0.427 741 HA ILE 100 HA ILE 100 -1.797 0.226 1.074 742 HB ILE 100 HB ILE 100 -4.012 2.219 0.483 743 HG12 ILE 100 2HG1 ILE 100 -2.810 3.167 2.290 744 HG13 ILE 100 1HG1 ILE 100 -4.166 2.346 3.009 745 HG21 ILE 100 1HG2 ILE 100 -4.809 -0.193 0.450 746 HG22 ILE 100 2HG2 ILE 100 -5.477 0.732 1.786 747 HG23 ILE 100 3HG2 ILE 100 -4.166 -0.391 2.104 748 HD11 ILE 100 3HD1 ILE 100 -1.383 1.114 3.020 749 HD12 ILE 100 1HD1 ILE 100 -2.796 0.650 4.016 750 HD13 ILE 100 2HD1 ILE 100 -1.938 2.215 4.274 751 H GLY 101 H GLY 101 -2.930 1.740 -1.754 752 HA2 GLY 101 2HA GLY 101 -3.075 0.842 -4.003 753 HA3 GLY 101 1HA GLY 101 -1.868 -0.251 -3.566 754 H GLY 102 H GLY 102 -3.036 -2.559 -4.604 755 HA2 GLY 102 2HA GLY 102 -4.924 -0.418 -5.777 756 HA3 GLY 102 1HA GLY 102 -3.290 -0.630 -6.314 757 H ALA 103 H ALA 103 -6.479 -1.957 -6.874 758 HA ALA 103 HA ALA 103 -6.192 -3.340 -9.168 759 HB1 ALA 103 3HB ALA 103 -8.081 -1.889 -10.040 760 HB2 ALA 103 1HB ALA 103 -7.575 -0.488 -9.118 761 HB3 ALA 103 2HB ALA 103 -8.223 -1.896 -8.294 762 H ALA 104 H ALA 104 -5.149 0.073 -9.321 763 HA ALA 104 HA ALA 104 -3.259 -0.677 -11.623 764 HB1 ALA 104 3HB ALA 104 -3.077 1.724 -12.183 765 HB2 ALA 104 1HB ALA 104 -4.213 2.134 -10.881 766 HB3 ALA 104 2HB ALA 104 -4.766 1.167 -12.275 767 H ILE 105 H ILE 105 -3.317 0.635 -8.318 768 HA ILE 105 HA ILE 105 -0.773 1.988 -8.445 769 HB ILE 105 HB ILE 105 -1.918 1.017 -5.826 770 HG12 ILE 105 2HG1 ILE 105 -3.843 2.113 -6.735 771 HG13 ILE 105 1HG1 ILE 105 -3.125 3.157 -5.580 772 HG21 ILE 105 1HG2 ILE 105 -0.878 2.917 -4.751 773 HG22 ILE 105 2HG2 ILE 105 -0.280 3.548 -6.284 774 HG23 ILE 105 3HG2 ILE 105 0.373 2.038 -5.613 775 HD11 ILE 105 3HD1 ILE 105 -2.945 4.821 -7.227 776 HD12 ILE 105 1HD1 ILE 105 -3.782 3.667 -8.336 777 HD13 ILE 105 2HD1 ILE 105 -2.011 3.782 -8.312 778 H TYR 106 H TYR 106 -1.078 -0.877 -6.287 779 HA TYR 106 HA TYR 106 1.660 -1.608 -6.154 780 HD1 TYR 106 HD1 TYR 106 2.329 -4.508 -4.950 781 HD2 TYR 106 HD2 TYR 106 -1.010 -2.237 -3.471 782 HE1 TYR 106 HE1 TYR 106 2.845 -5.173 -2.666 783 HE2 TYR 106 HE2 TYR 106 -0.420 -2.906 -1.166 784 HH TYR 106 HH TYR 106 2.172 -4.038 -0.126 785 HB2 TYR 106 2HB TYR 106 -0.960 -3.124 -5.850 786 HB3 TYR 106 1HB TYR 106 0.345 -4.129 -6.325 787 H ALA 107 H ALA 107 -0.409 -2.558 -8.916 788 HA ALA 107 HA ALA 107 1.607 -4.154 -10.391 789 HB1 ALA 107 3HB ALA 107 -0.863 -4.310 -10.811 790 HB2 ALA 107 1HB ALA 107 -0.053 -3.812 -12.289 791 HB3 ALA 107 2HB ALA 107 -0.916 -2.621 -11.300 792 H LEU 108 H LEU 108 0.693 -0.669 -10.769 793 HA LEU 108 HA LEU 108 2.988 -0.187 -12.606 794 HG LEU 108 HG LEU 108 1.735 2.186 -10.004 795 HB2 LEU 108 2HB LEU 108 2.190 1.848 -12.991 796 HB3 LEU 108 1HB LEU 108 0.719 1.190 -12.352 797 HD11 LEU 108 1HD1 LEU 108 2.803 4.241 -12.056 798 HD12 LEU 108 2HD1 LEU 108 3.862 3.019 -11.347 799 HD13 LEU 108 3HD1 LEU 108 3.064 4.189 -10.301 800 HD21 LEU 108 3HD2 LEU 108 0.248 3.828 -12.123 801 HD22 LEU 108 1HD2 LEU 108 0.485 4.316 -10.436 802 HD23 LEU 108 2HD2 LEU 108 -0.476 2.874 -10.773 803 H PHE 109 H PHE 109 2.658 0.306 -9.084 804 HA PHE 109 HA PHE 109 5.342 1.313 -8.715 805 HD1 PHE 109 HD2 PHE 109 6.388 2.023 -6.137 806 HD2 PHE 109 HD1 PHE 109 2.217 2.527 -6.959 807 HE1 PHE 109 HE2 PHE 109 6.583 4.382 -5.582 808 HE2 PHE 109 HE1 PHE 109 2.417 4.924 -6.455 809 HZ PHE 109 HZ PHE 109 4.632 5.871 -5.783 810 HB2 PHE 109 2HB PHE 109 3.161 0.226 -6.867 811 HB3 PHE 109 1HB PHE 109 4.761 0.027 -6.238 812 H GLN 110 H GLN 110 4.601 -2.086 -9.112 813 HA GLN 110 HA GLN 110 6.433 -3.417 -7.655 814 HB2 GLN 110 2HB GLN 110 5.965 -4.094 -10.636 815 HB3 GLN 110 1HB GLN 110 6.784 -5.129 -9.510 816 HG2 GLN 110 2HG GLN 110 4.585 -4.958 -8.018 817 HG3 GLN 110 1HG GLN 110 3.853 -4.270 -9.447 818 HE21 GLN 110 1HE2 GLN 110 5.114 -7.221 -8.096 819 HE22 GLN 110 2HE2 GLN 110 4.398 -8.291 -9.400 820 HA PRO 111 HA PRO 111 10.654 -2.947 -9.879 821 HB2 PRO 111 2HB PRO 111 10.594 -0.615 -11.728 822 HB3 PRO 111 1HB PRO 111 10.995 -2.311 -12.056 823 HG2 PRO 111 2HG PRO 111 8.655 -1.110 -13.043 824 HG3 PRO 111 1HG PRO 111 8.778 -2.856 -12.674 825 HD2 PRO 111 2HD PRO 111 7.628 -0.663 -10.859 826 HD3 PRO 111 1HD PRO 111 6.908 -2.211 -11.320 827 H HIS 112 H HIS 112 8.887 -0.295 -8.631 828 HA HIS 112 HA HIS 112 11.340 1.442 -8.034 829 HD1 HIS 112 HD1 HIS 112 10.876 4.232 -9.893 830 HD2 HIS 112 HD2 HIS 112 7.507 1.666 -10.399 831 HE1 HIS 112 HE1 HIS 112 9.793 4.626 -12.221 832 HB2 HIS 112 2HB HIS 112 8.352 2.162 -7.877 833 HB3 HIS 112 1HB HIS 112 9.713 3.247 -7.693 834 H LEU 113 H LEU 113 9.234 -0.635 -6.126 835 HA LEU 113 HA LEU 113 9.323 0.940 -3.618 836 HG LEU 113 HG LEU 113 6.743 -1.546 -2.702 837 HB2 LEU 113 2HB LEU 113 8.990 -2.127 -4.064 838 HB3 LEU 113 1HB LEU 113 8.870 -1.375 -2.491 839 HD11 LEU 113 1HD1 LEU 113 6.857 0.886 -2.675 840 HD12 LEU 113 2HD1 LEU 113 5.492 0.451 -3.711 841 HD13 LEU 113 3HD1 LEU 113 7.051 0.949 -4.425 842 HD21 LEU 113 3HD2 LEU 113 6.838 -2.963 -4.705 843 HD22 LEU 113 1HD2 LEU 113 6.798 -1.531 -5.768 844 HD23 LEU 113 2HD2 LEU 113 5.409 -1.929 -4.706 845 H ASP 114 H ASP 114 10.656 0.854 -1.774 846 HA ASP 114 HA ASP 114 13.243 -0.693 -1.681 847 HB2 ASP 114 2HB ASP 114 12.988 1.457 -0.531 848 HB3 ASP 114 1HB ASP 114 11.584 0.920 0.348 849 H ARG 115 H ARG 115 10.029 -1.114 -0.102 850 HA ARG 115 HA ARG 115 10.441 -4.140 -0.169 851 HE ARG 115 HE ARG 115 12.475 -1.448 3.169 852 HB2 ARG 115 2HB ARG 115 9.801 -2.449 2.338 853 HB3 ARG 115 1HB ARG 115 9.390 -4.156 2.288 854 HG2 ARG 115 2HG ARG 115 11.609 -4.897 2.140 855 HG3 ARG 115 1HG ARG 115 12.264 -3.340 1.661 856 HD2 ARG 115 2HD ARG 115 11.121 -3.974 4.435 857 HD3 ARG 115 1HD ARG 115 12.816 -3.989 4.002 858 HH11 ARG 115 2HH1 ARG 115 10.717 -2.702 5.882 859 HH12 ARG 115 1HH1 ARG 115 10.515 -1.013 6.571 860 HH21 ARG 115 1HH2 ARG 115 12.082 0.252 3.785 861 HH22 ARG 115 2HH2 ARG 115 11.140 0.698 5.295 862 H MET 116 H MET 116 8.560 -5.461 0.242 863 HA MET 116 HA MET 116 5.817 -4.205 -0.462 864 HB2 MET 116 2HB MET 116 7.331 -6.518 -1.625 865 HB3 MET 116 1HB MET 116 5.682 -6.946 -1.173 866 HG2 MET 116 2HG MET 116 4.907 -5.035 -2.678 867 HG3 MET 116 1HG MET 116 6.584 -4.830 -3.181 868 HE1 MET 116 3HE MET 116 4.689 -5.436 -5.372 869 HE2 MET 116 1HE MET 116 3.484 -6.447 -4.493 870 HE3 MET 116 2HE MET 116 4.416 -7.136 -5.851 871 H VAL 117 H VAL 117 4.908 -3.995 1.533 872 HA VAL 117 HA VAL 117 4.867 -6.262 3.604 873 HB VAL 117 HB VAL 117 4.186 -3.264 3.679 874 HG11 VAL 117 1HG1 VAL 117 3.882 -3.307 6.059 875 HG12 VAL 117 2HG1 VAL 117 4.329 -5.044 6.195 876 HG13 VAL 117 3HG1 VAL 117 2.806 -4.536 5.463 877 HG21 VAL 117 3HG2 VAL 117 6.533 -4.847 4.870 878 HG22 VAL 117 1HG2 VAL 117 6.210 -3.155 5.287 879 HG23 VAL 117 2HG2 VAL 117 6.644 -3.603 3.623 880 H LEU 118 H LEU 118 3.559 -7.334 1.860 881 HA LEU 118 HA LEU 118 0.581 -6.923 1.744 882 HG LEU 118 HG LEU 118 -0.214 -9.714 0.863 883 HB2 LEU 118 2HB LEU 118 1.385 -7.872 -0.152 884 HB3 LEU 118 1HB LEU 118 2.691 -8.759 0.549 885 HD11 LEU 118 1HD1 LEU 118 0.432 -11.327 -1.062 886 HD12 LEU 118 2HD1 LEU 118 1.793 -10.238 -1.448 887 HD13 LEU 118 3HD1 LEU 118 0.104 -9.668 -1.541 888 HD21 LEU 118 3HD2 LEU 118 1.154 -11.993 0.981 889 HD22 LEU 118 1HD2 LEU 118 1.235 -10.925 2.386 890 HD23 LEU 118 2HD2 LEU 118 2.567 -10.978 1.199 891 H SER 119 H SER 119 -0.966 -8.187 2.622 892 HA SER 119 HA SER 119 -0.332 -9.908 5.119 893 HG SER 119 HG SER 119 -1.430 -7.440 7.074 894 HB2 SER 119 2HB SER 119 -2.150 -7.463 4.796 895 HB3 SER 119 1HB SER 119 -2.646 -8.748 5.890 896 H ARG 120 H ARG 120 -0.983 -11.945 4.686 897 HA ARG 120 HA ARG 120 -3.038 -12.433 2.548 898 HE ARG 120 HE ARG 120 0.922 -15.096 4.580 899 HB2 ARG 120 2HB ARG 120 -1.737 -14.692 4.092 900 HB3 ARG 120 1HB ARG 120 -2.397 -14.686 2.471 901 HG2 ARG 120 2HG ARG 120 -0.480 -13.372 1.620 902 HG3 ARG 120 1HG ARG 120 0.207 -13.168 3.226 903 HD2 ARG 120 2HD ARG 120 -0.163 -15.941 1.914 904 HD3 ARG 120 1HD ARG 120 1.284 -14.937 1.755 905 HH11 ARG 120 2HH1 ARG 120 1.563 -17.359 2.047 906 HH12 ARG 120 1HH1 ARG 120 2.656 -18.343 3.154 907 HH21 ARG 120 1HH2 ARG 120 2.082 -16.273 5.768 908 HH22 ARG 120 2HH2 ARG 120 3.160 -17.535 5.088 909 H VAL 121 H VAL 121 -5.162 -12.338 3.135 910 HA VAL 121 HA VAL 121 -6.025 -13.183 5.929 911 HB VAL 121 HB VAL 121 -7.743 -11.568 4.015 912 HG11 VAL 121 1HG1 VAL 121 -8.934 -12.441 6.003 913 HG12 VAL 121 2HG1 VAL 121 -8.764 -10.705 6.172 914 HG13 VAL 121 3HG1 VAL 121 -7.705 -11.786 7.105 915 HG21 VAL 121 3HG2 VAL 121 -6.881 -9.507 5.592 916 HG22 VAL 121 1HG2 VAL 121 -6.173 -9.921 4.052 917 HG23 VAL 121 2HG2 VAL 121 -5.355 -10.429 5.517 918 HA PRO 122 HA PRO 122 -7.249 -16.689 3.210 919 HB2 PRO 122 2HB PRO 122 -7.466 -18.758 5.039 920 HB3 PRO 122 1HB PRO 122 -5.953 -18.088 4.420 921 HG2 PRO 122 2HG PRO 122 -7.337 -17.421 7.078 922 HG3 PRO 122 1HG PRO 122 -5.613 -17.758 6.816 923 HD2 PRO 122 2HD PRO 122 -6.569 -15.190 7.012 924 HD3 PRO 122 1HD PRO 122 -5.210 -15.591 5.932 925 H GLY 123 H GLY 123 -9.493 -16.374 6.033 926 HA2 GLY 123 2HA GLY 123 -11.658 -17.889 4.449 927 HA3 GLY 123 1HA GLY 123 -11.817 -17.338 6.107 928 H GLU 124 H GLU 124 -10.828 -14.667 4.332 929 HA GLU 124 HA GLU 124 -13.754 -13.741 4.033 930 HB2 GLU 124 2HB GLU 124 -11.192 -12.151 4.570 931 HB3 GLU 124 1HB GLU 124 -12.818 -11.499 4.515 932 HG2 GLU 124 2HG GLU 124 -13.429 -12.967 6.553 933 HG3 GLU 124 1HG GLU 124 -11.751 -13.472 6.664 934 H TYR 125 H TYR 125 -13.770 -14.798 1.902 935 HA TYR 125 HA TYR 125 -12.037 -13.507 -0.231 936 HD1 TYR 125 HD2 TYR 125 -14.101 -17.062 1.177 937 HD2 TYR 125 HD1 TYR 125 -10.105 -16.741 -0.361 938 HE1 TYR 125 HE2 TYR 125 -13.511 -19.233 2.211 939 HE2 TYR 125 HE1 TYR 125 -9.570 -18.935 0.588 940 HH TYR 125 HH TYR 125 -11.651 -20.504 2.821 941 HB2 TYR 125 2HB TYR 125 -13.428 -15.960 -1.167 942 HB3 TYR 125 1HB TYR 125 -11.808 -15.423 -1.366 943 H GLU 126 H GLU 126 -12.819 -12.471 -1.966 944 HA GLU 126 HA GLU 126 -15.861 -12.290 -2.325 945 HB2 GLU 126 2HB GLU 126 -13.753 -10.064 -2.542 946 HB3 GLU 126 1HB GLU 126 -15.490 -9.877 -2.696 947 HG2 GLU 126 2HG GLU 126 -14.027 -10.751 -0.099 948 HG3 GLU 126 1HG GLU 126 -14.567 -9.142 -0.449 949 H GLY 127 H GLY 127 -13.299 -10.988 -4.375 950 HA2 GLY 127 2HA GLY 127 -12.928 -12.086 -6.725 951 HA3 GLY 127 1HA GLY 127 -14.656 -12.363 -6.784 952 H ASP 128 H ASP 128 -13.403 -9.204 -5.937 953 HA ASP 128 HA ASP 128 -14.122 -8.173 -8.750 954 HB2 ASP 128 2HB ASP 128 -14.820 -6.945 -6.023 955 HB3 ASP 128 1HB ASP 128 -14.927 -6.063 -7.532 956 H THR 129 H THR 129 -12.181 -6.917 -5.916 957 HA THR 129 HA THR 129 -10.357 -5.560 -7.878 958 HB THR 129 HB THR 129 -9.995 -5.641 -4.844 959 HG1 THR 129 HG1 THR 129 -11.680 -4.490 -4.682 960 HG21 THR 129 3HG2 THR 129 -8.148 -4.469 -6.320 961 HG22 THR 129 1HG2 THR 129 -8.941 -3.460 -5.074 962 HG23 THR 129 2HG2 THR 129 -9.420 -3.311 -6.778 963 H TYR 130 H TYR 130 -8.361 -6.304 -8.522 964 HA TYR 130 HA TYR 130 -7.169 -8.810 -7.201 965 HD1 TYR 130 HD1 TYR 130 -9.932 -8.288 -9.723 966 HD2 TYR 130 HD2 TYR 130 -7.087 -11.429 -9.002 967 HE1 TYR 130 HE1 TYR 130 -11.743 -9.952 -9.780 968 HE2 TYR 130 HE2 TYR 130 -8.888 -13.089 -9.150 969 HH TYR 130 HH TYR 130 -11.147 -13.305 -8.989 970 HB2 TYR 130 2HB TYR 130 -7.355 -7.943 -10.137 971 HB3 TYR 130 1HB TYR 130 -6.278 -9.206 -9.615 972 H TYR 131 H TYR 131 -5.192 -8.936 -6.558 973 HA TYR 131 HA TYR 131 -3.222 -6.656 -6.745 974 HD1 TYR 131 HD2 TYR 131 -0.742 -9.553 -5.642 975 HD2 TYR 131 HD1 TYR 131 -2.489 -6.496 -3.220 976 HE1 TYR 131 HE2 TYR 131 1.429 -9.200 -4.554 977 HE2 TYR 131 HE1 TYR 131 -0.379 -6.325 -1.951 978 HH TYR 131 HH TYR 131 1.777 -6.885 -1.886 979 HB2 TYR 131 2HB TYR 131 -3.890 -7.892 -4.610 980 HB3 TYR 131 1HB TYR 131 -3.273 -9.363 -5.228 981 HA PRO 132 HA PRO 132 -0.814 -8.934 -9.925 982 HB2 PRO 132 2HB PRO 132 1.678 -7.535 -9.503 983 HB3 PRO 132 1HB PRO 132 0.384 -7.119 -10.623 984 HG2 PRO 132 2HG PRO 132 1.093 -5.562 -8.374 985 HG3 PRO 132 1HG PRO 132 -0.483 -5.476 -9.166 986 HD2 PRO 132 2HD PRO 132 0.232 -7.003 -6.680 987 HD3 PRO 132 1HD PRO 132 -1.213 -6.012 -7.042 988 H GLU 133 H GLU 133 1.204 -10.119 -10.526 989 HA GLU 133 HA GLU 133 1.631 -12.267 -8.529 990 HB2 GLU 133 2HB GLU 133 2.595 -13.587 -10.314 991 HB3 GLU 133 1HB GLU 133 1.038 -12.904 -10.730 992 HG2 GLU 133 2HG GLU 133 2.569 -11.078 -12.059 993 HG3 GLU 133 1HG GLU 133 3.798 -12.335 -11.915 994 H TRP 134 H TRP 134 3.520 -13.162 -7.804 995 HA TRP 134 HA TRP 134 5.868 -11.224 -7.378 996 HD1 TRP 134 HD1 TRP 134 5.466 -15.255 -5.682 997 HE1 TRP 134 HE1 TRP 134 3.353 -16.660 -4.913 998 HE3 TRP 134 HE3 TRP 134 2.607 -11.277 -4.221 999 HZ2 TRP 134 HZ2 TRP 134 0.828 -15.940 -3.830 1000 HZ3 TRP 134 HZ3 TRP 134 0.319 -11.693 -3.400 1001 HH2 TRP 134 HH2 TRP 134 -0.554 -13.998 -3.177 1002 HB2 TRP 134 2HB TRP 134 6.149 -12.305 -5.120 1003 HB3 TRP 134 1HB TRP 134 4.714 -11.369 -5.341 1004 H ASP 135 H ASP 135 7.894 -11.817 -7.823 1005 HA ASP 135 HA ASP 135 8.453 -14.608 -8.921 1006 HB2 ASP 135 2HB ASP 135 8.554 -12.603 -10.441 1007 HB3 ASP 135 1HB ASP 135 9.723 -11.837 -9.384 1008 H ALA 136 H ALA 136 11.253 -13.894 -8.678 1009 HA ALA 136 HA ALA 136 11.963 -14.346 -5.764 1010 HB1 ALA 136 3HB ALA 136 12.589 -16.413 -8.033 1011 HB2 ALA 136 1HB ALA 136 11.617 -16.672 -6.552 1012 HB3 ALA 136 2HB ALA 136 13.376 -16.438 -6.430 1013 H ALA 137 H ALA 137 13.044 -13.342 -8.927 1014 HA ALA 137 HA ALA 137 15.694 -12.422 -7.681 1015 HB1 ALA 137 3HB ALA 137 15.100 -13.012 -10.653 1016 HB2 ALA 137 1HB ALA 137 16.085 -13.991 -9.538 1017 HB3 ALA 137 2HB ALA 137 16.624 -12.360 -9.999 1018 H GLU 138 H GLU 138 12.699 -11.053 -8.743 1019 HA GLU 138 HA GLU 138 13.798 -8.235 -8.718 1020 HB2 GLU 138 2HB GLU 138 10.939 -9.197 -8.188 1021 HB3 GLU 138 1HB GLU 138 11.448 -7.537 -8.341 1022 HG2 GLU 138 2HG GLU 138 12.257 -8.296 -10.809 1023 HG3 GLU 138 1HG GLU 138 11.182 -9.658 -10.520 1024 H TRP 139 H TRP 139 12.388 -10.407 -6.301 1025 HA TRP 139 HA TRP 139 13.452 -8.804 -3.959 1026 HD1 TRP 139 HD1 TRP 139 10.273 -11.032 -5.514 1027 HE1 TRP 139 HE1 TRP 139 8.650 -10.274 -7.410 1028 HE3 TRP 139 HE3 TRP 139 9.646 -6.190 -4.110 1029 HZ2 TRP 139 HZ2 TRP 139 7.119 -8.092 -7.980 1030 HZ3 TRP 139 HZ3 TRP 139 8.236 -4.736 -5.540 1031 HH2 TRP 139 HH2 TRP 139 6.956 -5.694 -7.408 1032 HB2 TRP 139 2HB TRP 139 11.062 -8.807 -2.882 1033 HB3 TRP 139 1HB TRP 139 11.527 -7.611 -4.060 1034 H GLU 140 H GLU 140 13.786 -9.840 -2.087 1035 HA GLU 140 HA GLU 140 13.038 -12.798 -1.878 1036 HB2 GLU 140 2HB GLU 140 14.889 -13.230 -0.542 1037 HB3 GLU 140 1HB GLU 140 15.470 -12.238 -1.849 1038 HG2 GLU 140 2HG GLU 140 15.233 -10.231 -0.013 1039 HG3 GLU 140 1HG GLU 140 15.154 -11.566 1.147 1040 H LEU 141 H LEU 141 13.252 -12.919 1.025 1041 HA LEU 141 HA LEU 141 10.527 -11.705 1.737 1042 HG LEU 141 HG LEU 141 9.188 -14.956 2.983 1043 HB2 LEU 141 2HB LEU 141 10.973 -14.405 1.441 1044 HB3 LEU 141 1HB LEU 141 11.474 -14.237 3.094 1045 HD11 LEU 141 1HD1 LEU 141 7.914 -13.346 4.299 1046 HD12 LEU 141 2HD1 LEU 141 8.900 -11.988 3.740 1047 HD13 LEU 141 3HD1 LEU 141 9.614 -13.201 4.800 1048 HD21 LEU 141 3HD2 LEU 141 8.342 -12.510 1.326 1049 HD22 LEU 141 1HD2 LEU 141 7.363 -13.922 1.766 1050 HD23 LEU 141 2HD2 LEU 141 8.700 -14.092 0.611 1051 H ASP 142 H ASP 142 10.900 -10.092 3.156 1052 HA ASP 142 HA ASP 142 13.393 -9.758 4.796 1053 HB2 ASP 142 2HB ASP 142 12.156 -7.918 3.461 1054 HB3 ASP 142 1HB ASP 142 10.861 -8.018 4.659 1055 H ALA 143 H ALA 143 9.830 -10.014 5.520 1056 HA ALA 143 HA ALA 143 10.488 -11.692 7.967 1057 HB1 ALA 143 3HB ALA 143 8.880 -9.032 8.135 1058 HB2 ALA 143 1HB ALA 143 10.541 -9.265 8.712 1059 HB3 ALA 143 2HB ALA 143 9.205 -10.136 9.497 1060 H GLU 144 H GLU 144 9.160 -13.422 8.032 1061 HA GLU 144 HA GLU 144 6.211 -13.063 7.302 1062 HB2 GLU 144 2HB GLU 144 7.685 -14.960 6.175 1063 HB3 GLU 144 1HB GLU 144 7.341 -15.872 7.652 1064 HG2 GLU 144 2HG GLU 144 4.834 -15.442 7.284 1065 HG3 GLU 144 1HG GLU 144 5.230 -14.467 5.895 1066 H THR 145 H THR 145 4.811 -12.775 8.864 1067 HA THR 145 HA THR 145 4.933 -14.549 11.285 1068 HB THR 145 HB THR 145 6.107 -12.594 12.145 1069 HG1 THR 145 HG1 THR 145 3.543 -13.138 13.238 1070 HG21 THR 145 3HG2 THR 145 5.192 -10.532 11.294 1071 HG22 THR 145 1HG2 THR 145 4.688 -10.604 12.976 1072 HG23 THR 145 2HG2 THR 145 3.516 -10.980 11.678 1073 H ASP 146 H ASP 146 2.999 -15.404 11.873 1074 HA ASP 146 HA ASP 146 0.444 -14.674 10.886 1075 HB2 ASP 146 2HB ASP 146 1.196 -16.038 13.536 1076 HB3 ASP 146 1HB ASP 146 -0.431 -16.001 12.868 1077 H HIS 147 H HIS 147 -1.308 -13.531 11.620 1078 HA HIS 147 HA HIS 147 -1.126 -11.682 14.039 1079 HD1 HIS 147 HD1 HIS 147 1.260 -10.975 13.190 1080 HD2 HIS 147 HD2 HIS 147 -1.295 -7.638 12.556 1081 HE1 HIS 147 HE1 HIS 147 2.484 -8.784 13.823 1082 HB2 HIS 147 2HB HIS 147 -1.030 -10.872 11.119 1083 HB3 HIS 147 1HB HIS 147 -2.306 -10.073 11.973 1084 H GLU 148 H GLU 148 -3.730 -10.402 13.495 1085 HA GLU 148 HA GLU 148 -5.235 -12.505 14.955 1086 HB2 GLU 148 2HB GLU 148 -6.168 -9.674 14.270 1087 HB3 GLU 148 1HB GLU 148 -7.043 -10.787 15.258 1088 HG2 GLU 148 2HG GLU 148 -5.274 -10.852 17.011 1089 HG3 GLU 148 1HG GLU 148 -4.190 -9.870 16.047 1090 H GLY 149 H GLY 149 -6.189 -10.800 11.934 1091 HA2 GLY 149 2HA GLY 149 -8.089 -13.093 11.145 1092 HA3 GLY 149 1HA GLY 149 -7.939 -11.585 10.303 1093 H PHE 150 H PHE 150 -4.798 -12.283 10.582 1094 HA PHE 150 HA PHE 150 -4.621 -13.766 7.924 1095 HD1 PHE 150 HD1 PHE 150 -1.695 -10.731 7.968 1096 HD2 PHE 150 HD2 PHE 150 -5.724 -9.574 8.843 1097 HE1 PHE 150 HE1 PHE 150 -0.864 -8.679 9.072 1098 HE2 PHE 150 HE2 PHE 150 -4.908 -7.495 9.827 1099 HZ PHE 150 HZ PHE 150 -2.483 -7.029 9.975 1100 HB2 PHE 150 2HB PHE 150 -3.797 -11.750 6.776 1101 HB3 PHE 150 1HB PHE 150 -5.359 -11.476 7.467 1102 H THR 151 H THR 151 -2.430 -13.643 6.887 1103 HA THR 151 HA THR 151 -0.150 -13.702 8.949 1104 HB THR 151 HB THR 151 -0.054 -15.849 8.598 1105 HG1 THR 151 HG1 THR 151 1.888 -15.035 7.853 1106 HG21 THR 151 3HG2 THR 151 -0.469 -17.216 6.593 1107 HG22 THR 151 1HG2 THR 151 -0.888 -15.765 5.668 1108 HG23 THR 151 2HG2 THR 151 -1.904 -16.281 7.021 1109 H LEU 152 H LEU 152 1.079 -12.140 8.835 1110 HA LEU 152 HA LEU 152 1.293 -10.058 6.737 1111 HG LEU 152 HG LEU 152 3.224 -8.352 9.661 1112 HB2 LEU 152 2HB LEU 152 1.347 -9.541 9.116 1113 HB3 LEU 152 1HB LEU 152 2.610 -10.683 9.433 1114 HD11 LEU 152 1HD1 LEU 152 5.071 -9.537 7.560 1115 HD12 LEU 152 2HD1 LEU 152 4.897 -10.311 9.137 1116 HD13 LEU 152 3HD1 LEU 152 5.462 -8.632 9.036 1117 HD21 LEU 152 3HD2 LEU 152 3.142 -8.115 6.578 1118 HD22 LEU 152 1HD2 LEU 152 3.820 -6.934 7.716 1119 HD23 LEU 152 2HD2 LEU 152 2.080 -7.275 7.722 1120 H GLN 153 H GLN 153 2.751 -9.901 5.169 1121 HA GLN 153 HA GLN 153 5.374 -11.500 5.160 1122 HB2 GLN 153 2HB GLN 153 3.096 -11.699 3.228 1123 HB3 GLN 153 1HB GLN 153 4.564 -11.182 2.416 1124 HG2 GLN 153 2HG GLN 153 5.752 -13.210 3.349 1125 HG3 GLN 153 1HG GLN 153 4.257 -13.732 4.124 1126 HE21 GLN 153 1HE2 GLN 153 5.194 -15.485 2.586 1127 HE22 GLN 153 2HE2 GLN 153 4.682 -15.340 0.799 1128 H GLU 154 H GLU 154 6.878 -10.005 5.310 1129 HA GLU 154 HA GLU 154 6.726 -7.410 3.693 1130 HB2 GLU 154 2HB GLU 154 8.863 -7.976 5.788 1131 HB3 GLU 154 1HB GLU 154 8.424 -6.470 5.038 1132 HG2 GLU 154 2HG GLU 154 6.047 -6.807 6.135 1133 HG3 GLU 154 1HG GLU 154 6.806 -8.024 7.120 1134 H TRP 155 H TRP 155 7.722 -7.448 1.772 1135 HA TRP 155 HA TRP 155 9.931 -9.477 1.118 1136 HD1 TRP 155 HD1 TRP 155 5.836 -9.481 0.771 1137 HE1 TRP 155 HE1 TRP 155 4.685 -11.750 -0.056 1138 HE3 TRP 155 HE3 TRP 155 9.720 -11.071 -2.114 1139 HZ2 TRP 155 HZ2 TRP 155 5.468 -13.724 -1.892 1140 HZ3 TRP 155 HZ3 TRP 155 9.409 -13.076 -3.524 1141 HH2 TRP 155 HH2 TRP 155 7.304 -14.380 -3.422 1142 HB2 TRP 155 2HB TRP 155 7.749 -8.080 -0.472 1143 HB3 TRP 155 1HB TRP 155 9.028 -8.892 -1.329 1144 H VAL 156 H VAL 156 11.998 -8.575 1.100 1145 HA VAL 156 HA VAL 156 12.357 -5.698 0.227 1146 HB VAL 156 HB VAL 156 13.334 -6.438 2.362 1147 HG11 VAL 156 1HG1 VAL 156 14.190 -8.704 1.889 1148 HG12 VAL 156 2HG1 VAL 156 15.500 -7.656 2.470 1149 HG13 VAL 156 3HG1 VAL 156 15.378 -8.058 0.735 1150 HG21 VAL 156 3HG2 VAL 156 15.341 -5.121 2.226 1151 HG22 VAL 156 1HG2 VAL 156 14.170 -4.388 1.120 1152 HG23 VAL 156 2HG2 VAL 156 15.485 -5.371 0.455 1153 H ARG 157 H ARG 157 13.004 -4.993 -1.636 1154 HA ARG 157 HA ARG 157 13.698 -6.476 -3.988 1155 HE ARG 157 HE ARG 157 14.325 -3.937 -7.217 1156 HB2 ARG 157 2HB ARG 157 14.114 -3.593 -3.121 1157 HB3 ARG 157 1HB ARG 157 15.057 -4.123 -4.485 1158 HG2 ARG 157 2HG ARG 157 12.720 -5.056 -5.490 1159 HG3 ARG 157 1HG ARG 157 12.025 -4.043 -4.229 1160 HD2 ARG 157 2HD ARG 157 12.096 -2.613 -6.165 1161 HD3 ARG 157 1HD ARG 157 13.384 -2.111 -5.047 1162 HH11 ARG 157 2HH1 ARG 157 13.833 -0.622 -6.277 1163 HH12 ARG 157 1HH1 ARG 157 15.305 -0.022 -7.124 1164 HH21 ARG 157 1HH2 ARG 157 16.028 -3.273 -8.134 1165 HH22 ARG 157 2HH2 ARG 157 16.516 -1.500 -8.161 1166 H SER 158 H SER 158 15.279 -7.366 -4.859 1167 HA SER 158 HA SER 158 17.108 -8.883 -3.935 1168 HG SER 158 HG SER 158 18.343 -6.419 -6.007 1169 HB2 SER 158 2HB SER 158 18.286 -8.969 -6.065 1170 HB3 SER 158 1HB SER 158 16.598 -8.605 -6.335 1171 H ALA 159 H ALA 159 18.426 -8.721 -2.184 1172 HA ALA 159 HA ALA 159 20.106 -6.378 -1.693 1173 HB1 ALA 159 3HB ALA 159 20.373 -7.545 0.540 1174 HB2 ALA 159 1HB ALA 159 19.580 -8.977 -0.139 1175 HB3 ALA 159 2HB ALA 159 18.669 -7.457 -0.002 1176 H SER 160 H SER 160 21.768 -6.621 -3.386 1177 HA SER 160 HA SER 160 23.878 -8.515 -3.255 1178 HG SER 160 HG SER 160 23.931 -4.965 -3.627 1179 HB2 SER 160 2HB SER 160 25.108 -7.284 -4.809 1180 HB3 SER 160 1HB SER 160 23.451 -6.786 -5.108 1181 H SER 161 H SER 161 24.090 -5.479 -1.391 1182 HA SER 161 HA SER 161 25.800 -6.414 0.631 1183 HG SER 161 HG SER 161 27.095 -4.806 -2.277 1184 HB2 SER 161 2HB SER 161 28.097 -5.709 0.239 1185 HB3 SER 161 1HB SER 161 27.628 -6.785 -1.054 1186 H ARG 162 H ARG 162 25.852 -4.895 2.300 1187 HA ARG 162 HA ARG 162 25.694 -1.925 1.578 1188 HE ARG 162 HE ARG 162 22.067 1.189 3.471 1189 HB2 ARG 162 1HB ARG 162 23.402 -3.003 2.256 1190 HB3 ARG 162 2HB ARG 162 24.035 -3.125 3.882 1191 HG2 ARG 162 1HG ARG 162 24.244 -0.596 4.013 1192 HG3 ARG 162 2HG ARG 162 23.810 -0.455 2.299 1193 HD2 ARG 162 1HD ARG 162 21.553 -1.581 2.809 1194 HD3 ARG 162 2HD ARG 162 21.992 -1.632 4.513 1195 HH11 ARG 162 2HH1 ARG 162 19.694 -1.243 4.405 1196 HH12 ARG 162 1HH1 ARG 162 18.544 0.109 4.816 1197 HH21 ARG 162 1HH2 ARG 162 20.647 2.641 4.060 1198 HH22 ARG 162 2HH2 ARG 162 19.047 2.039 4.643 Start of MODEL 8 1 HA MET 1 HA MET 1 16.295 5.651 2.199 2 H1 MET 1 1H MET 1 15.235 6.651 4.362 3 H2 MET 1 2H MET 1 15.162 7.687 3.062 4 H3 MET 1 3H MET 1 13.856 6.889 3.503 5 HB2 MET 1 1HB MET 1 13.875 4.249 3.512 6 HB3 MET 1 2HB MET 1 14.973 3.474 2.428 7 HG2 MET 1 1HG MET 1 16.581 3.102 3.979 8 HG3 MET 1 2HG MET 1 16.499 4.717 4.715 9 HE1 MET 1 3HE MET 1 17.035 3.117 6.858 10 HE2 MET 1 1HE MET 1 16.613 1.537 6.120 11 HE3 MET 1 2HE MET 1 15.807 2.070 7.625 12 H GLU 2 H GLU 2 13.708 4.059 1.074 13 HA GLU 2 HA GLU 2 12.362 6.333 -0.301 14 HB2 GLU 2 2HB GLU 2 12.210 5.227 -2.515 15 HB3 GLU 2 1HB GLU 2 13.680 6.008 -2.090 16 HG2 GLU 2 2HG GLU 2 13.942 3.100 -1.538 17 HG3 GLU 2 1HG GLU 2 13.413 3.358 -3.185 18 H LEU 3 H LEU 3 10.720 3.729 -1.517 19 HA LEU 3 HA LEU 3 8.870 4.020 0.904 20 HG LEU 3 HG LEU 3 8.989 5.922 -2.228 21 HB2 LEU 3 2HB LEU 3 6.885 4.177 -0.834 22 HB3 LEU 3 1HB LEU 3 7.790 5.506 -0.222 23 HD11 LEU 3 1HD1 LEU 3 9.251 3.423 -2.994 24 HD12 LEU 3 2HD1 LEU 3 8.890 4.572 -4.260 25 HD13 LEU 3 3HD1 LEU 3 7.593 3.524 -3.617 26 HD21 LEU 3 3HD2 LEU 3 6.732 6.889 -2.082 27 HD22 LEU 3 1HD2 LEU 3 5.981 5.381 -2.659 28 HD23 LEU 3 2HD2 LEU 3 6.953 6.371 -3.765 29 H VAL 4 H VAL 4 7.293 2.674 1.459 30 HA VAL 4 HA VAL 4 7.651 -0.218 0.553 31 HB VAL 4 HB VAL 4 7.203 0.911 3.331 32 HG11 VAL 4 1HG1 VAL 4 7.826 -1.507 4.117 33 HG12 VAL 4 2HG1 VAL 4 7.607 -1.996 2.426 34 HG13 VAL 4 3HG1 VAL 4 6.242 -1.339 3.303 35 HG21 VAL 4 3HG2 VAL 4 9.861 -0.132 2.234 36 HG22 VAL 4 1HG2 VAL 4 9.499 0.201 3.953 37 HG23 VAL 4 2HG2 VAL 4 9.465 1.500 2.769 38 H SER 5 H SER 5 5.888 -1.342 -0.149 39 HA SER 5 HA SER 5 3.197 0.007 -0.030 40 HG SER 5 HG SER 5 4.098 -3.323 -1.291 41 HB2 SER 5 2HB SER 5 2.722 -1.590 -1.909 42 HB3 SER 5 1HB SER 5 4.157 -0.595 -2.140 43 H VAL 6 H VAL 6 1.335 -0.696 0.972 44 HA VAL 6 HA VAL 6 1.547 -3.165 2.737 45 HB VAL 6 HB VAL 6 1.407 -2.309 4.744 46 HG11 VAL 6 1HG1 VAL 6 3.554 -1.343 3.982 47 HG12 VAL 6 2HG1 VAL 6 2.803 -0.176 5.075 48 HG13 VAL 6 3HG1 VAL 6 2.734 0.086 3.352 49 HG21 VAL 6 3HG2 VAL 6 -0.737 -1.012 4.657 50 HG22 VAL 6 1HG2 VAL 6 0.222 0.392 4.113 51 HG23 VAL 6 2HG2 VAL 6 0.505 -0.314 5.700 52 H ALA 7 H ALA 7 0.125 -4.339 1.456 53 HA ALA 7 HA ALA 7 -2.820 -3.371 1.401 54 HB1 ALA 7 3HB ALA 7 -1.340 -5.243 -0.579 55 HB2 ALA 7 1HB ALA 7 -1.776 -3.549 -0.879 56 HB3 ALA 7 2HB ALA 7 -3.050 -4.760 -0.674 57 H ALA 8 H ALA 8 -4.431 -4.672 2.326 58 HA ALA 8 HA ALA 8 -3.843 -7.483 3.284 59 HB1 ALA 8 3HB ALA 8 -6.339 -5.678 3.566 60 HB2 ALA 8 1HB ALA 8 -5.099 -5.898 4.803 61 HB3 ALA 8 2HB ALA 8 -6.135 -7.255 4.319 62 H LEU 9 H LEU 9 -4.544 -9.368 2.334 63 HA LEU 9 HA LEU 9 -6.616 -9.369 0.260 64 HG LEU 9 HG LEU 9 -3.126 -9.414 -2.202 65 HB2 LEU 9 2HB LEU 9 -5.323 -10.046 -1.704 66 HB3 LEU 9 1HB LEU 9 -5.168 -8.410 -1.232 67 HD11 LEU 9 1HD1 LEU 9 -2.687 -8.347 0.650 68 HD12 LEU 9 2HD1 LEU 9 -2.930 -7.356 -0.805 69 HD13 LEU 9 3HD1 LEU 9 -1.486 -8.349 -0.625 70 HD21 LEU 9 3HD2 LEU 9 -3.272 -11.692 -1.216 71 HD22 LEU 9 1HD2 LEU 9 -2.837 -11.038 0.398 72 HD23 LEU 9 2HD2 LEU 9 -1.669 -10.972 -0.935 73 H ALA 10 H ALA 10 -7.406 -11.298 -0.571 74 HA ALA 10 HA ALA 10 -6.669 -13.774 1.114 75 HB1 ALA 10 3HB ALA 10 -9.427 -12.765 0.105 76 HB2 ALA 10 1HB ALA 10 -8.760 -12.462 1.729 77 HB3 ALA 10 2HB ALA 10 -9.150 -14.107 1.221 78 H GLU 11 H GLU 11 -8.890 -15.224 -0.555 79 HA GLU 11 HA GLU 11 -7.087 -16.506 -2.509 80 HB2 GLU 11 2HB GLU 11 -8.784 -17.870 -1.458 81 HB3 GLU 11 1HB GLU 11 -10.097 -16.919 -2.124 82 HG2 GLU 11 2HG GLU 11 -9.861 -17.835 -4.321 83 HG3 GLU 11 1HG GLU 11 -8.172 -18.317 -4.086 84 H ASN 12 H ASN 12 -7.804 -16.709 -4.808 85 HA ASN 12 HA ASN 12 -6.652 -15.576 -6.557 86 HB2 ASN 12 2HB ASN 12 -9.512 -15.335 -6.546 87 HB3 ASN 12 1HB ASN 12 -9.001 -13.762 -7.042 88 HD21 ASN 12 1HD2 ASN 12 -7.295 -13.838 -8.856 89 HD22 ASN 12 2HD2 ASN 12 -7.701 -15.079 -10.161 90 H ARG 13 H ARG 13 -5.984 -14.146 -4.077 91 HA ARG 13 HA ARG 13 -4.935 -12.290 -3.278 92 HE ARG 13 HE ARG 13 -2.311 -14.342 -6.755 93 HB2 ARG 13 2HB ARG 13 -3.017 -11.450 -4.332 94 HB3 ARG 13 1HB ARG 13 -3.144 -13.174 -4.628 95 HG2 ARG 13 2HG ARG 13 -4.103 -12.504 -7.026 96 HG3 ARG 13 1HG ARG 13 -3.618 -10.880 -6.638 97 HD2 ARG 13 2HD ARG 13 -1.740 -11.528 -7.710 98 HD3 ARG 13 1HD ARG 13 -1.195 -11.908 -6.093 99 HH11 ARG 13 2HH1 ARG 13 -0.280 -12.330 -8.706 100 HH12 ARG 13 1HH1 ARG 13 0.118 -13.627 -9.907 101 HH21 ARG 13 1HH2 ARG 13 -1.855 -15.878 -8.089 102 HH22 ARG 13 2HH2 ARG 13 -0.729 -15.600 -9.504 103 H VAL 14 H VAL 14 -7.241 -11.667 -3.383 104 HA VAL 14 HA VAL 14 -7.895 -9.179 -4.862 105 HB VAL 14 HB VAL 14 -9.343 -11.089 -2.934 106 HG11 VAL 14 1HG1 VAL 14 -11.469 -9.966 -3.187 107 HG12 VAL 14 2HG1 VAL 14 -10.723 -8.559 -4.009 108 HG13 VAL 14 3HG1 VAL 14 -10.367 -8.924 -2.295 109 HG21 VAL 14 3HG2 VAL 14 -9.045 -11.760 -5.331 110 HG22 VAL 14 1HG2 VAL 14 -9.789 -10.253 -5.900 111 HG23 VAL 14 2HG2 VAL 14 -10.754 -11.451 -4.973 112 H ILE 15 H ILE 15 -7.045 -7.243 -4.242 113 HA ILE 15 HA ILE 15 -6.545 -6.379 -1.416 114 HB ILE 15 HB ILE 15 -6.994 -4.486 -3.770 115 HG12 ILE 15 2HG1 ILE 15 -4.073 -4.893 -3.071 116 HG13 ILE 15 1HG1 ILE 15 -4.805 -6.319 -3.728 117 HG21 ILE 15 1HG2 ILE 15 -5.260 -3.954 -1.262 118 HG22 ILE 15 2HG2 ILE 15 -6.933 -3.399 -1.437 119 HG23 ILE 15 3HG2 ILE 15 -5.677 -2.779 -2.516 120 HD11 ILE 15 3HD1 ILE 15 -3.805 -4.816 -5.546 121 HD12 ILE 15 1HD1 ILE 15 -4.999 -3.569 -5.145 122 HD13 ILE 15 2HD1 ILE 15 -5.520 -5.127 -5.804 123 H GLY 16 H GLY 16 -9.265 -5.868 -3.621 124 HA2 GLY 16 2HA GLY 16 -10.960 -4.614 -1.396 125 HA3 GLY 16 1HA GLY 16 -10.550 -3.565 -2.743 126 H ARG 17 H ARG 17 -13.075 -4.782 -1.760 127 HA ARG 17 HA ARG 17 -14.141 -5.892 -4.414 128 HE ARG 17 HE ARG 17 -18.447 -9.243 -2.514 129 HB2 ARG 17 2HB ARG 17 -13.924 -7.780 -2.926 130 HB3 ARG 17 1HB ARG 17 -14.750 -6.961 -1.590 131 HG2 ARG 17 2HG ARG 17 -16.874 -6.954 -2.711 132 HG3 ARG 17 1HG ARG 17 -16.200 -7.370 -4.266 133 HD2 ARG 17 2HD ARG 17 -15.568 -9.709 -3.311 134 HD3 ARG 17 1HD ARG 17 -16.194 -9.191 -1.740 135 HH11 ARG 17 2HH1 ARG 17 -16.396 -9.425 -5.329 136 HH12 ARG 17 1HH1 ARG 17 -17.794 -9.618 -6.443 137 HH21 ARG 17 1HH2 ARG 17 -19.965 -9.470 -3.770 138 HH22 ARG 17 2HH2 ARG 17 -19.761 -9.704 -5.580 139 H ASP 18 H ASP 18 -15.379 -4.530 -1.369 140 HA ASP 18 HA ASP 18 -17.752 -3.403 -2.836 141 HB2 ASP 18 2HB ASP 18 -16.972 -3.959 0.126 142 HB3 ASP 18 1HB ASP 18 -18.407 -3.053 -0.284 143 H GLY 19 H GLY 19 -16.500 -1.643 -0.110 144 HA2 GLY 19 2HA GLY 19 -15.775 0.785 -1.922 145 HA3 GLY 19 1HA GLY 19 -16.227 0.990 -0.259 146 H GLU 20 H GLU 20 -14.759 -0.406 1.254 147 HA GLU 20 HA GLU 20 -11.806 -0.124 0.510 148 HB2 GLU 20 2HB GLU 20 -11.341 -0.623 2.948 149 HB3 GLU 20 1HB GLU 20 -11.985 0.928 2.583 150 HG2 GLU 20 2HG GLU 20 -14.211 0.284 3.562 151 HG3 GLU 20 1HG GLU 20 -13.675 -1.373 3.779 152 H LEU 21 H LEU 21 -12.958 -2.624 2.658 153 HA LEU 21 HA LEU 21 -11.522 -4.650 0.886 154 HG LEU 21 HG LEU 21 -10.484 -2.581 3.018 155 HB2 LEU 21 2HB LEU 21 -11.885 -4.763 3.915 156 HB3 LEU 21 1HB LEU 21 -10.719 -5.634 2.957 157 HD11 LEU 21 1HD1 LEU 21 -11.006 -3.246 5.405 158 HD12 LEU 21 2HD1 LEU 21 -9.458 -2.436 5.155 159 HD13 LEU 21 3HD1 LEU 21 -9.505 -4.196 5.417 160 HD21 LEU 21 3HD2 LEU 21 -8.074 -3.000 2.949 161 HD22 LEU 21 1HD2 LEU 21 -8.862 -3.897 1.624 162 HD23 LEU 21 2HD2 LEU 21 -8.333 -4.754 3.084 163 HA PRO 22 HA PRO 22 -15.253 -7.423 1.371 164 HB2 PRO 22 2HB PRO 22 -13.678 -9.901 1.398 165 HB3 PRO 22 1HB PRO 22 -14.701 -9.240 0.130 166 HG2 PRO 22 2HG PRO 22 -11.841 -9.396 0.076 167 HG3 PRO 22 1HG PRO 22 -12.840 -8.492 -1.063 168 HD2 PRO 22 2HD PRO 22 -11.217 -7.382 1.212 169 HD3 PRO 22 1HD PRO 22 -11.776 -6.595 -0.270 170 H TRP 23 H TRP 23 -12.600 -7.694 3.600 171 HA TRP 23 HA TRP 23 -14.257 -9.093 5.711 172 HD1 TRP 23 HD1 TRP 23 -10.472 -6.519 6.647 173 HE1 TRP 23 HE1 TRP 23 -8.584 -5.967 4.906 174 HE3 TRP 23 HE3 TRP 23 -11.362 -10.469 3.628 175 HZ2 TRP 23 HZ2 TRP 23 -7.887 -7.114 2.419 176 HZ3 TRP 23 HZ3 TRP 23 -10.260 -10.555 1.438 177 HH2 TRP 23 HH2 TRP 23 -8.626 -8.820 0.783 178 HB2 TRP 23 2HB TRP 23 -12.048 -8.820 7.161 179 HB3 TRP 23 1HB TRP 23 -12.134 -10.011 5.886 180 HA PRO 24 HA PRO 24 -15.921 -5.540 7.536 181 HB2 PRO 24 2HB PRO 24 -16.358 -6.189 10.181 182 HB3 PRO 24 1HB PRO 24 -17.107 -7.021 8.816 183 HG2 PRO 24 2HG PRO 24 -14.518 -7.871 10.279 184 HG3 PRO 24 1HG PRO 24 -15.973 -8.873 10.076 185 HD2 PRO 24 2HD PRO 24 -13.929 -9.119 8.359 186 HD3 PRO 24 1HD PRO 24 -15.573 -9.087 7.671 187 H SER 25 H SER 25 -13.852 -5.937 10.394 188 HA SER 25 HA SER 25 -11.743 -4.172 9.563 189 HG SER 25 HG SER 25 -13.154 -2.545 8.652 190 HB2 SER 25 2HB SER 25 -13.939 -2.618 10.961 191 HB3 SER 25 1HB SER 25 -12.274 -2.189 11.343 192 H ILE 26 H ILE 26 -10.199 -5.248 10.566 193 HA ILE 26 HA ILE 26 -10.642 -6.313 13.368 194 HB ILE 26 HB ILE 26 -8.242 -7.399 12.797 195 HG12 ILE 26 2HG1 ILE 26 -8.253 -6.505 10.433 196 HG13 ILE 26 1HG1 ILE 26 -7.837 -8.169 10.692 197 HG21 ILE 26 1HG2 ILE 26 -10.100 -8.686 13.738 198 HG22 ILE 26 2HG2 ILE 26 -9.280 -9.546 12.418 199 HG23 ILE 26 3HG2 ILE 26 -10.868 -8.798 12.135 200 HD11 ILE 26 3HD1 ILE 26 -9.236 -7.955 8.659 201 HD12 ILE 26 1HD1 ILE 26 -10.579 -7.241 9.570 202 HD13 ILE 26 2HD1 ILE 26 -10.102 -8.928 9.855 203 HA PRO 27 HA PRO 27 -7.978 -2.989 15.078 204 HB2 PRO 27 2HB PRO 27 -7.469 -5.039 17.301 205 HB3 PRO 27 1HB PRO 27 -7.862 -3.309 17.411 206 HG2 PRO 27 2HG PRO 27 -9.868 -5.095 17.819 207 HG3 PRO 27 1HG PRO 27 -10.190 -3.731 16.713 208 HD2 PRO 27 2HD PRO 27 -9.311 -6.563 15.869 209 HD3 PRO 27 1HD PRO 27 -10.751 -5.617 15.341 210 H ALA 28 H ALA 28 -6.404 -6.240 15.096 211 HA ALA 28 HA ALA 28 -3.735 -5.324 14.763 212 HB1 ALA 28 3HB ALA 28 -3.288 -7.579 13.852 213 HB2 ALA 28 1HB ALA 28 -4.983 -7.763 13.372 214 HB3 ALA 28 2HB ALA 28 -4.533 -7.692 15.109 215 H ASP 29 H ASP 29 -6.161 -5.143 12.199 216 HA ASP 29 HA ASP 29 -4.147 -4.599 10.018 217 HB2 ASP 29 2HB ASP 29 -6.287 -5.735 9.409 218 HB3 ASP 29 1HB ASP 29 -7.223 -4.356 9.962 219 H LYS 30 H LYS 30 -6.847 -2.605 11.252 220 HA LYS 30 HA LYS 30 -5.620 -0.110 10.732 221 HB2 LYS 30 2HB LYS 30 -8.083 -0.900 11.943 222 HB3 LYS 30 1HB LYS 30 -7.327 0.069 13.161 223 HG2 LYS 30 2HG LYS 30 -8.624 1.609 11.985 224 HG3 LYS 30 1HG LYS 30 -7.019 1.968 11.385 225 HD2 LYS 30 2HD LYS 30 -7.603 0.673 9.235 226 HD3 LYS 30 1HD LYS 30 -9.134 0.221 9.944 227 HE2 LYS 30 2HE LYS 30 -9.294 3.038 10.162 228 HE3 LYS 30 1HE LYS 30 -8.211 2.907 8.787 229 HZ1 LYS 30 3HZ LYS 30 -10.710 3.036 8.378 230 HZ2 LYS 30 1HZ LYS 30 -10.910 1.489 8.838 231 HZ3 LYS 30 2HZ LYS 30 -10.020 1.780 7.520 232 H LYS 31 H LYS 31 -4.713 -2.034 13.494 233 HA LYS 31 HA LYS 31 -2.814 0.089 14.578 234 HB2 LYS 31 2HB LYS 31 -3.936 -1.430 16.220 235 HB3 LYS 31 1HB LYS 31 -3.238 -2.815 15.415 236 HG2 LYS 31 2HG LYS 31 -1.961 -2.581 17.354 237 HG3 LYS 31 1HG LYS 31 -0.931 -2.156 16.020 238 HD2 LYS 31 2HD LYS 31 -1.335 0.342 16.507 239 HD3 LYS 31 1HD LYS 31 -2.367 -0.129 17.844 240 HE2 LYS 31 2HE LYS 31 -0.217 0.400 18.850 241 HE3 LYS 31 1HE LYS 31 -0.422 -1.348 18.966 242 HZ1 LYS 31 3HZ LYS 31 0.873 -1.452 16.712 243 HZ2 LYS 31 1HZ LYS 31 1.819 -0.977 17.986 244 HZ3 LYS 31 2HZ LYS 31 1.262 0.113 16.874 245 H GLN 32 H GLN 32 -2.487 -2.754 12.392 246 HA GLN 32 HA GLN 32 0.512 -2.607 12.424 247 HB2 GLN 32 2HB GLN 32 -0.558 -4.759 12.014 248 HB3 GLN 32 1HB GLN 32 -1.334 -4.174 10.556 249 HG2 GLN 32 2HG GLN 32 1.754 -4.229 10.941 250 HG3 GLN 32 1HG GLN 32 0.870 -5.623 10.383 251 HE21 GLN 32 1HE2 GLN 32 -0.636 -4.985 8.412 252 HE22 GLN 32 2HE2 GLN 32 0.335 -4.166 7.080 253 H TYR 33 H TYR 33 -2.076 -1.697 10.079 254 HA TYR 33 HA TYR 33 -0.493 0.085 8.398 255 HD1 TYR 33 HD1 TYR 33 -4.303 1.444 10.043 256 HD2 TYR 33 HD2 TYR 33 -2.704 1.792 6.090 257 HE1 TYR 33 HE1 TYR 33 -5.910 3.229 9.559 258 HE2 TYR 33 HE2 TYR 33 -4.357 3.572 5.600 259 HH TYR 33 HH TYR 33 -5.992 5.350 7.599 260 HB2 TYR 33 2HB TYR 33 -2.496 -0.354 7.421 261 HB3 TYR 33 1HB TYR 33 -3.385 -0.492 8.868 262 H ARG 34 H ARG 34 -2.072 0.960 11.570 263 HA ARG 34 HA ARG 34 -0.806 3.674 11.225 264 HE ARG 34 HE ARG 34 -3.729 6.214 10.770 265 HB2 ARG 34 2HB ARG 34 -2.501 2.660 13.551 266 HB3 ARG 34 1HB ARG 34 -1.750 4.251 13.421 267 HG2 ARG 34 2HG ARG 34 -3.001 4.189 10.939 268 HG3 ARG 34 1HG ARG 34 -4.043 3.104 11.757 269 HD2 ARG 34 2HD ARG 34 -5.164 4.727 12.839 270 HD3 ARG 34 1HD ARG 34 -3.696 5.330 13.613 271 HH11 ARG 34 2HH1 ARG 34 -5.202 6.989 13.812 272 HH12 ARG 34 1HH1 ARG 34 -5.639 8.657 13.209 273 HH21 ARG 34 1HH2 ARG 34 -4.267 8.027 10.135 274 HH22 ARG 34 2HH2 ARG 34 -5.156 9.201 11.196 275 H SER 35 H SER 35 0.498 0.929 12.920 276 HA SER 35 HA SER 35 2.783 2.791 13.863 277 HG SER 35 HG SER 35 1.525 2.259 15.558 278 HB2 SER 35 2HB SER 35 2.384 -0.150 14.577 279 HB3 SER 35 1HB SER 35 3.731 0.882 15.069 280 H ARG 36 H ARG 36 1.963 0.982 11.242 281 HA ARG 36 HA ARG 36 4.766 1.092 10.046 282 HE ARG 36 HE ARG 36 3.800 -2.729 8.569 283 HB2 ARG 36 2HB ARG 36 2.906 -0.751 9.614 284 HB3 ARG 36 1HB ARG 36 2.033 0.486 8.743 285 HG2 ARG 36 2HG ARG 36 3.111 -0.778 7.104 286 HG3 ARG 36 1HG ARG 36 4.008 0.718 7.184 287 HD2 ARG 36 2HD ARG 36 5.567 -1.176 6.968 288 HD3 ARG 36 1HD ARG 36 5.820 -0.460 8.554 289 HH11 ARG 36 2HH1 ARG 36 7.158 -2.228 8.359 290 HH12 ARG 36 1HH1 ARG 36 7.516 -3.909 8.922 291 HH21 ARG 36 1HH2 ARG 36 4.232 -4.580 9.369 292 HH22 ARG 36 2HH2 ARG 36 5.984 -5.112 9.546 293 H VAL 37 H VAL 37 1.515 2.618 9.278 294 HA VAL 37 HA VAL 37 3.027 4.732 7.725 295 HB VAL 37 HB VAL 37 1.467 4.839 6.173 296 HG11 VAL 37 1HG1 VAL 37 0.854 1.912 6.837 297 HG12 VAL 37 2HG1 VAL 37 2.360 2.470 6.081 298 HG13 VAL 37 3HG1 VAL 37 0.816 2.671 5.221 299 HG21 VAL 37 3HG2 VAL 37 -0.632 5.385 7.259 300 HG22 VAL 37 1HG2 VAL 37 -0.807 3.774 7.935 301 HG23 VAL 37 2HG2 VAL 37 -0.975 4.007 6.195 302 H ALA 38 H ALA 38 1.379 4.932 10.726 303 HA ALA 38 HA ALA 38 -0.206 7.361 10.007 304 HB1 ALA 38 3HB ALA 38 -0.894 7.574 12.302 305 HB2 ALA 38 1HB ALA 38 0.291 6.370 12.833 306 HB3 ALA 38 2HB ALA 38 -1.061 5.885 11.781 307 H ASP 39 H ASP 39 3.018 6.984 11.307 308 HA ASP 39 HA ASP 39 3.519 9.937 11.476 309 HB2 ASP 39 2HB ASP 39 5.005 7.417 12.217 310 HB3 ASP 39 1HB ASP 39 6.007 8.579 11.414 311 H ASP 40 H ASP 40 4.447 7.333 9.126 312 HA ASP 40 HA ASP 40 5.593 9.269 7.322 313 HB2 ASP 40 2HB ASP 40 5.187 6.243 7.374 314 HB3 ASP 40 1HB ASP 40 5.879 6.984 5.936 315 HA PRO 41 HA PRO 41 2.374 10.162 4.167 316 HB2 PRO 41 2HB PRO 41 4.792 9.992 2.252 317 HB3 PRO 41 1HB PRO 41 3.501 11.190 2.261 318 HG2 PRO 41 2HG PRO 41 5.848 11.856 3.444 319 HG3 PRO 41 1HG PRO 41 4.390 12.133 4.423 320 HD2 PRO 41 2HD PRO 41 6.270 9.716 4.623 321 HD3 PRO 41 1HD PRO 41 5.604 10.783 5.895 322 H VAL 42 H VAL 42 0.975 8.923 2.987 323 HA VAL 42 HA VAL 42 1.956 6.342 1.727 324 HB VAL 42 HB VAL 42 -0.864 7.135 2.590 325 HG11 VAL 42 1HG1 VAL 42 -0.883 5.279 0.826 326 HG12 VAL 42 2HG1 VAL 42 -1.370 4.685 2.424 327 HG13 VAL 42 3HG1 VAL 42 0.266 4.339 1.832 328 HG21 VAL 42 3HG2 VAL 42 1.387 5.498 3.957 329 HG22 VAL 42 1HG2 VAL 42 -0.313 5.294 4.428 330 HG23 VAL 42 2HG2 VAL 42 0.494 6.866 4.630 331 H VAL 43 H VAL 43 1.972 5.911 -0.372 332 HA VAL 43 HA VAL 43 0.513 7.688 -2.364 333 HB VAL 43 HB VAL 43 2.069 7.162 -4.051 334 HG11 VAL 43 1HG1 VAL 43 3.801 7.458 -1.498 335 HG12 VAL 43 2HG1 VAL 43 3.025 8.799 -2.304 336 HG13 VAL 43 3HG1 VAL 43 4.283 7.856 -3.146 337 HG21 VAL 43 3HG2 VAL 43 4.026 5.609 -3.807 338 HG22 VAL 43 1HG2 VAL 43 2.511 4.722 -3.723 339 HG23 VAL 43 2HG2 VAL 43 3.428 5.096 -2.226 340 H LEU 44 H LEU 44 -1.335 7.078 -3.289 341 HA LEU 44 HA LEU 44 -2.035 4.142 -3.684 342 HG LEU 44 HG LEU 44 -3.886 7.065 -2.344 343 HB2 LEU 44 2HB LEU 44 -3.879 4.211 -2.164 344 HB3 LEU 44 1HB LEU 44 -2.436 4.571 -1.314 345 HD11 LEU 44 1HD1 LEU 44 -5.172 5.290 -0.171 346 HD12 LEU 44 2HD1 LEU 44 -5.839 5.605 -1.780 347 HD13 LEU 44 3HD1 LEU 44 -5.703 6.936 -0.607 348 HD21 LEU 44 3HD2 LEU 44 -3.417 7.956 -0.159 349 HD22 LEU 44 1HD2 LEU 44 -1.959 7.115 -0.730 350 HD23 LEU 44 2HD2 LEU 44 -3.009 6.380 0.541 351 H GLY 45 H GLY 45 -4.775 4.142 -3.951 352 HA2 GLY 45 2HA GLY 45 -4.767 5.069 -6.874 353 HA3 GLY 45 1HA GLY 45 -5.575 3.621 -6.286 354 H ARG 46 H ARG 46 -7.330 4.456 -7.447 355 HA ARG 46 HA ARG 46 -9.080 6.309 -5.753 356 HE ARG 46 HE ARG 46 -11.503 8.720 -7.432 357 HB2 ARG 46 2HB ARG 46 -9.469 5.894 -8.755 358 HB3 ARG 46 1HB ARG 46 -10.681 6.545 -7.705 359 HG2 ARG 46 2HG ARG 46 -7.901 7.828 -8.046 360 HG3 ARG 46 1HG ARG 46 -9.309 8.319 -8.969 361 HD2 ARG 46 2HD ARG 46 -9.076 8.562 -5.887 362 HD3 ARG 46 1HD ARG 46 -8.766 9.847 -7.053 363 HH11 ARG 46 2HH1 ARG 46 -9.770 10.748 -5.207 364 HH12 ARG 46 1HH1 ARG 46 -11.296 11.616 -4.719 365 HH21 ARG 46 1HH2 ARG 46 -13.168 9.637 -6.795 366 HH22 ARG 46 2HH2 ARG 46 -13.132 11.016 -5.598 367 H THR 47 H THR 47 -8.949 2.913 -7.054 368 HA THR 47 HA THR 47 -11.209 2.109 -5.487 369 HB THR 47 HB THR 47 -8.555 0.548 -5.415 370 HG1 THR 47 HG1 THR 47 -10.553 0.014 -7.269 371 HG21 THR 47 3HG2 THR 47 -10.758 -0.195 -4.039 372 HG22 THR 47 1HG2 THR 47 -9.817 -1.367 -4.951 373 HG23 THR 47 2HG2 THR 47 -11.344 -0.738 -5.637 374 H THR 48 H THR 48 -7.834 2.197 -4.105 375 HA THR 48 HA THR 48 -8.810 2.132 -1.346 376 HB THR 48 HB THR 48 -6.414 2.657 -0.717 377 HG1 THR 48 HG1 THR 48 -5.025 2.048 -2.613 378 HG21 THR 48 3HG2 THR 48 -6.630 0.242 -2.578 379 HG22 THR 48 1HG2 THR 48 -7.338 0.251 -0.964 380 HG23 THR 48 2HG2 THR 48 -5.593 0.466 -1.155 381 H PHE 49 H PHE 49 -8.117 5.013 -3.320 382 HA PHE 49 HA PHE 49 -8.309 6.785 -0.887 383 HD1 PHE 49 HD2 PHE 49 -10.039 9.578 -2.559 384 HD2 PHE 49 HD1 PHE 49 -5.868 9.098 -1.664 385 HE1 PHE 49 HE2 PHE 49 -10.000 11.807 -1.520 386 HE2 PHE 49 HE1 PHE 49 -5.801 11.388 -0.779 387 HZ PHE 49 HZ PHE 49 -7.879 12.700 -0.606 388 HB2 PHE 49 2HB PHE 49 -6.942 7.411 -2.918 389 HB3 PHE 49 1HB PHE 49 -8.424 7.769 -3.779 390 H GLU 50 H GLU 50 -10.665 5.724 -3.334 391 HA GLU 50 HA GLU 50 -12.738 7.699 -2.479 392 HB2 GLU 50 2HB GLU 50 -12.977 5.186 -4.241 393 HB3 GLU 50 1HB GLU 50 -14.335 6.211 -3.819 394 HG2 GLU 50 2HG GLU 50 -13.258 8.221 -4.783 395 HG3 GLU 50 1HG GLU 50 -11.787 7.334 -5.165 396 H SER 51 H SER 51 -11.916 4.484 -1.263 397 HA SER 51 HA SER 51 -13.782 4.863 1.053 398 HG SER 51 HG SER 51 -13.335 1.633 1.486 399 HB2 SER 51 2HB SER 51 -11.713 2.807 0.369 400 HB3 SER 51 1HB SER 51 -11.776 3.238 2.094 401 H MET 52 H MET 52 -10.112 5.302 1.101 402 HA MET 52 HA MET 52 -10.036 6.515 3.646 403 HB2 MET 52 2HB MET 52 -8.275 7.209 1.209 404 HB3 MET 52 1HB MET 52 -7.926 7.732 2.868 405 HG2 MET 52 2HG MET 52 -7.640 5.457 3.677 406 HG3 MET 52 1HG MET 52 -7.833 4.831 1.989 407 HE1 MET 52 3HE MET 52 -5.172 4.596 3.652 408 HE2 MET 52 1HE MET 52 -3.974 5.065 2.403 409 HE3 MET 52 2HE MET 52 -5.396 4.050 1.959 410 H ARG 53 H ARG 53 -11.175 8.210 0.987 411 HA ARG 53 HA ARG 53 -11.280 10.962 1.917 412 HE ARG 53 HE ARG 53 -15.556 10.644 0.805 413 HB2 ARG 53 2HB ARG 53 -12.148 9.716 -0.306 414 HB3 ARG 53 1HB ARG 53 -13.572 9.359 0.656 415 HG2 ARG 53 2HG ARG 53 -13.574 12.023 1.130 416 HG3 ARG 53 1HG ARG 53 -12.403 12.094 -0.162 417 HD2 ARG 53 2HD ARG 53 -14.453 12.529 -1.231 418 HD3 ARG 53 1HD ARG 53 -14.128 10.825 -1.667 419 HH11 ARG 53 2HH1 ARG 53 -16.299 11.958 -2.297 420 HH12 ARG 53 1HH1 ARG 53 -18.103 11.954 -1.968 421 HH21 ARG 53 1HH2 ARG 53 -17.545 10.661 1.188 422 HH22 ARG 53 2HH2 ARG 53 -18.774 11.249 -0.024 423 H ASP 54 H ASP 54 -12.711 8.180 3.358 424 HA ASP 54 HA ASP 54 -13.989 9.849 5.533 425 HB2 ASP 54 2HB ASP 54 -14.796 7.268 4.311 426 HB3 ASP 54 1HB ASP 54 -14.349 6.966 5.962 427 H ASP 55 H ASP 55 -12.215 6.729 6.009 428 HA ASP 55 HA ASP 55 -10.580 7.978 8.159 429 HB2 ASP 55 2HB ASP 55 -11.148 5.181 7.329 430 HB3 ASP 55 1HB ASP 55 -9.453 5.355 7.662 431 H LEU 56 H LEU 56 -8.931 9.255 7.743 432 HA LEU 56 HA LEU 56 -7.165 8.988 5.404 433 HG LEU 56 HG LEU 56 -7.373 12.697 6.428 434 HB2 LEU 56 2HB LEU 56 -6.291 10.723 7.723 435 HB3 LEU 56 1HB LEU 56 -6.036 10.911 6.024 436 HD11 LEU 56 1HD1 LEU 56 -9.588 10.672 5.726 437 HD12 LEU 56 2HD1 LEU 56 -8.538 11.511 4.563 438 HD13 LEU 56 3HD1 LEU 56 -9.678 12.422 5.567 439 HD21 LEU 56 3HD2 LEU 56 -7.793 12.191 8.816 440 HD22 LEU 56 1HD2 LEU 56 -9.197 11.178 8.366 441 HD23 LEU 56 2HD2 LEU 56 -9.187 12.921 8.002 442 HA PRO 57 HA PRO 57 -3.993 6.219 7.206 443 HB2 PRO 57 2HB PRO 57 -1.937 6.461 5.441 444 HB3 PRO 57 1HB PRO 57 -3.506 5.785 4.999 445 HG2 PRO 57 2HG PRO 57 -2.533 8.657 4.478 446 HG3 PRO 57 1HG PRO 57 -3.294 7.521 3.331 447 HD2 PRO 57 2HD PRO 57 -4.711 9.455 4.719 448 HD3 PRO 57 1HD PRO 57 -5.470 7.899 4.238 449 H GLY 58 H GLY 58 -1.596 8.632 6.320 450 HA2 GLY 58 2HA GLY 58 -1.007 9.271 9.306 451 HA3 GLY 58 1HA GLY 58 0.255 8.793 8.162 452 H SER 59 H SER 59 1.406 10.670 8.675 453 HA SER 59 HA SER 59 0.569 13.356 8.373 454 HG SER 59 HG SER 59 3.949 14.251 8.630 455 HB2 SER 59 2HB SER 59 2.738 12.446 9.339 456 HB3 SER 59 1HB SER 59 3.353 12.245 7.692 457 H ALA 60 H ALA 60 0.507 11.387 5.691 458 HA ALA 60 HA ALA 60 -0.446 13.564 4.103 459 HB1 ALA 60 3HB ALA 60 1.709 14.345 3.530 460 HB2 ALA 60 1HB ALA 60 1.298 13.381 2.092 461 HB3 ALA 60 2HB ALA 60 2.398 12.734 3.337 462 H GLN 61 H GLN 61 -1.238 13.081 1.995 463 HA GLN 61 HA GLN 61 -1.764 10.118 1.418 464 HB2 GLN 61 2HB GLN 61 -3.483 11.442 2.961 465 HB3 GLN 61 1HB GLN 61 -3.972 12.260 1.490 466 HG2 GLN 61 2HG GLN 61 -4.412 9.928 0.450 467 HG3 GLN 61 1HG GLN 61 -3.978 9.203 1.972 468 HE21 GLN 61 1HE2 GLN 61 -5.736 11.565 3.300 469 HE22 GLN 61 2HE2 GLN 61 -7.364 10.694 3.121 470 H ILE 62 H ILE 62 -0.962 9.816 -0.499 471 HA ILE 62 HA ILE 62 -1.068 11.927 -2.711 472 HB ILE 62 HB ILE 62 0.821 9.647 -1.977 473 HG12 ILE 62 2HG1 ILE 62 1.678 12.492 -2.461 474 HG13 ILE 62 1HG1 ILE 62 0.879 12.155 -0.931 475 HG21 ILE 62 1HG2 ILE 62 0.700 9.649 -4.523 476 HG22 ILE 62 2HG2 ILE 62 2.275 10.156 -3.903 477 HG23 ILE 62 3HG2 ILE 62 1.107 11.383 -4.493 478 HD11 ILE 62 3HD1 ILE 62 3.555 11.063 -1.965 479 HD12 ILE 62 1HD1 ILE 62 2.753 10.369 -0.501 480 HD13 ILE 62 2HD1 ILE 62 3.255 12.055 -0.535 481 H VAL 63 H VAL 63 -2.566 11.492 -4.318 482 HA VAL 63 HA VAL 63 -2.969 8.597 -5.157 483 HB VAL 63 HB VAL 63 -4.534 11.055 -5.933 484 HG11 VAL 63 1HG1 VAL 63 -4.833 8.161 -7.011 485 HG12 VAL 63 2HG1 VAL 63 -4.449 9.581 -8.001 486 HG13 VAL 63 3HG1 VAL 63 -6.054 9.438 -7.243 487 HG21 VAL 63 3HG2 VAL 63 -6.379 9.717 -4.762 488 HG22 VAL 63 1HG2 VAL 63 -4.984 9.989 -3.716 489 HG23 VAL 63 2HG2 VAL 63 -5.198 8.402 -4.465 490 H MET 64 H MET 64 -1.651 7.618 -6.403 491 HA MET 64 HA MET 64 -0.151 8.894 -8.674 492 HB2 MET 64 2HB MET 64 -0.381 6.088 -7.426 493 HB3 MET 64 1HB MET 64 0.074 6.170 -9.084 494 HG2 MET 64 2HG MET 64 1.774 8.171 -7.830 495 HG3 MET 64 1HG MET 64 1.711 6.813 -6.725 496 HE1 MET 64 3HE MET 64 2.218 8.035 -10.409 497 HE2 MET 64 1HE MET 64 1.411 6.510 -10.908 498 HE3 MET 64 2HE MET 64 3.166 6.709 -11.156 499 H SER 65 H SER 65 -1.715 9.874 -9.817 500 HA SER 65 HA SER 65 -2.865 8.230 -12.014 501 HG SER 65 HG SER 65 -6.016 7.865 -11.691 502 HB2 SER 65 2HB SER 65 -4.658 8.072 -10.136 503 HB3 SER 65 1HB SER 65 -4.927 9.798 -10.311 504 H ARG 66 H ARG 66 -4.436 9.924 -13.279 505 HA ARG 66 HA ARG 66 -3.069 12.661 -13.493 506 HE ARG 66 HE ARG 66 -3.622 7.413 -15.168 507 HB2 ARG 66 2HB ARG 66 -3.242 12.640 -15.966 508 HB3 ARG 66 1HB ARG 66 -1.982 11.689 -15.260 509 HG2 ARG 66 2HG ARG 66 -4.607 10.340 -16.158 510 HG3 ARG 66 1HG ARG 66 -3.397 10.802 -17.331 511 HD2 ARG 66 2HD ARG 66 -1.860 9.129 -16.754 512 HD3 ARG 66 1HD ARG 66 -2.170 9.272 -15.064 513 HH11 ARG 66 2HH1 ARG 66 -3.572 8.784 -18.335 514 HH12 ARG 66 1HH1 ARG 66 -4.451 7.359 -19.065 515 HH21 ARG 66 1HH2 ARG 66 -4.578 5.804 -15.993 516 HH22 ARG 66 2HH2 ARG 66 -4.986 5.743 -17.763 517 H SER 67 H SER 67 -5.255 12.096 -11.979 518 HA SER 67 HA SER 67 -7.553 13.603 -13.303 519 HG SER 67 HG SER 67 -9.583 12.179 -12.157 520 HB2 SER 67 2HB SER 67 -7.633 11.408 -11.698 521 HB3 SER 67 1HB SER 67 -7.432 12.598 -10.406 522 H GLU 68 H GLU 68 -8.663 15.043 -11.301 523 HA GLU 68 HA GLU 68 -7.036 17.496 -11.186 524 HB2 GLU 68 2HB GLU 68 -9.829 16.638 -10.202 525 HB3 GLU 68 1HB GLU 68 -9.172 18.126 -9.614 526 HG2 GLU 68 2HG GLU 68 -9.627 17.538 -12.595 527 HG3 GLU 68 1HG GLU 68 -10.572 18.606 -11.564 528 H ARG 69 H ARG 69 -7.183 18.838 -9.101 529 HA ARG 69 HA ARG 69 -5.896 17.354 -6.728 530 HE ARG 69 HE ARG 69 -2.354 21.313 -8.028 531 HB2 ARG 69 2HB ARG 69 -5.135 20.162 -7.791 532 HB3 ARG 69 1HB ARG 69 -4.752 19.601 -6.165 533 HG2 ARG 69 2HG ARG 69 -3.606 17.543 -7.286 534 HG3 ARG 69 1HG ARG 69 -3.691 18.416 -8.799 535 HD2 ARG 69 2HD ARG 69 -2.385 19.636 -6.243 536 HD3 ARG 69 1HD ARG 69 -1.516 18.498 -7.209 537 HH11 ARG 69 2HH1 ARG 69 -0.778 18.410 -9.095 538 HH12 ARG 69 1HH1 ARG 69 0.385 19.304 -10.164 539 HH21 ARG 69 1HH2 ARG 69 -0.970 22.330 -9.207 540 HH22 ARG 69 2HH2 ARG 69 0.228 21.432 -10.240 541 H SER 70 H SER 70 -6.308 18.082 -4.700 542 HA SER 70 HA SER 70 -7.401 19.188 -2.905 543 HG SER 70 HG SER 70 -7.270 21.273 -5.082 544 HB2 SER 70 2HB SER 70 -9.410 20.587 -4.722 545 HB3 SER 70 1HB SER 70 -9.152 20.841 -2.997 546 H PHE 71 H PHE 71 -8.076 17.399 -1.945 547 HA PHE 71 HA PHE 71 -10.411 15.812 -3.137 548 HD1 PHE 71 HD1 PHE 71 -9.905 14.017 -4.670 549 HD2 PHE 71 HD2 PHE 71 -6.057 14.306 -2.767 550 HE1 PHE 71 HE1 PHE 71 -8.846 12.876 -6.595 551 HE2 PHE 71 HE2 PHE 71 -5.046 13.103 -4.658 552 HZ PHE 71 HZ PHE 71 -6.428 12.387 -6.563 553 HB2 PHE 71 2HB PHE 71 -7.982 14.914 -1.492 554 HB3 PHE 71 1HB PHE 71 -9.325 13.910 -1.931 555 H SER 72 H SER 72 -9.207 15.973 0.267 556 HA SER 72 HA SER 72 -11.940 16.608 1.256 557 HG SER 72 HG SER 72 -13.550 14.030 1.926 558 HB2 SER 72 2HB SER 72 -11.024 13.715 1.500 559 HB3 SER 72 1HB SER 72 -11.784 14.447 2.914 560 H VAL 73 H VAL 73 -8.999 15.118 2.686 561 HA VAL 73 HA VAL 73 -9.001 17.154 4.934 562 HB VAL 73 HB VAL 73 -8.443 14.811 5.465 563 HG11 VAL 73 1HG1 VAL 73 -7.211 13.974 3.495 564 HG12 VAL 73 2HG1 VAL 73 -6.160 13.829 4.909 565 HG13 VAL 73 3HG1 VAL 73 -5.890 15.147 3.754 566 HG21 VAL 73 3HG2 VAL 73 -5.950 16.540 5.997 567 HG22 VAL 73 1HG2 VAL 73 -6.560 15.182 6.955 568 HG23 VAL 73 2HG2 VAL 73 -7.459 16.716 6.885 569 H ASP 74 H ASP 74 -7.268 18.560 5.364 570 HA ASP 74 HA ASP 74 -5.954 20.043 3.265 571 HB2 ASP 74 2HB ASP 74 -4.588 20.964 5.182 572 HB3 ASP 74 1HB ASP 74 -6.324 21.103 5.298 573 H THR 75 H THR 75 -4.293 17.651 5.403 574 HA THR 75 HA THR 75 -2.089 17.364 3.552 575 HB THR 75 HB THR 75 -2.172 16.829 6.083 576 HG1 THR 75 HG1 THR 75 -0.235 15.695 5.645 577 HG21 THR 75 3HG2 THR 75 -2.743 13.933 5.150 578 HG22 THR 75 1HG2 THR 75 -3.835 14.951 6.119 579 HG23 THR 75 2HG2 THR 75 -2.265 14.472 6.779 580 H ALA 76 H ALA 76 -4.157 17.062 1.833 581 HA ALA 76 HA ALA 76 -3.611 14.293 0.653 582 HB1 ALA 76 3HB ALA 76 -5.747 14.026 1.682 583 HB2 ALA 76 1HB ALA 76 -5.995 14.027 -0.075 584 HB3 ALA 76 2HB ALA 76 -6.431 15.472 0.898 585 H HIS 77 H HIS 77 -3.163 14.187 -1.300 586 HA HIS 77 HA HIS 77 -2.995 16.637 -3.139 587 HD1 HIS 77 HD1 HIS 77 -0.392 15.806 0.653 588 HD2 HIS 77 HD2 HIS 77 -1.457 18.979 -2.006 589 HE1 HIS 77 HE1 HIS 77 -0.121 18.061 1.830 590 HB2 HIS 77 2HB HIS 77 -0.678 15.083 -1.820 591 HB3 HIS 77 1HB HIS 77 -0.483 16.381 -3.007 592 H ARG 78 H ARG 78 -1.666 15.962 -5.174 593 HA ARG 78 HA ARG 78 -2.370 13.100 -6.014 594 HE ARG 78 HE ARG 78 -4.280 14.515 -10.735 595 HB2 ARG 78 2HB ARG 78 -4.268 14.788 -6.561 596 HB3 ARG 78 1HB ARG 78 -3.230 15.422 -7.816 597 HG2 ARG 78 2HG ARG 78 -4.080 12.461 -7.581 598 HG3 ARG 78 1HG ARG 78 -5.043 13.651 -8.432 599 HD2 ARG 78 2HD ARG 78 -2.173 12.806 -9.194 600 HD3 ARG 78 1HD ARG 78 -3.650 12.190 -9.918 601 HH11 ARG 78 2HH1 ARG 78 -0.918 13.956 -10.056 602 HH12 ARG 78 1HH1 ARG 78 -0.370 15.149 -11.292 603 HH21 ARG 78 1HH2 ARG 78 -3.722 15.773 -12.073 604 HH22 ARG 78 2HH2 ARG 78 -1.961 16.175 -12.449 605 H ALA 79 H ALA 79 -0.495 12.256 -6.492 606 HA ALA 79 HA ALA 79 1.710 13.649 -7.982 607 HB1 ALA 79 3HB ALA 79 1.220 10.722 -7.045 608 HB2 ALA 79 1HB ALA 79 2.239 11.971 -6.251 609 HB3 ALA 79 2HB ALA 79 2.713 11.267 -7.814 610 H ALA 80 H ALA 80 2.308 13.353 -10.150 611 HA ALA 80 HA ALA 80 0.514 11.657 -11.990 612 HB1 ALA 80 3HB ALA 80 0.791 13.939 -12.740 613 HB2 ALA 80 1HB ALA 80 1.688 12.909 -13.864 614 HB3 ALA 80 2HB ALA 80 2.564 13.833 -12.642 615 H SER 81 H SER 81 3.748 11.275 -10.698 616 HA SER 81 HA SER 81 3.981 8.670 -12.258 617 HG SER 81 HG SER 81 6.874 9.415 -13.970 618 HB2 SER 81 2HB SER 81 5.125 10.724 -13.451 619 HB3 SER 81 1HB SER 81 6.266 10.766 -12.103 620 H VAL 82 H VAL 82 6.498 7.916 -11.384 621 HA VAL 82 HA VAL 82 6.189 7.436 -8.382 622 HB VAL 82 HB VAL 82 8.308 6.300 -10.295 623 HG11 VAL 82 1HG1 VAL 82 9.565 6.530 -8.266 624 HG12 VAL 82 2HG1 VAL 82 8.917 4.896 -8.144 625 HG13 VAL 82 3HG1 VAL 82 8.165 6.227 -7.233 626 HG21 VAL 82 3HG2 VAL 82 5.787 5.132 -8.990 627 HG22 VAL 82 1HG2 VAL 82 7.149 4.066 -9.283 628 HG23 VAL 82 2HG2 VAL 82 6.421 4.940 -10.646 629 H GLU 83 H GLU 83 8.902 8.780 -10.401 630 HA GLU 83 HA GLU 83 10.085 10.396 -8.485 631 HB2 GLU 83 2HB GLU 83 9.642 11.358 -11.345 632 HB3 GLU 83 1HB GLU 83 10.947 11.757 -10.261 633 HG2 GLU 83 2HG GLU 83 10.692 8.797 -11.116 634 HG3 GLU 83 1HG GLU 83 11.245 9.965 -12.285 635 H GLU 84 H GLU 84 6.968 11.426 -10.062 636 HA GLU 84 HA GLU 84 6.837 14.005 -8.530 637 HB2 GLU 84 2HB GLU 84 4.585 12.336 -9.743 638 HB3 GLU 84 1HB GLU 84 4.390 13.956 -9.141 639 HG2 GLU 84 2HG GLU 84 6.397 13.931 -11.379 640 HG3 GLU 84 1HG GLU 84 4.917 13.151 -11.839 641 H ALA 85 H ALA 85 6.063 10.765 -7.723 642 HA ALA 85 HA ALA 85 4.366 11.452 -5.302 643 HB1 ALA 85 3HB ALA 85 4.156 9.001 -4.991 644 HB2 ALA 85 1HB ALA 85 5.354 8.679 -6.245 645 HB3 ALA 85 2HB ALA 85 3.772 9.365 -6.691 646 H VAL 86 H VAL 86 7.705 10.482 -6.066 647 HA VAL 86 HA VAL 86 8.497 10.363 -3.145 648 HB VAL 86 HB VAL 86 9.944 9.805 -5.770 649 HG11 VAL 86 1HG1 VAL 86 12.093 9.444 -4.567 650 HG12 VAL 86 2HG1 VAL 86 11.408 10.190 -3.088 651 HG13 VAL 86 3HG1 VAL 86 11.629 11.150 -4.574 652 HG21 VAL 86 3HG2 VAL 86 8.677 7.927 -4.539 653 HG22 VAL 86 1HG2 VAL 86 9.720 8.191 -3.128 654 HG23 VAL 86 2HG2 VAL 86 10.417 7.599 -4.649 655 H ASP 87 H ASP 87 9.130 12.753 -5.843 656 HA ASP 87 HA ASP 87 10.215 14.750 -4.093 657 HB2 ASP 87 2HB ASP 87 9.026 14.737 -6.889 658 HB3 ASP 87 1HB ASP 87 8.925 16.268 -6.079 659 H ILE 88 H ILE 88 6.644 14.221 -4.666 660 HA ILE 88 HA ILE 88 6.148 16.539 -2.855 661 HB ILE 88 HB ILE 88 4.038 16.536 -2.733 662 HG12 ILE 88 2HG1 ILE 88 3.321 13.909 -4.131 663 HG13 ILE 88 1HG1 ILE 88 3.635 13.934 -2.427 664 HG21 ILE 88 1HG2 ILE 88 4.926 17.171 -5.062 665 HG22 ILE 88 2HG2 ILE 88 3.175 16.846 -4.985 666 HG23 ILE 88 3HG2 ILE 88 4.292 15.631 -5.655 667 HD11 ILE 88 3HD1 ILE 88 1.419 14.471 -2.178 668 HD12 ILE 88 1HD1 ILE 88 1.276 15.201 -3.794 669 HD13 ILE 88 2HD1 ILE 88 1.939 16.111 -2.413 670 H ALA 89 H ALA 89 6.399 13.098 -2.143 671 HA ALA 89 HA ALA 89 5.645 13.386 0.731 672 HB1 ALA 89 3HB ALA 89 7.385 11.281 -0.698 673 HB2 ALA 89 1HB ALA 89 5.644 11.158 -0.353 674 HB3 ALA 89 2HB ALA 89 6.803 11.187 0.981 675 H ALA 90 H ALA 90 8.880 13.529 -0.870 676 HA ALA 90 HA ALA 90 10.288 14.307 1.644 677 HB1 ALA 90 3HB ALA 90 12.188 14.733 -0.044 678 HB2 ALA 90 1HB ALA 90 11.040 14.417 -1.355 679 HB3 ALA 90 2HB ALA 90 11.432 13.126 -0.192 680 H SER 91 H SER 91 8.572 16.253 -0.684 681 HA SER 91 HA SER 91 9.727 18.898 0.186 682 HG SER 91 HG SER 91 7.060 20.169 -1.869 683 HB2 SER 91 2HB SER 91 8.764 18.357 -2.134 684 HB3 SER 91 1HB SER 91 7.187 18.118 -1.388 685 H LEU 92 H LEU 92 7.207 16.865 1.468 686 HA LEU 92 HA LEU 92 6.014 19.159 3.054 687 HG LEU 92 HG LEU 92 5.374 15.794 1.687 688 HB2 LEU 92 2HB LEU 92 4.230 17.638 3.858 689 HB3 LEU 92 1HB LEU 92 4.254 18.187 2.212 690 HD11 LEU 92 1HD1 LEU 92 3.814 15.182 4.269 691 HD12 LEU 92 2HD1 LEU 92 5.564 14.998 4.013 692 HD13 LEU 92 3HD1 LEU 92 4.454 14.003 3.089 693 HD21 LEU 92 3HD2 LEU 92 3.169 16.604 0.745 694 HD22 LEU 92 1HD2 LEU 92 2.345 16.095 2.242 695 HD23 LEU 92 2HD2 LEU 92 3.116 14.896 1.179 696 H ASP 93 H ASP 93 7.168 15.903 4.116 697 HA ASP 93 HA ASP 93 9.487 16.705 5.339 698 HB2 ASP 93 2HB ASP 93 7.317 17.480 7.301 699 HB3 ASP 93 1HB ASP 93 8.585 16.525 8.001 700 H ALA 94 H ALA 94 10.093 14.598 4.710 701 HA ALA 94 HA ALA 94 9.613 12.429 6.716 702 HB1 ALA 94 3HB ALA 94 8.448 12.014 3.875 703 HB2 ALA 94 1HB ALA 94 7.507 12.271 5.359 704 HB3 ALA 94 2HB ALA 94 8.481 10.808 5.195 705 H GLU 95 H GLU 95 11.048 10.819 6.773 706 HA GLU 95 HA GLU 95 13.232 10.642 4.685 707 HB2 GLU 95 2HB GLU 95 13.424 8.608 6.881 708 HB3 GLU 95 1HB GLU 95 14.635 9.413 5.911 709 HG2 GLU 95 2HG GLU 95 14.230 11.523 7.430 710 HG3 GLU 95 1HG GLU 95 13.268 10.453 8.446 711 H THR 96 H THR 96 10.849 8.295 6.094 712 HA THR 96 HA THR 96 11.028 6.632 3.539 713 HB THR 96 HB THR 96 9.364 5.055 4.862 714 HG1 THR 96 HG1 THR 96 9.259 6.634 6.634 715 HG21 THR 96 3HG2 THR 96 11.258 3.795 5.865 716 HG22 THR 96 1HG2 THR 96 12.331 5.207 5.723 717 HG23 THR 96 2HG2 THR 96 11.708 4.389 4.246 718 H ALA 97 H ALA 97 9.043 5.840 2.649 719 HA ALA 97 HA ALA 97 6.486 7.116 3.539 720 HB1 ALA 97 3HB ALA 97 6.966 8.723 1.798 721 HB2 ALA 97 1HB ALA 97 5.750 7.653 1.070 722 HB3 ALA 97 2HB ALA 97 7.465 7.496 0.614 723 H TYR 98 H TYR 98 4.571 6.044 2.452 724 HA TYR 98 HA TYR 98 5.053 3.064 1.977 725 HD1 TYR 98 HD1 TYR 98 4.958 0.912 4.224 726 HD2 TYR 98 HD2 TYR 98 4.838 4.945 5.619 727 HE1 TYR 98 HE1 TYR 98 6.715 0.391 5.889 728 HE2 TYR 98 HE2 TYR 98 6.532 4.395 7.330 729 HH TYR 98 HH TYR 98 7.905 2.961 8.082 730 HB2 TYR 98 2HB TYR 98 3.126 4.174 4.116 731 HB3 TYR 98 1HB TYR 98 3.097 2.516 3.572 732 H VAL 99 H VAL 99 2.915 1.914 1.396 733 HA VAL 99 HA VAL 99 1.067 3.593 -0.348 734 HB VAL 99 HB VAL 99 2.051 3.309 -2.238 735 HG11 VAL 99 1HG1 VAL 99 4.239 1.476 -1.258 736 HG12 VAL 99 2HG1 VAL 99 4.236 3.220 -1.343 737 HG13 VAL 99 3HG1 VAL 99 4.149 2.285 -2.825 738 HG21 VAL 99 3HG2 VAL 99 2.129 1.301 -3.671 739 HG22 VAL 99 1HG2 VAL 99 0.574 1.476 -2.823 740 HG23 VAL 99 2HG2 VAL 99 1.771 0.312 -2.266 741 H ILE 100 H ILE 100 -0.878 2.948 0.713 742 HA ILE 100 HA ILE 100 -1.557 0.208 1.140 743 HB ILE 100 HB ILE 100 -3.836 2.086 0.385 744 HG12 ILE 100 2HG1 ILE 100 -2.819 3.267 2.092 745 HG13 ILE 100 1HG1 ILE 100 -4.069 2.389 2.922 746 HG21 ILE 100 1HG2 ILE 100 -3.856 -0.369 2.236 747 HG22 ILE 100 2HG2 ILE 100 -4.532 -0.369 0.597 748 HG23 ILE 100 3HG2 ILE 100 -5.259 0.651 1.852 749 HD11 ILE 100 3HD1 ILE 100 -1.107 1.482 2.967 750 HD12 ILE 100 1HD1 ILE 100 -2.460 0.815 3.915 751 HD13 ILE 100 2HD1 ILE 100 -1.855 2.497 4.199 752 H GLY 101 H GLY 101 -1.916 1.689 -1.783 753 HA2 GLY 101 2HA GLY 101 -1.863 0.766 -3.939 754 HA3 GLY 101 1HA GLY 101 -1.213 -0.658 -3.232 755 H GLY 102 H GLY 102 -2.191 -2.025 -4.845 756 HA2 GLY 102 2HA GLY 102 -4.497 -0.307 -5.960 757 HA3 GLY 102 1HA GLY 102 -2.868 -0.243 -6.481 758 H ALA 103 H ALA 103 -5.799 -1.735 -7.220 759 HA ALA 103 HA ALA 103 -5.436 -3.079 -9.586 760 HB1 ALA 103 3HB ALA 103 -7.456 -1.558 -8.809 761 HB2 ALA 103 1HB ALA 103 -7.173 -1.448 -10.526 762 HB3 ALA 103 2HB ALA 103 -6.654 -0.173 -9.471 763 H ALA 104 H ALA 104 -4.189 0.238 -9.487 764 HA ALA 104 HA ALA 104 -2.280 -0.457 -11.790 765 HB1 ALA 104 3HB ALA 104 -2.034 1.947 -12.268 766 HB2 ALA 104 1HB ALA 104 -3.218 2.352 -11.004 767 HB3 ALA 104 2HB ALA 104 -3.733 1.422 -12.445 768 H ILE 105 H ILE 105 -2.423 0.431 -8.381 769 HA ILE 105 HA ILE 105 0.167 1.929 -8.392 770 HB ILE 105 HB ILE 105 -1.065 0.987 -5.844 771 HG12 ILE 105 2HG1 ILE 105 -3.059 1.940 -6.880 772 HG13 ILE 105 1HG1 ILE 105 -2.512 2.927 -5.587 773 HG21 ILE 105 1HG2 ILE 105 0.466 3.586 -6.401 774 HG22 ILE 105 2HG2 ILE 105 1.109 2.151 -5.590 775 HG23 ILE 105 3HG2 ILE 105 -0.207 3.068 -4.853 776 HD11 ILE 105 3HD1 ILE 105 -1.514 3.653 -8.431 777 HD12 ILE 105 1HD1 ILE 105 -2.109 4.733 -7.129 778 HD13 ILE 105 2HD1 ILE 105 -3.265 3.761 -8.098 779 H TYR 106 H TYR 106 -0.549 -1.105 -6.580 780 HA TYR 106 HA TYR 106 2.247 -1.840 -6.087 781 HD1 TYR 106 HD1 TYR 106 2.888 -4.687 -5.212 782 HD2 TYR 106 HD2 TYR 106 -0.373 -2.690 -3.225 783 HE1 TYR 106 HE1 TYR 106 3.736 -5.394 -3.051 784 HE2 TYR 106 HE2 TYR 106 0.561 -3.365 -1.040 785 HH TYR 106 HH TYR 106 2.410 -4.451 0.036 786 HB2 TYR 106 2HB TYR 106 -0.451 -3.083 -5.665 787 HB3 TYR 106 1HB TYR 106 0.638 -4.228 -6.339 788 H ALA 107 H ALA 107 0.151 -2.632 -8.890 789 HA ALA 107 HA ALA 107 2.153 -4.195 -10.402 790 HB1 ALA 107 3HB ALA 107 -0.380 -2.632 -11.200 791 HB2 ALA 107 1HB ALA 107 -0.309 -4.344 -10.741 792 HB3 ALA 107 2HB ALA 107 0.437 -3.799 -12.258 793 H LEU 108 H LEU 108 1.632 -0.671 -10.280 794 HA LEU 108 HA LEU 108 3.817 -0.296 -12.356 795 HG LEU 108 HG LEU 108 2.543 2.162 -9.841 796 HB2 LEU 108 2HB LEU 108 3.219 1.786 -12.772 797 HB3 LEU 108 1HB LEU 108 1.674 1.171 -12.290 798 HD11 LEU 108 1HD1 LEU 108 4.706 3.066 -11.066 799 HD12 LEU 108 2HD1 LEU 108 3.790 4.227 -10.097 800 HD13 LEU 108 3HD1 LEU 108 3.638 4.238 -11.860 801 HD21 LEU 108 3HD2 LEU 108 1.230 4.260 -10.361 802 HD22 LEU 108 1HD2 LEU 108 0.349 2.783 -10.764 803 HD23 LEU 108 2HD2 LEU 108 1.130 3.754 -12.061 804 H PHE 109 H PHE 109 3.441 0.207 -8.836 805 HA PHE 109 HA PHE 109 6.209 1.184 -8.489 806 HD1 PHE 109 HD2 PHE 109 7.150 2.329 -6.120 807 HD2 PHE 109 HD1 PHE 109 2.946 2.676 -6.928 808 HE1 PHE 109 HE2 PHE 109 7.314 4.738 -5.852 809 HE2 PHE 109 HE1 PHE 109 3.117 5.110 -6.631 810 HZ PHE 109 HZ PHE 109 5.321 6.159 -6.117 811 HB2 PHE 109 2HB PHE 109 3.928 0.418 -6.572 812 HB3 PHE 109 1HB PHE 109 5.526 0.345 -5.934 813 H GLN 110 H GLN 110 5.103 -2.137 -8.556 814 HA GLN 110 HA GLN 110 6.756 -3.549 -6.884 815 HB2 GLN 110 2HB GLN 110 6.926 -5.377 -8.638 816 HB3 GLN 110 1HB GLN 110 5.381 -4.926 -8.003 817 HG2 GLN 110 2HG GLN 110 4.625 -3.866 -9.999 818 HG3 GLN 110 1HG GLN 110 6.169 -3.789 -10.742 819 HE21 GLN 110 1HE2 GLN 110 7.153 -6.256 -10.789 820 HE22 GLN 110 2HE2 GLN 110 5.953 -7.364 -11.629 821 HA PRO 111 HA PRO 111 11.163 -3.377 -8.768 822 HB2 PRO 111 2HB PRO 111 11.758 -1.834 -10.968 823 HB3 PRO 111 1HB PRO 111 11.079 -3.469 -11.112 824 HG2 PRO 111 2HG PRO 111 9.538 -0.806 -11.218 825 HG3 PRO 111 1HG PRO 111 9.490 -2.161 -12.396 826 HD2 PRO 111 2HD PRO 111 7.597 -1.947 -10.424 827 HD3 PRO 111 1HD PRO 111 8.218 -3.537 -10.985 828 H HIS 112 H HIS 112 9.266 -0.664 -8.053 829 HA HIS 112 HA HIS 112 11.674 1.201 -7.636 830 HD1 HIS 112 HD1 HIS 112 12.005 2.674 -9.862 831 HD2 HIS 112 HD2 HIS 112 7.834 1.894 -10.345 832 HE1 HIS 112 HE1 HIS 112 11.336 2.873 -12.363 833 HB2 HIS 112 2HB HIS 112 8.715 2.013 -7.824 834 HB3 HIS 112 1HB HIS 112 10.102 3.073 -7.658 835 H LEU 113 H LEU 113 9.477 -0.703 -5.740 836 HA LEU 113 HA LEU 113 9.511 1.017 -3.341 837 HG LEU 113 HG LEU 113 6.906 -1.250 -2.266 838 HB2 LEU 113 2HB LEU 113 9.144 -2.044 -3.539 839 HB3 LEU 113 1HB LEU 113 9.042 -1.136 -2.050 840 HD11 LEU 113 1HD1 LEU 113 7.208 1.054 -4.273 841 HD12 LEU 113 2HD1 LEU 113 7.259 1.217 -2.508 842 HD13 LEU 113 3HD1 LEU 113 5.760 0.710 -3.313 843 HD21 LEU 113 3HD2 LEU 113 7.144 -1.478 -5.320 844 HD22 LEU 113 1HD2 LEU 113 5.607 -1.553 -4.394 845 HD23 LEU 113 2HD2 LEU 113 6.865 -2.780 -4.159 846 H ASP 114 H ASP 114 10.563 0.861 -1.481 847 HA ASP 114 HA ASP 114 13.240 -0.460 -1.100 848 HB2 ASP 114 2HB ASP 114 12.847 1.714 -0.113 849 HB3 ASP 114 1HB ASP 114 11.318 1.237 0.614 850 H ARG 115 H ARG 115 9.880 -0.997 0.291 851 HA ARG 115 HA ARG 115 10.425 -4.000 0.110 852 HE ARG 115 HE ARG 115 12.107 -1.650 3.401 853 HB2 ARG 115 2HB ARG 115 9.859 -2.370 2.649 854 HB3 ARG 115 1HB ARG 115 9.098 -3.949 2.542 855 HG2 ARG 115 2HG ARG 115 11.077 -5.145 2.578 856 HG3 ARG 115 1HG ARG 115 12.065 -3.841 1.958 857 HD2 ARG 115 2HD ARG 115 10.839 -3.792 4.803 858 HD3 ARG 115 1HD ARG 115 12.391 -4.498 4.381 859 HH11 ARG 115 2HH1 ARG 115 13.394 -3.716 5.909 860 HH12 ARG 115 1HH1 ARG 115 14.515 -2.385 6.469 861 HH21 ARG 115 1HH2 ARG 115 13.335 -0.316 3.966 862 HH22 ARG 115 2HH2 ARG 115 14.474 -0.441 5.404 863 H MET 116 H MET 116 8.703 -5.400 0.006 864 HA MET 116 HA MET 116 5.912 -4.234 -0.594 865 HB2 MET 116 2HB MET 116 7.375 -6.705 -1.629 866 HB3 MET 116 1HB MET 116 5.620 -6.605 -1.674 867 HG2 MET 116 2HG MET 116 5.760 -4.614 -3.195 868 HG3 MET 116 1HG MET 116 7.496 -4.505 -2.907 869 HE1 MET 116 3HE MET 116 4.839 -7.387 -3.882 870 HE2 MET 116 1HE MET 116 5.488 -7.855 -5.477 871 HE3 MET 116 2HE MET 116 4.774 -6.236 -5.261 872 H VAL 117 H VAL 117 5.508 -3.950 1.644 873 HA VAL 117 HA VAL 117 4.922 -6.217 3.446 874 HB VAL 117 HB VAL 117 4.097 -3.300 3.468 875 HG11 VAL 117 1HG1 VAL 117 3.611 -5.315 5.760 876 HG12 VAL 117 2HG1 VAL 117 2.339 -4.548 4.778 877 HG13 VAL 117 3HG1 VAL 117 3.344 -3.550 5.842 878 HG21 VAL 117 3HG2 VAL 117 5.742 -3.028 5.294 879 HG22 VAL 117 1HG2 VAL 117 6.564 -3.874 3.960 880 HG23 VAL 117 2HG2 VAL 117 6.019 -4.783 5.382 881 H LEU 118 H LEU 118 3.434 -7.635 3.304 882 HA LEU 118 HA LEU 118 0.728 -7.106 1.931 883 HG LEU 118 HG LEU 118 -0.124 -9.443 0.833 884 HB2 LEU 118 2HB LEU 118 2.193 -8.150 0.367 885 HB3 LEU 118 1HB LEU 118 2.854 -9.287 1.503 886 HD11 LEU 118 1HD1 LEU 118 2.175 -10.149 -1.071 887 HD12 LEU 118 2HD1 LEU 118 0.499 -9.595 -1.375 888 HD13 LEU 118 3HD1 LEU 118 0.796 -11.277 -0.987 889 HD21 LEU 118 3HD2 LEU 118 0.671 -10.920 2.607 890 HD22 LEU 118 1HD2 LEU 118 2.014 -11.536 1.610 891 HD23 LEU 118 2HD2 LEU 118 0.326 -11.890 1.152 892 H SER 119 H SER 119 -1.055 -8.136 2.810 893 HA SER 119 HA SER 119 -0.774 -9.556 5.544 894 HG SER 119 HG SER 119 -1.806 -6.551 6.762 895 HB2 SER 119 2HB SER 119 -2.375 -7.127 4.646 896 HB3 SER 119 1HB SER 119 -3.062 -8.167 5.890 897 H ARG 120 H ARG 120 -1.146 -11.666 4.955 898 HA ARG 120 HA ARG 120 -3.133 -12.393 2.851 899 HE ARG 120 HE ARG 120 -0.436 -16.440 2.446 900 HB2 ARG 120 2HB ARG 120 -1.606 -14.299 4.694 901 HB3 ARG 120 1HB ARG 120 -2.496 -14.776 3.262 902 HG2 ARG 120 2HG ARG 120 -0.840 -13.752 1.756 903 HG3 ARG 120 1HG ARG 120 -0.227 -12.768 3.074 904 HD2 ARG 120 2HD ARG 120 1.451 -14.371 2.427 905 HD3 ARG 120 1HD ARG 120 1.027 -14.418 4.128 906 HH11 ARG 120 2HH1 ARG 120 2.570 -15.933 4.289 907 HH12 ARG 120 1HH1 ARG 120 2.671 -17.615 4.740 908 HH21 ARG 120 1HH2 ARG 120 -0.234 -18.437 3.007 909 HH22 ARG 120 2HH2 ARG 120 1.188 -18.974 4.026 910 H VAL 121 H VAL 121 -5.289 -12.387 3.316 911 HA VAL 121 HA VAL 121 -6.251 -12.970 6.113 912 HB VAL 121 HB VAL 121 -7.957 -11.792 3.910 913 HG11 VAL 121 1HG1 VAL 121 -9.141 -12.574 6.021 914 HG12 VAL 121 2HG1 VAL 121 -9.229 -10.821 5.813 915 HG13 VAL 121 3HG1 VAL 121 -8.103 -11.500 6.986 916 HG21 VAL 121 3HG2 VAL 121 -7.343 -9.496 5.209 917 HG22 VAL 121 1HG2 VAL 121 -6.384 -10.069 3.864 918 HG23 VAL 121 2HG2 VAL 121 -5.811 -10.336 5.507 919 HA PRO 122 HA PRO 122 -7.877 -17.014 4.427 920 HB2 PRO 122 2HB PRO 122 -8.326 -17.637 7.363 921 HB3 PRO 122 1HB PRO 122 -7.477 -18.570 6.117 922 HG2 PRO 122 2HG PRO 122 -6.065 -17.234 8.051 923 HG3 PRO 122 1HG PRO 122 -5.468 -17.205 6.365 924 HD2 PRO 122 2HD PRO 122 -7.143 -15.045 7.758 925 HD3 PRO 122 1HD PRO 122 -5.619 -14.910 6.819 926 H GLY 123 H GLY 123 -9.751 -14.956 4.306 927 HA2 GLY 123 2HA GLY 123 -12.382 -16.442 5.039 928 HA3 GLY 123 1HA GLY 123 -12.373 -14.741 4.782 929 H GLU 124 H GLU 124 -10.485 -15.999 2.465 930 HA GLU 124 HA GLU 124 -10.637 -16.454 0.127 931 HB2 GLU 124 2HB GLU 124 -12.415 -18.472 1.550 932 HB3 GLU 124 1HB GLU 124 -11.842 -18.686 -0.093 933 HG2 GLU 124 2HG GLU 124 -9.531 -18.862 0.557 934 HG3 GLU 124 1HG GLU 124 -9.805 -18.191 2.157 935 H TYR 125 H TYR 125 -11.348 -15.116 -1.477 936 HA TYR 125 HA TYR 125 -14.331 -14.638 -1.888 937 HD1 TYR 125 HD1 TYR 125 -15.820 -12.543 0.158 938 HD2 TYR 125 HD2 TYR 125 -11.618 -12.917 0.901 939 HE1 TYR 125 HE1 TYR 125 -16.221 -12.260 2.583 940 HE2 TYR 125 HE2 TYR 125 -12.032 -12.665 3.325 941 HH TYR 125 HH TYR 125 -13.484 -12.179 4.844 942 HB2 TYR 125 2HB TYR 125 -12.396 -12.293 -1.317 943 HB3 TYR 125 1HB TYR 125 -14.091 -12.147 -1.673 944 H GLU 126 H GLU 126 -14.528 -14.819 -4.191 945 HA GLU 126 HA GLU 126 -12.924 -14.340 -6.178 946 HB2 GLU 126 2HB GLU 126 -15.580 -13.050 -6.865 947 HB3 GLU 126 1HB GLU 126 -14.568 -14.137 -7.773 948 HG2 GLU 126 2HG GLU 126 -16.399 -15.011 -5.446 949 HG3 GLU 126 1HG GLU 126 -16.800 -15.086 -7.151 950 H GLY 127 H GLY 127 -14.589 -11.447 -5.073 951 HA2 GLY 127 2HA GLY 127 -13.794 -9.123 -4.997 952 HA3 GLY 127 1HA GLY 127 -12.252 -9.723 -5.535 953 H ASP 128 H ASP 128 -13.202 -7.251 -6.114 954 HA ASP 128 HA ASP 128 -13.181 -7.341 -9.187 955 HB2 ASP 128 2HB ASP 128 -14.310 -5.164 -7.312 956 HB3 ASP 128 1HB ASP 128 -14.010 -4.924 -9.019 957 H THR 129 H THR 129 -11.287 -6.263 -6.442 958 HA THR 129 HA THR 129 -9.342 -4.793 -8.301 959 HB THR 129 HB THR 129 -9.232 -4.797 -5.256 960 HG1 THR 129 HG1 THR 129 -11.155 -3.945 -5.613 961 HG21 THR 129 3HG2 THR 129 -8.379 -2.505 -7.102 962 HG22 THR 129 1HG2 THR 129 -7.240 -3.829 -6.757 963 HG23 THR 129 2HG2 THR 129 -7.869 -2.823 -5.430 964 H TYR 130 H TYR 130 -7.734 -6.106 -8.952 965 HA TYR 130 HA TYR 130 -6.712 -8.374 -7.248 966 HD1 TYR 130 HD1 TYR 130 -9.272 -7.606 -10.014 967 HD2 TYR 130 HD2 TYR 130 -7.110 -11.131 -8.821 968 HE1 TYR 130 HE1 TYR 130 -11.340 -8.940 -10.143 969 HE2 TYR 130 HE2 TYR 130 -9.193 -12.446 -9.020 970 HH TYR 130 HH TYR 130 -11.899 -11.617 -8.810 971 HB2 TYR 130 2HB TYR 130 -6.620 -7.794 -10.255 972 HB3 TYR 130 1HB TYR 130 -5.845 -9.163 -9.502 973 H TYR 131 H TYR 131 -4.776 -8.720 -6.555 974 HA TYR 131 HA TYR 131 -2.645 -6.627 -6.656 975 HD1 TYR 131 HD2 TYR 131 -0.461 -9.783 -5.460 976 HD2 TYR 131 HD1 TYR 131 -1.908 -6.470 -3.196 977 HE1 TYR 131 HE2 TYR 131 1.741 -9.572 -4.413 978 HE2 TYR 131 HE1 TYR 131 0.246 -6.368 -1.993 979 HH TYR 131 HH TYR 131 2.399 -7.128 -1.909 980 HB2 TYR 131 2HB TYR 131 -3.456 -7.817 -4.578 981 HB3 TYR 131 1HB TYR 131 -2.923 -9.332 -5.175 982 HA PRO 132 HA PRO 132 0.007 -8.798 -9.750 983 HB2 PRO 132 2HB PRO 132 2.505 -7.857 -8.370 984 HB3 PRO 132 1HB PRO 132 1.911 -7.479 -9.992 985 HG2 PRO 132 2HG PRO 132 1.850 -5.630 -7.978 986 HG3 PRO 132 1HG PRO 132 0.549 -5.698 -9.191 987 HD2 PRO 132 2HD PRO 132 0.488 -6.815 -6.350 988 HD3 PRO 132 1HD PRO 132 -0.750 -5.872 -7.243 989 H GLU 133 H GLU 133 2.264 -10.045 -9.900 990 HA GLU 133 HA GLU 133 2.125 -12.467 -8.132 991 HB2 GLU 133 2HB GLU 133 4.075 -13.255 -9.687 992 HB3 GLU 133 1HB GLU 133 2.432 -13.278 -10.221 993 HG2 GLU 133 2HG GLU 133 4.281 -10.935 -11.023 994 HG3 GLU 133 1HG GLU 133 4.294 -12.471 -11.892 995 H TRP 134 H TRP 134 4.151 -13.438 -7.410 996 HA TRP 134 HA TRP 134 6.096 -11.530 -6.139 997 HD1 TRP 134 HD1 TRP 134 5.565 -15.630 -4.628 998 HE1 TRP 134 HE1 TRP 134 3.364 -17.079 -4.549 999 HE3 TRP 134 HE3 TRP 134 2.353 -11.772 -3.830 1000 HZ2 TRP 134 HZ2 TRP 134 0.646 -16.469 -4.061 1001 HZ3 TRP 134 HZ3 TRP 134 -0.071 -12.250 -3.593 1002 HH2 TRP 134 HH2 TRP 134 -0.916 -14.568 -3.778 1003 HB2 TRP 134 2HB TRP 134 6.095 -12.782 -3.950 1004 HB3 TRP 134 1HB TRP 134 4.706 -11.786 -4.251 1005 H ASP 135 H ASP 135 8.190 -12.189 -6.410 1006 HA ASP 135 HA ASP 135 8.639 -15.009 -7.516 1007 HB2 ASP 135 2HB ASP 135 8.726 -12.687 -9.057 1008 HB3 ASP 135 1HB ASP 135 10.359 -12.660 -8.443 1009 H ALA 136 H ALA 136 11.358 -14.800 -7.697 1010 HA ALA 136 HA ALA 136 12.293 -14.747 -4.725 1011 HB1 ALA 136 3HB ALA 136 13.074 -16.819 -6.901 1012 HB2 ALA 136 1HB ALA 136 11.792 -17.069 -5.685 1013 HB3 ALA 136 2HB ALA 136 13.486 -16.889 -5.163 1014 H ALA 137 H ALA 137 13.351 -13.872 -7.900 1015 HA ALA 137 HA ALA 137 15.932 -12.757 -6.652 1016 HB1 ALA 137 3HB ALA 137 15.504 -13.521 -9.614 1017 HB2 ALA 137 1HB ALA 137 16.487 -14.395 -8.410 1018 HB3 ALA 137 2HB ALA 137 16.960 -12.759 -8.930 1019 H GLU 138 H GLU 138 12.940 -11.680 -7.907 1020 HA GLU 138 HA GLU 138 13.954 -8.833 -8.041 1021 HB2 GLU 138 2HB GLU 138 11.463 -10.187 -8.982 1022 HB3 GLU 138 1HB GLU 138 11.088 -8.822 -8.008 1023 HG2 GLU 138 2HG GLU 138 12.430 -7.296 -9.444 1024 HG3 GLU 138 1HG GLU 138 13.152 -8.657 -10.314 1025 H TRP 139 H TRP 139 12.016 -10.769 -5.684 1026 HA TRP 139 HA TRP 139 13.196 -9.061 -3.465 1027 HD1 TRP 139 HD1 TRP 139 8.997 -10.962 -3.843 1028 HE1 TRP 139 HE1 TRP 139 7.423 -10.574 -5.991 1029 HE3 TRP 139 HE3 TRP 139 11.015 -6.564 -5.302 1030 HZ2 TRP 139 HZ2 TRP 139 7.562 -8.780 -8.133 1031 HZ3 TRP 139 HZ3 TRP 139 10.371 -5.602 -7.493 1032 HH2 TRP 139 HH2 TRP 139 8.702 -6.713 -8.900 1033 HB2 TRP 139 2HB TRP 139 10.725 -9.109 -2.375 1034 HB3 TRP 139 1HB TRP 139 11.343 -7.814 -3.338 1035 H GLU 140 H GLU 140 13.545 -9.911 -1.536 1036 HA GLU 140 HA GLU 140 12.902 -12.866 -1.075 1037 HB2 GLU 140 2HB GLU 140 14.928 -13.225 -0.157 1038 HB3 GLU 140 1HB GLU 140 15.375 -11.988 -1.283 1039 HG2 GLU 140 2HG GLU 140 15.277 -10.315 0.791 1040 HG3 GLU 140 1HG GLU 140 15.083 -11.761 1.789 1041 H LEU 141 H LEU 141 13.170 -12.947 1.750 1042 HA LEU 141 HA LEU 141 10.520 -11.614 2.539 1043 HG LEU 141 HG LEU 141 9.264 -14.838 3.872 1044 HB2 LEU 141 2HB LEU 141 11.285 -14.384 2.646 1045 HB3 LEU 141 1HB LEU 141 11.388 -13.848 4.281 1046 HD11 LEU 141 1HD1 LEU 141 7.618 -13.197 4.598 1047 HD12 LEU 141 2HD1 LEU 141 8.611 -11.848 4.037 1048 HD13 LEU 141 3HD1 LEU 141 9.151 -12.831 5.407 1049 HD21 LEU 141 3HD2 LEU 141 8.620 -12.848 1.618 1050 HD22 LEU 141 1HD2 LEU 141 7.640 -14.213 2.160 1051 HD23 LEU 141 2HD2 LEU 141 9.196 -14.501 1.355 1052 H ASP 142 H ASP 142 10.798 -9.949 3.916 1053 HA ASP 142 HA ASP 142 13.289 -9.528 5.587 1054 HB2 ASP 142 2HB ASP 142 12.005 -7.730 4.122 1055 HB3 ASP 142 1HB ASP 142 10.846 -7.687 5.448 1056 H ALA 143 H ALA 143 9.697 -9.849 6.133 1057 HA ALA 143 HA ALA 143 10.208 -11.496 8.604 1058 HB1 ALA 143 3HB ALA 143 10.300 -9.062 9.391 1059 HB2 ALA 143 1HB ALA 143 8.908 -9.904 10.117 1060 HB3 ALA 143 2HB ALA 143 8.676 -8.780 8.752 1061 H GLU 144 H GLU 144 8.573 -12.987 9.051 1062 HA GLU 144 HA GLU 144 5.753 -12.452 7.963 1063 HB2 GLU 144 2HB GLU 144 6.846 -14.237 6.606 1064 HB3 GLU 144 1HB GLU 144 6.946 -15.275 8.030 1065 HG2 GLU 144 2HG GLU 144 4.488 -15.377 8.246 1066 HG3 GLU 144 1HG GLU 144 4.263 -14.048 7.128 1067 H THR 145 H THR 145 4.409 -12.053 9.546 1068 HA THR 145 HA THR 145 4.719 -13.470 12.244 1069 HB THR 145 HB THR 145 4.401 -11.637 13.609 1070 HG1 THR 145 HG1 THR 145 2.997 -10.642 11.657 1071 HG21 THR 145 3HG2 THR 145 6.056 -9.858 13.094 1072 HG22 THR 145 1HG2 THR 145 6.123 -10.346 11.386 1073 HG23 THR 145 2HG2 THR 145 6.752 -11.444 12.636 1074 H ASP 146 H ASP 146 2.851 -14.196 13.258 1075 HA ASP 146 HA ASP 146 0.277 -14.090 11.860 1076 HB2 ASP 146 2HB ASP 146 -0.548 -15.419 13.714 1077 HB3 ASP 146 1HB ASP 146 0.938 -16.067 13.055 1078 H HIS 147 H HIS 147 -1.533 -12.900 12.190 1079 HA HIS 147 HA HIS 147 -1.676 -10.797 14.402 1080 HD1 HIS 147 HD1 HIS 147 0.901 -10.306 13.571 1081 HD2 HIS 147 HD2 HIS 147 -1.476 -6.987 12.409 1082 HE1 HIS 147 HE1 HIS 147 2.226 -8.123 13.914 1083 HB2 HIS 147 2HB HIS 147 -1.519 -10.289 11.364 1084 HB3 HIS 147 1HB HIS 147 -2.635 -9.320 12.256 1085 H GLU 148 H GLU 148 -3.905 -9.695 14.381 1086 HA GLU 148 HA GLU 148 -5.965 -11.802 14.683 1087 HB2 GLU 148 2HB GLU 148 -6.485 -8.804 14.638 1088 HB3 GLU 148 1HB GLU 148 -7.575 -10.028 15.218 1089 HG2 GLU 148 2HG GLU 148 -6.154 -10.462 17.222 1090 HG3 GLU 148 1HG GLU 148 -4.894 -9.376 16.622 1091 H GLY 149 H GLY 149 -6.906 -12.689 12.963 1092 HA2 GLY 149 2HA GLY 149 -8.731 -12.693 11.147 1093 HA3 GLY 149 1HA GLY 149 -8.347 -11.049 10.774 1094 H PHE 150 H PHE 150 -5.351 -11.758 10.808 1095 HA PHE 150 HA PHE 150 -5.040 -13.234 8.181 1096 HD1 PHE 150 HD1 PHE 150 -2.235 -10.085 7.833 1097 HD2 PHE 150 HD2 PHE 150 -6.140 -9.205 9.361 1098 HE1 PHE 150 HE1 PHE 150 -1.322 -8.149 9.074 1099 HE2 PHE 150 HE2 PHE 150 -5.240 -7.296 10.572 1100 HZ PHE 150 HZ PHE 150 -2.821 -6.769 10.478 1101 HB2 PHE 150 2HB PHE 150 -4.297 -11.269 6.953 1102 HB3 PHE 150 1HB PHE 150 -5.855 -10.930 7.642 1103 H THR 151 H THR 151 -2.714 -13.107 7.367 1104 HA THR 151 HA THR 151 -0.709 -12.927 9.693 1105 HB THR 151 HB THR 151 -0.805 -15.190 9.022 1106 HG1 THR 151 HG1 THR 151 1.591 -13.891 8.184 1107 HG21 THR 151 3HG2 THR 151 0.219 -16.003 6.850 1108 HG22 THR 151 1HG2 THR 151 0.131 -14.347 6.211 1109 HG23 THR 151 2HG2 THR 151 -1.370 -15.234 6.636 1110 H LEU 152 H LEU 152 0.503 -11.342 9.668 1111 HA LEU 152 HA LEU 152 0.993 -9.383 7.471 1112 HG LEU 152 HG LEU 152 2.613 -7.373 10.323 1113 HB2 LEU 152 2HB LEU 152 0.839 -8.690 9.782 1114 HB3 LEU 152 1HB LEU 152 2.074 -9.796 10.306 1115 HD11 LEU 152 1HD1 LEU 152 4.660 -8.812 8.539 1116 HD12 LEU 152 2HD1 LEU 152 4.468 -9.121 10.268 1117 HD13 LEU 152 3HD1 LEU 152 4.943 -7.516 9.701 1118 HD21 LEU 152 3HD2 LEU 152 1.499 -6.745 8.143 1119 HD22 LEU 152 1HD2 LEU 152 2.822 -7.468 7.234 1120 HD23 LEU 152 2HD2 LEU 152 3.145 -6.097 8.297 1121 H GLN 153 H GLN 153 2.645 -9.172 6.276 1122 HA GLN 153 HA GLN 153 4.966 -11.136 5.998 1123 HB2 GLN 153 2HB GLN 153 2.379 -10.970 4.496 1124 HB3 GLN 153 1HB GLN 153 3.658 -10.506 3.418 1125 HG2 GLN 153 2HG GLN 153 3.991 -13.058 5.116 1126 HG3 GLN 153 1HG GLN 153 2.839 -13.058 3.804 1127 HE21 GLN 153 1HE2 GLN 153 4.805 -14.794 3.372 1128 HE22 GLN 153 2HE2 GLN 153 5.593 -14.089 1.885 1129 H GLU 154 H GLU 154 6.790 -10.032 5.571 1130 HA GLU 154 HA GLU 154 6.670 -7.287 4.189 1131 HB2 GLU 154 2HB GLU 154 8.763 -8.090 6.263 1132 HB3 GLU 154 1HB GLU 154 8.496 -6.533 5.547 1133 HG2 GLU 154 2HG GLU 154 6.136 -6.592 6.708 1134 HG3 GLU 154 1HG GLU 154 6.734 -7.982 7.597 1135 H TRP 155 H TRP 155 7.460 -7.508 2.182 1136 HA TRP 155 HA TRP 155 9.696 -9.488 1.553 1137 HD1 TRP 155 HD1 TRP 155 5.456 -9.370 0.717 1138 HE1 TRP 155 HE1 TRP 155 4.467 -11.676 -0.083 1139 HE3 TRP 155 HE3 TRP 155 9.803 -11.194 -1.192 1140 HZ2 TRP 155 HZ2 TRP 155 5.626 -13.966 -1.261 1141 HZ3 TRP 155 HZ3 TRP 155 9.791 -13.447 -2.237 1142 HH2 TRP 155 HH2 TRP 155 7.725 -14.787 -2.305 1143 HB2 TRP 155 2HB TRP 155 7.618 -8.015 -0.127 1144 HB3 TRP 155 1HB TRP 155 8.906 -8.918 -0.876 1145 H VAL 156 H VAL 156 11.811 -8.621 1.606 1146 HA VAL 156 HA VAL 156 12.239 -5.755 0.680 1147 HB VAL 156 HB VAL 156 13.159 -6.361 2.875 1148 HG11 VAL 156 1HG1 VAL 156 15.294 -7.636 3.090 1149 HG12 VAL 156 2HG1 VAL 156 15.202 -8.088 1.362 1150 HG13 VAL 156 3HG1 VAL 156 13.974 -8.675 2.507 1151 HG21 VAL 156 3HG2 VAL 156 15.233 -5.136 2.723 1152 HG22 VAL 156 1HG2 VAL 156 14.132 -4.391 1.555 1153 HG23 VAL 156 2HG2 VAL 156 15.407 -5.476 0.978 1154 H ARG 157 H ARG 157 13.221 -5.094 -1.068 1155 HA ARG 157 HA ARG 157 13.807 -6.816 -3.377 1156 HE ARG 157 HE ARG 157 14.054 -4.469 -6.659 1157 HB2 ARG 157 2HB ARG 157 14.442 -3.886 -2.705 1158 HB3 ARG 157 1HB ARG 157 15.106 -4.619 -4.152 1159 HG2 ARG 157 2HG ARG 157 12.645 -5.367 -4.767 1160 HG3 ARG 157 1HG ARG 157 12.133 -4.295 -3.467 1161 HD2 ARG 157 2HD ARG 157 12.009 -2.956 -5.471 1162 HD3 ARG 157 1HD ARG 157 13.425 -2.435 -4.529 1163 HH11 ARG 157 2HH1 ARG 157 13.790 -1.126 -5.969 1164 HH12 ARG 157 1HH1 ARG 157 14.990 -0.630 -7.224 1165 HH21 ARG 157 1HH2 ARG 157 15.490 -3.954 -8.021 1166 HH22 ARG 157 2HH2 ARG 157 15.995 -2.221 -8.313 1167 H SER 158 H SER 158 15.512 -7.479 -4.387 1168 HA SER 158 HA SER 158 17.251 -8.980 -2.966 1169 HG SER 158 HG SER 158 18.115 -10.633 -4.979 1170 HB2 SER 158 2HB SER 158 16.554 -9.276 -5.344 1171 HB3 SER 158 1HB SER 158 17.696 -8.018 -5.855 1172 H ALA 159 H ALA 159 19.079 -8.983 -1.920 1173 HA ALA 159 HA ALA 159 20.873 -6.772 -1.476 1174 HB1 ALA 159 3HB ALA 159 22.313 -8.672 -0.421 1175 HB2 ALA 159 1HB ALA 159 21.139 -9.837 -1.084 1176 HB3 ALA 159 2HB ALA 159 20.602 -8.626 0.098 1177 H SER 160 H SER 160 22.362 -5.946 -2.690 1178 HA SER 160 HA SER 160 24.336 -5.689 -3.949 1179 HG SER 160 HG SER 160 23.391 -9.007 -4.995 1180 HB2 SER 160 2HB SER 160 25.563 -7.160 -5.284 1181 HB3 SER 160 1HB SER 160 25.159 -7.982 -3.790 1182 H SER 161 H SER 161 24.812 -5.194 -6.178 1183 HA SER 161 HA SER 161 24.270 -3.648 -7.845 1184 HG SER 161 HG SER 161 23.475 -6.677 -8.662 1185 HB2 SER 161 2HB SER 161 21.790 -5.408 -8.281 1186 HB3 SER 161 1HB SER 161 22.398 -4.220 -9.435 1187 H ARG 162 H ARG 162 22.506 -2.121 -8.803 1188 HA ARG 162 HA ARG 162 20.298 -1.434 -7.036 1189 HE ARG 162 HE ARG 162 18.993 2.694 -4.269 1190 HB2 ARG 162 1HB ARG 162 22.274 -0.141 -5.952 1191 HB3 ARG 162 2HB ARG 162 22.264 0.927 -7.342 1192 HG2 ARG 162 1HG ARG 162 19.910 1.670 -6.788 1193 HG3 ARG 162 2HG ARG 162 19.760 0.397 -5.566 1194 HD2 ARG 162 1HD ARG 162 21.644 1.426 -4.232 1195 HD3 ARG 162 2HD ARG 162 21.796 2.705 -5.432 1196 HH11 ARG 162 2HH1 ARG 162 22.279 3.734 -3.526 1197 HH12 ARG 162 1HH1 ARG 162 21.575 4.968 -2.376 1198 HH21 ARG 162 1HH2 ARG 162 18.320 4.150 -2.909 1199 HH22 ARG 162 2HH2 ARG 162 19.565 5.157 -2.099 Start of MODEL 9 1 HA MET 1 HA MET 1 16.413 5.146 1.081 2 H1 MET 1 1H MET 1 15.915 7.561 1.784 3 H2 MET 1 2H MET 1 15.426 6.932 3.195 4 HB2 MET 1 1HB MET 1 14.349 4.852 3.345 5 HB3 MET 1 2HB MET 1 14.715 3.604 2.176 6 HG2 MET 1 1HG MET 1 17.128 3.521 2.930 7 HG3 MET 1 2HG MET 1 16.761 4.695 4.203 8 HE1 MET 1 3HE MET 1 14.504 4.326 5.728 9 HE2 MET 1 1HE MET 1 15.985 3.880 6.621 10 HE3 MET 1 2HE MET 1 14.516 2.847 6.718 11 H GLU 2 H GLU 2 13.619 4.122 0.742 12 HA GLU 2 HA GLU 2 12.147 6.362 -0.539 13 HB2 GLU 2 2HB GLU 2 12.031 5.556 -2.830 14 HB3 GLU 2 1HB GLU 2 13.636 5.932 -2.317 15 HG2 GLU 2 2HG GLU 2 13.790 3.223 -1.883 16 HG3 GLU 2 1HG GLU 2 12.541 3.203 -3.126 17 H LEU 3 H LEU 3 10.549 3.859 -1.910 18 HA LEU 3 HA LEU 3 8.691 4.010 0.509 19 HG LEU 3 HG LEU 3 8.847 5.946 -2.591 20 HB2 LEU 3 2HB LEU 3 6.716 4.211 -1.205 21 HB3 LEU 3 1HB LEU 3 7.638 5.532 -0.586 22 HD11 LEU 3 1HD1 LEU 3 8.659 4.625 -4.648 23 HD12 LEU 3 2HD1 LEU 3 7.395 3.560 -3.960 24 HD13 LEU 3 3HD1 LEU 3 9.074 3.487 -3.390 25 HD21 LEU 3 3HD2 LEU 3 6.677 7.017 -2.431 26 HD22 LEU 3 1HD2 LEU 3 5.809 5.538 -2.919 27 HD23 LEU 3 2HD2 LEU 3 6.779 6.440 -4.105 28 H VAL 4 H VAL 4 7.255 2.606 1.065 29 HA VAL 4 HA VAL 4 7.560 -0.239 0.031 30 HB VAL 4 HB VAL 4 7.224 0.837 2.858 31 HG11 VAL 4 1HG1 VAL 4 6.317 -1.465 2.808 32 HG12 VAL 4 2HG1 VAL 4 7.909 -1.554 3.614 33 HG13 VAL 4 3HG1 VAL 4 7.714 -2.058 1.928 34 HG21 VAL 4 3HG2 VAL 4 9.818 -0.218 1.618 35 HG22 VAL 4 1HG2 VAL 4 9.575 0.172 3.348 36 HG23 VAL 4 2HG2 VAL 4 9.478 1.428 2.129 37 H SER 5 H SER 5 5.776 -1.420 -0.514 38 HA SER 5 HA SER 5 3.075 -0.109 -0.214 39 HG SER 5 HG SER 5 3.980 -3.311 -1.535 40 HB2 SER 5 2HB SER 5 2.534 -1.578 -2.164 41 HB3 SER 5 1HB SER 5 3.975 -0.590 -2.400 42 H VAL 6 H VAL 6 1.341 -0.842 0.899 43 HA VAL 6 HA VAL 6 1.552 -3.416 2.484 44 HB VAL 6 HB VAL 6 1.531 -2.655 4.518 45 HG11 VAL 6 1HG1 VAL 6 3.591 -1.531 3.610 46 HG12 VAL 6 2HG1 VAL 6 2.914 -0.607 4.957 47 HG13 VAL 6 3HG1 VAL 6 2.653 -0.070 3.298 48 HG21 VAL 6 3HG2 VAL 6 0.640 -0.723 5.624 49 HG22 VAL 6 1HG2 VAL 6 -0.643 -1.435 4.639 50 HG23 VAL 6 2HG2 VAL 6 0.223 0.023 4.090 51 H ALA 7 H ALA 7 0.036 -4.453 1.103 52 HA ALA 7 HA ALA 7 -2.901 -3.555 1.506 53 HB1 ALA 7 3HB ALA 7 -1.665 -5.186 -0.827 54 HB2 ALA 7 1HB ALA 7 -2.097 -3.469 -0.882 55 HB3 ALA 7 2HB ALA 7 -3.366 -4.679 -0.671 56 H ALA 8 H ALA 8 -4.304 -4.980 2.604 57 HA ALA 8 HA ALA 8 -3.440 -7.819 3.043 58 HB1 ALA 8 3HB ALA 8 -4.113 -6.285 4.980 59 HB2 ALA 8 1HB ALA 8 -4.966 -7.830 4.916 60 HB3 ALA 8 2HB ALA 8 -5.775 -6.352 4.408 61 H LEU 9 H LEU 9 -4.188 -9.569 2.074 62 HA LEU 9 HA LEU 9 -6.836 -9.576 0.614 63 HG LEU 9 HG LEU 9 -3.747 -9.448 -2.347 64 HB2 LEU 9 2HB LEU 9 -5.797 -10.040 -1.558 65 HB3 LEU 9 1HB LEU 9 -5.525 -8.463 -0.947 66 HD11 LEU 9 1HD1 LEU 9 -3.247 -7.484 -0.883 67 HD12 LEU 9 2HD1 LEU 9 -1.823 -8.495 -1.065 68 HD13 LEU 9 3HD1 LEU 9 -2.741 -8.571 0.430 69 HD21 LEU 9 3HD2 LEU 9 -2.858 -11.180 0.022 70 HD22 LEU 9 1HD2 LEU 9 -2.156 -11.108 -1.606 71 HD23 LEU 9 2HD2 LEU 9 -3.762 -11.805 -1.397 72 H ALA 10 H ALA 10 -7.571 -11.440 -0.428 73 HA ALA 10 HA ALA 10 -6.685 -14.031 0.970 74 HB1 ALA 10 3HB ALA 10 -9.539 -13.061 0.187 75 HB2 ALA 10 1HB ALA 10 -8.765 -12.767 1.758 76 HB3 ALA 10 2HB ALA 10 -9.115 -14.419 1.244 77 H GLU 11 H GLU 11 -8.998 -15.351 -0.730 78 HA GLU 11 HA GLU 11 -7.201 -16.583 -2.721 79 HB2 GLU 11 2HB GLU 11 -8.962 -17.939 -1.703 80 HB3 GLU 11 1HB GLU 11 -10.231 -16.955 -2.432 81 HG2 GLU 11 2HG GLU 11 -9.692 -17.773 -4.702 82 HG3 GLU 11 1HG GLU 11 -8.210 -18.573 -4.130 83 H ASN 12 H ASN 12 -7.951 -16.776 -5.026 84 HA ASN 12 HA ASN 12 -6.872 -15.644 -6.820 85 HB2 ASN 12 2HB ASN 12 -9.700 -15.384 -6.743 86 HB3 ASN 12 1HB ASN 12 -9.228 -13.760 -7.103 87 HD21 ASN 12 1HD2 ASN 12 -7.558 -13.663 -8.948 88 HD22 ASN 12 2HD2 ASN 12 -7.997 -14.757 -10.364 89 H ARG 13 H ARG 13 -6.102 -14.329 -4.331 90 HA ARG 13 HA ARG 13 -5.122 -12.499 -3.407 91 HE ARG 13 HE ARG 13 -2.257 -14.410 -6.753 92 HB2 ARG 13 2HB ARG 13 -3.241 -11.464 -4.428 93 HB3 ARG 13 1HB ARG 13 -3.263 -13.202 -4.708 94 HG2 ARG 13 2HG ARG 13 -4.280 -12.577 -7.127 95 HG3 ARG 13 1HG ARG 13 -3.827 -10.947 -6.729 96 HD2 ARG 13 2HD ARG 13 -1.957 -11.536 -7.822 97 HD3 ARG 13 1HD ARG 13 -1.379 -11.943 -6.228 98 HH11 ARG 13 2HH1 ARG 13 -0.982 -12.328 -9.187 99 HH12 ARG 13 1HH1 ARG 13 -0.573 -13.686 -10.322 100 HH21 ARG 13 1HH2 ARG 13 -1.803 -15.974 -8.027 101 HH22 ARG 13 2HH2 ARG 13 -1.030 -15.678 -9.656 102 H VAL 14 H VAL 14 -7.435 -12.025 -3.423 103 HA VAL 14 HA VAL 14 -8.337 -9.508 -4.746 104 HB VAL 14 HB VAL 14 -9.563 -11.547 -2.799 105 HG11 VAL 14 1HG1 VAL 14 -11.056 -8.965 -3.584 106 HG12 VAL 14 2HG1 VAL 14 -10.606 -9.480 -1.939 107 HG13 VAL 14 3HG1 VAL 14 -11.759 -10.443 -2.852 108 HG21 VAL 14 3HG2 VAL 14 -10.329 -10.555 -5.646 109 HG22 VAL 14 1HG2 VAL 14 -11.136 -11.853 -4.714 110 HG23 VAL 14 2HG2 VAL 14 -9.461 -12.051 -5.265 111 H ILE 15 H ILE 15 -7.634 -7.616 -4.126 112 HA ILE 15 HA ILE 15 -6.798 -6.763 -1.355 113 HB ILE 15 HB ILE 15 -7.524 -5.024 -3.766 114 HG12 ILE 15 2HG1 ILE 15 -4.712 -5.924 -2.873 115 HG13 ILE 15 1HG1 ILE 15 -5.604 -6.574 -4.237 116 HG21 ILE 15 1HG2 ILE 15 -7.553 -3.755 -1.538 117 HG22 ILE 15 2HG2 ILE 15 -6.315 -3.161 -2.623 118 HG23 ILE 15 3HG2 ILE 15 -5.852 -4.222 -1.276 119 HD11 ILE 15 3HD1 ILE 15 -5.424 -4.575 -5.579 120 HD12 ILE 15 1HD1 ILE 15 -3.819 -4.892 -4.902 121 HD13 ILE 15 2HD1 ILE 15 -4.834 -3.627 -4.189 122 H GLY 16 H GLY 16 -9.629 -5.705 -3.285 123 HA2 GLY 16 2HA GLY 16 -11.441 -6.839 -1.434 124 HA3 GLY 16 1HA GLY 16 -11.347 -5.142 -0.928 125 H ARG 17 H ARG 17 -13.039 -4.170 -1.606 126 HA ARG 17 HA ARG 17 -14.586 -4.776 -4.122 127 HE ARG 17 HE ARG 17 -16.972 -8.603 -4.787 128 HB2 ARG 17 2HB ARG 17 -15.261 -6.021 -1.422 129 HB3 ARG 17 1HB ARG 17 -16.599 -5.146 -2.128 130 HG2 ARG 17 2HG ARG 17 -16.380 -6.434 -4.254 131 HG3 ARG 17 1HG ARG 17 -15.012 -7.347 -3.624 132 HD2 ARG 17 2HD ARG 17 -16.473 -8.351 -1.835 133 HD3 ARG 17 1HD ARG 17 -17.851 -7.346 -2.390 134 HH11 ARG 17 2HH1 ARG 17 -18.284 -9.740 -1.784 135 HH12 ARG 17 1HH1 ARG 17 -18.826 -11.325 -2.515 136 HH21 ARG 17 1HH2 ARG 17 -17.476 -10.445 -5.556 137 HH22 ARG 17 2HH2 ARG 17 -18.342 -11.736 -4.612 138 H ASP 18 H ASP 18 -15.779 -3.279 -1.097 139 HA ASP 18 HA ASP 18 -16.380 -0.800 -2.305 140 HB2 ASP 18 2HB ASP 18 -15.939 -1.497 0.668 141 HB3 ASP 18 1HB ASP 18 -16.730 -0.048 0.070 142 H GLY 19 H GLY 19 -13.376 -1.397 -0.440 143 HA2 GLY 19 2HA GLY 19 -11.996 0.884 -1.868 144 HA3 GLY 19 1HA GLY 19 -12.232 1.229 -0.196 145 H GLU 20 H GLU 20 -10.793 0.309 1.340 146 HA GLU 20 HA GLU 20 -8.435 -1.203 0.286 147 HB2 GLU 20 2HB GLU 20 -7.558 -1.371 2.526 148 HB3 GLU 20 1HB GLU 20 -7.783 0.253 1.973 149 HG2 GLU 20 2HG GLU 20 -9.817 -1.042 3.904 150 HG3 GLU 20 1HG GLU 20 -8.314 -0.389 4.493 151 H LEU 21 H LEU 21 -11.172 -2.321 2.303 152 HA LEU 21 HA LEU 21 -10.544 -5.078 1.267 153 HG LEU 21 HG LEU 21 -9.088 -3.312 3.857 154 HB2 LEU 21 2HB LEU 21 -10.980 -5.686 4.022 155 HB3 LEU 21 1HB LEU 21 -9.619 -5.954 3.008 156 HD11 LEU 21 1HD1 LEU 21 -11.086 -3.409 5.424 157 HD12 LEU 21 2HD1 LEU 21 -9.531 -3.180 6.264 158 HD13 LEU 21 3HD1 LEU 21 -10.328 -4.781 6.266 159 HD21 LEU 21 3HD2 LEU 21 -7.369 -4.224 5.263 160 HD22 LEU 21 1HD2 LEU 21 -7.489 -5.168 3.759 161 HD23 LEU 21 2HD2 LEU 21 -8.127 -5.832 5.291 162 HA PRO 22 HA PRO 22 -15.027 -5.935 1.382 163 HB2 PRO 22 2HB PRO 22 -14.475 -8.858 1.883 164 HB3 PRO 22 1HB PRO 22 -15.158 -8.052 0.449 165 HG2 PRO 22 2HG PRO 22 -12.614 -9.188 0.440 166 HG3 PRO 22 1HG PRO 22 -13.060 -7.777 -0.536 167 HD2 PRO 22 2HD PRO 22 -11.670 -7.773 2.219 168 HD3 PRO 22 1HD PRO 22 -11.149 -6.978 0.734 169 H TRP 23 H TRP 23 -13.059 -6.746 4.013 170 HA TRP 23 HA TRP 23 -15.380 -7.091 5.954 171 HD1 TRP 23 HD1 TRP 23 -10.982 -6.950 7.175 172 HE1 TRP 23 HE1 TRP 23 -8.986 -7.489 5.557 173 HE3 TRP 23 HE3 TRP 23 -13.471 -10.228 4.205 174 HZ2 TRP 23 HZ2 TRP 23 -8.634 -9.242 3.372 175 HZ3 TRP 23 HZ3 TRP 23 -12.312 -11.077 2.186 176 HH2 TRP 23 HH2 TRP 23 -9.922 -10.606 1.792 177 HB2 TRP 23 2HB TRP 23 -13.614 -8.120 7.568 178 HB3 TRP 23 1HB TRP 23 -14.160 -9.106 6.246 179 HA PRO 24 HA PRO 24 -14.648 -3.024 7.227 180 HB2 PRO 24 2HB PRO 24 -14.652 -3.672 10.201 181 HB3 PRO 24 1HB PRO 24 -15.685 -2.563 9.288 182 HG2 PRO 24 2HG PRO 24 -16.652 -5.004 10.095 183 HG3 PRO 24 1HG PRO 24 -17.057 -4.394 8.471 184 HD2 PRO 24 2HD PRO 24 -14.899 -6.448 9.180 185 HD3 PRO 24 1HD PRO 24 -16.126 -6.477 7.877 186 H SER 25 H SER 25 -12.369 -4.870 9.134 187 HA SER 25 HA SER 25 -9.930 -3.960 8.878 188 HG SER 25 HG SER 25 -10.992 -1.522 8.070 189 HB2 SER 25 2HB SER 25 -11.023 -1.583 10.483 190 HB3 SER 25 1HB SER 25 -9.316 -2.026 10.325 191 H ILE 26 H ILE 26 -9.374 -5.683 10.046 192 HA ILE 26 HA ILE 26 -10.221 -6.237 12.831 193 HB ILE 26 HB ILE 26 -7.967 -7.720 12.785 194 HG12 ILE 26 2HG1 ILE 26 -7.264 -6.852 10.517 195 HG13 ILE 26 1HG1 ILE 26 -7.106 -8.538 10.852 196 HG21 ILE 26 1HG2 ILE 26 -9.166 -9.689 12.143 197 HG22 ILE 26 2HG2 ILE 26 -10.493 -8.744 11.434 198 HG23 ILE 26 3HG2 ILE 26 -10.179 -8.666 13.185 199 HD11 ILE 26 3HD1 ILE 26 -7.898 -8.044 8.488 200 HD12 ILE 26 1HD1 ILE 26 -9.439 -7.463 9.128 201 HD13 ILE 26 2HD1 ILE 26 -8.968 -9.161 9.355 202 HA PRO 27 HA PRO 27 -7.398 -3.461 15.072 203 HB2 PRO 27 2HB PRO 27 -7.042 -5.700 17.109 204 HB3 PRO 27 1HB PRO 27 -7.455 -3.999 17.361 205 HG2 PRO 27 2HG PRO 27 -9.443 -5.855 17.471 206 HG3 PRO 27 1HG PRO 27 -9.739 -4.362 16.533 207 HD2 PRO 27 2HD PRO 27 -8.839 -7.075 15.389 208 HD3 PRO 27 1HD PRO 27 -10.227 -6.032 14.915 209 H ALA 28 H ALA 28 -5.852 -6.735 14.888 210 HA ALA 28 HA ALA 28 -3.191 -5.782 14.548 211 HB1 ALA 28 3HB ALA 28 -4.607 -8.298 13.814 212 HB2 ALA 28 1HB ALA 28 -2.990 -8.047 14.547 213 HB3 ALA 28 2HB ALA 28 -3.242 -8.004 12.789 214 H ASP 29 H ASP 29 -5.612 -5.590 11.931 215 HA ASP 29 HA ASP 29 -3.594 -4.757 9.867 216 HB2 ASP 29 2HB ASP 29 -5.636 -5.943 9.174 217 HB3 ASP 29 1HB ASP 29 -6.679 -4.716 9.885 218 H LYS 30 H LYS 30 -6.332 -2.930 11.263 219 HA LYS 30 HA LYS 30 -5.128 -0.345 10.934 220 HB2 LYS 30 2HB LYS 30 -7.629 -1.307 11.992 221 HB3 LYS 30 1HB LYS 30 -6.943 -0.379 13.279 222 HG2 LYS 30 2HG LYS 30 -8.376 1.104 12.087 223 HG3 LYS 30 1HG LYS 30 -6.741 1.652 11.753 224 HD2 LYS 30 2HD LYS 30 -6.909 0.469 9.473 225 HD3 LYS 30 1HD LYS 30 -8.528 -0.001 9.827 226 HE2 LYS 30 2HE LYS 30 -7.868 3.020 9.938 227 HE3 LYS 30 1HE LYS 30 -7.825 2.234 8.387 228 HZ1 LYS 30 3HZ LYS 30 -10.191 1.609 8.578 229 HZ2 LYS 30 1HZ LYS 30 -10.100 3.205 8.944 230 HZ3 LYS 30 2HZ LYS 30 -10.311 2.188 10.125 231 H LYS 31 H LYS 31 -4.060 -2.518 13.311 232 HA LYS 31 HA LYS 31 -2.334 -0.390 14.673 233 HB2 LYS 31 2HB LYS 31 -3.271 -2.054 16.251 234 HB3 LYS 31 1HB LYS 31 -2.584 -3.357 15.314 235 HG2 LYS 31 2HG LYS 31 -1.289 -2.999 17.373 236 HG3 LYS 31 1HG LYS 31 -0.345 -2.914 15.901 237 HD2 LYS 31 2HD LYS 31 -0.440 -0.338 16.045 238 HD3 LYS 31 1HD LYS 31 -1.258 -0.484 17.594 239 HE2 LYS 31 2HE LYS 31 0.680 -1.621 18.627 240 HE3 LYS 31 1HE LYS 31 1.445 -1.916 17.056 241 HZ1 LYS 31 3HZ LYS 31 2.398 0.137 18.209 242 HZ2 LYS 31 1HZ LYS 31 0.945 0.918 18.037 243 HZ3 LYS 31 2HZ LYS 31 1.816 0.465 16.729 244 H GLN 32 H GLN 32 -1.860 -3.151 12.351 245 HA GLN 32 HA GLN 32 1.100 -2.768 12.255 246 HB2 GLN 32 2HB GLN 32 0.007 -4.925 11.744 247 HB3 GLN 32 1HB GLN 32 -0.779 -4.244 10.335 248 HG2 GLN 32 2HG GLN 32 2.311 -4.222 10.621 249 HG3 GLN 32 1HG GLN 32 1.490 -5.689 10.152 250 HE21 GLN 32 1HE2 GLN 32 -0.183 -5.184 8.194 251 HE22 GLN 32 2HE2 GLN 32 0.675 -4.298 6.839 252 H TYR 33 H TYR 33 -1.531 -1.871 9.934 253 HA TYR 33 HA TYR 33 -0.154 0.183 8.466 254 HD1 TYR 33 HD1 TYR 33 -3.714 1.194 10.405 255 HD2 TYR 33 HD2 TYR 33 -2.797 1.768 6.276 256 HE1 TYR 33 HE1 TYR 33 -5.251 3.097 10.351 257 HE2 TYR 33 HE2 TYR 33 -4.346 3.696 6.210 258 HH TYR 33 HH TYR 33 -6.157 4.756 7.421 259 HB2 TYR 33 2HB TYR 33 -2.105 -0.345 7.465 260 HB3 TYR 33 1HB TYR 33 -2.965 -0.706 8.891 261 H ARG 34 H ARG 34 -1.490 0.614 11.788 262 HA ARG 34 HA ARG 34 -0.628 3.545 11.646 263 HE ARG 34 HE ARG 34 -5.547 5.516 12.641 264 HB2 ARG 34 2HB ARG 34 -2.115 2.036 13.871 265 HB3 ARG 34 1HB ARG 34 -1.471 3.658 14.103 266 HG2 ARG 34 2HG ARG 34 -2.734 4.434 11.982 267 HG3 ARG 34 1HG ARG 34 -3.445 2.874 11.901 268 HD2 ARG 34 2HD ARG 34 -5.052 3.265 13.388 269 HD3 ARG 34 1HD ARG 34 -3.981 3.883 14.617 270 HH11 ARG 34 2HH1 ARG 34 -2.591 5.624 14.403 271 HH12 ARG 34 1HH1 ARG 34 -2.390 7.416 14.166 272 HH21 ARG 34 1HH2 ARG 34 -5.281 7.513 12.302 273 HH22 ARG 34 2HH2 ARG 34 -3.890 8.437 13.017 274 H SER 35 H SER 35 1.048 0.809 12.724 275 HA SER 35 HA SER 35 3.166 2.731 13.872 276 HG SER 35 HG SER 35 3.814 2.150 15.785 277 HB2 SER 35 2HB SER 35 2.685 -0.196 14.544 278 HB3 SER 35 1HB SER 35 4.350 0.362 14.454 279 H ARG 36 H ARG 36 2.387 0.871 11.161 280 HA ARG 36 HA ARG 36 5.110 1.215 9.874 281 HE ARG 36 HE ARG 36 4.224 -2.809 8.541 282 HB2 ARG 36 2HB ARG 36 3.378 -0.789 9.647 283 HB3 ARG 36 1HB ARG 36 2.384 0.302 8.718 284 HG2 ARG 36 2HG ARG 36 3.450 -0.941 7.095 285 HG3 ARG 36 1HG ARG 36 4.314 0.568 7.074 286 HD2 ARG 36 2HD ARG 36 5.916 -1.254 6.888 287 HD3 ARG 36 1HD ARG 36 6.187 -0.512 8.460 288 HH11 ARG 36 2HH1 ARG 36 7.550 -2.250 8.111 289 HH12 ARG 36 1HH1 ARG 36 7.964 -3.981 8.440 290 HH21 ARG 36 1HH2 ARG 36 4.748 -4.700 9.177 291 HH22 ARG 36 2HH2 ARG 36 6.526 -5.208 9.221 292 H VAL 37 H VAL 37 1.779 2.339 8.910 293 HA VAL 37 HA VAL 37 3.060 4.550 7.328 294 HB VAL 37 HB VAL 37 1.375 4.623 5.918 295 HG11 VAL 37 1HG1 VAL 37 0.812 2.441 4.991 296 HG12 VAL 37 2HG1 VAL 37 0.865 1.680 6.616 297 HG13 VAL 37 3HG1 VAL 37 2.354 2.264 5.867 298 HG21 VAL 37 3HG2 VAL 37 -1.024 3.812 6.070 299 HG22 VAL 37 1HG2 VAL 37 -0.653 5.103 7.218 300 HG23 VAL 37 2HG2 VAL 37 -0.755 3.434 7.778 301 H ALA 38 H ALA 38 1.475 4.616 10.362 302 HA ALA 38 HA ALA 38 0.065 7.199 9.798 303 HB1 ALA 38 3HB ALA 38 -0.979 5.693 11.348 304 HB2 ALA 38 1HB ALA 38 -0.602 7.234 12.146 305 HB3 ALA 38 2HB ALA 38 0.411 5.814 12.469 306 H ASP 39 H ASP 39 3.301 6.678 10.964 307 HA ASP 39 HA ASP 39 3.758 9.634 11.358 308 HB2 ASP 39 2HB ASP 39 5.425 7.106 11.717 309 HB3 ASP 39 1HB ASP 39 6.261 8.548 11.236 310 H ASP 40 H ASP 40 4.754 7.177 8.847 311 HA ASP 40 HA ASP 40 5.732 9.200 7.091 312 HB2 ASP 40 2HB ASP 40 5.322 6.189 6.998 313 HB3 ASP 40 1HB ASP 40 5.917 7.000 5.567 314 HA PRO 41 HA PRO 41 2.405 10.105 4.011 315 HB2 PRO 41 2HB PRO 41 4.691 9.891 1.948 316 HB3 PRO 41 1HB PRO 41 3.454 11.139 2.069 317 HG2 PRO 41 2HG PRO 41 5.911 11.683 3.056 318 HG3 PRO 41 1HG PRO 41 4.554 12.039 4.147 319 HD2 PRO 41 2HD PRO 41 6.303 9.504 4.165 320 HD3 PRO 41 1HD PRO 41 5.870 10.589 5.509 321 H VAL 42 H VAL 42 0.937 8.937 2.839 322 HA VAL 42 HA VAL 42 1.803 6.258 1.658 323 HB VAL 42 HB VAL 42 -0.969 7.155 2.588 324 HG11 VAL 42 1HG1 VAL 42 -1.551 4.756 2.538 325 HG12 VAL 42 2HG1 VAL 42 0.093 4.292 2.000 326 HG13 VAL 42 3HG1 VAL 42 -0.991 5.201 0.919 327 HG21 VAL 42 3HG2 VAL 42 -0.379 5.430 4.509 328 HG22 VAL 42 1HG2 VAL 42 0.449 7.000 4.604 329 HG23 VAL 42 2HG2 VAL 42 1.303 5.578 3.982 330 H VAL 43 H VAL 43 1.833 5.862 -0.444 331 HA VAL 43 HA VAL 43 0.279 7.593 -2.410 332 HB VAL 43 HB VAL 43 1.782 7.008 -4.144 333 HG11 VAL 43 1HG1 VAL 43 3.603 7.366 -1.661 334 HG12 VAL 43 2HG1 VAL 43 2.817 8.687 -2.486 335 HG13 VAL 43 3HG1 VAL 43 4.030 7.702 -3.340 336 HG21 VAL 43 3HG2 VAL 43 3.130 4.975 -2.286 337 HG22 VAL 43 1HG2 VAL 43 3.761 5.444 -3.861 338 HG23 VAL 43 2HG2 VAL 43 2.224 4.595 -3.793 339 H LEU 44 H LEU 44 -1.702 6.937 -2.924 340 HA LEU 44 HA LEU 44 -2.311 3.947 -3.364 341 HG LEU 44 HG LEU 44 -4.009 6.972 -2.074 342 HB2 LEU 44 2HB LEU 44 -4.146 4.065 -1.817 343 HB3 LEU 44 1HB LEU 44 -2.670 4.468 -1.056 344 HD11 LEU 44 1HD1 LEU 44 -6.122 5.773 -1.705 345 HD12 LEU 44 2HD1 LEU 44 -5.920 6.945 -0.396 346 HD13 LEU 44 3HD1 LEU 44 -5.623 5.220 -0.099 347 HD21 LEU 44 3HD2 LEU 44 -3.571 7.823 0.104 348 HD22 LEU 44 1HD2 LEU 44 -2.169 6.837 -0.320 349 HD23 LEU 44 2HD2 LEU 44 -3.357 6.198 0.829 350 H GLY 45 H GLY 45 -4.973 3.805 -3.723 351 HA2 GLY 45 2HA GLY 45 -5.136 4.732 -6.636 352 HA3 GLY 45 1HA GLY 45 -5.995 3.369 -5.925 353 H ARG 46 H ARG 46 -7.668 4.475 -7.272 354 HA ARG 46 HA ARG 46 -9.288 6.367 -5.496 355 HE ARG 46 HE ARG 46 -11.858 8.830 -7.140 356 HB2 ARG 46 2HB ARG 46 -9.736 5.896 -8.479 357 HB3 ARG 46 1HB ARG 46 -10.999 6.483 -7.456 358 HG2 ARG 46 2HG ARG 46 -8.270 7.863 -7.782 359 HG3 ARG 46 1HG ARG 46 -9.712 8.332 -8.660 360 HD2 ARG 46 2HD ARG 46 -9.541 8.449 -5.555 361 HD3 ARG 46 1HD ARG 46 -9.062 9.772 -6.596 362 HH11 ARG 46 2HH1 ARG 46 -10.024 10.747 -4.852 363 HH12 ARG 46 1HH1 ARG 46 -11.551 11.539 -4.263 364 HH21 ARG 46 1HH2 ARG 46 -13.503 9.661 -6.300 365 HH22 ARG 46 2HH2 ARG 46 -13.365 10.957 -5.031 366 H THR 47 H THR 47 -9.414 2.984 -6.649 367 HA THR 47 HA THR 47 -11.709 2.370 -5.039 368 HB THR 47 HB THR 47 -9.183 0.647 -5.430 369 HG1 THR 47 HG1 THR 47 -11.533 0.101 -6.711 370 HG21 THR 47 3HG2 THR 47 -12.025 -0.044 -4.378 371 HG22 THR 47 1HG2 THR 47 -10.428 -0.551 -3.774 372 HG23 THR 47 2HG2 THR 47 -11.039 -1.190 -5.301 373 H THR 48 H THR 48 -8.485 1.622 -3.578 374 HA THR 48 HA THR 48 -9.073 2.032 -0.877 375 HB THR 48 HB THR 48 -6.670 2.513 -0.475 376 HG1 THR 48 HG1 THR 48 -6.345 3.869 -2.157 377 HG21 THR 48 3HG2 THR 48 -6.798 0.330 -2.645 378 HG22 THR 48 1HG2 THR 48 -7.220 0.110 -0.931 379 HG23 THR 48 2HG2 THR 48 -5.579 0.583 -1.380 380 H PHE 49 H PHE 49 -8.788 4.820 -3.000 381 HA PHE 49 HA PHE 49 -8.558 6.729 -0.618 382 HD1 PHE 49 HD2 PHE 49 -10.366 9.530 -2.290 383 HD2 PHE 49 HD1 PHE 49 -6.191 8.984 -1.466 384 HE1 PHE 49 HE2 PHE 49 -10.259 11.773 -1.256 385 HE2 PHE 49 HE1 PHE 49 -6.062 11.273 -0.609 386 HZ PHE 49 HZ PHE 49 -8.082 12.627 -0.400 387 HB2 PHE 49 2HB PHE 49 -7.308 7.331 -2.726 388 HB3 PHE 49 1HB PHE 49 -8.832 7.652 -3.517 389 H GLU 50 H GLU 50 -11.055 5.706 -2.980 390 HA GLU 50 HA GLU 50 -13.072 7.624 -1.873 391 HB2 GLU 50 2HB GLU 50 -13.345 5.246 -3.802 392 HB3 GLU 50 1HB GLU 50 -14.695 6.229 -3.281 393 HG2 GLU 50 2HG GLU 50 -13.680 8.289 -4.232 394 HG3 GLU 50 1HG GLU 50 -12.184 7.458 -4.623 395 H SER 51 H SER 51 -12.035 4.434 -0.790 396 HA SER 51 HA SER 51 -13.681 4.820 1.716 397 HG SER 51 HG SER 51 -13.775 2.682 0.928 398 HB2 SER 51 2HB SER 51 -11.200 3.087 1.246 399 HB3 SER 51 1HB SER 51 -11.847 3.368 2.841 400 H MET 52 H MET 52 -10.065 5.175 1.723 401 HA MET 52 HA MET 52 -9.935 6.659 3.976 402 HB2 MET 52 2HB MET 52 -8.144 7.103 1.528 403 HB3 MET 52 1HB MET 52 -7.747 7.705 3.150 404 HG2 MET 52 2HG MET 52 -7.551 5.509 4.102 405 HG3 MET 52 1HG MET 52 -7.931 4.748 2.517 406 HE1 MET 52 3HE MET 52 -5.154 4.163 3.620 407 HE2 MET 52 1HE MET 52 -4.215 4.505 2.125 408 HE3 MET 52 2HE MET 52 -5.833 3.727 2.017 409 H ARG 53 H ARG 53 -10.872 8.352 1.188 410 HA ARG 53 HA ARG 53 -11.155 11.091 1.950 411 HE ARG 53 HE ARG 53 -16.508 12.275 0.694 412 HB2 ARG 53 2HB ARG 53 -12.016 9.870 -0.074 413 HB3 ARG 53 1HB ARG 53 -13.156 8.965 0.910 414 HG2 ARG 53 2HG ARG 53 -13.232 12.039 0.848 415 HG3 ARG 53 1HG ARG 53 -13.875 11.138 -0.529 416 HD2 ARG 53 2HD ARG 53 -15.578 10.025 0.736 417 HD3 ARG 53 1HD ARG 53 -14.841 10.336 2.262 418 HH11 ARG 53 2HH1 ARG 53 -14.423 11.881 3.478 419 HH12 ARG 53 1HH1 ARG 53 -14.906 13.468 4.174 420 HH21 ARG 53 1HH2 ARG 53 -16.937 14.134 1.460 421 HH22 ARG 53 2HH2 ARG 53 -16.228 14.694 3.060 422 H ASP 54 H ASP 54 -12.691 8.321 3.620 423 HA ASP 54 HA ASP 54 -13.748 10.185 5.783 424 HB2 ASP 54 2HB ASP 54 -14.602 7.395 4.846 425 HB3 ASP 54 1HB ASP 54 -15.011 7.972 6.453 426 H ASP 55 H ASP 55 -12.030 6.920 6.018 427 HA ASP 55 HA ASP 55 -10.576 8.030 8.466 428 HB2 ASP 55 2HB ASP 55 -11.275 5.253 7.608 429 HB3 ASP 55 1HB ASP 55 -9.597 5.381 8.014 430 H LEU 56 H LEU 56 -8.850 9.272 8.014 431 HA LEU 56 HA LEU 56 -7.206 8.938 5.631 432 HG LEU 56 HG LEU 56 -7.174 12.637 6.706 433 HB2 LEU 56 2HB LEU 56 -6.168 10.596 7.944 434 HB3 LEU 56 1HB LEU 56 -5.940 10.803 6.240 435 HD11 LEU 56 1HD1 LEU 56 -9.498 10.717 6.049 436 HD12 LEU 56 2HD1 LEU 56 -8.473 11.580 4.881 437 HD13 LEU 56 3HD1 LEU 56 -9.555 12.475 5.960 438 HD21 LEU 56 3HD2 LEU 56 -7.521 12.141 9.098 439 HD22 LEU 56 1HD2 LEU 56 -8.968 11.173 8.713 440 HD23 LEU 56 2HD2 LEU 56 -8.933 12.921 8.362 441 HA PRO 57 HA PRO 57 -3.998 6.095 7.218 442 HB2 PRO 57 2HB PRO 57 -2.015 6.357 5.396 443 HB3 PRO 57 1HB PRO 57 -3.589 5.658 4.997 444 HG2 PRO 57 2HG PRO 57 -2.618 8.513 4.450 445 HG3 PRO 57 1HG PRO 57 -3.463 7.401 3.339 446 HD2 PRO 57 2HD PRO 57 -4.776 9.365 4.793 447 HD3 PRO 57 1HD PRO 57 -5.585 7.828 4.354 448 H GLY 58 H GLY 58 -1.767 8.778 6.297 449 HA2 GLY 58 2HA GLY 58 -0.891 9.076 9.247 450 HA3 GLY 58 1HA GLY 58 0.288 8.627 8.009 451 H SER 59 H SER 59 1.528 10.421 8.520 452 HA SER 59 HA SER 59 0.812 13.160 8.508 453 HG SER 59 HG SER 59 4.247 13.900 8.329 454 HB2 SER 59 2HB SER 59 3.012 12.160 9.145 455 HB3 SER 59 1HB SER 59 3.431 11.962 7.434 456 H ALA 60 H ALA 60 1.081 11.243 5.527 457 HA ALA 60 HA ALA 60 -0.464 13.437 4.213 458 HB1 ALA 60 3HB ALA 60 1.678 14.298 3.590 459 HB2 ALA 60 1HB ALA 60 1.128 13.468 2.120 460 HB3 ALA 60 2HB ALA 60 2.343 12.708 3.169 461 H GLN 61 H GLN 61 -1.316 13.040 2.115 462 HA GLN 61 HA GLN 61 -1.880 10.083 1.536 463 HB2 GLN 61 2HB GLN 61 -3.596 11.490 3.044 464 HB3 GLN 61 1HB GLN 61 -4.073 12.222 1.521 465 HG2 GLN 61 2HG GLN 61 -4.528 9.865 0.593 466 HG3 GLN 61 1HG GLN 61 -4.068 9.194 2.120 467 HE21 GLN 61 1HE2 GLN 61 -5.719 11.360 3.650 468 HE22 GLN 61 2HE2 GLN 61 -7.365 10.558 3.439 469 H ILE 62 H ILE 62 -0.886 9.860 -0.315 470 HA ILE 62 HA ILE 62 -1.216 11.799 -2.647 471 HB ILE 62 HB ILE 62 0.747 9.538 -1.965 472 HG12 ILE 62 2HG1 ILE 62 1.611 12.371 -2.528 473 HG13 ILE 62 1HG1 ILE 62 0.876 12.083 -0.963 474 HG21 ILE 62 1HG2 ILE 62 2.037 10.090 -4.023 475 HG22 ILE 62 2HG2 ILE 62 0.791 11.307 -4.472 476 HG23 ILE 62 3HG2 ILE 62 0.413 9.564 -4.498 477 HD11 ILE 62 3HD1 ILE 62 3.464 10.877 -2.090 478 HD12 ILE 62 1HD1 ILE 62 2.727 10.281 -0.554 479 HD13 ILE 62 2HD1 ILE 62 3.269 11.954 -0.699 480 H VAL 63 H VAL 63 -2.425 11.177 -4.445 481 HA VAL 63 HA VAL 63 -3.018 8.173 -4.806 482 HB VAL 63 HB VAL 63 -4.761 10.457 -5.787 483 HG11 VAL 63 1HG1 VAL 63 -4.808 8.594 -7.560 484 HG12 VAL 63 2HG1 VAL 63 -6.339 8.537 -6.650 485 HG13 VAL 63 3HG1 VAL 63 -5.059 7.391 -6.293 486 HG21 VAL 63 3HG2 VAL 63 -5.191 8.193 -3.751 487 HG22 VAL 63 1HG2 VAL 63 -6.537 9.200 -4.353 488 HG23 VAL 63 2HG2 VAL 63 -5.195 9.939 -3.461 489 H MET 64 H MET 64 -2.052 7.172 -6.369 490 HA MET 64 HA MET 64 -0.738 8.560 -8.694 491 HB2 MET 64 2HB MET 64 -0.854 5.692 -7.568 492 HB3 MET 64 1HB MET 64 -0.396 5.934 -9.216 493 HG2 MET 64 2HG MET 64 1.212 7.919 -7.897 494 HG3 MET 64 1HG MET 64 1.186 6.566 -6.780 495 HE1 MET 64 3HE MET 64 1.724 7.937 -10.341 496 HE2 MET 64 1HE MET 64 0.904 6.471 -10.949 497 HE3 MET 64 2HE MET 64 2.658 6.665 -11.190 498 H SER 65 H SER 65 -2.059 9.351 -10.007 499 HA SER 65 HA SER 65 -3.016 7.956 -12.179 500 HG SER 65 HG SER 65 -5.115 8.745 -9.526 501 HB2 SER 65 2HB SER 65 -5.535 8.135 -12.273 502 HB3 SER 65 1HB SER 65 -4.979 7.022 -11.053 503 H ARG 66 H ARG 66 -4.786 9.635 -13.488 504 HA ARG 66 HA ARG 66 -3.134 12.208 -13.667 505 HE ARG 66 HE ARG 66 -3.505 11.937 -19.192 506 HB2 ARG 66 2HB ARG 66 -3.725 10.649 -15.682 507 HB3 ARG 66 1HB ARG 66 -5.363 11.287 -15.538 508 HG2 ARG 66 2HG ARG 66 -3.817 13.656 -15.733 509 HG3 ARG 66 1HG ARG 66 -2.740 12.546 -16.515 510 HD2 ARG 66 2HD ARG 66 -5.707 13.021 -17.354 511 HD3 ARG 66 1HD ARG 66 -4.340 13.883 -18.006 512 HH11 ARG 66 2HH1 ARG 66 -6.252 11.018 -17.291 513 HH12 ARG 66 1HH1 ARG 66 -6.477 9.459 -18.211 514 HH21 ARG 66 1HH2 ARG 66 -3.787 10.214 -20.226 515 HH22 ARG 66 2HH2 ARG 66 -5.130 9.045 -19.834 516 H SER 67 H SER 67 -4.270 14.254 -13.950 517 HA SER 67 HA SER 67 -6.012 15.917 -13.562 518 HG SER 67 HG SER 67 -8.238 16.052 -11.109 519 HB2 SER 67 2HB SER 67 -7.833 14.204 -13.093 520 HB3 SER 67 1HB SER 67 -7.303 14.182 -11.407 521 H GLU 68 H GLU 68 -6.398 17.199 -11.342 522 HA GLU 68 HA GLU 68 -3.900 17.048 -9.590 523 HB2 GLU 68 2HB GLU 68 -3.545 19.463 -9.800 524 HB3 GLU 68 1HB GLU 68 -3.401 18.648 -11.333 525 HG2 GLU 68 2HG GLU 68 -5.200 19.735 -12.307 526 HG3 GLU 68 1HG GLU 68 -6.140 19.832 -10.829 527 H ARG 69 H ARG 69 -4.449 19.254 -8.025 528 HA ARG 69 HA ARG 69 -5.528 20.117 -6.231 529 HE ARG 69 HE ARG 69 -9.025 22.992 -7.516 530 HB2 ARG 69 2HB ARG 69 -8.047 19.192 -7.671 531 HB3 ARG 69 1HB ARG 69 -8.120 20.219 -6.257 532 HG2 ARG 69 2HG ARG 69 -6.444 20.937 -8.694 533 HG3 ARG 69 1HG ARG 69 -8.105 21.327 -8.733 534 HD2 ARG 69 2HD ARG 69 -6.376 22.291 -6.338 535 HD3 ARG 69 1HD ARG 69 -6.195 23.074 -7.912 536 HH11 ARG 69 2HH1 ARG 69 -6.384 24.433 -5.795 537 HH12 ARG 69 1HH1 ARG 69 -7.383 25.867 -5.300 538 HH21 ARG 69 1HH2 ARG 69 -10.117 24.649 -6.999 539 HH22 ARG 69 2HH2 ARG 69 -9.411 25.987 -5.985 540 H SER 70 H SER 70 -6.146 20.015 -4.176 541 HA SER 70 HA SER 70 -6.171 17.547 -2.738 542 HG SER 70 HG SER 70 -4.669 19.460 -0.911 543 HB2 SER 70 2HB SER 70 -6.995 20.426 -1.887 544 HB3 SER 70 1HB SER 70 -6.708 19.116 -0.755 545 H PHE 71 H PHE 71 -7.649 16.447 -1.585 546 HA PHE 71 HA PHE 71 -10.478 16.571 -2.690 547 HD1 PHE 71 HD2 PHE 71 -10.179 14.547 -5.028 548 HD2 PHE 71 HD1 PHE 71 -6.882 14.120 -2.287 549 HE1 PHE 71 HE2 PHE 71 -8.631 14.138 -6.915 550 HE2 PHE 71 HE1 PHE 71 -5.383 13.686 -4.185 551 HZ PHE 71 HZ PHE 71 -6.259 13.706 -6.473 552 HB2 PHE 71 2HB PHE 71 -9.211 14.126 -1.427 553 HB3 PHE 71 1HB PHE 71 -10.561 14.182 -2.502 554 H SER 72 H SER 72 -9.229 16.329 0.655 555 HA SER 72 HA SER 72 -11.864 16.850 1.772 556 HG SER 72 HG SER 72 -12.668 15.220 0.395 557 HB2 SER 72 2HB SER 72 -11.116 13.878 1.979 558 HB3 SER 72 1HB SER 72 -12.232 14.653 3.089 559 H VAL 73 H VAL 73 -8.878 15.200 2.939 560 HA VAL 73 HA VAL 73 -8.845 17.099 5.335 561 HB VAL 73 HB VAL 73 -8.270 14.765 5.859 562 HG11 VAL 73 1HG1 VAL 73 -7.152 13.875 3.874 563 HG12 VAL 73 2HG1 VAL 73 -5.975 13.818 5.193 564 HG13 VAL 73 3HG1 VAL 73 -5.856 15.096 3.968 565 HG21 VAL 73 3HG2 VAL 73 -5.730 16.467 6.212 566 HG22 VAL 73 1HG2 VAL 73 -6.324 15.161 7.252 567 HG23 VAL 73 2HG2 VAL 73 -7.191 16.710 7.185 568 H ASP 74 H ASP 74 -7.010 18.520 5.611 569 HA ASP 74 HA ASP 74 -6.093 19.885 3.205 570 HB2 ASP 74 2HB ASP 74 -6.315 20.616 5.879 571 HB3 ASP 74 1HB ASP 74 -4.588 20.336 5.809 572 H THR 75 H THR 75 -4.222 17.591 5.332 573 HA THR 75 HA THR 75 -2.020 17.383 3.312 574 HB THR 75 HB THR 75 -1.683 17.102 5.793 575 HG1 THR 75 HG1 THR 75 -0.104 15.431 5.342 576 HG21 THR 75 3HG2 THR 75 -2.365 14.105 5.385 577 HG22 THR 75 1HG2 THR 75 -3.391 15.189 6.338 578 HG23 THR 75 2HG2 THR 75 -1.716 14.870 6.819 579 H ALA 76 H ALA 76 -3.992 17.057 1.706 580 HA ALA 76 HA ALA 76 -3.608 14.233 0.717 581 HB1 ALA 76 3HB ALA 76 -6.075 13.866 0.218 582 HB2 ALA 76 1HB ALA 76 -6.446 15.346 1.167 583 HB3 ALA 76 2HB ALA 76 -5.657 13.950 1.944 584 H HIS 77 H HIS 77 -3.391 14.011 -1.353 585 HA HIS 77 HA HIS 77 -3.342 16.478 -3.169 586 HD1 HIS 77 HD1 HIS 77 -0.372 15.684 0.407 587 HD2 HIS 77 HD2 HIS 77 -1.769 18.832 -2.124 588 HE1 HIS 77 HE1 HIS 77 -0.059 17.951 1.572 589 HB2 HIS 77 2HB HIS 77 -0.931 14.951 -1.981 590 HB3 HIS 77 1HB HIS 77 -0.821 16.268 -3.162 591 H ARG 78 H ARG 78 -2.271 16.026 -5.291 592 HA ARG 78 HA ARG 78 -2.973 13.191 -6.268 593 HE ARG 78 HE ARG 78 -4.463 11.436 -7.295 594 HB2 ARG 78 2HB ARG 78 -4.567 14.886 -6.980 595 HB3 ARG 78 1HB ARG 78 -3.321 15.878 -7.657 596 HG2 ARG 78 2HG ARG 78 -4.639 14.573 -9.337 597 HG3 ARG 78 1HG ARG 78 -2.901 14.478 -9.507 598 HD2 ARG 78 2HD ARG 78 -3.920 12.334 -10.079 599 HD3 ARG 78 1HD ARG 78 -2.788 12.191 -8.791 600 HH11 ARG 78 2HH1 ARG 78 -6.049 12.658 -10.144 601 HH12 ARG 78 1HH1 ARG 78 -7.634 11.903 -9.672 602 HH21 ARG 78 1HH2 ARG 78 -6.242 10.591 -6.851 603 HH22 ARG 78 2HH2 ARG 78 -7.740 10.755 -7.894 604 H ALA 79 H ALA 79 -1.177 12.022 -6.721 605 HA ALA 79 HA ALA 79 1.245 13.326 -8.023 606 HB1 ALA 79 3HB ALA 79 2.187 10.959 -7.886 607 HB2 ALA 79 1HB ALA 79 0.742 10.452 -6.995 608 HB3 ALA 79 2HB ALA 79 1.846 11.706 -6.318 609 H ALA 80 H ALA 80 1.450 13.282 -10.112 610 HA ALA 80 HA ALA 80 -0.344 11.746 -11.988 611 HB1 ALA 80 3HB ALA 80 1.053 13.091 -13.722 612 HB2 ALA 80 1HB ALA 80 1.849 13.857 -12.366 613 HB3 ALA 80 2HB ALA 80 0.078 14.039 -12.588 614 H SER 81 H SER 81 3.252 11.542 -11.316 615 HA SER 81 HA SER 81 3.123 8.656 -12.369 616 HG SER 81 HG SER 81 5.657 9.336 -14.599 617 HB2 SER 81 2HB SER 81 4.302 10.732 -13.712 618 HB3 SER 81 1HB SER 81 5.608 10.458 -12.571 619 H VAL 82 H VAL 82 5.785 8.058 -11.703 620 HA VAL 82 HA VAL 82 5.659 7.646 -8.665 621 HB VAL 82 HB VAL 82 7.659 6.352 -10.601 622 HG11 VAL 82 1HG1 VAL 82 7.545 6.382 -7.524 623 HG12 VAL 82 2HG1 VAL 82 8.949 6.547 -8.590 624 HG13 VAL 82 3HG1 VAL 82 8.194 4.970 -8.392 625 HG21 VAL 82 3HG2 VAL 82 5.672 5.101 -10.878 626 HG22 VAL 82 1HG2 VAL 82 5.134 5.296 -9.182 627 HG23 VAL 82 2HG2 VAL 82 6.447 4.187 -9.577 628 H GLU 83 H GLU 83 8.021 9.019 -11.075 629 HA GLU 83 HA GLU 83 9.590 10.539 -9.244 630 HB2 GLU 83 2HB GLU 83 8.753 11.095 -12.139 631 HB3 GLU 83 1HB GLU 83 9.936 12.054 -11.286 632 HG2 GLU 83 2HG GLU 83 11.604 10.351 -11.276 633 HG3 GLU 83 1HG GLU 83 10.463 9.044 -11.304 634 H GLU 84 H GLU 84 6.553 12.156 -10.722 635 HA GLU 84 HA GLU 84 6.349 14.074 -8.601 636 HB2 GLU 84 2HB GLU 84 4.106 12.661 -10.179 637 HB3 GLU 84 1HB GLU 84 3.813 14.031 -9.145 638 HG2 GLU 84 2HG GLU 84 4.024 15.333 -10.905 639 HG3 GLU 84 1HG GLU 84 5.760 15.134 -10.812 640 H ALA 85 H ALA 85 5.607 10.750 -8.074 641 HA ALA 85 HA ALA 85 4.056 11.279 -5.516 642 HB1 ALA 85 3HB ALA 85 5.066 8.562 -6.527 643 HB2 ALA 85 1HB ALA 85 3.451 9.223 -6.901 644 HB3 ALA 85 2HB ALA 85 3.908 8.856 -5.223 645 H VAL 86 H VAL 86 7.386 10.483 -6.411 646 HA VAL 86 HA VAL 86 8.286 10.358 -3.505 647 HB VAL 86 HB VAL 86 9.665 9.840 -6.177 648 HG11 VAL 86 1HG1 VAL 86 11.164 10.217 -3.512 649 HG12 VAL 86 2HG1 VAL 86 11.349 11.200 -4.991 650 HG13 VAL 86 3HG1 VAL 86 11.843 9.500 -5.005 651 HG21 VAL 86 3HG2 VAL 86 8.473 7.909 -4.961 652 HG22 VAL 86 1HG2 VAL 86 9.518 8.185 -3.552 653 HG23 VAL 86 2HG2 VAL 86 10.218 7.629 -5.085 654 H ASP 87 H ASP 87 8.722 12.735 -6.249 655 HA ASP 87 HA ASP 87 9.866 14.775 -4.583 656 HB2 ASP 87 2HB ASP 87 8.565 14.683 -7.333 657 HB3 ASP 87 1HB ASP 87 8.526 16.239 -6.574 658 H ILE 88 H ILE 88 6.330 14.127 -4.897 659 HA ILE 88 HA ILE 88 5.839 16.534 -3.168 660 HB ILE 88 HB ILE 88 3.731 16.503 -2.987 661 HG12 ILE 88 2HG1 ILE 88 2.987 13.877 -4.366 662 HG13 ILE 88 1HG1 ILE 88 3.392 13.875 -2.679 663 HG21 ILE 88 1HG2 ILE 88 2.778 16.744 -5.225 664 HG22 ILE 88 2HG2 ILE 88 3.941 15.591 -5.912 665 HG23 ILE 88 3HG2 ILE 88 4.505 17.162 -5.332 666 HD11 ILE 88 3HD1 ILE 88 1.633 16.041 -2.607 667 HD12 ILE 88 1HD1 ILE 88 1.189 14.378 -2.299 668 HD13 ILE 88 2HD1 ILE 88 0.934 15.065 -3.918 669 H ALA 89 H ALA 89 6.148 13.087 -2.442 670 HA ALA 89 HA ALA 89 5.549 13.377 0.459 671 HB1 ALA 89 3HB ALA 89 7.278 11.331 -1.067 672 HB2 ALA 89 1HB ALA 89 5.586 11.132 -0.553 673 HB3 ALA 89 2HB ALA 89 6.869 11.236 0.661 674 H ALA 90 H ALA 90 8.712 13.565 -1.279 675 HA ALA 90 HA ALA 90 10.216 14.409 1.133 676 HB1 ALA 90 3HB ALA 90 12.019 14.870 -0.661 677 HB2 ALA 90 1HB ALA 90 10.803 14.506 -1.898 678 HB3 ALA 90 2HB ALA 90 11.295 13.246 -0.741 679 H SER 91 H SER 91 8.304 16.289 -1.006 680 HA SER 91 HA SER 91 9.455 19.009 -0.271 681 HG SER 91 HG SER 91 8.672 17.859 -3.058 682 HB2 SER 91 2HB SER 91 6.924 18.152 -1.802 683 HB3 SER 91 1HB SER 91 7.371 19.837 -1.476 684 H LEU 92 H LEU 92 7.016 16.880 1.120 685 HA LEU 92 HA LEU 92 5.923 19.133 2.810 686 HG LEU 92 HG LEU 92 5.239 15.794 1.426 687 HB2 LEU 92 2HB LEU 92 4.191 17.557 3.700 688 HB3 LEU 92 1HB LEU 92 4.109 18.149 2.078 689 HD11 LEU 92 1HD1 LEU 92 4.464 13.939 2.839 690 HD12 LEU 92 2HD1 LEU 92 3.867 15.068 4.088 691 HD13 LEU 92 3HD1 LEU 92 5.603 14.944 3.713 692 HD21 LEU 92 3HD2 LEU 92 2.983 16.553 0.624 693 HD22 LEU 92 1HD2 LEU 92 2.240 16.009 2.154 694 HD23 LEU 92 2HD2 LEU 92 2.984 14.840 1.039 695 H ASP 93 H ASP 93 7.253 15.922 3.759 696 HA ASP 93 HA ASP 93 9.529 16.705 4.972 697 HB2 ASP 93 2HB ASP 93 7.473 17.380 7.110 698 HB3 ASP 93 1HB ASP 93 8.895 16.531 7.635 699 H ALA 94 H ALA 94 10.120 14.622 4.321 700 HA ALA 94 HA ALA 94 9.685 12.408 6.285 701 HB1 ALA 94 3HB ALA 94 8.542 10.817 4.758 702 HB2 ALA 94 1HB ALA 94 8.504 12.031 3.448 703 HB3 ALA 94 2HB ALA 94 7.565 12.278 4.936 704 H GLU 95 H GLU 95 11.062 10.740 6.223 705 HA GLU 95 HA GLU 95 13.354 10.714 4.226 706 HB2 GLU 95 2HB GLU 95 13.519 8.661 6.399 707 HB3 GLU 95 1HB GLU 95 14.754 9.531 5.536 708 HG2 GLU 95 2HG GLU 95 14.184 11.585 7.093 709 HG3 GLU 95 1HG GLU 95 13.150 10.463 7.980 710 H THR 96 H THR 96 11.234 8.149 5.729 711 HA THR 96 HA THR 96 11.146 6.674 3.083 712 HB THR 96 HB THR 96 9.561 5.003 4.426 713 HG1 THR 96 HG1 THR 96 9.226 6.248 6.344 714 HG21 THR 96 3HG2 THR 96 11.521 3.906 5.473 715 HG22 THR 96 1HG2 THR 96 12.466 5.385 5.190 716 HG23 THR 96 2HG2 THR 96 11.906 4.393 3.802 717 H ALA 97 H ALA 97 9.132 5.794 2.279 718 HA ALA 97 HA ALA 97 6.606 6.990 3.367 719 HB1 ALA 97 3HB ALA 97 5.717 7.493 0.909 720 HB2 ALA 97 1HB ALA 97 7.431 7.436 0.416 721 HB3 ALA 97 2HB ALA 97 6.901 8.603 1.638 722 H TYR 98 H TYR 98 4.614 5.992 2.397 723 HA TYR 98 HA TYR 98 4.974 3.002 1.892 724 HD1 TYR 98 HD1 TYR 98 4.808 0.795 3.802 725 HD2 TYR 98 HD2 TYR 98 5.040 4.666 5.583 726 HE1 TYR 98 HE1 TYR 98 6.697 0.037 5.191 727 HE2 TYR 98 HE2 TYR 98 6.849 3.891 7.042 728 HH TYR 98 HH TYR 98 8.422 2.381 7.276 729 HB2 TYR 98 2HB TYR 98 3.216 4.215 4.113 730 HB3 TYR 98 1HB TYR 98 2.947 2.603 3.517 731 H VAL 99 H VAL 99 2.907 1.940 1.296 732 HA VAL 99 HA VAL 99 0.933 3.634 -0.310 733 HB VAL 99 HB VAL 99 1.778 3.217 -2.266 734 HG11 VAL 99 1HG1 VAL 99 4.014 3.172 -1.467 735 HG12 VAL 99 2HG1 VAL 99 3.817 2.267 -2.960 736 HG13 VAL 99 3HG1 VAL 99 4.032 1.429 -1.417 737 HG21 VAL 99 3HG2 VAL 99 1.793 1.105 -3.557 738 HG22 VAL 99 1HG2 VAL 99 0.270 1.442 -2.700 739 HG23 VAL 99 2HG2 VAL 99 1.403 0.254 -2.051 740 H ILE 100 H ILE 100 -1.108 2.998 0.560 741 HA ILE 100 HA ILE 100 -1.586 0.153 1.178 742 HB ILE 100 HB ILE 100 -3.868 2.088 0.610 743 HG12 ILE 100 2HG1 ILE 100 -2.718 3.078 2.412 744 HG13 ILE 100 1HG1 ILE 100 -3.996 2.179 3.167 745 HG21 ILE 100 1HG2 ILE 100 -5.312 0.591 1.838 746 HG22 ILE 100 2HG2 ILE 100 -3.968 -0.445 2.337 747 HG23 ILE 100 3HG2 ILE 100 -4.520 -0.437 0.641 748 HD11 ILE 100 3HD1 ILE 100 -1.752 2.179 4.366 749 HD12 ILE 100 1HD1 ILE 100 -1.097 1.179 3.054 750 HD13 ILE 100 2HD1 ILE 100 -2.431 0.536 4.064 751 H GLY 101 H GLY 101 -2.716 1.723 -1.660 752 HA2 GLY 101 2HA GLY 101 -2.521 0.936 -3.917 753 HA3 GLY 101 1HA GLY 101 -1.437 -0.266 -3.367 754 H GLY 102 H GLY 102 -2.431 -2.227 -4.838 755 HA2 GLY 102 2HA GLY 102 -4.852 -0.421 -5.606 756 HA3 GLY 102 1HA GLY 102 -3.291 -0.243 -6.311 757 H ALA 103 H ALA 103 -6.229 -1.704 -6.881 758 HA ALA 103 HA ALA 103 -5.976 -3.119 -9.196 759 HB1 ALA 103 3HB ALA 103 -7.976 -1.645 -8.305 760 HB2 ALA 103 1HB ALA 103 -7.862 -1.640 -10.045 761 HB3 ALA 103 2HB ALA 103 -7.324 -0.260 -9.130 762 H ALA 104 H ALA 104 -4.728 0.172 -9.239 763 HA ALA 104 HA ALA 104 -2.996 -0.546 -11.666 764 HB1 ALA 104 3HB ALA 104 -4.412 1.387 -12.254 765 HB2 ALA 104 1HB ALA 104 -2.689 1.848 -12.158 766 HB3 ALA 104 2HB ALA 104 -3.794 2.293 -10.837 767 H ILE 105 H ILE 105 -2.920 0.397 -8.267 768 HA ILE 105 HA ILE 105 -0.401 1.900 -8.465 769 HB ILE 105 HB ILE 105 -1.436 0.969 -5.813 770 HG12 ILE 105 2HG1 ILE 105 -3.506 1.868 -6.577 771 HG13 ILE 105 1HG1 ILE 105 -2.768 3.048 -5.609 772 HG21 ILE 105 1HG2 ILE 105 -0.565 3.018 -4.891 773 HG22 ILE 105 2HG2 ILE 105 -0.037 3.597 -6.469 774 HG23 ILE 105 3HG2 ILE 105 0.736 2.180 -5.731 775 HD11 ILE 105 3HD1 ILE 105 -2.981 4.549 -7.462 776 HD12 ILE 105 1HD1 ILE 105 -3.775 3.181 -8.302 777 HD13 ILE 105 2HD1 ILE 105 -2.036 3.466 -8.521 778 H TYR 106 H TYR 106 -0.839 -1.115 -6.585 779 HA TYR 106 HA TYR 106 2.011 -1.754 -6.283 780 HD1 TYR 106 HD1 TYR 106 2.713 -4.610 -5.390 781 HD2 TYR 106 HD2 TYR 106 -0.539 -2.610 -3.396 782 HE1 TYR 106 HE1 TYR 106 3.523 -5.397 -3.244 783 HE2 TYR 106 HE2 TYR 106 0.328 -3.379 -1.222 784 HH TYR 106 HH TYR 106 2.347 -4.364 -0.181 785 HB2 TYR 106 2HB TYR 106 -0.651 -3.132 -5.830 786 HB3 TYR 106 1HB TYR 106 0.516 -4.205 -6.497 787 H ALA 107 H ALA 107 -0.181 -2.507 -8.988 788 HA ALA 107 HA ALA 107 1.678 -4.123 -10.623 789 HB1 ALA 107 3HB ALA 107 -0.086 -3.608 -12.394 790 HB2 ALA 107 1HB ALA 107 -0.794 -2.401 -11.308 791 HB3 ALA 107 2HB ALA 107 -0.820 -4.109 -10.878 792 H LEU 108 H LEU 108 1.116 -0.615 -10.584 793 HA LEU 108 HA LEU 108 3.269 -0.171 -12.659 794 HG LEU 108 HG LEU 108 2.013 2.167 -10.042 795 HB2 LEU 108 2HB LEU 108 2.499 1.897 -13.027 796 HB3 LEU 108 1HB LEU 108 1.024 1.213 -12.433 797 HD11 LEU 108 1HD1 LEU 108 3.222 4.250 -10.306 798 HD12 LEU 108 2HD1 LEU 108 2.993 4.305 -12.060 799 HD13 LEU 108 3HD1 LEU 108 4.105 3.130 -11.327 800 HD21 LEU 108 3HD2 LEU 108 0.650 4.231 -10.401 801 HD22 LEU 108 1HD2 LEU 108 -0.234 2.768 -10.878 802 HD23 LEU 108 2HD2 LEU 108 0.500 3.841 -12.127 803 H PHE 109 H PHE 109 2.957 0.220 -9.108 804 HA PHE 109 HA PHE 109 5.683 1.250 -8.804 805 HD1 PHE 109 HD2 PHE 109 6.723 2.259 -6.471 806 HD2 PHE 109 HD1 PHE 109 2.496 2.682 -7.038 807 HE1 PHE 109 HE2 PHE 109 6.939 4.659 -6.145 808 HE2 PHE 109 HE1 PHE 109 2.703 5.089 -6.585 809 HZ PHE 109 HZ PHE 109 4.942 6.102 -6.208 810 HB2 PHE 109 2HB PHE 109 3.465 0.405 -6.862 811 HB3 PHE 109 1HB PHE 109 5.067 0.289 -6.245 812 H GLN 110 H GLN 110 4.721 -2.160 -8.773 813 HA GLN 110 HA GLN 110 6.551 -3.589 -7.337 814 HB2 GLN 110 2HB GLN 110 5.545 -3.953 -10.168 815 HB3 GLN 110 1HB GLN 110 6.868 -4.976 -9.730 816 HG2 GLN 110 2HG GLN 110 5.663 -5.978 -7.833 817 HG3 GLN 110 1HG GLN 110 4.348 -4.854 -7.966 818 HE21 GLN 110 1HE2 GLN 110 5.492 -7.823 -9.062 819 HE22 GLN 110 2HE2 GLN 110 4.118 -8.124 -10.246 820 HA PRO 111 HA PRO 111 10.851 -3.087 -9.552 821 HB2 PRO 111 2HB PRO 111 11.131 -1.240 -11.607 822 HB3 PRO 111 1HB PRO 111 10.634 -2.926 -11.855 823 HG2 PRO 111 2HG PRO 111 8.809 -0.457 -11.601 824 HG3 PRO 111 1HG PRO 111 8.794 -1.696 -12.895 825 HD2 PRO 111 2HD PRO 111 7.064 -1.824 -10.815 826 HD3 PRO 111 1HD PRO 111 7.746 -3.325 -11.482 827 H HIS 112 H HIS 112 8.875 -0.381 -8.707 828 HA HIS 112 HA HIS 112 11.253 1.471 -8.160 829 HD1 HIS 112 HD1 HIS 112 11.196 3.585 -10.362 830 HD2 HIS 112 HD2 HIS 112 7.295 1.870 -10.605 831 HE1 HIS 112 HE1 HIS 112 10.249 3.832 -12.772 832 HB2 HIS 112 2HB HIS 112 8.273 2.221 -8.163 833 HB3 HIS 112 1HB HIS 112 9.639 3.301 -8.021 834 H LEU 113 H LEU 113 9.246 -0.696 -6.355 835 HA LEU 113 HA LEU 113 9.269 0.907 -3.867 836 HG LEU 113 HG LEU 113 6.740 -1.323 -2.682 837 HB2 LEU 113 2HB LEU 113 8.849 -2.131 -4.176 838 HB3 LEU 113 1HB LEU 113 8.874 -1.313 -2.641 839 HD11 LEU 113 1HD1 LEU 113 7.066 1.139 -2.863 840 HD12 LEU 113 2HD1 LEU 113 5.541 0.688 -3.648 841 HD13 LEU 113 3HD1 LEU 113 6.974 1.046 -4.627 842 HD21 LEU 113 3HD2 LEU 113 5.255 -1.656 -4.597 843 HD22 LEU 113 1HD2 LEU 113 6.625 -2.784 -4.695 844 HD23 LEU 113 2HD2 LEU 113 6.607 -1.363 -5.746 845 H ASP 114 H ASP 114 10.464 0.917 -2.151 846 HA ASP 114 HA ASP 114 13.124 -0.341 -1.706 847 HB2 ASP 114 2HB ASP 114 12.317 1.817 -0.720 848 HB3 ASP 114 1HB ASP 114 10.977 1.055 0.048 849 H ARG 115 H ARG 115 9.867 -1.073 -0.245 850 HA ARG 115 HA ARG 115 10.467 -4.068 -0.453 851 HE ARG 115 HE ARG 115 12.475 -1.441 2.644 852 HB2 ARG 115 2HB ARG 115 9.938 -2.459 2.097 853 HB3 ARG 115 1HB ARG 115 9.225 -4.042 2.020 854 HG2 ARG 115 2HG ARG 115 11.184 -5.185 2.324 855 HG3 ARG 115 1HG ARG 115 12.127 -4.120 1.323 856 HD2 ARG 115 2HD ARG 115 11.110 -3.091 4.047 857 HD3 ARG 115 1HD ARG 115 12.422 -4.238 4.042 858 HH11 ARG 115 2HH1 ARG 115 14.255 -4.183 3.606 859 HH12 ARG 115 1HH1 ARG 115 15.788 -3.475 2.917 860 HH21 ARG 115 1HH2 ARG 115 14.119 -0.679 1.909 861 HH22 ARG 115 2HH2 ARG 115 15.717 -1.519 2.023 862 H MET 116 H MET 116 8.731 -5.455 -0.541 863 HA MET 116 HA MET 116 5.913 -4.263 -0.965 864 HB2 MET 116 2HB MET 116 7.234 -6.769 -2.119 865 HB3 MET 116 1HB MET 116 5.483 -6.583 -2.054 866 HG2 MET 116 2HG MET 116 5.569 -4.636 -3.579 867 HG3 MET 116 1HG MET 116 7.325 -4.536 -3.414 868 HE1 MET 116 3HE MET 116 4.406 -6.290 -5.503 869 HE2 MET 116 1HE MET 116 4.605 -7.446 -4.147 870 HE3 MET 116 2HE MET 116 5.105 -7.903 -5.797 871 H VAL 117 H VAL 117 5.676 -4.057 1.307 872 HA VAL 117 HA VAL 117 5.198 -6.340 3.117 873 HB VAL 117 HB VAL 117 4.359 -3.424 3.145 874 HG11 VAL 117 1HG1 VAL 117 3.687 -3.656 5.560 875 HG12 VAL 117 2HG1 VAL 117 3.902 -5.427 5.454 876 HG13 VAL 117 3HG1 VAL 117 2.630 -4.618 4.515 877 HG21 VAL 117 3HG2 VAL 117 6.331 -4.949 4.986 878 HG22 VAL 117 1HG2 VAL 117 6.057 -3.189 4.979 879 HG23 VAL 117 2HG2 VAL 117 6.836 -3.979 3.585 880 H LEU 118 H LEU 118 3.710 -7.852 2.945 881 HA LEU 118 HA LEU 118 0.910 -7.185 1.839 882 HG LEU 118 HG LEU 118 -0.285 -9.119 0.732 883 HB2 LEU 118 2HB LEU 118 2.218 -8.284 0.116 884 HB3 LEU 118 1HB LEU 118 2.719 -9.587 1.174 885 HD11 LEU 118 1HD1 LEU 118 1.633 -10.295 -1.395 886 HD12 LEU 118 2HD1 LEU 118 0.364 -9.046 -1.511 887 HD13 LEU 118 3HD1 LEU 118 -0.106 -10.711 -1.298 888 HD21 LEU 118 3HD2 LEU 118 1.241 -11.789 0.831 889 HD22 LEU 118 1HD2 LEU 118 -0.501 -11.510 1.023 890 HD23 LEU 118 2HD2 LEU 118 0.624 -10.993 2.295 891 H SER 119 H SER 119 -0.804 -8.067 2.837 892 HA SER 119 HA SER 119 -0.381 -9.759 5.395 893 HG SER 119 HG SER 119 -0.870 -7.983 7.112 894 HB2 SER 119 2HB SER 119 -2.087 -7.322 4.678 895 HB3 SER 119 1HB SER 119 -2.648 -8.400 5.933 896 H ARG 120 H ARG 120 -0.883 -11.858 4.894 897 HA ARG 120 HA ARG 120 -2.917 -12.430 2.745 898 HE ARG 120 HE ARG 120 -0.192 -15.337 0.937 899 HB2 ARG 120 2HB ARG 120 -1.971 -14.952 3.784 900 HB3 ARG 120 1HB ARG 120 -1.914 -14.271 2.183 901 HG2 ARG 120 2HG ARG 120 0.323 -13.163 2.776 902 HG3 ARG 120 1HG ARG 120 0.178 -13.812 4.383 903 HD2 ARG 120 2HD ARG 120 1.715 -15.174 3.308 904 HD3 ARG 120 1HD ARG 120 0.303 -16.193 3.505 905 HH11 ARG 120 2HH1 ARG 120 2.884 -16.329 2.260 906 HH12 ARG 120 1HH1 ARG 120 3.570 -16.667 0.637 907 HH21 ARG 120 1HH2 ARG 120 0.667 -15.698 -0.936 908 HH22 ARG 120 2HH2 ARG 120 2.340 -16.394 -1.085 909 H VAL 121 H VAL 121 -4.995 -12.378 3.313 910 HA VAL 121 HA VAL 121 -5.878 -13.186 6.092 911 HB VAL 121 HB VAL 121 -7.708 -11.896 4.046 912 HG11 VAL 121 1HG1 VAL 121 -8.697 -12.850 6.215 913 HG12 VAL 121 2HG1 VAL 121 -8.934 -11.102 6.060 914 HG13 VAL 121 3HG1 VAL 121 -7.683 -11.732 7.144 915 HG21 VAL 121 3HG2 VAL 121 -5.808 -10.268 5.859 916 HG22 VAL 121 1HG2 VAL 121 -7.260 -9.637 5.082 917 HG23 VAL 121 2HG2 VAL 121 -5.933 -10.228 4.100 918 HA PRO 122 HA PRO 122 -7.759 -16.992 4.091 919 HB2 PRO 122 2HB PRO 122 -8.571 -17.618 6.957 920 HB3 PRO 122 1HB PRO 122 -7.721 -18.643 5.791 921 HG2 PRO 122 2HG PRO 122 -6.344 -17.512 7.865 922 HG3 PRO 122 1HG PRO 122 -5.597 -17.504 6.245 923 HD2 PRO 122 2HD PRO 122 -7.200 -15.219 7.533 924 HD3 PRO 122 1HD PRO 122 -5.550 -15.175 6.809 925 H GLY 123 H GLY 123 -9.882 -18.218 4.335 926 HA2 GLY 123 2HA GLY 123 -12.381 -18.044 4.893 927 HA3 GLY 123 1HA GLY 123 -12.303 -16.311 4.699 928 H GLU 124 H GLU 124 -10.593 -16.752 2.274 929 HA GLU 124 HA GLU 124 -10.685 -17.053 -0.036 930 HB2 GLU 124 2HB GLU 124 -12.331 -19.465 0.778 931 HB3 GLU 124 1HB GLU 124 -11.685 -19.221 -0.824 932 HG2 GLU 124 2HG GLU 124 -9.626 -20.035 -0.229 933 HG3 GLU 124 1HG GLU 124 -9.442 -18.834 1.030 934 H TYR 125 H TYR 125 -11.447 -15.748 -1.468 935 HA TYR 125 HA TYR 125 -14.430 -15.051 -1.620 936 HD1 TYR 125 HD1 TYR 125 -15.622 -12.976 0.417 937 HD2 TYR 125 HD2 TYR 125 -11.539 -14.002 1.242 938 HE1 TYR 125 HE1 TYR 125 -16.097 -12.963 2.846 939 HE2 TYR 125 HE2 TYR 125 -12.031 -14.011 3.656 940 HH TYR 125 HH TYR 125 -13.481 -13.609 5.186 941 HB2 TYR 125 2HB TYR 125 -12.139 -13.083 -0.961 942 HB3 TYR 125 1HB TYR 125 -13.780 -12.608 -1.306 943 H GLU 126 H GLU 126 -15.035 -14.849 -3.726 944 HA GLU 126 HA GLU 126 -13.429 -14.578 -6.009 945 HB2 GLU 126 2HB GLU 126 -16.228 -13.356 -5.956 946 HB3 GLU 126 1HB GLU 126 -15.377 -14.039 -7.327 947 HG2 GLU 126 2HG GLU 126 -15.828 -16.342 -6.604 948 HG3 GLU 126 1HG GLU 126 -16.314 -15.841 -4.993 949 H GLY 127 H GLY 127 -15.070 -11.713 -4.651 950 HA2 GLY 127 2HA GLY 127 -14.064 -9.481 -4.308 951 HA3 GLY 127 1HA GLY 127 -12.647 -10.008 -5.174 952 H ASP 128 H ASP 128 -13.114 -7.624 -5.500 953 HA ASP 128 HA ASP 128 -13.902 -7.373 -8.417 954 HB2 ASP 128 2HB ASP 128 -14.780 -5.301 -6.293 955 HB3 ASP 128 1HB ASP 128 -14.768 -5.022 -8.019 956 H THR 129 H THR 129 -12.021 -5.880 -5.741 957 HA THR 129 HA THR 129 -10.058 -4.675 -7.700 958 HB THR 129 HB THR 129 -9.687 -4.861 -4.681 959 HG1 THR 129 HG1 THR 129 -10.828 -3.040 -4.429 960 HG21 THR 129 3HG2 THR 129 -7.759 -3.861 -6.165 961 HG22 THR 129 1HG2 THR 129 -8.377 -2.799 -4.872 962 HG23 THR 129 2HG2 THR 129 -8.908 -2.550 -6.557 963 H TYR 130 H TYR 130 -8.432 -5.889 -8.466 964 HA TYR 130 HA TYR 130 -7.350 -8.307 -6.959 965 HD1 TYR 130 HD1 TYR 130 -9.988 -7.519 -9.795 966 HD2 TYR 130 HD2 TYR 130 -7.628 -10.961 -8.761 967 HE1 TYR 130 HE1 TYR 130 -11.918 -8.992 -10.236 968 HE2 TYR 130 HE2 TYR 130 -9.561 -12.414 -9.263 969 HH TYR 130 HH TYR 130 -12.321 -11.768 -9.012 970 HB2 TYR 130 2HB TYR 130 -7.357 -7.491 -9.925 971 HB3 TYR 130 1HB TYR 130 -6.499 -8.875 -9.312 972 H TYR 131 H TYR 131 -5.303 -8.739 -6.551 973 HA TYR 131 HA TYR 131 -3.223 -6.557 -6.651 974 HD1 TYR 131 HD2 TYR 131 -0.968 -9.824 -5.643 975 HD2 TYR 131 HD1 TYR 131 -2.182 -6.411 -3.379 976 HE1 TYR 131 HE2 TYR 131 1.339 -9.560 -4.852 977 HE2 TYR 131 HE1 TYR 131 0.057 -6.316 -2.371 978 HH TYR 131 HH TYR 131 2.171 -7.109 -2.407 979 HB2 TYR 131 2HB TYR 131 -3.850 -7.825 -4.541 980 HB3 TYR 131 1HB TYR 131 -3.381 -9.315 -5.240 981 HA PRO 132 HA PRO 132 -0.866 -8.663 -10.012 982 HB2 PRO 132 2HB PRO 132 1.735 -7.576 -8.996 983 HB3 PRO 132 1HB PRO 132 0.879 -7.170 -10.485 984 HG2 PRO 132 2HG PRO 132 1.055 -5.429 -8.396 985 HG3 PRO 132 1HG PRO 132 -0.423 -5.488 -9.370 986 HD2 PRO 132 2HD PRO 132 0.024 -6.785 -6.647 987 HD3 PRO 132 1HD PRO 132 -1.348 -5.804 -7.249 988 H GLU 133 H GLU 133 1.513 -9.803 -10.401 989 HA GLU 133 HA GLU 133 1.474 -12.225 -8.598 990 HB2 GLU 133 2HB GLU 133 2.786 -13.431 -10.259 991 HB3 GLU 133 1HB GLU 133 1.227 -12.879 -10.783 992 HG2 GLU 133 2HG GLU 133 2.785 -10.881 -11.910 993 HG3 GLU 133 1HG GLU 133 3.951 -12.201 -11.861 994 H TRP 134 H TRP 134 3.464 -13.242 -7.983 995 HA TRP 134 HA TRP 134 5.466 -11.294 -6.815 996 HD1 TRP 134 HD1 TRP 134 4.677 -15.523 -5.787 997 HE1 TRP 134 HE1 TRP 134 2.365 -16.738 -5.384 998 HE3 TRP 134 HE3 TRP 134 2.237 -11.495 -3.840 999 HZ2 TRP 134 HZ2 TRP 134 -0.112 -15.894 -4.263 1000 HZ3 TRP 134 HZ3 TRP 134 -0.139 -11.727 -3.238 1001 HH2 TRP 134 HH2 TRP 134 -1.296 -13.893 -3.410 1002 HB2 TRP 134 2HB TRP 134 5.645 -12.787 -4.721 1003 HB3 TRP 134 1HB TRP 134 4.334 -11.666 -4.840 1004 H ASP 135 H ASP 135 7.554 -11.884 -7.113 1005 HA ASP 135 HA ASP 135 8.055 -14.439 -8.693 1006 HB2 ASP 135 2HB ASP 135 8.455 -11.682 -9.431 1007 HB3 ASP 135 1HB ASP 135 10.027 -12.132 -8.847 1008 H ALA 136 H ALA 136 10.659 -14.512 -8.633 1009 HA ALA 136 HA ALA 136 11.639 -14.607 -5.696 1010 HB1 ALA 136 3HB ALA 136 10.890 -16.932 -6.562 1011 HB2 ALA 136 1HB ALA 136 12.578 -16.863 -5.996 1012 HB3 ALA 136 2HB ALA 136 12.226 -16.851 -7.749 1013 H ALA 137 H ALA 137 12.525 -13.728 -8.858 1014 HA ALA 137 HA ALA 137 15.337 -13.001 -7.845 1015 HB1 ALA 137 3HB ALA 137 15.494 -14.608 -9.726 1016 HB2 ALA 137 1HB ALA 137 16.129 -13.014 -10.209 1017 HB3 ALA 137 2HB ALA 137 14.527 -13.541 -10.780 1018 H GLU 138 H GLU 138 12.387 -11.477 -8.976 1019 HA GLU 138 HA GLU 138 13.672 -8.753 -8.989 1020 HB2 GLU 138 2HB GLU 138 10.771 -9.750 -8.943 1021 HB3 GLU 138 1HB GLU 138 11.204 -8.093 -8.705 1022 HG2 GLU 138 2HG GLU 138 12.165 -9.470 -11.258 1023 HG3 GLU 138 1HG GLU 138 10.542 -8.829 -11.102 1024 H TRP 139 H TRP 139 11.620 -10.503 -6.597 1025 HA TRP 139 HA TRP 139 12.953 -8.959 -4.321 1026 HD1 TRP 139 HD1 TRP 139 8.725 -10.808 -4.723 1027 HE1 TRP 139 HE1 TRP 139 7.143 -10.354 -6.866 1028 HE3 TRP 139 HE3 TRP 139 10.726 -6.347 -6.069 1029 HZ2 TRP 139 HZ2 TRP 139 7.360 -8.579 -8.989 1030 HZ3 TRP 139 HZ3 TRP 139 10.101 -5.368 -8.260 1031 HH2 TRP 139 HH2 TRP 139 8.472 -6.487 -9.709 1032 HB2 TRP 139 2HB TRP 139 10.488 -9.003 -3.227 1033 HB3 TRP 139 1HB TRP 139 11.107 -7.702 -4.173 1034 H GLU 140 H GLU 140 13.407 -9.912 -2.495 1035 HA GLU 140 HA GLU 140 12.718 -12.860 -2.089 1036 HB2 GLU 140 2HB GLU 140 14.792 -13.253 -1.330 1037 HB3 GLU 140 1HB GLU 140 15.224 -11.859 -2.265 1038 HG2 GLU 140 2HG GLU 140 15.061 -10.507 0.010 1039 HG3 GLU 140 1HG GLU 140 14.894 -12.061 0.810 1040 H LEU 141 H LEU 141 13.078 -13.013 0.712 1041 HA LEU 141 HA LEU 141 10.521 -11.625 1.688 1042 HG LEU 141 HG LEU 141 9.251 -14.804 3.191 1043 HB2 LEU 141 2HB LEU 141 10.857 -14.332 1.400 1044 HB3 LEU 141 1HB LEU 141 11.534 -14.161 2.986 1045 HD11 LEU 141 1HD1 LEU 141 8.057 -13.053 4.434 1046 HD12 LEU 141 2HD1 LEU 141 9.077 -11.788 3.747 1047 HD13 LEU 141 3HD1 LEU 141 9.783 -12.965 4.853 1048 HD21 LEU 141 3HD2 LEU 141 8.539 -14.195 0.838 1049 HD22 LEU 141 1HD2 LEU 141 8.339 -12.510 1.351 1050 HD23 LEU 141 2HD2 LEU 141 7.330 -13.787 2.066 1051 H ASP 142 H ASP 142 11.019 -10.003 3.059 1052 HA ASP 142 HA ASP 142 13.623 -9.738 4.545 1053 HB2 ASP 142 2HB ASP 142 12.332 -7.868 3.219 1054 HB3 ASP 142 1HB ASP 142 11.224 -7.825 4.577 1055 H ALA 143 H ALA 143 10.086 -9.912 5.449 1056 HA ALA 143 HA ALA 143 10.817 -11.562 7.879 1057 HB1 ALA 143 3HB ALA 143 11.033 -9.121 8.617 1058 HB2 ALA 143 1HB ALA 143 9.722 -9.945 9.501 1059 HB3 ALA 143 2HB ALA 143 9.346 -8.830 8.163 1060 H GLU 144 H GLU 144 9.330 -13.145 8.270 1061 HA GLU 144 HA GLU 144 6.405 -12.710 7.440 1062 HB2 GLU 144 2HB GLU 144 7.841 -14.502 6.290 1063 HB3 GLU 144 1HB GLU 144 7.728 -15.453 7.771 1064 HG2 GLU 144 2HG GLU 144 5.217 -15.509 7.564 1065 HG3 GLU 144 1HG GLU 144 5.269 -14.340 6.255 1066 H THR 145 H THR 145 4.940 -12.412 8.981 1067 HA THR 145 HA THR 145 5.298 -13.729 11.702 1068 HB THR 145 HB THR 145 5.001 -11.968 13.095 1069 HG1 THR 145 HG1 THR 145 4.752 -9.779 11.793 1070 HG21 THR 145 3HG2 THR 145 6.632 -10.129 12.596 1071 HG22 THR 145 1HG2 THR 145 6.653 -10.597 10.876 1072 HG23 THR 145 2HG2 THR 145 7.297 -11.716 12.090 1073 H ASP 146 H ASP 146 3.468 -14.701 12.526 1074 HA ASP 146 HA ASP 146 0.838 -14.435 11.451 1075 HB2 ASP 146 2HB ASP 146 1.823 -15.375 14.225 1076 HB3 ASP 146 1HB ASP 146 0.150 -15.502 13.707 1077 H HIS 147 H HIS 147 -0.896 -13.158 11.800 1078 HA HIS 147 HA HIS 147 -1.024 -11.175 14.134 1079 HD1 HIS 147 HD1 HIS 147 1.526 -10.574 13.086 1080 HD2 HIS 147 HD2 HIS 147 -1.083 -7.314 12.268 1081 HE1 HIS 147 HE1 HIS 147 2.722 -8.340 13.579 1082 HB2 HIS 147 2HB HIS 147 -0.948 -10.617 11.110 1083 HB3 HIS 147 1HB HIS 147 -2.127 -9.727 11.994 1084 H GLU 148 H GLU 148 -3.284 -10.065 14.184 1085 HA GLU 148 HA GLU 148 -5.185 -12.282 14.756 1086 HB2 GLU 148 2HB GLU 148 -6.045 -9.376 14.872 1087 HB3 GLU 148 1HB GLU 148 -6.715 -10.741 15.698 1088 HG2 GLU 148 2HG GLU 148 -4.793 -10.815 17.299 1089 HG3 GLU 148 1HG GLU 148 -3.941 -9.564 16.380 1090 H GLY 149 H GLY 149 -5.757 -13.185 12.833 1091 HA2 GLY 149 2HA GLY 149 -7.889 -13.363 11.245 1092 HA3 GLY 149 1HA GLY 149 -7.673 -11.687 10.920 1093 H PHE 150 H PHE 150 -4.519 -12.426 10.835 1094 HA PHE 150 HA PHE 150 -4.360 -13.661 8.103 1095 HD1 PHE 150 HD1 PHE 150 -1.697 -10.468 7.754 1096 HD2 PHE 150 HD2 PHE 150 -5.605 -9.598 9.275 1097 HE1 PHE 150 HE1 PHE 150 -0.807 -8.459 8.903 1098 HE2 PHE 150 HE2 PHE 150 -4.732 -7.595 10.362 1099 HZ PHE 150 HZ PHE 150 -2.343 -6.992 10.175 1100 HB2 PHE 150 2HB PHE 150 -3.803 -11.630 6.858 1101 HB3 PHE 150 1HB PHE 150 -5.321 -11.396 7.660 1102 H THR 151 H THR 151 -2.221 -13.681 7.154 1103 HA THR 151 HA THR 151 0.054 -13.462 9.198 1104 HB THR 151 HB THR 151 0.490 -15.530 8.684 1105 HG1 THR 151 HG1 THR 151 2.275 -14.483 7.791 1106 HG21 THR 151 3HG2 THR 151 -0.648 -15.340 5.839 1107 HG22 THR 151 1HG2 THR 151 -1.396 -16.151 7.237 1108 HG23 THR 151 2HG2 THR 151 0.117 -16.776 6.559 1109 H LEU 152 H LEU 152 1.368 -11.942 9.104 1110 HA LEU 152 HA LEU 152 1.473 -9.784 7.011 1111 HG LEU 152 HG LEU 152 3.193 -7.790 9.822 1112 HB2 LEU 152 2HB LEU 152 1.426 -9.173 9.364 1113 HB3 LEU 152 1HB LEU 152 2.736 -10.243 9.764 1114 HD11 LEU 152 1HD1 LEU 152 5.055 -9.534 9.610 1115 HD12 LEU 152 2HD1 LEU 152 5.496 -7.908 9.051 1116 HD13 LEU 152 3HD1 LEU 152 5.127 -9.184 7.880 1117 HD21 LEU 152 3HD2 LEU 152 1.987 -7.026 7.782 1118 HD22 LEU 152 1HD2 LEU 152 3.137 -7.864 6.728 1119 HD23 LEU 152 2HD2 LEU 152 3.686 -6.515 7.740 1120 H GLN 153 H GLN 153 2.835 -9.835 5.420 1121 HA GLN 153 HA GLN 153 5.544 -11.327 5.523 1122 HB2 GLN 153 2HB GLN 153 3.346 -11.210 3.418 1123 HB3 GLN 153 1HB GLN 153 4.955 -10.920 2.795 1124 HG2 GLN 153 2HG GLN 153 5.768 -13.119 3.735 1125 HG3 GLN 153 1HG GLN 153 4.172 -13.456 4.379 1126 HE21 GLN 153 1HE2 GLN 153 2.926 -12.277 1.914 1127 HE22 GLN 153 2HE2 GLN 153 3.258 -13.528 0.603 1128 H GLU 154 H GLU 154 7.227 -9.989 5.304 1129 HA GLU 154 HA GLU 154 6.957 -7.269 3.885 1130 HB2 GLU 154 2HB GLU 154 9.230 -8.017 5.778 1131 HB3 GLU 154 1HB GLU 154 8.834 -6.465 5.109 1132 HG2 GLU 154 2HG GLU 154 6.548 -6.673 6.431 1133 HG3 GLU 154 1HG GLU 154 7.310 -8.019 7.253 1134 H TRP 155 H TRP 155 7.608 -7.470 1.765 1135 HA TRP 155 HA TRP 155 9.797 -9.474 1.015 1136 HD1 TRP 155 HD1 TRP 155 5.709 -9.545 0.752 1137 HE1 TRP 155 HE1 TRP 155 4.704 -11.913 0.131 1138 HE3 TRP 155 HE3 TRP 155 9.603 -11.066 -2.153 1139 HZ2 TRP 155 HZ2 TRP 155 5.595 -14.016 -1.552 1140 HZ3 TRP 155 HZ3 TRP 155 9.462 -13.254 -3.299 1141 HH2 TRP 155 HH2 TRP 155 7.466 -14.675 -3.056 1142 HB2 TRP 155 2HB TRP 155 7.646 -8.047 -0.603 1143 HB3 TRP 155 1HB TRP 155 8.914 -8.937 -1.384 1144 H VAL 156 H VAL 156 11.917 -8.718 0.718 1145 HA VAL 156 HA VAL 156 12.298 -5.791 -0.057 1146 HB VAL 156 HB VAL 156 13.456 -6.427 1.948 1147 HG11 VAL 156 1HG1 VAL 156 14.034 -8.823 1.504 1148 HG12 VAL 156 2HG1 VAL 156 15.466 -7.895 1.986 1149 HG13 VAL 156 3HG1 VAL 156 15.211 -8.312 0.266 1150 HG21 VAL 156 3HG2 VAL 156 14.419 -4.566 0.554 1151 HG22 VAL 156 1HG2 VAL 156 15.455 -5.747 -0.281 1152 HG23 VAL 156 2HG2 VAL 156 15.666 -5.448 1.466 1153 H ARG 157 H ARG 157 12.927 -5.097 -1.969 1154 HA ARG 157 HA ARG 157 13.330 -6.721 -4.353 1155 HE ARG 157 HE ARG 157 14.308 -4.025 -7.660 1156 HB2 ARG 157 2HB ARG 157 13.717 -3.819 -3.602 1157 HB3 ARG 157 1HB ARG 157 14.833 -4.350 -4.825 1158 HG2 ARG 157 2HG ARG 157 12.721 -5.330 -6.128 1159 HG3 ARG 157 1HG ARG 157 11.776 -4.447 -4.923 1160 HD2 ARG 157 2HD ARG 157 11.913 -2.978 -6.827 1161 HD3 ARG 157 1HD ARG 157 12.935 -2.339 -5.539 1162 HH11 ARG 157 2HH1 ARG 157 13.615 -0.793 -6.589 1163 HH12 ARG 157 1HH1 ARG 157 15.188 -0.132 -7.169 1164 HH21 ARG 157 1HH2 ARG 157 16.105 -3.304 -8.263 1165 HH22 ARG 157 2HH2 ARG 157 16.564 -1.533 -8.098 1166 H SER 158 H SER 158 14.999 -7.588 -5.393 1167 HA SER 158 HA SER 158 17.156 -8.770 -4.152 1168 HG SER 158 HG SER 158 16.219 -7.450 -7.461 1169 HB2 SER 158 2HB SER 158 17.997 -9.374 -6.363 1170 HB3 SER 158 1HB SER 158 16.242 -9.399 -6.361 1171 H ALA 159 H ALA 159 17.472 -5.483 -4.934 1172 HA ALA 159 HA ALA 159 20.458 -5.520 -4.251 1173 HB1 ALA 159 3HB ALA 159 20.259 -4.644 -6.579 1174 HB2 ALA 159 1HB ALA 159 20.630 -3.284 -5.479 1175 HB3 ALA 159 2HB ALA 159 18.977 -3.511 -6.073 1176 H SER 160 H SER 160 19.216 -5.595 -1.967 1177 HA SER 160 HA SER 160 19.214 -2.676 -1.037 1178 HG SER 160 HG SER 160 18.047 -2.274 0.910 1179 HB2 SER 160 2HB SER 160 17.160 -3.891 -0.599 1180 HB3 SER 160 1HB SER 160 17.989 -5.098 0.378 1181 H SER 161 H SER 161 20.312 -5.508 0.859 1182 HA SER 161 HA SER 161 22.316 -5.847 2.074 1183 HG SER 161 HG SER 161 22.860 -5.608 -0.579 1184 HB2 SER 161 2HB SER 161 23.627 -3.597 0.440 1185 HB3 SER 161 1HB SER 161 24.488 -4.651 1.539 1186 H ARG 162 H ARG 162 23.579 -5.035 3.922 1187 HA ARG 162 HA ARG 162 22.891 -2.290 4.925 1188 HE ARG 162 HE ARG 162 19.856 -0.846 8.507 1189 HB2 ARG 162 1HB ARG 162 21.030 -4.060 5.626 1190 HB3 ARG 162 2HB ARG 162 22.188 -4.617 6.822 1191 HG2 ARG 162 1HG ARG 162 22.182 -2.361 7.927 1192 HG3 ARG 162 2HG ARG 162 21.307 -1.650 6.557 1193 HD2 ARG 162 1HD ARG 162 19.321 -3.202 7.013 1194 HD3 ARG 162 2HD ARG 162 20.179 -3.857 8.411 1195 HH11 ARG 162 2HH1 ARG 162 18.038 -3.792 9.200 1196 HH12 ARG 162 1HH1 ARG 162 17.143 -2.890 10.500 1197 HH21 ARG 162 1HH2 ARG 162 18.797 0.038 10.092 1198 HH22 ARG 162 2HH2 ARG 162 17.547 -0.955 10.941 Start of MODEL 10 1 HA MET 1 HA MET 1 16.089 5.426 2.740 2 H1 MET 1 1H MET 1 15.086 7.241 4.165 3 H2 MET 1 2H MET 1 14.328 6.095 5.005 4 HB2 MET 1 1HB MET 1 13.692 3.897 3.898 5 HB3 MET 1 2HB MET 1 14.789 3.328 2.673 6 HG2 MET 1 1HG MET 1 16.680 3.254 4.404 7 HG3 MET 1 2HG MET 1 15.469 3.675 5.641 8 HE1 MET 1 3HE MET 1 15.143 1.271 7.071 9 HE2 MET 1 1HE MET 1 16.787 1.287 6.348 10 HE3 MET 1 2HE MET 1 15.768 -0.186 6.244 11 H GLU 2 H GLU 2 13.910 4.256 1.252 12 HA GLU 2 HA GLU 2 12.154 6.633 0.484 13 HB2 GLU 2 2HB GLU 2 12.271 6.131 -1.835 14 HB3 GLU 2 1HB GLU 2 13.872 6.349 -1.206 15 HG2 GLU 2 2HG GLU 2 13.930 3.639 -1.129 16 HG3 GLU 2 1HG GLU 2 12.606 3.760 -2.283 17 H LEU 3 H LEU 3 10.630 4.540 -1.250 18 HA LEU 3 HA LEU 3 8.718 4.259 1.098 19 HG LEU 3 HG LEU 3 8.939 6.446 -1.867 20 HB2 LEU 3 2HB LEU 3 6.821 4.579 -0.654 21 HB3 LEU 3 1HB LEU 3 7.713 5.870 0.068 22 HD11 LEU 3 1HD1 LEU 3 8.737 5.243 -4.053 23 HD12 LEU 3 2HD1 LEU 3 7.773 3.939 -3.281 24 HD13 LEU 3 3HD1 LEU 3 9.480 4.214 -2.854 25 HD21 LEU 3 3HD2 LEU 3 6.952 6.908 -3.468 26 HD22 LEU 3 1HD2 LEU 3 6.696 7.384 -1.775 27 HD23 LEU 3 2HD2 LEU 3 5.945 5.895 -2.398 28 H VAL 4 H VAL 4 7.186 2.861 1.417 29 HA VAL 4 HA VAL 4 7.667 0.053 0.307 30 HB VAL 4 HB VAL 4 7.194 1.045 3.148 31 HG11 VAL 4 1HG1 VAL 4 6.300 -1.222 3.097 32 HG12 VAL 4 2HG1 VAL 4 7.915 -1.381 3.842 33 HG13 VAL 4 3HG1 VAL 4 7.640 -1.823 2.143 34 HG21 VAL 4 3HG2 VAL 4 9.518 0.403 3.735 35 HG22 VAL 4 1HG2 VAL 4 9.458 1.691 2.545 36 HG23 VAL 4 2HG2 VAL 4 9.872 0.059 2.021 37 H SER 5 H SER 5 5.885 -1.210 -0.230 38 HA SER 5 HA SER 5 3.149 0.077 -0.015 39 HG SER 5 HG SER 5 4.276 -2.740 -2.736 40 HB2 SER 5 2HB SER 5 2.685 -1.420 -1.936 41 HB3 SER 5 1HB SER 5 4.117 -0.461 -2.181 42 H VAL 6 H VAL 6 1.366 -0.624 1.065 43 HA VAL 6 HA VAL 6 1.566 -3.182 2.684 44 HB VAL 6 HB VAL 6 1.113 -2.428 4.701 45 HG11 VAL 6 1HG1 VAL 6 2.499 -0.404 5.321 46 HG12 VAL 6 2HG1 VAL 6 2.609 0.028 3.612 47 HG13 VAL 6 3HG1 VAL 6 3.354 -1.461 4.184 48 HG21 VAL 6 3HG2 VAL 6 -0.971 -1.112 4.476 49 HG22 VAL 6 1HG2 VAL 6 -0.017 0.285 3.888 50 HG23 VAL 6 2HG2 VAL 6 0.174 -0.325 5.544 51 H ALA 7 H ALA 7 0.186 -4.437 1.360 52 HA ALA 7 HA ALA 7 -2.834 -3.701 1.500 53 HB1 ALA 7 3HB ALA 7 -1.885 -3.595 -0.814 54 HB2 ALA 7 1HB ALA 7 -3.060 -4.913 -0.688 55 HB3 ALA 7 2HB ALA 7 -1.303 -5.276 -0.691 56 H ALA 8 H ALA 8 -4.421 -5.279 2.035 57 HA ALA 8 HA ALA 8 -3.364 -7.998 2.965 58 HB1 ALA 8 3HB ALA 8 -4.088 -6.302 4.780 59 HB2 ALA 8 1HB ALA 8 -4.899 -7.869 4.840 60 HB3 ALA 8 2HB ALA 8 -5.732 -6.447 4.165 61 H LEU 9 H LEU 9 -3.890 -9.644 1.879 62 HA LEU 9 HA LEU 9 -5.928 -9.333 -0.280 63 HG LEU 9 HG LEU 9 -4.115 -9.479 -2.366 64 HB2 LEU 9 2HB LEU 9 -3.452 -11.062 0.198 65 HB3 LEU 9 1HB LEU 9 -4.521 -11.451 -1.131 66 HD11 LEU 9 1HD1 LEU 9 -4.060 -7.632 -0.714 67 HD12 LEU 9 2HD1 LEU 9 -2.541 -7.617 -1.616 68 HD13 LEU 9 3HD1 LEU 9 -2.591 -8.287 0.027 69 HD21 LEU 9 3HD2 LEU 9 -2.259 -11.223 -2.426 70 HD22 LEU 9 1HD2 LEU 9 -1.479 -10.439 -1.034 71 HD23 LEU 9 2HD2 LEU 9 -1.559 -9.591 -2.575 72 H ALA 10 H ALA 10 -7.601 -10.596 -0.728 73 HA ALA 10 HA ALA 10 -8.427 -12.905 1.069 74 HB1 ALA 10 3HB ALA 10 -9.867 -10.866 0.671 75 HB2 ALA 10 1HB ALA 10 -10.672 -12.317 0.119 76 HB3 ALA 10 2HB ALA 10 -9.952 -11.216 -1.073 77 H GLU 11 H GLU 11 -9.978 -13.412 -1.815 78 HA GLU 11 HA GLU 11 -8.522 -15.987 -2.361 79 HB2 GLU 11 2HB GLU 11 -10.925 -16.066 -2.353 80 HB3 GLU 11 1HB GLU 11 -11.106 -14.661 -3.368 81 HG2 GLU 11 2HG GLU 11 -11.469 -15.983 -5.133 82 HG3 GLU 11 1HG GLU 11 -9.818 -16.552 -5.124 83 H ASN 12 H ASN 12 -7.747 -16.503 -4.492 84 HA ASN 12 HA ASN 12 -6.061 -16.063 -6.225 85 HB2 ASN 12 2HB ASN 12 -8.875 -15.147 -6.816 86 HB3 ASN 12 1HB ASN 12 -7.752 -14.396 -7.862 87 HD21 ASN 12 1HD2 ASN 12 -9.536 -17.147 -7.542 88 HD22 ASN 12 2HD2 ASN 12 -8.736 -17.945 -8.997 89 H ARG 13 H ARG 13 -5.549 -14.181 -4.214 90 HA ARG 13 HA ARG 13 -4.475 -12.272 -3.618 91 HE ARG 13 HE ARG 13 -0.675 -12.661 -9.036 92 HB2 ARG 13 2HB ARG 13 -2.639 -11.325 -4.652 93 HB3 ARG 13 1HB ARG 13 -2.580 -13.060 -4.862 94 HG2 ARG 13 2HG ARG 13 -3.396 -12.652 -7.324 95 HG3 ARG 13 1HG ARG 13 -3.202 -10.943 -7.023 96 HD2 ARG 13 2HD ARG 13 -0.992 -11.030 -7.430 97 HD3 ARG 13 1HD ARG 13 -0.667 -12.144 -6.162 98 HH11 ARG 13 2HH1 ARG 13 -1.560 -14.307 -6.157 99 HH12 ARG 13 1HH1 ARG 13 -1.680 -15.943 -6.989 100 HH21 ARG 13 1HH2 ARG 13 -0.928 -14.427 -9.998 101 HH22 ARG 13 2HH2 ARG 13 -1.392 -15.968 -9.134 102 H VAL 14 H VAL 14 -6.945 -11.923 -3.878 103 HA VAL 14 HA VAL 14 -7.519 -9.309 -5.183 104 HB VAL 14 HB VAL 14 -9.098 -11.272 -3.461 105 HG11 VAL 14 1HG1 VAL 14 -10.018 -9.060 -2.689 106 HG12 VAL 14 2HG1 VAL 14 -11.171 -9.971 -3.665 107 HG13 VAL 14 3HG1 VAL 14 -10.300 -8.580 -4.373 108 HG21 VAL 14 3HG2 VAL 14 -10.464 -11.481 -5.508 109 HG22 VAL 14 1HG2 VAL 14 -8.762 -11.637 -5.994 110 HG23 VAL 14 2HG2 VAL 14 -9.614 -10.108 -6.296 111 H ILE 15 H ILE 15 -6.816 -7.470 -4.406 112 HA ILE 15 HA ILE 15 -6.070 -6.735 -1.617 113 HB ILE 15 HB ILE 15 -6.939 -4.988 -3.977 114 HG12 ILE 15 2HG1 ILE 15 -4.003 -5.185 -3.097 115 HG13 ILE 15 1HG1 ILE 15 -4.701 -6.444 -4.096 116 HG21 ILE 15 1HG2 ILE 15 -7.079 -3.667 -1.766 117 HG22 ILE 15 2HG2 ILE 15 -5.968 -2.996 -2.938 118 HG23 ILE 15 3HG2 ILE 15 -5.337 -3.908 -1.552 119 HD11 ILE 15 3HD1 ILE 15 -3.530 -4.621 -5.438 120 HD12 ILE 15 1HD1 ILE 15 -4.818 -3.500 -4.949 121 HD13 ILE 15 2HD1 ILE 15 -5.198 -4.916 -5.952 122 H GLY 16 H GLY 16 -9.063 -5.912 -3.423 123 HA2 GLY 16 2HA GLY 16 -10.789 -6.289 -1.048 124 HA3 GLY 16 1HA GLY 16 -10.435 -4.560 -1.254 125 H ARG 17 H ARG 17 -12.675 -4.435 -1.395 126 HA ARG 17 HA ARG 17 -13.777 -4.803 -4.201 127 HE ARG 17 HE ARG 17 -17.730 -4.552 -2.817 128 HB2 ARG 17 2HB ARG 17 -14.310 -6.840 -2.573 129 HB3 ARG 17 1HB ARG 17 -15.416 -5.749 -1.779 130 HG2 ARG 17 2HG ARG 17 -16.104 -5.521 -4.619 131 HG3 ARG 17 1HG ARG 17 -15.602 -7.186 -4.425 132 HD2 ARG 17 2HD ARG 17 -17.919 -7.269 -3.982 133 HD3 ARG 17 1HD ARG 17 -17.142 -7.382 -2.408 134 HH11 ARG 17 2HH1 ARG 17 -19.306 -7.569 -2.169 135 HH12 ARG 17 1HH1 ARG 17 -20.721 -6.718 -1.371 136 HH21 ARG 17 1HH2 ARG 17 -19.254 -3.749 -1.714 137 HH22 ARG 17 2HH2 ARG 17 -20.689 -4.654 -1.170 138 H ASP 18 H ASP 18 -15.092 -3.518 -1.040 139 HA ASP 18 HA ASP 18 -16.183 -1.168 -2.595 140 HB2 ASP 18 2HB ASP 18 -16.404 -1.817 0.387 141 HB3 ASP 18 1HB ASP 18 -17.187 -0.449 -0.428 142 H GLY 19 H GLY 19 -13.203 -1.624 -0.962 143 HA2 GLY 19 2HA GLY 19 -12.115 0.255 -2.831 144 HA3 GLY 19 1HA GLY 19 -12.220 1.228 -1.405 145 H GLU 20 H GLU 20 -11.084 0.188 0.580 146 HA GLU 20 HA GLU 20 -8.402 -0.878 -0.260 147 HB2 GLU 20 2HB GLU 20 -7.620 -0.723 2.038 148 HB3 GLU 20 1HB GLU 20 -8.023 0.796 1.283 149 HG2 GLU 20 2HG GLU 20 -9.942 1.167 2.704 150 HG3 GLU 20 1HG GLU 20 -10.090 -0.544 3.101 151 H LEU 21 H LEU 21 -10.804 -2.225 1.977 152 HA LEU 21 HA LEU 21 -9.881 -4.938 1.020 153 HG LEU 21 HG LEU 21 -8.545 -2.800 3.479 154 HB2 LEU 21 2HB LEU 21 -10.001 -5.513 3.736 155 HB3 LEU 21 1HB LEU 21 -8.628 -5.382 2.701 156 HD11 LEU 21 1HD1 LEU 21 -10.295 -4.140 5.649 157 HD12 LEU 21 2HD1 LEU 21 -10.614 -2.645 4.748 158 HD13 LEU 21 3HD1 LEU 21 -9.307 -2.682 5.948 159 HD21 LEU 21 3HD2 LEU 21 -6.998 -3.411 5.274 160 HD22 LEU 21 1HD2 LEU 21 -6.769 -4.438 3.854 161 HD23 LEU 21 2HD2 LEU 21 -7.599 -5.079 5.288 162 HA PRO 22 HA PRO 22 -14.170 -6.083 1.008 163 HB2 PRO 22 2HB PRO 22 -13.760 -8.887 1.861 164 HB3 PRO 22 1HB PRO 22 -14.088 -8.243 0.256 165 HG2 PRO 22 2HG PRO 22 -11.625 -9.381 1.059 166 HG3 PRO 22 1HG PRO 22 -11.799 -8.267 -0.317 167 HD2 PRO 22 2HD PRO 22 -10.837 -7.593 2.510 168 HD3 PRO 22 1HD PRO 22 -10.239 -7.030 0.950 169 H TRP 23 H TRP 23 -12.568 -7.161 3.901 170 HA TRP 23 HA TRP 23 -15.014 -7.165 5.659 171 HD1 TRP 23 HD1 TRP 23 -11.227 -5.931 7.511 172 HE1 TRP 23 HE1 TRP 23 -8.827 -5.923 6.419 173 HE3 TRP 23 HE3 TRP 23 -11.895 -9.997 4.550 174 HZ2 TRP 23 HZ2 TRP 23 -7.539 -7.561 4.555 175 HZ3 TRP 23 HZ3 TRP 23 -10.076 -10.643 2.990 176 HH2 TRP 23 HH2 TRP 23 -7.926 -9.405 2.987 177 HB2 TRP 23 2HB TRP 23 -13.413 -7.773 7.495 178 HB3 TRP 23 1HB TRP 23 -13.408 -8.916 6.182 179 HA PRO 24 HA PRO 24 -14.674 -2.796 6.585 180 HB2 PRO 24 2HB PRO 24 -15.055 -3.164 9.554 181 HB3 PRO 24 1HB PRO 24 -16.057 -2.299 8.379 182 HG2 PRO 24 2HG PRO 24 -16.837 -4.746 9.437 183 HG3 PRO 24 1HG PRO 24 -17.248 -4.286 7.775 184 HD2 PRO 24 2HD PRO 24 -15.018 -6.154 8.686 185 HD3 PRO 24 1HD PRO 24 -16.129 -6.288 7.296 186 H SER 25 H SER 25 -12.829 -4.413 9.090 187 HA SER 25 HA SER 25 -10.265 -3.946 8.321 188 HG SER 25 HG SER 25 -10.990 -1.499 7.660 189 HB2 SER 25 2HB SER 25 -10.797 -1.495 10.112 190 HB3 SER 25 1HB SER 25 -9.201 -2.165 9.753 191 H ILE 26 H ILE 26 -9.753 -5.807 9.502 192 HA ILE 26 HA ILE 26 -10.524 -6.224 12.296 193 HB ILE 26 HB ILE 26 -8.702 -7.981 12.395 194 HG12 ILE 26 2HG1 ILE 26 -7.562 -6.769 10.141 195 HG13 ILE 26 1HG1 ILE 26 -7.062 -8.202 10.956 196 HG21 ILE 26 1HG2 ILE 26 -9.923 -9.665 11.103 197 HG22 ILE 26 2HG2 ILE 26 -10.870 -8.415 10.289 198 HG23 ILE 26 3HG2 ILE 26 -11.009 -8.630 12.044 199 HD11 ILE 26 3HD1 ILE 26 -9.034 -8.258 8.574 200 HD12 ILE 26 1HD1 ILE 26 -8.207 -9.648 9.307 201 HD13 ILE 26 2HD1 ILE 26 -7.278 -8.413 8.415 202 HA PRO 27 HA PRO 27 -7.624 -3.639 14.634 203 HB2 PRO 27 2HB PRO 27 -7.486 -5.971 16.625 204 HB3 PRO 27 1HB PRO 27 -7.636 -4.230 16.938 205 HG2 PRO 27 2HG PRO 27 -9.909 -5.694 16.986 206 HG3 PRO 27 1HG PRO 27 -9.923 -4.179 16.048 207 HD2 PRO 27 2HD PRO 27 -9.529 -7.021 14.932 208 HD3 PRO 27 1HD PRO 27 -10.639 -5.723 14.373 209 H ALA 28 H ALA 28 -6.168 -6.932 14.286 210 HA ALA 28 HA ALA 28 -3.444 -5.913 14.377 211 HB1 ALA 28 3HB ALA 28 -3.959 -8.255 14.628 212 HB2 ALA 28 1HB ALA 28 -2.859 -8.083 13.262 213 HB3 ALA 28 2HB ALA 28 -4.568 -8.381 12.941 214 H ASP 29 H ASP 29 -5.598 -5.794 11.533 215 HA ASP 29 HA ASP 29 -3.443 -4.976 9.603 216 HB2 ASP 29 2HB ASP 29 -5.528 -6.028 8.768 217 HB3 ASP 29 1HB ASP 29 -6.521 -4.756 9.474 218 H LYS 30 H LYS 30 -6.131 -3.185 10.989 219 HA LYS 30 HA LYS 30 -4.956 -0.586 10.676 220 HB2 LYS 30 2HB LYS 30 -7.503 -1.628 11.485 221 HB3 LYS 30 1HB LYS 30 -6.946 -0.814 12.914 222 HG2 LYS 30 2HG LYS 30 -8.067 0.895 11.867 223 HG3 LYS 30 1HG LYS 30 -6.467 1.257 11.287 224 HD2 LYS 30 2HD LYS 30 -8.900 0.169 9.782 225 HD3 LYS 30 1HD LYS 30 -7.988 1.607 9.503 226 HE2 LYS 30 2HE LYS 30 -6.008 -0.110 8.773 227 HE3 LYS 30 1HE LYS 30 -7.295 -1.272 8.639 228 HZ1 LYS 30 3HZ LYS 30 -7.561 1.394 7.191 229 HZ2 LYS 30 1HZ LYS 30 -8.352 0.035 6.847 230 HZ3 LYS 30 2HZ LYS 30 -6.823 0.130 6.496 231 H LYS 31 H LYS 31 -4.384 -2.665 13.461 232 HA LYS 31 HA LYS 31 -2.687 -0.586 14.832 233 HB2 LYS 31 2HB LYS 31 -3.734 -2.258 16.267 234 HB3 LYS 31 1HB LYS 31 -2.928 -3.560 15.431 235 HG2 LYS 31 2HG LYS 31 -1.884 -3.128 17.606 236 HG3 LYS 31 1HG LYS 31 -0.762 -3.034 16.262 237 HD2 LYS 31 2HD LYS 31 -0.893 -0.492 16.333 238 HD3 LYS 31 1HD LYS 31 -2.002 -0.581 17.699 239 HE2 LYS 31 2HE LYS 31 -0.294 -1.590 19.170 240 HE3 LYS 31 1HE LYS 31 0.766 -1.985 17.803 241 HZ1 LYS 31 3HZ LYS 31 1.428 0.182 19.015 242 HZ2 LYS 31 1HZ LYS 31 0.069 0.906 18.392 243 HZ3 LYS 31 2HZ LYS 31 1.230 0.336 17.384 244 H GLN 32 H GLN 32 -2.010 -3.170 12.418 245 HA GLN 32 HA GLN 32 0.936 -2.739 12.461 246 HB2 GLN 32 2HB GLN 32 -0.124 -4.870 11.760 247 HB3 GLN 32 1HB GLN 32 -0.858 -4.098 10.373 248 HG2 GLN 32 2HG GLN 32 2.129 -3.667 10.492 249 HG3 GLN 32 1HG GLN 32 1.737 -5.364 10.582 250 HE21 GLN 32 1HE2 GLN 32 0.027 -6.009 8.792 251 HE22 GLN 32 2HE2 GLN 32 0.518 -5.377 7.138 252 H TYR 33 H TYR 33 -1.532 -1.790 10.002 253 HA TYR 33 HA TYR 33 -0.111 0.333 8.676 254 HD1 TYR 33 HD1 TYR 33 -3.883 1.307 10.251 255 HD2 TYR 33 HD2 TYR 33 -2.815 1.456 6.150 256 HE1 TYR 33 HE1 TYR 33 -5.606 3.033 9.894 257 HE2 TYR 33 HE2 TYR 33 -4.654 3.083 5.727 258 HH TYR 33 HH TYR 33 -6.362 4.520 6.822 259 HB2 TYR 33 2HB TYR 33 -1.970 -0.352 7.567 260 HB3 TYR 33 1HB TYR 33 -2.932 -0.644 8.943 261 H ARG 34 H ARG 34 -1.709 0.690 11.877 262 HA ARG 34 HA ARG 34 -0.866 3.641 11.802 263 HE ARG 34 HE ARG 34 -5.224 4.835 11.127 264 HB2 ARG 34 2HB ARG 34 -2.558 2.146 13.887 265 HB3 ARG 34 1HB ARG 34 -2.009 3.819 14.063 266 HG2 ARG 34 2HG ARG 34 -3.053 4.214 11.636 267 HG3 ARG 34 1HG ARG 34 -3.849 2.679 11.885 268 HD2 ARG 34 2HD ARG 34 -5.208 3.420 13.680 269 HD3 ARG 34 1HD ARG 34 -4.229 4.892 13.938 270 HH11 ARG 34 2HH1 ARG 34 -6.375 5.571 14.300 271 HH12 ARG 34 1HH1 ARG 34 -7.412 6.937 13.637 272 HH21 ARG 34 1HH2 ARG 34 -6.434 6.344 10.421 273 HH22 ARG 34 2HH2 ARG 34 -7.460 7.292 11.563 274 H SER 35 H SER 35 0.737 0.945 12.756 275 HA SER 35 HA SER 35 2.666 2.608 14.478 276 HG SER 35 HG SER 35 1.021 -0.265 14.897 277 HB2 SER 35 2HB SER 35 3.092 -0.372 14.035 278 HB3 SER 35 1HB SER 35 3.681 0.671 15.322 279 H ARG 36 H ARG 36 2.236 1.007 11.441 280 HA ARG 36 HA ARG 36 4.981 1.634 10.324 281 HE ARG 36 HE ARG 36 4.043 -2.626 8.571 282 HB2 ARG 36 2HB ARG 36 3.526 -0.540 10.079 283 HB3 ARG 36 1HB ARG 36 2.388 0.404 9.145 284 HG2 ARG 36 2HG ARG 36 3.499 -0.494 7.384 285 HG3 ARG 36 1HG ARG 36 4.476 0.921 7.579 286 HD2 ARG 36 2HD ARG 36 6.003 -0.939 7.338 287 HD3 ARG 36 1HD ARG 36 6.120 -0.465 9.030 288 HH11 ARG 36 2HH1 ARG 36 7.433 -2.216 8.644 289 HH12 ARG 36 1HH1 ARG 36 7.688 -3.998 8.877 290 HH21 ARG 36 1HH2 ARG 36 4.423 -4.630 8.895 291 HH22 ARG 36 2HH2 ARG 36 6.170 -5.203 9.116 292 H VAL 37 H VAL 37 1.606 2.494 9.192 293 HA VAL 37 HA VAL 37 2.800 4.732 7.550 294 HB VAL 37 HB VAL 37 1.197 4.658 6.055 295 HG11 VAL 37 1HG1 VAL 37 0.807 1.716 6.845 296 HG12 VAL 37 2HG1 VAL 37 2.284 2.359 6.111 297 HG13 VAL 37 3HG1 VAL 37 0.756 2.419 5.194 298 HG21 VAL 37 3HG2 VAL 37 -0.896 5.094 7.227 299 HG22 VAL 37 1HG2 VAL 37 -0.968 3.452 7.865 300 HG23 VAL 37 2HG2 VAL 37 -1.168 3.735 6.125 301 H ALA 38 H ALA 38 1.260 4.783 10.579 302 HA ALA 38 HA ALA 38 -0.367 7.234 9.968 303 HB1 ALA 38 3HB ALA 38 -1.328 5.711 11.511 304 HB2 ALA 38 1HB ALA 38 -1.023 7.250 12.323 305 HB3 ALA 38 2HB ALA 38 0.060 5.877 12.636 306 H ASP 39 H ASP 39 2.858 6.910 11.361 307 HA ASP 39 HA ASP 39 3.204 9.886 11.544 308 HB2 ASP 39 2HB ASP 39 4.954 7.443 12.045 309 HB3 ASP 39 1HB ASP 39 5.757 8.877 11.475 310 H ASP 40 H ASP 40 4.525 7.449 9.192 311 HA ASP 40 HA ASP 40 5.312 9.390 7.353 312 HB2 ASP 40 2HB ASP 40 4.999 6.367 7.380 313 HB3 ASP 40 1HB ASP 40 5.366 7.100 5.835 314 HA PRO 41 HA PRO 41 1.933 10.271 4.246 315 HB2 PRO 41 2HB PRO 41 4.326 10.071 2.307 316 HB3 PRO 41 1HB PRO 41 3.032 11.270 2.307 317 HG2 PRO 41 2HG PRO 41 5.383 11.974 3.408 318 HG3 PRO 41 1HG PRO 41 3.962 12.271 4.429 319 HD2 PRO 41 2HD PRO 41 5.846 9.831 4.601 320 HD3 PRO 41 1HD PRO 41 5.284 10.927 5.886 321 H VAL 42 H VAL 42 0.584 9.122 2.835 322 HA VAL 42 HA VAL 42 1.578 6.402 1.821 323 HB VAL 42 HB VAL 42 -1.232 7.232 2.690 324 HG11 VAL 42 1HG1 VAL 42 -1.324 5.382 0.982 325 HG12 VAL 42 2HG1 VAL 42 -1.756 4.763 2.589 326 HG13 VAL 42 3HG1 VAL 42 -0.136 4.436 1.897 327 HG21 VAL 42 3HG2 VAL 42 1.024 5.641 4.086 328 HG22 VAL 42 1HG2 VAL 42 -0.668 5.446 4.563 329 HG23 VAL 42 2HG2 VAL 42 0.124 7.034 4.720 330 H VAL 43 H VAL 43 1.644 5.918 -0.250 331 HA VAL 43 HA VAL 43 0.293 7.715 -2.308 332 HB VAL 43 HB VAL 43 1.902 7.115 -3.929 333 HG11 VAL 43 1HG1 VAL 43 3.538 7.525 -1.341 334 HG12 VAL 43 2HG1 VAL 43 2.772 8.824 -2.235 335 HG13 VAL 43 3HG1 VAL 43 4.065 7.871 -2.988 336 HG21 VAL 43 3HG2 VAL 43 3.119 5.096 -1.976 337 HG22 VAL 43 1HG2 VAL 43 3.893 5.593 -3.476 338 HG23 VAL 43 2HG2 VAL 43 2.365 4.725 -3.568 339 H LEU 44 H LEU 44 -1.699 7.105 -2.837 340 HA LEU 44 HA LEU 44 -2.276 4.152 -3.459 341 HG LEU 44 HG LEU 44 -4.310 6.946 -2.042 342 HB2 LEU 44 2HB LEU 44 -4.066 4.078 -1.958 343 HB3 LEU 44 1HB LEU 44 -2.674 4.559 -1.098 344 HD11 LEU 44 1HD1 LEU 44 -5.579 4.862 -0.112 345 HD12 LEU 44 2HD1 LEU 44 -6.185 5.350 -1.693 346 HD13 LEU 44 3HD1 LEU 44 -6.189 6.520 -0.364 347 HD21 LEU 44 3HD2 LEU 44 -3.437 6.118 0.799 348 HD22 LEU 44 1HD2 LEU 44 -4.081 7.707 0.269 349 HD23 LEU 44 2HD2 LEU 44 -2.501 7.159 -0.289 350 H GLY 45 H GLY 45 -5.015 4.138 -3.831 351 HA2 GLY 45 2HA GLY 45 -4.937 5.082 -6.768 352 HA3 GLY 45 1HA GLY 45 -5.587 3.522 -6.253 353 H ARG 46 H ARG 46 -7.357 4.620 -7.680 354 HA ARG 46 HA ARG 46 -9.239 6.312 -5.950 355 HE ARG 46 HE ARG 46 -11.608 8.410 -7.521 356 HB2 ARG 46 2HB ARG 46 -9.461 5.794 -8.942 357 HB3 ARG 46 1HB ARG 46 -10.748 6.450 -7.979 358 HG2 ARG 46 2HG ARG 46 -7.953 7.751 -8.212 359 HG3 ARG 46 1HG ARG 46 -9.310 8.200 -9.217 360 HD2 ARG 46 2HD ARG 46 -9.086 8.624 -6.151 361 HD3 ARG 46 1HD ARG 46 -8.960 9.836 -7.422 362 HH11 ARG 46 2HH1 ARG 46 -9.942 10.842 -5.674 363 HH12 ARG 46 1HH1 ARG 46 -11.512 11.676 -5.258 364 HH21 ARG 46 1HH2 ARG 46 -13.366 9.311 -6.876 365 HH22 ARG 46 2HH2 ARG 46 -13.317 10.843 -5.908 366 H THR 47 H THR 47 -9.040 2.937 -7.210 367 HA THR 47 HA THR 47 -11.396 2.150 -5.713 368 HB THR 47 HB THR 47 -8.857 0.468 -6.127 369 HG1 THR 47 HG1 THR 47 -11.171 -0.006 -7.511 370 HG21 THR 47 3HG2 THR 47 -10.255 -0.699 -4.500 371 HG22 THR 47 1HG2 THR 47 -10.605 -1.399 -6.091 372 HG23 THR 47 2HG2 THR 47 -11.771 -0.288 -5.331 373 H THR 48 H THR 48 -8.128 1.525 -4.176 374 HA THR 48 HA THR 48 -8.948 1.771 -1.543 375 HB THR 48 HB THR 48 -6.683 2.420 -0.831 376 HG1 THR 48 HG1 THR 48 -5.130 2.354 -2.562 377 HG21 THR 48 3HG2 THR 48 -6.436 0.264 -2.980 378 HG22 THR 48 1HG2 THR 48 -7.041 -0.031 -1.376 379 HG23 THR 48 2HG2 THR 48 -5.414 0.534 -1.530 380 H PHE 49 H PHE 49 -8.342 4.751 -3.416 381 HA PHE 49 HA PHE 49 -8.626 6.484 -0.997 382 HD1 PHE 49 HD2 PHE 49 -10.250 9.310 -3.221 383 HD2 PHE 49 HD1 PHE 49 -6.417 8.746 -1.382 384 HE1 PHE 49 HE2 PHE 49 -10.431 11.531 -2.138 385 HE2 PHE 49 HE1 PHE 49 -6.548 11.019 -0.436 386 HZ PHE 49 HZ PHE 49 -8.561 12.356 -0.715 387 HB2 PHE 49 2HB PHE 49 -7.222 7.132 -2.976 388 HB3 PHE 49 1HB PHE 49 -8.672 7.411 -3.920 389 H GLU 50 H GLU 50 -11.007 5.420 -3.396 390 HA GLU 50 HA GLU 50 -13.068 7.352 -2.361 391 HB2 GLU 50 2HB GLU 50 -13.345 5.038 -4.339 392 HB3 GLU 50 1HB GLU 50 -14.692 5.997 -3.755 393 HG2 GLU 50 2HG GLU 50 -13.701 8.097 -4.657 394 HG3 GLU 50 1HG GLU 50 -12.201 7.289 -5.080 395 H SER 51 H SER 51 -12.064 4.067 -1.387 396 HA SER 51 HA SER 51 -13.667 4.332 1.139 397 HG SER 51 HG SER 51 -13.604 2.168 0.218 398 HB2 SER 51 2HB SER 51 -11.044 2.820 0.606 399 HB3 SER 51 1HB SER 51 -11.802 2.916 2.180 400 H MET 52 H MET 52 -10.121 5.054 0.750 401 HA MET 52 HA MET 52 -9.749 6.082 3.299 402 HB2 MET 52 2HB MET 52 -8.025 5.682 1.276 403 HB3 MET 52 1HB MET 52 -8.215 7.417 0.981 404 HG2 MET 52 2HG MET 52 -6.304 7.275 2.446 405 HG3 MET 52 1HG MET 52 -7.594 7.746 3.529 406 HE1 MET 52 3HE MET 52 -5.381 5.283 2.119 407 HE2 MET 52 1HE MET 52 -6.260 3.748 2.421 408 HE3 MET 52 2HE MET 52 -4.984 4.321 3.562 409 H ARG 53 H ARG 53 -11.000 8.073 0.879 410 HA ARG 53 HA ARG 53 -11.288 10.735 1.948 411 HE ARG 53 HE ARG 53 -14.961 12.814 -0.151 412 HB2 ARG 53 2HB ARG 53 -12.115 9.632 -0.240 413 HB3 ARG 53 1HB ARG 53 -13.325 8.758 0.722 414 HG2 ARG 53 2HG ARG 53 -14.290 11.007 1.452 415 HG3 ARG 53 1HG ARG 53 -13.065 11.811 0.457 416 HD2 ARG 53 2HD ARG 53 -14.030 10.535 -1.592 417 HD3 ARG 53 1HD ARG 53 -15.268 9.863 -0.479 418 HH11 ARG 53 2HH1 ARG 53 -16.547 10.503 -2.144 419 HH12 ARG 53 1HH1 ARG 53 -18.077 11.506 -2.295 420 HH21 ARG 53 1HH2 ARG 53 -16.706 13.858 -0.167 421 HH22 ARG 53 2HH2 ARG 53 -18.156 13.342 -1.154 422 H ASP 54 H ASP 54 -12.725 7.804 3.296 423 HA ASP 54 HA ASP 54 -14.111 9.349 5.494 424 HB2 ASP 54 2HB ASP 54 -14.826 6.917 3.997 425 HB3 ASP 54 1HB ASP 54 -14.535 6.457 5.643 426 H ASP 55 H ASP 55 -12.275 6.212 5.725 427 HA ASP 55 HA ASP 55 -10.885 7.269 8.139 428 HB2 ASP 55 2HB ASP 55 -11.167 4.528 6.880 429 HB3 ASP 55 1HB ASP 55 -9.645 4.797 7.664 430 H LEU 56 H LEU 56 -9.374 8.709 7.870 431 HA LEU 56 HA LEU 56 -7.381 8.830 5.812 432 HG LEU 56 HG LEU 56 -7.343 11.999 6.453 433 HB2 LEU 56 2HB LEU 56 -7.314 9.991 8.642 434 HB3 LEU 56 1HB LEU 56 -6.149 10.420 7.446 435 HD11 LEU 56 1HD1 LEU 56 -10.049 10.553 6.740 436 HD12 LEU 56 2HD1 LEU 56 -9.065 10.608 5.275 437 HD13 LEU 56 3HD1 LEU 56 -9.759 12.101 5.924 438 HD21 LEU 56 3HD2 LEU 56 -7.539 12.487 8.915 439 HD22 LEU 56 1HD2 LEU 56 -9.139 11.705 8.931 440 HD23 LEU 56 2HD2 LEU 56 -8.880 13.197 7.989 441 HA PRO 57 HA PRO 57 -4.287 5.844 7.488 442 HB2 PRO 57 2HB PRO 57 -2.368 6.014 5.602 443 HB3 PRO 57 1HB PRO 57 -4.006 5.481 5.220 444 HG2 PRO 57 2HG PRO 57 -2.737 8.183 4.596 445 HG3 PRO 57 1HG PRO 57 -3.894 7.249 3.620 446 HD2 PRO 57 2HD PRO 57 -4.496 9.367 5.497 447 HD3 PRO 57 1HD PRO 57 -5.675 8.299 4.649 448 H GLY 58 H GLY 58 -2.161 8.534 6.511 449 HA2 GLY 58 2HA GLY 58 -1.389 9.145 9.427 450 HA3 GLY 58 1HA GLY 58 -0.119 8.650 8.302 451 H SER 59 H SER 59 0.920 10.597 8.658 452 HA SER 59 HA SER 59 -0.077 13.183 8.343 453 HG SER 59 HG SER 59 3.074 14.393 8.827 454 HB2 SER 59 2HB SER 59 2.272 12.343 9.145 455 HB3 SER 59 1HB SER 59 2.783 12.538 7.462 456 H ALA 60 H ALA 60 0.125 11.216 5.538 457 HA ALA 60 HA ALA 60 -1.228 13.418 4.133 458 HB1 ALA 60 3HB ALA 60 0.883 14.292 3.508 459 HB2 ALA 60 1HB ALA 60 0.398 13.421 2.036 460 HB3 ALA 60 2HB ALA 60 1.606 12.719 3.146 461 H GLN 61 H GLN 61 -1.999 13.009 2.000 462 HA GLN 61 HA GLN 61 -2.620 10.050 1.390 463 HB2 GLN 61 2HB GLN 61 -4.347 12.043 2.582 464 HB3 GLN 61 1HB GLN 61 -4.847 12.017 0.920 465 HG2 GLN 61 2HG GLN 61 -5.326 9.569 1.023 466 HG3 GLN 61 1HG GLN 61 -4.620 9.447 2.610 467 HE21 GLN 61 1HE2 GLN 61 -5.724 10.837 4.316 468 HE22 GLN 61 2HE2 GLN 61 -7.566 10.714 4.203 469 H ILE 62 H ILE 62 -1.187 10.002 -0.292 470 HA ILE 62 HA ILE 62 -1.331 11.955 -2.604 471 HB ILE 62 HB ILE 62 0.544 9.676 -1.807 472 HG12 ILE 62 2HG1 ILE 62 1.386 12.510 -2.318 473 HG13 ILE 62 1HG1 ILE 62 0.587 12.177 -0.792 474 HG21 ILE 62 1HG2 ILE 62 0.613 11.318 -4.388 475 HG22 ILE 62 2HG2 ILE 62 0.549 9.536 -4.274 476 HG23 ILE 62 3HG2 ILE 62 2.027 10.384 -3.775 477 HD11 ILE 62 3HD1 ILE 62 2.454 10.431 -0.310 478 HD12 ILE 62 1HD1 ILE 62 2.992 12.112 -0.454 479 HD13 ILE 62 2HD1 ILE 62 3.250 11.007 -1.815 480 H VAL 63 H VAL 63 -2.797 11.513 -4.306 481 HA VAL 63 HA VAL 63 -3.250 8.590 -5.050 482 HB VAL 63 HB VAL 63 -4.781 10.987 -6.048 483 HG11 VAL 63 1HG1 VAL 63 -4.755 9.216 -7.866 484 HG12 VAL 63 2HG1 VAL 63 -6.354 9.237 -7.095 485 HG13 VAL 63 3HG1 VAL 63 -5.168 7.971 -6.680 486 HG21 VAL 63 3HG2 VAL 63 -5.473 8.604 -4.163 487 HG22 VAL 63 1HG2 VAL 63 -6.676 9.796 -4.715 488 HG23 VAL 63 2HG2 VAL 63 -5.328 10.301 -3.688 489 H MET 64 H MET 64 -1.874 7.634 -6.259 490 HA MET 64 HA MET 64 -0.427 8.819 -8.597 491 HB2 MET 64 2HB MET 64 -0.608 6.121 -7.123 492 HB3 MET 64 1HB MET 64 -0.090 6.078 -8.766 493 HG2 MET 64 2HG MET 64 1.442 8.271 -7.531 494 HG3 MET 64 1HG MET 64 1.482 6.889 -6.460 495 HE1 MET 64 3HE MET 64 1.123 6.864 -10.569 496 HE2 MET 64 1HE MET 64 2.867 6.896 -10.936 497 HE3 MET 64 2HE MET 64 2.099 8.286 -10.107 498 H SER 65 H SER 65 -1.986 9.635 -9.934 499 HA SER 65 HA SER 65 -3.144 7.763 -11.957 500 HG SER 65 HG SER 65 -5.928 7.118 -11.747 501 HB2 SER 65 2HB SER 65 -4.838 7.603 -10.009 502 HB3 SER 65 1HB SER 65 -5.191 9.308 -10.213 503 H ARG 66 H ARG 66 -5.038 9.389 -13.156 504 HA ARG 66 HA ARG 66 -3.804 12.182 -13.522 505 HE ARG 66 HE ARG 66 -0.521 11.949 -17.810 506 HB2 ARG 66 2HB ARG 66 -4.820 10.415 -15.811 507 HB3 ARG 66 1HB ARG 66 -4.892 12.148 -15.911 508 HG2 ARG 66 2HG ARG 66 -2.184 11.530 -14.965 509 HG3 ARG 66 1HG ARG 66 -2.536 10.336 -16.179 510 HD2 ARG 66 2HD ARG 66 -2.959 12.007 -17.906 511 HD3 ARG 66 1HD ARG 66 -3.012 13.345 -16.769 512 HH11 ARG 66 2HH1 ARG 66 -1.672 14.101 -15.349 513 HH12 ARG 66 1HH1 ARG 66 -0.019 14.870 -15.152 514 HH21 ARG 66 1HH2 ARG 66 1.325 12.846 -17.559 515 HH22 ARG 66 2HH2 ARG 66 1.576 14.180 -16.351 516 H SER 67 H SER 67 -5.449 11.601 -11.532 517 HA SER 67 HA SER 67 -8.000 13.126 -12.037 518 HG SER 67 HG SER 67 -9.295 12.941 -9.915 519 HB2 SER 67 2HB SER 67 -6.778 11.627 -9.779 520 HB3 SER 67 1HB SER 67 -7.167 13.226 -9.218 521 H GLU 68 H GLU 68 -8.376 15.210 -10.685 522 HA GLU 68 HA GLU 68 -6.002 17.055 -10.475 523 HB2 GLU 68 2HB GLU 68 -6.749 18.681 -12.092 524 HB3 GLU 68 1HB GLU 68 -6.626 17.134 -12.856 525 HG2 GLU 68 2HG GLU 68 -8.577 18.065 -13.822 526 HG3 GLU 68 1HG GLU 68 -9.241 16.918 -12.683 527 H ARG 69 H ARG 69 -7.841 19.329 -10.420 528 HA ARG 69 HA ARG 69 -8.484 20.806 -8.802 529 HE ARG 69 HE ARG 69 -14.064 21.538 -7.612 530 HB2 ARG 69 2HB ARG 69 -10.309 19.720 -9.836 531 HB3 ARG 69 1HB ARG 69 -10.438 18.483 -8.607 532 HG2 ARG 69 2HG ARG 69 -11.429 19.957 -7.025 533 HG3 ARG 69 1HG ARG 69 -10.618 21.377 -7.681 534 HD2 ARG 69 2HD ARG 69 -12.136 21.076 -9.852 535 HD3 ARG 69 1HD ARG 69 -12.993 19.843 -8.958 536 HH11 ARG 69 2HH1 ARG 69 -11.355 22.969 -9.216 537 HH12 ARG 69 1HH1 ARG 69 -11.741 24.645 -8.613 538 HH21 ARG 69 1HH2 ARG 69 -14.495 23.419 -6.927 539 HH22 ARG 69 2HH2 ARG 69 -13.486 24.874 -7.364 540 H SER 70 H SER 70 -8.885 18.026 -6.664 541 HA SER 70 HA SER 70 -7.413 18.412 -4.411 542 HG SER 70 HG SER 70 -6.840 20.632 -3.001 543 HB2 SER 70 2HB SER 70 -9.329 20.798 -4.312 544 HB3 SER 70 1HB SER 70 -8.901 20.005 -2.812 545 H PHE 71 H PHE 71 -8.218 17.296 -2.552 546 HA PHE 71 HA PHE 71 -10.675 15.607 -3.253 547 HD1 PHE 71 HD2 PHE 71 -10.055 14.127 -4.860 548 HD2 PHE 71 HD1 PHE 71 -6.380 13.823 -2.656 549 HE1 PHE 71 HE2 PHE 71 -8.971 13.019 -6.787 550 HE2 PHE 71 HE1 PHE 71 -5.328 12.713 -4.563 551 HZ PHE 71 HZ PHE 71 -6.607 12.306 -6.634 552 HB2 PHE 71 2HB PHE 71 -8.204 14.929 -1.599 553 HB3 PHE 71 1HB PHE 71 -9.551 13.867 -1.930 554 H SER 72 H SER 72 -10.180 14.719 -0.127 555 HA SER 72 HA SER 72 -12.541 16.461 0.782 556 HG SER 72 HG SER 72 -14.354 15.132 1.134 557 HB2 SER 72 2HB SER 72 -12.032 13.503 1.327 558 HB3 SER 72 1HB SER 72 -12.831 14.460 2.541 559 H VAL 73 H VAL 73 -9.604 14.907 2.232 560 HA VAL 73 HA VAL 73 -9.789 16.873 4.549 561 HB VAL 73 HB VAL 73 -9.329 14.514 5.121 562 HG11 VAL 73 1HG1 VAL 73 -6.615 14.775 3.663 563 HG12 VAL 73 2HG1 VAL 73 -7.939 13.652 3.262 564 HG13 VAL 73 3HG1 VAL 73 -7.054 13.469 4.774 565 HG21 VAL 73 3HG2 VAL 73 -6.874 16.231 5.864 566 HG22 VAL 73 1HG2 VAL 73 -7.568 14.867 6.757 567 HG23 VAL 73 2HG2 VAL 73 -8.461 16.394 6.619 568 H ASP 74 H ASP 74 -8.346 18.613 4.786 569 HA ASP 74 HA ASP 74 -6.873 19.649 2.625 570 HB2 ASP 74 2HB ASP 74 -6.431 20.216 5.616 571 HB3 ASP 74 1HB ASP 74 -5.822 21.186 4.285 572 H THR 75 H THR 75 -5.543 17.219 4.798 573 HA THR 75 HA THR 75 -2.808 17.357 3.442 574 HB THR 75 HB THR 75 -3.042 16.875 5.934 575 HG1 THR 75 HG1 THR 75 -1.378 15.065 5.549 576 HG21 THR 75 3HG2 THR 75 -3.531 13.949 5.024 577 HG22 THR 75 1HG2 THR 75 -4.672 14.926 5.987 578 HG23 THR 75 2HG2 THR 75 -3.077 14.473 6.644 579 H ALA 76 H ALA 76 -5.174 16.812 1.770 580 HA ALA 76 HA ALA 76 -4.283 14.136 0.569 581 HB1 ALA 76 3HB ALA 76 -6.482 13.789 1.477 582 HB2 ALA 76 1HB ALA 76 -6.612 13.770 -0.287 583 HB3 ALA 76 2HB ALA 76 -7.158 15.204 0.632 584 H HIS 77 H HIS 77 -3.681 14.056 -1.370 585 HA HIS 77 HA HIS 77 -3.573 16.529 -3.194 586 HD1 HIS 77 HD1 HIS 77 -0.979 15.798 0.668 587 HD2 HIS 77 HD2 HIS 77 -2.137 18.965 -1.965 588 HE1 HIS 77 HE1 HIS 77 -0.804 18.048 1.874 589 HB2 HIS 77 2HB HIS 77 -1.196 15.113 -1.805 590 HB3 HIS 77 1HB HIS 77 -1.054 16.437 -2.960 591 H ARG 78 H ARG 78 -2.252 15.957 -5.243 592 HA ARG 78 HA ARG 78 -2.729 13.011 -6.017 593 HE ARG 78 HE ARG 78 -3.891 14.373 -11.090 594 HB2 ARG 78 2HB ARG 78 -4.441 14.734 -6.877 595 HB3 ARG 78 1HB ARG 78 -3.200 15.354 -7.938 596 HG2 ARG 78 2HG ARG 78 -4.081 12.382 -7.889 597 HG3 ARG 78 1HG ARG 78 -4.927 13.567 -8.840 598 HD2 ARG 78 2HD ARG 78 -1.945 12.848 -9.237 599 HD3 ARG 78 1HD ARG 78 -3.245 12.132 -10.122 600 HH11 ARG 78 2HH1 ARG 78 -0.764 14.350 -9.556 601 HH12 ARG 78 1HH1 ARG 78 -0.248 15.874 -10.363 602 HH21 ARG 78 1HH2 ARG 78 -3.383 16.045 -11.885 603 HH22 ARG 78 2HH2 ARG 78 -1.746 16.860 -11.649 604 H ALA 79 H ALA 79 -0.991 11.946 -6.637 605 HA ALA 79 HA ALA 79 1.432 13.351 -7.887 606 HB1 ALA 79 3HB ALA 79 1.911 11.754 -6.101 607 HB2 ALA 79 1HB ALA 79 2.451 11.031 -7.627 608 HB3 ALA 79 2HB ALA 79 0.946 10.461 -6.885 609 H ALA 80 H ALA 80 1.991 13.079 -10.041 610 HA ALA 80 HA ALA 80 0.299 11.216 -11.813 611 HB1 ALA 80 3HB ALA 80 0.087 13.477 -12.572 612 HB2 ALA 80 1HB ALA 80 1.155 12.661 -13.738 613 HB3 ALA 80 2HB ALA 80 1.848 13.756 -12.532 614 H SER 81 H SER 81 3.519 11.247 -10.584 615 HA SER 81 HA SER 81 4.001 8.730 -12.140 616 HG SER 81 HG SER 81 4.909 9.281 -14.129 617 HB2 SER 81 2HB SER 81 5.287 11.225 -12.980 618 HB3 SER 81 1HB SER 81 6.523 10.400 -12.058 619 H VAL 82 H VAL 82 6.507 8.071 -11.176 620 HA VAL 82 HA VAL 82 6.023 7.705 -8.191 621 HB VAL 82 HB VAL 82 8.278 6.497 -9.877 622 HG11 VAL 82 1HG1 VAL 82 7.843 6.586 -6.840 623 HG12 VAL 82 2HG1 VAL 82 9.347 6.729 -7.763 624 HG13 VAL 82 3HG1 VAL 82 8.578 5.155 -7.582 625 HG21 VAL 82 3HG2 VAL 82 6.320 5.206 -10.360 626 HG22 VAL 82 1HG2 VAL 82 5.660 5.346 -8.710 627 HG23 VAL 82 2HG2 VAL 82 7.039 4.301 -9.021 628 H GLU 83 H GLU 83 8.900 8.987 -10.030 629 HA GLU 83 HA GLU 83 9.845 10.798 -8.228 630 HB2 GLU 83 2HB GLU 83 9.429 11.613 -11.135 631 HB3 GLU 83 1HB GLU 83 10.687 12.122 -10.047 632 HG2 GLU 83 2HG GLU 83 10.730 9.118 -10.546 633 HG3 GLU 83 1HG GLU 83 10.892 10.074 -11.995 634 H GLU 84 H GLU 84 6.716 11.566 -9.909 635 HA GLU 84 HA GLU 84 6.465 14.202 -8.450 636 HB2 GLU 84 2HB GLU 84 4.219 12.603 -9.746 637 HB3 GLU 84 1HB GLU 84 4.111 14.253 -9.205 638 HG2 GLU 84 2HG GLU 84 6.216 14.053 -11.312 639 HG3 GLU 84 1HG GLU 84 4.734 13.298 -11.855 640 H ALA 85 H ALA 85 5.822 10.951 -7.588 641 HA ALA 85 HA ALA 85 4.061 11.635 -5.215 642 HB1 ALA 85 3HB ALA 85 3.936 9.228 -4.781 643 HB2 ALA 85 1HB ALA 85 5.225 8.871 -5.936 644 HB3 ALA 85 2HB ALA 85 3.641 9.420 -6.526 645 H VAL 86 H VAL 86 7.469 10.786 -5.873 646 HA VAL 86 HA VAL 86 8.186 10.778 -2.942 647 HB VAL 86 HB VAL 86 9.794 10.374 -5.503 648 HG11 VAL 86 1HG1 VAL 86 11.876 10.083 -4.148 649 HG12 VAL 86 2HG1 VAL 86 11.043 10.721 -2.698 650 HG13 VAL 86 3HG1 VAL 86 11.317 11.762 -4.121 651 HG21 VAL 86 3HG2 VAL 86 10.368 8.171 -4.387 652 HG22 VAL 86 1HG2 VAL 86 8.603 8.347 -4.461 653 HG23 VAL 86 2HG2 VAL 86 9.468 8.647 -2.934 654 H ASP 87 H ASP 87 8.822 13.163 -5.640 655 HA ASP 87 HA ASP 87 9.669 15.281 -3.926 656 HB2 ASP 87 2HB ASP 87 8.483 15.137 -6.728 657 HB3 ASP 87 1HB ASP 87 8.332 16.676 -5.943 658 H ILE 88 H ILE 88 6.169 14.469 -4.525 659 HA ILE 88 HA ILE 88 5.483 16.778 -2.731 660 HB ILE 88 HB ILE 88 3.374 16.675 -2.722 661 HG12 ILE 88 2HG1 ILE 88 2.816 14.036 -4.167 662 HG13 ILE 88 1HG1 ILE 88 3.123 14.032 -2.453 663 HG21 ILE 88 1HG2 ILE 88 3.764 15.780 -5.629 664 HG22 ILE 88 2HG2 ILE 88 4.327 17.339 -5.011 665 HG23 ILE 88 3HG2 ILE 88 2.590 16.955 -4.987 666 HD11 ILE 88 3HD1 ILE 88 1.293 16.144 -2.481 667 HD12 ILE 88 1HD1 ILE 88 0.889 14.478 -2.183 668 HD13 ILE 88 2HD1 ILE 88 0.687 15.137 -3.822 669 H ALA 89 H ALA 89 5.969 13.372 -2.018 670 HA ALA 89 HA ALA 89 5.040 13.577 0.816 671 HB1 ALA 89 3HB ALA 89 6.521 11.507 1.116 672 HB2 ALA 89 1HB ALA 89 6.933 11.606 -0.612 673 HB3 ALA 89 2HB ALA 89 5.246 11.337 -0.100 674 H ALA 90 H ALA 90 8.364 13.857 -0.571 675 HA ALA 90 HA ALA 90 9.550 14.822 1.964 676 HB1 ALA 90 3HB ALA 90 11.512 15.328 0.369 677 HB2 ALA 90 1HB ALA 90 10.463 14.871 -0.987 678 HB3 ALA 90 2HB ALA 90 10.874 13.675 0.267 679 H SER 91 H SER 91 7.804 16.614 -0.429 680 HA SER 91 HA SER 91 8.748 19.332 0.456 681 HG SER 91 HG SER 91 7.094 20.543 -2.249 682 HB2 SER 91 2HB SER 91 7.922 18.653 -1.882 683 HB3 SER 91 1HB SER 91 6.291 18.509 -1.216 684 H LEU 92 H LEU 92 6.296 17.167 1.682 685 HA LEU 92 HA LEU 92 4.826 19.427 3.058 686 HG LEU 92 HG LEU 92 4.518 15.998 1.763 687 HB2 LEU 92 2HB LEU 92 3.158 17.742 3.892 688 HB3 LEU 92 1HB LEU 92 3.190 18.280 2.243 689 HD11 LEU 92 1HD1 LEU 92 2.951 15.250 4.308 690 HD12 LEU 92 2HD1 LEU 92 4.723 15.211 4.095 691 HD13 LEU 92 3HD1 LEU 92 3.714 14.128 3.147 692 HD21 LEU 92 3HD2 LEU 92 2.293 16.585 0.751 693 HD22 LEU 92 1HD2 LEU 92 1.465 16.085 2.246 694 HD23 LEU 92 2HD2 LEU 92 2.345 14.890 1.256 695 H ASP 93 H ASP 93 6.017 16.366 4.550 696 HA ASP 93 HA ASP 93 8.192 17.645 5.870 697 HB2 ASP 93 2HB ASP 93 5.696 17.833 7.597 698 HB3 ASP 93 1HB ASP 93 7.078 17.183 8.415 699 H ALA 94 H ALA 94 9.010 15.594 4.900 700 HA ALA 94 HA ALA 94 8.985 13.235 6.727 701 HB1 ALA 94 3HB ALA 94 7.729 11.675 5.187 702 HB2 ALA 94 1HB ALA 94 7.417 13.029 4.070 703 HB3 ALA 94 2HB ALA 94 6.704 13.022 5.702 704 H GLU 95 H GLU 95 10.075 11.327 5.948 705 HA GLU 95 HA GLU 95 12.200 11.817 3.804 706 HB2 GLU 95 2HB GLU 95 13.060 10.011 6.045 707 HB3 GLU 95 1HB GLU 95 13.996 11.004 4.956 708 HG2 GLU 95 2HG GLU 95 13.203 13.064 6.410 709 HG3 GLU 95 1HG GLU 95 12.501 11.873 7.501 710 H THR 96 H THR 96 11.227 8.879 5.698 711 HA THR 96 HA THR 96 10.852 7.149 3.337 712 HB THR 96 HB THR 96 9.368 5.819 5.175 713 HG1 THR 96 HG1 THR 96 9.179 7.396 6.731 714 HG21 THR 96 3HG2 THR 96 12.369 6.087 5.657 715 HG22 THR 96 1HG2 THR 96 11.631 5.067 4.393 716 HG23 THR 96 2HG2 THR 96 11.305 4.741 6.109 717 H ALA 97 H ALA 97 8.797 6.060 2.850 718 HA ALA 97 HA ALA 97 6.268 7.202 3.777 719 HB1 ALA 97 3HB ALA 97 6.573 8.910 2.087 720 HB2 ALA 97 1HB ALA 97 5.295 7.858 1.452 721 HB3 ALA 97 2HB ALA 97 6.959 7.757 0.799 722 H TYR 98 H TYR 98 4.274 6.154 2.694 723 HA TYR 98 HA TYR 98 4.812 3.207 2.129 724 HD1 TYR 98 HD1 TYR 98 4.664 0.955 4.011 725 HD2 TYR 98 HD2 TYR 98 4.809 4.815 5.843 726 HE1 TYR 98 HE1 TYR 98 6.558 0.219 5.402 727 HE2 TYR 98 HE2 TYR 98 6.649 4.070 7.273 728 HH TYR 98 HH TYR 98 8.310 2.594 7.396 729 HB2 TYR 98 2HB TYR 98 3.006 4.352 4.338 730 HB3 TYR 98 1HB TYR 98 2.763 2.726 3.745 731 H VAL 99 H VAL 99 2.729 1.959 1.525 732 HA VAL 99 HA VAL 99 0.826 3.607 -0.218 733 HB VAL 99 HB VAL 99 1.790 3.342 -2.090 734 HG11 VAL 99 1HG1 VAL 99 4.029 3.281 -1.143 735 HG12 VAL 99 2HG1 VAL 99 3.928 2.517 -2.712 736 HG13 VAL 99 3HG1 VAL 99 4.067 1.556 -1.237 737 HG21 VAL 99 3HG2 VAL 99 0.416 1.536 -2.729 738 HG22 VAL 99 1HG2 VAL 99 1.567 0.347 -2.120 739 HG23 VAL 99 2HG2 VAL 99 1.998 1.346 -3.519 740 H ILE 100 H ILE 100 -1.119 2.874 0.932 741 HA ILE 100 HA ILE 100 -1.787 0.193 1.192 742 HB ILE 100 HB ILE 100 -4.118 1.965 0.354 743 HG12 ILE 100 2HG1 ILE 100 -3.271 3.349 2.039 744 HG13 ILE 100 1HG1 ILE 100 -4.454 2.346 2.850 745 HG21 ILE 100 1HG2 ILE 100 -4.590 -0.545 0.716 746 HG22 ILE 100 2HG2 ILE 100 -5.428 0.493 1.882 747 HG23 ILE 100 3HG2 ILE 100 -3.959 -0.376 2.370 748 HD11 ILE 100 3HD1 ILE 100 -2.855 1.041 4.022 749 HD12 ILE 100 1HD1 ILE 100 -2.231 2.744 4.145 750 HD13 ILE 100 2HD1 ILE 100 -1.478 1.575 3.046 751 H GLY 101 H GLY 101 -2.101 1.725 -1.756 752 HA2 GLY 101 2HA GLY 101 -2.325 0.932 -3.972 753 HA3 GLY 101 1HA GLY 101 -1.295 -0.303 -3.398 754 H GLY 102 H GLY 102 -2.353 -2.178 -4.993 755 HA2 GLY 102 2HA GLY 102 -4.690 -0.337 -5.828 756 HA3 GLY 102 1HA GLY 102 -3.119 -0.031 -6.447 757 H ALA 103 H ALA 103 -5.968 -1.668 -7.131 758 HA ALA 103 HA ALA 103 -5.692 -2.851 -9.554 759 HB1 ALA 103 3HB ALA 103 -7.723 -1.463 -8.557 760 HB2 ALA 103 1HB ALA 103 -7.604 -1.396 -10.298 761 HB3 ALA 103 2HB ALA 103 -7.097 -0.042 -9.333 762 H ALA 104 H ALA 104 -4.570 0.502 -9.409 763 HA ALA 104 HA ALA 104 -2.711 -0.096 -11.778 764 HB1 ALA 104 3HB ALA 104 -2.478 2.314 -12.201 765 HB2 ALA 104 1HB ALA 104 -3.619 2.694 -10.890 766 HB3 ALA 104 2HB ALA 104 -4.180 1.812 -12.344 767 H ILE 105 H ILE 105 -2.755 0.722 -8.336 768 HA ILE 105 HA ILE 105 -0.181 2.128 -8.429 769 HB ILE 105 HB ILE 105 -1.302 1.205 -5.825 770 HG12 ILE 105 2HG1 ILE 105 -3.321 2.225 -6.586 771 HG13 ILE 105 1HG1 ILE 105 -2.499 3.362 -5.612 772 HG21 ILE 105 1HG2 ILE 105 -0.272 3.143 -4.874 773 HG22 ILE 105 2HG2 ILE 105 0.209 3.797 -6.440 774 HG23 ILE 105 3HG2 ILE 105 0.974 2.327 -5.809 775 HD11 ILE 105 3HD1 ILE 105 -3.361 3.538 -8.423 776 HD12 ILE 105 1HD1 ILE 105 -1.620 3.939 -8.357 777 HD13 ILE 105 2HD1 ILE 105 -2.785 4.871 -7.383 778 H TYR 106 H TYR 106 -0.621 -0.820 -6.306 779 HA TYR 106 HA TYR 106 2.163 -1.612 -6.243 780 HD1 TYR 106 HD1 TYR 106 2.770 -4.554 -5.050 781 HD2 TYR 106 HD2 TYR 106 -0.510 -2.251 -3.488 782 HE1 TYR 106 HE1 TYR 106 3.387 -5.178 -2.774 783 HE2 TYR 106 HE2 TYR 106 0.155 -2.847 -1.199 784 HH TYR 106 HH TYR 106 2.757 -4.057 -0.190 785 HB2 TYR 106 2HB TYR 106 -0.509 -3.037 -5.871 786 HB3 TYR 106 1HB TYR 106 0.765 -4.063 -6.371 787 H ALA 107 H ALA 107 -0.051 -2.130 -8.967 788 HA ALA 107 HA ALA 107 1.825 -3.849 -10.544 789 HB1 ALA 107 3HB ALA 107 -0.749 -2.311 -11.275 790 HB2 ALA 107 1HB ALA 107 -0.632 -4.029 -10.837 791 HB3 ALA 107 2HB ALA 107 0.073 -3.452 -12.356 792 H LEU 108 H LEU 108 1.184 -0.304 -10.580 793 HA LEU 108 HA LEU 108 3.466 0.056 -12.526 794 HG LEU 108 HG LEU 108 2.243 2.438 -9.925 795 HB2 LEU 108 2HB LEU 108 2.915 2.174 -12.869 796 HB3 LEU 108 1HB LEU 108 1.349 1.590 -12.420 797 HD11 LEU 108 1HD1 LEU 108 4.454 3.284 -11.142 798 HD12 LEU 108 2HD1 LEU 108 3.649 4.397 -10.037 799 HD13 LEU 108 3HD1 LEU 108 3.450 4.592 -11.786 800 HD21 LEU 108 3HD2 LEU 108 0.095 3.182 -10.799 801 HD22 LEU 108 1HD2 LEU 108 0.889 4.190 -12.048 802 HD23 LEU 108 2HD2 LEU 108 1.030 4.600 -10.327 803 H PHE 109 H PHE 109 3.069 0.532 -8.999 804 HA PHE 109 HA PHE 109 5.758 1.609 -8.669 805 HD1 PHE 109 HD2 PHE 109 6.902 2.319 -6.149 806 HD2 PHE 109 HD1 PHE 109 2.786 3.292 -6.866 807 HE1 PHE 109 HE2 PHE 109 7.353 4.628 -5.539 808 HE2 PHE 109 HE1 PHE 109 3.268 5.655 -6.229 809 HZ PHE 109 HZ PHE 109 5.559 6.312 -5.589 810 HB2 PHE 109 2HB PHE 109 3.447 0.944 -6.833 811 HB3 PHE 109 1HB PHE 109 4.933 0.558 -6.072 812 H GLN 110 H GLN 110 4.847 -1.758 -8.581 813 HA GLN 110 HA GLN 110 6.621 -3.097 -6.969 814 HB2 GLN 110 2HB GLN 110 6.788 -4.879 -8.777 815 HB3 GLN 110 1HB GLN 110 5.273 -4.509 -8.039 816 HG2 GLN 110 2HG GLN 110 4.240 -3.883 -9.994 817 HG3 GLN 110 1HG GLN 110 5.562 -2.953 -10.574 818 HE21 GLN 110 1HE2 GLN 110 4.983 -6.405 -9.976 819 HE22 GLN 110 2HE2 GLN 110 5.579 -6.861 -11.645 820 HA PRO 111 HA PRO 111 10.931 -2.890 -9.057 821 HB2 PRO 111 2HB PRO 111 11.430 -1.355 -11.276 822 HB3 PRO 111 1HB PRO 111 10.770 -3.003 -11.371 823 HG2 PRO 111 2HG PRO 111 9.201 -0.353 -11.467 824 HG3 PRO 111 1HG PRO 111 9.102 -1.733 -12.611 825 HD2 PRO 111 2HD PRO 111 7.309 -1.432 -10.539 826 HD3 PRO 111 1HD PRO 111 7.828 -3.052 -11.100 827 H HIS 112 H HIS 112 9.054 -0.160 -8.275 828 HA HIS 112 HA HIS 112 11.491 1.678 -7.873 829 HD1 HIS 112 HD1 HIS 112 11.555 3.481 -10.126 830 HD2 HIS 112 HD2 HIS 112 7.486 2.209 -10.359 831 HE1 HIS 112 HE1 HIS 112 10.681 3.709 -12.557 832 HB2 HIS 112 2HB HIS 112 8.520 2.466 -7.893 833 HB3 HIS 112 1HB HIS 112 9.919 3.517 -7.830 834 H LEU 113 H LEU 113 9.397 -0.250 -5.873 835 HA LEU 113 HA LEU 113 9.464 1.483 -3.448 836 HG LEU 113 HG LEU 113 6.894 -1.027 -2.423 837 HB2 LEU 113 2HB LEU 113 9.189 -1.609 -3.616 838 HB3 LEU 113 1HB LEU 113 9.011 -0.665 -2.163 839 HD11 LEU 113 1HD1 LEU 113 5.623 0.907 -3.539 840 HD12 LEU 113 2HD1 LEU 113 7.188 1.462 -4.175 841 HD13 LEU 113 3HD1 LEU 113 6.917 1.407 -2.426 842 HD21 LEU 113 3HD2 LEU 113 5.629 -1.484 -4.437 843 HD22 LEU 113 1HD2 LEU 113 7.128 -2.431 -4.456 844 HD23 LEU 113 2HD2 LEU 113 7.004 -0.982 -5.479 845 H ASP 114 H ASP 114 10.750 1.384 -1.549 846 HA ASP 114 HA ASP 114 13.266 -0.220 -1.307 847 HB2 ASP 114 2HB ASP 114 13.056 1.716 0.121 848 HB3 ASP 114 1HB ASP 114 11.488 1.230 0.738 849 H ARG 115 H ARG 115 10.083 -0.822 0.308 850 HA ARG 115 HA ARG 115 10.523 -3.827 -0.164 851 HE ARG 115 HE ARG 115 13.717 -2.801 3.203 852 HB2 ARG 115 2HB ARG 115 9.728 -2.229 2.329 853 HB3 ARG 115 1HB ARG 115 9.360 -3.949 2.254 854 HG2 ARG 115 2HG ARG 115 11.697 -4.562 2.272 855 HG3 ARG 115 1HG ARG 115 12.183 -2.945 1.735 856 HD2 ARG 115 2HD ARG 115 11.305 -2.030 4.011 857 HD3 ARG 115 1HD ARG 115 11.127 -3.723 4.559 858 HH11 ARG 115 2HH1 ARG 115 12.374 -3.853 6.172 859 HH12 ARG 115 1HH1 ARG 115 13.938 -3.659 7.021 860 HH21 ARG 115 1HH2 ARG 115 15.405 -2.762 4.123 861 HH22 ARG 115 2HH2 ARG 115 15.623 -3.056 5.927 862 H MET 116 H MET 116 8.798 -5.216 -0.392 863 HA MET 116 HA MET 116 5.964 -4.020 -0.697 864 HB2 MET 116 2HB MET 116 7.242 -6.494 -1.946 865 HB3 MET 116 1HB MET 116 5.503 -6.290 -1.875 866 HG2 MET 116 2HG MET 116 5.624 -4.298 -3.336 867 HG3 MET 116 1HG MET 116 7.360 -4.125 -3.042 868 HE1 MET 116 3HE MET 116 4.629 -6.536 -4.413 869 HE2 MET 116 1HE MET 116 5.394 -7.111 -5.920 870 HE3 MET 116 2HE MET 116 4.946 -5.386 -5.756 871 H VAL 117 H VAL 117 5.619 -3.806 1.490 872 HA VAL 117 HA VAL 117 5.236 -6.070 3.380 873 HB VAL 117 HB VAL 117 4.293 -3.174 3.310 874 HG11 VAL 117 1HG1 VAL 117 2.538 -4.417 4.618 875 HG12 VAL 117 2HG1 VAL 117 3.467 -3.337 5.651 876 HG13 VAL 117 3HG1 VAL 117 3.791 -5.093 5.680 877 HG21 VAL 117 3HG2 VAL 117 6.764 -3.686 3.872 878 HG22 VAL 117 1HG2 VAL 117 6.212 -4.559 5.315 879 HG23 VAL 117 2HG2 VAL 117 5.903 -2.809 5.160 880 H LEU 118 H LEU 118 3.802 -7.645 3.092 881 HA LEU 118 HA LEU 118 0.992 -7.013 2.007 882 HG LEU 118 HG LEU 118 0.161 -9.593 0.777 883 HB2 LEU 118 2HB LEU 118 1.948 -7.782 0.088 884 HB3 LEU 118 1HB LEU 118 3.127 -8.814 0.838 885 HD11 LEU 118 1HD1 LEU 118 0.951 -11.131 -1.170 886 HD12 LEU 118 2HD1 LEU 118 2.433 -10.129 -1.267 887 HD13 LEU 118 3HD1 LEU 118 0.815 -9.415 -1.546 888 HD21 LEU 118 3HD2 LEU 118 1.486 -10.944 2.413 889 HD22 LEU 118 1HD2 LEU 118 2.828 -11.092 1.270 890 HD23 LEU 118 2HD2 LEU 118 1.307 -11.929 0.965 891 H SER 119 H SER 119 -0.666 -8.162 2.770 892 HA SER 119 HA SER 119 -0.197 -9.946 5.248 893 HG SER 119 HG SER 119 -1.363 -6.897 6.481 894 HB2 SER 119 2HB SER 119 -2.176 -7.695 4.616 895 HB3 SER 119 1HB SER 119 -2.488 -8.847 5.902 896 H ARG 120 H ARG 120 -0.738 -11.981 4.923 897 HA ARG 120 HA ARG 120 -2.532 -12.806 2.640 898 HE ARG 120 HE ARG 120 -0.736 -13.256 0.750 899 HB2 ARG 120 2HB ARG 120 -1.020 -14.728 4.474 900 HB3 ARG 120 1HB ARG 120 -1.599 -15.020 2.854 901 HG2 ARG 120 2HG ARG 120 0.418 -12.789 2.889 902 HG3 ARG 120 1HG ARG 120 1.018 -14.148 3.762 903 HD2 ARG 120 2HD ARG 120 1.808 -14.242 1.465 904 HD3 ARG 120 1HD ARG 120 0.773 -15.639 1.771 905 HH11 ARG 120 2HH1 ARG 120 1.305 -15.666 -0.505 906 HH12 ARG 120 1HH1 ARG 120 0.196 -16.070 -1.906 907 HH21 ARG 120 1HH2 ARG 120 -2.088 -13.786 -0.674 908 HH22 ARG 120 2HH2 ARG 120 -1.755 -15.095 -1.905 909 H VAL 121 H VAL 121 -4.724 -12.576 3.249 910 HA VAL 121 HA VAL 121 -5.583 -13.357 6.008 911 HB VAL 121 HB VAL 121 -7.237 -11.834 3.986 912 HG11 VAL 121 1HG1 VAL 121 -7.266 -11.859 7.073 913 HG12 VAL 121 2HG1 VAL 121 -8.513 -12.529 5.994 914 HG13 VAL 121 3HG1 VAL 121 -8.243 -10.787 6.057 915 HG21 VAL 121 3HG2 VAL 121 -4.801 -10.734 5.377 916 HG22 VAL 121 1HG2 VAL 121 -6.275 -9.758 5.560 917 HG23 VAL 121 2HG2 VAL 121 -5.703 -10.195 3.958 918 HA PRO 122 HA PRO 122 -8.027 -16.831 4.046 919 HB2 PRO 122 2HB PRO 122 -7.808 -18.364 6.569 920 HB3 PRO 122 1HB PRO 122 -7.105 -18.705 4.992 921 HG2 PRO 122 2HG PRO 122 -5.570 -17.957 7.209 922 HG3 PRO 122 1HG PRO 122 -5.063 -17.606 5.538 923 HD2 PRO 122 2HD PRO 122 -6.493 -15.726 7.476 924 HD3 PRO 122 1HD PRO 122 -5.058 -15.433 6.451 925 H GLY 123 H GLY 123 -9.403 -14.532 5.409 926 HA2 GLY 123 2HA GLY 123 -11.727 -15.892 6.904 927 HA3 GLY 123 1HA GLY 123 -11.479 -14.175 6.844 928 H GLU 124 H GLU 124 -12.637 -13.075 5.395 929 HA GLU 124 HA GLU 124 -14.485 -14.497 3.531 930 HB2 GLU 124 2HB GLU 124 -15.863 -12.433 3.886 931 HB3 GLU 124 1HB GLU 124 -15.570 -13.434 5.270 932 HG2 GLU 124 2HG GLU 124 -13.714 -11.038 5.006 933 HG3 GLU 124 1HG GLU 124 -15.389 -10.658 5.307 934 H TYR 125 H TYR 125 -14.827 -14.133 1.430 935 HA TYR 125 HA TYR 125 -12.885 -12.308 -0.043 936 HD1 TYR 125 HD2 TYR 125 -10.829 -14.065 1.621 937 HD2 TYR 125 HD1 TYR 125 -12.979 -17.121 -0.508 938 HE1 TYR 125 HE2 TYR 125 -9.716 -15.797 2.949 939 HE2 TYR 125 HE1 TYR 125 -11.864 -18.825 0.853 940 HH TYR 125 HH TYR 125 -10.114 -17.966 3.719 941 HB2 TYR 125 2HB TYR 125 -13.117 -14.987 -1.315 942 HB3 TYR 125 1HB TYR 125 -11.766 -13.979 -1.059 943 H GLU 126 H GLU 126 -13.310 -11.609 -2.078 944 HA GLU 126 HA GLU 126 -16.172 -12.065 -3.127 945 HB2 GLU 126 2HB GLU 126 -14.667 -9.435 -2.715 946 HB3 GLU 126 1HB GLU 126 -16.162 -9.546 -3.607 947 HG2 GLU 126 2HG GLU 126 -16.023 -10.499 -0.664 948 HG3 GLU 126 1HG GLU 126 -16.226 -8.819 -1.051 949 H GLY 127 H GLY 127 -13.271 -10.379 -4.422 950 HA2 GLY 127 2HA GLY 127 -12.280 -11.404 -6.646 951 HA3 GLY 127 1HA GLY 127 -13.902 -11.699 -7.142 952 H ASP 128 H ASP 128 -12.867 -8.491 -5.983 953 HA ASP 128 HA ASP 128 -13.374 -7.438 -8.822 954 HB2 ASP 128 2HB ASP 128 -14.988 -7.033 -6.784 955 HB3 ASP 128 1HB ASP 128 -13.821 -5.846 -6.242 956 H THR 129 H THR 129 -11.495 -5.970 -6.043 957 HA THR 129 HA THR 129 -9.564 -4.808 -7.970 958 HB THR 129 HB THR 129 -9.146 -5.000 -4.949 959 HG1 THR 129 HG1 THR 129 -10.407 -3.311 -4.669 960 HG21 THR 129 3HG2 THR 129 -7.258 -3.894 -6.412 961 HG22 THR 129 1HG2 THR 129 -7.939 -2.864 -5.133 962 HG23 THR 129 2HG2 THR 129 -8.454 -2.640 -6.821 963 H TYR 130 H TYR 130 -7.859 -5.951 -8.824 964 HA TYR 130 HA TYR 130 -6.654 -8.312 -7.338 965 HD1 TYR 130 HD1 TYR 130 -9.378 -7.713 -9.953 966 HD2 TYR 130 HD2 TYR 130 -6.749 -10.982 -9.018 967 HE1 TYR 130 HE1 TYR 130 -11.286 -9.254 -9.981 968 HE2 TYR 130 HE2 TYR 130 -8.661 -12.536 -9.134 969 HH TYR 130 HH TYR 130 -11.963 -11.271 -9.544 970 HB2 TYR 130 2HB TYR 130 -6.814 -7.523 -10.301 971 HB3 TYR 130 1HB TYR 130 -5.806 -8.832 -9.745 972 H TYR 131 H TYR 131 -4.667 -8.671 -6.798 973 HA TYR 131 HA TYR 131 -2.616 -6.480 -6.864 974 HD1 TYR 131 HD2 TYR 131 -0.351 -9.671 -5.772 975 HD2 TYR 131 HD1 TYR 131 -1.744 -6.355 -3.444 976 HE1 TYR 131 HE2 TYR 131 1.870 -9.459 -4.764 977 HE2 TYR 131 HE1 TYR 131 0.409 -6.326 -2.257 978 HH TYR 131 HH TYR 131 2.527 -7.014 -2.258 979 HB2 TYR 131 2HB TYR 131 -3.331 -7.774 -4.800 980 HB3 TYR 131 1HB TYR 131 -2.765 -9.227 -5.489 981 HA PRO 132 HA PRO 132 0.026 -8.528 -10.066 982 HB2 PRO 132 2HB PRO 132 2.559 -7.462 -8.876 983 HB3 PRO 132 1HB PRO 132 1.757 -7.019 -10.389 984 HG2 PRO 132 2HG PRO 132 1.846 -5.354 -8.170 985 HG3 PRO 132 1HG PRO 132 0.527 -5.310 -9.357 986 HD2 PRO 132 2HD PRO 132 0.499 -6.594 -6.618 987 HD3 PRO 132 1HD PRO 132 -0.763 -5.645 -7.462 988 H GLU 133 H GLU 133 1.885 -10.003 -10.487 989 HA GLU 133 HA GLU 133 2.071 -12.186 -8.459 990 HB2 GLU 133 2HB GLU 133 3.327 -13.458 -10.128 991 HB3 GLU 133 1HB GLU 133 1.770 -12.896 -10.675 992 HG2 GLU 133 2HG GLU 133 3.408 -10.918 -11.789 993 HG3 GLU 133 1HG GLU 133 4.547 -12.249 -11.701 994 H TRP 134 H TRP 134 4.112 -13.136 -7.811 995 HA TRP 134 HA TRP 134 6.137 -11.056 -6.877 996 HD1 TRP 134 HD1 TRP 134 5.606 -15.238 -5.527 997 HE1 TRP 134 HE1 TRP 134 3.294 -16.483 -5.368 998 HE3 TRP 134 HE3 TRP 134 2.911 -11.238 -3.907 999 HZ2 TRP 134 HZ2 TRP 134 0.691 -15.668 -4.566 1000 HZ3 TRP 134 HZ3 TRP 134 0.489 -11.492 -3.532 1001 HH2 TRP 134 HH2 TRP 134 -0.613 -13.686 -3.823 1002 HB2 TRP 134 2HB TRP 134 6.428 -12.426 -4.709 1003 HB3 TRP 134 1HB TRP 134 5.072 -11.360 -4.833 1004 H ASP 135 H ASP 135 8.287 -11.651 -7.044 1005 HA ASP 135 HA ASP 135 8.836 -14.259 -8.550 1006 HB2 ASP 135 2HB ASP 135 8.959 -11.877 -9.735 1007 HB3 ASP 135 1HB ASP 135 10.407 -11.626 -8.781 1008 H ALA 136 H ALA 136 11.534 -14.034 -8.438 1009 HA ALA 136 HA ALA 136 12.423 -14.143 -5.484 1010 HB1 ALA 136 3HB ALA 136 11.832 -16.463 -6.528 1011 HB2 ALA 136 1HB ALA 136 13.486 -16.338 -5.882 1012 HB3 ALA 136 2HB ALA 136 13.209 -16.230 -7.649 1013 H ALA 137 H ALA 137 13.366 -13.145 -8.641 1014 HA ALA 137 HA ALA 137 16.075 -12.221 -7.492 1015 HB1 ALA 137 3HB ALA 137 16.440 -13.684 -9.443 1016 HB2 ALA 137 1HB ALA 137 16.946 -12.013 -9.801 1017 HB3 ALA 137 2HB ALA 137 15.421 -12.640 -10.475 1018 H GLU 138 H GLU 138 13.071 -10.921 -8.807 1019 HA GLU 138 HA GLU 138 13.961 -8.082 -8.685 1020 HB2 GLU 138 2HB GLU 138 11.220 -9.443 -8.457 1021 HB3 GLU 138 1HB GLU 138 11.460 -7.730 -8.364 1022 HG2 GLU 138 2HG GLU 138 12.390 -9.203 -10.880 1023 HG3 GLU 138 1HG GLU 138 10.724 -8.725 -10.639 1024 H TRP 139 H TRP 139 12.176 -10.072 -6.257 1025 HA TRP 139 HA TRP 139 13.374 -8.435 -3.981 1026 HD1 TRP 139 HD1 TRP 139 9.273 -10.496 -4.436 1027 HE1 TRP 139 HE1 TRP 139 7.662 -10.123 -6.558 1028 HE3 TRP 139 HE3 TRP 139 11.047 -5.948 -5.747 1029 HZ2 TRP 139 HZ2 TRP 139 7.661 -8.221 -8.617 1030 HZ3 TRP 139 HZ3 TRP 139 10.300 -4.922 -7.877 1031 HH2 TRP 139 HH2 TRP 139 8.652 -6.051 -9.300 1032 HB2 TRP 139 2HB TRP 139 10.893 -8.614 -2.914 1033 HB3 TRP 139 1HB TRP 139 11.470 -7.270 -3.832 1034 H GLU 140 H GLU 140 13.753 -9.304 -2.118 1035 HA GLU 140 HA GLU 140 13.400 -12.312 -1.666 1036 HB2 GLU 140 2HB GLU 140 15.610 -12.228 -1.492 1037 HB3 GLU 140 1HB GLU 140 15.730 -10.516 -1.549 1038 HG2 GLU 140 2HG GLU 140 16.449 -10.361 0.562 1039 HG3 GLU 140 1HG GLU 140 15.096 -11.199 1.249 1040 H LEU 141 H LEU 141 13.488 -12.598 1.012 1041 HA LEU 141 HA LEU 141 10.857 -11.248 1.893 1042 HG LEU 141 HG LEU 141 9.598 -14.503 3.288 1043 HB2 LEU 141 2HB LEU 141 11.206 -13.905 1.470 1044 HB3 LEU 141 1HB LEU 141 11.856 -13.859 3.072 1045 HD11 LEU 141 1HD1 LEU 141 8.349 -12.813 4.542 1046 HD12 LEU 141 2HD1 LEU 141 9.333 -11.499 3.897 1047 HD13 LEU 141 3HD1 LEU 141 10.065 -12.688 4.981 1048 HD21 LEU 141 3HD2 LEU 141 8.680 -12.225 1.432 1049 HD22 LEU 141 1HD2 LEU 141 7.654 -13.479 2.159 1050 HD23 LEU 141 2HD2 LEU 141 8.871 -13.925 0.957 1051 H ASP 142 H ASP 142 11.338 -9.625 3.276 1052 HA ASP 142 HA ASP 142 13.843 -9.393 4.920 1053 HB2 ASP 142 2HB ASP 142 12.553 -7.510 3.600 1054 HB3 ASP 142 1HB ASP 142 11.386 -7.538 4.893 1055 H ALA 143 H ALA 143 10.290 -9.650 5.655 1056 HA ALA 143 HA ALA 143 10.948 -11.206 8.171 1057 HB1 ALA 143 3HB ALA 143 11.027 -8.762 8.855 1058 HB2 ALA 143 1HB ALA 143 9.694 -9.621 9.673 1059 HB3 ALA 143 2HB ALA 143 9.360 -8.533 8.295 1060 H GLU 144 H GLU 144 9.525 -12.792 8.580 1061 HA GLU 144 HA GLU 144 6.606 -12.508 7.654 1062 HB2 GLU 144 2HB GLU 144 8.106 -14.155 6.382 1063 HB3 GLU 144 1HB GLU 144 8.102 -15.177 7.817 1064 HG2 GLU 144 2HG GLU 144 5.574 -15.355 7.677 1065 HG3 GLU 144 1HG GLU 144 5.547 -14.169 6.383 1066 H THR 145 H THR 145 5.223 -12.242 9.275 1067 HA THR 145 HA THR 145 5.451 -13.979 11.750 1068 HB THR 145 HB THR 145 6.543 -11.805 12.359 1069 HG1 THR 145 HG1 THR 145 4.241 -12.644 13.795 1070 HG21 THR 145 3HG2 THR 145 3.790 -10.572 11.863 1071 HG22 THR 145 1HG2 THR 145 5.408 -9.853 11.756 1072 HG23 THR 145 2HG2 THR 145 4.666 -10.094 13.333 1073 H ASP 146 H ASP 146 3.592 -14.404 12.973 1074 HA ASP 146 HA ASP 146 1.046 -14.367 11.519 1075 HB2 ASP 146 2HB ASP 146 0.264 -15.702 13.412 1076 HB3 ASP 146 1HB ASP 146 1.763 -16.306 12.744 1077 H HIS 147 H HIS 147 -0.839 -13.321 11.916 1078 HA HIS 147 HA HIS 147 -1.050 -11.135 14.024 1079 HD1 HIS 147 HD1 HIS 147 1.544 -10.512 13.077 1080 HD2 HIS 147 HD2 HIS 147 -1.124 -7.368 12.096 1081 HE1 HIS 147 HE1 HIS 147 2.705 -8.233 13.450 1082 HB2 HIS 147 2HB HIS 147 -0.822 -10.728 10.991 1083 HB3 HIS 147 1HB HIS 147 -2.057 -9.803 11.773 1084 H GLU 148 H GLU 148 -3.297 -10.115 13.957 1085 HA GLU 148 HA GLU 148 -5.189 -12.359 14.476 1086 HB2 GLU 148 2HB GLU 148 -5.855 -9.382 14.649 1087 HB3 GLU 148 1HB GLU 148 -6.762 -10.695 15.323 1088 HG2 GLU 148 2HG GLU 148 -4.966 -11.161 17.033 1089 HG3 GLU 148 1HG GLU 148 -3.927 -9.934 16.315 1090 H GLY 149 H GLY 149 -5.805 -13.268 12.634 1091 HA2 GLY 149 2HA GLY 149 -7.856 -13.354 10.916 1092 HA3 GLY 149 1HA GLY 149 -7.444 -11.726 10.512 1093 H PHE 150 H PHE 150 -4.418 -12.628 10.698 1094 HA PHE 150 HA PHE 150 -4.134 -13.950 7.999 1095 HD1 PHE 150 HD1 PHE 150 -1.402 -10.696 7.865 1096 HD2 PHE 150 HD2 PHE 150 -5.442 -9.925 9.079 1097 HE1 PHE 150 HE1 PHE 150 -0.695 -8.538 8.834 1098 HE2 PHE 150 HE2 PHE 150 -4.757 -7.776 9.988 1099 HZ PHE 150 HZ PHE 150 -2.373 -7.055 9.894 1100 HB2 PHE 150 2HB PHE 150 -3.395 -11.926 6.829 1101 HB3 PHE 150 1HB PHE 150 -4.978 -11.693 7.482 1102 H THR 151 H THR 151 -1.844 -13.670 7.098 1103 HA THR 151 HA THR 151 0.225 -13.359 9.339 1104 HB THR 151 HB THR 151 0.233 -15.645 8.827 1105 HG1 THR 151 HG1 THR 151 2.394 -13.998 8.493 1106 HG21 THR 151 3HG2 THR 151 1.203 -16.600 6.730 1107 HG22 THR 151 1HG2 THR 151 1.094 -15.020 5.936 1108 HG23 THR 151 2HG2 THR 151 -0.398 -15.882 6.446 1109 H LEU 152 H LEU 152 1.567 -11.877 9.166 1110 HA LEU 152 HA LEU 152 1.639 -9.839 6.967 1111 HG LEU 152 HG LEU 152 3.294 -7.769 9.798 1112 HB2 LEU 152 2HB LEU 152 1.547 -9.160 9.294 1113 HB3 LEU 152 1HB LEU 152 2.849 -10.204 9.762 1114 HD11 LEU 152 1HD1 LEU 152 5.133 -9.664 9.577 1115 HD12 LEU 152 2HD1 LEU 152 5.628 -7.983 9.280 1116 HD13 LEU 152 3HD1 LEU 152 5.349 -9.095 7.932 1117 HD21 LEU 152 3HD2 LEU 152 3.738 -6.437 7.844 1118 HD22 LEU 152 1HD2 LEU 152 2.183 -7.228 7.510 1119 HD23 LEU 152 2HD2 LEU 152 3.654 -7.816 6.735 1120 H GLN 153 H GLN 153 3.012 -9.891 5.386 1121 HA GLN 153 HA GLN 153 5.785 -11.223 5.549 1122 HB2 GLN 153 2HB GLN 153 3.587 -11.243 3.428 1123 HB3 GLN 153 1HB GLN 153 5.170 -10.862 2.794 1124 HG2 GLN 153 2HG GLN 153 6.113 -12.991 3.754 1125 HG3 GLN 153 1HG GLN 153 4.553 -13.381 4.474 1126 HE21 GLN 153 1HE2 GLN 153 5.433 -15.257 3.087 1127 HE22 GLN 153 2HE2 GLN 153 4.920 -15.225 1.301 1128 H GLU 154 H GLU 154 7.447 -9.849 5.250 1129 HA GLU 154 HA GLU 154 7.036 -7.139 3.839 1130 HB2 GLU 154 2HB GLU 154 9.267 -7.783 5.827 1131 HB3 GLU 154 1HB GLU 154 8.859 -6.246 5.123 1132 HG2 GLU 154 2HG GLU 154 6.502 -6.552 6.360 1133 HG3 GLU 154 1HG GLU 154 7.330 -7.819 7.250 1134 H TRP 155 H TRP 155 7.830 -7.184 1.811 1135 HA TRP 155 HA TRP 155 10.071 -9.113 1.072 1136 HD1 TRP 155 HD1 TRP 155 5.902 -9.272 0.673 1137 HE1 TRP 155 HE1 TRP 155 5.032 -11.706 0.092 1138 HE3 TRP 155 HE3 TRP 155 10.067 -10.781 -1.859 1139 HZ2 TRP 155 HZ2 TRP 155 6.012 -13.720 -1.643 1140 HZ3 TRP 155 HZ3 TRP 155 9.998 -12.944 -3.073 1141 HH2 TRP 155 HH2 TRP 155 7.997 -14.371 -2.987 1142 HB2 TRP 155 2HB TRP 155 7.849 -7.735 -0.477 1143 HB3 TRP 155 1HB TRP 155 9.131 -8.541 -1.326 1144 H VAL 156 H VAL 156 12.138 -8.127 1.197 1145 HA VAL 156 HA VAL 156 12.514 -5.299 0.233 1146 HB VAL 156 HB VAL 156 13.550 -6.059 2.338 1147 HG11 VAL 156 1HG1 VAL 156 15.739 -7.332 2.328 1148 HG12 VAL 156 2HG1 VAL 156 15.473 -7.749 0.614 1149 HG13 VAL 156 3HG1 VAL 156 14.360 -8.342 1.859 1150 HG21 VAL 156 3HG2 VAL 156 15.633 -4.848 2.125 1151 HG22 VAL 156 1HG2 VAL 156 14.394 -4.027 1.150 1152 HG23 VAL 156 2HG2 VAL 156 15.632 -5.016 0.344 1153 H ARG 157 H ARG 157 13.221 -4.599 -1.656 1154 HA ARG 157 HA ARG 157 13.873 -6.194 -3.993 1155 HE ARG 157 HE ARG 157 14.204 -3.430 -7.356 1156 HB2 ARG 157 2HB ARG 157 14.273 -3.265 -3.217 1157 HB3 ARG 157 1HB ARG 157 15.150 -3.836 -4.615 1158 HG2 ARG 157 2HG ARG 157 12.875 -4.788 -5.555 1159 HG3 ARG 157 1HG ARG 157 12.116 -3.907 -4.223 1160 HD2 ARG 157 2HD ARG 157 11.982 -2.396 -6.092 1161 HD3 ARG 157 1HD ARG 157 13.225 -1.826 -4.974 1162 HH11 ARG 157 2HH1 ARG 157 13.683 -0.281 -5.988 1163 HH12 ARG 157 1HH1 ARG 157 15.014 0.496 -6.936 1164 HH21 ARG 157 1HH2 ARG 157 15.776 -2.577 -8.373 1165 HH22 ARG 157 2HH2 ARG 157 16.167 -0.784 -8.228 1166 H SER 158 H SER 158 15.657 -6.392 -5.255 1167 HA SER 158 HA SER 158 17.339 -8.255 -4.288 1168 HG SER 158 HG SER 158 18.614 -5.681 -6.178 1169 HB2 SER 158 2HB SER 158 18.566 -8.146 -6.421 1170 HB3 SER 158 1HB SER 158 16.851 -7.858 -6.668 1171 H ALA 159 H ALA 159 18.333 -7.621 -2.342 1172 HA ALA 159 HA ALA 159 21.012 -6.189 -2.550 1173 HB1 ALA 159 3HB ALA 159 20.538 -5.426 -0.265 1174 HB2 ALA 159 1HB ALA 159 19.175 -6.558 -0.091 1175 HB3 ALA 159 2HB ALA 159 19.069 -5.194 -1.228 1176 H SER 160 H SER 160 19.738 -8.915 -0.543 1177 HA SER 160 HA SER 160 22.280 -9.847 0.475 1178 HG SER 160 HG SER 160 19.112 -10.992 1.827 1179 HB2 SER 160 2HB SER 160 19.778 -11.422 -0.206 1180 HB3 SER 160 1HB SER 160 21.026 -12.008 0.889 1181 H SER 161 H SER 161 20.889 -10.645 -2.686 1182 HA SER 161 HA SER 161 22.740 -12.985 -3.204 1183 HG SER 161 HG SER 161 19.737 -13.103 -3.483 1184 HB2 SER 161 2HB SER 161 20.587 -11.619 -4.930 1185 HB3 SER 161 1HB SER 161 21.648 -12.867 -5.557 1186 H ARG 162 H ARG 162 24.660 -11.701 -2.847 1187 HA ARG 162 HA ARG 162 25.718 -10.427 -5.442 1188 HE ARG 162 HE ARG 162 27.869 -5.982 -5.200 1189 HB2 ARG 162 1HB ARG 162 25.032 -8.932 -3.411 1190 HB3 ARG 162 2HB ARG 162 26.414 -9.578 -2.555 1191 HG2 ARG 162 1HG ARG 162 27.971 -8.611 -4.294 1192 HG3 ARG 162 2HG ARG 162 26.582 -8.178 -5.324 1193 HD2 ARG 162 1HD ARG 162 25.696 -6.658 -3.456 1194 HD3 ARG 162 2HD ARG 162 27.129 -7.047 -2.496 1195 HH11 ARG 162 2HH1 ARG 162 26.692 -4.830 -2.099 1196 HH12 ARG 162 1HH1 ARG 162 27.531 -3.236 -2.373 1197 HH21 ARG 162 1HH2 ARG 162 28.867 -4.084 -5.372 1198 HH22 ARG 162 2HH2 ARG 162 28.616 -2.894 -4.027 Start of MODEL 11 1 HA MET 1 HA MET 1 16.231 4.854 2.025 2 H1 MET 1 1H MET 1 15.730 6.820 3.437 3 H2 MET 1 2H MET 1 14.916 5.884 4.461 4 HB2 MET 1 1HB MET 1 14.083 3.583 3.810 5 HB3 MET 1 2HB MET 1 14.740 2.872 2.372 6 HG2 MET 1 1HG MET 1 17.112 3.350 3.867 7 HG3 MET 1 2HG MET 1 15.944 2.913 5.105 8 HE1 MET 1 3HE MET 1 18.218 1.843 2.227 9 HE2 MET 1 1HE MET 1 16.698 1.910 1.281 10 HE3 MET 1 2HE MET 1 17.478 0.344 1.555 11 H GLU 2 H GLU 2 14.230 3.907 0.591 12 HA GLU 2 HA GLU 2 12.274 6.213 0.094 13 HB2 GLU 2 2HB GLU 2 12.278 5.785 -2.223 14 HB3 GLU 2 1HB GLU 2 13.915 5.924 -1.696 15 HG2 GLU 2 2HG GLU 2 13.811 3.190 -1.643 16 HG3 GLU 2 1HG GLU 2 12.493 3.441 -2.782 17 H LEU 3 H LEU 3 10.555 4.528 -1.582 18 HA LEU 3 HA LEU 3 8.833 4.125 0.831 19 HG LEU 3 HG LEU 3 8.985 6.195 -2.195 20 HB2 LEU 3 2HB LEU 3 6.863 4.382 -0.898 21 HB3 LEU 3 1HB LEU 3 7.767 5.691 -0.235 22 HD11 LEU 3 1HD1 LEU 3 8.687 4.948 -4.368 23 HD12 LEU 3 2HD1 LEU 3 7.775 3.658 -3.517 24 HD13 LEU 3 3HD1 LEU 3 9.480 3.949 -3.158 25 HD21 LEU 3 3HD2 LEU 3 6.829 7.223 -2.112 26 HD22 LEU 3 1HD2 LEU 3 5.964 5.735 -2.562 27 HD23 LEU 3 2HD2 LEU 3 6.936 6.611 -3.775 28 H VAL 4 H VAL 4 7.288 2.704 1.250 29 HA VAL 4 HA VAL 4 7.648 -0.097 0.098 30 HB VAL 4 HB VAL 4 7.399 0.877 2.977 31 HG11 VAL 4 1HG1 VAL 4 6.367 -1.372 2.892 32 HG12 VAL 4 2HG1 VAL 4 7.937 -1.498 3.732 33 HG13 VAL 4 3HG1 VAL 4 7.760 -2.035 2.051 34 HG21 VAL 4 3HG2 VAL 4 9.707 0.052 3.372 35 HG22 VAL 4 1HG2 VAL 4 9.643 1.393 2.242 36 HG23 VAL 4 2HG2 VAL 4 9.880 -0.238 1.614 37 H SER 5 H SER 5 5.880 -1.359 -0.306 38 HA SER 5 HA SER 5 3.159 -0.009 -0.112 39 HG SER 5 HG SER 5 5.377 -2.156 -2.181 40 HB2 SER 5 2HB SER 5 2.629 -1.559 -2.026 41 HB3 SER 5 1HB SER 5 3.986 -0.476 -2.319 42 H VAL 6 H VAL 6 1.363 -0.697 0.941 43 HA VAL 6 HA VAL 6 1.589 -3.196 2.663 44 HB VAL 6 HB VAL 6 1.484 -2.250 4.654 45 HG11 VAL 6 1HG1 VAL 6 2.896 -0.204 4.980 46 HG12 VAL 6 2HG1 VAL 6 2.765 0.167 3.259 47 HG13 VAL 6 3HG1 VAL 6 3.629 -1.278 3.782 48 HG21 VAL 6 3HG2 VAL 6 0.229 0.411 3.876 49 HG22 VAL 6 1HG2 VAL 6 0.637 -0.147 5.506 50 HG23 VAL 6 2HG2 VAL 6 -0.637 -0.963 4.620 51 H ALA 7 H ALA 7 0.074 -4.254 1.215 52 HA ALA 7 HA ALA 7 -2.896 -3.438 1.582 53 HB1 ALA 7 3HB ALA 7 -3.258 -4.814 -0.493 54 HB2 ALA 7 1HB ALA 7 -1.523 -5.236 -0.546 55 HB3 ALA 7 2HB ALA 7 -2.049 -3.557 -0.778 56 H ALA 8 H ALA 8 -4.572 -5.049 2.114 57 HA ALA 8 HA ALA 8 -3.546 -7.748 3.129 58 HB1 ALA 8 3HB ALA 8 -5.065 -7.685 4.966 59 HB2 ALA 8 1HB ALA 8 -5.988 -6.317 4.319 60 HB3 ALA 8 2HB ALA 8 -4.356 -6.062 4.948 61 H LEU 9 H LEU 9 -4.235 -9.517 2.226 62 HA LEU 9 HA LEU 9 -6.738 -9.531 0.555 63 HG LEU 9 HG LEU 9 -3.403 -9.533 -2.134 64 HB2 LEU 9 2HB LEU 9 -5.531 -10.155 -1.507 65 HB3 LEU 9 1HB LEU 9 -5.351 -8.534 -0.986 66 HD11 LEU 9 1HD1 LEU 9 -1.645 -8.445 -0.725 67 HD12 LEU 9 2HD1 LEU 9 -2.717 -8.429 0.659 68 HD13 LEU 9 3HD1 LEU 9 -3.109 -7.472 -0.786 69 HD21 LEU 9 3HD2 LEU 9 -2.726 -11.098 0.420 70 HD22 LEU 9 1HD2 LEU 9 -1.863 -11.095 -1.134 71 HD23 LEU 9 2HD2 LEU 9 -3.474 -11.823 -1.042 72 H ALA 10 H ALA 10 -7.479 -11.388 -0.339 73 HA ALA 10 HA ALA 10 -6.787 -13.919 1.255 74 HB1 ALA 10 3HB ALA 10 -9.320 -14.135 1.225 75 HB2 ALA 10 1HB ALA 10 -9.461 -12.682 0.221 76 HB3 ALA 10 2HB ALA 10 -8.818 -12.593 1.888 77 H GLU 11 H GLU 11 -8.994 -15.278 -0.488 78 HA GLU 11 HA GLU 11 -7.219 -16.597 -2.383 79 HB2 GLU 11 2HB GLU 11 -9.071 -17.823 -1.419 80 HB3 GLU 11 1HB GLU 11 -10.273 -16.794 -2.185 81 HG2 GLU 11 2HG GLU 11 -9.768 -17.695 -4.414 82 HG3 GLU 11 1HG GLU 11 -8.297 -18.502 -3.843 83 H ASN 12 H ASN 12 -7.848 -16.817 -4.703 84 HA ASN 12 HA ASN 12 -6.698 -15.831 -6.533 85 HB2 ASN 12 2HB ASN 12 -9.488 -15.559 -6.544 86 HB3 ASN 12 1HB ASN 12 -9.047 -13.923 -6.893 87 HD21 ASN 12 1HD2 ASN 12 -7.324 -13.802 -8.713 88 HD22 ASN 12 2HD2 ASN 12 -7.723 -14.925 -10.128 89 H ARG 13 H ARG 13 -5.915 -14.368 -4.135 90 HA ARG 13 HA ARG 13 -4.914 -12.508 -3.314 91 HE ARG 13 HE ARG 13 -2.655 -14.039 -7.933 92 HB2 ARG 13 2HB ARG 13 -3.022 -11.583 -4.314 93 HB3 ARG 13 1HB ARG 13 -3.076 -13.290 -4.702 94 HG2 ARG 13 2HG ARG 13 -4.102 -12.438 -7.078 95 HG3 ARG 13 1HG ARG 13 -3.527 -10.886 -6.575 96 HD2 ARG 13 2HD ARG 13 -1.645 -11.507 -7.673 97 HD3 ARG 13 1HD ARG 13 -1.195 -12.087 -6.090 98 HH11 ARG 13 2HH1 ARG 13 0.382 -13.027 -6.670 99 HH12 ARG 13 1HH1 ARG 13 1.308 -14.424 -7.367 100 HH21 ARG 13 1HH2 ARG 13 -1.579 -15.525 -8.955 101 HH22 ARG 13 2HH2 ARG 13 0.218 -15.711 -8.708 102 H VAL 14 H VAL 14 -7.291 -12.013 -3.434 103 HA VAL 14 HA VAL 14 -8.012 -9.469 -4.805 104 HB VAL 14 HB VAL 14 -9.414 -11.456 -2.932 105 HG11 VAL 14 1HG1 VAL 14 -11.539 -10.257 -3.004 106 HG12 VAL 14 2HG1 VAL 14 -10.766 -8.796 -3.695 107 HG13 VAL 14 3HG1 VAL 14 -10.368 -9.364 -2.050 108 HG21 VAL 14 3HG2 VAL 14 -10.926 -11.617 -4.929 109 HG22 VAL 14 1HG2 VAL 14 -9.247 -11.937 -5.383 110 HG23 VAL 14 2HG2 VAL 14 -9.975 -10.374 -5.798 111 H ILE 15 H ILE 15 -7.193 -7.605 -4.212 112 HA ILE 15 HA ILE 15 -6.450 -6.671 -1.474 113 HB ILE 15 HB ILE 15 -7.266 -4.920 -3.845 114 HG12 ILE 15 2HG1 ILE 15 -4.311 -5.397 -3.187 115 HG13 ILE 15 1HG1 ILE 15 -5.192 -6.516 -4.216 116 HG21 ILE 15 1HG2 ILE 15 -7.226 -3.625 -1.669 117 HG22 ILE 15 2HG2 ILE 15 -5.920 -3.090 -2.691 118 HG23 ILE 15 3HG2 ILE 15 -5.568 -4.182 -1.342 119 HD11 ILE 15 3HD1 ILE 15 -3.992 -4.658 -5.538 120 HD12 ILE 15 1HD1 ILE 15 -5.192 -3.524 -4.874 121 HD13 ILE 15 2HD1 ILE 15 -5.702 -4.862 -5.911 122 H GLY 16 H GLY 16 -9.224 -5.542 -3.408 123 HA2 GLY 16 2HA GLY 16 -11.069 -5.958 -1.049 124 HA3 GLY 16 1HA GLY 16 -10.775 -4.268 -1.480 125 H ARG 17 H ARG 17 -12.972 -4.365 -1.500 126 HA ARG 17 HA ARG 17 -14.346 -5.145 -4.112 127 HE ARG 17 HE ARG 17 -15.986 -10.181 -3.711 128 HB2 ARG 17 2HB ARG 17 -14.930 -6.256 -1.350 129 HB3 ARG 17 1HB ARG 17 -16.319 -5.500 -2.038 130 HG2 ARG 17 2HG ARG 17 -16.564 -7.025 -3.775 131 HG3 ARG 17 1HG ARG 17 -14.866 -7.394 -3.947 132 HD2 ARG 17 2HD ARG 17 -14.783 -8.859 -2.031 133 HD3 ARG 17 1HD ARG 17 -16.293 -8.269 -1.354 134 HH11 ARG 17 2HH1 ARG 17 -18.224 -8.203 -1.965 135 HH12 ARG 17 1HH1 ARG 17 -19.665 -9.064 -2.660 136 HH21 ARG 17 1HH2 ARG 17 -17.598 -11.102 -4.509 137 HH22 ARG 17 2HH2 ARG 17 -19.306 -10.653 -4.077 138 H ASP 18 H ASP 18 -15.518 -3.491 -1.130 139 HA ASP 18 HA ASP 18 -16.333 -1.138 -2.520 140 HB2 ASP 18 2HB ASP 18 -15.777 -1.628 0.481 141 HB3 ASP 18 1HB ASP 18 -16.646 -0.255 -0.176 142 H GLY 19 H GLY 19 -13.293 -1.459 -0.613 143 HA2 GLY 19 2HA GLY 19 -12.073 0.863 -2.184 144 HA3 GLY 19 1HA GLY 19 -12.318 1.135 -0.486 145 H GLU 20 H GLU 20 -10.736 0.373 0.938 146 HA GLU 20 HA GLU 20 -8.310 -0.967 -0.184 147 HB2 GLU 20 2HB GLU 20 -7.320 -1.024 2.043 148 HB3 GLU 20 1HB GLU 20 -7.642 0.572 1.467 149 HG2 GLU 20 2HG GLU 20 -9.541 -0.825 3.479 150 HG3 GLU 20 1HG GLU 20 -8.095 -0.035 4.021 151 H LEU 21 H LEU 21 -11.018 -2.233 1.711 152 HA LEU 21 HA LEU 21 -10.191 -4.936 0.883 153 HG LEU 21 HG LEU 21 -8.983 -2.827 3.640 154 HB2 LEU 21 2HB LEU 21 -9.751 -5.798 3.315 155 HB3 LEU 21 1HB LEU 21 -8.536 -4.979 2.366 156 HD11 LEU 21 1HD1 LEU 21 -10.192 -3.063 5.862 157 HD12 LEU 21 2HD1 LEU 21 -10.706 -4.696 5.352 158 HD13 LEU 21 3HD1 LEU 21 -11.265 -3.263 4.465 159 HD21 LEU 21 3HD2 LEU 21 -7.645 -3.461 5.602 160 HD22 LEU 21 1HD2 LEU 21 -7.033 -4.248 4.138 161 HD23 LEU 21 2HD2 LEU 21 -7.985 -5.176 5.311 162 HA PRO 22 HA PRO 22 -14.376 -6.098 1.116 163 HB2 PRO 22 2HB PRO 22 -13.736 -8.965 1.877 164 HB3 PRO 22 1HB PRO 22 -14.401 -8.308 0.374 165 HG2 PRO 22 2HG PRO 22 -11.800 -9.270 0.519 166 HG3 PRO 22 1HG PRO 22 -12.220 -7.893 -0.529 167 HD2 PRO 22 2HD PRO 22 -11.013 -7.729 2.296 168 HD3 PRO 22 1HD PRO 22 -10.490 -6.960 0.818 169 H TRP 23 H TRP 23 -12.796 -6.682 3.966 170 HA TRP 23 HA TRP 23 -15.271 -6.980 5.708 171 HD1 TRP 23 HD1 TRP 23 -11.466 -6.048 7.792 172 HE1 TRP 23 HE1 TRP 23 -9.071 -5.997 6.691 173 HE3 TRP 23 HE3 TRP 23 -12.217 -9.825 4.510 174 HZ2 TRP 23 HZ2 TRP 23 -7.752 -7.604 4.816 175 HZ3 TRP 23 HZ3 TRP 23 -10.365 -10.446 2.964 176 HH2 TRP 23 HH2 TRP 23 -8.200 -9.254 3.061 177 HB2 TRP 23 2HB TRP 23 -13.725 -7.668 7.567 178 HB3 TRP 23 1HB TRP 23 -13.724 -8.811 6.228 179 HA PRO 24 HA PRO 24 -14.486 -2.624 6.579 180 HB2 PRO 24 2HB PRO 24 -14.850 -2.811 9.548 181 HB3 PRO 24 1HB PRO 24 -15.810 -1.973 8.328 182 HG2 PRO 24 2HG PRO 24 -16.736 -4.288 9.557 183 HG3 PRO 24 1HG PRO 24 -17.140 -3.895 7.877 184 HD2 PRO 24 2HD PRO 24 -14.998 -5.844 8.847 185 HD3 PRO 24 1HD PRO 24 -16.182 -6.018 7.517 186 H SER 25 H SER 25 -12.659 -4.514 8.825 187 HA SER 25 HA SER 25 -10.123 -4.273 8.264 188 HG SER 25 HG SER 25 -8.423 -2.378 7.753 189 HB2 SER 25 2HB SER 25 -10.466 -1.524 9.523 190 HB3 SER 25 1HB SER 25 -8.985 -2.435 9.779 191 H ILE 26 H ILE 26 -9.350 -5.760 9.649 192 HA ILE 26 HA ILE 26 -10.386 -6.062 12.425 193 HB ILE 26 HB ILE 26 -8.423 -7.722 12.704 194 HG12 ILE 26 2HG1 ILE 26 -7.297 -6.799 10.468 195 HG13 ILE 26 1HG1 ILE 26 -6.990 -8.370 11.123 196 HG21 ILE 26 1HG2 ILE 26 -9.683 -9.580 11.651 197 HG22 ILE 26 2HG2 ILE 26 -10.747 -8.419 10.831 198 HG23 ILE 26 3HG2 ILE 26 -10.699 -8.488 12.608 199 HD11 ILE 26 3HD1 ILE 26 -9.143 -8.000 8.936 200 HD12 ILE 26 1HD1 ILE 26 -8.300 -9.492 9.396 201 HD13 ILE 26 2HD1 ILE 26 -7.427 -8.189 8.539 202 HA PRO 27 HA PRO 27 -7.550 -3.329 14.685 203 HB2 PRO 27 2HB PRO 27 -7.359 -5.559 16.769 204 HB3 PRO 27 1HB PRO 27 -7.634 -3.817 16.995 205 HG2 PRO 27 2HG PRO 27 -9.791 -5.460 17.084 206 HG3 PRO 27 1HG PRO 27 -9.913 -3.986 16.083 207 HD2 PRO 27 2HD PRO 27 -9.240 -6.825 15.084 208 HD3 PRO 27 1HD PRO 27 -10.491 -5.671 14.497 209 H ALA 28 H ALA 28 -6.050 -6.646 14.668 210 HA ALA 28 HA ALA 28 -3.366 -5.782 14.463 211 HB1 ALA 28 3HB ALA 28 -4.079 -8.106 14.624 212 HB2 ALA 28 1HB ALA 28 -2.980 -7.960 13.243 213 HB3 ALA 28 2HB ALA 28 -4.713 -8.097 12.950 214 H ASP 29 H ASP 29 -5.606 -5.408 11.783 215 HA ASP 29 HA ASP 29 -3.602 -4.564 9.683 216 HB2 ASP 29 2HB ASP 29 -5.622 -5.643 8.937 217 HB3 ASP 29 1HB ASP 29 -6.668 -4.682 9.957 218 H LYS 30 H LYS 30 -6.273 -2.724 11.080 219 HA LYS 30 HA LYS 30 -5.003 -0.210 10.872 220 HB2 LYS 30 2HB LYS 30 -7.554 -1.021 11.397 221 HB3 LYS 30 1HB LYS 30 -7.105 -0.545 13.008 222 HG2 LYS 30 2HG LYS 30 -8.145 1.379 12.116 223 HG3 LYS 30 1HG LYS 30 -6.443 1.777 12.019 224 HD2 LYS 30 2HD LYS 30 -7.536 2.630 10.061 225 HD3 LYS 30 1HD LYS 30 -6.466 1.333 9.531 226 HE2 LYS 30 2HE LYS 30 -8.407 -0.187 9.194 227 HE3 LYS 30 1HE LYS 30 -9.529 1.032 9.840 228 HZ1 LYS 30 3HZ LYS 30 -7.906 1.480 7.300 229 HZ2 LYS 30 1HZ LYS 30 -8.946 2.561 8.014 230 HZ3 LYS 30 2HZ LYS 30 -9.541 1.204 7.410 231 H LYS 31 H LYS 31 -4.119 -2.381 13.331 232 HA LYS 31 HA LYS 31 -2.431 -0.309 14.817 233 HB2 LYS 31 2HB LYS 31 -3.501 -2.035 16.254 234 HB3 LYS 31 1HB LYS 31 -2.821 -3.316 15.280 235 HG2 LYS 31 2HG LYS 31 -1.575 -3.317 17.294 236 HG3 LYS 31 1HG LYS 31 -0.531 -2.844 16.000 237 HD2 LYS 31 2HD LYS 31 -1.306 -0.305 16.830 238 HD3 LYS 31 1HD LYS 31 -1.664 -1.172 18.294 239 HE2 LYS 31 2HE LYS 31 0.577 -0.200 18.508 240 HE3 LYS 31 1HE LYS 31 0.755 -1.952 18.475 241 HZ1 LYS 31 3HZ LYS 31 2.328 -0.801 16.798 242 HZ2 LYS 31 1HZ LYS 31 1.006 -0.214 15.991 243 HZ3 LYS 31 2HZ LYS 31 1.256 -1.793 16.020 244 H GLN 32 H GLN 32 -1.896 -2.966 12.432 245 HA GLN 32 HA GLN 32 1.100 -2.745 12.558 246 HB2 GLN 32 2HB GLN 32 0.101 -4.897 12.063 247 HB3 GLN 32 1HB GLN 32 -0.756 -4.266 10.676 248 HG2 GLN 32 2HG GLN 32 2.282 -3.929 10.586 249 HG3 GLN 32 1HG GLN 32 1.722 -5.583 10.572 250 HE21 GLN 32 1HE2 GLN 32 0.076 -6.108 8.896 251 HE22 GLN 32 2HE2 GLN 32 0.410 -5.348 7.267 252 H TYR 33 H TYR 33 -1.364 -1.897 10.059 253 HA TYR 33 HA TYR 33 0.256 -0.026 8.593 254 HD1 TYR 33 HD1 TYR 33 -3.327 0.966 10.339 255 HD2 TYR 33 HD2 TYR 33 -2.444 1.687 6.236 256 HE1 TYR 33 HE1 TYR 33 -4.668 3.025 10.427 257 HE2 TYR 33 HE2 TYR 33 -3.751 3.808 6.339 258 HH TYR 33 HH TYR 33 -5.606 4.897 7.774 259 HB2 TYR 33 2HB TYR 33 -1.539 -0.308 7.322 260 HB3 TYR 33 1HB TYR 33 -2.521 -0.928 8.572 261 H ARG 34 H ARG 34 -1.347 0.747 11.757 262 HA ARG 34 HA ARG 34 -0.443 3.621 11.419 263 HE ARG 34 HE ARG 34 -5.175 5.024 11.383 264 HB2 ARG 34 2HB ARG 34 -1.460 2.306 13.978 265 HB3 ARG 34 1HB ARG 34 -1.058 4.010 13.812 266 HG2 ARG 34 2HG ARG 34 -3.163 2.789 11.982 267 HG3 ARG 34 1HG ARG 34 -3.553 3.061 13.628 268 HD2 ARG 34 2HD ARG 34 -2.896 5.611 13.251 269 HD3 ARG 34 1HD ARG 34 -2.799 5.211 11.543 270 HH11 ARG 34 2HH1 ARG 34 -4.292 5.036 14.702 271 HH12 ARG 34 1HH1 ARG 34 -6.017 5.054 15.310 272 HH21 ARG 34 1HH2 ARG 34 -7.156 5.021 12.034 273 HH22 ARG 34 2HH2 ARG 34 -7.578 5.036 13.808 274 H SER 35 H SER 35 1.125 0.843 12.693 275 HA SER 35 HA SER 35 3.464 2.564 13.713 276 HG SER 35 HG SER 35 5.267 1.056 14.209 277 HB2 SER 35 2HB SER 35 2.802 0.959 15.389 278 HB3 SER 35 1HB SER 35 3.025 -0.419 14.252 279 H ARG 36 H ARG 36 2.423 1.133 10.956 280 HA ARG 36 HA ARG 36 5.233 1.078 9.758 281 HE ARG 36 HE ARG 36 6.008 -3.337 7.714 282 HB2 ARG 36 2HB ARG 36 3.362 -0.840 9.456 283 HB3 ARG 36 1HB ARG 36 2.540 0.334 8.471 284 HG2 ARG 36 2HG ARG 36 3.693 -1.163 7.029 285 HG3 ARG 36 1HG ARG 36 4.464 0.394 6.926 286 HD2 ARG 36 2HD ARG 36 6.198 -1.188 6.870 287 HD3 ARG 36 1HD ARG 36 6.394 -0.522 8.445 288 HH11 ARG 36 2HH1 ARG 36 5.293 -1.269 10.337 289 HH12 ARG 36 1HH1 ARG 36 5.528 -2.657 11.516 290 HH21 ARG 36 1HH2 ARG 36 6.195 -4.722 8.886 291 HH22 ARG 36 2HH2 ARG 36 5.827 -4.705 10.654 292 H VAL 37 H VAL 37 1.944 2.501 9.114 293 HA VAL 37 HA VAL 37 3.297 4.770 7.668 294 HB VAL 37 HB VAL 37 1.716 4.817 6.151 295 HG11 VAL 37 1HG1 VAL 37 2.647 2.460 6.034 296 HG12 VAL 37 2HG1 VAL 37 1.111 2.675 5.160 297 HG13 VAL 37 3HG1 VAL 37 1.142 1.863 6.758 298 HG21 VAL 37 3HG2 VAL 37 -0.375 5.320 7.226 299 HG22 VAL 37 1HG2 VAL 37 -0.502 3.723 7.960 300 HG23 VAL 37 2HG2 VAL 37 -0.708 3.907 6.209 301 H ALA 38 H ALA 38 1.765 4.851 10.760 302 HA ALA 38 HA ALA 38 0.074 7.246 10.105 303 HB1 ALA 38 3HB ALA 38 -0.498 7.407 12.449 304 HB2 ALA 38 1HB ALA 38 0.726 6.201 12.887 305 HB3 ALA 38 2HB ALA 38 -0.667 5.733 11.888 306 H ASP 39 H ASP 39 3.337 6.930 11.288 307 HA ASP 39 HA ASP 39 3.799 9.896 11.499 308 HB2 ASP 39 2HB ASP 39 5.453 7.382 11.994 309 HB3 ASP 39 1HB ASP 39 6.310 8.743 11.344 310 H ASP 40 H ASP 40 4.915 7.360 9.150 311 HA ASP 40 HA ASP 40 5.758 9.208 7.240 312 HB2 ASP 40 2HB ASP 40 5.168 6.216 7.228 313 HB3 ASP 40 1HB ASP 40 5.786 6.971 5.777 314 HA PRO 41 HA PRO 41 2.314 10.224 4.238 315 HB2 PRO 41 2HB PRO 41 4.639 9.984 2.231 316 HB3 PRO 41 1HB PRO 41 3.400 11.229 2.307 317 HG2 PRO 41 2HG PRO 41 5.841 11.789 3.322 318 HG3 PRO 41 1HG PRO 41 4.465 12.160 4.389 319 HD2 PRO 41 2HD PRO 41 6.216 9.629 4.508 320 HD3 PRO 41 1HD PRO 41 5.740 10.760 5.806 321 H VAL 42 H VAL 42 0.961 9.160 2.724 322 HA VAL 42 HA VAL 42 1.921 6.440 1.664 323 HB VAL 42 HB VAL 42 -0.822 7.175 2.779 324 HG11 VAL 42 1HG1 VAL 42 0.136 4.388 1.805 325 HG12 VAL 42 2HG1 VAL 42 -1.049 5.406 0.944 326 HG13 VAL 42 3HG1 VAL 42 -1.436 4.758 2.550 327 HG21 VAL 42 3HG2 VAL 42 1.537 5.449 3.823 328 HG22 VAL 42 1HG2 VAL 42 -0.106 5.267 4.471 329 HG23 VAL 42 2HG2 VAL 42 0.760 6.810 4.636 330 H VAL 43 H VAL 43 1.792 5.940 -0.363 331 HA VAL 43 HA VAL 43 0.397 7.788 -2.342 332 HB VAL 43 HB VAL 43 1.974 7.185 -4.008 333 HG11 VAL 43 1HG1 VAL 43 2.981 8.820 -2.289 334 HG12 VAL 43 2HG1 VAL 43 4.205 7.802 -3.086 335 HG13 VAL 43 3HG1 VAL 43 3.684 7.452 -1.435 336 HG21 VAL 43 3HG2 VAL 43 3.927 5.562 -3.557 337 HG22 VAL 43 1HG2 VAL 43 2.362 4.763 -3.696 338 HG23 VAL 43 2HG2 VAL 43 3.089 5.072 -2.087 339 H LEU 44 H LEU 44 -1.612 7.208 -2.938 340 HA LEU 44 HA LEU 44 -2.267 4.252 -3.427 341 HG LEU 44 HG LEU 44 -4.283 7.087 -2.030 342 HB2 LEU 44 2HB LEU 44 -4.156 4.305 -1.961 343 HB3 LEU 44 1HB LEU 44 -2.717 4.618 -1.088 344 HD11 LEU 44 1HD1 LEU 44 -5.789 6.930 0.037 345 HD12 LEU 44 2HD1 LEU 44 -5.204 5.272 0.310 346 HD13 LEU 44 3HD1 LEU 44 -6.130 5.664 -1.156 347 HD21 LEU 44 3HD2 LEU 44 -3.115 6.621 0.783 348 HD22 LEU 44 1HD2 LEU 44 -3.463 8.127 -0.083 349 HD23 LEU 44 2HD2 LEU 44 -2.098 7.137 -0.602 350 H GLY 45 H GLY 45 -4.894 4.145 -3.871 351 HA2 GLY 45 2HA GLY 45 -5.005 5.403 -6.688 352 HA3 GLY 45 1HA GLY 45 -5.606 3.796 -6.287 353 H ARG 46 H ARG 46 -7.395 5.081 -7.558 354 HA ARG 46 HA ARG 46 -9.251 6.561 -5.631 355 HE ARG 46 HE ARG 46 -11.713 8.911 -7.382 356 HB2 ARG 46 2HB ARG 46 -9.568 6.093 -8.628 357 HB3 ARG 46 1HB ARG 46 -10.857 6.689 -7.632 358 HG2 ARG 46 2HG ARG 46 -8.102 8.069 -7.887 359 HG3 ARG 46 1HG ARG 46 -9.492 8.522 -8.846 360 HD2 ARG 46 2HD ARG 46 -9.279 8.792 -5.759 361 HD3 ARG 46 1HD ARG 46 -9.040 10.080 -6.949 362 HH11 ARG 46 2HH1 ARG 46 -10.098 10.727 -4.875 363 HH12 ARG 46 1HH1 ARG 46 -11.666 11.500 -4.379 364 HH21 ARG 46 1HH2 ARG 46 -13.490 9.698 -6.610 365 HH22 ARG 46 2HH2 ARG 46 -13.423 11.052 -5.416 366 H THR 47 H THR 47 -9.027 3.188 -6.805 367 HA THR 47 HA THR 47 -11.442 2.349 -5.439 368 HB THR 47 HB THR 47 -8.823 0.739 -5.444 369 HG1 THR 47 HG1 THR 47 -10.922 0.586 -7.326 370 HG21 THR 47 3HG2 THR 47 -10.015 -1.050 -4.690 371 HG22 THR 47 1HG2 THR 47 -11.294 -0.844 -5.899 372 HG23 THR 47 2HG2 THR 47 -11.381 -0.000 -4.334 373 H THR 48 H THR 48 -8.262 1.848 -3.773 374 HA THR 48 HA THR 48 -9.055 2.071 -1.085 375 HB THR 48 HB THR 48 -6.700 2.838 -0.572 376 HG1 THR 48 HG1 THR 48 -6.637 4.173 -2.444 377 HG21 THR 48 3HG2 THR 48 -7.023 0.392 -1.024 378 HG22 THR 48 1HG2 THR 48 -5.424 1.002 -1.423 379 HG23 THR 48 2HG2 THR 48 -6.597 0.651 -2.723 380 H PHE 49 H PHE 49 -8.474 4.988 -3.067 381 HA PHE 49 HA PHE 49 -8.583 6.792 -0.643 382 HD1 PHE 49 HD2 PHE 49 -10.107 9.656 -2.393 383 HD2 PHE 49 HD1 PHE 49 -5.986 8.895 -1.509 384 HE1 PHE 49 HE2 PHE 49 -9.905 11.906 -1.395 385 HE2 PHE 49 HE1 PHE 49 -5.743 11.230 -0.718 386 HZ PHE 49 HZ PHE 49 -7.684 12.669 -0.557 387 HB2 PHE 49 2HB PHE 49 -7.165 7.282 -2.718 388 HB3 PHE 49 1HB PHE 49 -8.623 7.705 -3.581 389 H GLU 50 H GLU 50 -10.959 5.810 -3.091 390 HA GLU 50 HA GLU 50 -13.028 7.745 -2.091 391 HB2 GLU 50 2HB GLU 50 -13.238 5.344 -3.998 392 HB3 GLU 50 1HB GLU 50 -14.599 6.338 -3.508 393 HG2 GLU 50 2HG GLU 50 -13.570 8.386 -4.460 394 HG3 GLU 50 1HG GLU 50 -12.080 7.519 -4.866 395 H SER 51 H SER 51 -12.035 4.448 -1.108 396 HA SER 51 HA SER 51 -13.619 4.539 1.398 397 HG SER 51 HG SER 51 -11.950 1.917 2.629 398 HB2 SER 51 2HB SER 51 -11.476 2.861 0.341 399 HB3 SER 51 1HB SER 51 -10.876 3.522 1.814 400 H MET 52 H MET 52 -10.182 5.447 1.319 401 HA MET 52 HA MET 52 -10.106 6.540 3.826 402 HB2 MET 52 2HB MET 52 -8.318 7.405 1.449 403 HB3 MET 52 1HB MET 52 -7.955 7.724 3.122 404 HG2 MET 52 2HG MET 52 -8.439 4.867 3.055 405 HG3 MET 52 1HG MET 52 -7.415 5.257 1.674 406 HE1 MET 52 3HE MET 52 -4.418 5.374 2.663 407 HE2 MET 52 1HE MET 52 -5.663 4.088 2.501 408 HE3 MET 52 2HE MET 52 -4.756 4.270 4.033 409 H ARG 53 H ARG 53 -11.232 8.382 1.358 410 HA ARG 53 HA ARG 53 -11.683 11.054 2.390 411 HE ARG 53 HE ARG 53 -15.131 11.101 3.591 412 HB2 ARG 53 2HB ARG 53 -12.312 10.046 0.190 413 HB3 ARG 53 1HB ARG 53 -13.403 8.925 0.962 414 HG2 ARG 53 2HG ARG 53 -13.802 11.991 0.887 415 HG3 ARG 53 1HG ARG 53 -14.363 10.874 -0.328 416 HD2 ARG 53 2HD ARG 53 -16.355 10.798 0.845 417 HD3 ARG 53 1HD ARG 53 -15.538 9.583 1.756 418 HH11 ARG 53 2HH1 ARG 53 -16.429 12.880 0.955 419 HH12 ARG 53 1HH1 ARG 53 -16.630 14.405 1.952 420 HH21 ARG 53 1HH2 ARG 53 -15.385 12.713 4.687 421 HH22 ARG 53 2HH2 ARG 53 -16.036 14.303 4.059 422 H ASP 54 H ASP 54 -13.010 7.985 3.718 423 HA ASP 54 HA ASP 54 -14.067 9.495 6.091 424 HB2 ASP 54 2HB ASP 54 -15.036 7.131 4.845 425 HB3 ASP 54 1HB ASP 54 -14.191 6.500 6.247 426 H ASP 55 H ASP 55 -11.844 6.552 6.209 427 HA ASP 55 HA ASP 55 -10.429 8.109 8.395 428 HB2 ASP 55 2HB ASP 55 -10.198 6.535 9.790 429 HB3 ASP 55 1HB ASP 55 -11.540 5.840 8.961 430 H LEU 56 H LEU 56 -8.685 9.109 8.041 431 HA LEU 56 HA LEU 56 -7.098 8.835 5.630 432 HG LEU 56 HG LEU 56 -7.290 12.519 6.654 433 HB2 LEU 56 2HB LEU 56 -6.147 10.548 7.966 434 HB3 LEU 56 1HB LEU 56 -5.909 10.791 6.281 435 HD11 LEU 56 1HD1 LEU 56 -8.573 11.200 4.913 436 HD12 LEU 56 2HD1 LEU 56 -9.614 12.207 5.921 437 HD13 LEU 56 3HD1 LEU 56 -9.543 10.467 6.212 438 HD21 LEU 56 3HD2 LEU 56 -9.015 12.764 8.328 439 HD22 LEU 56 1HD2 LEU 56 -7.616 12.004 9.098 440 HD23 LEU 56 2HD2 LEU 56 -9.043 11.019 8.667 441 HA PRO 57 HA PRO 57 -3.697 6.172 7.112 442 HB2 PRO 57 2HB PRO 57 -1.700 6.551 5.301 443 HB3 PRO 57 1HB PRO 57 -3.250 5.823 4.910 444 HG2 PRO 57 2HG PRO 57 -2.320 8.681 4.361 445 HG3 PRO 57 1HG PRO 57 -3.241 7.587 3.299 446 HD2 PRO 57 2HD PRO 57 -4.360 9.603 4.924 447 HD3 PRO 57 1HD PRO 57 -5.289 8.202 4.295 448 H GLY 58 H GLY 58 -1.512 8.873 6.287 449 HA2 GLY 58 2HA GLY 58 -0.662 9.087 9.259 450 HA3 GLY 58 1HA GLY 58 0.551 8.822 8.002 451 H SER 59 H SER 59 1.570 10.745 8.709 452 HA SER 59 HA SER 59 0.582 13.397 8.573 453 HG SER 59 HG SER 59 3.948 14.393 8.666 454 HB2 SER 59 2HB SER 59 2.827 12.573 9.367 455 HB3 SER 59 1HB SER 59 3.352 12.394 7.686 456 H ALA 60 H ALA 60 0.777 11.420 5.737 457 HA ALA 60 HA ALA 60 -0.574 13.569 4.220 458 HB1 ALA 60 3HB ALA 60 1.624 14.388 3.721 459 HB2 ALA 60 1HB ALA 60 1.156 13.532 2.237 460 HB3 ALA 60 2HB ALA 60 2.286 12.785 3.383 461 H GLN 61 H GLN 61 -1.263 13.100 2.053 462 HA GLN 61 HA GLN 61 -1.884 10.146 1.546 463 HB2 GLN 61 2HB GLN 61 -3.522 11.461 3.149 464 HB3 GLN 61 1HB GLN 61 -4.048 12.320 1.711 465 HG2 GLN 61 2HG GLN 61 -4.630 10.016 0.672 466 HG3 GLN 61 1HG GLN 61 -4.155 9.253 2.129 467 HE21 GLN 61 1HE2 GLN 61 -5.593 11.378 3.863 468 HE22 GLN 61 2HE2 GLN 61 -7.296 10.682 3.694 469 H ILE 62 H ILE 62 -0.963 9.934 -0.364 470 HA ILE 62 HA ILE 62 -1.177 12.017 -2.568 471 HB ILE 62 HB ILE 62 0.729 9.727 -1.884 472 HG12 ILE 62 2HG1 ILE 62 1.583 12.557 -2.419 473 HG13 ILE 62 1HG1 ILE 62 0.821 12.240 -0.865 474 HG21 ILE 62 1HG2 ILE 62 0.651 9.572 -4.327 475 HG22 ILE 62 2HG2 ILE 62 2.144 10.408 -3.879 476 HG23 ILE 62 3HG2 ILE 62 0.727 11.349 -4.482 477 HD11 ILE 62 3HD1 ILE 62 3.231 12.112 -0.575 478 HD12 ILE 62 1HD1 ILE 62 3.433 11.036 -1.959 479 HD13 ILE 62 2HD1 ILE 62 2.655 10.444 -0.449 480 H VAL 63 H VAL 63 -2.717 11.614 -4.201 481 HA VAL 63 HA VAL 63 -3.193 8.725 -5.032 482 HB VAL 63 HB VAL 63 -4.721 11.186 -5.871 483 HG11 VAL 63 1HG1 VAL 63 -4.717 9.616 -7.859 484 HG12 VAL 63 2HG1 VAL 63 -6.305 9.541 -7.079 485 HG13 VAL 63 3HG1 VAL 63 -5.111 8.246 -6.806 486 HG21 VAL 63 3HG2 VAL 63 -5.426 8.615 -4.259 487 HG22 VAL 63 1HG2 VAL 63 -6.601 9.916 -4.637 488 HG23 VAL 63 2HG2 VAL 63 -5.207 10.245 -3.597 489 H MET 64 H MET 64 -1.936 7.743 -6.318 490 HA MET 64 HA MET 64 -0.547 8.955 -8.702 491 HB2 MET 64 2HB MET 64 -0.791 6.143 -7.449 492 HB3 MET 64 1HB MET 64 -0.295 6.310 -9.098 493 HG2 MET 64 2HG MET 64 1.407 8.224 -7.827 494 HG3 MET 64 1HG MET 64 1.289 6.918 -6.652 495 HE1 MET 64 3HE MET 64 2.921 6.704 -10.996 496 HE2 MET 64 1HE MET 64 2.044 8.082 -10.255 497 HE3 MET 64 2HE MET 64 1.143 6.650 -10.840 498 H SER 65 H SER 65 -2.183 9.882 -9.827 499 HA SER 65 HA SER 65 -3.583 7.981 -11.735 500 HG SER 65 HG SER 65 -6.618 9.999 -11.712 501 HB2 SER 65 2HB SER 65 -5.343 8.362 -10.035 502 HB3 SER 65 1HB SER 65 -5.208 10.108 -10.200 503 H ARG 66 H ARG 66 -4.938 10.660 -12.634 504 HA ARG 66 HA ARG 66 -2.593 11.516 -14.453 505 HE ARG 66 HE ARG 66 -1.575 7.606 -16.418 506 HB2 ARG 66 2HB ARG 66 -5.509 11.017 -15.254 507 HB3 ARG 66 1HB ARG 66 -4.280 11.598 -16.346 508 HG2 ARG 66 2HG ARG 66 -3.799 8.933 -14.877 509 HG3 ARG 66 1HG ARG 66 -4.964 8.978 -16.152 510 HD2 ARG 66 2HD ARG 66 -3.196 9.675 -17.826 511 HD3 ARG 66 1HD ARG 66 -2.051 9.933 -16.527 512 HH11 ARG 66 2HH1 ARG 66 -4.647 7.909 -17.989 513 HH12 ARG 66 1HH1 ARG 66 -4.675 6.148 -18.461 514 HH21 ARG 66 1HH2 ARG 66 -1.611 5.643 -16.993 515 HH22 ARG 66 2HH2 ARG 66 -2.999 4.931 -17.931 516 H SER 67 H SER 67 -5.853 12.801 -13.362 517 HA SER 67 HA SER 67 -4.630 15.493 -12.990 518 HG SER 67 HG SER 67 -3.831 15.250 -15.076 519 HB2 SER 67 2HB SER 67 -6.518 15.130 -15.389 520 HB3 SER 67 1HB SER 67 -6.124 16.688 -14.690 521 H GLU 68 H GLU 68 -5.797 14.177 -11.004 522 HA GLU 68 HA GLU 68 -8.485 15.126 -10.572 523 HB2 GLU 68 2HB GLU 68 -6.957 14.194 -8.173 524 HB3 GLU 68 1HB GLU 68 -8.573 13.847 -8.704 525 HG2 GLU 68 2HG GLU 68 -5.969 12.473 -9.575 526 HG3 GLU 68 1HG GLU 68 -7.328 11.780 -8.727 527 H ARG 69 H ARG 69 -9.349 16.455 -8.801 528 HA ARG 69 HA ARG 69 -7.471 18.232 -7.305 529 HE ARG 69 HE ARG 69 -6.684 21.329 -10.526 530 HB2 ARG 69 2HB ARG 69 -8.192 19.281 -9.758 531 HB3 ARG 69 1HB ARG 69 -9.592 19.797 -8.869 532 HG2 ARG 69 2HG ARG 69 -8.135 21.666 -8.571 533 HG3 ARG 69 1HG ARG 69 -7.850 20.794 -7.095 534 HD2 ARG 69 2HD ARG 69 -5.649 21.378 -7.898 535 HD3 ARG 69 1HD ARG 69 -5.820 19.640 -8.189 536 HH11 ARG 69 2HH1 ARG 69 -3.973 19.676 -9.114 537 HH12 ARG 69 1HH1 ARG 69 -3.123 19.544 -10.709 538 HH21 ARG 69 1HH2 ARG 69 -5.717 21.118 -12.340 539 HH22 ARG 69 2HH2 ARG 69 -4.085 20.321 -12.452 540 H SER 70 H SER 70 -8.136 18.632 -5.329 541 HA SER 70 HA SER 70 -9.428 19.359 -3.535 542 HG SER 70 HG SER 70 -11.726 20.101 -2.722 543 HB2 SER 70 2HB SER 70 -10.816 20.674 -5.377 544 HB3 SER 70 1HB SER 70 -12.063 19.501 -5.010 545 H PHE 71 H PHE 71 -9.127 17.581 -2.324 546 HA PHE 71 HA PHE 71 -10.889 15.130 -2.726 547 HD1 PHE 71 HD1 PHE 71 -10.056 13.944 -4.355 548 HD2 PHE 71 HD2 PHE 71 -6.187 14.575 -2.560 549 HE1 PHE 71 HE1 PHE 71 -8.960 12.835 -6.265 550 HE2 PHE 71 HE2 PHE 71 -5.140 13.430 -4.468 551 HZ PHE 71 HZ PHE 71 -6.516 12.574 -6.315 552 HB2 PHE 71 2HB PHE 71 -8.112 15.592 -1.489 553 HB3 PHE 71 1HB PHE 71 -8.982 14.102 -1.354 554 H SER 72 H SER 72 -9.455 15.499 0.486 555 HA SER 72 HA SER 72 -11.972 16.521 1.630 556 HG SER 72 HG SER 72 -13.383 15.055 0.747 557 HB2 SER 72 2HB SER 72 -11.723 13.554 1.508 558 HB3 SER 72 1HB SER 72 -12.066 14.124 3.117 559 H VAL 73 H VAL 73 -8.991 14.920 2.892 560 HA VAL 73 HA VAL 73 -9.094 16.845 5.248 561 HB VAL 73 HB VAL 73 -8.426 14.532 5.704 562 HG11 VAL 73 1HG1 VAL 73 -6.094 13.687 5.137 563 HG12 VAL 73 2HG1 VAL 73 -5.895 15.042 4.007 564 HG13 VAL 73 3HG1 VAL 73 -7.157 13.811 3.732 565 HG21 VAL 73 3HG2 VAL 73 -7.600 16.443 7.177 566 HG22 VAL 73 1HG2 VAL 73 -6.052 16.399 6.311 567 HG23 VAL 73 2HG2 VAL 73 -6.595 14.980 7.224 568 H ASP 74 H ASP 74 -7.321 18.332 5.654 569 HA ASP 74 HA ASP 74 -6.401 19.850 3.323 570 HB2 ASP 74 2HB ASP 74 -6.688 20.489 6.038 571 HB3 ASP 74 1HB ASP 74 -4.939 20.306 5.944 572 H THR 75 H THR 75 -4.512 17.563 5.458 573 HA THR 75 HA THR 75 -2.241 17.486 3.522 574 HB THR 75 HB THR 75 -1.987 17.034 5.980 575 HG1 THR 75 HG1 THR 75 -0.330 15.511 5.487 576 HG21 THR 75 3HG2 THR 75 -2.691 14.078 5.329 577 HG22 THR 75 1HG2 THR 75 -3.750 15.132 6.283 578 HG23 THR 75 2HG2 THR 75 -2.118 14.729 6.855 579 H ALA 76 H ALA 76 -4.260 17.156 1.857 580 HA ALA 76 HA ALA 76 -3.735 14.359 0.763 581 HB1 ALA 76 3HB ALA 76 -5.873 14.126 1.829 582 HB2 ALA 76 1HB ALA 76 -6.102 14.042 0.075 583 HB3 ALA 76 2HB ALA 76 -6.567 15.525 0.974 584 H HIS 77 H HIS 77 -3.320 14.205 -1.206 585 HA HIS 77 HA HIS 77 -3.109 16.652 -3.041 586 HD1 HIS 77 HD1 HIS 77 -0.432 15.780 0.730 587 HD2 HIS 77 HD2 HIS 77 -1.539 19.001 -1.853 588 HE1 HIS 77 HE1 HIS 77 -0.156 18.017 1.951 589 HB2 HIS 77 2HB HIS 77 -0.797 15.091 -1.706 590 HB3 HIS 77 1HB HIS 77 -0.603 16.402 -2.884 591 H ARG 78 H ARG 78 -1.827 16.012 -5.080 592 HA ARG 78 HA ARG 78 -2.601 13.161 -5.968 593 HE ARG 78 HE ARG 78 -3.073 13.878 -11.575 594 HB2 ARG 78 2HB ARG 78 -4.150 15.104 -6.749 595 HB3 ARG 78 1HB ARG 78 -2.851 15.658 -7.772 596 HG2 ARG 78 2HG ARG 78 -4.196 12.882 -7.860 597 HG3 ARG 78 1HG ARG 78 -4.684 14.223 -8.863 598 HD2 ARG 78 2HD ARG 78 -1.900 12.916 -9.067 599 HD3 ARG 78 1HD ARG 78 -3.289 12.325 -9.891 600 HH11 ARG 78 2HH1 ARG 78 -1.056 15.069 -9.026 601 HH12 ARG 78 1HH1 ARG 78 0.081 15.824 -10.202 602 HH21 ARG 78 1HH2 ARG 78 -1.841 14.679 -12.801 603 HH22 ARG 78 2HH2 ARG 78 -0.410 15.683 -12.243 604 H ALA 79 H ALA 79 -0.931 12.034 -6.856 605 HA ALA 79 HA ALA 79 1.573 13.459 -7.948 606 HB1 ALA 79 3HB ALA 79 2.022 11.760 -6.205 607 HB2 ALA 79 1HB ALA 79 2.543 11.088 -7.764 608 HB3 ALA 79 2HB ALA 79 1.023 10.534 -7.050 609 H ALA 80 H ALA 80 2.017 13.301 -10.231 610 HA ALA 80 HA ALA 80 0.202 11.544 -11.953 611 HB1 ALA 80 3HB ALA 80 1.129 12.663 -13.908 612 HB2 ALA 80 1HB ALA 80 2.380 13.448 -12.941 613 HB3 ALA 80 2HB ALA 80 0.700 13.903 -12.707 614 H SER 81 H SER 81 3.591 11.440 -10.931 615 HA SER 81 HA SER 81 3.768 8.643 -12.144 616 HG SER 81 HG SER 81 7.217 9.250 -12.771 617 HB2 SER 81 2HB SER 81 4.942 10.275 -13.673 618 HB3 SER 81 1HB SER 81 5.946 10.848 -12.331 619 H VAL 82 H VAL 82 6.103 7.805 -11.205 620 HA VAL 82 HA VAL 82 5.806 7.661 -8.188 621 HB VAL 82 HB VAL 82 7.898 6.192 -9.888 622 HG11 VAL 82 1HG1 VAL 82 8.133 4.857 -7.624 623 HG12 VAL 82 2HG1 VAL 82 7.407 6.271 -6.851 624 HG13 VAL 82 3HG1 VAL 82 8.933 6.413 -7.730 625 HG21 VAL 82 3HG2 VAL 82 5.164 5.306 -8.788 626 HG22 VAL 82 1HG2 VAL 82 6.453 4.119 -9.000 627 HG23 VAL 82 2HG2 VAL 82 5.888 5.040 -10.399 628 H GLU 83 H GLU 83 8.753 8.595 -10.199 629 HA GLU 83 HA GLU 83 9.855 10.395 -8.538 630 HB2 GLU 83 2HB GLU 83 9.396 11.186 -11.450 631 HB3 GLU 83 1HB GLU 83 10.688 11.668 -10.397 632 HG2 GLU 83 2HG GLU 83 10.603 8.656 -10.819 633 HG3 GLU 83 1HG GLU 83 10.826 9.579 -12.283 634 H GLU 84 H GLU 84 6.670 11.339 -9.952 635 HA GLU 84 HA GLU 84 6.689 14.001 -8.497 636 HB2 GLU 84 2HB GLU 84 4.312 12.486 -9.719 637 HB3 GLU 84 1HB GLU 84 4.200 14.068 -8.971 638 HG2 GLU 84 2HG GLU 84 5.955 14.753 -10.972 639 HG3 GLU 84 1HG GLU 84 5.227 13.355 -11.728 640 H ALA 85 H ALA 85 5.829 10.746 -7.671 641 HA ALA 85 HA ALA 85 4.247 11.511 -5.207 642 HB1 ALA 85 3HB ALA 85 3.991 9.108 -4.816 643 HB2 ALA 85 1HB ALA 85 5.222 8.695 -6.008 644 HB3 ALA 85 2HB ALA 85 3.660 9.365 -6.542 645 H VAL 86 H VAL 86 7.563 10.504 -5.995 646 HA VAL 86 HA VAL 86 8.436 10.476 -3.097 647 HB VAL 86 HB VAL 86 9.911 10.056 -5.739 648 HG11 VAL 86 1HG1 VAL 86 11.275 10.336 -2.984 649 HG12 VAL 86 2HG1 VAL 86 11.534 11.377 -4.410 650 HG13 VAL 86 3HG1 VAL 86 12.038 9.684 -4.463 651 HG21 VAL 86 3HG2 VAL 86 8.719 8.038 -4.685 652 HG22 VAL 86 1HG2 VAL 86 9.637 8.308 -3.188 653 HG23 VAL 86 2HG2 VAL 86 10.478 7.823 -4.672 654 H ASP 87 H ASP 87 9.044 12.827 -5.847 655 HA ASP 87 HA ASP 87 10.053 14.912 -4.193 656 HB2 ASP 87 2HB ASP 87 8.717 14.828 -6.929 657 HB3 ASP 87 1HB ASP 87 8.685 16.377 -6.142 658 H ILE 88 H ILE 88 6.496 14.308 -4.653 659 HA ILE 88 HA ILE 88 5.994 16.635 -2.840 660 HB ILE 88 HB ILE 88 3.881 16.627 -2.760 661 HG12 ILE 88 2HG1 ILE 88 3.188 13.980 -4.126 662 HG13 ILE 88 1HG1 ILE 88 3.496 14.022 -2.417 663 HG21 ILE 88 1HG2 ILE 88 4.759 17.237 -5.091 664 HG22 ILE 88 2HG2 ILE 88 3.017 16.856 -5.031 665 HG23 ILE 88 3HG2 ILE 88 4.181 15.663 -5.658 666 HD11 ILE 88 3HD1 ILE 88 1.777 16.198 -2.471 667 HD12 ILE 88 1HD1 ILE 88 1.281 14.556 -2.185 668 HD13 ILE 88 2HD1 ILE 88 1.129 15.237 -3.823 669 H ALA 89 H ALA 89 6.309 13.192 -2.150 670 HA ALA 89 HA ALA 89 5.490 13.427 0.717 671 HB1 ALA 89 3HB ALA 89 7.257 11.360 -0.739 672 HB2 ALA 89 1HB ALA 89 5.534 11.198 -0.325 673 HB3 ALA 89 2HB ALA 89 6.749 11.252 0.962 674 H ALA 90 H ALA 90 8.769 13.495 -0.789 675 HA ALA 90 HA ALA 90 10.135 14.337 1.711 676 HB1 ALA 90 3HB ALA 90 10.933 14.395 -1.265 677 HB2 ALA 90 1HB ALA 90 11.347 13.155 -0.049 678 HB3 ALA 90 2HB ALA 90 12.050 14.786 0.058 679 H SER 91 H SER 91 8.452 16.292 -0.717 680 HA SER 91 HA SER 91 9.567 18.901 0.314 681 HG SER 91 HG SER 91 7.483 20.540 -0.368 682 HB2 SER 91 2HB SER 91 8.681 18.602 -2.079 683 HB3 SER 91 1HB SER 91 7.055 18.430 -1.404 684 H LEU 92 H LEU 92 7.129 16.861 1.654 685 HA LEU 92 HA LEU 92 5.739 19.248 2.926 686 HG LEU 92 HG LEU 92 5.145 15.853 1.660 687 HB2 LEU 92 2HB LEU 92 3.952 17.751 3.768 688 HB3 LEU 92 1HB LEU 92 4.045 18.211 2.097 689 HD11 LEU 92 1HD1 LEU 92 5.492 15.112 3.978 690 HD12 LEU 92 2HD1 LEU 92 4.340 14.076 3.167 691 HD13 LEU 92 3HD1 LEU 92 3.753 15.280 4.350 692 HD21 LEU 92 3HD2 LEU 92 2.144 16.104 2.355 693 HD22 LEU 92 1HD2 LEU 92 2.898 14.858 1.328 694 HD23 LEU 92 2HD2 LEU 92 2.880 16.539 0.796 695 H ASP 93 H ASP 93 6.717 16.148 4.441 696 HA ASP 93 HA ASP 93 8.971 17.349 5.748 697 HB2 ASP 93 2HB ASP 93 6.520 17.913 7.294 698 HB3 ASP 93 1HB ASP 93 7.448 16.799 8.227 699 H ALA 94 H ALA 94 9.644 15.269 4.657 700 HA ALA 94 HA ALA 94 9.610 12.904 6.501 701 HB1 ALA 94 3HB ALA 94 7.315 12.777 5.499 702 HB2 ALA 94 1HB ALA 94 8.282 11.404 4.944 703 HB3 ALA 94 2HB ALA 94 8.003 12.786 3.855 704 H GLU 95 H GLU 95 10.597 10.963 5.723 705 HA GLU 95 HA GLU 95 12.718 11.361 3.562 706 HB2 GLU 95 2HB GLU 95 13.502 9.447 5.730 707 HB3 GLU 95 1HB GLU 95 14.467 10.445 4.664 708 HG2 GLU 95 2HG GLU 95 13.869 12.479 6.171 709 HG3 GLU 95 1HG GLU 95 13.027 11.352 7.229 710 H THR 96 H THR 96 11.548 8.451 5.368 711 HA THR 96 HA THR 96 11.062 6.858 2.891 712 HB THR 96 HB THR 96 9.694 5.382 4.662 713 HG1 THR 96 HG1 THR 96 9.581 6.844 6.346 714 HG21 THR 96 3HG2 THR 96 12.709 5.591 5.104 715 HG22 THR 96 1HG2 THR 96 11.942 4.723 3.748 716 HG23 THR 96 2HG2 THR 96 11.629 4.226 5.431 717 H ALA 97 H ALA 97 8.984 5.950 2.386 718 HA ALA 97 HA ALA 97 6.528 7.099 3.573 719 HB1 ALA 97 3HB ALA 97 6.882 8.814 1.859 720 HB2 ALA 97 1HB ALA 97 5.485 7.856 1.331 721 HB3 ALA 97 2HB ALA 97 7.075 7.626 0.554 722 H TYR 98 H TYR 98 4.495 6.065 2.489 723 HA TYR 98 HA TYR 98 5.035 3.151 1.792 724 HD1 TYR 98 HD1 TYR 98 5.141 0.861 3.871 725 HD2 TYR 98 HD2 TYR 98 4.885 4.790 5.529 726 HE1 TYR 98 HE1 TYR 98 6.996 0.330 5.414 727 HE2 TYR 98 HE2 TYR 98 6.736 4.259 7.065 728 HH TYR 98 HH TYR 98 8.396 2.882 7.419 729 HB2 TYR 98 2HB TYR 98 3.154 4.054 4.051 730 HB3 TYR 98 1HB TYR 98 3.161 2.429 3.408 731 H VAL 99 H VAL 99 2.881 1.974 1.256 732 HA VAL 99 HA VAL 99 0.976 3.705 -0.414 733 HB VAL 99 HB VAL 99 1.747 3.216 -2.399 734 HG11 VAL 99 1HG1 VAL 99 4.024 3.234 -1.642 735 HG12 VAL 99 2HG1 VAL 99 3.833 2.129 -3.011 736 HG13 VAL 99 3HG1 VAL 99 4.021 1.522 -1.351 737 HG21 VAL 99 3HG2 VAL 99 0.296 1.351 -2.706 738 HG22 VAL 99 1HG2 VAL 99 1.506 0.241 -2.041 739 HG23 VAL 99 2HG2 VAL 99 1.808 1.064 -3.585 740 H ILE 100 H ILE 100 -1.094 3.065 0.597 741 HA ILE 100 HA ILE 100 -1.587 0.299 1.206 742 HB ILE 100 HB ILE 100 -3.973 2.010 0.386 743 HG12 ILE 100 2HG1 ILE 100 -3.063 3.361 2.074 744 HG13 ILE 100 1HG1 ILE 100 -4.248 2.378 2.883 745 HG21 ILE 100 1HG2 ILE 100 -3.828 -0.336 2.357 746 HG22 ILE 100 2HG2 ILE 100 -4.440 -0.503 0.696 747 HG23 ILE 100 3HG2 ILE 100 -5.278 0.535 1.844 748 HD11 ILE 100 3HD1 ILE 100 -2.069 2.713 4.194 749 HD12 ILE 100 1HD1 ILE 100 -1.252 1.668 3.029 750 HD13 ILE 100 2HD1 ILE 100 -2.591 0.998 3.987 751 H GLY 101 H GLY 101 -2.591 1.703 -1.701 752 HA2 GLY 101 2HA GLY 101 -2.435 0.840 -3.910 753 HA3 GLY 101 1HA GLY 101 -1.538 -0.494 -3.336 754 H GLY 102 H GLY 102 -2.703 -2.261 -4.777 755 HA2 GLY 102 2HA GLY 102 -4.850 -0.232 -5.746 756 HA3 GLY 102 1HA GLY 102 -3.209 -0.166 -6.278 757 H ALA 103 H ALA 103 -6.204 -1.616 -6.990 758 HA ALA 103 HA ALA 103 -5.967 -2.951 -9.367 759 HB1 ALA 103 3HB ALA 103 -7.791 -1.357 -10.183 760 HB2 ALA 103 1HB ALA 103 -7.226 -0.075 -9.126 761 HB3 ALA 103 2HB ALA 103 -7.962 -1.507 -8.449 762 H ALA 104 H ALA 104 -4.749 0.347 -9.289 763 HA ALA 104 HA ALA 104 -2.962 -0.299 -11.704 764 HB1 ALA 104 3HB ALA 104 -4.416 1.610 -12.274 765 HB2 ALA 104 1HB ALA 104 -2.705 2.109 -12.156 766 HB3 ALA 104 2HB ALA 104 -3.834 2.511 -10.839 767 H ILE 105 H ILE 105 -2.952 0.682 -8.286 768 HA ILE 105 HA ILE 105 -0.384 2.083 -8.433 769 HB ILE 105 HB ILE 105 -1.446 1.113 -5.789 770 HG12 ILE 105 2HG1 ILE 105 -3.458 2.129 -6.619 771 HG13 ILE 105 1HG1 ILE 105 -2.710 3.194 -5.510 772 HG21 ILE 105 1HG2 ILE 105 0.787 2.172 -5.698 773 HG22 ILE 105 2HG2 ILE 105 -0.436 3.085 -4.826 774 HG23 ILE 105 3HG2 ILE 105 0.121 3.657 -6.401 775 HD11 ILE 105 3HD1 ILE 105 -2.732 4.855 -7.189 776 HD12 ILE 105 1HD1 ILE 105 -3.567 3.658 -8.227 777 HD13 ILE 105 2HD1 ILE 105 -1.801 3.844 -8.319 778 H TYR 106 H TYR 106 -0.796 -0.821 -6.321 779 HA TYR 106 HA TYR 106 1.930 -1.617 -6.183 780 HD1 TYR 106 HD1 TYR 106 2.625 -4.472 -5.296 781 HD2 TYR 106 HD2 TYR 106 -0.652 -2.475 -3.359 782 HE1 TYR 106 HE1 TYR 106 3.461 -5.182 -3.122 783 HE2 TYR 106 HE2 TYR 106 0.207 -3.203 -1.167 784 HH TYR 106 HH TYR 106 2.600 -4.068 -0.231 785 HB2 TYR 106 2HB TYR 106 -0.741 -2.952 -5.753 786 HB3 TYR 106 1HB TYR 106 0.393 -4.061 -6.409 787 H ALA 107 H ALA 107 -0.203 -2.529 -8.902 788 HA ALA 107 HA ALA 107 1.737 -4.099 -10.460 789 HB1 ALA 107 3HB ALA 107 0.014 -3.670 -12.282 790 HB2 ALA 107 1HB ALA 107 -0.756 -2.463 -11.240 791 HB3 ALA 107 2HB ALA 107 -0.748 -4.161 -10.764 792 H LEU 108 H LEU 108 0.915 -0.585 -10.797 793 HA LEU 108 HA LEU 108 3.230 -0.118 -12.618 794 HG LEU 108 HG LEU 108 2.029 2.255 -9.970 795 HB2 LEU 108 2HB LEU 108 2.509 1.961 -12.956 796 HB3 LEU 108 1HB LEU 108 1.010 1.333 -12.369 797 HD11 LEU 108 1HD1 LEU 108 4.163 3.108 -11.257 798 HD12 LEU 108 2HD1 LEU 108 3.340 4.279 -10.229 799 HD13 LEU 108 3HD1 LEU 108 3.118 4.335 -11.988 800 HD21 LEU 108 3HD2 LEU 108 0.567 3.988 -12.043 801 HD22 LEU 108 1HD2 LEU 108 0.772 4.389 -10.331 802 HD23 LEU 108 2HD2 LEU 108 -0.183 2.967 -10.759 803 H PHE 109 H PHE 109 2.895 0.215 -9.093 804 HA PHE 109 HA PHE 109 5.568 1.300 -8.732 805 HD1 PHE 109 HD2 PHE 109 6.630 2.027 -6.149 806 HD2 PHE 109 HD1 PHE 109 2.512 2.652 -7.102 807 HE1 PHE 109 HE2 PHE 109 6.874 4.386 -5.562 808 HE2 PHE 109 HE1 PHE 109 2.745 5.034 -6.513 809 HZ PHE 109 HZ PHE 109 4.952 5.913 -5.752 810 HB2 PHE 109 2HB PHE 109 3.357 0.337 -6.881 811 HB3 PHE 109 1HB PHE 109 4.925 0.088 -6.224 812 H GLN 110 H GLN 110 4.761 -2.127 -8.840 813 HA GLN 110 HA GLN 110 6.627 -3.474 -7.497 814 HB2 GLN 110 2HB GLN 110 6.129 -4.036 -10.489 815 HB3 GLN 110 1HB GLN 110 6.982 -5.092 -9.413 816 HG2 GLN 110 2HG GLN 110 4.680 -4.932 -7.960 817 HG3 GLN 110 1HG GLN 110 4.030 -4.429 -9.508 818 HE21 GLN 110 1HE2 GLN 110 4.854 -6.068 -11.374 819 HE22 GLN 110 2HE2 GLN 110 4.357 -7.768 -10.867 820 HA PRO 111 HA PRO 111 10.864 -2.884 -9.729 821 HB2 PRO 111 2HB PRO 111 10.806 -0.672 -11.686 822 HB3 PRO 111 1HB PRO 111 11.110 -2.396 -11.959 823 HG2 PRO 111 2HG PRO 111 8.800 -1.047 -12.892 824 HG3 PRO 111 1HG PRO 111 8.900 -2.816 -12.619 825 HD2 PRO 111 2HD PRO 111 7.781 -0.694 -10.725 826 HD3 PRO 111 1HD PRO 111 7.067 -2.233 -11.199 827 H HIS 112 H HIS 112 8.974 -0.302 -8.573 828 HA HIS 112 HA HIS 112 11.332 1.614 -8.108 829 HD1 HIS 112 HD1 HIS 112 11.162 3.245 -10.560 830 HD2 HIS 112 HD2 HIS 112 7.086 2.031 -10.279 831 HE1 HIS 112 HE1 HIS 112 10.042 3.279 -12.911 832 HB2 HIS 112 2HB HIS 112 8.345 2.329 -7.978 833 HB3 HIS 112 1HB HIS 112 9.726 3.406 -8.066 834 H LEU 113 H LEU 113 9.461 -0.527 -6.214 835 HA LEU 113 HA LEU 113 9.565 1.132 -3.706 836 HG LEU 113 HG LEU 113 6.940 -1.267 -2.645 837 HB2 LEU 113 2HB LEU 113 9.112 -1.919 -3.993 838 HB3 LEU 113 1HB LEU 113 9.066 -1.026 -2.487 839 HD11 LEU 113 1HD1 LEU 113 5.713 0.802 -3.632 840 HD12 LEU 113 2HD1 LEU 113 7.310 1.317 -4.229 841 HD13 LEU 113 3HD1 LEU 113 7.026 1.137 -2.502 842 HD21 LEU 113 3HD2 LEU 113 5.551 -1.674 -4.553 843 HD22 LEU 113 1HD2 LEU 113 7.047 -2.569 -4.798 844 HD23 LEU 113 2HD2 LEU 113 6.809 -1.056 -5.687 845 H ASP 114 H ASP 114 10.900 0.990 -2.038 846 HA ASP 114 HA ASP 114 13.329 -0.721 -1.702 847 HB2 ASP 114 2HB ASP 114 13.081 1.348 -0.471 848 HB3 ASP 114 1HB ASP 114 11.485 0.972 0.098 849 H ARG 115 H ARG 115 10.121 -1.080 -0.080 850 HA ARG 115 HA ARG 115 10.325 -4.119 -0.468 851 HE ARG 115 HE ARG 115 12.209 -1.832 2.892 852 HB2 ARG 115 2HB ARG 115 9.945 -2.446 2.078 853 HB3 ARG 115 1HB ARG 115 9.242 -4.062 2.029 854 HG2 ARG 115 2HG ARG 115 11.337 -5.132 1.711 855 HG3 ARG 115 1HG ARG 115 12.183 -3.636 1.320 856 HD2 ARG 115 2HD ARG 115 11.001 -4.333 4.088 857 HD3 ARG 115 1HD ARG 115 12.688 -4.567 3.609 858 HH11 ARG 115 2HH1 ARG 115 12.039 -3.561 5.896 859 HH12 ARG 115 1HH1 ARG 115 12.053 -1.988 6.834 860 HH21 ARG 115 1HH2 ARG 115 12.213 -0.244 3.843 861 HH22 ARG 115 2HH2 ARG 115 12.134 -0.054 5.668 862 H MET 116 H MET 116 8.575 -5.391 -0.485 863 HA MET 116 HA MET 116 5.778 -4.110 -0.753 864 HB2 MET 116 2HB MET 116 6.970 -6.654 -1.983 865 HB3 MET 116 1HB MET 116 5.256 -6.288 -1.973 866 HG2 MET 116 2HG MET 116 5.488 -4.427 -3.482 867 HG3 MET 116 1HG MET 116 7.221 -4.261 -3.171 868 HE1 MET 116 3HE MET 116 4.553 -7.004 -4.425 869 HE2 MET 116 1HE MET 116 5.242 -7.265 -6.056 870 HE3 MET 116 2HE MET 116 4.644 -5.647 -5.595 871 H VAL 117 H VAL 117 5.478 -3.916 1.402 872 HA VAL 117 HA VAL 117 5.038 -6.120 3.333 873 HB VAL 117 HB VAL 117 4.085 -3.233 3.221 874 HG11 VAL 117 1HG1 VAL 117 2.423 -4.463 4.649 875 HG12 VAL 117 2HG1 VAL 117 3.415 -3.390 5.638 876 HG13 VAL 117 3HG1 VAL 117 3.739 -5.147 5.631 877 HG21 VAL 117 3HG2 VAL 117 5.761 -2.820 5.023 878 HG22 VAL 117 1HG2 VAL 117 6.571 -3.622 3.650 879 HG23 VAL 117 2HG2 VAL 117 6.158 -4.554 5.095 880 H LEU 118 H LEU 118 3.540 -7.583 3.332 881 HA LEU 118 HA LEU 118 0.781 -7.088 2.084 882 HG LEU 118 HG LEU 118 -0.023 -9.538 1.036 883 HB2 LEU 118 2HB LEU 118 2.038 -7.877 0.290 884 HB3 LEU 118 1HB LEU 118 2.991 -9.000 1.185 885 HD11 LEU 118 1HD1 LEU 118 0.476 -8.995 -1.256 886 HD12 LEU 118 2HD1 LEU 118 0.288 -10.736 -1.124 887 HD13 LEU 118 3HD1 LEU 118 1.927 -10.036 -1.327 888 HD21 LEU 118 3HD2 LEU 118 1.353 -11.101 2.376 889 HD22 LEU 118 1HD2 LEU 118 2.525 -11.314 1.043 890 HD23 LEU 118 2HD2 LEU 118 0.893 -11.927 0.861 891 H SER 119 H SER 119 -0.881 -8.180 2.915 892 HA SER 119 HA SER 119 -0.442 -9.774 5.543 893 HG SER 119 HG SER 119 -1.165 -6.429 6.144 894 HB2 SER 119 2HB SER 119 -2.312 -7.466 4.757 895 HB3 SER 119 1HB SER 119 -2.651 -8.462 6.154 896 H ARG 120 H ARG 120 -0.709 -11.854 4.750 897 HA ARG 120 HA ARG 120 -2.780 -12.503 2.710 898 HE ARG 120 HE ARG 120 0.868 -15.528 0.267 899 HB2 ARG 120 2HB ARG 120 -1.247 -14.604 4.313 900 HB3 ARG 120 1HB ARG 120 -2.082 -14.796 2.768 901 HG2 ARG 120 2HG ARG 120 -0.379 -13.347 1.645 902 HG3 ARG 120 1HG ARG 120 0.441 -13.075 3.184 903 HD2 ARG 120 2HD ARG 120 1.827 -14.639 2.268 904 HD3 ARG 120 1HD ARG 120 0.896 -15.660 3.302 905 HH11 ARG 120 2HH1 ARG 120 -0.819 -16.831 2.986 906 HH12 ARG 120 1HH1 ARG 120 -1.659 -18.094 1.973 907 HH21 ARG 120 1HH2 ARG 120 -0.040 -16.953 -0.849 908 HH22 ARG 120 2HH2 ARG 120 -1.211 -18.151 -0.140 909 H VAL 121 H VAL 121 -4.884 -12.673 3.248 910 HA VAL 121 HA VAL 121 -5.701 -13.234 6.099 911 HB VAL 121 HB VAL 121 -7.346 -11.968 3.877 912 HG11 VAL 121 1HG1 VAL 121 -8.734 -12.721 5.846 913 HG12 VAL 121 2HG1 VAL 121 -8.659 -10.956 5.799 914 HG13 VAL 121 3HG1 VAL 121 -7.651 -11.822 6.945 915 HG21 VAL 121 3HG2 VAL 121 -6.156 -10.061 4.039 916 HG22 VAL 121 1HG2 VAL 121 -5.080 -10.700 5.277 917 HG23 VAL 121 2HG2 VAL 121 -6.570 -9.863 5.729 918 HA PRO 122 HA PRO 122 -7.518 -17.230 4.434 919 HB2 PRO 122 2HB PRO 122 -7.950 -17.777 7.398 920 HB3 PRO 122 1HB PRO 122 -7.207 -18.794 6.143 921 HG2 PRO 122 2HG PRO 122 -5.618 -17.543 7.985 922 HG3 PRO 122 1HG PRO 122 -5.112 -17.587 6.271 923 HD2 PRO 122 2HD PRO 122 -6.486 -15.261 7.713 924 HD3 PRO 122 1HD PRO 122 -5.038 -15.287 6.654 925 H GLY 123 H GLY 123 -9.285 -14.990 4.477 926 HA2 GLY 123 2HA GLY 123 -12.000 -16.180 5.361 927 HA3 GLY 123 1HA GLY 123 -11.826 -14.548 4.821 928 H GLU 124 H GLU 124 -10.178 -15.700 2.575 929 HA GLU 124 HA GLU 124 -10.348 -16.198 0.317 930 HB2 GLU 124 2HB GLU 124 -11.996 -18.547 1.201 931 HB3 GLU 124 1HB GLU 124 -10.898 -18.440 -0.132 932 HG2 GLU 124 2HG GLU 124 -9.353 -17.817 2.317 933 HG3 GLU 124 1HG GLU 124 -10.339 -19.213 2.642 934 H TYR 125 H TYR 125 -11.174 -14.962 -1.259 935 HA TYR 125 HA TYR 125 -14.209 -14.680 -1.584 936 HD1 TYR 125 HD1 TYR 125 -15.686 -13.122 0.394 937 HD2 TYR 125 HD2 TYR 125 -11.530 -12.336 1.088 938 HE1 TYR 125 HE1 TYR 125 -16.119 -12.959 2.820 939 HE2 TYR 125 HE2 TYR 125 -11.961 -12.206 3.508 940 HH TYR 125 HH TYR 125 -13.451 -12.511 5.097 941 HB2 TYR 125 2HB TYR 125 -12.309 -12.283 -1.144 942 HB3 TYR 125 1HB TYR 125 -14.009 -12.153 -1.467 943 H GLU 126 H GLU 126 -14.528 -14.958 -3.835 944 HA GLU 126 HA GLU 126 -13.099 -14.545 -5.973 945 HB2 GLU 126 2HB GLU 126 -15.812 -13.248 -6.421 946 HB3 GLU 126 1HB GLU 126 -14.894 -14.328 -7.427 947 HG2 GLU 126 2HG GLU 126 -16.365 -15.340 -4.898 948 HG3 GLU 126 1HG GLU 126 -17.122 -15.127 -6.469 949 H GLY 127 H GLY 127 -14.554 -11.681 -4.674 950 HA2 GLY 127 2HA GLY 127 -13.779 -9.349 -4.643 951 HA3 GLY 127 1HA GLY 127 -12.321 -9.952 -5.343 952 H ASP 128 H ASP 128 -13.442 -7.416 -5.711 953 HA ASP 128 HA ASP 128 -13.597 -7.360 -8.778 954 HB2 ASP 128 2HB ASP 128 -14.421 -5.197 -6.721 955 HB3 ASP 128 1HB ASP 128 -14.364 -4.963 -8.457 956 H THR 129 H THR 129 -11.579 -6.345 -6.083 957 HA THR 129 HA THR 129 -9.713 -4.810 -7.973 958 HB THR 129 HB THR 129 -9.571 -4.818 -4.924 959 HG1 THR 129 HG1 THR 129 -11.514 -3.943 -5.360 960 HG21 THR 129 3HG2 THR 129 -8.739 -2.516 -6.761 961 HG22 THR 129 1HG2 THR 129 -7.605 -3.864 -6.521 962 HG23 THR 129 2HG2 THR 129 -8.155 -2.898 -5.125 963 H TYR 130 H TYR 130 -8.038 -5.996 -8.644 964 HA TYR 130 HA TYR 130 -7.035 -8.405 -7.082 965 HD1 TYR 130 HD1 TYR 130 -9.715 -7.659 -9.731 966 HD2 TYR 130 HD2 TYR 130 -7.343 -11.103 -8.729 967 HE1 TYR 130 HE1 TYR 130 -11.718 -9.094 -9.852 968 HE2 TYR 130 HE2 TYR 130 -9.360 -12.520 -8.917 969 HH TYR 130 HH TYR 130 -12.089 -11.812 -8.561 970 HB2 TYR 130 2HB TYR 130 -7.087 -7.697 -10.065 971 HB3 TYR 130 1HB TYR 130 -6.210 -9.061 -9.434 972 H TYR 131 H TYR 131 -5.080 -8.735 -6.432 973 HA TYR 131 HA TYR 131 -2.985 -6.615 -6.555 974 HD1 TYR 131 HD2 TYR 131 -0.680 -9.784 -5.535 975 HD2 TYR 131 HD1 TYR 131 -2.084 -6.444 -3.269 976 HE1 TYR 131 HE2 TYR 131 1.582 -9.445 -4.663 977 HE2 TYR 131 HE1 TYR 131 0.126 -6.245 -2.212 978 HH TYR 131 HH TYR 131 2.268 -6.950 -2.204 979 HB2 TYR 131 2HB TYR 131 -3.657 -7.898 -4.468 980 HB3 TYR 131 1HB TYR 131 -3.135 -9.374 -5.139 981 HA PRO 132 HA PRO 132 -0.557 -8.607 -9.881 982 HB2 PRO 132 2HB PRO 132 2.007 -7.650 -8.616 983 HB3 PRO 132 1HB PRO 132 1.345 -7.277 -10.214 984 HG2 PRO 132 2HG PRO 132 1.314 -5.435 -8.196 985 HG3 PRO 132 1HG PRO 132 -0.069 -5.554 -9.311 986 HD2 PRO 132 2HD PRO 132 0.140 -6.698 -6.490 987 HD3 PRO 132 1HD PRO 132 -1.190 -5.780 -7.265 988 H GLU 133 H GLU 133 1.387 -9.870 -10.437 989 HA GLU 133 HA GLU 133 1.578 -12.395 -9.013 990 HB2 GLU 133 2HB GLU 133 3.366 -12.955 -10.676 991 HB3 GLU 133 1HB GLU 133 1.780 -12.592 -11.295 992 HG2 GLU 133 2HG GLU 133 4.087 -10.526 -11.410 993 HG3 GLU 133 1HG GLU 133 3.769 -11.712 -12.670 994 H TRP 134 H TRP 134 3.669 -13.336 -8.395 995 HA TRP 134 HA TRP 134 5.599 -11.584 -7.016 996 HD1 TRP 134 HD1 TRP 134 4.635 -15.667 -5.581 997 HE1 TRP 134 HE1 TRP 134 2.356 -16.824 -4.886 998 HE3 TRP 134 HE3 TRP 134 2.323 -11.428 -3.950 999 HZ2 TRP 134 HZ2 TRP 134 -0.104 -15.803 -3.858 1000 HZ3 TRP 134 HZ3 TRP 134 -0.015 -11.562 -3.172 1001 HH2 TRP 134 HH2 TRP 134 -1.208 -13.723 -3.099 1002 HB2 TRP 134 2HB TRP 134 5.668 -12.875 -4.839 1003 HB3 TRP 134 1HB TRP 134 4.386 -11.725 -5.034 1004 H ASP 135 H ASP 135 7.588 -12.321 -7.486 1005 HA ASP 135 HA ASP 135 7.966 -15.284 -8.140 1006 HB2 ASP 135 2HB ASP 135 7.804 -13.503 -10.161 1007 HB3 ASP 135 1HB ASP 135 9.419 -13.049 -9.656 1008 H ALA 136 H ALA 136 10.702 -15.007 -8.584 1009 HA ALA 136 HA ALA 136 11.784 -14.623 -5.696 1010 HB1 ALA 136 3HB ALA 136 11.245 -16.978 -6.200 1011 HB2 ALA 136 1HB ALA 136 13.017 -16.845 -6.147 1012 HB3 ALA 136 2HB ALA 136 12.179 -16.951 -7.726 1013 H ALA 137 H ALA 137 12.698 -13.982 -8.957 1014 HA ALA 137 HA ALA 137 15.468 -13.048 -7.977 1015 HB1 ALA 137 3HB ALA 137 16.156 -12.956 -10.387 1016 HB2 ALA 137 1HB ALA 137 14.571 -13.596 -10.879 1017 HB3 ALA 137 2HB ALA 137 15.664 -14.589 -9.883 1018 H GLU 138 H GLU 138 12.418 -11.705 -9.056 1019 HA GLU 138 HA GLU 138 13.474 -8.902 -9.063 1020 HB2 GLU 138 2HB GLU 138 10.752 -10.248 -9.376 1021 HB3 GLU 138 1HB GLU 138 10.777 -8.667 -8.707 1022 HG2 GLU 138 2HG GLU 138 11.373 -7.601 -10.664 1023 HG3 GLU 138 1HG GLU 138 12.503 -8.859 -11.175 1024 H TRP 139 H TRP 139 11.512 -10.657 -6.572 1025 HA TRP 139 HA TRP 139 12.961 -9.054 -4.399 1026 HD1 TRP 139 HD1 TRP 139 8.840 -11.011 -4.590 1027 HE1 TRP 139 HE1 TRP 139 7.160 -10.694 -6.648 1028 HE3 TRP 139 HE3 TRP 139 10.581 -6.506 -6.065 1029 HZ2 TRP 139 HZ2 TRP 139 7.193 -8.903 -8.837 1030 HZ3 TRP 139 HZ3 TRP 139 9.881 -5.609 -8.270 1031 HH2 TRP 139 HH2 TRP 139 8.275 -6.860 -9.669 1032 HB2 TRP 139 2HB TRP 139 10.552 -9.074 -3.182 1033 HB3 TRP 139 1HB TRP 139 11.112 -7.801 -4.200 1034 H GLU 140 H GLU 140 13.451 -9.936 -2.526 1035 HA GLU 140 HA GLU 140 12.754 -12.864 -2.008 1036 HB2 GLU 140 2HB GLU 140 14.769 -13.290 -1.104 1037 HB3 GLU 140 1HB GLU 140 15.230 -12.140 -2.317 1038 HG2 GLU 140 2HG GLU 140 15.387 -10.356 -0.362 1039 HG3 GLU 140 1HG GLU 140 15.071 -11.697 0.743 1040 H LEU 141 H LEU 141 13.172 -12.910 0.808 1041 HA LEU 141 HA LEU 141 10.567 -11.528 1.701 1042 HG LEU 141 HG LEU 141 9.327 -14.734 3.253 1043 HB2 LEU 141 2HB LEU 141 10.889 -14.221 1.424 1044 HB3 LEU 141 1HB LEU 141 11.579 -14.068 3.007 1045 HD11 LEU 141 1HD1 LEU 141 9.017 -11.716 3.787 1046 HD12 LEU 141 2HD1 LEU 141 9.846 -12.841 4.873 1047 HD13 LEU 141 3HD1 LEU 141 8.121 -13.058 4.532 1048 HD21 LEU 141 3HD2 LEU 141 7.349 -13.707 2.151 1049 HD22 LEU 141 1HD2 LEU 141 8.525 -14.226 0.937 1050 HD23 LEU 141 2HD2 LEU 141 8.388 -12.508 1.357 1051 H ASP 142 H ASP 142 11.037 -9.890 3.092 1052 HA ASP 142 HA ASP 142 13.621 -9.607 4.611 1053 HB2 ASP 142 2HB ASP 142 12.357 -7.694 3.391 1054 HB3 ASP 142 1HB ASP 142 11.138 -7.793 4.655 1055 H ALA 143 H ALA 143 10.118 -9.659 5.519 1056 HA ALA 143 HA ALA 143 10.827 -11.186 8.071 1057 HB1 ALA 143 3HB ALA 143 9.155 -8.571 7.993 1058 HB2 ALA 143 1HB ALA 143 10.841 -8.696 8.541 1059 HB3 ALA 143 2HB ALA 143 9.553 -9.527 9.442 1060 H GLU 144 H GLU 144 9.553 -12.861 8.439 1061 HA GLU 144 HA GLU 144 6.622 -12.820 7.568 1062 HB2 GLU 144 2HB GLU 144 8.512 -14.721 6.887 1063 HB3 GLU 144 1HB GLU 144 7.933 -15.436 8.381 1064 HG2 GLU 144 2HG GLU 144 5.481 -14.916 7.257 1065 HG3 GLU 144 1HG GLU 144 6.453 -14.818 5.788 1066 H THR 145 H THR 145 5.154 -12.454 9.133 1067 HA THR 145 HA THR 145 5.355 -14.080 11.639 1068 HB THR 145 HB THR 145 6.537 -11.974 12.266 1069 HG1 THR 145 HG1 THR 145 4.221 -12.789 13.688 1070 HG21 THR 145 3HG2 THR 145 3.931 -10.588 11.646 1071 HG22 THR 145 1HG2 THR 145 5.572 -9.933 11.806 1072 HG23 THR 145 2HG2 THR 145 4.605 -10.228 13.253 1073 H ASP 146 H ASP 146 3.534 -14.592 12.760 1074 HA ASP 146 HA ASP 146 0.940 -14.368 11.443 1075 HB2 ASP 146 2HB ASP 146 0.170 -15.749 13.310 1076 HB3 ASP 146 1HB ASP 146 1.621 -16.384 12.579 1077 H HIS 147 H HIS 147 -0.896 -13.310 11.991 1078 HA HIS 147 HA HIS 147 -0.962 -11.211 14.190 1079 HD1 HIS 147 HD1 HIS 147 1.546 -10.582 13.207 1080 HD2 HIS 147 HD2 HIS 147 -1.041 -7.337 12.301 1081 HE1 HIS 147 HE1 HIS 147 2.809 -8.348 13.478 1082 HB2 HIS 147 2HB HIS 147 -0.900 -10.667 11.175 1083 HB3 HIS 147 1HB HIS 147 -2.095 -9.778 12.069 1084 H GLU 148 H GLU 148 -3.404 -10.157 13.986 1085 HA GLU 148 HA GLU 148 -4.936 -12.287 15.181 1086 HB2 GLU 148 2HB GLU 148 -5.869 -9.497 14.333 1087 HB3 GLU 148 1HB GLU 148 -6.870 -10.579 15.229 1088 HG2 GLU 148 2HG GLU 148 -5.317 -10.568 17.192 1089 HG3 GLU 148 1HG GLU 148 -4.160 -9.575 16.340 1090 H GLY 149 H GLY 149 -5.808 -10.755 12.049 1091 HA2 GLY 149 2HA GLY 149 -7.597 -13.206 11.386 1092 HA3 GLY 149 1HA GLY 149 -7.807 -11.644 10.652 1093 H PHE 150 H PHE 150 -4.455 -12.681 10.864 1094 HA PHE 150 HA PHE 150 -4.255 -13.712 8.090 1095 HD1 PHE 150 HD1 PHE 150 -1.499 -10.564 7.987 1096 HD2 PHE 150 HD2 PHE 150 -5.523 -9.619 9.104 1097 HE1 PHE 150 HE1 PHE 150 -0.717 -8.460 9.023 1098 HE2 PHE 150 HE2 PHE 150 -4.761 -7.474 10.013 1099 HZ PHE 150 HZ PHE 150 -2.369 -6.877 9.983 1100 HB2 PHE 150 2HB PHE 150 -3.506 -11.699 6.914 1101 HB3 PHE 150 1HB PHE 150 -5.088 -11.452 7.548 1102 H THR 151 H THR 151 -2.012 -13.488 7.132 1103 HA THR 151 HA THR 151 0.171 -13.359 9.286 1104 HB THR 151 HB THR 151 0.625 -15.449 8.882 1105 HG1 THR 151 HG1 THR 151 2.338 -14.110 7.777 1106 HG21 THR 151 3HG2 THR 151 0.303 -16.860 6.939 1107 HG22 THR 151 1HG2 THR 151 -0.186 -15.481 5.935 1108 HG23 THR 151 2HG2 THR 151 -1.235 -16.038 7.271 1109 H LEU 152 H LEU 152 1.569 -11.894 9.142 1110 HA LEU 152 HA LEU 152 1.594 -9.795 6.989 1111 HG LEU 152 HG LEU 152 3.355 -7.731 9.781 1112 HB2 LEU 152 2HB LEU 152 1.537 -9.053 9.252 1113 HB3 LEU 152 1HB LEU 152 2.787 -10.140 9.775 1114 HD11 LEU 152 1HD1 LEU 152 5.105 -9.700 9.592 1115 HD12 LEU 152 2HD1 LEU 152 5.670 -8.046 9.242 1116 HD13 LEU 152 3HD1 LEU 152 5.317 -9.175 7.924 1117 HD21 LEU 152 3HD2 LEU 152 3.533 -7.871 6.704 1118 HD22 LEU 152 1HD2 LEU 152 4.042 -6.526 7.739 1119 HD23 LEU 152 2HD2 LEU 152 2.330 -6.963 7.619 1120 H GLN 153 H GLN 153 2.819 -9.968 5.358 1121 HA GLN 153 HA GLN 153 5.581 -11.318 5.368 1122 HB2 GLN 153 2HB GLN 153 3.433 -10.878 3.198 1123 HB3 GLN 153 1HB GLN 153 5.098 -10.722 2.714 1124 HG2 GLN 153 2HG GLN 153 4.473 -12.930 2.164 1125 HG3 GLN 153 1HG GLN 153 5.726 -12.941 3.390 1126 HE21 GLN 153 1HE2 GLN 153 5.208 -15.070 3.776 1127 HE22 GLN 153 2HE2 GLN 153 3.883 -15.430 4.950 1128 H GLU 154 H GLU 154 7.269 -9.915 5.112 1129 HA GLU 154 HA GLU 154 6.799 -7.268 3.615 1130 HB2 GLU 154 2HB GLU 154 9.025 -7.660 5.673 1131 HB3 GLU 154 1HB GLU 154 8.502 -6.188 4.909 1132 HG2 GLU 154 2HG GLU 154 6.180 -6.537 6.099 1133 HG3 GLU 154 1HG GLU 154 6.954 -7.795 7.027 1134 H TRP 155 H TRP 155 7.507 -7.481 1.590 1135 HA TRP 155 HA TRP 155 9.715 -9.459 0.884 1136 HD1 TRP 155 HD1 TRP 155 5.469 -9.627 0.544 1137 HE1 TRP 155 HE1 TRP 155 4.505 -11.959 -0.241 1138 HE3 TRP 155 HE3 TRP 155 9.563 -11.173 -2.032 1139 HZ2 TRP 155 HZ2 TRP 155 5.587 -14.187 -1.557 1140 HZ3 TRP 155 HZ3 TRP 155 9.464 -13.358 -3.212 1141 HH2 TRP 155 HH2 TRP 155 7.509 -14.818 -2.990 1142 HB2 TRP 155 2HB TRP 155 7.396 -8.153 -0.634 1143 HB3 TRP 155 1HB TRP 155 8.642 -8.973 -1.509 1144 H VAL 156 H VAL 156 11.792 -8.580 0.734 1145 HA VAL 156 HA VAL 156 12.159 -5.721 -0.234 1146 HB VAL 156 HB VAL 156 13.201 -6.402 1.912 1147 HG11 VAL 156 1HG1 VAL 156 15.207 -8.023 0.226 1148 HG12 VAL 156 2HG1 VAL 156 14.036 -8.725 1.361 1149 HG13 VAL 156 3HG1 VAL 156 15.345 -7.664 1.963 1150 HG21 VAL 156 3HG2 VAL 156 15.226 -5.157 1.670 1151 HG22 VAL 156 1HG2 VAL 156 14.051 -4.399 0.596 1152 HG23 VAL 156 2HG2 VAL 156 15.293 -5.464 -0.090 1153 H ARG 157 H ARG 157 12.981 -5.073 -2.091 1154 HA ARG 157 HA ARG 157 13.334 -6.776 -4.422 1155 HE ARG 157 HE ARG 157 13.812 -4.475 -7.677 1156 HB2 ARG 157 2HB ARG 157 14.116 -3.890 -3.739 1157 HB3 ARG 157 1HB ARG 157 14.804 -4.607 -5.171 1158 HG2 ARG 157 2HG ARG 157 12.315 -5.276 -5.854 1159 HG3 ARG 157 1HG ARG 157 11.830 -4.183 -4.562 1160 HD2 ARG 157 2HD ARG 157 11.776 -2.910 -6.636 1161 HD3 ARG 157 1HD ARG 157 13.124 -2.333 -5.647 1162 HH11 ARG 157 2HH1 ARG 157 13.874 -1.087 -6.960 1163 HH12 ARG 157 1HH1 ARG 157 15.321 -0.777 -7.990 1164 HH21 ARG 157 1HH2 ARG 157 15.450 -4.146 -8.825 1165 HH22 ARG 157 2HH2 ARG 157 16.186 -2.482 -9.023 1166 H SER 158 H SER 158 14.873 -7.796 -5.426 1167 HA SER 158 HA SER 158 17.144 -8.893 -4.194 1168 HG SER 158 HG SER 158 15.615 -8.518 -7.693 1169 HB2 SER 158 2HB SER 158 17.745 -9.723 -6.488 1170 HB3 SER 158 1HB SER 158 16.036 -9.865 -6.151 1171 H ALA 159 H ALA 159 19.329 -8.935 -4.691 1172 HA ALA 159 HA ALA 159 21.536 -8.091 -4.793 1173 HB1 ALA 159 3HB ALA 159 21.040 -6.565 -6.698 1174 HB2 ALA 159 1HB ALA 159 22.254 -5.899 -5.568 1175 HB3 ALA 159 2HB ALA 159 20.587 -5.296 -5.540 1176 H SER 160 H SER 160 19.878 -8.341 -2.439 1177 HA SER 160 HA SER 160 20.420 -8.448 -0.228 1178 HG SER 160 HG SER 160 21.763 -7.778 1.539 1179 HB2 SER 160 2HB SER 160 22.824 -8.622 -0.855 1180 HB3 SER 160 1HB SER 160 23.016 -6.877 -0.646 1181 H SER 161 H SER 161 20.454 -5.238 -1.414 1182 HA SER 161 HA SER 161 19.343 -3.221 -0.551 1183 HG SER 161 HG SER 161 17.485 -5.135 -2.901 1184 HB2 SER 161 2HB SER 161 17.413 -5.569 -0.786 1185 HB3 SER 161 1HB SER 161 16.967 -3.860 -0.918 1186 H ARG 162 H ARG 162 19.892 -2.509 1.537 1187 HA ARG 162 HA ARG 162 17.840 -3.124 3.713 1188 HE ARG 162 HE ARG 162 18.866 -5.419 7.962 1189 HB2 ARG 162 1HB ARG 162 19.746 -4.904 3.678 1190 HB3 ARG 162 2HB ARG 162 20.863 -3.623 4.143 1191 HG2 ARG 162 1HG ARG 162 19.548 -3.283 6.285 1192 HG3 ARG 162 2HG ARG 162 18.325 -4.441 5.721 1193 HD2 ARG 162 1HD ARG 162 20.122 -6.265 5.583 1194 HD3 ARG 162 2HD ARG 162 21.303 -5.104 6.214 1195 HH11 ARG 162 2HH1 ARG 162 21.970 -6.918 7.261 1196 HH12 ARG 162 1HH1 ARG 162 22.085 -7.539 8.977 1197 HH21 ARG 162 1HH2 ARG 162 19.165 -6.145 9.986 1198 HH22 ARG 162 2HH2 ARG 162 20.652 -7.128 10.338 Start of MODEL 12 1 HA MET 1 HA MET 1 16.335 4.855 1.684 2 H1 MET 1 1H MET 1 15.888 7.215 2.633 3 H2 MET 1 2H MET 1 15.371 6.448 3.966 4 HB2 MET 1 1HB MET 1 14.242 4.448 3.886 5 HB3 MET 1 2HB MET 1 14.514 3.285 2.630 6 HG2 MET 1 1HG MET 1 16.608 2.561 3.431 7 HG3 MET 1 2HG MET 1 16.974 4.074 4.276 8 HE1 MET 1 3HE MET 1 14.856 5.023 5.929 9 HE2 MET 1 1HE MET 1 16.330 4.604 6.829 10 HE3 MET 1 2HE MET 1 14.717 4.079 7.425 11 H GLU 2 H GLU 2 13.653 3.915 1.023 12 HA GLU 2 HA GLU 2 12.174 6.348 0.075 13 HB2 GLU 2 2HB GLU 2 12.076 5.853 -2.259 14 HB3 GLU 2 1HB GLU 2 13.715 6.005 -1.734 15 HG2 GLU 2 2HG GLU 2 13.755 3.327 -1.659 16 HG3 GLU 2 1HG GLU 2 12.306 3.422 -2.658 17 H LEU 3 H LEU 3 10.467 4.208 -1.565 18 HA LEU 3 HA LEU 3 8.630 4.174 0.862 19 HG LEU 3 HG LEU 3 8.794 6.184 -2.211 20 HB2 LEU 3 2HB LEU 3 6.672 4.419 -0.863 21 HB3 LEU 3 1HB LEU 3 7.589 5.730 -0.222 22 HD11 LEU 3 1HD1 LEU 3 7.503 3.726 -3.620 23 HD12 LEU 3 2HD1 LEU 3 9.166 3.743 -3.015 24 HD13 LEU 3 3HD1 LEU 3 8.722 4.862 -4.275 25 HD21 LEU 3 3HD2 LEU 3 5.793 5.610 -2.681 26 HD22 LEU 3 1HD2 LEU 3 6.779 6.580 -3.800 27 HD23 LEU 3 2HD2 LEU 3 6.540 7.134 -2.127 28 H VAL 4 H VAL 4 7.224 2.769 1.402 29 HA VAL 4 HA VAL 4 7.533 -0.065 0.318 30 HB VAL 4 HB VAL 4 7.149 1.033 3.123 31 HG11 VAL 4 1HG1 VAL 4 6.188 -1.177 3.208 32 HG12 VAL 4 2HG1 VAL 4 7.824 -1.400 3.886 33 HG13 VAL 4 3HG1 VAL 4 7.451 -1.876 2.217 34 HG21 VAL 4 3HG2 VAL 4 9.801 -0.036 2.040 35 HG22 VAL 4 1HG2 VAL 4 9.423 0.368 3.740 36 HG23 VAL 4 2HG2 VAL 4 9.397 1.616 2.507 37 H SER 5 H SER 5 5.732 -1.268 -0.185 38 HA SER 5 HA SER 5 3.056 0.115 -0.010 39 HG SER 5 HG SER 5 3.864 -3.200 -1.080 40 HB2 SER 5 2HB SER 5 2.532 -1.415 -1.886 41 HB3 SER 5 1HB SER 5 4.033 -0.548 -2.143 42 H VAL 6 H VAL 6 1.305 -0.472 1.170 43 HA VAL 6 HA VAL 6 1.435 -3.008 2.836 44 HB VAL 6 HB VAL 6 1.196 -2.191 4.829 45 HG11 VAL 6 1HG1 VAL 6 3.329 -1.138 4.132 46 HG12 VAL 6 2HG1 VAL 6 2.529 -0.109 5.336 47 HG13 VAL 6 3HG1 VAL 6 2.483 0.326 3.630 48 HG21 VAL 6 3HG2 VAL 6 -0.962 -1.040 4.784 49 HG22 VAL 6 1HG2 VAL 6 -0.216 0.406 4.075 50 HG23 VAL 6 2HG2 VAL 6 0.207 -0.127 5.723 51 H ALA 7 H ALA 7 0.090 -4.117 1.304 52 HA ALA 7 HA ALA 7 -2.896 -3.301 1.391 53 HB1 ALA 7 3HB ALA 7 -1.380 -4.983 -0.716 54 HB2 ALA 7 1HB ALA 7 -2.084 -3.359 -0.924 55 HB3 ALA 7 2HB ALA 7 -3.147 -4.741 -0.687 56 H ALA 8 H ALA 8 -4.441 -4.737 2.184 57 HA ALA 8 HA ALA 8 -3.557 -7.520 3.096 58 HB1 ALA 8 3HB ALA 8 -4.411 -5.983 4.904 59 HB2 ALA 8 1HB ALA 8 -5.500 -7.361 4.656 60 HB3 ALA 8 2HB ALA 8 -5.915 -5.755 4.022 61 H LEU 9 H LEU 9 -4.427 -9.368 2.355 62 HA LEU 9 HA LEU 9 -6.783 -9.431 0.551 63 HG LEU 9 HG LEU 9 -3.545 -9.325 -2.236 64 HB2 LEU 9 2HB LEU 9 -5.655 -9.946 -1.537 65 HB3 LEU 9 1HB LEU 9 -5.432 -8.336 -0.999 66 HD11 LEU 9 1HD1 LEU 9 -1.716 -8.326 -0.840 67 HD12 LEU 9 2HD1 LEU 9 -2.752 -8.332 0.574 68 HD13 LEU 9 3HD1 LEU 9 -3.153 -7.315 -0.826 69 HD21 LEU 9 3HD2 LEU 9 -3.613 -11.652 -1.209 70 HD22 LEU 9 1HD2 LEU 9 -2.811 -10.983 0.249 71 HD23 LEU 9 2HD2 LEU 9 -1.999 -10.944 -1.331 72 H ALA 10 H ALA 10 -7.370 -11.379 -0.451 73 HA ALA 10 HA ALA 10 -6.473 -13.884 1.105 74 HB1 ALA 10 3HB ALA 10 -9.269 -12.894 0.228 75 HB2 ALA 10 1HB ALA 10 -8.583 -12.688 1.861 76 HB3 ALA 10 2HB ALA 10 -8.955 -14.299 1.259 77 H GLU 11 H GLU 11 -8.781 -15.252 -0.598 78 HA GLU 11 HA GLU 11 -7.041 -16.490 -2.635 79 HB2 GLU 11 2HB GLU 11 -8.816 -17.835 -1.633 80 HB3 GLU 11 1HB GLU 11 -10.069 -16.802 -2.289 81 HG2 GLU 11 2HG GLU 11 -9.805 -17.622 -4.516 82 HG3 GLU 11 1HG GLU 11 -8.139 -18.166 -4.261 83 H ASN 12 H ASN 12 -7.758 -16.539 -4.965 84 HA ASN 12 HA ASN 12 -6.711 -15.307 -6.741 85 HB2 ASN 12 2HB ASN 12 -9.580 -14.449 -6.255 86 HB3 ASN 12 1HB ASN 12 -8.711 -13.319 -7.213 87 HD21 ASN 12 1HD2 ASN 12 -10.569 -15.976 -7.528 88 HD22 ASN 12 2HD2 ASN 12 -10.003 -16.404 -9.219 89 H ARG 13 H ARG 13 -5.857 -14.114 -4.141 90 HA ARG 13 HA ARG 13 -4.915 -12.273 -3.172 91 HE ARG 13 HE ARG 13 -1.323 -14.234 -6.899 92 HB2 ARG 13 2HB ARG 13 -2.945 -11.323 -4.097 93 HB3 ARG 13 1HB ARG 13 -3.034 -13.022 -4.485 94 HG2 ARG 13 2HG ARG 13 -4.020 -12.197 -6.844 95 HG3 ARG 13 1HG ARG 13 -3.404 -10.655 -6.405 96 HD2 ARG 13 2HD ARG 13 -1.498 -11.355 -7.497 97 HD3 ARG 13 1HD ARG 13 -1.058 -12.041 -5.963 98 HH11 ARG 13 2HH1 ARG 13 -3.056 -12.009 -8.931 99 HH12 ARG 13 1HH1 ARG 13 -3.389 -13.277 -10.197 100 HH21 ARG 13 1HH2 ARG 13 -1.782 -15.651 -8.285 101 HH22 ARG 13 2HH2 ARG 13 -2.705 -15.275 -9.819 102 H VAL 14 H VAL 14 -7.220 -11.727 -3.286 103 HA VAL 14 HA VAL 14 -7.955 -9.240 -4.746 104 HB VAL 14 HB VAL 14 -9.361 -11.354 -3.040 105 HG11 VAL 14 1HG1 VAL 14 -10.827 -8.763 -3.802 106 HG12 VAL 14 2HG1 VAL 14 -10.515 -9.395 -2.162 107 HG13 VAL 14 3HG1 VAL 14 -11.550 -10.313 -3.251 108 HG21 VAL 14 3HG2 VAL 14 -10.675 -11.642 -5.124 109 HG22 VAL 14 1HG2 VAL 14 -8.945 -11.667 -5.516 110 HG23 VAL 14 2HG2 VAL 14 -9.897 -10.215 -5.886 111 H ILE 15 H ILE 15 -7.132 -7.358 -4.068 112 HA ILE 15 HA ILE 15 -6.634 -6.462 -1.304 113 HB ILE 15 HB ILE 15 -7.364 -4.652 -3.655 114 HG12 ILE 15 2HG1 ILE 15 -4.405 -4.896 -2.966 115 HG13 ILE 15 1HG1 ILE 15 -5.125 -6.284 -3.710 116 HG21 ILE 15 1HG2 ILE 15 -5.524 -3.738 -1.335 117 HG22 ILE 15 2HG2 ILE 15 -7.270 -3.527 -1.237 118 HG23 ILE 15 3HG2 ILE 15 -6.385 -2.747 -2.525 119 HD11 ILE 15 3HD1 ILE 15 -4.160 -4.655 -5.437 120 HD12 ILE 15 1HD1 ILE 15 -5.410 -3.476 -4.967 121 HD13 ILE 15 2HD1 ILE 15 -5.866 -5.020 -5.703 122 H GLY 16 H GLY 16 -9.555 -5.983 -3.301 123 HA2 GLY 16 2HA GLY 16 -11.234 -5.332 -0.952 124 HA3 GLY 16 1HA GLY 16 -10.814 -3.837 -1.812 125 H ARG 17 H ARG 17 -13.247 -4.129 -1.621 126 HA ARG 17 HA ARG 17 -14.458 -5.331 -4.112 127 HE ARG 17 HE ARG 17 -16.469 -10.058 -4.326 128 HB2 ARG 17 2HB ARG 17 -14.103 -7.177 -2.335 129 HB3 ARG 17 1HB ARG 17 -15.318 -6.389 -1.328 130 HG2 ARG 17 2HG ARG 17 -17.017 -6.750 -3.126 131 HG3 ARG 17 1HG ARG 17 -15.789 -7.345 -4.243 132 HD2 ARG 17 2HD ARG 17 -15.262 -9.212 -2.414 133 HD3 ARG 17 1HD ARG 17 -16.736 -8.712 -1.600 134 HH11 ARG 17 2HH1 ARG 17 -18.671 -8.252 -2.376 135 HH12 ARG 17 1HH1 ARG 17 -20.100 -8.751 -3.380 136 HH21 ARG 17 1HH2 ARG 17 -18.013 -10.550 -5.451 137 HH22 ARG 17 2HH2 ARG 17 -19.724 -10.029 -5.096 138 H ASP 18 H ASP 18 -15.971 -4.236 -1.004 139 HA ASP 18 HA ASP 18 -17.539 -2.225 -2.443 140 HB2 ASP 18 2HB ASP 18 -17.161 -2.724 0.568 141 HB3 ASP 18 1HB ASP 18 -18.293 -1.585 -0.141 142 H GLY 19 H GLY 19 -14.660 -1.705 -0.349 143 HA2 GLY 19 2HA GLY 19 -13.922 0.614 -2.155 144 HA3 GLY 19 1HA GLY 19 -14.182 1.122 -0.497 145 H GLU 20 H GLU 20 -12.597 0.560 1.050 146 HA GLU 20 HA GLU 20 -9.882 0.005 0.097 147 HB2 GLU 20 2HB GLU 20 -9.092 0.232 2.302 148 HB3 GLU 20 1HB GLU 20 -10.233 1.486 1.984 149 HG2 GLU 20 2HG GLU 20 -11.550 -0.804 3.447 150 HG3 GLU 20 1HG GLU 20 -10.109 -0.261 4.263 151 H LEU 21 H LEU 21 -12.016 -2.223 1.926 152 HA LEU 21 HA LEU 21 -10.557 -4.542 0.835 153 HG LEU 21 HG LEU 21 -9.468 -2.375 3.547 154 HB2 LEU 21 2HB LEU 21 -9.830 -5.420 3.192 155 HB3 LEU 21 1HB LEU 21 -8.864 -4.402 2.163 156 HD11 LEU 21 1HD1 LEU 21 -10.866 -4.497 5.298 157 HD12 LEU 21 2HD1 LEU 21 -11.532 -2.971 4.708 158 HD13 LEU 21 3HD1 LEU 21 -10.286 -2.957 5.982 159 HD21 LEU 21 3HD2 LEU 21 -7.749 -2.783 5.158 160 HD22 LEU 21 1HD2 LEU 21 -7.327 -3.807 3.778 161 HD23 LEU 21 2HD2 LEU 21 -8.071 -4.521 5.221 162 HA PRO 22 HA PRO 22 -14.423 -6.505 1.199 163 HB2 PRO 22 2HB PRO 22 -13.367 -9.283 1.357 164 HB3 PRO 22 1HB PRO 22 -14.020 -8.429 -0.037 165 HG2 PRO 22 2HG PRO 22 -11.305 -9.119 0.246 166 HG3 PRO 22 1HG PRO 22 -11.851 -7.750 -0.754 167 HD2 PRO 22 2HD PRO 22 -10.818 -7.659 2.124 168 HD3 PRO 22 1HD PRO 22 -10.390 -6.643 0.763 169 H TRP 23 H TRP 23 -12.468 -7.304 3.847 170 HA TRP 23 HA TRP 23 -14.781 -8.288 5.579 171 HD1 TRP 23 HD1 TRP 23 -11.306 -6.493 7.575 172 HE1 TRP 23 HE1 TRP 23 -9.050 -5.826 6.396 173 HE3 TRP 23 HE3 TRP 23 -11.269 -10.295 4.273 174 HZ2 TRP 23 HZ2 TRP 23 -7.733 -6.811 4.159 175 HZ3 TRP 23 HZ3 TRP 23 -9.508 -10.337 2.505 176 HH2 TRP 23 HH2 TRP 23 -7.816 -8.561 2.421 177 HB2 TRP 23 2HB TRP 23 -13.083 -8.803 7.358 178 HB3 TRP 23 1HB TRP 23 -12.850 -9.747 5.918 179 HA PRO 24 HA PRO 24 -15.231 -4.194 7.210 180 HB2 PRO 24 2HB PRO 24 -15.147 -5.037 10.114 181 HB3 PRO 24 1HB PRO 24 -16.433 -4.250 9.193 182 HG2 PRO 24 2HG PRO 24 -16.634 -6.917 9.855 183 HG3 PRO 24 1HG PRO 24 -17.193 -6.355 8.266 184 HD2 PRO 24 2HD PRO 24 -14.501 -7.672 8.908 185 HD3 PRO 24 1HD PRO 24 -15.651 -8.044 7.595 186 H SER 25 H SER 25 -12.737 -5.557 9.354 187 HA SER 25 HA SER 25 -10.454 -4.203 8.918 188 HG SER 25 HG SER 25 -11.921 -1.925 8.138 189 HB2 SER 25 2HB SER 25 -12.071 -2.112 10.506 190 HB3 SER 25 1HB SER 25 -10.312 -2.150 10.499 191 H ILE 26 H ILE 26 -9.512 -5.875 10.117 192 HA ILE 26 HA ILE 26 -10.297 -6.383 12.948 193 HB ILE 26 HB ILE 26 -8.069 -7.784 13.042 194 HG12 ILE 26 2HG1 ILE 26 -7.142 -7.142 10.833 195 HG13 ILE 26 1HG1 ILE 26 -7.224 -8.853 11.187 196 HG21 ILE 26 1HG2 ILE 26 -10.266 -8.779 13.412 197 HG22 ILE 26 2HG2 ILE 26 -9.221 -9.827 12.443 198 HG23 ILE 26 3HG2 ILE 26 -10.531 -8.914 11.658 199 HD11 ILE 26 3HD1 ILE 26 -7.801 -8.586 8.834 200 HD12 ILE 26 1HD1 ILE 26 -8.977 -7.341 9.159 201 HD13 ILE 26 2HD1 ILE 26 -9.314 -9.027 9.643 202 HA PRO 27 HA PRO 27 -7.529 -3.469 15.088 203 HB2 PRO 27 2HB PRO 27 -7.057 -5.775 17.048 204 HB3 PRO 27 1HB PRO 27 -7.446 -4.069 17.377 205 HG2 PRO 27 2HG PRO 27 -9.440 -5.903 17.553 206 HG3 PRO 27 1HG PRO 27 -9.781 -4.405 16.636 207 HD2 PRO 27 2HD PRO 27 -8.892 -7.114 15.463 208 HD3 PRO 27 1HD PRO 27 -10.315 -6.110 15.029 209 H ALA 28 H ALA 28 -6.134 -6.577 14.204 210 HA ALA 28 HA ALA 28 -3.297 -5.597 14.423 211 HB1 ALA 28 3HB ALA 28 -3.606 -8.030 14.596 212 HB2 ALA 28 1HB ALA 28 -2.696 -7.657 13.143 213 HB3 ALA 28 2HB ALA 28 -4.406 -8.079 12.988 214 H ASP 29 H ASP 29 -5.708 -5.541 11.850 215 HA ASP 29 HA ASP 29 -3.895 -4.694 9.620 216 HB2 ASP 29 2HB ASP 29 -6.017 -5.859 9.172 217 HB3 ASP 29 1HB ASP 29 -6.959 -4.701 10.103 218 H LYS 30 H LYS 30 -6.493 -2.770 10.981 219 HA LYS 30 HA LYS 30 -5.279 -0.307 10.841 220 HB2 LYS 30 2HB LYS 30 -7.751 -1.290 12.010 221 HB3 LYS 30 1HB LYS 30 -7.042 -0.234 13.191 222 HG2 LYS 30 2HG LYS 30 -8.394 1.230 11.977 223 HG3 LYS 30 1HG LYS 30 -6.825 1.570 11.306 224 HD2 LYS 30 2HD LYS 30 -7.406 0.073 9.270 225 HD3 LYS 30 1HD LYS 30 -8.990 -0.207 9.986 226 HE2 LYS 30 2HE LYS 30 -9.455 2.331 9.973 227 HE3 LYS 30 1HE LYS 30 -7.919 2.591 9.200 228 HZ1 LYS 30 3HZ LYS 30 -10.391 2.001 7.935 229 HZ2 LYS 30 1HZ LYS 30 -9.425 0.725 7.539 230 HZ3 LYS 30 2HZ LYS 30 -9.069 2.321 7.213 231 H LYS 31 H LYS 31 -4.294 -2.410 13.418 232 HA LYS 31 HA LYS 31 -2.614 -0.219 14.732 233 HB2 LYS 31 2HB LYS 31 -3.566 -1.908 16.280 234 HB3 LYS 31 1HB LYS 31 -2.791 -3.187 15.377 235 HG2 LYS 31 2HG LYS 31 -1.529 -2.973 17.352 236 HG3 LYS 31 1HG LYS 31 -0.534 -2.467 16.020 237 HD2 LYS 31 2HD LYS 31 -1.088 0.008 16.622 238 HD3 LYS 31 1HD LYS 31 -1.988 -0.603 17.997 239 HE2 LYS 31 2HE LYS 31 0.179 0.053 18.881 240 HE3 LYS 31 1HE LYS 31 0.126 -1.708 18.927 241 HZ1 LYS 31 3HZ LYS 31 1.304 -1.638 16.628 242 HZ2 LYS 31 1HZ LYS 31 2.268 -1.037 17.836 243 HZ3 LYS 31 2HZ LYS 31 1.506 -0.041 16.768 244 H GLN 32 H GLN 32 -2.038 -2.873 12.383 245 HA GLN 32 HA GLN 32 0.928 -2.447 12.335 246 HB2 GLN 32 2HB GLN 32 0.038 -4.654 11.808 247 HB3 GLN 32 1HB GLN 32 -0.974 -4.013 10.534 248 HG2 GLN 32 2HG GLN 32 1.933 -3.343 10.027 249 HG3 GLN 32 1HG GLN 32 1.720 -5.054 10.314 250 HE21 GLN 32 1HE2 GLN 32 1.319 -2.629 7.946 251 HE22 GLN 32 2HE2 GLN 32 0.342 -3.719 6.807 252 H TYR 33 H TYR 33 -1.757 -1.612 10.023 253 HA TYR 33 HA TYR 33 -0.293 0.400 8.521 254 HD1 TYR 33 HD1 TYR 33 -3.998 1.264 10.308 255 HD2 TYR 33 HD2 TYR 33 -2.916 2.107 6.253 256 HE1 TYR 33 HE1 TYR 33 -5.616 3.095 10.270 257 HE2 TYR 33 HE2 TYR 33 -4.560 3.942 6.213 258 HH TYR 33 HH TYR 33 -6.422 4.949 7.447 259 HB2 TYR 33 2HB TYR 33 -2.179 -0.057 7.394 260 HB3 TYR 33 1HB TYR 33 -3.097 -0.510 8.766 261 H ARG 34 H ARG 34 -1.919 0.914 11.722 262 HA ARG 34 HA ARG 34 -0.978 3.793 11.638 263 HE ARG 34 HE ARG 34 -5.906 5.578 12.332 264 HB2 ARG 34 2HB ARG 34 -2.466 2.276 13.864 265 HB3 ARG 34 1HB ARG 34 -1.931 3.942 14.007 266 HG2 ARG 34 2HG ARG 34 -3.200 4.465 11.791 267 HG3 ARG 34 1HG ARG 34 -3.902 2.896 11.912 268 HD2 ARG 34 2HD ARG 34 -5.448 3.453 13.459 269 HD3 ARG 34 1HD ARG 34 -4.311 4.228 14.527 270 HH11 ARG 34 2HH1 ARG 34 -3.093 5.970 14.298 271 HH12 ARG 34 1HH1 ARG 34 -2.856 7.689 13.765 272 HH21 ARG 34 1HH2 ARG 34 -5.557 7.459 11.655 273 HH22 ARG 34 2HH2 ARG 34 -4.223 8.491 12.321 274 H SER 35 H SER 35 0.793 1.148 12.487 275 HA SER 35 HA SER 35 2.842 3.015 13.864 276 HG SER 35 HG SER 35 1.229 1.893 15.294 277 HB2 SER 35 2HB SER 35 2.682 -0.030 14.300 278 HB3 SER 35 1HB SER 35 3.827 1.089 15.056 279 H ARG 36 H ARG 36 2.170 1.257 11.146 280 HA ARG 36 HA ARG 36 4.994 1.455 10.004 281 HE ARG 36 HE ARG 36 5.875 -3.077 7.914 282 HB2 ARG 36 2HB ARG 36 3.237 -0.614 9.707 283 HB3 ARG 36 1HB ARG 36 2.427 0.479 8.618 284 HG2 ARG 36 2HG ARG 36 3.776 -0.872 7.222 285 HG3 ARG 36 1HG ARG 36 4.546 0.676 7.289 286 HD2 ARG 36 2HD ARG 36 6.315 -0.846 7.354 287 HD3 ARG 36 1HD ARG 36 6.283 -0.324 9.002 288 HH11 ARG 36 2HH1 ARG 36 5.309 -1.199 10.710 289 HH12 ARG 36 1HH1 ARG 36 5.225 -2.717 11.723 290 HH21 ARG 36 1HH2 ARG 36 5.804 -4.619 8.983 291 HH22 ARG 36 2HH2 ARG 36 5.337 -4.651 10.734 292 H VAL 37 H VAL 37 1.614 2.649 9.183 293 HA VAL 37 HA VAL 37 2.908 4.819 7.527 294 HB VAL 37 HB VAL 37 1.246 4.885 6.096 295 HG11 VAL 37 1HG1 VAL 37 0.702 2.703 5.171 296 HG12 VAL 37 2HG1 VAL 37 0.777 1.933 6.792 297 HG13 VAL 37 3HG1 VAL 37 2.254 2.558 6.041 298 HG21 VAL 37 3HG2 VAL 37 -0.922 3.711 7.924 299 HG22 VAL 37 1HG2 VAL 37 -1.139 4.041 6.197 300 HG23 VAL 37 2HG2 VAL 37 -0.801 5.366 7.318 301 H ALA 38 H ALA 38 1.386 4.963 10.587 302 HA ALA 38 HA ALA 38 -0.190 7.423 9.895 303 HB1 ALA 38 3HB ALA 38 0.075 6.099 12.608 304 HB2 ALA 38 1HB ALA 38 -1.261 5.948 11.424 305 HB3 ALA 38 2HB ALA 38 -0.943 7.502 12.214 306 H ASP 39 H ASP 39 2.995 7.112 11.218 307 HA ASP 39 HA ASP 39 3.302 10.088 11.509 308 HB2 ASP 39 2HB ASP 39 5.073 7.656 11.999 309 HB3 ASP 39 1HB ASP 39 5.860 9.095 11.451 310 H ASP 40 H ASP 40 4.325 7.614 9.048 311 HA ASP 40 HA ASP 40 5.273 9.461 7.244 312 HB2 ASP 40 2HB ASP 40 4.370 6.547 6.969 313 HB3 ASP 40 1HB ASP 40 5.313 7.349 5.730 314 HA PRO 41 HA PRO 41 2.002 10.427 4.022 315 HB2 PRO 41 2HB PRO 41 4.392 10.089 2.107 316 HB3 PRO 41 1HB PRO 41 3.197 11.382 2.127 317 HG2 PRO 41 2HG PRO 41 5.620 11.884 3.212 318 HG3 PRO 41 1HG PRO 41 4.228 12.311 4.231 319 HD2 PRO 41 2HD PRO 41 5.865 9.703 4.395 320 HD3 PRO 41 1HD PRO 41 5.459 10.871 5.678 321 H VAL 42 H VAL 42 0.609 9.155 2.814 322 HA VAL 42 HA VAL 42 1.623 6.467 1.746 323 HB VAL 42 HB VAL 42 -1.184 7.237 2.670 324 HG11 VAL 42 1HG1 VAL 42 -1.658 4.791 2.623 325 HG12 VAL 42 2HG1 VAL 42 -0.014 4.433 2.032 326 HG13 VAL 42 3HG1 VAL 42 -1.171 5.307 1.003 327 HG21 VAL 42 3HG2 VAL 42 0.230 7.132 4.680 328 HG22 VAL 42 1HG2 VAL 42 1.150 5.745 4.070 329 HG23 VAL 42 2HG2 VAL 42 -0.527 5.527 4.582 330 H VAL 43 H VAL 43 1.646 6.007 -0.322 331 HA VAL 43 HA VAL 43 0.124 7.708 -2.338 332 HB VAL 43 HB VAL 43 1.668 7.130 -4.021 333 HG11 VAL 43 1HG1 VAL 43 2.644 8.831 -2.362 334 HG12 VAL 43 2HG1 VAL 43 3.890 7.861 -3.178 335 HG13 VAL 43 3HG1 VAL 43 3.427 7.525 -1.508 336 HG21 VAL 43 3HG2 VAL 43 3.014 5.123 -2.129 337 HG22 VAL 43 1HG2 VAL 43 3.684 5.611 -3.683 338 HG23 VAL 43 2HG2 VAL 43 2.164 4.731 -3.671 339 H LEU 44 H LEU 44 -1.896 7.035 -2.755 340 HA LEU 44 HA LEU 44 -2.428 4.029 -3.194 341 HG LEU 44 HG LEU 44 -4.423 6.917 -1.848 342 HB2 LEU 44 2HB LEU 44 -4.330 4.072 -1.740 343 HB3 LEU 44 1HB LEU 44 -2.888 4.447 -0.905 344 HD11 LEU 44 1HD1 LEU 44 -6.351 5.408 -1.133 345 HD12 LEU 44 2HD1 LEU 44 -6.137 6.769 -0.033 346 HD13 LEU 44 3HD1 LEU 44 -5.570 5.146 0.441 347 HD21 LEU 44 3HD2 LEU 44 -3.332 6.170 0.944 348 HD22 LEU 44 1HD2 LEU 44 -3.844 7.781 0.359 349 HD23 LEU 44 2HD2 LEU 44 -2.401 7.009 -0.306 350 H GLY 45 H GLY 45 -5.008 3.755 -3.713 351 HA2 GLY 45 2HA GLY 45 -5.090 4.798 -6.599 352 HA3 GLY 45 1HA GLY 45 -5.900 3.352 -5.981 353 H ARG 46 H ARG 46 -7.549 4.530 -7.399 354 HA ARG 46 HA ARG 46 -9.259 6.272 -5.598 355 HE ARG 46 HE ARG 46 -12.166 8.819 -7.289 356 HB2 ARG 46 2HB ARG 46 -9.614 5.910 -8.586 357 HB3 ARG 46 1HB ARG 46 -11.006 6.228 -7.614 358 HG2 ARG 46 2HG ARG 46 -8.514 8.016 -7.636 359 HG3 ARG 46 1HG ARG 46 -9.966 8.353 -8.563 360 HD2 ARG 46 2HD ARG 46 -10.275 8.024 -5.509 361 HD3 ARG 46 1HD ARG 46 -9.454 9.471 -6.076 362 HH11 ARG 46 2HH1 ARG 46 -11.010 9.552 -4.290 363 HH12 ARG 46 1HH1 ARG 46 -12.625 10.212 -3.801 364 HH21 ARG 46 1HH2 ARG 46 -13.799 9.682 -6.854 365 HH22 ARG 46 2HH2 ARG 46 -14.092 10.439 -5.241 366 H THR 47 H THR 47 -9.353 2.928 -6.824 367 HA THR 47 HA THR 47 -11.641 2.199 -5.293 368 HB THR 47 HB THR 47 -9.061 0.546 -5.697 369 HG1 THR 47 HG1 THR 47 -11.095 -0.284 -7.069 370 HG21 THR 47 3HG2 THR 47 -10.790 -1.373 -5.568 371 HG22 THR 47 1HG2 THR 47 -11.927 -0.254 -4.799 372 HG23 THR 47 2HG2 THR 47 -10.383 -0.645 -3.996 373 H THR 48 H THR 48 -8.423 1.574 -3.743 374 HA THR 48 HA THR 48 -9.175 1.830 -1.062 375 HB THR 48 HB THR 48 -6.823 2.543 -0.524 376 HG1 THR 48 HG1 THR 48 -6.520 3.889 -2.232 377 HG21 THR 48 3HG2 THR 48 -5.554 0.700 -1.364 378 HG22 THR 48 1HG2 THR 48 -6.723 0.313 -2.635 379 HG23 THR 48 2HG2 THR 48 -7.156 0.101 -0.920 380 H PHE 49 H PHE 49 -8.749 4.739 -3.087 381 HA PHE 49 HA PHE 49 -8.867 6.551 -0.656 382 HD1 PHE 49 HD2 PHE 49 -10.313 9.411 -2.365 383 HD2 PHE 49 HD1 PHE 49 -6.129 8.829 -1.617 384 HE1 PHE 49 HE2 PHE 49 -10.137 11.725 -1.559 385 HE2 PHE 49 HE1 PHE 49 -5.936 11.200 -0.964 386 HZ PHE 49 HZ PHE 49 -7.954 12.603 -0.828 387 HB2 PHE 49 2HB PHE 49 -7.335 7.068 -2.595 388 HB3 PHE 49 1HB PHE 49 -8.731 7.498 -3.555 389 H GLU 50 H GLU 50 -11.123 5.520 -3.154 390 HA GLU 50 HA GLU 50 -13.253 7.425 -2.371 391 HB2 GLU 50 2HB GLU 50 -13.267 4.931 -4.131 392 HB3 GLU 50 1HB GLU 50 -14.770 5.620 -3.593 393 HG2 GLU 50 2HG GLU 50 -14.365 7.750 -4.701 394 HG3 GLU 50 1HG GLU 50 -12.629 7.439 -4.800 395 H SER 51 H SER 51 -12.371 4.208 -0.929 396 HA SER 51 HA SER 51 -14.005 4.790 1.504 397 HG SER 51 HG SER 51 -13.186 1.779 2.657 398 HB2 SER 51 2HB SER 51 -11.791 2.814 0.994 399 HB3 SER 51 1HB SER 51 -11.904 3.419 2.628 400 H MET 52 H MET 52 -10.351 5.115 1.329 401 HA MET 52 HA MET 52 -9.884 6.459 3.625 402 HB2 MET 52 2HB MET 52 -8.254 5.744 1.615 403 HB3 MET 52 1HB MET 52 -8.376 7.454 1.147 404 HG2 MET 52 2HG MET 52 -6.355 7.185 2.385 405 HG3 MET 52 1HG MET 52 -7.464 8.093 3.402 406 HE1 MET 52 3HE MET 52 -6.600 4.124 2.715 407 HE2 MET 52 1HE MET 52 -5.685 3.986 4.246 408 HE3 MET 52 2HE MET 52 -5.188 5.200 3.034 409 H ARG 53 H ARG 53 -11.191 8.273 1.107 410 HA ARG 53 HA ARG 53 -11.231 11.019 2.136 411 HE ARG 53 HE ARG 53 -15.294 13.158 1.644 412 HB2 ARG 53 2HB ARG 53 -11.931 10.314 -0.113 413 HB3 ARG 53 1HB ARG 53 -13.168 9.248 0.509 414 HG2 ARG 53 2HG ARG 53 -13.213 12.242 1.162 415 HG3 ARG 53 1HG ARG 53 -13.773 11.747 -0.430 416 HD2 ARG 53 2HD ARG 53 -15.737 10.684 0.337 417 HD3 ARG 53 1HD ARG 53 -14.968 10.124 1.790 418 HH11 ARG 53 2HH1 ARG 53 -16.168 10.209 3.071 419 HH12 ARG 53 1HH1 ARG 53 -16.786 10.928 4.582 420 HH21 ARG 53 1HH2 ARG 53 -16.014 14.098 3.430 421 HH22 ARG 53 2HH2 ARG 53 -16.714 12.999 4.723 422 H ASP 54 H ASP 54 -12.862 8.196 3.573 423 HA ASP 54 HA ASP 54 -14.153 10.000 5.655 424 HB2 ASP 54 2HB ASP 54 -15.066 7.474 4.595 425 HB3 ASP 54 1HB ASP 54 -14.549 7.146 6.223 426 H ASP 55 H ASP 55 -12.036 6.964 6.035 427 HA ASP 55 HA ASP 55 -10.734 8.516 8.281 428 HB2 ASP 55 2HB ASP 55 -10.334 6.885 9.633 429 HB3 ASP 55 1HB ASP 55 -11.877 6.463 9.034 430 H LEU 56 H LEU 56 -8.879 9.261 8.245 431 HA LEU 56 HA LEU 56 -7.322 9.172 5.730 432 HG LEU 56 HG LEU 56 -7.609 12.779 6.626 433 HB2 LEU 56 2HB LEU 56 -6.556 10.859 8.149 434 HB3 LEU 56 1HB LEU 56 -6.132 11.092 6.492 435 HD11 LEU 56 1HD1 LEU 56 -8.788 11.330 4.887 436 HD12 LEU 56 2HD1 LEU 56 -9.893 12.384 5.769 437 HD13 LEU 56 3HD1 LEU 56 -9.815 10.668 6.160 438 HD21 LEU 56 3HD2 LEU 56 -8.057 12.406 9.063 439 HD22 LEU 56 1HD2 LEU 56 -9.418 11.340 8.626 440 HD23 LEU 56 2HD2 LEU 56 -9.444 13.064 8.179 441 HA PRO 57 HA PRO 57 -4.181 6.257 7.228 442 HB2 PRO 57 2HB PRO 57 -2.248 6.408 5.350 443 HB3 PRO 57 1HB PRO 57 -3.877 5.880 4.966 444 HG2 PRO 57 2HG PRO 57 -2.607 8.588 4.399 445 HG3 PRO 57 1HG PRO 57 -3.715 7.645 3.375 446 HD2 PRO 57 2HD PRO 57 -4.483 9.777 5.112 447 HD3 PRO 57 1HD PRO 57 -5.600 8.557 4.439 448 H GLY 58 H GLY 58 -1.954 8.941 6.361 449 HA2 GLY 58 2HA GLY 58 -1.189 9.274 9.314 450 HA3 GLY 58 1HA GLY 58 0.086 8.843 8.166 451 H SER 59 H SER 59 1.224 10.676 8.551 452 HA SER 59 HA SER 59 0.375 13.398 8.426 453 HG SER 59 HG SER 59 3.727 14.260 8.628 454 HB2 SER 59 2HB SER 59 2.589 12.438 9.217 455 HB3 SER 59 1HB SER 59 3.104 12.307 7.527 456 H ALA 60 H ALA 60 0.574 11.367 5.580 457 HA ALA 60 HA ALA 60 -0.841 13.537 4.160 458 HB1 ALA 60 3HB ALA 60 2.019 12.886 3.243 459 HB2 ALA 60 1HB ALA 60 1.257 14.448 3.541 460 HB3 ALA 60 2HB ALA 60 0.832 13.523 2.085 461 H GLN 61 H GLN 61 -1.613 13.125 2.054 462 HA GLN 61 HA GLN 61 -2.274 10.173 1.516 463 HB2 GLN 61 2HB GLN 61 -3.902 11.755 3.000 464 HB3 GLN 61 1HB GLN 61 -4.391 12.389 1.450 465 HG2 GLN 61 2HG GLN 61 -5.003 10.000 0.715 466 HG3 GLN 61 1HG GLN 61 -4.542 9.429 2.276 467 HE21 GLN 61 1HE2 GLN 61 -5.781 11.364 3.997 468 HE22 GLN 61 2HE2 GLN 61 -7.566 10.934 3.771 469 H ILE 62 H ILE 62 -1.167 9.975 -0.322 470 HA ILE 62 HA ILE 62 -1.445 11.929 -2.650 471 HB ILE 62 HB ILE 62 0.496 9.666 -1.938 472 HG12 ILE 62 2HG1 ILE 62 1.361 12.483 -2.523 473 HG13 ILE 62 1HG1 ILE 62 0.597 12.212 -0.967 474 HG21 ILE 62 1HG2 ILE 62 1.847 10.178 -3.959 475 HG22 ILE 62 2HG2 ILE 62 0.622 11.374 -4.488 476 HG23 ILE 62 3HG2 ILE 62 0.244 9.631 -4.474 477 HD11 ILE 62 3HD1 ILE 62 3.222 11.000 -2.010 478 HD12 ILE 62 1HD1 ILE 62 2.446 10.439 -0.482 479 HD13 ILE 62 2HD1 ILE 62 2.986 12.111 -0.656 480 H VAL 63 H VAL 63 -2.651 11.343 -4.485 481 HA VAL 63 HA VAL 63 -3.224 8.345 -4.885 482 HB VAL 63 HB VAL 63 -4.808 10.547 -6.243 483 HG11 VAL 63 1HG1 VAL 63 -6.312 8.489 -6.966 484 HG12 VAL 63 2HG1 VAL 63 -5.045 7.431 -6.354 485 HG13 VAL 63 3HG1 VAL 63 -4.710 8.471 -7.740 486 HG21 VAL 63 3HG2 VAL 63 -6.756 9.547 -4.849 487 HG22 VAL 63 1HG2 VAL 63 -5.489 10.317 -3.881 488 HG23 VAL 63 2HG2 VAL 63 -5.534 8.546 -4.001 489 H MET 64 H MET 64 -2.174 7.297 -6.341 490 HA MET 64 HA MET 64 -0.611 8.658 -8.553 491 HB2 MET 64 2HB MET 64 -0.626 5.963 -7.106 492 HB3 MET 64 1HB MET 64 -0.226 5.883 -8.782 493 HG2 MET 64 2HG MET 64 1.324 8.168 -7.784 494 HG3 MET 64 1HG MET 64 1.435 6.894 -6.593 495 HE1 MET 64 3HE MET 64 1.740 8.070 -10.265 496 HE2 MET 64 1HE MET 64 0.883 6.568 -10.691 497 HE3 MET 64 2HE MET 64 2.611 6.746 -11.105 498 H SER 65 H SER 65 -2.087 9.512 -9.791 499 HA SER 65 HA SER 65 -2.784 8.068 -12.159 500 HG SER 65 HG SER 65 -6.062 7.225 -12.395 501 HB2 SER 65 2HB SER 65 -4.658 7.035 -10.866 502 HB3 SER 65 1HB SER 65 -5.293 8.606 -10.427 503 H ARG 66 H ARG 66 -4.316 9.527 -13.615 504 HA ARG 66 HA ARG 66 -3.034 12.289 -13.628 505 HE ARG 66 HE ARG 66 -6.531 9.844 -18.549 506 HB2 ARG 66 2HB ARG 66 -3.703 12.401 -15.973 507 HB3 ARG 66 1HB ARG 66 -2.829 10.931 -15.602 508 HG2 ARG 66 2HG ARG 66 -5.118 9.696 -15.526 509 HG3 ARG 66 1HG ARG 66 -5.879 11.174 -16.107 510 HD2 ARG 66 2HD ARG 66 -4.481 11.119 -18.194 511 HD3 ARG 66 1HD ARG 66 -3.617 9.696 -17.641 512 HH11 ARG 66 2HH1 ARG 66 -4.094 7.732 -17.217 513 HH12 ARG 66 1HH1 ARG 66 -5.180 6.282 -17.373 514 HH21 ARG 66 1HH2 ARG 66 -7.736 8.219 -18.624 515 HH22 ARG 66 2HH2 ARG 66 -7.170 6.561 -18.121 516 H SER 67 H SER 67 -4.068 13.965 -12.583 517 HA SER 67 HA SER 67 -6.424 15.117 -13.468 518 HG SER 67 HG SER 67 -8.554 15.270 -12.900 519 HB2 SER 67 2HB SER 67 -7.655 13.086 -12.234 520 HB3 SER 67 1HB SER 67 -7.263 13.936 -10.738 521 H GLU 68 H GLU 68 -7.504 16.540 -11.307 522 HA GLU 68 HA GLU 68 -5.279 18.525 -10.829 523 HB2 GLU 68 2HB GLU 68 -8.250 18.853 -10.093 524 HB3 GLU 68 1HB GLU 68 -7.014 20.087 -10.209 525 HG2 GLU 68 2HG GLU 68 -6.893 19.454 -12.804 526 HG3 GLU 68 1HG GLU 68 -8.442 18.655 -12.509 527 H ARG 69 H ARG 69 -5.288 19.677 -8.692 528 HA ARG 69 HA ARG 69 -4.691 17.499 -6.630 529 HE ARG 69 HE ARG 69 -1.065 21.235 -4.735 530 HB2 ARG 69 2HB ARG 69 -2.904 19.072 -7.830 531 HB3 ARG 69 1HB ARG 69 -3.397 20.284 -6.672 532 HG2 ARG 69 2HG ARG 69 -2.733 17.542 -5.561 533 HG3 ARG 69 1HG ARG 69 -1.404 18.306 -6.356 534 HD2 ARG 69 2HD ARG 69 -2.965 19.847 -4.182 535 HD3 ARG 69 1HD ARG 69 -1.915 18.543 -3.730 536 HH11 ARG 69 2HH1 ARG 69 0.118 17.973 -4.361 537 HH12 ARG 69 1HH1 ARG 69 1.828 18.536 -4.150 538 HH21 ARG 69 1HH2 ARG 69 0.921 21.820 -4.512 539 HH22 ARG 69 2HH2 ARG 69 2.238 20.588 -4.252 540 H SER 70 H SER 70 -7.081 17.724 -6.170 541 HA SER 70 HA SER 70 -7.350 19.118 -3.461 542 HG SER 70 HG SER 70 -9.531 18.585 -6.041 543 HB2 SER 70 2HB SER 70 -9.341 20.386 -4.132 544 HB3 SER 70 1HB SER 70 -8.053 20.777 -5.253 545 H PHE 71 H PHE 71 -8.587 17.879 -1.990 546 HA PHE 71 HA PHE 71 -10.668 15.923 -3.067 547 HD1 PHE 71 HD1 PHE 71 -10.410 13.631 -4.228 548 HD2 PHE 71 HD2 PHE 71 -6.417 14.411 -2.835 549 HE1 PHE 71 HE1 PHE 71 -9.493 12.188 -6.007 550 HE2 PHE 71 HE2 PHE 71 -5.529 12.931 -4.584 551 HZ PHE 71 HZ PHE 71 -7.052 11.813 -6.146 552 HB2 PHE 71 2HB PHE 71 -8.251 15.004 -1.412 553 HB3 PHE 71 1HB PHE 71 -9.680 14.051 -1.663 554 H SER 72 H SER 72 -9.423 16.136 0.355 555 HA SER 72 HA SER 72 -12.111 17.021 1.297 556 HG SER 72 HG SER 72 -13.332 15.440 0.203 557 HB2 SER 72 2HB SER 72 -11.586 14.059 1.153 558 HB3 SER 72 1HB SER 72 -12.216 14.603 2.691 559 H VAL 73 H VAL 73 -9.216 15.380 2.667 560 HA VAL 73 HA VAL 73 -9.306 17.320 5.030 561 HB VAL 73 HB VAL 73 -8.859 14.940 5.585 562 HG11 VAL 73 1HG1 VAL 73 -7.645 14.025 3.667 563 HG12 VAL 73 2HG1 VAL 73 -6.569 13.899 5.063 564 HG13 VAL 73 3HG1 VAL 73 -6.305 15.180 3.871 565 HG21 VAL 73 3HG2 VAL 73 -7.871 16.781 7.032 566 HG22 VAL 73 1HG2 VAL 73 -6.338 16.605 6.163 567 HG23 VAL 73 2HG2 VAL 73 -6.983 15.242 7.097 568 H ASP 74 H ASP 74 -7.706 18.992 5.240 569 HA ASP 74 HA ASP 74 -6.273 19.997 3.035 570 HB2 ASP 74 2HB ASP 74 -5.572 20.284 6.024 571 HB3 ASP 74 1HB ASP 74 -4.903 21.258 4.725 572 H THR 75 H THR 75 -4.943 17.454 5.212 573 HA THR 75 HA THR 75 -2.411 17.333 3.544 574 HB THR 75 HB THR 75 -2.314 16.931 6.042 575 HG1 THR 75 HG1 THR 75 -0.596 15.425 5.543 576 HG21 THR 75 3HG2 THR 75 -3.996 14.943 6.291 577 HG22 THR 75 1HG2 THR 75 -2.348 14.597 6.859 578 HG23 THR 75 2HG2 THR 75 -2.883 13.966 5.317 579 H ALA 76 H ALA 76 -4.502 17.096 1.869 580 HA ALA 76 HA ALA 76 -4.007 14.321 0.738 581 HB1 ALA 76 3HB ALA 76 -6.402 14.023 0.054 582 HB2 ALA 76 1HB ALA 76 -6.840 15.493 0.975 583 HB3 ALA 76 2HB ALA 76 -6.170 14.068 1.811 584 H HIS 77 H HIS 77 -3.702 14.122 -1.268 585 HA HIS 77 HA HIS 77 -3.449 16.572 -3.080 586 HD1 HIS 77 HD1 HIS 77 -1.191 15.511 0.754 587 HD2 HIS 77 HD2 HIS 77 -1.194 18.941 -1.807 588 HE1 HIS 77 HE1 HIS 77 -0.397 17.595 2.017 589 HB2 HIS 77 2HB HIS 77 -1.141 14.969 -1.825 590 HB3 HIS 77 1HB HIS 77 -0.964 16.314 -2.948 591 H ARG 78 H ARG 78 -2.125 15.907 -5.146 592 HA ARG 78 HA ARG 78 -2.989 13.132 -6.105 593 HE ARG 78 HE ARG 78 -5.039 12.478 -10.856 594 HB2 ARG 78 2HB ARG 78 -4.167 15.563 -7.037 595 HB3 ARG 78 1HB ARG 78 -3.039 15.194 -8.285 596 HG2 ARG 78 2HG ARG 78 -5.370 13.463 -7.259 597 HG3 ARG 78 1HG ARG 78 -5.314 14.435 -8.712 598 HD2 ARG 78 2HD ARG 78 -3.228 12.927 -9.417 599 HD3 ARG 78 1HD ARG 78 -3.775 11.775 -8.237 600 HH11 ARG 78 2HH1 ARG 78 -5.770 11.095 -7.822 601 HH12 ARG 78 1HH1 ARG 78 -7.131 10.063 -8.464 602 HH21 ARG 78 1HH2 ARG 78 -6.524 11.279 -11.634 603 HH22 ARG 78 2HH2 ARG 78 -7.525 10.180 -10.558 604 H ALA 79 H ALA 79 -1.262 11.987 -6.906 605 HA ALA 79 HA ALA 79 1.159 13.475 -8.084 606 HB1 ALA 79 3HB ALA 79 1.789 11.889 -6.306 607 HB2 ALA 79 1HB ALA 79 2.252 11.175 -7.860 608 HB3 ALA 79 2HB ALA 79 0.804 10.576 -7.034 609 H ALA 80 H ALA 80 1.405 13.396 -10.287 610 HA ALA 80 HA ALA 80 -0.273 11.565 -11.998 611 HB1 ALA 80 3HB ALA 80 1.825 13.681 -12.758 612 HB2 ALA 80 1HB ALA 80 0.071 13.926 -12.643 613 HB3 ALA 80 2HB ALA 80 0.745 12.843 -13.888 614 H SER 81 H SER 81 3.175 11.468 -11.056 615 HA SER 81 HA SER 81 3.281 8.645 -12.216 616 HG SER 81 HG SER 81 6.524 9.152 -13.458 617 HB2 SER 81 2HB SER 81 4.344 10.475 -13.761 618 HB3 SER 81 1HB SER 81 5.540 10.748 -12.488 619 H VAL 82 H VAL 82 5.865 7.952 -11.457 620 HA VAL 82 HA VAL 82 5.687 7.687 -8.433 621 HB VAL 82 HB VAL 82 7.719 6.409 -10.348 622 HG11 VAL 82 1HG1 VAL 82 9.037 6.708 -8.350 623 HG12 VAL 82 2HG1 VAL 82 8.397 5.079 -8.198 624 HG13 VAL 82 3HG1 VAL 82 7.665 6.412 -7.275 625 HG21 VAL 82 3HG2 VAL 82 5.180 5.408 -8.955 626 HG22 VAL 82 1HG2 VAL 82 6.508 4.270 -9.146 627 HG23 VAL 82 2HG2 VAL 82 5.825 5.054 -10.581 628 H GLU 83 H GLU 83 8.527 8.856 -10.449 629 HA GLU 83 HA GLU 83 9.600 10.641 -8.787 630 HB2 GLU 83 2HB GLU 83 8.958 11.597 -11.607 631 HB3 GLU 83 1HB GLU 83 10.300 12.039 -10.594 632 HG2 GLU 83 2HG GLU 83 10.168 9.066 -11.374 633 HG3 GLU 83 1HG GLU 83 10.510 10.210 -12.644 634 H GLU 84 H GLU 84 6.423 11.630 -10.283 635 HA GLU 84 HA GLU 84 6.194 14.149 -8.702 636 HB2 GLU 84 2HB GLU 84 3.951 12.383 -9.801 637 HB3 GLU 84 1HB GLU 84 3.765 14.037 -9.303 638 HG2 GLU 84 2HG GLU 84 5.723 13.697 -11.615 639 HG3 GLU 84 1HG GLU 84 4.103 13.159 -11.948 640 H ALA 85 H ALA 85 5.569 10.869 -7.850 641 HA ALA 85 HA ALA 85 3.931 11.509 -5.376 642 HB1 ALA 85 3HB ALA 85 5.035 8.775 -6.291 643 HB2 ALA 85 1HB ALA 85 3.422 9.375 -6.744 644 HB3 ALA 85 2HB ALA 85 3.826 9.065 -5.036 645 H VAL 86 H VAL 86 7.277 10.642 -6.184 646 HA VAL 86 HA VAL 86 8.148 10.610 -3.287 647 HB VAL 86 HB VAL 86 9.553 10.066 -5.939 648 HG11 VAL 86 1HG1 VAL 86 11.724 9.756 -4.763 649 HG12 VAL 86 2HG1 VAL 86 11.041 10.477 -3.270 650 HG13 VAL 86 3HG1 VAL 86 11.218 11.453 -4.757 651 HG21 VAL 86 3HG2 VAL 86 10.111 7.877 -4.824 652 HG22 VAL 86 1HG2 VAL 86 8.361 8.143 -4.710 653 HG23 VAL 86 2HG2 VAL 86 9.399 8.435 -3.295 654 H ASP 87 H ASP 87 8.602 12.960 -6.059 655 HA ASP 87 HA ASP 87 9.645 15.053 -4.397 656 HB2 ASP 87 2HB ASP 87 8.363 14.949 -7.143 657 HB3 ASP 87 1HB ASP 87 8.160 16.473 -6.340 658 H ILE 88 H ILE 88 6.103 14.351 -4.855 659 HA ILE 88 HA ILE 88 5.548 16.670 -3.057 660 HB ILE 88 HB ILE 88 3.446 16.632 -2.971 661 HG12 ILE 88 2HG1 ILE 88 2.675 14.046 -4.391 662 HG13 ILE 88 1HG1 ILE 88 3.177 13.928 -2.737 663 HG21 ILE 88 1HG2 ILE 88 2.559 16.820 -5.265 664 HG22 ILE 88 2HG2 ILE 88 3.765 15.688 -5.871 665 HG23 ILE 88 3HG2 ILE 88 4.293 17.269 -5.294 666 HD11 ILE 88 3HD1 ILE 88 0.675 15.184 -3.761 667 HD12 ILE 88 1HD1 ILE 88 1.444 16.114 -2.430 668 HD13 ILE 88 2HD1 ILE 88 1.013 14.452 -2.176 669 H ALA 89 H ALA 89 6.001 13.278 -2.306 670 HA ALA 89 HA ALA 89 5.236 13.572 0.572 671 HB1 ALA 89 3HB ALA 89 7.084 11.551 -0.850 672 HB2 ALA 89 1HB ALA 89 5.369 11.310 -0.415 673 HB3 ALA 89 2HB ALA 89 6.595 11.475 0.861 674 H ALA 90 H ALA 90 8.443 13.786 -1.082 675 HA ALA 90 HA ALA 90 9.836 14.777 1.325 676 HB1 ALA 90 3HB ALA 90 11.007 13.584 -0.452 677 HB2 ALA 90 1HB ALA 90 11.687 15.226 -0.405 678 HB3 ALA 90 2HB ALA 90 10.537 14.781 -1.683 679 H SER 91 H SER 91 8.125 16.632 -1.143 680 HA SER 91 HA SER 91 8.959 19.317 -0.136 681 HG SER 91 HG SER 91 8.948 18.995 -2.464 682 HB2 SER 91 2HB SER 91 6.788 18.239 -1.978 683 HB3 SER 91 1HB SER 91 6.475 19.804 -1.260 684 H LEU 92 H LEU 92 6.749 17.077 1.333 685 HA LEU 92 HA LEU 92 5.440 19.361 2.855 686 HG LEU 92 HG LEU 92 4.876 15.990 1.494 687 HB2 LEU 92 2HB LEU 92 3.720 17.795 3.696 688 HB3 LEU 92 1HB LEU 92 3.715 18.336 2.046 689 HD11 LEU 92 1HD1 LEU 92 3.435 15.310 4.130 690 HD12 LEU 92 2HD1 LEU 92 5.184 15.195 3.812 691 HD13 LEU 92 3HD1 LEU 92 4.083 14.159 2.923 692 HD21 LEU 92 3HD2 LEU 92 2.620 16.718 0.633 693 HD22 LEU 92 1HD2 LEU 92 1.865 16.188 2.163 694 HD23 LEU 92 2HD2 LEU 92 2.635 15.007 1.075 695 H ASP 93 H ASP 93 6.662 16.202 4.006 696 HA ASP 93 HA ASP 93 8.982 17.135 5.164 697 HB2 ASP 93 2HB ASP 93 6.804 17.665 7.225 698 HB3 ASP 93 1HB ASP 93 8.238 16.883 7.821 699 H ALA 94 H ALA 94 9.592 15.037 4.393 700 HA ALA 94 HA ALA 94 9.364 12.846 6.416 701 HB1 ALA 94 3HB ALA 94 7.187 12.567 5.196 702 HB2 ALA 94 1HB ALA 94 8.234 11.165 4.928 703 HB3 ALA 94 2HB ALA 94 8.050 12.396 3.646 704 H GLU 95 H GLU 95 10.814 11.232 6.297 705 HA GLU 95 HA GLU 95 12.922 11.211 4.109 706 HB2 GLU 95 2HB GLU 95 13.278 9.187 6.287 707 HB3 GLU 95 1HB GLU 95 14.432 10.067 5.323 708 HG2 GLU 95 2HG GLU 95 14.000 12.142 6.835 709 HG3 GLU 95 1HG GLU 95 12.983 11.102 7.827 710 H THR 96 H THR 96 11.193 8.441 5.735 711 HA THR 96 HA THR 96 10.777 7.096 3.064 712 HB THR 96 HB THR 96 9.595 5.261 4.398 713 HG1 THR 96 HG1 THR 96 8.994 6.462 6.276 714 HG21 THR 96 3HG2 THR 96 12.001 5.028 3.833 715 HG22 THR 96 1HG2 THR 96 11.628 4.321 5.425 716 HG23 THR 96 2HG2 THR 96 12.446 5.896 5.321 717 H ALA 97 H ALA 97 8.798 6.328 2.287 718 HA ALA 97 HA ALA 97 6.216 7.345 3.553 719 HB1 ALA 97 3HB ALA 97 5.298 7.835 1.158 720 HB2 ALA 97 1HB ALA 97 6.961 7.686 0.556 721 HB3 ALA 97 2HB ALA 97 6.558 8.944 1.740 722 H TYR 98 H TYR 98 4.278 6.200 2.626 723 HA TYR 98 HA TYR 98 4.862 3.263 2.009 724 HD1 TYR 98 HD1 TYR 98 4.852 0.984 4.050 725 HD2 TYR 98 HD2 TYR 98 4.885 4.960 5.616 726 HE1 TYR 98 HE1 TYR 98 6.758 0.404 5.502 727 HE2 TYR 98 HE2 TYR 98 6.739 4.349 7.115 728 HH TYR 98 HH TYR 98 8.427 2.785 7.413 729 HB2 TYR 98 2HB TYR 98 2.991 4.257 4.243 730 HB3 TYR 98 1HB TYR 98 2.926 2.626 3.624 731 H VAL 99 H VAL 99 2.749 2.070 1.449 732 HA VAL 99 HA VAL 99 0.874 3.771 -0.278 733 HB VAL 99 HB VAL 99 1.744 3.346 -2.178 734 HG11 VAL 99 1HG1 VAL 99 3.983 3.299 -1.261 735 HG12 VAL 99 2HG1 VAL 99 3.857 2.438 -2.779 736 HG13 VAL 99 3HG1 VAL 99 4.002 1.563 -1.264 737 HG21 VAL 99 3HG2 VAL 99 1.443 0.372 -2.017 738 HG22 VAL 99 1HG2 VAL 99 1.859 1.269 -3.481 739 HG23 VAL 99 2HG2 VAL 99 0.295 1.549 -2.668 740 H ILE 100 H ILE 100 -1.167 3.170 0.757 741 HA ILE 100 HA ILE 100 -1.790 0.470 1.284 742 HB ILE 100 HB ILE 100 -4.123 2.212 0.413 743 HG12 ILE 100 2HG1 ILE 100 -3.355 3.600 2.114 744 HG13 ILE 100 1HG1 ILE 100 -4.442 2.552 2.951 745 HG21 ILE 100 1HG2 ILE 100 -4.617 -0.266 0.707 746 HG22 ILE 100 2HG2 ILE 100 -5.444 0.715 1.927 747 HG23 ILE 100 3HG2 ILE 100 -3.962 -0.168 2.352 748 HD11 ILE 100 3HD1 ILE 100 -2.582 1.226 3.949 749 HD12 ILE 100 1HD1 ILE 100 -2.312 2.993 4.255 750 HD13 ILE 100 2HD1 ILE 100 -1.354 2.143 3.034 751 H GLY 101 H GLY 101 -2.479 1.891 -1.739 752 HA2 GLY 101 2HA GLY 101 -2.682 0.948 -3.938 753 HA3 GLY 101 1HA GLY 101 -1.581 -0.220 -3.329 754 H GLY 102 H GLY 102 -3.207 -2.559 -4.690 755 HA2 GLY 102 2HA GLY 102 -4.797 -0.131 -5.618 756 HA3 GLY 102 1HA GLY 102 -3.145 -0.092 -6.126 757 H ALA 103 H ALA 103 -6.198 -1.605 -6.891 758 HA ALA 103 HA ALA 103 -5.969 -2.791 -9.279 759 HB1 ALA 103 3HB ALA 103 -7.294 0.061 -9.142 760 HB2 ALA 103 1HB ALA 103 -8.004 -1.362 -8.435 761 HB3 ALA 103 2HB ALA 103 -7.792 -1.260 -10.163 762 H ALA 104 H ALA 104 -4.760 0.520 -9.264 763 HA ALA 104 HA ALA 104 -2.978 -0.196 -11.659 764 HB1 ALA 104 3HB ALA 104 -3.784 2.624 -10.764 765 HB2 ALA 104 1HB ALA 104 -4.389 1.758 -12.218 766 HB3 ALA 104 2HB ALA 104 -2.664 2.212 -12.093 767 H ILE 105 H ILE 105 -2.918 0.680 -8.228 768 HA ILE 105 HA ILE 105 -0.338 2.069 -8.392 769 HB ILE 105 HB ILE 105 -1.418 1.189 -5.734 770 HG12 ILE 105 2HG1 ILE 105 -3.455 2.147 -6.489 771 HG13 ILE 105 1HG1 ILE 105 -2.639 3.308 -5.524 772 HG21 ILE 105 1HG2 ILE 105 0.062 3.784 -6.409 773 HG22 ILE 105 2HG2 ILE 105 0.809 2.332 -5.717 774 HG23 ILE 105 3HG2 ILE 105 -0.446 3.172 -4.820 775 HD11 ILE 105 3HD1 ILE 105 -1.867 3.818 -8.358 776 HD12 ILE 105 1HD1 ILE 105 -2.894 4.835 -7.315 777 HD13 ILE 105 2HD1 ILE 105 -3.626 3.512 -8.270 778 H TYR 106 H TYR 106 -0.880 -0.885 -6.377 779 HA TYR 106 HA TYR 106 1.915 -1.722 -6.233 780 HD1 TYR 106 HD1 TYR 106 2.423 -4.624 -5.050 781 HD2 TYR 106 HD2 TYR 106 -0.729 -2.151 -3.446 782 HE1 TYR 106 HE1 TYR 106 3.083 -5.207 -2.787 783 HE2 TYR 106 HE2 TYR 106 -0.007 -2.739 -1.155 784 HH TYR 106 HH TYR 106 2.170 -3.909 0.027 785 HB2 TYR 106 2HB TYR 106 -0.824 -3.017 -5.809 786 HB3 TYR 106 1HB TYR 106 0.392 -4.110 -6.335 787 H ALA 107 H ALA 107 -0.384 -2.300 -8.899 788 HA ALA 107 HA ALA 107 1.490 -3.943 -10.542 789 HB1 ALA 107 3HB ALA 107 -1.094 -2.370 -11.193 790 HB2 ALA 107 1HB ALA 107 -0.992 -4.090 -10.766 791 HB3 ALA 107 2HB ALA 107 -0.319 -3.515 -12.299 792 H LEU 108 H LEU 108 1.303 -0.500 -10.109 793 HA LEU 108 HA LEU 108 3.339 -0.156 -12.371 794 HG LEU 108 HG LEU 108 2.077 2.331 -9.879 795 HB2 LEU 108 2HB LEU 108 2.722 1.933 -12.820 796 HB3 LEU 108 1HB LEU 108 1.180 1.320 -12.325 797 HD11 LEU 108 1HD1 LEU 108 3.320 4.390 -10.182 798 HD12 LEU 108 2HD1 LEU 108 3.114 4.399 -11.940 799 HD13 LEU 108 3HD1 LEU 108 4.203 3.229 -11.171 800 HD21 LEU 108 3HD2 LEU 108 -0.145 2.891 -10.794 801 HD22 LEU 108 1HD2 LEU 108 0.605 3.889 -12.083 802 HD23 LEU 108 2HD2 LEU 108 0.703 4.379 -10.377 803 H PHE 109 H PHE 109 2.951 0.421 -8.878 804 HA PHE 109 HA PHE 109 5.771 1.272 -8.504 805 HD1 PHE 109 HD2 PHE 109 6.797 2.335 -6.192 806 HD2 PHE 109 HD1 PHE 109 2.610 3.055 -6.855 807 HE1 PHE 109 HE2 PHE 109 7.155 4.715 -5.848 808 HE2 PHE 109 HE1 PHE 109 2.986 5.457 -6.390 809 HZ PHE 109 HZ PHE 109 5.261 6.297 -5.934 810 HB2 PHE 109 2HB PHE 109 3.362 0.764 -6.673 811 HB3 PHE 109 1HB PHE 109 4.881 0.491 -5.934 812 H GLN 110 H GLN 110 4.560 -1.998 -8.678 813 HA GLN 110 HA GLN 110 6.316 -3.359 -6.968 814 HB2 GLN 110 2HB GLN 110 6.283 -5.340 -8.566 815 HB3 GLN 110 1HB GLN 110 4.849 -4.749 -7.798 816 HG2 GLN 110 2HG GLN 110 3.784 -4.969 -9.735 817 HG3 GLN 110 1HG GLN 110 4.458 -3.448 -10.188 818 HE21 GLN 110 1HE2 GLN 110 5.179 -6.939 -10.354 819 HE22 GLN 110 2HE2 GLN 110 5.937 -6.774 -12.019 820 HA PRO 111 HA PRO 111 10.507 -3.139 -9.282 821 HB2 PRO 111 2HB PRO 111 10.500 -1.149 -11.433 822 HB3 PRO 111 1HB PRO 111 10.741 -2.898 -11.536 823 HG2 PRO 111 2HG PRO 111 8.468 -1.561 -12.584 824 HG3 PRO 111 1HG PRO 111 8.557 -3.302 -12.202 825 HD2 PRO 111 2HD PRO 111 7.426 -1.050 -10.457 826 HD3 PRO 111 1HD PRO 111 6.714 -2.633 -10.793 827 H HIS 112 H HIS 112 8.637 -0.473 -8.314 828 HA HIS 112 HA HIS 112 11.093 1.354 -7.882 829 HD1 HIS 112 HD1 HIS 112 11.282 2.280 -10.461 830 HD2 HIS 112 HD2 HIS 112 7.028 2.263 -10.345 831 HE1 HIS 112 HE1 HIS 112 10.328 2.250 -12.864 832 HB2 HIS 112 2HB HIS 112 8.226 2.387 -7.985 833 HB3 HIS 112 1HB HIS 112 9.726 3.273 -8.067 834 H LEU 113 H LEU 113 9.174 -0.624 -5.916 835 HA LEU 113 HA LEU 113 9.191 1.126 -3.509 836 HG LEU 113 HG LEU 113 6.773 -1.124 -2.248 837 HB2 LEU 113 2HB LEU 113 8.936 -1.950 -3.827 838 HB3 LEU 113 1HB LEU 113 8.890 -1.163 -2.279 839 HD11 LEU 113 1HD1 LEU 113 5.412 0.558 -3.517 840 HD12 LEU 113 2HD1 LEU 113 6.779 0.791 -4.631 841 HD13 LEU 113 3HD1 LEU 113 6.933 1.256 -2.923 842 HD21 LEU 113 3HD2 LEU 113 6.705 -2.987 -3.812 843 HD22 LEU 113 1HD2 LEU 113 6.717 -1.893 -5.228 844 HD23 LEU 113 2HD2 LEU 113 5.314 -1.929 -4.108 845 H ASP 114 H ASP 114 10.504 1.097 -1.659 846 HA ASP 114 HA ASP 114 13.055 -0.482 -1.451 847 HB2 ASP 114 2HB ASP 114 12.886 1.535 -0.086 848 HB3 ASP 114 1HB ASP 114 11.390 1.023 0.644 849 H ARG 115 H ARG 115 9.895 -0.941 0.261 850 HA ARG 115 HA ARG 115 10.294 -3.961 -0.030 851 HE ARG 115 HE ARG 115 13.028 -1.805 3.329 852 HB2 ARG 115 2HB ARG 115 9.648 -2.225 2.388 853 HB3 ARG 115 1HB ARG 115 9.107 -3.897 2.430 854 HG2 ARG 115 2HG ARG 115 11.341 -4.773 2.460 855 HG3 ARG 115 1HG ARG 115 12.008 -3.305 1.789 856 HD2 ARG 115 2HD ARG 115 10.826 -2.374 4.241 857 HD3 ARG 115 1HD ARG 115 11.332 -4.001 4.692 858 HH11 ARG 115 2HH1 ARG 115 12.967 -4.417 5.725 859 HH12 ARG 115 1HH1 ARG 115 14.602 -3.991 6.305 860 HH21 ARG 115 1HH2 ARG 115 14.841 -1.420 4.018 861 HH22 ARG 115 2HH2 ARG 115 15.610 -2.281 5.467 862 H MET 116 H MET 116 8.616 -5.338 0.032 863 HA MET 116 HA MET 116 5.844 -4.272 -0.749 864 HB2 MET 116 2HB MET 116 7.608 -6.035 -2.052 865 HB3 MET 116 1HB MET 116 6.524 -7.156 -1.238 866 HG2 MET 116 2HG MET 116 4.700 -6.607 -2.503 867 HG3 MET 116 1HG MET 116 5.277 -4.954 -2.918 868 HE1 MET 116 3HE MET 116 4.675 -5.671 -5.598 869 HE2 MET 116 1HE MET 116 4.139 -7.223 -4.869 870 HE3 MET 116 2HE MET 116 5.264 -7.229 -6.260 871 H VAL 117 H VAL 117 5.455 -3.855 1.543 872 HA VAL 117 HA VAL 117 4.877 -6.009 3.462 873 HB VAL 117 HB VAL 117 4.027 -3.078 3.329 874 HG11 VAL 117 1HG1 VAL 117 2.317 -4.345 4.734 875 HG12 VAL 117 2HG1 VAL 117 3.294 -3.225 5.695 876 HG13 VAL 117 3HG1 VAL 117 3.641 -4.975 5.737 877 HG21 VAL 117 3HG2 VAL 117 6.034 -4.553 5.157 878 HG22 VAL 117 1HG2 VAL 117 5.706 -2.805 5.195 879 HG23 VAL 117 2HG2 VAL 117 6.482 -3.551 3.774 880 H LEU 118 H LEU 118 3.498 -7.548 3.159 881 HA LEU 118 HA LEU 118 0.722 -7.041 1.933 882 HG LEU 118 HG LEU 118 -0.202 -9.325 0.985 883 HB2 LEU 118 2HB LEU 118 2.082 -7.979 0.226 884 HB3 LEU 118 1HB LEU 118 2.839 -9.163 1.265 885 HD11 LEU 118 1HD1 LEU 118 0.306 -9.063 -1.322 886 HD12 LEU 118 2HD1 LEU 118 0.128 -10.791 -1.076 887 HD13 LEU 118 3HD1 LEU 118 1.765 -10.096 -1.278 888 HD21 LEU 118 3HD2 LEU 118 0.203 -11.702 1.210 889 HD22 LEU 118 1HD2 LEU 118 1.228 -10.921 2.438 890 HD23 LEU 118 2HD2 LEU 118 1.959 -11.531 0.938 891 H SER 119 H SER 119 -0.949 -7.980 2.892 892 HA SER 119 HA SER 119 -0.531 -9.599 5.504 893 HG SER 119 HG SER 119 -0.763 -7.694 7.042 894 HB2 SER 119 2HB SER 119 -2.364 -7.265 4.752 895 HB3 SER 119 1HB SER 119 -2.743 -8.290 6.103 896 H ARG 120 H ARG 120 -0.763 -11.643 4.823 897 HA ARG 120 HA ARG 120 -2.711 -12.401 2.696 898 HE ARG 120 HE ARG 120 2.033 -14.919 1.404 899 HB2 ARG 120 2HB ARG 120 -1.596 -14.816 3.861 900 HB3 ARG 120 1HB ARG 120 -1.450 -14.172 2.250 901 HG2 ARG 120 2HG ARG 120 0.667 -12.988 2.882 902 HG3 ARG 120 1HG ARG 120 0.446 -13.402 4.547 903 HD2 ARG 120 2HD ARG 120 2.129 -14.823 3.794 904 HD3 ARG 120 1HD ARG 120 0.767 -15.863 4.014 905 HH11 ARG 120 2HH1 ARG 120 -0.501 -16.793 2.802 906 HH12 ARG 120 1HH1 ARG 120 -0.746 -17.812 1.304 907 HH21 ARG 120 1HH2 ARG 120 1.780 -16.055 -0.280 908 HH22 ARG 120 2HH2 ARG 120 0.539 -17.394 -0.387 909 H VAL 121 H VAL 121 -4.793 -12.586 3.214 910 HA VAL 121 HA VAL 121 -5.672 -13.330 5.984 911 HB VAL 121 HB VAL 121 -7.378 -12.112 3.779 912 HG11 VAL 121 1HG1 VAL 121 -7.639 -12.009 6.853 913 HG12 VAL 121 2HG1 VAL 121 -8.700 -12.927 5.757 914 HG13 VAL 121 3HG1 VAL 121 -8.689 -11.158 5.730 915 HG21 VAL 121 3HG2 VAL 121 -5.294 -10.684 5.463 916 HG22 VAL 121 1HG2 VAL 121 -6.857 -9.866 5.269 917 HG23 VAL 121 2HG2 VAL 121 -5.925 -10.329 3.863 918 HA PRO 122 HA PRO 122 -7.469 -17.288 4.229 919 HB2 PRO 122 2HB PRO 122 -7.893 -17.930 7.166 920 HB3 PRO 122 1HB PRO 122 -7.116 -18.887 5.893 921 HG2 PRO 122 2HG PRO 122 -5.594 -17.660 7.812 922 HG3 PRO 122 1HG PRO 122 -5.039 -17.637 6.113 923 HD2 PRO 122 2HD PRO 122 -6.541 -15.388 7.580 924 HD3 PRO 122 1HD PRO 122 -5.035 -15.335 6.599 925 H GLY 123 H GLY 123 -9.199 -15.097 4.185 926 HA2 GLY 123 2HA GLY 123 -11.911 -16.334 5.073 927 HA3 GLY 123 1HA GLY 123 -11.745 -14.645 4.779 928 H GLU 124 H GLU 124 -10.166 -16.159 2.382 929 HA GLU 124 HA GLU 124 -10.525 -16.553 0.046 930 HB2 GLU 124 2HB GLU 124 -12.293 -18.455 1.635 931 HB3 GLU 124 1HB GLU 124 -11.921 -18.695 -0.059 932 HG2 GLU 124 2HG GLU 124 -9.560 -19.023 0.329 933 HG3 GLU 124 1HG GLU 124 -9.631 -18.400 1.970 934 H TYR 125 H TYR 125 -11.245 -15.052 -1.411 935 HA TYR 125 HA TYR 125 -14.249 -14.653 -1.765 936 HD1 TYR 125 HD2 TYR 125 -15.430 -13.098 0.660 937 HD2 TYR 125 HD1 TYR 125 -11.247 -12.165 0.420 938 HE1 TYR 125 HE2 TYR 125 -15.325 -12.835 3.121 939 HE2 TYR 125 HE1 TYR 125 -11.138 -12.045 2.861 940 HH TYR 125 HH TYR 125 -12.244 -12.148 4.728 941 HB2 TYR 125 2HB TYR 125 -12.467 -12.158 -1.567 942 HB3 TYR 125 1HB TYR 125 -14.197 -12.231 -1.595 943 H GLU 126 H GLU 126 -14.576 -14.912 -4.030 944 HA GLU 126 HA GLU 126 -13.131 -14.434 -6.149 945 HB2 GLU 126 2HB GLU 126 -15.885 -13.167 -6.498 946 HB3 GLU 126 1HB GLU 126 -14.928 -14.127 -7.600 947 HG2 GLU 126 2HG GLU 126 -16.460 -15.268 -5.171 948 HG3 GLU 126 1HG GLU 126 -17.000 -15.280 -6.845 949 H GLY 127 H GLY 127 -14.567 -11.588 -4.722 950 HA2 GLY 127 2HA GLY 127 -13.782 -9.274 -4.678 951 HA3 GLY 127 1HA GLY 127 -12.331 -9.870 -5.451 952 H ASP 128 H ASP 128 -13.327 -7.346 -5.770 953 HA ASP 128 HA ASP 128 -13.616 -7.309 -8.833 954 HB2 ASP 128 2HB ASP 128 -14.606 -5.191 -6.814 955 HB3 ASP 128 1HB ASP 128 -14.479 -4.928 -8.541 956 H THR 129 H THR 129 -11.808 -5.864 -6.114 957 HA THR 129 HA THR 129 -9.746 -4.691 -7.967 958 HB THR 129 HB THR 129 -9.312 -5.022 -4.964 959 HG1 THR 129 HG1 THR 129 -10.587 -3.442 -4.455 960 HG21 THR 129 3HG2 THR 129 -8.824 -2.545 -6.725 961 HG22 THR 129 1HG2 THR 129 -7.581 -3.808 -6.549 962 HG23 THR 129 2HG2 THR 129 -8.134 -2.888 -5.116 963 H TYR 130 H TYR 130 -8.071 -5.907 -8.721 964 HA TYR 130 HA TYR 130 -7.050 -8.336 -7.183 965 HD1 TYR 130 HD1 TYR 130 -9.680 -7.482 -9.872 966 HD2 TYR 130 HD2 TYR 130 -7.460 -11.034 -8.880 967 HE1 TYR 130 HE1 TYR 130 -11.744 -8.824 -9.990 968 HE2 TYR 130 HE2 TYR 130 -9.526 -12.364 -9.114 969 HH TYR 130 HH TYR 130 -12.240 -11.528 -8.732 970 HB2 TYR 130 2HB TYR 130 -7.045 -7.624 -10.173 971 HB3 TYR 130 1HB TYR 130 -6.237 -9.013 -9.490 972 H TYR 131 H TYR 131 -5.103 -8.569 -6.490 973 HA TYR 131 HA TYR 131 -3.020 -6.436 -6.735 974 HD1 TYR 131 HD2 TYR 131 -0.852 -9.664 -5.516 975 HD2 TYR 131 HD1 TYR 131 -2.076 -6.261 -3.222 976 HE1 TYR 131 HE2 TYR 131 1.430 -9.462 -4.633 977 HE2 TYR 131 HE1 TYR 131 0.137 -6.222 -2.157 978 HH TYR 131 HH TYR 131 2.337 -6.902 -2.370 979 HB2 TYR 131 2HB TYR 131 -3.696 -7.483 -4.576 980 HB3 TYR 131 1HB TYR 131 -3.279 -9.052 -5.087 981 HA PRO 132 HA PRO 132 -0.537 -8.660 -9.909 982 HB2 PRO 132 2HB PRO 132 2.049 -7.554 -8.914 983 HB3 PRO 132 1HB PRO 132 1.147 -7.136 -10.376 984 HG2 PRO 132 2HG PRO 132 1.384 -5.419 -8.210 985 HG3 PRO 132 1HG PRO 132 -0.028 -5.407 -9.282 986 HD2 PRO 132 2HD PRO 132 0.190 -6.711 -6.543 987 HD3 PRO 132 1HD PRO 132 -1.121 -5.721 -7.246 988 H GLU 133 H GLU 133 1.422 -10.059 -10.343 989 HA GLU 133 HA GLU 133 1.636 -12.222 -8.302 990 HB2 GLU 133 2HB GLU 133 2.891 -13.495 -9.972 991 HB3 GLU 133 1HB GLU 133 1.309 -12.964 -10.480 992 HG2 GLU 133 2HG GLU 133 2.856 -10.989 -11.705 993 HG3 GLU 133 1HG GLU 133 4.046 -12.281 -11.607 994 H TRP 134 H TRP 134 3.542 -13.063 -7.472 995 HA TRP 134 HA TRP 134 5.696 -11.009 -6.774 996 HD1 TRP 134 HD1 TRP 134 5.259 -15.221 -5.476 997 HE1 TRP 134 HE1 TRP 134 3.020 -16.528 -4.996 998 HE3 TRP 134 HE3 TRP 134 2.600 -11.241 -3.722 999 HZ2 TRP 134 HZ2 TRP 134 0.524 -15.789 -3.888 1000 HZ3 TRP 134 HZ3 TRP 134 0.234 -11.569 -3.143 1001 HH2 TRP 134 HH2 TRP 134 -0.797 -13.813 -3.189 1002 HB2 TRP 134 2HB TRP 134 6.095 -12.368 -4.629 1003 HB3 TRP 134 1HB TRP 134 4.704 -11.343 -4.697 1004 H ASP 135 H ASP 135 7.823 -11.542 -7.025 1005 HA ASP 135 HA ASP 135 8.381 -14.111 -8.557 1006 HB2 ASP 135 2HB ASP 135 8.645 -11.462 -9.394 1007 HB3 ASP 135 1HB ASP 135 10.200 -11.658 -8.617 1008 H ALA 136 H ALA 136 11.060 -14.051 -8.453 1009 HA ALA 136 HA ALA 136 11.877 -14.401 -5.481 1010 HB1 ALA 136 3HB ALA 136 11.246 -16.623 -6.504 1011 HB2 ALA 136 1HB ALA 136 12.968 -16.585 -6.047 1012 HB3 ALA 136 2HB ALA 136 12.493 -16.414 -7.766 1013 H ALA 137 H ALA 137 13.024 -13.376 -8.573 1014 HA ALA 137 HA ALA 137 15.700 -12.597 -7.274 1015 HB1 ALA 137 3HB ALA 137 15.139 -12.934 -10.290 1016 HB2 ALA 137 1HB ALA 137 16.088 -14.030 -9.246 1017 HB3 ALA 137 2HB ALA 137 16.661 -12.373 -9.562 1018 H GLU 138 H GLU 138 12.807 -11.109 -8.710 1019 HA GLU 138 HA GLU 138 13.882 -8.347 -8.558 1020 HB2 GLU 138 2HB GLU 138 11.033 -9.491 -8.502 1021 HB3 GLU 138 1HB GLU 138 11.420 -7.801 -8.447 1022 HG2 GLU 138 2HG GLU 138 12.302 -9.481 -10.851 1023 HG3 GLU 138 1HG GLU 138 10.743 -8.687 -10.732 1024 H TRP 139 H TRP 139 11.881 -10.199 -6.184 1025 HA TRP 139 HA TRP 139 13.066 -8.552 -3.896 1026 HD1 TRP 139 HD1 TRP 139 8.773 -10.422 -4.297 1027 HE1 TRP 139 HE1 TRP 139 7.206 -9.996 -6.448 1028 HE3 TRP 139 HE3 TRP 139 11.002 -6.147 -5.829 1029 HZ2 TRP 139 HZ2 TRP 139 7.395 -8.196 -8.604 1030 HZ3 TRP 139 HZ3 TRP 139 10.332 -5.133 -7.990 1031 HH2 TRP 139 HH2 TRP 139 8.577 -6.148 -9.364 1032 HB2 TRP 139 2HB TRP 139 10.561 -8.678 -2.870 1033 HB3 TRP 139 1HB TRP 139 11.182 -7.351 -3.786 1034 H GLU 140 H GLU 140 13.548 -9.535 -2.077 1035 HA GLU 140 HA GLU 140 12.826 -12.483 -1.706 1036 HB2 GLU 140 2HB GLU 140 14.835 -12.929 -0.779 1037 HB3 GLU 140 1HB GLU 140 15.307 -11.715 -1.928 1038 HG2 GLU 140 2HG GLU 140 15.336 -10.020 0.116 1039 HG3 GLU 140 1HG GLU 140 15.059 -11.419 1.152 1040 H LEU 141 H LEU 141 13.218 -12.670 1.121 1041 HA LEU 141 HA LEU 141 10.590 -11.369 2.032 1042 HG LEU 141 HG LEU 141 9.315 -14.585 3.421 1043 HB2 LEU 141 2HB LEU 141 11.027 -14.079 1.773 1044 HB3 LEU 141 1HB LEU 141 11.581 -13.860 3.402 1045 HD11 LEU 141 1HD1 LEU 141 9.000 -11.594 4.057 1046 HD12 LEU 141 2HD1 LEU 141 9.751 -12.762 5.147 1047 HD13 LEU 141 3HD1 LEU 141 8.046 -12.944 4.687 1048 HD21 LEU 141 3HD2 LEU 141 7.455 -13.715 2.197 1049 HD22 LEU 141 1HD2 LEU 141 8.767 -13.796 1.009 1050 HD23 LEU 141 2HD2 LEU 141 8.314 -12.238 1.728 1051 H ASP 142 H ASP 142 10.962 -9.799 3.488 1052 HA ASP 142 HA ASP 142 13.516 -9.492 5.067 1053 HB2 ASP 142 2HB ASP 142 12.336 -7.616 3.750 1054 HB3 ASP 142 1HB ASP 142 11.021 -7.683 4.917 1055 H ALA 143 H ALA 143 9.959 -9.575 5.836 1056 HA ALA 143 HA ALA 143 10.584 -11.191 8.355 1057 HB1 ALA 143 3HB ALA 143 8.970 -8.536 8.367 1058 HB2 ALA 143 1HB ALA 143 10.642 -8.713 8.941 1059 HB3 ALA 143 2HB ALA 143 9.318 -9.561 9.783 1060 H GLU 144 H GLU 144 9.236 -12.865 8.592 1061 HA GLU 144 HA GLU 144 6.304 -12.597 7.733 1062 HB2 GLU 144 2HB GLU 144 7.926 -14.358 6.648 1063 HB3 GLU 144 1HB GLU 144 7.670 -15.310 8.106 1064 HG2 GLU 144 2HG GLU 144 5.188 -15.355 7.663 1065 HG3 GLU 144 1HG GLU 144 5.353 -14.146 6.406 1066 H THR 145 H THR 145 4.855 -12.321 9.296 1067 HA THR 145 HA THR 145 5.010 -14.027 11.760 1068 HB THR 145 HB THR 145 6.297 -12.085 12.498 1069 HG1 THR 145 HG1 THR 145 3.816 -12.664 13.721 1070 HG21 THR 145 3HG2 THR 145 3.759 -10.418 12.024 1071 HG22 THR 145 1HG2 THR 145 5.462 -10.008 11.727 1072 HG23 THR 145 2HG2 THR 145 4.861 -10.042 13.379 1073 H ASP 146 H ASP 146 3.150 -14.756 12.562 1074 HA ASP 146 HA ASP 146 0.598 -14.354 11.567 1075 HB2 ASP 146 2HB ASP 146 1.386 -15.089 14.461 1076 HB3 ASP 146 1HB ASP 146 -0.182 -15.400 13.741 1077 H HIS 147 H HIS 147 -1.147 -13.066 11.880 1078 HA HIS 147 HA HIS 147 -1.254 -10.957 14.095 1079 HD1 HIS 147 HD1 HIS 147 1.191 -10.467 13.372 1080 HD2 HIS 147 HD2 HIS 147 -0.931 -7.241 11.572 1081 HE1 HIS 147 HE1 HIS 147 2.696 -8.368 13.249 1082 HB2 HIS 147 2HB HIS 147 -1.231 -10.533 11.056 1083 HB3 HIS 147 1HB HIS 147 -2.304 -9.534 11.968 1084 H GLU 148 H GLU 148 -3.787 -9.861 13.530 1085 HA GLU 148 HA GLU 148 -5.241 -11.865 15.106 1086 HB2 GLU 148 2HB GLU 148 -6.236 -9.184 13.987 1087 HB3 GLU 148 1HB GLU 148 -7.212 -10.190 15.002 1088 HG2 GLU 148 2HG GLU 148 -4.623 -9.662 16.402 1089 HG3 GLU 148 1HG GLU 148 -5.371 -8.178 15.841 1090 H GLY 149 H GLY 149 -6.089 -10.710 11.830 1091 HA2 GLY 149 2HA GLY 149 -7.818 -13.253 11.424 1092 HA3 GLY 149 1HA GLY 149 -8.129 -11.768 10.561 1093 H PHE 150 H PHE 150 -4.719 -12.665 10.869 1094 HA PHE 150 HA PHE 150 -4.477 -13.781 8.126 1095 HD1 PHE 150 HD1 PHE 150 -1.786 -10.601 7.749 1096 HD2 PHE 150 HD2 PHE 150 -5.709 -9.661 9.183 1097 HE1 PHE 150 HE1 PHE 150 -0.928 -8.491 8.703 1098 HE2 PHE 150 HE2 PHE 150 -4.872 -7.537 10.070 1099 HZ PHE 150 HZ PHE 150 -2.486 -6.928 9.837 1100 HB2 PHE 150 2HB PHE 150 -3.825 -11.805 6.898 1101 HB3 PHE 150 1HB PHE 150 -5.372 -11.516 7.599 1102 H THR 151 H THR 151 -2.212 -13.621 7.221 1103 HA THR 151 HA THR 151 -0.079 -13.357 9.423 1104 HB THR 151 HB THR 151 0.201 -15.521 8.951 1105 HG1 THR 151 HG1 THR 151 2.168 -14.452 8.548 1106 HG21 THR 151 3HG2 THR 151 -0.252 -15.127 5.949 1107 HG22 THR 151 1HG2 THR 151 -1.275 -16.050 7.072 1108 HG23 THR 151 2HG2 THR 151 0.361 -16.627 6.687 1109 H LEU 152 H LEU 152 1.273 -11.808 9.316 1110 HA LEU 152 HA LEU 152 1.339 -9.726 7.147 1111 HG LEU 152 HG LEU 152 3.087 -7.724 9.975 1112 HB2 LEU 152 2HB LEU 152 1.297 -9.046 9.472 1113 HB3 LEU 152 1HB LEU 152 2.584 -10.117 9.917 1114 HD11 LEU 152 1HD1 LEU 152 5.065 -9.049 8.047 1115 HD12 LEU 152 2HD1 LEU 152 4.864 -9.668 9.675 1116 HD13 LEU 152 3HD1 LEU 152 5.401 -7.990 9.430 1117 HD21 LEU 152 3HD2 LEU 152 1.965 -6.980 7.831 1118 HD22 LEU 152 1HD2 LEU 152 3.273 -7.736 6.897 1119 HD23 LEU 152 2HD2 LEU 152 3.628 -6.396 8.011 1120 H GLN 153 H GLN 153 2.666 -9.824 5.510 1121 HA GLN 153 HA GLN 153 5.386 -11.257 5.625 1122 HB2 GLN 153 2HB GLN 153 3.157 -11.405 3.564 1123 HB3 GLN 153 1HB GLN 153 4.670 -10.904 2.853 1124 HG2 GLN 153 2HG GLN 153 5.834 -12.924 3.842 1125 HG3 GLN 153 1HG GLN 153 4.313 -13.452 4.551 1126 HE21 GLN 153 1HE2 GLN 153 5.518 -15.160 3.067 1127 HE22 GLN 153 2HE2 GLN 153 4.922 -15.169 1.318 1128 H GLU 154 H GLU 154 7.015 -9.856 5.450 1129 HA GLU 154 HA GLU 154 6.664 -7.232 3.867 1130 HB2 GLU 154 2HB GLU 154 8.777 -7.650 6.038 1131 HB3 GLU 154 1HB GLU 154 8.282 -6.171 5.260 1132 HG2 GLU 154 2HG GLU 154 5.883 -6.677 6.389 1133 HG3 GLU 154 1HG GLU 154 6.794 -7.813 7.350 1134 H TRP 155 H TRP 155 7.596 -7.420 1.901 1135 HA TRP 155 HA TRP 155 10.023 -9.247 1.520 1136 HD1 TRP 155 HD1 TRP 155 5.978 -9.281 0.950 1137 HE1 TRP 155 HE1 TRP 155 4.726 -11.467 0.158 1138 HE3 TRP 155 HE3 TRP 155 9.844 -11.215 -1.756 1139 HZ2 TRP 155 HZ2 TRP 155 5.455 -13.618 -1.500 1140 HZ3 TRP 155 HZ3 TRP 155 9.456 -13.283 -3.055 1141 HH2 TRP 155 HH2 TRP 155 7.290 -14.450 -2.952 1142 HB2 TRP 155 2HB TRP 155 8.171 -8.018 -0.553 1143 HB3 TRP 155 1HB TRP 155 9.459 -9.082 -0.922 1144 H VAL 156 H VAL 156 12.075 -8.300 1.416 1145 HA VAL 156 HA VAL 156 12.330 -5.425 0.497 1146 HB VAL 156 HB VAL 156 13.403 -6.060 2.587 1147 HG11 VAL 156 1HG1 VAL 156 14.220 -8.359 2.159 1148 HG12 VAL 156 2HG1 VAL 156 15.577 -7.326 2.644 1149 HG13 VAL 156 3HG1 VAL 156 15.360 -7.773 0.925 1150 HG21 VAL 156 3HG2 VAL 156 15.510 -5.100 0.574 1151 HG22 VAL 156 1HG2 VAL 156 15.453 -4.807 2.336 1152 HG23 VAL 156 2HG2 VAL 156 14.246 -4.064 1.273 1153 H ARG 157 H ARG 157 13.025 -4.694 -1.341 1154 HA ARG 157 HA ARG 157 13.538 -6.222 -3.726 1155 HE ARG 157 HE ARG 157 14.702 -3.860 -6.758 1156 HB2 ARG 157 2HB ARG 157 13.762 -3.337 -2.892 1157 HB3 ARG 157 1HB ARG 157 14.963 -3.740 -4.068 1158 HG2 ARG 157 2HG ARG 157 12.826 -4.886 -5.396 1159 HG3 ARG 157 1HG ARG 157 11.928 -3.844 -4.298 1160 HD2 ARG 157 2HD ARG 157 12.174 -2.545 -6.270 1161 HD3 ARG 157 1HD ARG 157 13.311 -1.864 -5.086 1162 HH11 ARG 157 2HH1 ARG 157 13.415 -0.670 -6.962 1163 HH12 ARG 157 1HH1 ARG 157 14.805 -0.016 -7.929 1164 HH21 ARG 157 1HH2 ARG 157 16.283 -3.164 -7.852 1165 HH22 ARG 157 2HH2 ARG 157 16.389 -1.411 -8.407 1166 H SER 158 H SER 158 15.182 -6.689 -4.983 1167 HA SER 158 HA SER 158 16.954 -8.424 -4.103 1168 HG SER 158 HG SER 158 18.117 -5.970 -6.223 1169 HB2 SER 158 2HB SER 158 17.973 -8.426 -6.359 1170 HB3 SER 158 1HB SER 158 16.256 -8.107 -6.457 1171 H ALA 159 H ALA 159 18.343 -8.072 -2.398 1172 HA ALA 159 HA ALA 159 20.407 -6.104 -2.231 1173 HB1 ALA 159 3HB ALA 159 19.225 -7.342 -0.369 1174 HB2 ALA 159 1HB ALA 159 20.996 -7.306 -0.161 1175 HB3 ALA 159 2HB ALA 159 20.187 -8.794 -0.726 1176 H SER 160 H SER 160 21.804 -6.097 -3.971 1177 HA SER 160 HA SER 160 23.318 -7.899 -5.309 1178 HG SER 160 HG SER 160 22.575 -5.148 -5.723 1179 HB2 SER 160 2HB SER 160 24.421 -5.208 -4.291 1180 HB3 SER 160 1HB SER 160 25.235 -6.171 -5.516 1181 H SER 161 H SER 161 24.496 -7.049 -2.121 1182 HA SER 161 HA SER 161 26.163 -7.944 -0.701 1183 HG SER 161 HG SER 161 23.259 -9.311 -0.931 1184 HB2 SER 161 2HB SER 161 24.795 -10.383 -1.955 1185 HB3 SER 161 1HB SER 161 25.749 -10.463 -0.469 1186 H ARG 162 H ARG 162 27.952 -9.418 -0.159 1187 HA ARG 162 HA ARG 162 29.536 -10.609 -2.341 1188 HE ARG 162 HE ARG 162 33.398 -9.302 -4.911 1189 HB2 ARG 162 1HB ARG 162 30.065 -7.929 -2.245 1190 HB3 ARG 162 2HB ARG 162 31.159 -8.386 -0.960 1191 HG2 ARG 162 1HG ARG 162 32.474 -9.828 -2.483 1192 HG3 ARG 162 2HG ARG 162 31.197 -9.800 -3.718 1193 HD2 ARG 162 1HD ARG 162 31.494 -7.313 -4.045 1194 HD3 ARG 162 2HD ARG 162 32.770 -7.290 -2.815 1195 HH11 ARG 162 2HH1 ARG 162 33.434 -5.798 -4.508 1196 HH12 ARG 162 1HH1 ARG 162 34.838 -5.690 -5.666 1197 HH21 ARG 162 1HH2 ARG 162 35.057 -9.034 -6.198 1198 HH22 ARG 162 2HH2 ARG 162 35.647 -7.350 -6.510 Start of MODEL 13 1 HA MET 1 HA MET 1 16.537 5.374 1.273 2 H1 MET 1 1H MET 1 15.576 7.553 2.145 3 H2 MET 1 2H MET 1 14.951 6.698 3.374 4 HB2 MET 1 1HB MET 1 14.286 4.389 3.115 5 HB3 MET 1 2HB MET 1 15.055 3.422 1.879 6 HG2 MET 1 1HG MET 1 17.302 3.648 3.142 7 HG3 MET 1 2HG MET 1 16.368 4.369 4.476 8 HE1 MET 1 3HE MET 1 16.749 2.029 6.264 9 HE2 MET 1 1HE MET 1 17.974 1.849 4.964 10 HE3 MET 1 2HE MET 1 16.942 0.461 5.425 11 H GLU 2 H GLU 2 13.542 4.174 0.942 12 HA GLU 2 HA GLU 2 12.215 6.271 -0.574 13 HB2 GLU 2 2HB GLU 2 12.109 5.383 -2.829 14 HB3 GLU 2 1HB GLU 2 13.721 5.750 -2.324 15 HG2 GLU 2 2HG GLU 2 13.940 3.120 -1.807 16 HG3 GLU 2 1HG GLU 2 12.587 2.972 -2.926 17 H LEU 3 H LEU 3 10.560 3.739 -1.863 18 HA LEU 3 HA LEU 3 8.752 3.915 0.600 19 HG LEU 3 HG LEU 3 8.818 5.811 -2.555 20 HB2 LEU 3 2HB LEU 3 6.742 4.116 -1.065 21 HB3 LEU 3 1HB LEU 3 7.696 5.436 -0.512 22 HD11 LEU 3 1HD1 LEU 3 7.397 3.389 -3.875 23 HD12 LEU 3 2HD1 LEU 3 9.081 3.326 -3.306 24 HD13 LEU 3 3HD1 LEU 3 8.657 4.450 -4.570 25 HD21 LEU 3 3HD2 LEU 3 5.797 5.270 -2.899 26 HD22 LEU 3 1HD2 LEU 3 6.745 6.247 -4.039 27 HD23 LEU 3 2HD2 LEU 3 6.567 6.784 -2.355 28 H VAL 4 H VAL 4 7.294 2.520 1.217 29 HA VAL 4 HA VAL 4 7.622 -0.339 0.214 30 HB VAL 4 HB VAL 4 7.264 0.763 3.026 31 HG11 VAL 4 1HG1 VAL 4 7.892 -1.635 3.786 32 HG12 VAL 4 2HG1 VAL 4 7.611 -2.144 2.109 33 HG13 VAL 4 3HG1 VAL 4 6.280 -1.467 3.032 34 HG21 VAL 4 3HG2 VAL 4 9.847 -0.235 1.735 35 HG22 VAL 4 1HG2 VAL 4 9.605 -0.063 3.503 36 HG23 VAL 4 2HG2 VAL 4 9.497 1.337 2.446 37 H SER 5 H SER 5 5.830 -1.498 -0.401 38 HA SER 5 HA SER 5 3.141 -0.145 -0.214 39 HG SER 5 HG SER 5 4.700 -2.720 -2.885 40 HB2 SER 5 2HB SER 5 2.613 -1.730 -2.053 41 HB3 SER 5 1HB SER 5 3.996 -0.752 -2.358 42 H VAL 6 H VAL 6 1.296 -0.797 0.792 43 HA VAL 6 HA VAL 6 1.427 -3.278 2.514 44 HB VAL 6 HB VAL 6 1.269 -2.480 4.546 45 HG11 VAL 6 1HG1 VAL 6 3.436 -1.484 3.729 46 HG12 VAL 6 2HG1 VAL 6 2.730 -0.539 5.050 47 HG13 VAL 6 3HG1 VAL 6 2.603 0.025 3.374 48 HG21 VAL 6 3HG2 VAL 6 -0.817 -1.165 4.557 49 HG22 VAL 6 1HG2 VAL 6 0.020 0.202 3.793 50 HG23 VAL 6 2HG2 VAL 6 0.442 -0.313 5.441 51 H ALA 7 H ALA 7 0.004 -4.370 1.181 52 HA ALA 7 HA ALA 7 -2.966 -3.500 1.439 53 HB1 ALA 7 3HB ALA 7 -2.218 -3.473 -0.922 54 HB2 ALA 7 1HB ALA 7 -3.390 -4.765 -0.669 55 HB3 ALA 7 2HB ALA 7 -1.649 -5.147 -0.820 56 H ALA 8 H ALA 8 -4.391 -4.852 2.440 57 HA ALA 8 HA ALA 8 -3.559 -7.665 3.224 58 HB1 ALA 8 3HB ALA 8 -5.352 -7.411 4.923 59 HB2 ALA 8 1HB ALA 8 -5.886 -5.879 4.218 60 HB3 ALA 8 2HB ALA 8 -4.299 -6.001 4.979 61 H LEU 9 H LEU 9 -4.364 -9.468 2.331 62 HA LEU 9 HA LEU 9 -6.874 -9.468 0.672 63 HG LEU 9 HG LEU 9 -3.642 -9.516 -2.158 64 HB2 LEU 9 2HB LEU 9 -5.787 -9.986 -1.453 65 HB3 LEU 9 1HB LEU 9 -5.511 -8.403 -0.867 66 HD11 LEU 9 1HD1 LEU 9 -3.254 -7.413 -0.873 67 HD12 LEU 9 2HD1 LEU 9 -1.819 -8.418 -0.803 68 HD13 LEU 9 3HD1 LEU 9 -2.887 -8.357 0.586 69 HD21 LEU 9 3HD2 LEU 9 -3.052 -11.008 0.465 70 HD22 LEU 9 1HD2 LEU 9 -2.014 -10.980 -0.967 71 HD23 LEU 9 2HD2 LEU 9 -3.613 -11.761 -1.074 72 H ALA 10 H ALA 10 -7.620 -11.341 -0.228 73 HA ALA 10 HA ALA 10 -6.912 -13.835 1.386 74 HB1 ALA 10 3HB ALA 10 -9.447 -14.015 1.383 75 HB2 ALA 10 1HB ALA 10 -9.571 -12.603 0.324 76 HB3 ALA 10 2HB ALA 10 -8.912 -12.455 1.977 77 H GLU 11 H GLU 11 -9.259 -15.084 -0.402 78 HA GLU 11 HA GLU 11 -7.569 -16.601 -2.293 79 HB2 GLU 11 2HB GLU 11 -9.575 -17.704 -1.416 80 HB3 GLU 11 1HB GLU 11 -10.634 -16.497 -2.136 81 HG2 GLU 11 2HG GLU 11 -9.978 -17.315 -4.463 82 HG3 GLU 11 1HG GLU 11 -8.885 -18.505 -3.723 83 H ASN 12 H ASN 12 -8.124 -16.617 -4.604 84 HA ASN 12 HA ASN 12 -7.198 -15.546 -6.534 85 HB2 ASN 12 2HB ASN 12 -10.008 -14.754 -5.917 86 HB3 ASN 12 1HB ASN 12 -9.271 -13.492 -6.817 87 HD21 ASN 12 1HD2 ASN 12 -11.307 -15.585 -7.484 88 HD22 ASN 12 2HD2 ASN 12 -10.673 -16.237 -9.079 89 H ARG 13 H ARG 13 -6.231 -14.158 -4.065 90 HA ARG 13 HA ARG 13 -5.137 -12.313 -3.290 91 HE ARG 13 HE ARG 13 -3.437 -14.153 -7.490 92 HB2 ARG 13 2HB ARG 13 -3.266 -11.471 -4.385 93 HB3 ARG 13 1HB ARG 13 -3.406 -13.173 -4.788 94 HG2 ARG 13 2HG ARG 13 -4.565 -12.165 -7.092 95 HG3 ARG 13 1HG ARG 13 -3.766 -10.726 -6.585 96 HD2 ARG 13 2HD ARG 13 -2.159 -11.651 -7.943 97 HD3 ARG 13 1HD ARG 13 -1.557 -12.146 -6.361 98 HH11 ARG 13 2HH1 ARG 13 -0.205 -13.071 -7.721 99 HH12 ARG 13 1HH1 ARG 13 0.354 -14.433 -8.799 100 HH21 ARG 13 1HH2 ARG 13 -2.889 -15.640 -8.886 101 HH22 ARG 13 2HH2 ARG 13 -1.161 -15.808 -9.447 102 H VAL 14 H VAL 14 -7.495 -11.794 -3.304 103 HA VAL 14 HA VAL 14 -8.276 -9.281 -4.711 104 HB VAL 14 HB VAL 14 -9.633 -11.246 -2.774 105 HG11 VAL 14 1HG1 VAL 14 -11.001 -8.636 -3.685 106 HG12 VAL 14 2HG1 VAL 14 -10.606 -9.121 -2.016 107 HG13 VAL 14 3HG1 VAL 14 -11.779 -10.063 -2.934 108 HG21 VAL 14 3HG2 VAL 14 -11.134 -11.547 -4.759 109 HG22 VAL 14 1HG2 VAL 14 -9.436 -11.783 -5.234 110 HG23 VAL 14 2HG2 VAL 14 -10.258 -10.273 -5.668 111 H ILE 15 H ILE 15 -7.520 -7.387 -4.138 112 HA ILE 15 HA ILE 15 -6.646 -6.522 -1.394 113 HB ILE 15 HB ILE 15 -7.414 -4.687 -3.722 114 HG12 ILE 15 2HG1 ILE 15 -4.445 -5.150 -3.215 115 HG13 ILE 15 1HG1 ILE 15 -5.341 -6.405 -4.047 116 HG21 ILE 15 1HG2 ILE 15 -6.150 -2.883 -2.623 117 HG22 ILE 15 2HG2 ILE 15 -5.491 -3.979 -1.393 118 HG23 ILE 15 3HG2 ILE 15 -7.205 -3.555 -1.404 119 HD11 ILE 15 3HD1 ILE 15 -5.492 -3.501 -5.045 120 HD12 ILE 15 1HD1 ILE 15 -6.018 -4.989 -5.865 121 HD13 ILE 15 2HD1 ILE 15 -4.303 -4.679 -5.651 122 H GLY 16 H GLY 16 -9.383 -5.412 -3.389 123 HA2 GLY 16 2HA GLY 16 -11.111 -5.099 -0.887 124 HA3 GLY 16 1HA GLY 16 -10.805 -3.666 -1.879 125 H ARG 17 H ARG 17 -13.120 -3.991 -1.618 126 HA ARG 17 HA ARG 17 -14.361 -5.154 -4.089 127 HE ARG 17 HE ARG 17 -18.822 -7.185 -1.473 128 HB2 ARG 17 2HB ARG 17 -14.317 -6.989 -2.220 129 HB3 ARG 17 1HB ARG 17 -15.486 -6.001 -1.348 130 HG2 ARG 17 2HG ARG 17 -16.925 -6.124 -3.542 131 HG3 ARG 17 1HG ARG 17 -15.835 -7.363 -4.106 132 HD2 ARG 17 2HD ARG 17 -16.820 -9.024 -2.743 133 HD3 ARG 17 1HD ARG 17 -16.630 -8.052 -1.313 134 HH11 ARG 17 2HH1 ARG 17 -18.053 -8.610 -4.537 135 HH12 ARG 17 1HH1 ARG 17 -19.673 -8.236 -5.256 136 HH21 ARG 17 1HH2 ARG 17 -20.589 -6.679 -2.304 137 HH22 ARG 17 2HH2 ARG 17 -21.069 -7.144 -4.004 138 H ASP 18 H ASP 18 -15.142 -3.197 -1.112 139 HA ASP 18 HA ASP 18 -16.477 -1.282 -3.050 140 HB2 ASP 18 2HB ASP 18 -17.203 -0.007 -0.999 141 HB3 ASP 18 1HB ASP 18 -17.939 -1.565 -1.310 142 H GLY 19 H GLY 19 -13.834 -0.942 -0.611 143 HA2 GLY 19 2HA GLY 19 -12.378 0.879 -2.645 144 HA3 GLY 19 1HA GLY 19 -12.732 1.509 -1.067 145 H GLU 20 H GLU 20 -11.546 0.609 0.739 146 HA GLU 20 HA GLU 20 -8.825 -0.382 0.044 147 HB2 GLU 20 2HB GLU 20 -8.141 -0.251 2.305 148 HB3 GLU 20 1HB GLU 20 -8.824 1.251 1.729 149 HG2 GLU 20 2HG GLU 20 -10.876 0.888 3.131 150 HG3 GLU 20 1HG GLU 20 -10.316 -0.694 3.624 151 H LEU 21 H LEU 21 -11.385 -2.057 1.958 152 HA LEU 21 HA LEU 21 -10.277 -4.646 0.999 153 HG LEU 21 HG LEU 21 -9.173 -2.495 3.732 154 HB2 LEU 21 2HB LEU 21 -9.807 -5.499 3.409 155 HB3 LEU 21 1HB LEU 21 -8.648 -4.614 2.438 156 HD11 LEU 21 1HD1 LEU 21 -10.321 -2.778 5.985 157 HD12 LEU 21 2HD1 LEU 21 -10.684 -4.472 5.564 158 HD13 LEU 21 3HD1 LEU 21 -11.437 -3.144 4.651 159 HD21 LEU 21 3HD2 LEU 21 -7.682 -3.000 5.542 160 HD22 LEU 21 1HD2 LEU 21 -7.182 -3.977 4.155 161 HD23 LEU 21 2HD2 LEU 21 -8.075 -4.735 5.491 162 HA PRO 22 HA PRO 22 -14.469 -5.920 1.302 163 HB2 PRO 22 2HB PRO 22 -13.740 -8.850 1.517 164 HB3 PRO 22 1HB PRO 22 -14.480 -7.967 0.172 165 HG2 PRO 22 2HG PRO 22 -11.869 -8.881 0.053 166 HG3 PRO 22 1HG PRO 22 -12.330 -7.342 -0.719 167 HD2 PRO 22 2HD PRO 22 -11.045 -7.656 2.049 168 HD3 PRO 22 1HD PRO 22 -10.576 -6.656 0.696 169 H TRP 23 H TRP 23 -12.704 -6.686 3.976 170 HA TRP 23 HA TRP 23 -15.111 -7.324 5.717 171 HD1 TRP 23 HD1 TRP 23 -11.416 -6.193 7.962 172 HE1 TRP 23 HE1 TRP 23 -8.960 -5.934 6.950 173 HE3 TRP 23 HE3 TRP 23 -11.863 -9.708 4.363 174 HZ2 TRP 23 HZ2 TRP 23 -7.591 -7.201 4.903 175 HZ3 TRP 23 HZ3 TRP 23 -9.977 -10.095 2.806 176 HH2 TRP 23 HH2 TRP 23 -7.901 -8.766 3.012 177 HB2 TRP 23 2HB TRP 23 -13.558 -8.049 7.531 178 HB3 TRP 23 1HB TRP 23 -13.408 -9.058 6.101 179 HA PRO 24 HA PRO 24 -14.875 -3.061 6.919 180 HB2 PRO 24 2HB PRO 24 -15.099 -3.550 9.883 181 HB3 PRO 24 1HB PRO 24 -16.194 -2.721 8.775 182 HG2 PRO 24 2HG PRO 24 -16.823 -5.228 9.760 183 HG3 PRO 24 1HG PRO 24 -17.251 -4.767 8.103 184 HD2 PRO 24 2HD PRO 24 -14.837 -6.433 8.975 185 HD3 PRO 24 1HD PRO 24 -16.000 -6.728 7.651 186 H SER 25 H SER 25 -12.735 -4.705 9.197 187 HA SER 25 HA SER 25 -10.254 -3.811 8.704 188 HG SER 25 HG SER 25 -10.976 -1.455 7.779 189 HB2 SER 25 2HB SER 25 -11.508 -1.373 10.072 190 HB3 SER 25 1HB SER 25 -9.820 -1.772 10.370 191 H ILE 26 H ILE 26 -9.624 -5.578 9.852 192 HA ILE 26 HA ILE 26 -10.523 -6.114 12.622 193 HB ILE 26 HB ILE 26 -8.505 -7.720 12.791 194 HG12 ILE 26 2HG1 ILE 26 -7.652 -6.713 10.404 195 HG13 ILE 26 1HG1 ILE 26 -7.079 -8.151 11.171 196 HG21 ILE 26 1HG2 ILE 26 -10.780 -8.489 12.823 197 HG22 ILE 26 2HG2 ILE 26 -9.773 -9.583 11.855 198 HG23 ILE 26 3HG2 ILE 26 -10.895 -8.463 11.049 199 HD11 ILE 26 3HD1 ILE 26 -7.573 -8.382 8.691 200 HD12 ILE 26 1HD1 ILE 26 -9.298 -8.200 9.023 201 HD13 ILE 26 2HD1 ILE 26 -8.426 -9.603 9.677 202 HA PRO 27 HA PRO 27 -7.740 -3.261 14.796 203 HB2 PRO 27 2HB PRO 27 -7.804 -5.391 17.006 204 HB3 PRO 27 1HB PRO 27 -7.985 -3.617 17.139 205 HG2 PRO 27 2HG PRO 27 -10.246 -5.120 17.157 206 HG3 PRO 27 1HG PRO 27 -10.206 -3.695 16.080 207 HD2 PRO 27 2HD PRO 27 -9.704 -6.616 15.265 208 HD3 PRO 27 1HD PRO 27 -10.774 -5.361 14.538 209 H ALA 28 H ALA 28 -6.376 -6.602 14.881 210 HA ALA 28 HA ALA 28 -3.603 -5.788 14.996 211 HB1 ALA 28 3HB ALA 28 -4.092 -8.079 15.202 212 HB2 ALA 28 1HB ALA 28 -3.166 -7.979 13.686 213 HB3 ALA 28 2HB ALA 28 -4.923 -8.172 13.618 214 H ASP 29 H ASP 29 -5.709 -5.435 12.196 215 HA ASP 29 HA ASP 29 -3.522 -5.014 10.184 216 HB2 ASP 29 2HB ASP 29 -5.733 -6.072 9.686 217 HB3 ASP 29 1HB ASP 29 -6.583 -4.572 10.057 218 H LYS 30 H LYS 30 -6.023 -2.544 10.791 219 HA LYS 30 HA LYS 30 -4.400 -0.303 11.015 220 HB2 LYS 30 2HB LYS 30 -6.789 -0.254 10.854 221 HB3 LYS 30 1HB LYS 30 -7.043 -0.882 12.479 222 HG2 LYS 30 2HG LYS 30 -6.644 1.196 13.527 223 HG3 LYS 30 1HG LYS 30 -5.584 1.784 12.250 224 HD2 LYS 30 2HD LYS 30 -7.211 2.663 10.944 225 HD3 LYS 30 1HD LYS 30 -8.370 1.384 11.217 226 HE2 LYS 30 2HE LYS 30 -9.120 2.390 13.369 227 HE3 LYS 30 1HE LYS 30 -7.824 3.619 13.325 228 HZ1 LYS 30 3HZ LYS 30 -9.926 3.389 11.111 229 HZ2 LYS 30 1HZ LYS 30 -8.895 4.542 11.213 230 HZ3 LYS 30 2HZ LYS 30 -10.007 4.499 12.277 231 H LYS 31 H LYS 31 -3.926 -2.566 13.436 232 HA LYS 31 HA LYS 31 -2.208 -0.651 15.087 233 HB2 LYS 31 2HB LYS 31 -3.377 -2.456 16.351 234 HB3 LYS 31 1HB LYS 31 -2.668 -3.680 15.330 235 HG2 LYS 31 2HG LYS 31 -1.440 -3.759 17.394 236 HG3 LYS 31 1HG LYS 31 -0.372 -3.154 16.172 237 HD2 LYS 31 2HD LYS 31 -1.244 -0.696 17.062 238 HD3 LYS 31 1HD LYS 31 -1.746 -1.615 18.450 239 HE2 LYS 31 2HE LYS 31 0.466 -0.714 18.960 240 HE3 LYS 31 1HE LYS 31 0.663 -2.457 18.763 241 HZ1 LYS 31 3HZ LYS 31 2.360 -1.243 17.311 242 HZ2 LYS 31 1HZ LYS 31 1.193 -0.387 16.574 243 HZ3 LYS 31 2HZ LYS 31 1.257 -1.958 16.304 244 H GLN 32 H GLN 32 -1.778 -2.951 12.468 245 HA GLN 32 HA GLN 32 1.238 -2.704 12.500 246 HB2 GLN 32 2HB GLN 32 0.421 -4.990 12.204 247 HB3 GLN 32 1HB GLN 32 -0.556 -4.533 10.823 248 HG2 GLN 32 2HG GLN 32 2.522 -4.119 10.861 249 HG3 GLN 32 1HG GLN 32 1.847 -5.679 10.455 250 HE21 GLN 32 1HE2 GLN 32 0.295 -5.650 8.552 251 HE22 GLN 32 2HE2 GLN 32 0.803 -4.520 7.192 252 H TYR 33 H TYR 33 -1.554 -2.159 10.171 253 HA TYR 33 HA TYR 33 -0.215 -0.262 8.476 254 HD1 TYR 33 HD2 TYR 33 -1.790 2.100 7.310 255 HD2 TYR 33 HD1 TYR 33 -5.079 -0.163 8.811 256 HE1 TYR 33 HE2 TYR 33 -3.076 4.166 7.548 257 HE2 TYR 33 HE1 TYR 33 -6.405 1.897 9.029 258 HH TYR 33 HH TYR 33 -5.767 4.791 7.849 259 HB2 TYR 33 2HB TYR 33 -2.107 -0.848 7.433 260 HB3 TYR 33 1HB TYR 33 -2.980 -1.201 8.840 261 H ARG 34 H ARG 34 -1.636 0.582 11.709 262 HA ARG 34 HA ARG 34 -0.461 3.364 11.241 263 HE ARG 34 HE ARG 34 -4.165 5.681 10.554 264 HB2 ARG 34 2HB ARG 34 -2.257 2.523 13.569 265 HB3 ARG 34 1HB ARG 34 -1.342 4.001 13.491 266 HG2 ARG 34 2HG ARG 34 -2.539 4.096 10.972 267 HG3 ARG 34 1HG ARG 34 -3.760 3.202 11.817 268 HD2 ARG 34 2HD ARG 34 -4.247 5.008 13.367 269 HD3 ARG 34 1HD ARG 34 -2.663 5.767 13.123 270 HH11 ARG 34 2HH1 ARG 34 -3.712 7.615 13.426 271 HH12 ARG 34 1HH1 ARG 34 -4.066 9.129 12.464 272 HH21 ARG 34 1HH2 ARG 34 -4.515 7.409 9.610 273 HH22 ARG 34 2HH2 ARG 34 -4.453 9.021 10.408 274 H SER 35 H SER 35 0.860 0.630 12.694 275 HA SER 35 HA SER 35 3.113 2.407 13.816 276 HG SER 35 HG SER 35 2.639 1.948 15.831 277 HB2 SER 35 2HB SER 35 2.629 -0.551 14.390 278 HB3 SER 35 1HB SER 35 4.098 0.324 14.814 279 H ARG 36 H ARG 36 2.262 0.675 11.110 280 HA ARG 36 HA ARG 36 5.034 0.920 9.877 281 HE ARG 36 HE ARG 36 5.646 -3.461 8.096 282 HB2 ARG 36 2HB ARG 36 3.190 -1.016 9.483 283 HB3 ARG 36 1HB ARG 36 2.393 0.171 8.502 284 HG2 ARG 36 2HG ARG 36 3.610 -1.368 7.127 285 HG3 ARG 36 1HG ARG 36 4.303 0.214 6.949 286 HD2 ARG 36 2HD ARG 36 6.071 -1.431 6.923 287 HD3 ARG 36 1HD ARG 36 6.314 -0.529 8.374 288 HH11 ARG 36 2HH1 ARG 36 5.554 -0.875 10.395 289 HH12 ARG 36 1HH1 ARG 36 5.907 -2.024 11.763 290 HH21 ARG 36 1HH2 ARG 36 6.083 -4.630 9.506 291 HH22 ARG 36 2HH2 ARG 36 6.147 -4.139 11.274 292 H VAL 37 H VAL 37 1.691 2.351 9.137 293 HA VAL 37 HA VAL 37 3.214 4.591 7.800 294 HB VAL 37 HB VAL 37 1.811 4.678 6.139 295 HG11 VAL 37 1HG1 VAL 37 2.626 2.290 6.104 296 HG12 VAL 37 2HG1 VAL 37 1.156 2.545 5.141 297 HG13 VAL 37 3HG1 VAL 37 1.058 1.765 6.747 298 HG21 VAL 37 3HG2 VAL 37 -0.299 5.338 6.850 299 HG22 VAL 37 1HG2 VAL 37 -0.535 3.938 7.903 300 HG23 VAL 37 2HG2 VAL 37 -0.697 3.765 6.134 301 H ALA 38 H ALA 38 1.643 4.779 10.754 302 HA ALA 38 HA ALA 38 -0.112 7.123 10.080 303 HB1 ALA 38 3HB ALA 38 -0.732 5.569 11.848 304 HB2 ALA 38 1HB ALA 38 -0.657 7.240 12.452 305 HB3 ALA 38 2HB ALA 38 0.645 6.093 12.845 306 H ASP 39 H ASP 39 3.136 6.897 11.345 307 HA ASP 39 HA ASP 39 3.550 9.876 11.419 308 HB2 ASP 39 2HB ASP 39 5.260 7.409 11.991 309 HB3 ASP 39 1HB ASP 39 6.070 8.846 11.446 310 H ASP 40 H ASP 40 4.843 7.266 9.217 311 HA ASP 40 HA ASP 40 5.663 9.048 7.331 312 HB2 ASP 40 2HB ASP 40 5.110 6.051 7.196 313 HB3 ASP 40 1HB ASP 40 6.045 6.883 5.956 314 HA PRO 41 HA PRO 41 2.340 9.910 4.262 315 HB2 PRO 41 2HB PRO 41 4.593 10.046 2.180 316 HB3 PRO 41 1HB PRO 41 3.328 11.232 2.516 317 HG2 PRO 41 2HG PRO 41 5.851 11.656 3.454 318 HG3 PRO 41 1HG PRO 41 4.506 11.934 4.578 319 HD2 PRO 41 2HD PRO 41 6.258 9.414 4.423 320 HD3 PRO 41 1HD PRO 41 5.818 10.439 5.820 321 H VAL 42 H VAL 42 0.979 8.834 2.874 322 HA VAL 42 HA VAL 42 1.954 6.204 1.661 323 HB VAL 42 HB VAL 42 -0.844 7.033 2.586 324 HG11 VAL 42 1HG1 VAL 42 0.165 4.190 1.857 325 HG12 VAL 42 2HG1 VAL 42 -0.883 5.178 0.799 326 HG13 VAL 42 3HG1 VAL 42 -1.471 4.651 2.380 327 HG21 VAL 42 3HG2 VAL 42 0.494 6.717 4.617 328 HG22 VAL 42 1HG2 VAL 42 1.427 5.394 3.911 329 HG23 VAL 42 2HG2 VAL 42 -0.264 5.127 4.379 330 H VAL 43 H VAL 43 1.914 5.819 -0.460 331 HA VAL 43 HA VAL 43 0.369 7.616 -2.370 332 HB VAL 43 HB VAL 43 1.838 7.054 -4.125 333 HG11 VAL 43 1HG1 VAL 43 4.114 7.695 -3.316 334 HG12 VAL 43 2HG1 VAL 43 3.691 7.332 -1.648 335 HG13 VAL 43 3HG1 VAL 43 2.917 8.683 -2.438 336 HG21 VAL 43 3HG2 VAL 43 3.791 5.462 -3.933 337 HG22 VAL 43 1HG2 VAL 43 2.253 4.618 -3.815 338 HG23 VAL 43 2HG2 VAL 43 3.216 4.962 -2.342 339 H LEU 44 H LEU 44 -1.604 7.043 -3.036 340 HA LEU 44 HA LEU 44 -2.289 4.105 -3.533 341 HG LEU 44 HG LEU 44 -4.258 6.938 -2.049 342 HB2 LEU 44 2HB LEU 44 -4.195 4.158 -2.068 343 HB3 LEU 44 1HB LEU 44 -2.737 4.411 -1.191 344 HD11 LEU 44 1HD1 LEU 44 -5.208 5.164 0.312 345 HD12 LEU 44 2HD1 LEU 44 -6.091 5.372 -1.215 346 HD13 LEU 44 3HD1 LEU 44 -5.854 6.765 -0.137 347 HD21 LEU 44 3HD2 LEU 44 -2.169 7.119 -0.651 348 HD22 LEU 44 1HD2 LEU 44 -2.959 6.172 0.652 349 HD23 LEU 44 2HD2 LEU 44 -3.592 7.758 0.203 350 H GLY 45 H GLY 45 -4.931 4.009 -3.953 351 HA2 GLY 45 2HA GLY 45 -4.963 5.213 -6.792 352 HA3 GLY 45 1HA GLY 45 -5.689 3.675 -6.346 353 H ARG 46 H ARG 46 -7.452 4.805 -7.603 354 HA ARG 46 HA ARG 46 -9.258 6.447 -5.727 355 HE ARG 46 HE ARG 46 -11.664 8.962 -7.213 356 HB2 ARG 46 2HB ARG 46 -9.592 6.158 -8.741 357 HB3 ARG 46 1HB ARG 46 -10.844 6.738 -7.688 358 HG2 ARG 46 2HG ARG 46 -8.081 8.060 -7.962 359 HG3 ARG 46 1HG ARG 46 -9.503 8.598 -8.832 360 HD2 ARG 46 2HD ARG 46 -9.191 8.673 -5.751 361 HD3 ARG 46 1HD ARG 46 -8.919 10.024 -6.856 362 HH11 ARG 46 2HH1 ARG 46 -9.862 10.558 -4.809 363 HH12 ARG 46 1HH1 ARG 46 -11.344 11.299 -4.031 364 HH21 ARG 46 1HH2 ARG 46 -13.304 9.780 -6.339 365 HH22 ARG 46 2HH2 ARG 46 -13.197 10.948 -4.943 366 H THR 47 H THR 47 -9.018 3.106 -6.964 367 HA THR 47 HA THR 47 -11.435 2.348 -5.587 368 HB THR 47 HB THR 47 -8.890 0.618 -5.736 369 HG1 THR 47 HG1 THR 47 -11.056 0.327 -7.426 370 HG21 THR 47 3HG2 THR 47 -10.307 -0.785 -4.504 371 HG22 THR 47 1HG2 THR 47 -11.088 -1.038 -6.079 372 HG23 THR 47 2HG2 THR 47 -11.792 0.092 -4.908 373 H THR 48 H THR 48 -8.476 1.390 -3.784 374 HA THR 48 HA THR 48 -9.001 1.969 -1.262 375 HB THR 48 HB THR 48 -6.578 2.657 -0.832 376 HG1 THR 48 HG1 THR 48 -6.882 3.009 -3.541 377 HG21 THR 48 3HG2 THR 48 -6.714 0.309 -2.786 378 HG22 THR 48 1HG2 THR 48 -7.203 0.186 -1.088 379 HG23 THR 48 2HG2 THR 48 -5.550 0.649 -1.498 380 H PHE 49 H PHE 49 -8.216 4.958 -3.225 381 HA PHE 49 HA PHE 49 -8.422 6.675 -0.808 382 HD1 PHE 49 HD2 PHE 49 -10.062 9.543 -2.440 383 HD2 PHE 49 HD1 PHE 49 -5.897 8.957 -1.618 384 HE1 PHE 49 HE2 PHE 49 -9.928 11.814 -1.529 385 HE2 PHE 49 HE1 PHE 49 -5.734 11.296 -0.831 386 HZ PHE 49 HZ PHE 49 -7.763 12.671 -0.662 387 HB2 PHE 49 2HB PHE 49 -7.070 7.279 -2.832 388 HB3 PHE 49 1HB PHE 49 -8.532 7.700 -3.679 389 H GLU 50 H GLU 50 -10.903 5.592 -3.015 390 HA GLU 50 HA GLU 50 -12.884 7.673 -2.106 391 HB2 GLU 50 2HB GLU 50 -13.264 5.259 -3.969 392 HB3 GLU 50 1HB GLU 50 -14.575 6.295 -3.425 393 HG2 GLU 50 2HG GLU 50 -13.473 8.324 -4.324 394 HG3 GLU 50 1HG GLU 50 -12.061 7.437 -4.827 395 H SER 51 H SER 51 -12.099 4.346 -1.044 396 HA SER 51 HA SER 51 -13.636 4.732 1.484 397 HG SER 51 HG SER 51 -13.375 2.039 2.048 398 HB2 SER 51 2HB SER 51 -11.061 3.141 0.914 399 HB3 SER 51 1HB SER 51 -11.740 3.291 2.529 400 H MET 52 H MET 52 -10.087 5.132 1.169 401 HA MET 52 HA MET 52 -9.543 6.272 3.591 402 HB2 MET 52 2HB MET 52 -7.962 5.609 1.554 403 HB3 MET 52 1HB MET 52 -8.067 7.335 1.114 404 HG2 MET 52 2HG MET 52 -6.045 7.078 2.367 405 HG3 MET 52 1HG MET 52 -7.172 7.883 3.449 406 HE1 MET 52 3HE MET 52 -6.263 3.852 2.645 407 HE2 MET 52 1HE MET 52 -5.212 3.941 4.101 408 HE3 MET 52 2HE MET 52 -4.945 5.083 2.752 409 H ARG 53 H ARG 53 -10.784 8.290 1.162 410 HA ARG 53 HA ARG 53 -10.501 10.987 2.247 411 HE ARG 53 HE ARG 53 -15.032 11.734 -0.728 412 HB2 ARG 53 2HB ARG 53 -11.236 10.386 0.008 413 HB3 ARG 53 1HB ARG 53 -12.649 9.522 0.615 414 HG2 ARG 53 2HG ARG 53 -13.836 11.450 1.162 415 HG3 ARG 53 1HG ARG 53 -12.443 12.437 1.400 416 HD2 ARG 53 2HD ARG 53 -12.334 13.170 -0.738 417 HD3 ARG 53 1HD ARG 53 -12.434 11.565 -1.451 418 HH11 ARG 53 2HH1 ARG 53 -13.170 14.323 -2.040 419 HH12 ARG 53 1HH1 ARG 53 -14.569 14.973 -3.009 420 HH21 ARG 53 1HH2 ARG 53 -16.600 12.488 -1.833 421 HH22 ARG 53 2HH2 ARG 53 -16.431 13.967 -2.895 422 H ASP 54 H ASP 54 -12.570 8.358 3.421 423 HA ASP 54 HA ASP 54 -13.805 10.147 5.530 424 HB2 ASP 54 2HB ASP 54 -14.320 7.270 4.639 425 HB3 ASP 54 1HB ASP 54 -14.913 7.860 6.184 426 H ASP 55 H ASP 55 -11.834 7.053 5.754 427 HA ASP 55 HA ASP 55 -10.658 8.165 8.357 428 HB2 ASP 55 2HB ASP 55 -11.538 5.394 7.772 429 HB3 ASP 55 1HB ASP 55 -9.814 5.401 8.055 430 H LEU 56 H LEU 56 -8.865 9.231 7.969 431 HA LEU 56 HA LEU 56 -7.218 8.924 5.664 432 HG LEU 56 HG LEU 56 -7.146 12.525 6.944 433 HB2 LEU 56 2HB LEU 56 -6.185 10.401 8.129 434 HB3 LEU 56 1HB LEU 56 -5.901 10.722 6.450 435 HD11 LEU 56 1HD1 LEU 56 -8.492 11.486 5.089 436 HD12 LEU 56 2HD1 LEU 56 -9.490 12.457 6.167 437 HD13 LEU 56 3HD1 LEU 56 -9.551 10.699 6.281 438 HD21 LEU 56 3HD2 LEU 56 -9.177 12.528 8.556 439 HD22 LEU 56 1HD2 LEU 56 -7.553 12.310 9.236 440 HD23 LEU 56 2HD2 LEU 56 -8.639 10.906 9.056 441 HA PRO 57 HA PRO 57 -3.891 6.121 7.290 442 HB2 PRO 57 2HB PRO 57 -2.072 6.151 5.293 443 HB3 PRO 57 1HB PRO 57 -3.719 5.627 5.041 444 HG2 PRO 57 2HG PRO 57 -2.454 8.292 4.233 445 HG3 PRO 57 1HG PRO 57 -3.681 7.331 3.376 446 HD2 PRO 57 2HD PRO 57 -4.139 9.575 5.173 447 HD3 PRO 57 1HD PRO 57 -5.382 8.516 4.448 448 H GLY 58 H GLY 58 -1.606 8.498 6.016 449 HA2 GLY 58 2HA GLY 58 -0.374 8.892 8.844 450 HA3 GLY 58 1HA GLY 58 0.611 8.534 7.431 451 H SER 59 H SER 59 1.755 10.455 8.091 452 HA SER 59 HA SER 59 0.753 13.108 8.089 453 HG SER 59 HG SER 59 4.120 14.155 8.148 454 HB2 SER 59 2HB SER 59 2.971 12.366 8.855 455 HB3 SER 59 1HB SER 59 3.533 12.149 7.191 456 H ALA 60 H ALA 60 1.204 11.332 5.127 457 HA ALA 60 HA ALA 60 -0.659 13.313 3.986 458 HB1 ALA 60 3HB ALA 60 2.007 13.029 2.460 459 HB2 ALA 60 1HB ALA 60 1.368 14.460 3.291 460 HB3 ALA 60 2HB ALA 60 0.550 13.845 1.834 461 H GLN 61 H GLN 61 -1.468 12.857 1.838 462 HA GLN 61 HA GLN 61 -2.043 9.857 1.472 463 HB2 GLN 61 2HB GLN 61 -3.576 11.219 3.101 464 HB3 GLN 61 1HB GLN 61 -4.125 12.119 1.700 465 HG2 GLN 61 2HG GLN 61 -4.874 9.826 0.677 466 HG3 GLN 61 1HG GLN 61 -4.475 9.096 2.180 467 HE21 GLN 61 1HE2 GLN 61 -5.648 11.154 3.979 468 HE22 GLN 61 2HE2 GLN 61 -7.445 10.766 3.724 469 H ILE 62 H ILE 62 -0.879 9.815 -0.386 470 HA ILE 62 HA ILE 62 -1.202 11.859 -2.595 471 HB ILE 62 HB ILE 62 0.712 9.562 -2.001 472 HG12 ILE 62 2HG1 ILE 62 1.612 12.390 -2.488 473 HG13 ILE 62 1HG1 ILE 62 0.833 12.068 -0.942 474 HG21 ILE 62 1HG2 ILE 62 0.921 11.309 -4.514 475 HG22 ILE 62 2HG2 ILE 62 0.492 9.576 -4.528 476 HG23 ILE 62 3HG2 ILE 62 2.094 10.064 -3.967 477 HD11 ILE 62 3HD1 ILE 62 3.211 11.888 -0.589 478 HD12 ILE 62 1HD1 ILE 62 3.457 10.916 -2.041 479 HD13 ILE 62 2HD1 ILE 62 2.665 10.214 -0.578 480 H VAL 63 H VAL 63 -2.628 11.450 -4.301 481 HA VAL 63 HA VAL 63 -3.067 8.560 -5.121 482 HB VAL 63 HB VAL 63 -4.635 11.015 -5.871 483 HG11 VAL 63 1HG1 VAL 63 -6.174 9.452 -7.184 484 HG12 VAL 63 2HG1 VAL 63 -5.017 8.115 -6.909 485 HG13 VAL 63 3HG1 VAL 63 -4.548 9.499 -7.900 486 HG21 VAL 63 3HG2 VAL 63 -5.064 9.947 -3.641 487 HG22 VAL 63 1HG2 VAL 63 -5.327 8.368 -4.386 488 HG23 VAL 63 2HG2 VAL 63 -6.478 9.717 -4.671 489 H MET 64 H MET 64 -1.824 7.553 -6.436 490 HA MET 64 HA MET 64 -0.545 8.812 -8.850 491 HB2 MET 64 2HB MET 64 -0.662 5.993 -7.613 492 HB3 MET 64 1HB MET 64 -0.247 6.158 -9.282 493 HG2 MET 64 2HG MET 64 1.413 8.177 -8.106 494 HG3 MET 64 1HG MET 64 1.379 6.911 -6.886 495 HE1 MET 64 3HE MET 64 2.894 6.633 -11.263 496 HE2 MET 64 1HE MET 64 1.969 7.991 -10.537 497 HE3 MET 64 2HE MET 64 1.129 6.490 -11.041 498 H SER 65 H SER 65 -2.168 9.729 -9.854 499 HA SER 65 HA SER 65 -3.533 8.076 -11.938 500 HG SER 65 HG SER 65 -6.893 8.430 -11.384 501 HB2 SER 65 2HB SER 65 -5.220 7.857 -10.169 502 HB3 SER 65 1HB SER 65 -5.300 9.601 -9.906 503 H ARG 66 H ARG 66 -5.163 10.024 -13.037 504 HA ARG 66 HA ARG 66 -3.526 12.567 -13.214 505 HE ARG 66 HE ARG 66 -2.015 15.057 -17.732 506 HB2 ARG 66 2HB ARG 66 -3.210 10.791 -15.317 507 HB3 ARG 66 1HB ARG 66 -4.530 11.728 -15.939 508 HG2 ARG 66 2HG ARG 66 -1.947 13.010 -14.748 509 HG3 ARG 66 1HG ARG 66 -1.937 12.364 -16.341 510 HD2 ARG 66 2HD ARG 66 -4.291 14.231 -15.982 511 HD3 ARG 66 1HD ARG 66 -2.814 14.996 -15.477 512 HH11 ARG 66 2HH1 ARG 66 -4.542 12.716 -17.580 513 HH12 ARG 66 1HH1 ARG 66 -4.550 12.433 -19.383 514 HH21 ARG 66 1HH2 ARG 66 -2.013 14.749 -19.748 515 HH22 ARG 66 2HH2 ARG 66 -3.151 13.576 -20.560 516 H SER 67 H SER 67 -5.449 12.188 -11.640 517 HA SER 67 HA SER 67 -7.928 13.607 -12.575 518 HG SER 67 HG SER 67 -6.757 13.273 -9.133 519 HB2 SER 67 2HB SER 67 -8.774 13.071 -10.338 520 HB3 SER 67 1HB SER 67 -8.092 11.624 -11.076 521 H GLU 68 H GLU 68 -7.835 15.789 -12.677 522 HA GLU 68 HA GLU 68 -6.214 17.475 -10.987 523 HB2 GLU 68 2HB GLU 68 -8.457 17.956 -13.047 524 HB3 GLU 68 1HB GLU 68 -7.480 19.250 -12.382 525 HG2 GLU 68 2HG GLU 68 -6.106 16.863 -13.816 526 HG3 GLU 68 1HG GLU 68 -6.721 18.247 -14.702 527 H ARG 69 H ARG 69 -6.623 18.812 -9.341 528 HA ARG 69 HA ARG 69 -7.866 20.385 -7.971 529 HE ARG 69 HE ARG 69 -11.080 18.094 -10.104 530 HB2 ARG 69 2HB ARG 69 -10.341 18.629 -8.008 531 HB3 ARG 69 1HB ARG 69 -10.202 20.162 -7.198 532 HG2 ARG 69 2HG ARG 69 -10.380 21.474 -9.167 533 HG3 ARG 69 1HG ARG 69 -9.887 20.184 -10.253 534 HD2 ARG 69 2HD ARG 69 -12.528 20.147 -8.628 535 HD3 ARG 69 1HD ARG 69 -12.393 20.685 -10.326 536 HH11 ARG 69 2HH1 ARG 69 -14.314 19.287 -9.873 537 HH12 ARG 69 1HH1 ARG 69 -15.053 17.679 -10.302 538 HH21 ARG 69 1HH2 ARG 69 -11.889 16.294 -10.542 539 HH22 ARG 69 2HH2 ARG 69 -13.680 15.997 -10.683 540 H SER 70 H SER 70 -8.286 20.404 -5.678 541 HA SER 70 HA SER 70 -7.014 18.155 -4.193 542 HG SER 70 HG SER 70 -6.549 20.017 -1.482 543 HB2 SER 70 2HB SER 70 -6.528 20.480 -3.603 544 HB3 SER 70 1HB SER 70 -8.230 20.813 -3.213 545 H PHE 71 H PHE 71 -7.934 17.275 -2.263 546 HA PHE 71 HA PHE 71 -10.390 15.773 -3.260 547 HD1 PHE 71 HD1 PHE 71 -9.968 13.874 -4.647 548 HD2 PHE 71 HD2 PHE 71 -6.118 14.169 -2.738 549 HE1 PHE 71 HE1 PHE 71 -8.910 12.693 -6.546 550 HE2 PHE 71 HE2 PHE 71 -5.109 12.967 -4.621 551 HZ PHE 71 HZ PHE 71 -6.481 12.248 -6.527 552 HB2 PHE 71 2HB PHE 71 -8.016 14.910 -1.514 553 HB3 PHE 71 1HB PHE 71 -9.380 13.907 -1.867 554 H SER 72 H SER 72 -9.197 16.414 0.108 555 HA SER 72 HA SER 72 -11.751 17.365 1.035 556 HG SER 72 HG SER 72 -12.620 15.489 -0.081 557 HB2 SER 72 2HB SER 72 -11.342 14.424 1.839 558 HB3 SER 72 1HB SER 72 -12.416 15.529 2.686 559 H VAL 73 H VAL 73 -9.004 15.488 2.458 560 HA VAL 73 HA VAL 73 -8.940 17.445 4.775 561 HB VAL 73 HB VAL 73 -8.890 15.071 5.346 562 HG11 VAL 73 1HG1 VAL 73 -7.574 14.022 3.507 563 HG12 VAL 73 2HG1 VAL 73 -6.868 13.652 5.070 564 HG13 VAL 73 3HG1 VAL 73 -6.107 14.890 4.036 565 HG21 VAL 73 3HG2 VAL 73 -6.241 16.436 6.146 566 HG22 VAL 73 1HG2 VAL 73 -7.072 15.145 7.023 567 HG23 VAL 73 2HG2 VAL 73 -7.831 16.752 6.882 568 H ASP 74 H ASP 74 -6.876 18.336 5.412 569 HA ASP 74 HA ASP 74 -5.582 19.836 3.212 570 HB2 ASP 74 2HB ASP 74 -6.241 20.647 5.655 571 HB3 ASP 74 1HB ASP 74 -4.730 19.894 6.172 572 H THR 75 H THR 75 -4.329 17.348 5.527 573 HA THR 75 HA THR 75 -1.872 16.707 3.962 574 HB THR 75 HB THR 75 -1.958 14.565 5.385 575 HG1 THR 75 HG1 THR 75 -3.334 14.805 7.216 576 HG21 THR 75 3HG2 THR 75 -1.309 15.533 7.473 577 HG22 THR 75 1HG2 THR 75 -2.199 17.043 7.181 578 HG23 THR 75 2HG2 THR 75 -0.736 16.659 6.228 579 H ALA 76 H ALA 76 -3.805 16.835 1.994 580 HA ALA 76 HA ALA 76 -3.583 14.047 0.869 581 HB1 ALA 76 3HB ALA 76 -5.999 13.840 0.238 582 HB2 ALA 76 1HB ALA 76 -6.366 15.334 1.157 583 HB3 ALA 76 2HB ALA 76 -5.734 13.895 1.990 584 H HIS 77 H HIS 77 -3.259 13.945 -1.166 585 HA HIS 77 HA HIS 77 -3.099 16.450 -2.919 586 HD1 HIS 77 HD1 HIS 77 -0.408 15.699 0.786 587 HD2 HIS 77 HD2 HIS 77 -1.385 18.877 -1.902 588 HE1 HIS 77 HE1 HIS 77 -0.160 17.971 1.969 589 HB2 HIS 77 2HB HIS 77 -0.693 14.979 -1.663 590 HB3 HIS 77 1HB HIS 77 -0.561 16.267 -2.866 591 H ARG 78 H ARG 78 -1.686 15.818 -4.963 592 HA ARG 78 HA ARG 78 -2.383 12.965 -5.840 593 HE ARG 78 HE ARG 78 -4.169 14.801 -10.602 594 HB2 ARG 78 2HB ARG 78 -4.233 14.645 -6.394 595 HB3 ARG 78 1HB ARG 78 -3.159 15.413 -7.536 596 HG2 ARG 78 2HG ARG 78 -3.918 12.410 -7.632 597 HG3 ARG 78 1HG ARG 78 -4.937 13.636 -8.345 598 HD2 ARG 78 2HD ARG 78 -2.050 12.991 -9.216 599 HD3 ARG 78 1HD ARG 78 -3.501 12.419 -9.995 600 HH11 ARG 78 2HH1 ARG 78 -0.823 14.382 -9.695 601 HH12 ARG 78 1HH1 ARG 78 -0.301 15.834 -10.612 602 HH21 ARG 78 1HH2 ARG 78 -3.558 16.517 -11.613 603 HH22 ARG 78 2HH2 ARG 78 -1.825 16.984 -11.641 604 H ALA 79 H ALA 79 -0.693 11.991 -6.659 605 HA ALA 79 HA ALA 79 1.639 13.465 -7.958 606 HB1 ALA 79 3HB ALA 79 1.085 10.512 -7.135 607 HB2 ALA 79 1HB ALA 79 2.128 11.702 -6.286 608 HB3 ALA 79 2HB ALA 79 2.587 11.066 -7.883 609 H ALA 80 H ALA 80 2.052 13.339 -10.238 610 HA ALA 80 HA ALA 80 0.204 11.658 -11.992 611 HB1 ALA 80 3HB ALA 80 1.204 12.948 -13.886 612 HB2 ALA 80 1HB ALA 80 2.265 13.785 -12.751 613 HB3 ALA 80 2HB ALA 80 0.513 14.009 -12.633 614 H SER 81 H SER 81 3.526 11.272 -10.896 615 HA SER 81 HA SER 81 3.583 8.612 -12.351 616 HG SER 81 HG SER 81 6.811 9.235 -13.878 617 HB2 SER 81 2HB SER 81 4.747 10.378 -13.784 618 HB3 SER 81 1HB SER 81 5.862 10.716 -12.446 619 H VAL 82 H VAL 82 6.104 7.793 -11.575 620 HA VAL 82 HA VAL 82 5.919 7.420 -8.557 621 HB VAL 82 HB VAL 82 7.953 6.184 -10.507 622 HG11 VAL 82 1HG1 VAL 82 8.481 4.773 -8.309 623 HG12 VAL 82 2HG1 VAL 82 7.829 6.178 -7.444 624 HG13 VAL 82 3HG1 VAL 82 9.234 6.357 -8.497 625 HG21 VAL 82 3HG2 VAL 82 5.995 4.907 -10.834 626 HG22 VAL 82 1HG2 VAL 82 5.392 5.124 -9.171 627 HG23 VAL 82 2HG2 VAL 82 6.707 4.003 -9.486 628 H GLU 83 H GLU 83 8.422 8.806 -10.812 629 HA GLU 83 HA GLU 83 9.889 10.346 -8.890 630 HB2 GLU 83 2HB GLU 83 9.138 10.983 -11.800 631 HB3 GLU 83 1HB GLU 83 10.335 11.861 -10.884 632 HG2 GLU 83 2HG GLU 83 11.968 10.149 -11.004 633 HG3 GLU 83 1HG GLU 83 10.809 8.850 -11.029 634 H GLU 84 H GLU 84 6.703 11.427 -10.329 635 HA GLU 84 HA GLU 84 6.621 13.913 -8.685 636 HB2 GLU 84 2HB GLU 84 4.258 12.313 -9.786 637 HB3 GLU 84 1HB GLU 84 4.171 13.951 -9.198 638 HG2 GLU 84 2HG GLU 84 6.101 13.975 -11.429 639 HG3 GLU 84 1HG GLU 84 4.726 13.023 -11.933 640 H ALA 85 H ALA 85 5.790 10.637 -7.922 641 HA ALA 85 HA ALA 85 4.240 11.317 -5.408 642 HB1 ALA 85 3HB ALA 85 5.193 8.552 -6.392 643 HB2 ALA 85 1HB ALA 85 3.618 9.253 -6.832 644 HB3 ALA 85 2HB ALA 85 3.994 8.872 -5.137 645 H VAL 86 H VAL 86 7.543 10.330 -6.234 646 HA VAL 86 HA VAL 86 8.385 10.152 -3.324 647 HB VAL 86 HB VAL 86 9.779 9.641 -5.987 648 HG11 VAL 86 1HG1 VAL 86 11.949 9.242 -4.816 649 HG12 VAL 86 2HG1 VAL 86 11.284 9.964 -3.317 650 HG13 VAL 86 3HG1 VAL 86 11.490 10.953 -4.789 651 HG21 VAL 86 3HG2 VAL 86 9.610 7.963 -3.381 652 HG22 VAL 86 1HG2 VAL 86 10.271 7.410 -4.931 653 HG23 VAL 86 2HG2 VAL 86 8.534 7.732 -4.775 654 H ASP 87 H ASP 87 8.992 12.568 -6.003 655 HA ASP 87 HA ASP 87 10.138 14.539 -4.259 656 HB2 ASP 87 2HB ASP 87 8.824 14.608 -7.011 657 HB3 ASP 87 1HB ASP 87 8.937 16.126 -6.175 658 H ILE 88 H ILE 88 6.554 14.036 -4.762 659 HA ILE 88 HA ILE 88 6.098 16.370 -2.994 660 HB ILE 88 HB ILE 88 4.001 16.404 -2.790 661 HG12 ILE 88 2HG1 ILE 88 3.215 13.785 -4.160 662 HG13 ILE 88 1HG1 ILE 88 3.557 13.825 -2.457 663 HG21 ILE 88 1HG2 ILE 88 3.102 16.700 -5.045 664 HG22 ILE 88 2HG2 ILE 88 4.235 15.504 -5.717 665 HG23 ILE 88 3HG2 ILE 88 4.848 17.046 -5.102 666 HD11 ILE 88 3HD1 ILE 88 1.885 16.023 -2.454 667 HD12 ILE 88 1HD1 ILE 88 1.334 14.384 -2.217 668 HD13 ILE 88 2HD1 ILE 88 1.201 15.120 -3.827 669 H ALA 89 H ALA 89 6.292 12.932 -2.229 670 HA ALA 89 HA ALA 89 5.623 13.181 0.656 671 HB1 ALA 89 3HB ALA 89 5.586 10.987 -0.472 672 HB2 ALA 89 1HB ALA 89 6.827 10.960 0.794 673 HB3 ALA 89 2HB ALA 89 7.308 11.113 -0.908 674 H ALA 90 H ALA 90 8.824 13.279 -0.999 675 HA ALA 90 HA ALA 90 10.319 14.007 1.463 676 HB1 ALA 90 3HB ALA 90 11.366 12.870 -0.464 677 HB2 ALA 90 1HB ALA 90 12.160 14.450 -0.278 678 HB3 ALA 90 2HB ALA 90 10.964 14.207 -1.561 679 H SER 91 H SER 91 8.680 16.032 -0.922 680 HA SER 91 HA SER 91 9.747 18.628 0.099 681 HG SER 91 HG SER 91 6.791 17.140 -1.064 682 HB2 SER 91 2HB SER 91 8.112 19.633 -1.361 683 HB3 SER 91 1HB SER 91 8.737 18.242 -2.208 684 H LEU 92 H LEU 92 7.219 16.608 1.414 685 HA LEU 92 HA LEU 92 6.224 18.890 3.133 686 HG LEU 92 HG LEU 92 5.478 15.518 1.845 687 HB2 LEU 92 2HB LEU 92 4.560 17.271 4.137 688 HB3 LEU 92 1HB LEU 92 4.342 18.010 2.592 689 HD11 LEU 92 1HD1 LEU 92 3.546 15.019 4.201 690 HD12 LEU 92 2HD1 LEU 92 5.282 14.606 4.126 691 HD13 LEU 92 3HD1 LEU 92 4.151 13.809 3.033 692 HD21 LEU 92 3HD2 LEU 92 2.451 16.142 2.015 693 HD22 LEU 92 1HD2 LEU 92 3.259 14.971 0.955 694 HD23 LEU 92 2HD2 LEU 92 3.533 16.690 0.707 695 H ASP 93 H ASP 93 7.159 15.625 4.308 696 HA ASP 93 HA ASP 93 9.588 16.467 5.464 697 HB2 ASP 93 2HB ASP 93 8.024 17.857 7.091 698 HB3 ASP 93 1HB ASP 93 7.618 16.349 7.829 699 H ALA 94 H ALA 94 10.313 14.375 4.820 700 HA ALA 94 HA ALA 94 9.721 12.098 6.637 701 HB1 ALA 94 3HB ALA 94 8.601 10.603 4.946 702 HB2 ALA 94 1HB ALA 94 8.647 11.917 3.729 703 HB3 ALA 94 2HB ALA 94 7.656 12.075 5.190 704 H GLU 95 H GLU 95 11.109 10.410 6.583 705 HA GLU 95 HA GLU 95 13.371 10.380 4.559 706 HB2 GLU 95 2HB GLU 95 13.387 8.296 6.743 707 HB3 GLU 95 1HB GLU 95 14.685 8.989 5.800 708 HG2 GLU 95 2HG GLU 95 14.395 11.184 7.200 709 HG3 GLU 95 1HG GLU 95 13.269 10.267 8.201 710 H THR 96 H THR 96 11.303 7.761 5.959 711 HA THR 96 HA THR 96 11.059 6.358 3.283 712 HB THR 96 HB THR 96 9.557 4.700 4.603 713 HG1 THR 96 HG1 THR 96 9.271 6.013 6.476 714 HG21 THR 96 3HG2 THR 96 12.508 4.937 5.367 715 HG22 THR 96 1HG2 THR 96 11.850 4.163 3.886 716 HG23 THR 96 2HG2 THR 96 11.512 3.478 5.496 717 H ALA 97 H ALA 97 9.099 5.828 2.252 718 HA ALA 97 HA ALA 97 6.481 6.910 3.428 719 HB1 ALA 97 3HB ALA 97 6.975 8.556 1.742 720 HB2 ALA 97 1HB ALA 97 5.723 7.534 1.009 721 HB3 ALA 97 2HB ALA 97 7.418 7.359 0.506 722 H TYR 98 H TYR 98 4.533 5.873 2.315 723 HA TYR 98 HA TYR 98 5.016 2.904 1.793 724 HD1 TYR 98 HD1 TYR 98 4.995 0.721 3.928 725 HD2 TYR 98 HD2 TYR 98 4.796 4.691 5.497 726 HE1 TYR 98 HE1 TYR 98 6.797 0.177 5.528 727 HE2 TYR 98 HE2 TYR 98 6.592 4.131 7.113 728 HH TYR 98 HH TYR 98 8.267 2.694 7.489 729 HB2 TYR 98 2HB TYR 98 3.092 3.954 3.958 730 HB3 TYR 98 1HB TYR 98 3.084 2.307 3.389 731 H VAL 99 H VAL 99 2.844 1.753 1.241 732 HA VAL 99 HA VAL 99 0.983 3.475 -0.439 733 HB VAL 99 HB VAL 99 1.840 3.156 -2.376 734 HG11 VAL 99 1HG1 VAL 99 3.932 2.218 -3.054 735 HG12 VAL 99 2HG1 VAL 99 4.107 1.329 -1.539 736 HG13 VAL 99 3HG1 VAL 99 4.096 3.082 -1.535 737 HG21 VAL 99 3HG2 VAL 99 0.389 1.307 -2.878 738 HG22 VAL 99 1HG2 VAL 99 1.621 0.165 -2.348 739 HG23 VAL 99 2HG2 VAL 99 1.909 1.150 -3.790 740 H ILE 100 H ILE 100 -0.903 2.916 0.788 741 HA ILE 100 HA ILE 100 -1.679 0.249 1.287 742 HB ILE 100 HB ILE 100 -3.921 2.177 0.550 743 HG12 ILE 100 2HG1 ILE 100 -3.105 3.363 2.393 744 HG13 ILE 100 1HG1 ILE 100 -4.270 2.322 3.101 745 HG21 ILE 100 1HG2 ILE 100 -4.043 -0.299 2.375 746 HG22 ILE 100 2HG2 ILE 100 -4.631 -0.301 0.702 747 HG23 ILE 100 3HG2 ILE 100 -5.409 0.734 1.901 748 HD11 ILE 100 3HD1 ILE 100 -2.239 2.355 4.540 749 HD12 ILE 100 1HD1 ILE 100 -1.236 1.802 3.186 750 HD13 ILE 100 2HD1 ILE 100 -2.480 0.711 3.849 751 H GLY 101 H GLY 101 -2.466 1.766 -1.665 752 HA2 GLY 101 2HA GLY 101 -2.409 0.890 -3.841 753 HA3 GLY 101 1HA GLY 101 -1.482 -0.416 -3.233 754 H GLY 102 H GLY 102 -2.416 -1.994 -4.910 755 HA2 GLY 102 2HA GLY 102 -4.963 -0.435 -5.701 756 HA3 GLY 102 1HA GLY 102 -3.413 -0.111 -6.362 757 H ALA 103 H ALA 103 -6.208 -1.677 -7.054 758 HA ALA 103 HA ALA 103 -5.946 -3.013 -9.414 759 HB1 ALA 103 3HB ALA 103 -7.717 -1.403 -10.295 760 HB2 ALA 103 1HB ALA 103 -7.155 -0.101 -9.282 761 HB3 ALA 103 2HB ALA 103 -7.934 -1.477 -8.563 762 H ALA 104 H ALA 104 -4.692 0.307 -9.370 763 HA ALA 104 HA ALA 104 -2.883 -0.382 -11.739 764 HB1 ALA 104 3HB ALA 104 -4.320 1.526 -12.323 765 HB2 ALA 104 1HB ALA 104 -2.608 2.014 -12.208 766 HB3 ALA 104 2HB ALA 104 -3.734 2.437 -10.899 767 H ILE 105 H ILE 105 -2.865 0.366 -8.305 768 HA ILE 105 HA ILE 105 -0.279 1.865 -8.400 769 HB ILE 105 HB ILE 105 -1.458 0.974 -5.808 770 HG12 ILE 105 2HG1 ILE 105 -3.423 2.020 -6.840 771 HG13 ILE 105 1HG1 ILE 105 -2.785 3.001 -5.586 772 HG21 ILE 105 1HG2 ILE 105 0.132 3.522 -6.436 773 HG22 ILE 105 2HG2 ILE 105 0.787 2.070 -5.661 774 HG23 ILE 105 3HG2 ILE 105 -0.481 3.009 -4.865 775 HD11 ILE 105 3HD1 ILE 105 -3.511 3.761 -8.180 776 HD12 ILE 105 1HD1 ILE 105 -1.741 3.686 -8.394 777 HD13 ILE 105 2HD1 ILE 105 -2.441 4.761 -7.142 778 H TYR 106 H TYR 106 -0.872 -1.168 -6.488 779 HA TYR 106 HA TYR 106 1.982 -1.898 -6.275 780 HD1 TYR 106 HD1 TYR 106 2.630 -4.771 -4.920 781 HD2 TYR 106 HD2 TYR 106 -0.675 -2.432 -3.456 782 HE1 TYR 106 HE1 TYR 106 3.231 -5.335 -2.622 783 HE2 TYR 106 HE2 TYR 106 -0.081 -3.062 -1.160 784 HH TYR 106 HH TYR 106 2.617 -4.256 -0.102 785 HB2 TYR 106 2HB TYR 106 -0.663 -3.334 -5.797 786 HB3 TYR 106 1HB TYR 106 0.645 -4.349 -6.269 787 H ALA 107 H ALA 107 -0.347 -2.548 -8.891 788 HA ALA 107 HA ALA 107 1.487 -4.192 -10.548 789 HB1 ALA 107 3HB ALA 107 -1.055 -2.551 -11.170 790 HB2 ALA 107 1HB ALA 107 -0.989 -4.274 -10.749 791 HB3 ALA 107 2HB ALA 107 -0.320 -3.711 -12.295 792 H LEU 108 H LEU 108 1.125 -0.659 -10.334 793 HA LEU 108 HA LEU 108 3.230 -0.351 -12.519 794 HG LEU 108 HG LEU 108 2.109 2.148 -9.958 795 HB2 LEU 108 2HB LEU 108 2.661 1.748 -12.914 796 HB3 LEU 108 1HB LEU 108 1.121 1.176 -12.375 797 HD11 LEU 108 1HD1 LEU 108 3.403 4.181 -10.274 798 HD12 LEU 108 2HD1 LEU 108 3.189 4.175 -12.031 799 HD13 LEU 108 3HD1 LEU 108 4.252 2.986 -11.259 800 HD21 LEU 108 3HD2 LEU 108 0.836 4.265 -10.421 801 HD22 LEU 108 1HD2 LEU 108 -0.097 2.811 -10.797 802 HD23 LEU 108 2HD2 LEU 108 0.660 3.775 -12.117 803 H PHE 109 H PHE 109 2.949 0.191 -8.997 804 HA PHE 109 HA PHE 109 5.727 1.137 -8.710 805 HD1 PHE 109 HD2 PHE 109 6.770 2.207 -6.369 806 HD2 PHE 109 HD1 PHE 109 2.558 2.710 -7.042 807 HE1 PHE 109 HE2 PHE 109 7.032 4.600 -6.102 808 HE2 PHE 109 HE1 PHE 109 2.827 5.136 -6.715 809 HZ PHE 109 HZ PHE 109 5.085 6.093 -6.286 810 HB2 PHE 109 2HB PHE 109 3.470 0.412 -6.751 811 HB3 PHE 109 1HB PHE 109 5.065 0.268 -6.127 812 H GLN 110 H GLN 110 4.619 -2.161 -8.817 813 HA GLN 110 HA GLN 110 6.377 -3.493 -7.141 814 HB2 GLN 110 2HB GLN 110 6.393 -5.486 -8.803 815 HB3 GLN 110 1HB GLN 110 4.995 -4.987 -7.924 816 HG2 GLN 110 2HG GLN 110 3.795 -5.100 -9.767 817 HG3 GLN 110 1HG GLN 110 4.499 -3.619 -10.307 818 HE21 GLN 110 1HE2 GLN 110 3.678 -6.456 -11.535 819 HE22 GLN 110 2HE2 GLN 110 5.009 -6.494 -12.793 820 HA PRO 111 HA PRO 111 10.572 -3.433 -9.394 821 HB2 PRO 111 2HB PRO 111 10.717 -1.500 -11.578 822 HB3 PRO 111 1HB PRO 111 10.842 -3.263 -11.637 823 HG2 PRO 111 2HG PRO 111 8.673 -1.823 -12.758 824 HG3 PRO 111 1HG PRO 111 8.671 -3.557 -12.340 825 HD2 PRO 111 2HD PRO 111 7.596 -1.234 -10.650 826 HD3 PRO 111 1HD PRO 111 6.828 -2.794 -10.980 827 H HIS 112 H HIS 112 8.793 -0.698 -8.499 828 HA HIS 112 HA HIS 112 11.244 1.125 -8.135 829 HD1 HIS 112 HD1 HIS 112 11.329 2.970 -10.358 830 HD2 HIS 112 HD2 HIS 112 7.270 1.671 -10.524 831 HE1 HIS 112 HE1 HIS 112 10.410 3.184 -12.790 832 HB2 HIS 112 2HB HIS 112 8.299 1.972 -8.084 833 HB3 HIS 112 1HB HIS 112 9.711 3.006 -8.003 834 H LEU 113 H LEU 113 9.130 -0.755 -6.116 835 HA LEU 113 HA LEU 113 9.289 0.923 -3.711 836 HG LEU 113 HG LEU 113 6.781 -1.390 -2.568 837 HB2 LEU 113 2HB LEU 113 8.968 -2.144 -4.030 838 HB3 LEU 113 1HB LEU 113 8.913 -1.342 -2.484 839 HD11 LEU 113 1HD1 LEU 113 7.098 1.061 -2.901 840 HD12 LEU 113 2HD1 LEU 113 5.547 0.526 -3.568 841 HD13 LEU 113 3HD1 LEU 113 6.912 0.848 -4.650 842 HD21 LEU 113 3HD2 LEU 113 6.587 -2.994 -4.338 843 HD22 LEU 113 1HD2 LEU 113 6.941 -1.807 -5.606 844 HD23 LEU 113 2HD2 LEU 113 5.390 -1.737 -4.709 845 H ASP 114 H ASP 114 10.497 0.763 -1.821 846 HA ASP 114 HA ASP 114 13.093 -0.764 -1.679 847 HB2 ASP 114 2HB ASP 114 12.982 1.297 -0.488 848 HB3 ASP 114 1HB ASP 114 11.392 0.978 0.197 849 H ARG 115 H ARG 115 9.789 -1.194 -0.207 850 HA ARG 115 HA ARG 115 10.226 -4.217 -0.307 851 HE ARG 115 HE ARG 115 12.294 -1.890 2.790 852 HB2 ARG 115 2HB ARG 115 9.995 -2.456 2.185 853 HB3 ARG 115 1HB ARG 115 9.092 -3.957 2.252 854 HG2 ARG 115 2HG ARG 115 10.966 -5.349 2.078 855 HG3 ARG 115 1HG ARG 115 11.982 -4.128 1.339 856 HD2 ARG 115 2HD ARG 115 11.086 -3.991 4.288 857 HD3 ARG 115 1HD ARG 115 12.552 -4.779 3.704 858 HH11 ARG 115 2HH1 ARG 115 13.708 -4.022 5.210 859 HH12 ARG 115 1HH1 ARG 115 14.877 -2.691 5.653 860 HH21 ARG 115 1HH2 ARG 115 13.553 -0.596 3.281 861 HH22 ARG 115 2HH2 ARG 115 14.763 -0.743 4.646 862 H MET 116 H MET 116 8.468 -5.556 -0.077 863 HA MET 116 HA MET 116 5.663 -4.330 -0.471 864 HB2 MET 116 2HB MET 116 7.066 -6.751 -1.633 865 HB3 MET 116 1HB MET 116 5.310 -6.718 -1.565 866 HG2 MET 116 2HG MET 116 5.364 -4.805 -3.186 867 HG3 MET 116 1HG MET 116 7.092 -4.551 -2.870 868 HE1 MET 116 3HE MET 116 4.608 -6.133 -5.156 869 HE2 MET 116 1HE MET 116 4.599 -7.503 -3.995 870 HE3 MET 116 2HE MET 116 5.282 -7.721 -5.635 871 H VAL 117 H VAL 117 5.208 -4.081 1.627 872 HA VAL 117 HA VAL 117 5.000 -6.306 3.667 873 HB VAL 117 HB VAL 117 4.444 -3.305 3.617 874 HG11 VAL 117 1HG1 VAL 117 4.092 -3.342 6.086 875 HG12 VAL 117 2HG1 VAL 117 4.260 -5.117 6.114 876 HG13 VAL 117 3HG1 VAL 117 2.869 -4.337 5.353 877 HG21 VAL 117 3HG2 VAL 117 6.908 -4.041 3.691 878 HG22 VAL 117 1HG2 VAL 117 6.563 -4.875 5.209 879 HG23 VAL 117 2HG2 VAL 117 6.419 -3.120 5.132 880 H LEU 118 H LEU 118 3.629 -7.551 2.169 881 HA LEU 118 HA LEU 118 0.692 -6.853 1.879 882 HG LEU 118 HG LEU 118 -0.355 -9.396 0.784 883 HB2 LEU 118 2HB LEU 118 1.581 -7.811 -0.043 884 HB3 LEU 118 1HB LEU 118 2.667 -8.907 0.757 885 HD11 LEU 118 1HD1 LEU 118 0.124 -9.457 -1.565 886 HD12 LEU 118 2HD1 LEU 118 0.320 -11.147 -1.114 887 HD13 LEU 118 3HD1 LEU 118 1.762 -10.143 -1.360 888 HD21 LEU 118 3HD2 LEU 118 0.360 -11.733 1.141 889 HD22 LEU 118 1HD2 LEU 118 1.031 -10.765 2.438 890 HD23 LEU 118 2HD2 LEU 118 2.081 -11.290 1.108 891 H SER 119 H SER 119 -0.992 -7.903 2.888 892 HA SER 119 HA SER 119 -0.364 -9.727 5.308 893 HG SER 119 HG SER 119 -1.518 -7.399 7.295 894 HB2 SER 119 2HB SER 119 -2.208 -7.332 4.975 895 HB3 SER 119 1HB SER 119 -2.727 -8.621 6.051 896 H ARG 120 H ARG 120 -0.783 -11.762 4.861 897 HA ARG 120 HA ARG 120 -2.723 -12.683 2.779 898 HE ARG 120 HE ARG 120 0.367 -16.350 1.299 899 HB2 ARG 120 2HB ARG 120 -1.045 -14.244 4.821 900 HB3 ARG 120 1HB ARG 120 -1.907 -15.006 3.505 901 HG2 ARG 120 2HG ARG 120 0.414 -13.002 3.112 902 HG3 ARG 120 1HG ARG 120 0.680 -14.675 3.359 903 HD2 ARG 120 2HD ARG 120 -0.956 -13.590 0.964 904 HD3 ARG 120 1HD ARG 120 0.754 -13.940 0.944 905 HH11 ARG 120 2HH1 ARG 120 -2.568 -14.600 0.558 906 HH12 ARG 120 1HH1 ARG 120 -3.385 -16.087 -0.082 907 HH21 ARG 120 1HH2 ARG 120 -0.587 -17.988 0.584 908 HH22 ARG 120 2HH2 ARG 120 -2.296 -17.938 -0.054 909 H VAL 121 H VAL 121 -4.910 -12.497 3.373 910 HA VAL 121 HA VAL 121 -5.802 -13.094 6.184 911 HB VAL 121 HB VAL 121 -7.360 -11.722 3.972 912 HG11 VAL 121 1HG1 VAL 121 -7.755 -11.643 7.032 913 HG12 VAL 121 2HG1 VAL 121 -8.853 -12.418 5.865 914 HG13 VAL 121 3HG1 VAL 121 -8.655 -10.664 5.881 915 HG21 VAL 121 3HG2 VAL 121 -5.088 -10.578 5.512 916 HG22 VAL 121 1HG2 VAL 121 -6.566 -9.653 5.798 917 HG23 VAL 121 2HG2 VAL 121 -6.013 -9.924 4.166 918 HA PRO 122 HA PRO 122 -7.860 -16.955 4.511 919 HB2 PRO 122 2HB PRO 122 -8.367 -17.458 7.478 920 HB3 PRO 122 1HB PRO 122 -7.691 -18.530 6.233 921 HG2 PRO 122 2HG PRO 122 -6.016 -17.398 8.061 922 HG3 PRO 122 1HG PRO 122 -5.519 -17.446 6.344 923 HD2 PRO 122 2HD PRO 122 -6.773 -15.061 7.809 924 HD3 PRO 122 1HD PRO 122 -5.308 -15.157 6.772 925 H GLY 123 H GLY 123 -9.533 -14.646 4.485 926 HA2 GLY 123 2HA GLY 123 -12.294 -15.682 5.419 927 HA3 GLY 123 1HA GLY 123 -12.059 -14.109 4.746 928 H GLU 124 H GLU 124 -10.478 -15.490 2.583 929 HA GLU 124 HA GLU 124 -10.735 -16.084 0.348 930 HB2 GLU 124 2HB GLU 124 -12.489 -18.315 1.367 931 HB3 GLU 124 1HB GLU 124 -11.465 -18.280 -0.042 932 HG2 GLU 124 2HG GLU 124 -9.552 -17.728 1.921 933 HG3 GLU 124 1HG GLU 124 -10.687 -18.659 2.870 934 H TYR 125 H TYR 125 -11.509 -14.804 -1.181 935 HA TYR 125 HA TYR 125 -14.523 -14.378 -1.471 936 HD1 TYR 125 HD1 TYR 125 -15.751 -12.947 0.662 937 HD2 TYR 125 HD2 TYR 125 -11.603 -11.858 0.868 938 HE1 TYR 125 HE1 TYR 125 -15.921 -12.692 3.108 939 HE2 TYR 125 HE2 TYR 125 -11.777 -11.670 3.300 940 HH TYR 125 HH TYR 125 -13.078 -11.729 5.017 941 HB2 TYR 125 2HB TYR 125 -12.562 -12.011 -1.259 942 HB3 TYR 125 1HB TYR 125 -14.284 -11.905 -1.435 943 H GLU 126 H GLU 126 -15.130 -14.297 -3.602 944 HA GLU 126 HA GLU 126 -13.437 -14.282 -5.839 945 HB2 GLU 126 2HB GLU 126 -16.276 -13.178 -6.099 946 HB3 GLU 126 1HB GLU 126 -15.290 -13.965 -7.316 947 HG2 GLU 126 2HG GLU 126 -15.572 -16.196 -6.193 948 HG3 GLU 126 1HG GLU 126 -16.411 -15.446 -4.844 949 H GLY 127 H GLY 127 -15.143 -11.294 -4.861 950 HA2 GLY 127 2HA GLY 127 -13.999 -9.081 -4.632 951 HA3 GLY 127 1HA GLY 127 -12.655 -9.700 -5.544 952 H ASP 128 H ASP 128 -13.377 -7.201 -5.880 953 HA ASP 128 HA ASP 128 -13.662 -7.402 -8.884 954 HB2 ASP 128 2HB ASP 128 -14.514 -5.262 -9.237 955 HB3 ASP 128 1HB ASP 128 -15.584 -5.994 -8.070 956 H THR 129 H THR 129 -11.886 -5.864 -6.267 957 HA THR 129 HA THR 129 -9.813 -4.822 -8.129 958 HB THR 129 HB THR 129 -9.942 -4.693 -5.079 959 HG1 THR 129 HG1 THR 129 -11.835 -3.834 -6.172 960 HG21 THR 129 3HG2 THR 129 -8.792 -2.533 -6.941 961 HG22 THR 129 1HG2 THR 129 -7.743 -3.870 -6.476 962 HG23 THR 129 2HG2 THR 129 -8.437 -2.809 -5.225 963 H TYR 130 H TYR 130 -8.317 -6.185 -8.825 964 HA TYR 130 HA TYR 130 -7.202 -8.414 -7.158 965 HD1 TYR 130 HD1 TYR 130 -9.800 -7.708 -9.852 966 HD2 TYR 130 HD2 TYR 130 -7.515 -11.197 -8.841 967 HE1 TYR 130 HE1 TYR 130 -11.858 -9.073 -9.877 968 HE2 TYR 130 HE2 TYR 130 -9.562 -12.563 -8.976 969 HH TYR 130 HH TYR 130 -12.297 -11.704 -8.483 970 HB2 TYR 130 2HB TYR 130 -7.185 -7.802 -10.165 971 HB3 TYR 130 1HB TYR 130 -6.341 -9.153 -9.457 972 H TYR 131 H TYR 131 -5.308 -8.623 -6.375 973 HA TYR 131 HA TYR 131 -3.139 -6.618 -6.599 974 HD1 TYR 131 HD2 TYR 131 -1.075 -9.984 -5.529 975 HD2 TYR 131 HD1 TYR 131 -2.106 -6.501 -3.258 976 HE1 TYR 131 HE2 TYR 131 1.288 -9.703 -4.883 977 HE2 TYR 131 HE1 TYR 131 0.190 -6.383 -2.434 978 HH TYR 131 HH TYR 131 2.237 -7.260 -2.514 979 HB2 TYR 131 2HB TYR 131 -3.810 -7.726 -4.481 980 HB3 TYR 131 1HB TYR 131 -3.483 -9.295 -5.062 981 HA PRO 132 HA PRO 132 -0.669 -8.740 -9.857 982 HB2 PRO 132 2HB PRO 132 1.905 -7.821 -8.620 983 HB3 PRO 132 1HB PRO 132 1.197 -7.400 -10.187 984 HG2 PRO 132 2HG PRO 132 1.279 -5.611 -8.119 985 HG3 PRO 132 1HG PRO 132 -0.107 -5.639 -9.234 986 HD2 PRO 132 2HD PRO 132 0.033 -6.865 -6.440 987 HD3 PRO 132 1HD PRO 132 -1.254 -5.878 -7.202 988 H GLU 133 H GLU 133 1.506 -9.962 -10.219 989 HA GLU 133 HA GLU 133 1.638 -12.360 -8.432 990 HB2 GLU 133 2HB GLU 133 3.221 -13.266 -10.205 991 HB3 GLU 133 1HB GLU 133 1.539 -13.082 -10.611 992 HG2 GLU 133 2HG GLU 133 3.600 -10.969 -11.532 993 HG3 GLU 133 1HG GLU 133 3.320 -12.470 -12.422 994 H TRP 134 H TRP 134 3.706 -13.347 -7.975 995 HA TRP 134 HA TRP 134 5.729 -11.438 -6.823 996 HD1 TRP 134 HD1 TRP 134 5.311 -15.586 -5.350 997 HE1 TRP 134 HE1 TRP 134 3.160 -17.077 -4.998 998 HE3 TRP 134 HE3 TRP 134 2.153 -11.759 -4.224 999 HZ2 TRP 134 HZ2 TRP 134 0.462 -16.466 -4.340 1000 HZ3 TRP 134 HZ3 TRP 134 -0.224 -12.261 -3.735 1001 HH2 TRP 134 HH2 TRP 134 -1.083 -14.569 -3.900 1002 HB2 TRP 134 2HB TRP 134 5.873 -12.753 -4.667 1003 HB3 TRP 134 1HB TRP 134 4.466 -11.753 -4.849 1004 H ASP 135 H ASP 135 7.822 -12.086 -7.291 1005 HA ASP 135 HA ASP 135 8.154 -14.803 -8.675 1006 HB2 ASP 135 2HB ASP 135 8.218 -12.663 -10.087 1007 HB3 ASP 135 1HB ASP 135 9.665 -12.178 -9.220 1008 H ALA 136 H ALA 136 10.970 -14.445 -8.706 1009 HA ALA 136 HA ALA 136 11.880 -14.778 -5.778 1010 HB1 ALA 136 3HB ALA 136 13.022 -16.920 -6.407 1011 HB2 ALA 136 1HB ALA 136 12.591 -16.700 -8.128 1012 HB3 ALA 136 2HB ALA 136 11.316 -17.034 -6.925 1013 H ALA 137 H ALA 137 12.873 -13.773 -8.991 1014 HA ALA 137 HA ALA 137 15.576 -12.874 -7.826 1015 HB1 ALA 137 3HB ALA 137 15.917 -14.226 -9.834 1016 HB2 ALA 137 1HB ALA 137 16.368 -12.535 -10.165 1017 HB3 ALA 137 2HB ALA 137 14.835 -13.186 -10.801 1018 H GLU 138 H GLU 138 12.534 -11.504 -8.986 1019 HA GLU 138 HA GLU 138 13.558 -8.693 -8.971 1020 HB2 GLU 138 2HB GLU 138 10.694 -9.729 -8.781 1021 HB3 GLU 138 1HB GLU 138 11.215 -8.067 -8.955 1022 HG2 GLU 138 2HG GLU 138 12.335 -9.624 -11.198 1023 HG3 GLU 138 1HG GLU 138 10.614 -9.906 -11.056 1024 H TRP 139 H TRP 139 11.573 -10.550 -6.573 1025 HA TRP 139 HA TRP 139 12.880 -8.985 -4.303 1026 HD1 TRP 139 HD1 TRP 139 8.654 -10.860 -4.585 1027 HE1 TRP 139 HE1 TRP 139 7.042 -10.496 -6.708 1028 HE3 TRP 139 HE3 TRP 139 10.695 -6.510 -6.166 1029 HZ2 TRP 139 HZ2 TRP 139 7.155 -8.733 -8.893 1030 HZ3 TRP 139 HZ3 TRP 139 9.983 -5.564 -8.350 1031 HH2 TRP 139 HH2 TRP 139 8.262 -6.672 -9.699 1032 HB2 TRP 139 2HB TRP 139 10.421 -9.072 -3.188 1033 HB3 TRP 139 1HB TRP 139 11.015 -7.747 -4.128 1034 H GLU 140 H GLU 140 13.413 -9.937 -2.526 1035 HA GLU 140 HA GLU 140 12.806 -12.888 -2.110 1036 HB2 GLU 140 2HB GLU 140 14.845 -13.202 -1.191 1037 HB3 GLU 140 1HB GLU 140 15.259 -11.927 -2.293 1038 HG2 GLU 140 2HG GLU 140 15.037 -10.321 -0.155 1039 HG3 GLU 140 1HG GLU 140 14.963 -11.808 0.780 1040 H LEU 141 H LEU 141 13.129 -12.997 0.719 1041 HA LEU 141 HA LEU 141 10.516 -11.673 1.640 1042 HG LEU 141 HG LEU 141 9.209 -14.871 3.109 1043 HB2 LEU 141 2HB LEU 141 10.849 -14.382 1.335 1044 HB3 LEU 141 1HB LEU 141 11.492 -14.220 2.939 1045 HD11 LEU 141 1HD1 LEU 141 7.989 -13.120 4.319 1046 HD12 LEU 141 2HD1 LEU 141 9.014 -11.852 3.647 1047 HD13 LEU 141 3HD1 LEU 141 9.708 -13.020 4.770 1048 HD21 LEU 141 3HD2 LEU 141 8.508 -14.260 0.748 1049 HD22 LEU 141 1HD2 LEU 141 8.290 -12.583 1.286 1050 HD23 LEU 141 2HD2 LEU 141 7.291 -13.878 1.980 1051 H ASP 142 H ASP 142 10.975 -10.108 3.109 1052 HA ASP 142 HA ASP 142 13.566 -9.920 4.642 1053 HB2 ASP 142 2HB ASP 142 12.273 -7.982 3.379 1054 HB3 ASP 142 1HB ASP 142 11.179 -7.990 4.759 1055 H ALA 143 H ALA 143 10.012 -9.971 5.466 1056 HA ALA 143 HA ALA 143 10.639 -11.675 7.912 1057 HB1 ALA 143 3HB ALA 143 10.838 -9.245 8.607 1058 HB2 ALA 143 1HB ALA 143 9.489 -10.045 9.448 1059 HB3 ALA 143 2HB ALA 143 9.167 -8.941 8.080 1060 H GLU 144 H GLU 144 9.270 -13.363 7.940 1061 HA GLU 144 HA GLU 144 6.295 -12.917 7.377 1062 HB2 GLU 144 2HB GLU 144 7.681 -14.587 6.021 1063 HB3 GLU 144 1HB GLU 144 7.700 -15.634 7.443 1064 HG2 GLU 144 2HG GLU 144 5.179 -15.762 7.387 1065 HG3 GLU 144 1HG GLU 144 5.112 -14.503 6.163 1066 H THR 145 H THR 145 5.000 -12.698 9.034 1067 HA THR 145 HA THR 145 5.336 -14.393 11.522 1068 HB THR 145 HB THR 145 6.631 -12.192 11.808 1069 HG1 THR 145 HG1 THR 145 4.639 -13.012 13.660 1070 HG21 THR 145 3HG2 THR 145 4.563 -10.690 13.176 1071 HG22 THR 145 1HG2 THR 145 4.057 -10.829 11.483 1072 HG23 THR 145 2HG2 THR 145 5.640 -10.148 11.887 1073 H ASP 146 H ASP 146 3.487 -14.898 12.731 1074 HA ASP 146 HA ASP 146 0.926 -14.489 11.385 1075 HB2 ASP 146 2HB ASP 146 0.060 -16.071 13.021 1076 HB3 ASP 146 1HB ASP 146 1.492 -16.640 12.208 1077 H HIS 147 H HIS 147 -0.921 -13.483 11.989 1078 HA HIS 147 HA HIS 147 -0.966 -11.548 14.351 1079 HD1 HIS 147 HD1 HIS 147 1.572 -10.930 13.194 1080 HD2 HIS 147 HD2 HIS 147 -1.028 -7.600 12.732 1081 HE1 HIS 147 HE1 HIS 147 2.905 -8.728 13.438 1082 HB2 HIS 147 2HB HIS 147 -1.027 -10.857 11.362 1083 HB3 HIS 147 1HB HIS 147 -2.126 -9.980 12.386 1084 H GLU 148 H GLU 148 -3.404 -10.447 14.160 1085 HA GLU 148 HA GLU 148 -4.912 -12.624 15.349 1086 HB2 GLU 148 2HB GLU 148 -5.829 -9.770 14.723 1087 HB3 GLU 148 1HB GLU 148 -6.764 -10.886 15.658 1088 HG2 GLU 148 2HG GLU 148 -4.997 -10.984 17.442 1089 HG3 GLU 148 1HG GLU 148 -3.949 -9.927 16.530 1090 H GLY 149 H GLY 149 -5.872 -10.872 12.354 1091 HA2 GLY 149 2HA GLY 149 -7.734 -13.241 11.589 1092 HA3 GLY 149 1HA GLY 149 -7.922 -11.629 10.968 1093 H PHE 150 H PHE 150 -4.607 -12.830 11.012 1094 HA PHE 150 HA PHE 150 -4.469 -13.641 8.167 1095 HD1 PHE 150 HD1 PHE 150 -1.702 -10.446 7.902 1096 HD2 PHE 150 HD2 PHE 150 -5.469 -9.756 9.822 1097 HE1 PHE 150 HE1 PHE 150 -0.737 -8.510 9.089 1098 HE2 PHE 150 HE2 PHE 150 -4.522 -7.800 10.966 1099 HZ PHE 150 HZ PHE 150 -2.173 -7.153 10.608 1100 HB2 PHE 150 2HB PHE 150 -3.757 -11.586 7.110 1101 HB3 PHE 150 1HB PHE 150 -5.277 -11.290 7.852 1102 H THR 151 H THR 151 -2.243 -13.521 7.216 1103 HA THR 151 HA THR 151 -0.023 -13.480 9.345 1104 HB THR 151 HB THR 151 0.976 -15.296 8.714 1105 HG1 THR 151 HG1 THR 151 2.066 -14.378 7.039 1106 HG21 THR 151 3HG2 THR 151 0.003 -17.005 7.219 1107 HG22 THR 151 1HG2 THR 151 -1.152 -15.825 6.558 1108 HG23 THR 151 2HG2 THR 151 -1.274 -16.315 8.260 1109 H LEU 152 H LEU 152 1.440 -12.004 9.209 1110 HA LEU 152 HA LEU 152 1.424 -9.821 7.128 1111 HG LEU 152 HG LEU 152 3.373 -7.961 9.920 1112 HB2 LEU 152 2HB LEU 152 1.508 -9.202 9.459 1113 HB3 LEU 152 1HB LEU 152 2.745 -10.352 9.838 1114 HD11 LEU 152 1HD1 LEU 152 5.099 -9.908 9.604 1115 HD12 LEU 152 2HD1 LEU 152 5.636 -8.262 9.217 1116 HD13 LEU 152 3HD1 LEU 152 5.205 -9.392 7.924 1117 HD21 LEU 152 3HD2 LEU 152 3.415 -7.954 6.833 1118 HD22 LEU 152 1HD2 LEU 152 3.891 -6.654 7.938 1119 HD23 LEU 152 2HD2 LEU 152 2.194 -7.151 7.839 1120 H GLN 153 H GLN 153 2.738 -9.857 5.423 1121 HA GLN 153 HA GLN 153 5.350 -11.484 5.376 1122 HB2 GLN 153 2HB GLN 153 2.966 -11.637 3.535 1123 HB3 GLN 153 1HB GLN 153 4.387 -11.128 2.659 1124 HG2 GLN 153 2HG GLN 153 5.649 -13.158 3.491 1125 HG3 GLN 153 1HG GLN 153 4.226 -13.692 4.367 1126 HE21 GLN 153 1HE2 GLN 153 4.991 -15.457 2.822 1127 HE22 GLN 153 2HE2 GLN 153 4.375 -15.353 1.081 1128 H GLU 154 H GLU 154 7.036 -10.177 5.115 1129 HA GLU 154 HA GLU 154 6.734 -7.475 3.677 1130 HB2 GLU 154 2HB GLU 154 8.817 -8.024 5.835 1131 HB3 GLU 154 1HB GLU 154 8.397 -6.500 5.109 1132 HG2 GLU 154 2HG GLU 154 5.924 -7.138 6.213 1133 HG3 GLU 154 1HG GLU 154 6.942 -8.103 7.224 1134 H TRP 155 H TRP 155 7.509 -7.620 1.721 1135 HA TRP 155 HA TRP 155 9.698 -9.599 0.946 1136 HD1 TRP 155 HD1 TRP 155 5.525 -9.670 0.678 1137 HE1 TRP 155 HE1 TRP 155 4.518 -12.038 0.038 1138 HE3 TRP 155 HE3 TRP 155 9.526 -11.253 -2.061 1139 HZ2 TRP 155 HZ2 TRP 155 5.403 -14.084 -1.705 1140 HZ3 TRP 155 HZ3 TRP 155 9.337 -13.405 -3.304 1141 HH2 TRP 155 HH2 TRP 155 7.304 -14.765 -3.150 1142 HB2 TRP 155 2HB TRP 155 7.373 -8.236 -0.436 1143 HB3 TRP 155 1HB TRP 155 8.601 -8.948 -1.442 1144 H VAL 156 H VAL 156 11.754 -8.571 1.113 1145 HA VAL 156 HA VAL 156 12.145 -5.821 -0.005 1146 HB VAL 156 HB VAL 156 13.244 -6.478 2.106 1147 HG11 VAL 156 1HG1 VAL 156 14.040 -8.789 1.619 1148 HG12 VAL 156 2HG1 VAL 156 15.389 -7.752 2.135 1149 HG13 VAL 156 3HG1 VAL 156 15.182 -8.157 0.409 1150 HG21 VAL 156 3HG2 VAL 156 15.326 -5.544 0.050 1151 HG22 VAL 156 1HG2 VAL 156 15.304 -5.252 1.815 1152 HG23 VAL 156 2HG2 VAL 156 14.100 -4.481 0.775 1153 H ARG 157 H ARG 157 12.968 -5.172 -1.820 1154 HA ARG 157 HA ARG 157 13.329 -6.883 -4.172 1155 HE ARG 157 HE ARG 157 14.564 -3.775 -7.275 1156 HB2 ARG 157 2HB ARG 157 13.619 -3.967 -3.519 1157 HB3 ARG 157 1HB ARG 157 14.832 -4.482 -4.655 1158 HG2 ARG 157 2HG ARG 157 12.945 -5.510 -6.140 1159 HG3 ARG 157 1HG ARG 157 11.803 -4.863 -4.961 1160 HD2 ARG 157 2HD ARG 157 11.913 -3.255 -6.805 1161 HD3 ARG 157 1HD ARG 157 12.571 -2.610 -5.314 1162 HH11 ARG 157 2HH1 ARG 157 13.155 -0.834 -6.015 1163 HH12 ARG 157 1HH1 ARG 157 14.614 0.154 -6.354 1164 HH21 ARG 157 1HH2 ARG 157 16.265 -2.692 -7.531 1165 HH22 ARG 157 2HH2 ARG 157 16.342 -0.889 -7.179 1166 H SER 158 H SER 158 15.028 -7.610 -5.278 1167 HA SER 158 HA SER 158 17.256 -8.779 -4.163 1168 HG SER 158 HG SER 158 16.540 -10.318 -6.597 1169 HB2 SER 158 2HB SER 158 16.282 -8.273 -6.901 1170 HB3 SER 158 1HB SER 158 18.013 -8.074 -6.927 1171 H ALA 159 H ALA 159 17.436 -5.534 -3.969 1172 HA ALA 159 HA ALA 159 20.452 -5.282 -4.478 1173 HB1 ALA 159 3HB ALA 159 19.970 -2.785 -4.583 1174 HB2 ALA 159 1HB ALA 159 18.244 -3.110 -4.369 1175 HB3 ALA 159 2HB ALA 159 19.075 -3.691 -5.835 1176 H SER 160 H SER 160 19.685 -6.640 -2.224 1177 HA SER 160 HA SER 160 19.486 -5.082 0.184 1178 HG SER 160 HG SER 160 18.179 -8.349 0.156 1179 HB2 SER 160 2HB SER 160 20.342 -8.005 -0.294 1180 HB3 SER 160 1HB SER 160 20.091 -7.329 1.318 1181 H SER 161 H SER 161 20.842 -4.266 1.623 1182 HA SER 161 HA SER 161 22.740 -3.341 2.640 1183 HG SER 161 HG SER 161 22.700 -5.905 3.208 1184 HB2 SER 161 2HB SER 161 24.260 -5.733 1.600 1185 HB3 SER 161 1HB SER 161 25.041 -4.445 2.518 1186 H ARG 162 H ARG 162 22.426 -1.506 1.598 1187 HA ARG 162 HA ARG 162 24.814 -0.669 -0.130 1188 HE ARG 162 HE ARG 162 23.924 2.110 -4.305 1189 HB2 ARG 162 1HB ARG 162 22.566 -1.103 -1.402 1190 HB3 ARG 162 2HB ARG 162 21.906 0.295 -0.579 1191 HG2 ARG 162 1HG ARG 162 23.711 1.757 -1.653 1192 HG3 ARG 162 2HG ARG 162 24.436 0.303 -2.384 1193 HD2 ARG 162 1HD ARG 162 22.244 -0.201 -3.578 1194 HD3 ARG 162 2HD ARG 162 21.526 1.255 -2.878 1195 HH11 ARG 162 2HH1 ARG 162 20.743 0.829 -5.087 1196 HH12 ARG 162 1HH1 ARG 162 20.851 1.584 -6.743 1197 HH21 ARG 162 1HH2 ARG 162 23.932 2.925 -6.285 1198 HH22 ARG 162 2HH2 ARG 162 22.470 2.620 -7.320 Start of MODEL 14 1 HA MET 1 HA MET 1 16.496 5.232 1.306 2 H1 MET 1 1H MET 1 15.829 7.480 2.271 3 H2 MET 1 2H MET 1 15.142 6.671 3.498 4 HB2 MET 1 1HB MET 1 14.210 4.449 3.191 5 HB3 MET 1 2HB MET 1 14.898 3.415 1.960 6 HG2 MET 1 1HG MET 1 17.201 3.674 3.246 7 HG3 MET 1 2HG MET 1 16.204 4.250 4.590 8 HE1 MET 1 3HE MET 1 13.388 2.370 3.943 9 HE2 MET 1 1HE MET 1 14.071 2.898 5.509 10 HE3 MET 1 2HE MET 1 13.744 1.156 5.192 11 H GLU 2 H GLU 2 13.534 4.237 0.891 12 HA GLU 2 HA GLU 2 12.202 6.537 -0.343 13 HB2 GLU 2 2HB GLU 2 12.105 5.912 -2.678 14 HB3 GLU 2 1HB GLU 2 13.746 6.128 -2.154 15 HG2 GLU 2 2HG GLU 2 13.677 3.401 -1.884 16 HG3 GLU 2 1HG GLU 2 12.382 3.537 -3.074 17 H LEU 3 H LEU 3 10.561 4.237 -1.907 18 HA LEU 3 HA LEU 3 8.706 4.172 0.500 19 HG LEU 3 HG LEU 3 8.919 6.250 -2.422 20 HB2 LEU 3 2HB LEU 3 6.789 4.286 -1.370 21 HB3 LEU 3 1HB LEU 3 7.525 5.605 -0.550 22 HD11 LEU 3 1HD1 LEU 3 7.716 3.809 -3.923 23 HD12 LEU 3 2HD1 LEU 3 9.415 4.075 -3.515 24 HD13 LEU 3 3HD1 LEU 3 8.651 5.141 -4.681 25 HD21 LEU 3 3HD2 LEU 3 6.862 6.740 -4.029 26 HD22 LEU 3 1HD2 LEU 3 6.810 7.330 -2.353 27 HD23 LEU 3 2HD2 LEU 3 5.891 5.878 -2.806 28 H VAL 4 H VAL 4 7.251 2.770 1.011 29 HA VAL 4 HA VAL 4 7.651 -0.081 0.012 30 HB VAL 4 HB VAL 4 7.342 1.020 2.841 31 HG11 VAL 4 1HG1 VAL 4 7.724 -1.879 1.893 32 HG12 VAL 4 2HG1 VAL 4 6.418 -1.256 2.878 33 HG13 VAL 4 3HG1 VAL 4 8.058 -1.380 3.573 34 HG21 VAL 4 3HG2 VAL 4 9.891 0.033 1.470 35 HG22 VAL 4 1HG2 VAL 4 9.729 0.272 3.231 36 HG23 VAL 4 2HG2 VAL 4 9.552 1.630 2.129 37 H SER 5 H SER 5 5.888 -1.272 -0.524 38 HA SER 5 HA SER 5 3.183 0.017 -0.282 39 HG SER 5 HG SER 5 4.548 -2.636 -3.024 40 HB2 SER 5 2HB SER 5 2.697 -1.502 -2.188 41 HB3 SER 5 1HB SER 5 4.109 -0.521 -2.422 42 H VAL 6 H VAL 6 1.447 -0.578 0.844 43 HA VAL 6 HA VAL 6 1.581 -3.076 2.517 44 HB VAL 6 HB VAL 6 1.463 -2.331 4.531 45 HG11 VAL 6 1HG1 VAL 6 3.572 -1.299 3.747 46 HG12 VAL 6 2HG1 VAL 6 2.852 -0.298 5.018 47 HG13 VAL 6 3HG1 VAL 6 2.733 0.187 3.329 48 HG21 VAL 6 3HG2 VAL 6 -0.688 -1.147 4.579 49 HG22 VAL 6 1HG2 VAL 6 0.067 0.307 3.904 50 HG23 VAL 6 2HG2 VAL 6 0.533 -0.291 5.511 51 H ALA 7 H ALA 7 0.222 -4.142 1.021 52 HA ALA 7 HA ALA 7 -2.771 -3.397 1.301 53 HB1 ALA 7 3HB ALA 7 -3.177 -4.714 -0.784 54 HB2 ALA 7 1HB ALA 7 -1.426 -5.032 -0.944 55 HB3 ALA 7 2HB ALA 7 -2.066 -3.375 -1.053 56 H ALA 8 H ALA 8 -4.193 -4.786 2.251 57 HA ALA 8 HA ALA 8 -3.308 -7.591 3.067 58 HB1 ALA 8 3HB ALA 8 -5.645 -5.827 4.059 59 HB2 ALA 8 1HB ALA 8 -4.133 -6.097 4.915 60 HB3 ALA 8 2HB ALA 8 -5.244 -7.451 4.654 61 H LEU 9 H LEU 9 -4.253 -9.444 2.319 62 HA LEU 9 HA LEU 9 -6.677 -9.427 0.599 63 HG LEU 9 HG LEU 9 -3.573 -9.376 -2.328 64 HB2 LEU 9 2HB LEU 9 -5.657 -9.956 -1.544 65 HB3 LEU 9 1HB LEU 9 -5.390 -8.350 -1.006 66 HD11 LEU 9 1HD1 LEU 9 -2.636 -8.405 0.446 67 HD12 LEU 9 2HD1 LEU 9 -3.111 -7.368 -0.913 68 HD13 LEU 9 3HD1 LEU 9 -1.680 -8.383 -1.028 69 HD21 LEU 9 3HD2 LEU 9 -2.744 -11.025 0.134 70 HD22 LEU 9 1HD2 LEU 9 -2.012 -11.008 -1.486 71 HD23 LEU 9 2HD2 LEU 9 -3.621 -11.700 -1.280 72 H ALA 10 H ALA 10 -7.319 -11.334 -0.465 73 HA ALA 10 HA ALA 10 -6.469 -13.898 1.018 74 HB1 ALA 10 3HB ALA 10 -8.526 -12.702 1.882 75 HB2 ALA 10 1HB ALA 10 -8.976 -14.255 1.179 76 HB3 ALA 10 2HB ALA 10 -9.260 -12.773 0.252 77 H GLU 11 H GLU 11 -8.814 -15.208 -0.593 78 HA GLU 11 HA GLU 11 -7.110 -16.445 -2.666 79 HB2 GLU 11 2HB GLU 11 -8.794 -17.753 -1.439 80 HB3 GLU 11 1HB GLU 11 -10.099 -16.779 -2.084 81 HG2 GLU 11 2HG GLU 11 -10.042 -18.949 -3.215 82 HG3 GLU 11 1HG GLU 11 -9.759 -17.684 -4.373 83 H ASN 12 H ASN 12 -7.692 -16.639 -4.867 84 HA ASN 12 HA ASN 12 -6.878 -15.494 -6.702 85 HB2 ASN 12 2HB ASN 12 -9.726 -15.076 -6.602 86 HB3 ASN 12 1HB ASN 12 -9.125 -13.524 -7.042 87 HD21 ASN 12 1HD2 ASN 12 -7.233 -13.827 -8.852 88 HD22 ASN 12 2HD2 ASN 12 -7.876 -14.873 -10.239 89 H ARG 13 H ARG 13 -6.107 -14.181 -4.165 90 HA ARG 13 HA ARG 13 -5.017 -12.336 -3.317 91 HE ARG 13 HE ARG 13 -2.439 -11.497 -8.923 92 HB2 ARG 13 2HB ARG 13 -3.196 -11.316 -4.567 93 HB3 ARG 13 1HB ARG 13 -3.209 -13.069 -4.543 94 HG2 ARG 13 2HG ARG 13 -4.066 -13.118 -6.916 95 HG3 ARG 13 1HG ARG 13 -4.048 -11.348 -6.985 96 HD2 ARG 13 2HD ARG 13 -1.502 -11.478 -6.486 97 HD3 ARG 13 1HD ARG 13 -1.626 -13.222 -6.477 98 HH11 ARG 13 2HH1 ARG 13 -0.481 -14.025 -7.652 99 HH12 ARG 13 1HH1 ARG 13 0.081 -14.558 -9.318 100 HH21 ARG 13 1HH2 ARG 13 -1.821 -12.122 -10.807 101 HH22 ARG 13 2HH2 ARG 13 -0.596 -13.420 -11.033 102 H VAL 14 H VAL 14 -7.341 -11.770 -3.321 103 HA VAL 14 HA VAL 14 -8.087 -9.249 -4.711 104 HB VAL 14 HB VAL 14 -9.470 -11.350 -2.975 105 HG11 VAL 14 1HG1 VAL 14 -10.875 -8.673 -3.557 106 HG12 VAL 14 2HG1 VAL 14 -10.505 -9.391 -1.965 107 HG13 VAL 14 3HG1 VAL 14 -11.651 -10.200 -3.039 108 HG21 VAL 14 3HG2 VAL 14 -10.121 -10.075 -5.730 109 HG22 VAL 14 1HG2 VAL 14 -10.946 -11.474 -4.974 110 HG23 VAL 14 2HG2 VAL 14 -9.250 -11.607 -5.468 111 H ILE 15 H ILE 15 -7.379 -7.349 -4.095 112 HA ILE 15 HA ILE 15 -6.681 -6.484 -1.331 113 HB ILE 15 HB ILE 15 -7.442 -4.680 -3.664 114 HG12 ILE 15 2HG1 ILE 15 -4.465 -4.985 -3.057 115 HG13 ILE 15 1HG1 ILE 15 -5.213 -6.360 -3.799 116 HG21 ILE 15 1HG2 ILE 15 -5.521 -3.818 -1.388 117 HG22 ILE 15 2HG2 ILE 15 -7.260 -3.541 -1.273 118 HG23 ILE 15 3HG2 ILE 15 -6.357 -2.800 -2.567 119 HD11 ILE 15 3HD1 ILE 15 -5.999 -5.060 -5.751 120 HD12 ILE 15 1HD1 ILE 15 -4.277 -4.738 -5.530 121 HD13 ILE 15 2HD1 ILE 15 -5.479 -3.530 -5.015 122 H GLY 16 H GLY 16 -9.742 -6.036 -3.206 123 HA2 GLY 16 2HA GLY 16 -11.212 -5.269 -0.693 124 HA3 GLY 16 1HA GLY 16 -10.938 -3.886 -1.751 125 H ARG 17 H ARG 17 -13.326 -4.192 -1.208 126 HA ARG 17 HA ARG 17 -14.612 -4.994 -3.829 127 HE ARG 17 HE ARG 17 -15.932 -7.840 0.001 128 HB2 ARG 17 2HB ARG 17 -15.873 -5.832 -1.130 129 HB3 ARG 17 1HB ARG 17 -16.736 -5.760 -2.658 130 HG2 ARG 17 2HG ARG 17 -15.261 -7.460 -3.691 131 HG3 ARG 17 1HG ARG 17 -14.280 -7.609 -2.254 132 HD2 ARG 17 2HD ARG 17 -17.315 -8.263 -2.403 133 HD3 ARG 17 1HD ARG 17 -15.993 -9.435 -2.580 134 HH11 ARG 17 2HH1 ARG 17 -17.093 -10.729 -1.475 135 HH12 ARG 17 1HH1 ARG 17 -17.226 -11.613 0.120 136 HH21 ARG 17 1HH2 ARG 17 -15.993 -8.897 1.839 137 HH22 ARG 17 2HH2 ARG 17 -16.612 -10.597 1.882 138 H ASP 18 H ASP 18 -16.304 -3.710 -0.950 139 HA ASP 18 HA ASP 18 -17.220 -1.444 -2.263 140 HB2 ASP 18 2HB ASP 18 -16.908 -1.815 0.778 141 HB3 ASP 18 1HB ASP 18 -17.971 -0.677 -0.030 142 H GLY 19 H GLY 19 -14.169 -1.444 -0.497 143 HA2 GLY 19 2HA GLY 19 -13.219 0.878 -2.040 144 HA3 GLY 19 1HA GLY 19 -13.603 1.458 -0.435 145 H GLU 20 H GLU 20 -12.142 0.775 1.312 146 HA GLU 20 HA GLU 20 -9.422 0.035 0.535 147 HB2 GLU 20 2HB GLU 20 -8.722 0.001 2.808 148 HB3 GLU 20 1HB GLU 20 -9.590 1.458 2.402 149 HG2 GLU 20 2HG GLU 20 -11.564 0.707 3.785 150 HG3 GLU 20 1HG GLU 20 -10.782 -0.817 4.113 151 H LEU 21 H LEU 21 -11.747 -2.085 2.304 152 HA LEU 21 HA LEU 21 -10.420 -4.439 1.089 153 HG LEU 21 HG LEU 21 -9.279 -2.353 3.854 154 HB2 LEU 21 2HB LEU 21 -9.653 -5.385 3.416 155 HB3 LEU 21 1HB LEU 21 -8.711 -4.343 2.386 156 HD11 LEU 21 1HD1 LEU 21 -9.943 -3.060 6.311 157 HD12 LEU 21 2HD1 LEU 21 -10.611 -4.538 5.567 158 HD13 LEU 21 3HD1 LEU 21 -11.256 -2.951 5.122 159 HD21 LEU 21 3HD2 LEU 21 -7.123 -3.748 3.909 160 HD22 LEU 21 1HD2 LEU 21 -7.753 -4.491 5.395 161 HD23 LEU 21 2HD2 LEU 21 -7.484 -2.744 5.318 162 HA PRO 22 HA PRO 22 -14.195 -6.429 1.425 163 HB2 PRO 22 2HB PRO 22 -13.241 -9.182 1.215 164 HB3 PRO 22 1HB PRO 22 -13.574 -8.035 -0.092 165 HG2 PRO 22 2HG PRO 22 -10.989 -9.030 0.567 166 HG3 PRO 22 1HG PRO 22 -11.368 -7.665 -0.503 167 HD2 PRO 22 2HD PRO 22 -10.628 -7.568 2.449 168 HD3 PRO 22 1HD PRO 22 -10.096 -6.531 1.150 169 H TRP 23 H TRP 23 -12.294 -7.108 4.087 170 HA TRP 23 HA TRP 23 -14.552 -8.383 5.703 171 HD1 TRP 23 HD1 TRP 23 -11.063 -6.544 7.692 172 HE1 TRP 23 HE1 TRP 23 -8.806 -5.882 6.502 173 HE3 TRP 23 HE3 TRP 23 -11.020 -10.379 4.410 174 HZ2 TRP 23 HZ2 TRP 23 -7.507 -6.864 4.250 175 HZ3 TRP 23 HZ3 TRP 23 -9.303 -10.402 2.615 176 HH2 TRP 23 HH2 TRP 23 -7.627 -8.600 2.489 177 HB2 TRP 23 2HB TRP 23 -12.814 -8.922 7.480 178 HB3 TRP 23 1HB TRP 23 -12.602 -9.797 5.997 179 HA PRO 24 HA PRO 24 -15.213 -4.457 7.639 180 HB2 PRO 24 2HB PRO 24 -14.947 -5.422 10.486 181 HB3 PRO 24 1HB PRO 24 -16.334 -4.722 9.643 182 HG2 PRO 24 2HG PRO 24 -16.273 -7.420 10.190 183 HG3 PRO 24 1HG PRO 24 -16.937 -6.845 8.648 184 HD2 PRO 24 2HD PRO 24 -14.102 -7.907 9.147 185 HD3 PRO 24 1HD PRO 24 -15.260 -8.366 7.867 186 H SER 25 H SER 25 -12.470 -5.745 9.523 187 HA SER 25 HA SER 25 -10.342 -4.198 9.196 188 HG SER 25 HG SER 25 -11.503 -2.036 8.284 189 HB2 SER 25 2HB SER 25 -12.207 -2.183 10.525 190 HB3 SER 25 1HB SER 25 -10.502 -2.174 10.961 191 H ILE 26 H ILE 26 -9.359 -5.811 10.241 192 HA ILE 26 HA ILE 26 -9.964 -6.530 13.072 193 HB ILE 26 HB ILE 26 -7.465 -7.657 12.740 194 HG12 ILE 26 2HG1 ILE 26 -7.479 -6.975 10.282 195 HG13 ILE 26 1HG1 ILE 26 -6.921 -8.539 10.769 196 HG21 ILE 26 1HG2 ILE 26 -10.108 -9.074 12.181 197 HG22 ILE 26 2HG2 ILE 26 -9.347 -8.813 13.770 198 HG23 ILE 26 3HG2 ILE 26 -8.541 -9.826 12.568 199 HD11 ILE 26 3HD1 ILE 26 -8.975 -9.648 9.912 200 HD12 ILE 26 1HD1 ILE 26 -8.249 -8.626 8.663 201 HD13 ILE 26 2HD1 ILE 26 -9.703 -8.072 9.522 202 HA PRO 27 HA PRO 27 -7.234 -3.442 15.076 203 HB2 PRO 27 2HB PRO 27 -6.725 -5.662 17.110 204 HB3 PRO 27 1HB PRO 27 -7.138 -3.956 17.380 205 HG2 PRO 27 2HG PRO 27 -9.114 -5.805 17.619 206 HG3 PRO 27 1HG PRO 27 -9.467 -4.337 16.658 207 HD2 PRO 27 2HD PRO 27 -8.568 -7.074 15.558 208 HD3 PRO 27 1HD PRO 27 -10.003 -6.076 15.117 209 H ALA 28 H ALA 28 -5.651 -6.702 14.729 210 HA ALA 28 HA ALA 28 -2.984 -5.554 14.502 211 HB1 ALA 28 3HB ALA 28 -3.505 -7.989 14.846 212 HB2 ALA 28 1HB ALA 28 -2.270 -7.694 13.618 213 HB3 ALA 28 2HB ALA 28 -3.909 -8.117 13.103 214 H ASP 29 H ASP 29 -5.434 -5.559 11.990 215 HA ASP 29 HA ASP 29 -3.578 -4.826 9.737 216 HB2 ASP 29 2HB ASP 29 -5.678 -6.081 9.340 217 HB3 ASP 29 1HB ASP 29 -6.651 -4.780 10.031 218 H LYS 30 H LYS 30 -6.269 -2.933 11.109 219 HA LYS 30 HA LYS 30 -5.079 -0.368 10.742 220 HB2 LYS 30 2HB LYS 30 -7.501 -1.322 12.076 221 HB3 LYS 30 1HB LYS 30 -6.759 -0.139 13.086 222 HG2 LYS 30 2HG LYS 30 -8.389 0.973 11.719 223 HG3 LYS 30 1HG LYS 30 -6.820 1.605 11.283 224 HD2 LYS 30 2HD LYS 30 -6.866 0.476 9.089 225 HD3 LYS 30 1HD LYS 30 -8.082 -0.640 9.610 226 HE2 LYS 30 2HE LYS 30 -9.493 0.587 8.389 227 HE3 LYS 30 1HE LYS 30 -9.722 1.532 9.822 228 HZ1 LYS 30 3HZ LYS 30 -7.890 2.180 7.505 229 HZ2 LYS 30 1HZ LYS 30 -8.013 3.187 8.834 230 HZ3 LYS 30 2HZ LYS 30 -9.268 2.914 7.809 231 H LYS 31 H LYS 31 -4.019 -2.506 13.281 232 HA LYS 31 HA LYS 31 -2.283 -0.318 14.522 233 HB2 LYS 31 2HB LYS 31 -3.299 -1.995 16.088 234 HB3 LYS 31 1HB LYS 31 -2.454 -3.272 15.253 235 HG2 LYS 31 2HG LYS 31 -1.263 -2.876 17.283 236 HG3 LYS 31 1HG LYS 31 -0.248 -2.449 15.930 237 HD2 LYS 31 2HD LYS 31 -0.794 0.028 16.282 238 HD3 LYS 31 1HD LYS 31 -1.847 -0.420 17.613 239 HE2 LYS 31 2HE LYS 31 0.253 0.383 18.576 240 HE3 LYS 31 1HE LYS 31 0.109 -1.336 18.936 241 HZ1 LYS 31 3HZ LYS 31 1.568 -1.772 16.888 242 HZ2 LYS 31 1HZ LYS 31 2.398 -0.849 17.980 243 HZ3 LYS 31 2HZ LYS 31 1.757 -0.185 16.623 244 H GLN 32 H GLN 32 -1.808 -3.014 12.194 245 HA GLN 32 HA GLN 32 1.172 -2.697 12.156 246 HB2 GLN 32 2HB GLN 32 0.110 -4.840 11.613 247 HB3 GLN 32 1HB GLN 32 -0.725 -4.155 10.229 248 HG2 GLN 32 2HG GLN 32 2.375 -4.172 10.491 249 HG3 GLN 32 1HG GLN 32 1.504 -5.570 9.932 250 HE21 GLN 32 1HE2 GLN 32 -0.036 -5.017 7.969 251 HE22 GLN 32 2HE2 GLN 32 0.847 -4.059 6.678 252 H TYR 33 H TYR 33 -1.394 -1.828 9.756 253 HA TYR 33 HA TYR 33 0.044 0.256 8.376 254 HD1 TYR 33 HD1 TYR 33 -3.638 1.107 10.163 255 HD2 TYR 33 HD2 TYR 33 -2.531 1.997 6.127 256 HE1 TYR 33 HE1 TYR 33 -5.364 2.834 10.085 257 HE2 TYR 33 HE2 TYR 33 -4.294 3.740 6.051 258 HH TYR 33 HH TYR 33 -6.009 4.815 7.273 259 HB2 TYR 33 2HB TYR 33 -1.815 -0.175 7.205 260 HB3 TYR 33 1HB TYR 33 -2.753 -0.680 8.543 261 H ARG 34 H ARG 34 -1.494 0.678 11.632 262 HA ARG 34 HA ARG 34 -0.676 3.603 11.522 263 HE ARG 34 HE ARG 34 -5.644 4.918 11.684 264 HB2 ARG 34 2HB ARG 34 -1.808 2.096 13.901 265 HB3 ARG 34 1HB ARG 34 -1.396 3.804 13.903 266 HG2 ARG 34 2HG ARG 34 -3.344 2.765 11.761 267 HG3 ARG 34 1HG ARG 34 -3.875 2.827 13.397 268 HD2 ARG 34 2HD ARG 34 -3.078 5.468 13.179 269 HD3 ARG 34 1HD ARG 34 -3.238 5.114 11.469 270 HH11 ARG 34 2HH1 ARG 34 -4.235 4.885 14.810 271 HH12 ARG 34 1HH1 ARG 34 -5.842 4.959 15.685 272 HH21 ARG 34 1HH2 ARG 34 -7.509 4.992 12.655 273 HH22 ARG 34 2HH2 ARG 34 -7.615 4.982 14.469 274 H SER 35 H SER 35 0.942 0.762 12.982 275 HA SER 35 HA SER 35 3.139 2.598 14.024 276 HG SER 35 HG SER 35 3.445 1.819 15.700 277 HB2 SER 35 2HB SER 35 2.630 -0.411 14.170 278 HB3 SER 35 1HB SER 35 4.309 0.115 14.163 279 H ARG 36 H ARG 36 2.518 0.877 11.151 280 HA ARG 36 HA ARG 36 5.199 1.418 9.878 281 HE ARG 36 HE ARG 36 4.355 -2.700 8.415 282 HB2 ARG 36 2HB ARG 36 3.563 -0.651 9.637 283 HB3 ARG 36 1HB ARG 36 2.516 0.409 8.724 284 HG2 ARG 36 2HG ARG 36 3.582 -0.764 7.064 285 HG3 ARG 36 1HG ARG 36 4.470 0.731 7.066 286 HD2 ARG 36 2HD ARG 36 6.055 -1.122 6.852 287 HD3 ARG 36 1HD ARG 36 6.326 -0.383 8.432 288 HH11 ARG 36 2HH1 ARG 36 7.722 -2.057 8.381 289 HH12 ARG 36 1HH1 ARG 36 8.034 -3.769 8.819 290 HH21 ARG 36 1HH2 ARG 36 4.884 -4.541 9.056 291 HH22 ARG 36 2HH2 ARG 36 6.634 -5.017 9.285 292 H VAL 37 H VAL 37 1.817 2.534 8.993 293 HA VAL 37 HA VAL 37 3.123 4.746 7.403 294 HB VAL 37 HB VAL 37 1.519 4.789 5.919 295 HG11 VAL 37 1HG1 VAL 37 0.935 2.589 5.015 296 HG12 VAL 37 2HG1 VAL 37 0.975 1.854 6.652 297 HG13 VAL 37 3HG1 VAL 37 2.471 2.429 5.909 298 HG21 VAL 37 3HG2 VAL 37 -0.540 5.314 7.123 299 HG22 VAL 37 1HG2 VAL 37 -0.670 3.684 7.773 300 HG23 VAL 37 2HG2 VAL 37 -0.909 3.961 6.040 301 H ALA 38 H ALA 38 1.553 4.784 10.436 302 HA ALA 38 HA ALA 38 0.096 7.341 9.886 303 HB1 ALA 38 3HB ALA 38 -0.925 5.806 11.395 304 HB2 ALA 38 1HB ALA 38 -0.584 7.337 12.227 305 HB3 ALA 38 2HB ALA 38 0.438 5.941 12.545 306 H ASP 39 H ASP 39 3.338 6.833 11.138 307 HA ASP 39 HA ASP 39 3.840 9.790 11.323 308 HB2 ASP 39 2HB ASP 39 5.492 7.254 11.717 309 HB3 ASP 39 1HB ASP 39 6.325 8.690 11.209 310 H ASP 40 H ASP 40 4.882 7.268 8.908 311 HA ASP 40 HA ASP 40 5.780 9.205 7.063 312 HB2 ASP 40 2HB ASP 40 5.360 6.188 7.042 313 HB3 ASP 40 1HB ASP 40 6.040 6.990 5.631 314 HA PRO 41 HA PRO 41 2.384 10.170 4.056 315 HB2 PRO 41 2HB PRO 41 4.729 9.990 2.055 316 HB3 PRO 41 1HB PRO 41 3.445 11.201 2.104 317 HG2 PRO 41 2HG PRO 41 5.825 11.859 3.194 318 HG3 PRO 41 1HG PRO 41 4.409 12.158 4.224 319 HD2 PRO 41 2HD PRO 41 6.295 9.731 4.352 320 HD3 PRO 41 1HD PRO 41 5.692 10.786 5.658 321 H VAL 42 H VAL 42 0.928 9.085 2.772 322 HA VAL 42 HA VAL 42 1.772 6.385 1.618 323 HB VAL 42 HB VAL 42 -0.966 7.251 2.630 324 HG11 VAL 42 1HG1 VAL 42 -1.117 5.349 0.944 325 HG12 VAL 42 2HG1 VAL 42 -1.511 4.797 2.578 326 HG13 VAL 42 3HG1 VAL 42 0.081 4.418 1.870 327 HG21 VAL 42 3HG2 VAL 42 -0.315 5.470 4.483 328 HG22 VAL 42 1HG2 VAL 42 0.474 7.059 4.596 329 HG23 VAL 42 2HG2 VAL 42 1.361 5.680 3.927 330 H VAL 43 H VAL 43 1.746 5.951 -0.422 331 HA VAL 43 HA VAL 43 0.298 7.718 -2.423 332 HB VAL 43 HB VAL 43 1.853 7.124 -4.089 333 HG11 VAL 43 1HG1 VAL 43 3.626 7.448 -1.578 334 HG12 VAL 43 2HG1 VAL 43 2.872 8.794 -2.416 335 HG13 VAL 43 3HG1 VAL 43 4.079 7.798 -3.248 336 HG21 VAL 43 3HG2 VAL 43 3.820 5.534 -3.702 337 HG22 VAL 43 1HG2 VAL 43 2.272 4.716 -3.763 338 HG23 VAL 43 2HG2 VAL 43 3.059 5.054 -2.191 339 H LEU 44 H LEU 44 -1.708 7.120 -2.934 340 HA LEU 44 HA LEU 44 -2.324 4.166 -3.496 341 HG LEU 44 HG LEU 44 -4.336 6.936 -1.971 342 HB2 LEU 44 2HB LEU 44 -4.167 4.106 -2.003 343 HB3 LEU 44 1HB LEU 44 -2.723 4.462 -1.143 344 HD11 LEU 44 1HD1 LEU 44 -6.026 6.598 -0.144 345 HD12 LEU 44 2HD1 LEU 44 -5.353 4.982 0.216 346 HD13 LEU 44 3HD1 LEU 44 -6.150 5.292 -1.334 347 HD21 LEU 44 3HD2 LEU 44 -3.245 6.193 0.814 348 HD22 LEU 44 1HD2 LEU 44 -3.762 7.779 0.196 349 HD23 LEU 44 2HD2 LEU 44 -2.285 7.035 -0.430 350 H GLY 45 H GLY 45 -5.106 4.190 -3.792 351 HA2 GLY 45 2HA GLY 45 -5.099 5.221 -6.702 352 HA3 GLY 45 1HA GLY 45 -5.761 3.656 -6.233 353 H ARG 46 H ARG 46 -7.624 4.641 -7.470 354 HA ARG 46 HA ARG 46 -9.386 6.372 -5.640 355 HE ARG 46 HE ARG 46 -11.770 8.732 -7.203 356 HB2 ARG 46 2HB ARG 46 -9.780 5.959 -8.626 357 HB3 ARG 46 1HB ARG 46 -10.982 6.625 -7.569 358 HG2 ARG 46 2HG ARG 46 -8.171 7.854 -7.907 359 HG3 ARG 46 1HG ARG 46 -9.555 8.367 -8.843 360 HD2 ARG 46 2HD ARG 46 -9.256 8.655 -5.768 361 HD3 ARG 46 1HD ARG 46 -9.032 9.922 -6.965 362 HH11 ARG 46 2HH1 ARG 46 -9.980 10.751 -4.999 363 HH12 ARG 46 1HH1 ARG 46 -11.512 11.551 -4.427 364 HH21 ARG 46 1HH2 ARG 46 -13.472 9.588 -6.390 365 HH22 ARG 46 2HH2 ARG 46 -13.318 10.906 -5.163 366 H THR 47 H THR 47 -9.270 2.988 -6.879 367 HA THR 47 HA THR 47 -11.618 2.294 -5.306 368 HB THR 47 HB THR 47 -9.140 0.534 -5.757 369 HG1 THR 47 HG1 THR 47 -11.461 -0.074 -6.980 370 HG21 THR 47 3HG2 THR 47 -12.049 -0.177 -4.888 371 HG22 THR 47 1HG2 THR 47 -10.575 -0.417 -3.921 372 HG23 THR 47 2HG2 THR 47 -10.801 -1.319 -5.422 373 H THR 48 H THR 48 -8.242 1.818 -3.973 374 HA THR 48 HA THR 48 -9.092 1.965 -1.258 375 HB THR 48 HB THR 48 -6.724 2.441 -0.620 376 HG1 THR 48 HG1 THR 48 -5.242 2.057 -2.391 377 HG21 THR 48 3HG2 THR 48 -6.807 0.068 -2.558 378 HG22 THR 48 1HG2 THR 48 -7.566 0.029 -0.961 379 HG23 THR 48 2HG2 THR 48 -5.834 0.299 -1.098 380 H PHE 49 H PHE 49 -8.344 4.902 -3.197 381 HA PHE 49 HA PHE 49 -8.537 6.621 -0.755 382 HD1 PHE 49 HD2 PHE 49 -10.048 9.558 -2.589 383 HD2 PHE 49 HD1 PHE 49 -5.997 8.831 -1.392 384 HE1 PHE 49 HE2 PHE 49 -9.921 11.829 -1.626 385 HE2 PHE 49 HE1 PHE 49 -5.819 11.165 -0.620 386 HZ PHE 49 HZ PHE 49 -7.769 12.620 -0.637 387 HB2 PHE 49 2HB PHE 49 -7.093 7.212 -2.711 388 HB3 PHE 49 1HB PHE 49 -8.525 7.654 -3.618 389 H GLU 50 H GLU 50 -10.953 5.666 -3.152 390 HA GLU 50 HA GLU 50 -12.955 7.663 -2.134 391 HB2 GLU 50 2HB GLU 50 -13.335 5.258 -3.998 392 HB3 GLU 50 1HB GLU 50 -14.656 6.239 -3.399 393 HG2 GLU 50 2HG GLU 50 -13.695 8.293 -4.355 394 HG3 GLU 50 1HG GLU 50 -12.213 7.471 -4.856 395 H SER 51 H SER 51 -11.888 4.528 -1.000 396 HA SER 51 HA SER 51 -13.612 4.815 1.445 397 HG SER 51 HG SER 51 -12.287 3.158 3.342 398 HB2 SER 51 2HB SER 51 -12.213 2.691 0.543 399 HB3 SER 51 1HB SER 51 -10.963 3.331 1.561 400 H MET 52 H MET 52 -10.098 5.491 0.899 401 HA MET 52 HA MET 52 -9.537 6.379 3.533 402 HB2 MET 52 2HB MET 52 -7.918 5.763 1.535 403 HB3 MET 52 1HB MET 52 -8.018 7.484 1.102 404 HG2 MET 52 2HG MET 52 -6.033 7.294 2.420 405 HG3 MET 52 1HG MET 52 -7.208 8.025 3.495 406 HE1 MET 52 3HE MET 52 -6.258 3.940 2.716 407 HE2 MET 52 1HE MET 52 -5.051 4.189 4.025 408 HE3 MET 52 2HE MET 52 -5.031 5.257 2.596 409 H ARG 53 H ARG 53 -10.821 8.430 1.163 410 HA ARG 53 HA ARG 53 -10.788 11.095 2.404 411 HE ARG 53 HE ARG 53 -15.796 11.197 -0.782 412 HB2 ARG 53 2HB ARG 53 -11.424 10.757 0.157 413 HB3 ARG 53 1HB ARG 53 -12.527 9.423 0.510 414 HG2 ARG 53 2HG ARG 53 -14.252 10.649 1.271 415 HG3 ARG 53 1HG ARG 53 -13.356 12.104 1.616 416 HD2 ARG 53 2HD ARG 53 -13.137 12.721 -0.769 417 HD3 ARG 53 1HD ARG 53 -13.428 11.070 -1.291 418 HH11 ARG 53 2HH1 ARG 53 -14.278 14.142 0.302 419 HH12 ARG 53 1HH1 ARG 53 -15.889 14.914 0.638 420 HH21 ARG 53 1HH2 ARG 53 -17.529 12.067 -0.342 421 HH22 ARG 53 2HH2 ARG 53 -17.655 13.767 0.312 422 H ASP 54 H ASP 54 -12.501 8.194 3.489 423 HA ASP 54 HA ASP 54 -13.913 9.763 5.676 424 HB2 ASP 54 2HB ASP 54 -14.280 6.930 4.565 425 HB3 ASP 54 1HB ASP 54 -14.907 7.396 6.133 426 H ASP 55 H ASP 55 -11.784 6.769 5.690 427 HA ASP 55 HA ASP 55 -10.630 7.784 8.351 428 HB2 ASP 55 2HB ASP 55 -11.210 5.027 7.442 429 HB3 ASP 55 1HB ASP 55 -9.500 5.171 7.731 430 H LEU 56 H LEU 56 -8.849 9.020 8.161 431 HA LEU 56 HA LEU 56 -7.157 8.983 5.763 432 HG LEU 56 HG LEU 56 -7.292 12.539 6.824 433 HB2 LEU 56 2HB LEU 56 -6.431 10.478 8.320 434 HB3 LEU 56 1HB LEU 56 -5.903 10.798 6.709 435 HD11 LEU 56 1HD1 LEU 56 -9.569 10.552 6.168 436 HD12 LEU 56 2HD1 LEU 56 -8.476 11.284 4.985 437 HD13 LEU 56 3HD1 LEU 56 -9.583 12.297 5.909 438 HD21 LEU 56 3HD2 LEU 56 -7.813 12.129 9.222 439 HD22 LEU 56 1HD2 LEU 56 -9.215 11.131 8.751 440 HD23 LEU 56 2HD2 LEU 56 -9.161 12.869 8.341 441 HA PRO 57 HA PRO 57 -3.891 6.119 7.309 442 HB2 PRO 57 2HB PRO 57 -1.951 6.418 5.461 443 HB3 PRO 57 1HB PRO 57 -3.553 5.803 5.054 444 HG2 PRO 57 2HG PRO 57 -2.391 8.540 4.473 445 HG3 PRO 57 1HG PRO 57 -3.544 7.583 3.508 446 HD2 PRO 57 2HD PRO 57 -4.171 9.708 5.378 447 HD3 PRO 57 1HD PRO 57 -5.348 8.627 4.575 448 H GLY 58 H GLY 58 -1.761 8.845 6.431 449 HA2 GLY 58 2HA GLY 58 -0.848 9.213 9.355 450 HA3 GLY 58 1HA GLY 58 0.336 8.763 8.124 451 H SER 59 H SER 59 1.491 10.633 8.632 452 HA SER 59 HA SER 59 0.706 13.335 8.334 453 HG SER 59 HG SER 59 4.143 14.109 8.380 454 HB2 SER 59 2HB SER 59 2.892 12.331 9.203 455 HB3 SER 59 1HB SER 59 3.434 12.166 7.525 456 H ALA 60 H ALA 60 0.620 11.285 5.609 457 HA ALA 60 HA ALA 60 -0.490 13.523 4.124 458 HB1 ALA 60 3HB ALA 60 2.319 12.689 3.236 459 HB2 ALA 60 1HB ALA 60 1.629 14.291 3.460 460 HB3 ALA 60 2HB ALA 60 1.182 13.337 2.026 461 H GLN 61 H GLN 61 -1.313 13.123 2.012 462 HA GLN 61 HA GLN 61 -2.050 10.199 1.409 463 HB2 GLN 61 2HB GLN 61 -3.717 12.069 2.747 464 HB3 GLN 61 1HB GLN 61 -4.227 12.282 1.092 465 HG2 GLN 61 2HG GLN 61 -4.746 9.818 0.903 466 HG3 GLN 61 1HG GLN 61 -4.138 9.551 2.504 467 HE21 GLN 61 1HE2 GLN 61 -5.323 11.287 4.155 468 HE22 GLN 61 2HE2 GLN 61 -7.137 10.946 4.021 469 H ILE 62 H ILE 62 -1.202 9.859 -0.499 470 HA ILE 62 HA ILE 62 -1.236 11.948 -2.742 471 HB ILE 62 HB ILE 62 0.633 9.646 -1.951 472 HG12 ILE 62 2HG1 ILE 62 1.473 12.483 -2.456 473 HG13 ILE 62 1HG1 ILE 62 0.747 12.108 -0.902 474 HG21 ILE 62 1HG2 ILE 62 2.094 10.380 -3.943 475 HG22 ILE 62 2HG2 ILE 62 0.649 11.264 -4.549 476 HG23 ILE 62 3HG2 ILE 62 0.633 9.481 -4.397 477 HD11 ILE 62 3HD1 ILE 62 3.380 11.003 -2.056 478 HD12 ILE 62 1HD1 ILE 62 2.643 10.369 -0.545 479 HD13 ILE 62 2HD1 ILE 62 3.155 12.056 -0.659 480 H VAL 63 H VAL 63 -2.795 11.484 -4.323 481 HA VAL 63 HA VAL 63 -3.281 8.570 -5.048 482 HB VAL 63 HB VAL 63 -4.779 11.045 -5.908 483 HG11 VAL 63 1HG1 VAL 63 -5.296 8.107 -6.757 484 HG12 VAL 63 2HG1 VAL 63 -4.871 9.431 -7.854 485 HG13 VAL 63 3HG1 VAL 63 -6.443 9.455 -7.029 486 HG21 VAL 63 3HG2 VAL 63 -5.235 10.237 -3.607 487 HG22 VAL 63 1HG2 VAL 63 -5.499 8.580 -4.180 488 HG23 VAL 63 2HG2 VAL 63 -6.653 9.880 -4.600 489 H MET 64 H MET 64 -2.041 7.549 -6.373 490 HA MET 64 HA MET 64 -0.719 8.797 -8.775 491 HB2 MET 64 2HB MET 64 -0.725 6.052 -7.394 492 HB3 MET 64 1HB MET 64 -0.354 6.114 -9.078 493 HG2 MET 64 2HG MET 64 1.280 8.259 -8.107 494 HG3 MET 64 1HG MET 64 1.332 7.080 -6.806 495 HE1 MET 64 3HE MET 64 0.946 6.510 -10.932 496 HE2 MET 64 1HE MET 64 2.698 6.693 -11.207 497 HE3 MET 64 2HE MET 64 1.757 8.031 -10.477 498 H SER 65 H SER 65 -2.321 9.647 -9.861 499 HA SER 65 HA SER 65 -3.654 7.939 -11.891 500 HG SER 65 HG SER 65 -6.991 8.000 -11.254 501 HB2 SER 65 2HB SER 65 -5.325 7.869 -9.945 502 HB3 SER 65 1HB SER 65 -5.531 9.615 -10.072 503 H ARG 66 H ARG 66 -5.414 9.843 -13.016 504 HA ARG 66 HA ARG 66 -3.827 12.455 -13.203 505 HE ARG 66 HE ARG 66 -5.028 12.144 -18.393 506 HB2 ARG 66 2HB ARG 66 -3.523 10.903 -15.295 507 HB3 ARG 66 1HB ARG 66 -5.168 11.359 -15.728 508 HG2 ARG 66 2HG ARG 66 -4.401 13.864 -15.580 509 HG3 ARG 66 1HG ARG 66 -2.788 13.280 -15.194 510 HD2 ARG 66 2HD ARG 66 -2.596 13.719 -17.500 511 HD3 ARG 66 1HD ARG 66 -2.791 11.994 -17.457 512 HH11 ARG 66 2HH1 ARG 66 -3.915 15.340 -17.636 513 HH12 ARG 66 1HH1 ARG 66 -5.129 16.142 -18.731 514 HH21 ARG 66 1HH2 ARG 66 -6.354 13.050 -19.661 515 HH22 ARG 66 2HH2 ARG 66 -6.463 14.865 -19.838 516 H SER 67 H SER 67 -4.934 14.085 -12.734 517 HA SER 67 HA SER 67 -6.831 15.699 -12.925 518 HG SER 67 HG SER 67 -8.114 13.335 -14.424 519 HB2 SER 67 2HB SER 67 -8.921 13.551 -12.384 520 HB3 SER 67 1HB SER 67 -9.168 15.287 -12.668 521 H GLU 68 H GLU 68 -6.662 16.859 -11.198 522 HA GLU 68 HA GLU 68 -6.741 15.641 -8.394 523 HB2 GLU 68 2HB GLU 68 -5.238 17.499 -7.783 524 HB3 GLU 68 1HB GLU 68 -4.602 16.483 -9.026 525 HG2 GLU 68 2HG GLU 68 -4.124 18.343 -10.314 526 HG3 GLU 68 1HG GLU 68 -5.842 18.692 -10.480 527 H ARG 69 H ARG 69 -7.062 19.067 -8.454 528 HA ARG 69 HA ARG 69 -8.792 20.573 -8.052 529 HE ARG 69 HE ARG 69 -12.764 20.286 -11.556 530 HB2 ARG 69 2HB ARG 69 -10.055 19.173 -9.791 531 HB3 ARG 69 1HB ARG 69 -10.801 18.338 -8.411 532 HG2 ARG 69 2HG ARG 69 -11.795 20.651 -7.741 533 HG3 ARG 69 1HG ARG 69 -11.218 21.273 -9.274 534 HD2 ARG 69 2HD ARG 69 -13.136 18.846 -8.869 535 HD3 ARG 69 1HD ARG 69 -13.653 20.459 -9.273 536 HH11 ARG 69 2HH1 ARG 69 -11.992 17.349 -9.814 537 HH12 ARG 69 1HH1 ARG 69 -11.896 16.392 -11.355 538 HH21 ARG 69 1HH2 ARG 69 -12.644 19.170 -13.237 539 HH22 ARG 69 2HH2 ARG 69 -12.243 17.384 -13.206 540 H SER 70 H SER 70 -7.463 19.385 -5.899 541 HA SER 70 HA SER 70 -7.535 18.803 -3.638 542 HG SER 70 HG SER 70 -7.846 20.179 -1.561 543 HB2 SER 70 2HB SER 70 -8.339 21.200 -3.502 544 HB3 SER 70 1HB SER 70 -9.993 20.607 -3.401 545 H PHE 71 H PHE 71 -8.947 17.879 -1.737 546 HA PHE 71 HA PHE 71 -10.637 15.587 -2.878 547 HD1 PHE 71 HD1 PHE 71 -10.075 14.185 -4.499 548 HD2 PHE 71 HD2 PHE 71 -6.150 14.187 -2.713 549 HE1 PHE 71 HE1 PHE 71 -9.160 12.972 -6.447 550 HE2 PHE 71 HE2 PHE 71 -5.300 12.927 -4.630 551 HZ PHE 71 HZ PHE 71 -6.779 12.311 -6.486 552 HB2 PHE 71 2HB PHE 71 -7.930 15.227 -1.476 553 HB3 PHE 71 1HB PHE 71 -9.136 13.984 -1.591 554 H SER 72 H SER 72 -9.243 16.070 0.440 555 HA SER 72 HA SER 72 -11.925 16.558 1.521 556 HG SER 72 HG SER 72 -12.824 14.501 3.536 557 HB2 SER 72 2HB SER 72 -11.872 13.936 0.986 558 HB3 SER 72 1HB SER 72 -11.057 13.796 2.521 559 H VAL 73 H VAL 73 -8.874 15.134 2.892 560 HA VAL 73 HA VAL 73 -9.037 17.100 5.216 561 HB VAL 73 HB VAL 73 -8.452 14.790 5.794 562 HG11 VAL 73 1HG1 VAL 73 -5.883 15.081 4.113 563 HG12 VAL 73 2HG1 VAL 73 -7.206 13.910 3.864 564 HG13 VAL 73 3HG1 VAL 73 -6.173 13.796 5.292 565 HG21 VAL 73 3HG2 VAL 73 -7.502 16.702 7.204 566 HG22 VAL 73 1HG2 VAL 73 -5.977 16.545 6.337 567 HG23 VAL 73 2HG2 VAL 73 -6.577 15.186 7.296 568 H ASP 74 H ASP 74 -7.223 18.512 5.724 569 HA ASP 74 HA ASP 74 -6.005 20.008 3.556 570 HB2 ASP 74 2HB ASP 74 -4.635 21.050 5.392 571 HB3 ASP 74 1HB ASP 74 -6.370 21.196 5.491 572 H THR 75 H THR 75 -4.352 17.563 5.679 573 HA THR 75 HA THR 75 -2.129 17.392 3.773 574 HB THR 75 HB THR 75 -2.090 16.780 6.278 575 HG1 THR 75 HG1 THR 75 -0.202 15.578 5.690 576 HG21 THR 75 3HG2 THR 75 -2.202 14.409 6.914 577 HG22 THR 75 1HG2 THR 75 -2.737 13.920 5.290 578 HG23 THR 75 2HG2 THR 75 -3.791 14.918 6.320 579 H ALA 76 H ALA 76 -4.387 17.074 2.179 580 HA ALA 76 HA ALA 76 -3.787 14.361 0.911 581 HB1 ALA 76 3HB ALA 76 -6.623 15.466 1.230 582 HB2 ALA 76 1HB ALA 76 -5.890 14.023 1.989 583 HB3 ALA 76 2HB ALA 76 -6.165 14.044 0.237 584 H HIS 77 H HIS 77 -3.329 14.267 -0.993 585 HA HIS 77 HA HIS 77 -3.323 16.631 -2.944 586 HD1 HIS 77 HD1 HIS 77 -0.481 15.891 0.736 587 HD2 HIS 77 HD2 HIS 77 -1.741 19.051 -1.858 588 HE1 HIS 77 HE1 HIS 77 -0.232 18.151 1.918 589 HB2 HIS 77 2HB HIS 77 -0.908 15.169 -1.694 590 HB3 HIS 77 1HB HIS 77 -0.811 16.460 -2.889 591 H ARG 78 H ARG 78 -1.781 15.794 -4.909 592 HA ARG 78 HA ARG 78 -2.608 12.947 -5.665 593 HE ARG 78 HE ARG 78 -4.298 14.525 -10.563 594 HB2 ARG 78 2HB ARG 78 -4.398 14.659 -6.336 595 HB3 ARG 78 1HB ARG 78 -3.284 15.324 -7.498 596 HG2 ARG 78 2HG ARG 78 -4.127 12.351 -7.450 597 HG3 ARG 78 1HG ARG 78 -5.131 13.539 -8.216 598 HD2 ARG 78 2HD ARG 78 -2.275 12.726 -9.091 599 HD3 ARG 78 1HD ARG 78 -3.769 12.217 -9.821 600 HH11 ARG 78 2HH1 ARG 78 -1.064 14.206 -9.349 601 HH12 ARG 78 1HH1 ARG 78 -0.507 15.742 -10.110 602 HH21 ARG 78 1HH2 ARG 78 -3.680 16.272 -11.353 603 HH22 ARG 78 2HH2 ARG 78 -1.946 16.852 -11.238 604 H ALA 79 H ALA 79 -1.008 11.837 -6.650 605 HA ALA 79 HA ALA 79 1.366 13.303 -7.913 606 HB1 ALA 79 3HB ALA 79 2.393 10.982 -7.881 607 HB2 ALA 79 1HB ALA 79 0.948 10.352 -7.067 608 HB3 ALA 79 2HB ALA 79 1.973 11.599 -6.279 609 H ALA 80 H ALA 80 1.810 13.110 -10.111 610 HA ALA 80 HA ALA 80 -0.159 11.633 -11.925 611 HB1 ALA 80 3HB ALA 80 1.036 13.022 -13.773 612 HB2 ALA 80 1HB ALA 80 1.759 13.929 -12.449 613 HB3 ALA 80 2HB ALA 80 -0.002 13.903 -12.618 614 H SER 81 H SER 81 3.321 11.506 -11.130 615 HA SER 81 HA SER 81 3.324 8.706 -12.337 616 HG SER 81 HG SER 81 5.350 8.607 -14.292 617 HB2 SER 81 2HB SER 81 4.899 11.102 -13.249 618 HB3 SER 81 1HB SER 81 5.971 9.854 -12.709 619 H VAL 82 H VAL 82 6.005 8.136 -11.514 620 HA VAL 82 HA VAL 82 5.655 7.778 -8.503 621 HB VAL 82 HB VAL 82 7.758 6.380 -10.242 622 HG11 VAL 82 1HG1 VAL 82 8.120 5.067 -7.992 623 HG12 VAL 82 2HG1 VAL 82 7.322 6.443 -7.192 624 HG13 VAL 82 3HG1 VAL 82 8.829 6.677 -8.093 625 HG21 VAL 82 3HG2 VAL 82 5.723 5.177 -10.652 626 HG22 VAL 82 1HG2 VAL 82 5.125 5.377 -8.983 627 HG23 VAL 82 2HG2 VAL 82 6.451 4.262 -9.324 628 H GLU 83 H GLU 83 8.360 8.909 -10.713 629 HA GLU 83 HA GLU 83 9.644 10.600 -8.995 630 HB2 GLU 83 2HB GLU 83 8.940 11.449 -11.836 631 HB3 GLU 83 1HB GLU 83 10.296 11.979 -10.877 632 HG2 GLU 83 2HG GLU 83 10.232 8.955 -11.377 633 HG3 GLU 83 1HG GLU 83 10.417 9.948 -12.796 634 H GLU 84 H GLU 84 6.629 12.133 -10.606 635 HA GLU 84 HA GLU 84 6.360 14.158 -8.563 636 HB2 GLU 84 2HB GLU 84 4.311 12.657 -10.295 637 HB3 GLU 84 1HB GLU 84 3.768 13.902 -9.219 638 HG2 GLU 84 2HG GLU 84 4.226 15.566 -10.656 639 HG3 GLU 84 1HG GLU 84 5.905 15.110 -10.800 640 H ALA 85 H ALA 85 5.786 10.863 -7.902 641 HA ALA 85 HA ALA 85 4.114 11.425 -5.419 642 HB1 ALA 85 3HB ALA 85 3.892 9.048 -5.072 643 HB2 ALA 85 1HB ALA 85 5.143 8.660 -6.260 644 HB3 ALA 85 2HB ALA 85 3.570 9.292 -6.801 645 H VAL 86 H VAL 86 7.431 10.566 -6.312 646 HA VAL 86 HA VAL 86 8.378 10.538 -3.444 647 HB VAL 86 HB VAL 86 9.763 10.141 -6.136 648 HG11 VAL 86 1HG1 VAL 86 11.410 11.496 -4.885 649 HG12 VAL 86 2HG1 VAL 86 11.940 9.809 -4.959 650 HG13 VAL 86 3HG1 VAL 86 11.242 10.453 -3.442 651 HG21 VAL 86 3HG2 VAL 86 9.608 8.383 -3.571 652 HG22 VAL 86 1HG2 VAL 86 10.423 7.924 -5.079 653 HG23 VAL 86 2HG2 VAL 86 8.660 8.101 -5.050 654 H ASP 87 H ASP 87 8.771 12.921 -6.204 655 HA ASP 87 HA ASP 87 9.816 15.024 -4.581 656 HB2 ASP 87 2HB ASP 87 8.387 14.904 -7.262 657 HB3 ASP 87 1HB ASP 87 8.297 16.442 -6.466 658 H ILE 88 H ILE 88 6.274 14.281 -4.875 659 HA ILE 88 HA ILE 88 5.765 16.627 -3.081 660 HB ILE 88 HB ILE 88 3.666 16.586 -2.919 661 HG12 ILE 88 2HG1 ILE 88 2.920 13.949 -4.283 662 HG13 ILE 88 1HG1 ILE 88 3.324 13.974 -2.588 663 HG21 ILE 88 1HG2 ILE 88 3.846 15.682 -5.841 664 HG22 ILE 88 2HG2 ILE 88 4.467 17.231 -5.255 665 HG23 ILE 88 3HG2 ILE 88 2.731 16.872 -5.132 666 HD11 ILE 88 3HD1 ILE 88 0.887 15.231 -3.857 667 HD12 ILE 88 1HD1 ILE 88 1.596 16.119 -2.485 668 HD13 ILE 88 2HD1 ILE 88 1.092 14.465 -2.264 669 H ALA 89 H ALA 89 6.181 13.203 -2.367 670 HA ALA 89 HA ALA 89 5.498 13.495 0.532 671 HB1 ALA 89 3HB ALA 89 5.526 11.243 -0.452 672 HB2 ALA 89 1HB ALA 89 6.810 11.355 0.771 673 HB3 ALA 89 2HB ALA 89 7.229 11.425 -0.960 674 H ALA 90 H ALA 90 8.672 13.674 -1.189 675 HA ALA 90 HA ALA 90 10.126 14.593 1.223 676 HB1 ALA 90 3HB ALA 90 11.250 13.390 -0.579 677 HB2 ALA 90 1HB ALA 90 11.964 15.019 -0.529 678 HB3 ALA 90 2HB ALA 90 10.786 14.607 -1.795 679 H SER 91 H SER 91 8.311 16.488 -1.090 680 HA SER 91 HA SER 91 9.312 19.160 -0.141 681 HG SER 91 HG SER 91 9.242 18.893 -2.453 682 HB2 SER 91 2HB SER 91 7.056 18.169 -1.930 683 HB3 SER 91 1HB SER 91 6.817 19.728 -1.182 684 H LEU 92 H LEU 92 6.983 16.971 1.266 685 HA LEU 92 HA LEU 92 5.849 19.244 2.925 686 HG LEU 92 HG LEU 92 5.173 15.898 1.504 687 HB2 LEU 92 2HB LEU 92 4.065 17.720 3.720 688 HB3 LEU 92 1HB LEU 92 4.084 18.267 2.071 689 HD11 LEU 92 1HD1 LEU 92 3.763 15.216 4.155 690 HD12 LEU 92 2HD1 LEU 92 5.510 15.113 3.833 691 HD13 LEU 92 3HD1 LEU 92 4.408 14.073 2.942 692 HD21 LEU 92 3HD2 LEU 92 2.926 16.660 0.676 693 HD22 LEU 92 1HD2 LEU 92 2.178 16.149 2.215 694 HD23 LEU 92 2HD2 LEU 92 2.917 14.950 1.121 695 H ASP 93 H ASP 93 7.285 16.092 3.778 696 HA ASP 93 HA ASP 93 9.512 16.862 5.000 697 HB2 ASP 93 2HB ASP 93 7.489 17.532 7.183 698 HB3 ASP 93 1HB ASP 93 8.965 16.749 7.663 699 H ALA 94 H ALA 94 10.060 14.762 4.362 700 HA ALA 94 HA ALA 94 9.629 12.583 6.369 701 HB1 ALA 94 3HB ALA 94 7.502 12.446 5.034 702 HB2 ALA 94 1HB ALA 94 8.472 10.979 4.840 703 HB3 ALA 94 2HB ALA 94 8.431 12.196 3.536 704 H GLU 95 H GLU 95 10.962 10.822 6.224 705 HA GLU 95 HA GLU 95 13.263 10.892 4.228 706 HB2 GLU 95 2HB GLU 95 13.405 8.828 6.418 707 HB3 GLU 95 1HB GLU 95 14.653 9.627 5.498 708 HG2 GLU 95 2HG GLU 95 14.144 11.772 6.984 709 HG3 GLU 95 1HG GLU 95 13.169 10.682 7.964 710 H THR 96 H THR 96 11.261 8.220 5.675 711 HA THR 96 HA THR 96 11.119 6.775 3.032 712 HB THR 96 HB THR 96 9.484 5.235 4.558 713 HG1 THR 96 HG1 THR 96 9.452 6.752 6.337 714 HG21 THR 96 3HG2 THR 96 11.374 3.976 5.424 715 HG22 THR 96 1HG2 THR 96 12.474 5.346 5.169 716 HG23 THR 96 2HG2 THR 96 11.741 4.513 3.761 717 H ALA 97 H ALA 97 9.049 5.852 2.333 718 HA ALA 97 HA ALA 97 6.542 7.096 3.342 719 HB1 ALA 97 3HB ALA 97 5.656 7.717 0.957 720 HB2 ALA 97 1HB ALA 97 7.334 7.538 0.375 721 HB3 ALA 97 2HB ALA 97 6.951 8.739 1.616 722 H TYR 98 H TYR 98 4.530 6.073 2.327 723 HA TYR 98 HA TYR 98 4.969 3.117 1.748 724 HD1 TYR 98 HD1 TYR 98 5.041 0.903 3.788 725 HD2 TYR 98 HD2 TYR 98 4.859 4.828 5.453 726 HE1 TYR 98 HE1 TYR 98 6.921 0.347 5.277 727 HE2 TYR 98 HE2 TYR 98 6.693 4.254 7.003 728 HH TYR 98 HH TYR 98 8.425 2.857 7.241 729 HB2 TYR 98 2HB TYR 98 3.128 4.177 3.976 730 HB3 TYR 98 1HB TYR 98 3.039 2.538 3.394 731 H VAL 99 H VAL 99 2.834 1.939 1.212 732 HA VAL 99 HA VAL 99 0.934 3.673 -0.466 733 HB VAL 99 HB VAL 99 1.727 3.218 -2.425 734 HG11 VAL 99 1HG1 VAL 99 4.004 3.231 -1.587 735 HG12 VAL 99 2HG1 VAL 99 3.832 2.291 -3.057 736 HG13 VAL 99 3HG1 VAL 99 4.034 1.508 -1.496 737 HG21 VAL 99 3HG2 VAL 99 1.888 1.110 -3.675 738 HG22 VAL 99 1HG2 VAL 99 0.329 1.367 -2.842 739 HG23 VAL 99 2HG2 VAL 99 1.512 0.238 -2.186 740 H ILE 100 H ILE 100 -1.078 3.046 0.673 741 HA ILE 100 HA ILE 100 -1.753 0.353 1.094 742 HB ILE 100 HB ILE 100 -4.058 2.192 0.375 743 HG12 ILE 100 2HG1 ILE 100 -3.127 3.524 2.058 744 HG13 ILE 100 1HG1 ILE 100 -4.216 2.501 2.935 745 HG21 ILE 100 1HG2 ILE 100 -4.531 -0.358 0.758 746 HG22 ILE 100 2HG2 ILE 100 -5.377 0.750 1.861 747 HG23 ILE 100 3HG2 ILE 100 -3.931 -0.125 2.413 748 HD11 ILE 100 3HD1 ILE 100 -1.943 2.855 4.084 749 HD12 ILE 100 1HD1 ILE 100 -1.190 1.824 2.858 750 HD13 ILE 100 2HD1 ILE 100 -2.447 1.130 3.896 751 H GLY 101 H GLY 101 -2.260 1.827 -1.893 752 HA2 GLY 101 2HA GLY 101 -2.703 0.920 -4.095 753 HA3 GLY 101 1HA GLY 101 -1.544 -0.219 -3.554 754 H GLY 102 H GLY 102 -3.097 -2.610 -4.809 755 HA2 GLY 102 2HA GLY 102 -4.715 -0.204 -5.779 756 HA3 GLY 102 1HA GLY 102 -3.100 -0.238 -6.348 757 H ALA 103 H ALA 103 -6.210 -1.582 -6.958 758 HA ALA 103 HA ALA 103 -6.048 -2.892 -9.318 759 HB1 ALA 103 3HB ALA 103 -8.030 -1.405 -8.373 760 HB2 ALA 103 1HB ALA 103 -7.924 -1.397 -10.115 761 HB3 ALA 103 2HB ALA 103 -7.362 -0.029 -9.199 762 H ALA 104 H ALA 104 -4.847 0.437 -9.393 763 HA ALA 104 HA ALA 104 -3.078 -0.327 -11.778 764 HB1 ALA 104 3HB ALA 104 -4.479 1.623 -12.345 765 HB2 ALA 104 1HB ALA 104 -2.757 2.081 -12.243 766 HB3 ALA 104 2HB ALA 104 -3.865 2.511 -10.914 767 H ILE 105 H ILE 105 -3.022 0.680 -8.374 768 HA ILE 105 HA ILE 105 -0.474 2.039 -8.534 769 HB ILE 105 HB ILE 105 -1.467 1.078 -5.879 770 HG12 ILE 105 2HG1 ILE 105 -3.517 2.074 -6.651 771 HG13 ILE 105 1HG1 ILE 105 -2.747 3.189 -5.610 772 HG21 ILE 105 1HG2 ILE 105 0.033 3.648 -6.483 773 HG22 ILE 105 2HG2 ILE 105 0.737 2.168 -5.791 774 HG23 ILE 105 3HG2 ILE 105 -0.504 3.048 -4.916 775 HD11 ILE 105 3HD1 ILE 105 -2.932 4.780 -7.330 776 HD12 ILE 105 1HD1 ILE 105 -3.646 3.507 -8.359 777 HD13 ILE 105 2HD1 ILE 105 -1.898 3.819 -8.412 778 H TYR 106 H TYR 106 -0.689 -0.879 -6.351 779 HA TYR 106 HA TYR 106 2.087 -1.581 -6.406 780 HD1 TYR 106 HD1 TYR 106 2.737 -4.541 -5.128 781 HD2 TYR 106 HD2 TYR 106 -0.551 -2.200 -3.643 782 HE1 TYR 106 HE1 TYR 106 3.299 -5.180 -2.838 783 HE2 TYR 106 HE2 TYR 106 0.038 -2.849 -1.347 784 HH TYR 106 HH TYR 106 2.491 -3.903 -0.177 785 HB2 TYR 106 2HB TYR 106 -0.521 -3.127 -6.016 786 HB3 TYR 106 1HB TYR 106 0.822 -4.090 -6.491 787 H ALA 107 H ALA 107 -0.178 -2.306 -9.038 788 HA ALA 107 HA ALA 107 1.624 -4.021 -10.678 789 HB1 ALA 107 3HB ALA 107 -0.875 -2.338 -11.369 790 HB2 ALA 107 1HB ALA 107 -0.877 -4.039 -10.909 791 HB3 ALA 107 2HB ALA 107 -0.149 -3.556 -12.436 792 H LEU 108 H LEU 108 0.961 -0.504 -10.815 793 HA LEU 108 HA LEU 108 3.220 -0.071 -12.753 794 HG LEU 108 HG LEU 108 1.950 2.233 -10.094 795 HB2 LEU 108 2HB LEU 108 2.506 2.023 -13.076 796 HB3 LEU 108 1HB LEU 108 1.000 1.355 -12.558 797 HD11 LEU 108 1HD1 LEU 108 3.214 4.293 -10.294 798 HD12 LEU 108 2HD1 LEU 108 2.996 4.392 -12.052 799 HD13 LEU 108 3HD1 LEU 108 4.073 3.172 -11.345 800 HD21 LEU 108 3HD2 LEU 108 0.640 4.353 -10.466 801 HD22 LEU 108 1HD2 LEU 108 -0.262 2.887 -10.845 802 HD23 LEU 108 2HD2 LEU 108 0.419 3.892 -12.169 803 H PHE 109 H PHE 109 2.839 0.267 -9.229 804 HA PHE 109 HA PHE 109 5.506 1.374 -8.853 805 HD1 PHE 109 HD2 PHE 109 6.585 2.231 -6.477 806 HD2 PHE 109 HD1 PHE 109 2.387 2.804 -7.099 807 HE1 PHE 109 HE2 PHE 109 6.837 4.587 -5.926 808 HE2 PHE 109 HE1 PHE 109 2.635 5.193 -6.536 809 HZ PHE 109 HZ PHE 109 4.889 6.094 -5.967 810 HB2 PHE 109 2HB PHE 109 3.247 0.516 -7.015 811 HB3 PHE 109 1HB PHE 109 4.786 0.279 -6.295 812 H GLN 110 H GLN 110 4.631 -2.047 -8.708 813 HA GLN 110 HA GLN 110 6.547 -3.478 -7.463 814 HB2 GLN 110 2HB GLN 110 5.425 -3.695 -10.281 815 HB3 GLN 110 1HB GLN 110 6.793 -4.708 -9.954 816 HG2 GLN 110 2HG GLN 110 5.647 -5.788 -8.032 817 HG3 GLN 110 1HG GLN 110 4.273 -4.720 -8.181 818 HE21 GLN 110 1HE2 GLN 110 5.447 -7.662 -9.132 819 HE22 GLN 110 2HE2 GLN 110 4.255 -7.967 -10.503 820 HA PRO 111 HA PRO 111 10.707 -2.875 -9.745 821 HB2 PRO 111 2HB PRO 111 10.573 -0.692 -11.744 822 HB3 PRO 111 1HB PRO 111 10.983 -2.403 -11.963 823 HG2 PRO 111 2HG PRO 111 8.610 -1.251 -12.964 824 HG3 PRO 111 1HG PRO 111 8.812 -2.985 -12.591 825 HD2 PRO 111 2HD PRO 111 7.531 -0.823 -10.834 826 HD3 PRO 111 1HD PRO 111 6.948 -2.453 -11.211 827 H HIS 112 H HIS 112 8.841 -0.197 -8.682 828 HA HIS 112 HA HIS 112 11.273 1.639 -8.231 829 HD1 HIS 112 HD1 HIS 112 11.114 3.496 -10.619 830 HD2 HIS 112 HD2 HIS 112 7.104 2.060 -10.452 831 HE1 HIS 112 HE1 HIS 112 10.035 3.567 -12.985 832 HB2 HIS 112 2HB HIS 112 8.297 2.429 -8.134 833 HB3 HIS 112 1HB HIS 112 9.688 3.483 -8.178 834 H LEU 113 H LEU 113 9.559 -0.514 -6.331 835 HA LEU 113 HA LEU 113 9.466 1.220 -3.832 836 HG LEU 113 HG LEU 113 6.833 -1.094 -2.758 837 HB2 LEU 113 2HB LEU 113 9.058 -1.840 -4.122 838 HB3 LEU 113 1HB LEU 113 8.978 -0.959 -2.612 839 HD11 LEU 113 1HD1 LEU 113 5.627 0.827 -3.994 840 HD12 LEU 113 2HD1 LEU 113 7.204 1.226 -4.712 841 HD13 LEU 113 3HD1 LEU 113 6.973 1.349 -2.962 842 HD21 LEU 113 3HD2 LEU 113 5.488 -1.611 -4.739 843 HD22 LEU 113 1HD2 LEU 113 6.927 -2.649 -4.691 844 HD23 LEU 113 2HD2 LEU 113 6.884 -1.281 -5.815 845 H ASP 114 H ASP 114 10.755 1.076 -2.109 846 HA ASP 114 HA ASP 114 13.261 -0.542 -1.847 847 HB2 ASP 114 2HB ASP 114 13.035 1.548 -0.649 848 HB3 ASP 114 1HB ASP 114 11.457 1.154 -0.002 849 H ARG 115 H ARG 115 10.046 -0.968 -0.218 850 HA ARG 115 HA ARG 115 10.403 -4.009 -0.469 851 HE ARG 115 HE ARG 115 13.246 -4.751 4.131 852 HB2 ARG 115 2HB ARG 115 9.848 -2.266 1.982 853 HB3 ARG 115 1HB ARG 115 9.220 -3.909 1.994 854 HG2 ARG 115 2HG ARG 115 11.367 -4.913 2.022 855 HG3 ARG 115 1HG ARG 115 12.146 -3.491 1.320 856 HD2 ARG 115 2HD ARG 115 11.684 -2.180 3.487 857 HD3 ARG 115 1HD ARG 115 11.022 -3.648 4.205 858 HH11 ARG 115 2HH1 ARG 115 13.442 -1.549 2.650 859 HH12 ARG 115 1HH1 ARG 115 15.214 -1.622 2.550 860 HH21 ARG 115 1HH2 ARG 115 15.033 -4.926 3.773 861 HH22 ARG 115 2HH2 ARG 115 16.151 -3.602 3.092 862 H MET 116 H MET 116 8.633 -5.363 -0.534 863 HA MET 116 HA MET 116 5.826 -4.112 -0.829 864 HB2 MET 116 2HB MET 116 7.040 -6.618 -2.080 865 HB3 MET 116 1HB MET 116 5.309 -6.357 -2.015 866 HG2 MET 116 2HG MET 116 5.531 -4.392 -3.510 867 HG3 MET 116 1HG MET 116 7.276 -4.306 -3.213 868 HE1 MET 116 3HE MET 116 4.702 -5.628 -5.793 869 HE2 MET 116 1HE MET 116 4.442 -6.695 -4.378 870 HE3 MET 116 2HE MET 116 5.122 -7.366 -5.886 871 H VAL 117 H VAL 117 5.537 -3.888 1.343 872 HA VAL 117 HA VAL 117 5.190 -6.134 3.270 873 HB VAL 117 HB VAL 117 4.365 -3.206 3.242 874 HG11 VAL 117 1HG1 VAL 117 2.772 -4.408 4.791 875 HG12 VAL 117 2HG1 VAL 117 3.869 -3.353 5.688 876 HG13 VAL 117 3HG1 VAL 117 4.151 -5.112 5.668 877 HG21 VAL 117 3HG2 VAL 117 6.486 -4.617 5.016 878 HG22 VAL 117 1HG2 VAL 117 6.214 -2.866 4.870 879 HG23 VAL 117 2HG2 VAL 117 6.888 -3.781 3.508 880 H LEU 118 H LEU 118 3.910 -7.706 2.466 881 HA LEU 118 HA LEU 118 1.001 -7.079 1.660 882 HG LEU 118 HG LEU 118 -0.115 -9.081 0.624 883 HB2 LEU 118 2HB LEU 118 2.350 -8.139 -0.069 884 HB3 LEU 118 1HB LEU 118 2.904 -9.411 1.001 885 HD11 LEU 118 1HD1 LEU 118 0.361 -9.056 -1.653 886 HD12 LEU 118 2HD1 LEU 118 0.101 -10.742 -1.375 887 HD13 LEU 118 3HD1 LEU 118 1.777 -10.156 -1.570 888 HD21 LEU 118 3HD2 LEU 118 -0.157 -11.481 0.886 889 HD22 LEU 118 1HD2 LEU 118 0.921 -10.871 2.162 890 HD23 LEU 118 2HD2 LEU 118 1.611 -11.626 0.719 891 H SER 119 H SER 119 -0.686 -7.961 2.758 892 HA SER 119 HA SER 119 -0.174 -9.669 5.298 893 HG SER 119 HG SER 119 -1.233 -7.517 7.174 894 HB2 SER 119 2HB SER 119 -1.877 -7.204 4.691 895 HB3 SER 119 1HB SER 119 -2.514 -8.363 5.837 896 H ARG 120 H ARG 120 -0.572 -11.783 4.701 897 HA ARG 120 HA ARG 120 -2.651 -12.418 2.620 898 HE ARG 120 HE ARG 120 0.564 -16.406 2.183 899 HB2 ARG 120 2HB ARG 120 -1.257 -14.668 4.134 900 HB3 ARG 120 1HB ARG 120 -2.010 -14.698 2.560 901 HG2 ARG 120 2HG ARG 120 0.287 -12.851 2.599 902 HG3 ARG 120 1HG ARG 120 0.804 -14.292 3.314 903 HD2 ARG 120 2HD ARG 120 -0.664 -14.430 0.559 904 HD3 ARG 120 1HD ARG 120 0.995 -13.856 0.679 905 HH11 ARG 120 2HH1 ARG 120 1.540 -15.224 -0.911 906 HH12 ARG 120 1HH1 ARG 120 2.925 -16.415 -1.009 907 HH21 ARG 120 1HH2 ARG 120 2.223 -17.568 2.142 908 HH22 ARG 120 2HH2 ARG 120 3.304 -17.651 0.703 909 H VAL 121 H VAL 121 -4.745 -12.621 3.179 910 HA VAL 121 HA VAL 121 -5.546 -13.354 6.004 911 HB VAL 121 HB VAL 121 -7.364 -12.094 3.924 912 HG11 VAL 121 1HG1 VAL 121 -7.429 -12.195 7.011 913 HG12 VAL 121 2HG1 VAL 121 -8.615 -12.891 5.884 914 HG13 VAL 121 3HG1 VAL 121 -8.475 -11.143 6.057 915 HG21 VAL 121 3HG2 VAL 121 -5.171 -10.673 5.481 916 HG22 VAL 121 1HG2 VAL 121 -6.745 -9.868 5.384 917 HG23 VAL 121 2HG2 VAL 121 -5.903 -10.316 3.920 918 HA PRO 122 HA PRO 122 -7.426 -17.252 4.177 919 HB2 PRO 122 2HB PRO 122 -7.769 -17.966 7.109 920 HB3 PRO 122 1HB PRO 122 -7.051 -18.900 5.787 921 HG2 PRO 122 2HG PRO 122 -5.439 -17.753 7.683 922 HG3 PRO 122 1HG PRO 122 -4.940 -17.694 5.967 923 HD2 PRO 122 2HD PRO 122 -6.367 -15.474 7.539 924 HD3 PRO 122 1HD PRO 122 -4.876 -15.393 6.533 925 H GLY 123 H GLY 123 -9.013 -15.066 4.133 926 HA2 GLY 123 2HA GLY 123 -11.771 -16.042 5.172 927 HA3 GLY 123 1HA GLY 123 -11.465 -14.391 4.761 928 H GLU 124 H GLU 124 -10.090 -16.052 2.397 929 HA GLU 124 HA GLU 124 -10.523 -16.478 0.092 930 HB2 GLU 124 2HB GLU 124 -12.337 -18.291 1.728 931 HB3 GLU 124 1HB GLU 124 -11.974 -18.574 0.039 932 HG2 GLU 124 2HG GLU 124 -9.582 -18.926 0.473 933 HG3 GLU 124 1HG GLU 124 -9.723 -18.390 2.138 934 H TYR 125 H TYR 125 -11.234 -14.969 -1.388 935 HA TYR 125 HA TYR 125 -14.241 -14.573 -1.733 936 HD1 TYR 125 HD1 TYR 125 -15.389 -13.169 0.556 937 HD2 TYR 125 HD2 TYR 125 -11.269 -11.979 0.480 938 HE1 TYR 125 HE1 TYR 125 -15.358 -13.062 3.024 939 HE2 TYR 125 HE2 TYR 125 -11.240 -11.964 2.931 940 HH TYR 125 HH TYR 125 -13.746 -13.304 4.751 941 HB2 TYR 125 2HB TYR 125 -12.396 -12.111 -1.568 942 HB3 TYR 125 1HB TYR 125 -14.124 -12.125 -1.649 943 H GLU 126 H GLU 126 -14.564 -14.942 -4.007 944 HA GLU 126 HA GLU 126 -13.090 -14.441 -6.090 945 HB2 GLU 126 2HB GLU 126 -15.853 -13.421 -6.726 946 HB3 GLU 126 1HB GLU 126 -14.822 -14.561 -7.547 947 HG2 GLU 126 2HG GLU 126 -16.527 -15.200 -5.051 948 HG3 GLU 126 1HG GLU 126 -16.949 -15.577 -6.718 949 H GLY 127 H GLY 127 -15.031 -11.595 -5.140 950 HA2 GLY 127 2HA GLY 127 -14.207 -9.297 -4.937 951 HA3 GLY 127 1HA GLY 127 -12.646 -9.862 -5.444 952 H ASP 128 H ASP 128 -13.484 -7.410 -5.979 953 HA ASP 128 HA ASP 128 -13.356 -7.436 -9.032 954 HB2 ASP 128 2HB ASP 128 -14.426 -5.242 -9.145 955 HB3 ASP 128 1HB ASP 128 -15.469 -6.490 -8.497 956 H THR 129 H THR 129 -12.019 -5.536 -6.278 957 HA THR 129 HA THR 129 -9.758 -4.604 -7.874 958 HB THR 129 HB THR 129 -9.457 -4.932 -4.862 959 HG1 THR 129 HG1 THR 129 -10.774 -3.272 -4.467 960 HG21 THR 129 3HG2 THR 129 -8.320 -2.772 -4.981 961 HG22 THR 129 1HG2 THR 129 -8.929 -2.466 -6.632 962 HG23 THR 129 2HG2 THR 129 -7.681 -3.705 -6.368 963 H TYR 130 H TYR 130 -8.345 -6.024 -8.765 964 HA TYR 130 HA TYR 130 -7.249 -8.398 -7.236 965 HD1 TYR 130 HD1 TYR 130 -9.754 -7.559 -10.189 966 HD2 TYR 130 HD2 TYR 130 -7.625 -11.011 -8.772 967 HE1 TYR 130 HE1 TYR 130 -11.834 -8.887 -10.268 968 HE2 TYR 130 HE2 TYR 130 -9.706 -12.340 -8.937 969 HH TYR 130 HH TYR 130 -12.431 -11.378 -8.717 970 HB2 TYR 130 2HB TYR 130 -7.190 -7.591 -10.202 971 HB3 TYR 130 1HB TYR 130 -6.366 -8.995 -9.573 972 H TYR 131 H TYR 131 -5.241 -8.701 -6.549 973 HA TYR 131 HA TYR 131 -3.177 -6.561 -6.743 974 HD1 TYR 131 HD2 TYR 131 -0.804 -9.686 -5.665 975 HD2 TYR 131 HD1 TYR 131 -2.178 -6.300 -3.409 976 HE1 TYR 131 HE2 TYR 131 1.464 -9.338 -4.841 977 HE2 TYR 131 HE1 TYR 131 0.070 -6.103 -2.411 978 HH TYR 131 HH TYR 131 2.076 -7.242 -2.145 979 HB2 TYR 131 2HB TYR 131 -3.806 -7.815 -4.630 980 HB3 TYR 131 1HB TYR 131 -3.223 -9.283 -5.312 981 HA PRO 132 HA PRO 132 -0.660 -8.565 -10.053 982 HB2 PRO 132 2HB PRO 132 1.868 -7.461 -8.833 983 HB3 PRO 132 1HB PRO 132 1.152 -7.106 -10.411 984 HG2 PRO 132 2HG PRO 132 1.121 -5.308 -8.373 985 HG3 PRO 132 1HG PRO 132 -0.265 -5.432 -9.474 986 HD2 PRO 132 2HD PRO 132 -0.041 -6.593 -6.672 987 HD3 PRO 132 1HD PRO 132 -1.383 -5.690 -7.435 988 H GLU 133 H GLU 133 1.498 -9.798 -10.476 989 HA GLU 133 HA GLU 133 1.558 -12.122 -8.582 990 HB2 GLU 133 2HB GLU 133 2.896 -13.362 -10.269 991 HB3 GLU 133 1HB GLU 133 1.273 -12.911 -10.646 992 HG2 GLU 133 2HG GLU 133 2.569 -10.865 -12.010 993 HG3 GLU 133 1HG GLU 133 3.818 -12.110 -12.034 994 H TRP 134 H TRP 134 3.283 -13.098 -7.756 995 HA TRP 134 HA TRP 134 5.606 -11.322 -6.897 996 HD1 TRP 134 HD1 TRP 134 4.698 -15.515 -5.694 997 HE1 TRP 134 HE1 TRP 134 2.342 -16.662 -5.267 998 HE3 TRP 134 HE3 TRP 134 2.267 -11.353 -4.010 999 HZ2 TRP 134 HZ2 TRP 134 -0.093 -15.764 -4.132 1000 HZ3 TRP 134 HZ3 TRP 134 -0.111 -11.537 -3.398 1001 HH2 TRP 134 HH2 TRP 134 -1.259 -13.724 -3.378 1002 HB2 TRP 134 2HB TRP 134 5.721 -12.767 -4.788 1003 HB3 TRP 134 1HB TRP 134 4.436 -11.616 -4.899 1004 H ASP 135 H ASP 135 7.666 -12.112 -7.311 1005 HA ASP 135 HA ASP 135 7.918 -14.860 -8.653 1006 HB2 ASP 135 2HB ASP 135 8.061 -12.873 -10.193 1007 HB3 ASP 135 1HB ASP 135 9.379 -12.207 -9.251 1008 H ALA 136 H ALA 136 10.758 -14.418 -8.602 1009 HA ALA 136 HA ALA 136 11.666 -14.601 -5.685 1010 HB1 ALA 136 3HB ALA 136 12.692 -16.838 -6.071 1011 HB2 ALA 136 1HB ALA 136 12.361 -16.754 -7.825 1012 HB3 ALA 136 2HB ALA 136 11.017 -16.965 -6.672 1013 H ALA 137 H ALA 137 12.520 -13.730 -8.992 1014 HA ALA 137 HA ALA 137 15.303 -12.863 -7.994 1015 HB1 ALA 137 3HB ALA 137 16.041 -12.768 -10.371 1016 HB2 ALA 137 1HB ALA 137 14.466 -13.393 -10.914 1017 HB3 ALA 137 2HB ALA 137 15.526 -14.404 -9.892 1018 H GLU 138 H GLU 138 12.325 -11.453 -9.229 1019 HA GLU 138 HA GLU 138 13.409 -8.655 -9.252 1020 HB2 GLU 138 2HB GLU 138 10.585 -9.836 -9.049 1021 HB3 GLU 138 1HB GLU 138 10.908 -8.138 -8.908 1022 HG2 GLU 138 2HG GLU 138 11.794 -9.618 -11.444 1023 HG3 GLU 138 1HG GLU 138 10.180 -8.963 -11.233 1024 H TRP 139 H TRP 139 11.634 -10.514 -6.739 1025 HA TRP 139 HA TRP 139 12.947 -8.859 -4.534 1026 HD1 TRP 139 HD1 TRP 139 8.814 -10.814 -4.815 1027 HE1 TRP 139 HE1 TRP 139 7.164 -10.483 -6.908 1028 HE3 TRP 139 HE3 TRP 139 10.532 -6.263 -6.239 1029 HZ2 TRP 139 HZ2 TRP 139 7.189 -8.690 -9.026 1030 HZ3 TRP 139 HZ3 TRP 139 9.760 -5.317 -8.397 1031 HH2 TRP 139 HH2 TRP 139 8.143 -6.527 -9.783 1032 HB2 TRP 139 2HB TRP 139 10.516 -8.875 -3.367 1033 HB3 TRP 139 1HB TRP 139 11.080 -7.598 -4.380 1034 H GLU 140 H GLU 140 13.306 -9.785 -2.608 1035 HA GLU 140 HA GLU 140 12.566 -12.736 -2.235 1036 HB2 GLU 140 2HB GLU 140 14.607 -13.233 -1.405 1037 HB3 GLU 140 1HB GLU 140 15.081 -11.976 -2.504 1038 HG2 GLU 140 2HG GLU 140 15.046 -10.380 -0.347 1039 HG3 GLU 140 1HG GLU 140 14.912 -11.866 0.585 1040 H LEU 141 H LEU 141 13.031 -12.923 0.573 1041 HA LEU 141 HA LEU 141 10.511 -11.502 1.592 1042 HG LEU 141 HG LEU 141 9.243 -14.652 3.197 1043 HB2 LEU 141 2HB LEU 141 10.812 -14.229 1.322 1044 HB3 LEU 141 1HB LEU 141 11.506 -14.048 2.895 1045 HD11 LEU 141 1HD1 LEU 141 9.784 -12.758 4.753 1046 HD12 LEU 141 2HD1 LEU 141 8.054 -12.839 4.357 1047 HD13 LEU 141 3HD1 LEU 141 9.082 -11.615 3.610 1048 HD21 LEU 141 3HD2 LEU 141 8.457 -14.263 0.869 1049 HD22 LEU 141 1HD2 LEU 141 8.355 -12.519 1.166 1050 HD23 LEU 141 2HD2 LEU 141 7.291 -13.647 2.042 1051 H ASP 142 H ASP 142 11.091 -9.883 2.949 1052 HA ASP 142 HA ASP 142 13.726 -9.752 4.420 1053 HB2 ASP 142 2HB ASP 142 12.584 -7.805 3.116 1054 HB3 ASP 142 1HB ASP 142 11.444 -7.701 4.426 1055 H ALA 143 H ALA 143 10.195 -9.679 5.349 1056 HA ALA 143 HA ALA 143 10.885 -11.341 7.816 1057 HB1 ALA 143 3HB ALA 143 9.779 -9.679 9.350 1058 HB2 ALA 143 1HB ALA 143 9.393 -8.616 7.968 1059 HB3 ALA 143 2HB ALA 143 11.087 -8.874 8.436 1060 H GLU 144 H GLU 144 9.448 -12.907 8.257 1061 HA GLU 144 HA GLU 144 6.511 -12.595 7.381 1062 HB2 GLU 144 2HB GLU 144 8.051 -14.315 6.239 1063 HB3 GLU 144 1HB GLU 144 7.987 -15.265 7.726 1064 HG2 GLU 144 2HG GLU 144 5.478 -15.473 7.489 1065 HG3 GLU 144 1HG GLU 144 5.489 -14.327 6.169 1066 H THR 145 H THR 145 5.122 -12.250 8.984 1067 HA THR 145 HA THR 145 5.571 -13.527 11.724 1068 HB THR 145 HB THR 145 5.209 -11.651 13.046 1069 HG1 THR 145 HG1 THR 145 4.606 -10.199 10.707 1070 HG21 THR 145 3HG2 THR 145 6.916 -9.915 12.476 1071 HG22 THR 145 1HG2 THR 145 7.039 -10.530 10.823 1072 HG23 THR 145 2HG2 THR 145 7.573 -11.546 12.181 1073 H ASP 146 H ASP 146 3.792 -14.050 13.014 1074 HA ASP 146 HA ASP 146 1.164 -14.227 11.625 1075 HB2 ASP 146 2HB ASP 146 0.503 -15.666 13.428 1076 HB3 ASP 146 1HB ASP 146 2.021 -16.171 12.729 1077 H HIS 147 H HIS 147 -0.620 -13.053 11.929 1078 HA HIS 147 HA HIS 147 -0.789 -10.956 14.165 1079 HD1 HIS 147 HD1 HIS 147 1.775 -10.486 13.218 1080 HD2 HIS 147 HD2 HIS 147 -0.613 -7.223 11.884 1081 HE1 HIS 147 HE1 HIS 147 3.139 -8.303 13.319 1082 HB2 HIS 147 2HB HIS 147 -0.786 -10.542 11.109 1083 HB3 HIS 147 1HB HIS 147 -1.830 -9.539 12.052 1084 H GLU 148 H GLU 148 -3.001 -9.940 14.278 1085 HA GLU 148 HA GLU 148 -5.044 -11.998 14.701 1086 HB2 GLU 148 2HB GLU 148 -5.521 -8.987 14.448 1087 HB3 GLU 148 1HB GLU 148 -6.665 -10.131 15.069 1088 HG2 GLU 148 2HG GLU 148 -5.352 -10.538 17.123 1089 HG3 GLU 148 1HG GLU 148 -3.969 -9.640 16.501 1090 H GLY 149 H GLY 149 -5.921 -13.061 13.049 1091 HA2 GLY 149 2HA GLY 149 -7.776 -13.273 11.285 1092 HA3 GLY 149 1HA GLY 149 -7.492 -11.638 10.804 1093 H PHE 150 H PHE 150 -4.423 -12.293 10.784 1094 HA PHE 150 HA PHE 150 -4.250 -13.754 8.129 1095 HD1 PHE 150 HD1 PHE 150 -1.607 -10.502 7.623 1096 HD2 PHE 150 HD2 PHE 150 -5.453 -9.711 9.323 1097 HE1 PHE 150 HE1 PHE 150 -0.690 -8.511 8.765 1098 HE2 PHE 150 HE2 PHE 150 -4.571 -7.703 10.400 1099 HZ PHE 150 HZ PHE 150 -2.186 -7.086 10.148 1100 HB2 PHE 150 2HB PHE 150 -3.654 -11.741 6.878 1101 HB3 PHE 150 1HB PHE 150 -5.183 -11.497 7.642 1102 H THR 151 H THR 151 -1.986 -13.472 7.130 1103 HA THR 151 HA THR 151 0.183 -13.233 9.297 1104 HB THR 151 HB THR 151 0.717 -15.297 8.897 1105 HG1 THR 151 HG1 THR 151 2.443 -13.896 7.982 1106 HG21 THR 151 3HG2 THR 151 0.619 -16.658 6.868 1107 HG22 THR 151 1HG2 THR 151 0.015 -15.282 5.907 1108 HG23 THR 151 2HG2 THR 151 -0.995 -15.991 7.203 1109 H LEU 152 H LEU 152 1.390 -11.649 9.236 1110 HA LEU 152 HA LEU 152 1.568 -9.560 7.094 1111 HG LEU 152 HG LEU 152 3.417 -7.661 9.953 1112 HB2 LEU 152 2HB LEU 152 1.568 -8.962 9.473 1113 HB3 LEU 152 1HB LEU 152 2.860 -10.055 9.836 1114 HD11 LEU 152 1HD1 LEU 152 5.256 -9.466 9.361 1115 HD12 LEU 152 2HD1 LEU 152 5.654 -7.753 9.140 1116 HD13 LEU 152 3HD1 LEU 152 5.247 -8.759 7.753 1117 HD21 LEU 152 3HD2 LEU 152 2.054 -6.799 8.050 1118 HD22 LEU 152 1HD2 LEU 152 3.118 -7.568 6.866 1119 HD23 LEU 152 2HD2 LEU 152 3.745 -6.272 7.901 1120 H GLN 153 H GLN 153 3.051 -9.459 5.593 1121 HA GLN 153 HA GLN 153 5.570 -11.222 5.509 1122 HB2 GLN 153 2HB GLN 153 3.010 -11.598 4.150 1123 HB3 GLN 153 1HB GLN 153 4.001 -10.769 2.975 1124 HG2 GLN 153 2HG GLN 153 5.743 -12.627 3.200 1125 HG3 GLN 153 1HG GLN 153 4.772 -13.411 4.417 1126 HE21 GLN 153 1HE2 GLN 153 3.963 -12.025 1.336 1127 HE22 GLN 153 2HE2 GLN 153 3.515 -13.656 0.561 1128 H GLU 154 H GLU 154 7.312 -9.901 5.117 1129 HA GLU 154 HA GLU 154 6.955 -7.207 3.656 1130 HB2 GLU 154 2HB GLU 154 9.242 -7.831 5.577 1131 HB3 GLU 154 1HB GLU 154 8.787 -6.304 4.884 1132 HG2 GLU 154 2HG GLU 154 6.470 -6.667 6.165 1133 HG3 GLU 154 1HG GLU 154 7.334 -7.906 7.049 1134 H TRP 155 H TRP 155 7.653 -7.327 1.572 1135 HA TRP 155 HA TRP 155 9.882 -9.283 0.822 1136 HD1 TRP 155 HD1 TRP 155 5.864 -9.480 0.625 1137 HE1 TRP 155 HE1 TRP 155 4.935 -11.910 0.060 1138 HE3 TRP 155 HE3 TRP 155 9.737 -10.962 -2.331 1139 HZ2 TRP 155 HZ2 TRP 155 5.747 -13.927 -1.731 1140 HZ3 TRP 155 HZ3 TRP 155 9.598 -13.165 -3.481 1141 HH2 TRP 155 HH2 TRP 155 7.619 -14.590 -3.223 1142 HB2 TRP 155 2HB TRP 155 7.653 -7.950 -0.745 1143 HB3 TRP 155 1HB TRP 155 8.951 -8.753 -1.589 1144 H VAL 156 H VAL 156 11.940 -8.346 0.797 1145 HA VAL 156 HA VAL 156 12.329 -5.537 -0.242 1146 HB VAL 156 HB VAL 156 13.575 -6.225 1.728 1147 HG11 VAL 156 1HG1 VAL 156 14.124 -8.620 1.266 1148 HG12 VAL 156 2HG1 VAL 156 15.602 -7.702 1.602 1149 HG13 VAL 156 3HG1 VAL 156 15.186 -8.138 -0.074 1150 HG21 VAL 156 3HG2 VAL 156 15.424 -5.519 -0.630 1151 HG22 VAL 156 1HG2 VAL 156 15.784 -5.269 1.093 1152 HG23 VAL 156 2HG2 VAL 156 14.464 -4.358 0.318 1153 H ARG 157 H ARG 157 12.723 -4.973 -2.276 1154 HA ARG 157 HA ARG 157 13.283 -6.568 -4.628 1155 HE ARG 157 HE ARG 157 13.588 -3.769 -8.219 1156 HB2 ARG 157 2HB ARG 157 13.850 -3.672 -3.787 1157 HB3 ARG 157 1HB ARG 157 14.689 -4.288 -5.184 1158 HG2 ARG 157 2HG ARG 157 12.358 -5.046 -6.147 1159 HG3 ARG 157 1HG ARG 157 11.646 -4.058 -4.878 1160 HD2 ARG 157 2HD ARG 157 11.715 -2.732 -6.928 1161 HD3 ARG 157 1HD ARG 157 12.852 -2.018 -5.834 1162 HH11 ARG 157 2HH1 ARG 157 14.646 -1.468 -5.802 1163 HH12 ARG 157 1HH1 ARG 157 16.341 -1.445 -6.446 1164 HH21 ARG 157 1HH2 ARG 157 15.491 -3.831 -8.812 1165 HH22 ARG 157 2HH2 ARG 157 16.831 -2.837 -8.056 1166 H SER 158 H SER 158 15.013 -7.068 -5.858 1167 HA SER 158 HA SER 158 16.812 -8.747 -4.683 1168 HG SER 158 HG SER 158 17.523 -10.148 -6.961 1169 HB2 SER 158 2HB SER 158 16.057 -8.688 -7.077 1170 HB3 SER 158 1HB SER 158 17.259 -7.440 -7.424 1171 H ALA 159 H ALA 159 18.203 -8.300 -3.120 1172 HA ALA 159 HA ALA 159 20.676 -6.597 -3.552 1173 HB1 ALA 159 3HB ALA 159 18.693 -5.113 -2.763 1174 HB2 ALA 159 1HB ALA 159 20.091 -5.092 -1.657 1175 HB3 ALA 159 2HB ALA 159 18.643 -6.066 -1.262 1176 H SER 160 H SER 160 22.333 -7.009 -2.077 1177 HA SER 160 HA SER 160 22.275 -9.531 -0.447 1178 HG SER 160 HG SER 160 23.600 -9.440 -2.253 1179 HB2 SER 160 2HB SER 160 24.451 -7.342 -0.633 1180 HB3 SER 160 1HB SER 160 24.643 -8.936 0.073 1181 H SER 161 H SER 161 21.688 -6.244 0.417 1182 HA SER 161 HA SER 161 22.011 -4.962 2.421 1183 HG SER 161 HG SER 161 18.990 -5.452 4.146 1184 HB2 SER 161 2HB SER 161 19.700 -5.935 2.062 1185 HB3 SER 161 1HB SER 161 20.099 -7.230 3.204 1186 H ARG 162 H ARG 162 21.898 -5.170 4.948 1187 HA ARG 162 HA ARG 162 23.370 -7.198 6.295 1188 HE ARG 162 HE ARG 162 27.833 -8.375 7.735 1189 HB2 ARG 162 1HB ARG 162 25.350 -5.958 4.867 1190 HB3 ARG 162 2HB ARG 162 25.339 -4.830 6.191 1191 HG2 ARG 162 1HG ARG 162 25.937 -6.573 7.817 1192 HG3 ARG 162 2HG ARG 162 25.565 -7.876 6.674 1193 HD2 ARG 162 1HD ARG 162 27.440 -7.128 5.143 1194 HD3 ARG 162 2HD ARG 162 27.845 -5.815 6.263 1195 HH11 ARG 162 2HH1 ARG 162 29.864 -6.710 5.380 1196 HH12 ARG 162 1HH1 ARG 162 31.337 -7.545 6.059 1197 HH21 ARG 162 1HH2 ARG 162 29.639 -9.259 8.444 1198 HH22 ARG 162 2HH2 ARG 162 31.198 -8.835 7.619 Start of MODEL 15 1 HA MET 1 HA MET 1 16.211 4.923 2.796 2 H1 MET 1 1H MET 1 15.588 7.124 3.914 3 H2 MET 1 2H MET 1 14.877 6.235 5.063 4 HB2 MET 1 1HB MET 1 13.869 4.080 4.594 5 HB3 MET 1 2HB MET 1 14.585 3.104 3.332 6 HG2 MET 1 1HG MET 1 16.721 2.867 4.603 7 HG3 MET 1 2HG MET 1 16.163 4.019 5.829 8 HE1 MET 1 3HE MET 1 16.324 0.101 5.170 9 HE2 MET 1 1HE MET 1 15.311 0.863 3.922 10 HE3 MET 1 2HE MET 1 14.555 -0.237 5.068 11 H GLU 2 H GLU 2 13.934 3.861 1.555 12 HA GLU 2 HA GLU 2 12.281 6.278 0.673 13 HB2 GLU 2 2HB GLU 2 12.407 5.774 -1.641 14 HB3 GLU 2 1HB GLU 2 13.989 5.983 -0.979 15 HG2 GLU 2 2HG GLU 2 14.089 3.305 -0.911 16 HG3 GLU 2 1HG GLU 2 12.747 3.374 -2.045 17 H LEU 3 H LEU 3 10.689 4.266 -1.072 18 HA LEU 3 HA LEU 3 8.751 4.095 1.260 19 HG LEU 3 HG LEU 3 9.053 6.186 -1.792 20 HB2 LEU 3 2HB LEU 3 6.876 4.467 -0.479 21 HB3 LEU 3 1HB LEU 3 7.846 5.741 0.164 22 HD11 LEU 3 1HD1 LEU 3 9.557 3.884 -2.657 23 HD12 LEU 3 2HD1 LEU 3 8.869 4.877 -3.908 24 HD13 LEU 3 3HD1 LEU 3 7.848 3.638 -3.103 25 HD21 LEU 3 3HD2 LEU 3 6.796 7.139 -1.747 26 HD22 LEU 3 1HD2 LEU 3 6.062 5.632 -2.350 27 HD23 LEU 3 2HD2 LEU 3 7.092 6.618 -3.420 28 H VAL 4 H VAL 4 7.206 2.712 1.632 29 HA VAL 4 HA VAL 4 7.649 -0.100 0.543 30 HB VAL 4 HB VAL 4 7.165 0.938 3.357 31 HG11 VAL 4 1HG1 VAL 4 7.607 -1.954 2.464 32 HG12 VAL 4 2HG1 VAL 4 6.205 -1.319 3.299 33 HG13 VAL 4 3HG1 VAL 4 7.771 -1.440 4.161 34 HG21 VAL 4 3HG2 VAL 4 9.436 0.276 4.009 35 HG22 VAL 4 1HG2 VAL 4 9.444 1.516 2.762 36 HG23 VAL 4 2HG2 VAL 4 9.830 -0.148 2.319 37 H SER 5 H SER 5 5.895 -1.389 -0.011 38 HA SER 5 HA SER 5 3.164 -0.088 0.080 39 HG SER 5 HG SER 5 4.403 -2.881 -2.599 40 HB2 SER 5 2HB SER 5 2.722 -1.595 -1.823 41 HB3 SER 5 1HB SER 5 4.170 -0.673 -2.044 42 H VAL 6 H VAL 6 1.297 -0.768 1.007 43 HA VAL 6 HA VAL 6 1.371 -3.284 2.687 44 HB VAL 6 HB VAL 6 1.276 -2.447 4.721 45 HG11 VAL 6 1HG1 VAL 6 3.501 -1.579 3.775 46 HG12 VAL 6 2HG1 VAL 6 2.920 -0.665 5.183 47 HG13 VAL 6 3HG1 VAL 6 2.754 -0.012 3.544 48 HG21 VAL 6 3HG2 VAL 6 -0.704 -0.987 4.749 49 HG22 VAL 6 1HG2 VAL 6 0.211 0.310 3.937 50 HG23 VAL 6 2HG2 VAL 6 0.628 -0.198 5.586 51 H ALA 7 H ALA 7 -0.081 -4.165 1.144 52 HA ALA 7 HA ALA 7 -3.037 -3.348 1.514 53 HB1 ALA 7 3HB ALA 7 -3.413 -4.716 -0.558 54 HB2 ALA 7 1HB ALA 7 -1.684 -5.162 -0.602 55 HB3 ALA 7 2HB ALA 7 -2.191 -3.484 -0.844 56 H ALA 8 H ALA 8 -4.620 -4.800 2.311 57 HA ALA 8 HA ALA 8 -3.688 -7.550 3.275 58 HB1 ALA 8 3HB ALA 8 -4.416 -5.954 5.084 59 HB2 ALA 8 1HB ALA 8 -5.399 -7.417 5.005 60 HB3 ALA 8 2HB ALA 8 -6.025 -5.888 4.378 61 H LEU 9 H LEU 9 -4.319 -9.269 2.228 62 HA LEU 9 HA LEU 9 -6.867 -9.321 0.598 63 HG LEU 9 HG LEU 9 -3.476 -9.361 -2.040 64 HB2 LEU 9 2HB LEU 9 -5.646 -9.882 -1.455 65 HB3 LEU 9 1HB LEU 9 -5.416 -8.283 -0.887 66 HD11 LEU 9 1HD1 LEU 9 -2.858 -8.286 0.779 67 HD12 LEU 9 2HD1 LEU 9 -3.149 -7.308 -0.671 68 HD13 LEU 9 3HD1 LEU 9 -1.724 -8.317 -0.556 69 HD21 LEU 9 3HD2 LEU 9 -2.884 -10.903 0.546 70 HD22 LEU 9 1HD2 LEU 9 -2.014 -10.954 -1.002 71 HD23 LEU 9 2HD2 LEU 9 -3.639 -11.647 -0.906 72 H ALA 10 H ALA 10 -7.568 -11.199 -0.368 73 HA ALA 10 HA ALA 10 -6.881 -13.729 1.234 74 HB1 ALA 10 3HB ALA 10 -9.557 -12.485 0.213 75 HB2 ALA 10 1HB ALA 10 -8.922 -12.436 1.885 76 HB3 ALA 10 2HB ALA 10 -9.430 -13.965 1.184 77 H GLU 11 H GLU 11 -9.111 -15.043 -0.491 78 HA GLU 11 HA GLU 11 -7.372 -16.416 -2.436 79 HB2 GLU 11 2HB GLU 11 -9.214 -17.616 -1.394 80 HB3 GLU 11 1HB GLU 11 -10.400 -16.467 -1.993 81 HG2 GLU 11 2HG GLU 11 -10.613 -18.537 -3.238 82 HG3 GLU 11 1HG GLU 11 -10.143 -17.258 -4.324 83 H ASN 12 H ASN 12 -7.714 -16.526 -4.702 84 HA ASN 12 HA ASN 12 -6.782 -15.365 -6.527 85 HB2 ASN 12 2HB ASN 12 -9.634 -14.326 -6.229 86 HB3 ASN 12 1HB ASN 12 -8.638 -13.317 -7.195 87 HD21 ASN 12 1HD2 ASN 12 -9.981 -16.515 -7.057 88 HD22 ASN 12 2HD2 ASN 12 -9.648 -16.851 -8.821 89 H ARG 13 H ARG 13 -6.055 -14.115 -3.898 90 HA ARG 13 HA ARG 13 -5.003 -12.257 -2.993 91 HE ARG 13 HE ARG 13 -2.268 -11.939 -8.654 92 HB2 ARG 13 2HB ARG 13 -3.133 -11.213 -4.197 93 HB3 ARG 13 1HB ARG 13 -3.079 -12.955 -4.084 94 HG2 ARG 13 2HG ARG 13 -3.802 -13.197 -6.474 95 HG3 ARG 13 1HG ARG 13 -3.934 -11.436 -6.651 96 HD2 ARG 13 2HD ARG 13 -1.518 -11.180 -6.346 97 HD3 ARG 13 1HD ARG 13 -1.301 -12.845 -5.856 98 HH11 ARG 13 2HH1 ARG 13 -0.043 -13.775 -6.807 99 HH12 ARG 13 1HH1 ARG 13 0.512 -14.762 -8.244 100 HH21 ARG 13 1HH2 ARG 13 -1.681 -13.055 -10.273 101 HH22 ARG 13 2HH2 ARG 13 -0.395 -14.334 -10.164 102 H VAL 14 H VAL 14 -7.350 -11.741 -3.248 103 HA VAL 14 HA VAL 14 -8.030 -9.244 -4.709 104 HB VAL 14 HB VAL 14 -9.498 -11.212 -2.868 105 HG11 VAL 14 1HG1 VAL 14 -11.643 -10.007 -3.076 106 HG12 VAL 14 2HG1 VAL 14 -10.814 -8.553 -3.706 107 HG13 VAL 14 3HG1 VAL 14 -10.504 -9.141 -2.051 108 HG21 VAL 14 3HG2 VAL 14 -9.209 -11.661 -5.341 109 HG22 VAL 14 1HG2 VAL 14 -10.061 -10.149 -5.737 110 HG23 VAL 14 2HG2 VAL 14 -10.912 -11.478 -4.885 111 H ILE 15 H ILE 15 -7.202 -7.342 -4.101 112 HA ILE 15 HA ILE 15 -6.617 -6.443 -1.324 113 HB ILE 15 HB ILE 15 -7.233 -4.628 -3.696 114 HG12 ILE 15 2HG1 ILE 15 -4.313 -5.045 -2.900 115 HG13 ILE 15 1HG1 ILE 15 -5.070 -6.336 -3.779 116 HG21 ILE 15 1HG2 ILE 15 -5.481 -3.856 -1.254 117 HG22 ILE 15 2HG2 ILE 15 -7.206 -3.490 -1.349 118 HG23 ILE 15 3HG2 ILE 15 -6.111 -2.791 -2.519 119 HD11 ILE 15 3HD1 ILE 15 -3.921 -4.625 -5.304 120 HD12 ILE 15 1HD1 ILE 15 -5.166 -3.442 -4.841 121 HD13 ILE 15 2HD1 ILE 15 -5.614 -4.921 -5.710 122 H GLY 16 H GLY 16 -9.357 -5.391 -3.401 123 HA2 GLY 16 2HA GLY 16 -11.156 -5.308 -0.956 124 HA3 GLY 16 1HA GLY 16 -10.814 -3.742 -1.712 125 H ARG 17 H ARG 17 -13.182 -4.125 -1.487 126 HA ARG 17 HA ARG 17 -14.419 -5.156 -4.069 127 HE ARG 17 HE ARG 17 -17.083 -8.989 -4.625 128 HB2 ARG 17 2HB ARG 17 -14.524 -6.754 -1.854 129 HB3 ARG 17 1HB ARG 17 -15.903 -5.760 -1.449 130 HG2 ARG 17 2HG ARG 17 -17.109 -6.544 -3.464 131 HG3 ARG 17 1HG ARG 17 -15.632 -7.116 -4.224 132 HD2 ARG 17 2HD ARG 17 -15.406 -8.831 -2.244 133 HD3 ARG 17 1HD ARG 17 -17.056 -8.342 -1.760 134 HH11 ARG 17 2HH1 ARG 17 -16.842 -10.694 -1.596 135 HH12 ARG 17 1HH1 ARG 17 -17.209 -12.292 -2.397 136 HH21 ARG 17 1HH2 ARG 17 -17.465 -10.839 -5.480 137 HH22 ARG 17 2HH2 ARG 17 -17.565 -12.384 -4.549 138 H ASP 18 H ASP 18 -16.022 -3.514 -1.229 139 HA ASP 18 HA ASP 18 -16.762 -1.236 -2.700 140 HB2 ASP 18 2HB ASP 18 -16.266 -1.566 0.335 141 HB3 ASP 18 1HB ASP 18 -17.131 -0.234 -0.413 142 H GLY 19 H GLY 19 -13.719 -1.409 -0.829 143 HA2 GLY 19 2HA GLY 19 -12.484 0.718 -2.562 144 HA3 GLY 19 1HA GLY 19 -12.840 1.351 -0.977 145 H GLU 20 H GLU 20 -11.532 0.516 0.861 146 HA GLU 20 HA GLU 20 -8.836 -0.432 0.042 147 HB2 GLU 20 2HB GLU 20 -8.027 -0.245 2.221 148 HB3 GLU 20 1HB GLU 20 -8.841 1.218 1.791 149 HG2 GLU 20 2HG GLU 20 -10.482 -0.753 3.468 150 HG3 GLU 20 1HG GLU 20 -9.059 -0.122 4.245 151 H LEU 21 H LEU 21 -11.488 -2.082 1.770 152 HA LEU 21 HA LEU 21 -10.369 -4.673 0.938 153 HG LEU 21 HG LEU 21 -9.149 -2.560 3.587 154 HB2 LEU 21 2HB LEU 21 -10.056 -5.511 3.443 155 HB3 LEU 21 1HB LEU 21 -8.824 -4.822 2.427 156 HD11 LEU 21 1HD1 LEU 21 -10.179 -2.704 5.938 157 HD12 LEU 21 2HD1 LEU 21 -10.853 -4.299 5.479 158 HD13 LEU 21 3HD1 LEU 21 -11.382 -2.824 4.630 159 HD21 LEU 21 3HD2 LEU 21 -8.153 -4.824 5.357 160 HD22 LEU 21 1HD2 LEU 21 -7.670 -3.119 5.420 161 HD23 LEU 21 2HD2 LEU 21 -7.263 -4.091 3.998 162 HA PRO 22 HA PRO 22 -14.505 -6.091 1.082 163 HB2 PRO 22 2HB PRO 22 -13.693 -8.947 1.622 164 HB3 PRO 22 1HB PRO 22 -14.370 -8.229 0.153 165 HG2 PRO 22 2HG PRO 22 -11.726 -9.054 0.302 166 HG3 PRO 22 1HG PRO 22 -12.194 -7.635 -0.675 167 HD2 PRO 22 2HD PRO 22 -11.077 -7.596 2.190 168 HD3 PRO 22 1HD PRO 22 -10.546 -6.718 0.773 169 H TRP 23 H TRP 23 -12.806 -6.774 3.869 170 HA TRP 23 HA TRP 23 -15.249 -7.282 5.594 171 HD1 TRP 23 HD1 TRP 23 -11.594 -5.975 7.735 172 HE1 TRP 23 HE1 TRP 23 -9.168 -5.776 6.701 173 HE3 TRP 23 HE3 TRP 23 -12.012 -9.755 4.412 174 HZ2 TRP 23 HZ2 TRP 23 -7.757 -7.188 4.760 175 HZ3 TRP 23 HZ3 TRP 23 -10.131 -10.192 2.844 176 HH2 TRP 23 HH2 TRP 23 -8.055 -8.861 2.991 177 HB2 TRP 23 2HB TRP 23 -13.708 -7.876 7.470 178 HB3 TRP 23 1HB TRP 23 -13.569 -8.982 6.117 179 HA PRO 24 HA PRO 24 -15.033 -2.937 6.566 180 HB2 PRO 24 2HB PRO 24 -15.318 -3.334 9.548 181 HB3 PRO 24 1HB PRO 24 -16.352 -2.469 8.407 182 HG2 PRO 24 2HG PRO 24 -17.113 -4.926 9.412 183 HG3 PRO 24 1HG PRO 24 -17.475 -4.485 7.734 184 HD2 PRO 24 2HD PRO 24 -15.177 -6.253 8.716 185 HD3 PRO 24 1HD PRO 24 -16.302 -6.495 7.349 186 H SER 25 H SER 25 -13.088 -4.383 9.166 187 HA SER 25 HA SER 25 -10.524 -3.548 8.492 188 HG SER 25 HG SER 25 -11.501 -1.315 7.688 189 HB2 SER 25 2HB SER 25 -11.749 -1.237 10.121 190 HB3 SER 25 1HB SER 25 -10.029 -1.592 10.100 191 H ILE 26 H ILE 26 -9.898 -5.380 9.609 192 HA ILE 26 HA ILE 26 -10.713 -5.962 12.369 193 HB ILE 26 HB ILE 26 -8.660 -7.544 12.457 194 HG12 ILE 26 2HG1 ILE 26 -8.050 -6.441 9.876 195 HG13 ILE 26 1HG1 ILE 26 -7.162 -7.557 10.844 196 HG21 ILE 26 1HG2 ILE 26 -11.046 -8.229 10.689 197 HG22 ILE 26 2HG2 ILE 26 -10.960 -8.291 12.463 198 HG23 ILE 26 3HG2 ILE 26 -9.936 -9.367 11.500 199 HD11 ILE 26 3HD1 ILE 26 -8.267 -9.507 9.687 200 HD12 ILE 26 1HD1 ILE 26 -7.555 -8.369 8.510 201 HD13 ILE 26 2HD1 ILE 26 -9.305 -8.386 8.770 202 HA PRO 27 HA PRO 27 -8.056 -3.057 14.606 203 HB2 PRO 27 2HB PRO 27 -8.223 -5.131 16.865 204 HB3 PRO 27 1HB PRO 27 -8.403 -3.354 16.941 205 HG2 PRO 27 2HG PRO 27 -10.672 -4.835 16.876 206 HG3 PRO 27 1HG PRO 27 -10.557 -3.438 15.770 207 HD2 PRO 27 2HD PRO 27 -10.060 -6.381 15.053 208 HD3 PRO 27 1HD PRO 27 -11.068 -5.130 14.239 209 H ALA 28 H ALA 28 -6.637 -6.380 14.861 210 HA ALA 28 HA ALA 28 -3.913 -5.496 15.062 211 HB1 ALA 28 3HB ALA 28 -3.423 -7.767 13.926 212 HB2 ALA 28 1HB ALA 28 -5.169 -7.926 13.704 213 HB3 ALA 28 2HB ALA 28 -4.472 -7.761 15.345 214 H ASP 29 H ASP 29 -5.807 -5.503 12.052 215 HA ASP 29 HA ASP 29 -3.543 -4.578 10.309 216 HB2 ASP 29 2HB ASP 29 -5.456 -5.998 9.478 217 HB3 ASP 29 1HB ASP 29 -6.593 -4.705 9.832 218 H LYS 30 H LYS 30 -6.583 -2.948 11.329 219 HA LYS 30 HA LYS 30 -5.642 -0.297 10.866 220 HB2 LYS 30 2HB LYS 30 -8.084 -1.392 11.693 221 HB3 LYS 30 1HB LYS 30 -7.632 -0.486 13.091 222 HG2 LYS 30 2HG LYS 30 -8.950 0.981 11.758 223 HG3 LYS 30 1HG LYS 30 -7.321 1.615 11.606 224 HD2 LYS 30 2HD LYS 30 -7.140 0.798 9.256 225 HD3 LYS 30 1HD LYS 30 -8.375 -0.367 9.491 226 HE2 LYS 30 2HE LYS 30 -9.585 1.197 8.207 227 HE3 LYS 30 1HE LYS 30 -10.132 1.575 9.821 228 HZ1 LYS 30 3HZ LYS 30 -9.338 3.700 8.889 229 HZ2 LYS 30 1HZ LYS 30 -8.052 3.005 8.159 230 HZ3 LYS 30 2HZ LYS 30 -8.090 3.267 9.803 231 H LYS 31 H LYS 31 -4.644 -2.139 13.465 232 HA LYS 31 HA LYS 31 -3.180 0.146 14.865 233 HB2 LYS 31 2HB LYS 31 -4.152 -1.546 16.403 234 HB3 LYS 31 1HB LYS 31 -3.360 -2.829 15.518 235 HG2 LYS 31 2HG LYS 31 -2.174 -2.476 17.618 236 HG3 LYS 31 1HG LYS 31 -1.164 -2.248 16.212 237 HD2 LYS 31 2HD LYS 31 -1.534 0.323 16.459 238 HD3 LYS 31 1HD LYS 31 -2.337 -0.004 17.995 239 HE2 LYS 31 2HE LYS 31 -0.262 -1.076 18.911 240 HE3 LYS 31 1HE LYS 31 0.508 -1.036 17.319 241 HZ1 LYS 31 3HZ LYS 31 1.152 0.923 18.851 242 HZ2 LYS 31 1HZ LYS 31 -0.370 1.548 18.639 243 HZ3 LYS 31 2HZ LYS 31 0.642 1.358 17.355 244 H GLN 32 H GLN 32 -2.364 -2.711 12.765 245 HA GLN 32 HA GLN 32 0.578 -2.201 13.005 246 HB2 GLN 32 2HB GLN 32 -0.179 -4.495 12.769 247 HB3 GLN 32 1HB GLN 32 -0.997 -4.147 11.249 248 HG2 GLN 32 2HG GLN 32 0.999 -3.878 10.022 249 HG3 GLN 32 1HG GLN 32 2.009 -3.577 11.421 250 HE21 GLN 32 1HE2 GLN 32 3.064 -5.345 12.264 251 HE22 GLN 32 2HE2 GLN 32 2.626 -7.076 11.803 252 H TYR 33 H TYR 33 -1.838 -1.649 10.420 253 HA TYR 33 HA TYR 33 -0.162 0.083 8.731 254 HD1 TYR 33 HD1 TYR 33 -4.024 0.877 10.277 255 HD2 TYR 33 HD2 TYR 33 -2.650 1.962 6.385 256 HE1 TYR 33 HE1 TYR 33 -5.605 2.749 10.253 257 HE2 TYR 33 HE2 TYR 33 -4.181 3.914 6.392 258 HH TYR 33 HH TYR 33 -5.594 5.255 7.807 259 HB2 TYR 33 2HB TYR 33 -1.976 -0.277 7.456 260 HB3 TYR 33 1HB TYR 33 -2.952 -0.810 8.747 261 H ARG 34 H ARG 34 -1.872 0.902 11.773 262 HA ARG 34 HA ARG 34 -0.889 3.759 11.499 263 HE ARG 34 HE ARG 34 -5.120 5.773 11.846 264 HB2 ARG 34 2HB ARG 34 -2.496 2.354 13.694 265 HB3 ARG 34 1HB ARG 34 -1.799 3.974 13.928 266 HG2 ARG 34 2HG ARG 34 -3.001 4.796 11.822 267 HG3 ARG 34 1HG ARG 34 -3.722 3.224 11.646 268 HD2 ARG 34 2HD ARG 34 -5.207 3.417 13.432 269 HD3 ARG 34 1HD ARG 34 -4.110 4.448 14.365 270 HH11 ARG 34 2HH1 ARG 34 -5.841 5.241 15.162 271 HH12 ARG 34 1HH1 ARG 34 -6.694 6.845 15.343 272 HH21 ARG 34 1HH2 ARG 34 -6.129 7.575 12.030 273 HH22 ARG 34 2HH2 ARG 34 -6.844 8.100 13.609 274 H SER 35 H SER 35 0.422 1.023 13.363 275 HA SER 35 HA SER 35 2.618 2.701 14.566 276 HG SER 35 HG SER 35 2.682 -0.299 16.331 277 HB2 SER 35 2HB SER 35 2.548 -0.330 14.012 278 HB3 SER 35 1HB SER 35 3.893 0.522 14.770 279 H ARG 36 H ARG 36 2.063 1.307 11.487 280 HA ARG 36 HA ARG 36 4.902 1.718 10.415 281 HE ARG 36 HE ARG 36 6.274 -2.551 8.907 282 HB2 ARG 36 2HB ARG 36 3.493 -0.409 10.094 283 HB3 ARG 36 1HB ARG 36 2.309 0.555 9.231 284 HG2 ARG 36 2HG ARG 36 3.287 -0.329 7.418 285 HG3 ARG 36 1HG ARG 36 4.253 1.063 7.525 286 HD2 ARG 36 2HD ARG 36 5.540 -1.018 6.991 287 HD3 ARG 36 1HD ARG 36 6.191 -0.173 8.356 288 HH11 ARG 36 2HH1 ARG 36 2.957 -1.877 8.273 289 HH12 ARG 36 1HH1 ARG 36 2.541 -3.626 8.615 290 HH21 ARG 36 1HH2 ARG 36 5.750 -4.395 9.290 291 HH22 ARG 36 2HH2 ARG 36 4.026 -4.881 9.287 292 H VAL 37 H VAL 37 1.502 2.825 9.476 293 HA VAL 37 HA VAL 37 2.814 5.068 7.910 294 HB VAL 37 HB VAL 37 1.361 4.956 6.295 295 HG11 VAL 37 1HG1 VAL 37 0.837 2.031 7.052 296 HG12 VAL 37 2HG1 VAL 37 2.350 2.633 6.336 297 HG13 VAL 37 3HG1 VAL 37 0.834 2.737 5.408 298 HG21 VAL 37 3HG2 VAL 37 -0.798 5.480 7.159 299 HG22 VAL 37 1HG2 VAL 37 -0.950 3.948 8.018 300 HG23 VAL 37 2HG2 VAL 37 -1.043 3.980 6.245 301 H ALA 38 H ALA 38 1.253 5.175 10.874 302 HA ALA 38 HA ALA 38 -0.602 7.472 10.270 303 HB1 ALA 38 3HB ALA 38 -1.159 5.949 12.109 304 HB2 ALA 38 1HB ALA 38 -1.013 7.628 12.662 305 HB3 ALA 38 2HB ALA 38 0.286 6.463 13.005 306 H ASP 39 H ASP 39 2.728 7.268 11.392 307 HA ASP 39 HA ASP 39 3.099 10.259 11.489 308 HB2 ASP 39 2HB ASP 39 4.798 7.843 12.221 309 HB3 ASP 39 1HB ASP 39 5.647 9.185 11.531 310 H ASP 40 H ASP 40 4.455 7.638 9.371 311 HA ASP 40 HA ASP 40 5.337 9.382 7.386 312 HB2 ASP 40 2HB ASP 40 4.791 6.392 7.480 313 HB3 ASP 40 1HB ASP 40 5.402 7.097 6.004 314 HA PRO 41 HA PRO 41 1.980 10.298 4.242 315 HB2 PRO 41 2HB PRO 41 4.403 10.076 2.348 316 HB3 PRO 41 1HB PRO 41 3.129 11.289 2.350 317 HG2 PRO 41 2HG PRO 41 5.493 11.938 3.464 318 HG3 PRO 41 1HG PRO 41 4.059 12.288 4.456 319 HD2 PRO 41 2HD PRO 41 5.873 9.803 4.699 320 HD3 PRO 41 1HD PRO 41 5.321 10.936 5.960 321 H VAL 42 H VAL 42 0.688 9.123 2.777 322 HA VAL 42 HA VAL 42 1.782 6.438 1.765 323 HB VAL 42 HB VAL 42 -1.049 7.158 2.695 324 HG11 VAL 42 1HG1 VAL 42 -1.591 4.733 2.475 325 HG12 VAL 42 2HG1 VAL 42 0.042 4.373 1.856 326 HG13 VAL 42 3HG1 VAL 42 -1.095 5.342 0.885 327 HG21 VAL 42 3HG2 VAL 42 1.225 5.438 3.933 328 HG22 VAL 42 1HG2 VAL 42 -0.456 5.341 4.491 329 HG23 VAL 42 2HG2 VAL 42 0.459 6.857 4.656 330 H VAL 43 H VAL 43 1.743 5.872 -0.269 331 HA VAL 43 HA VAL 43 0.421 7.675 -2.346 332 HB VAL 43 HB VAL 43 2.054 7.047 -3.943 333 HG11 VAL 43 1HG1 VAL 43 2.937 8.757 -2.240 334 HG12 VAL 43 2HG1 VAL 43 4.225 7.762 -2.964 335 HG13 VAL 43 3HG1 VAL 43 3.659 7.446 -1.323 336 HG21 VAL 43 3HG2 VAL 43 2.464 4.656 -3.553 337 HG22 VAL 43 1HG2 VAL 43 3.164 5.004 -1.936 338 HG23 VAL 43 2HG2 VAL 43 4.013 5.481 -3.403 339 H LEU 44 H LEU 44 -1.548 7.068 -2.974 340 HA LEU 44 HA LEU 44 -2.190 4.093 -3.382 341 HG LEU 44 HG LEU 44 -4.165 7.056 -2.143 342 HB2 LEU 44 2HB LEU 44 -4.124 4.238 -1.986 343 HB3 LEU 44 1HB LEU 44 -2.696 4.566 -1.092 344 HD11 LEU 44 1HD1 LEU 44 -5.311 5.322 0.169 345 HD12 LEU 44 2HD1 LEU 44 -6.096 5.619 -1.390 346 HD13 LEU 44 3HD1 LEU 44 -5.859 6.963 -0.270 347 HD21 LEU 44 3HD2 LEU 44 -2.121 7.168 -0.596 348 HD22 LEU 44 1HD2 LEU 44 -3.116 6.460 0.698 349 HD23 LEU 44 2HD2 LEU 44 -3.557 8.021 -0.026 350 H GLY 45 H GLY 45 -4.712 3.856 -3.990 351 HA2 GLY 45 2HA GLY 45 -4.733 5.031 -6.830 352 HA3 GLY 45 1HA GLY 45 -5.489 3.514 -6.341 353 H ARG 46 H ARG 46 -7.222 4.519 -7.595 354 HA ARG 46 HA ARG 46 -8.970 6.373 -5.903 355 HE ARG 46 HE ARG 46 -11.587 8.518 -7.636 356 HB2 ARG 46 2HB ARG 46 -9.284 5.793 -8.875 357 HB3 ARG 46 1HB ARG 46 -10.604 6.365 -7.913 358 HG2 ARG 46 2HG ARG 46 -7.903 7.828 -8.117 359 HG3 ARG 46 1HG ARG 46 -9.291 8.234 -9.104 360 HD2 ARG 46 2HD ARG 46 -9.208 8.482 -6.001 361 HD3 ARG 46 1HD ARG 46 -8.926 9.787 -7.136 362 HH11 ARG 46 2HH1 ARG 46 -10.096 10.396 -5.182 363 HH12 ARG 46 1HH1 ARG 46 -11.696 11.133 -4.696 364 HH21 ARG 46 1HH2 ARG 46 -13.328 9.196 -6.932 365 HH22 ARG 46 2HH2 ARG 46 -13.423 10.532 -5.701 366 H THR 47 H THR 47 -8.955 2.959 -6.991 367 HA THR 47 HA THR 47 -11.312 2.292 -5.553 368 HB THR 47 HB THR 47 -8.770 0.550 -5.642 369 HG1 THR 47 HG1 THR 47 -10.839 0.175 -7.408 370 HG21 THR 47 3HG2 THR 47 -10.224 -0.801 -4.408 371 HG22 THR 47 1HG2 THR 47 -10.883 -1.186 -6.003 372 HG23 THR 47 2HG2 THR 47 -11.707 0.004 -4.962 373 H THR 48 H THR 48 -8.136 1.743 -3.921 374 HA THR 48 HA THR 48 -8.955 2.000 -1.201 375 HB THR 48 HB THR 48 -6.582 2.668 -0.696 376 HG1 THR 48 HG1 THR 48 -6.376 3.934 -2.567 377 HG21 THR 48 3HG2 THR 48 -6.566 0.399 -2.746 378 HG22 THR 48 1HG2 THR 48 -7.065 0.220 -1.046 379 HG23 THR 48 2HG2 THR 48 -5.413 0.733 -1.425 380 H PHE 49 H PHE 49 -8.548 4.823 -3.318 381 HA PHE 49 HA PHE 49 -8.554 6.714 -0.909 382 HD1 PHE 49 HD2 PHE 49 -10.260 9.388 -2.643 383 HD2 PHE 49 HD1 PHE 49 -6.058 9.030 -1.875 384 HE1 PHE 49 HE2 PHE 49 -10.252 11.623 -1.655 385 HE2 PHE 49 HE1 PHE 49 -6.008 11.374 -1.112 386 HZ PHE 49 HZ PHE 49 -8.121 12.621 -0.876 387 HB2 PHE 49 2HB PHE 49 -7.147 7.243 -2.945 388 HB3 PHE 49 1HB PHE 49 -8.616 7.549 -3.859 389 H GLU 50 H GLU 50 -10.852 5.629 -3.394 390 HA GLU 50 HA GLU 50 -13.068 7.443 -2.495 391 HB2 GLU 50 2HB GLU 50 -13.029 4.950 -4.311 392 HB3 GLU 50 1HB GLU 50 -14.501 5.801 -3.891 393 HG2 GLU 50 2HG GLU 50 -13.669 7.913 -4.861 394 HG3 GLU 50 1HG GLU 50 -12.050 7.252 -5.128 395 H SER 51 H SER 51 -11.965 4.270 -1.466 396 HA SER 51 HA SER 51 -13.486 4.239 1.081 397 HG SER 51 HG SER 51 -10.838 2.797 2.614 398 HB2 SER 51 2HB SER 51 -12.291 2.328 1.139 399 HB3 SER 51 1HB SER 51 -11.147 2.835 -0.090 400 H MET 52 H MET 52 -10.155 5.273 1.107 401 HA MET 52 HA MET 52 -10.210 6.461 3.502 402 HB2 MET 52 2HB MET 52 -8.366 7.432 1.192 403 HB3 MET 52 1HB MET 52 -8.065 7.703 2.891 404 HG2 MET 52 2HG MET 52 -8.430 4.815 2.594 405 HG3 MET 52 1HG MET 52 -7.306 5.396 1.367 406 HE1 MET 52 3HE MET 52 -5.753 4.014 2.375 407 HE2 MET 52 1HE MET 52 -4.954 4.191 3.969 408 HE3 MET 52 2HE MET 52 -4.490 5.269 2.614 409 H ARG 53 H ARG 53 -11.387 8.182 1.038 410 HA ARG 53 HA ARG 53 -11.868 10.900 2.007 411 HE ARG 53 HE ARG 53 -15.792 12.608 -1.467 412 HB2 ARG 53 2HB ARG 53 -12.553 9.507 -0.223 413 HB3 ARG 53 1HB ARG 53 -13.856 8.905 0.779 414 HG2 ARG 53 2HG ARG 53 -14.207 11.600 1.211 415 HG3 ARG 53 1HG ARG 53 -13.264 11.744 -0.261 416 HD2 ARG 53 2HD ARG 53 -14.857 10.350 -1.532 417 HD3 ARG 53 1HD ARG 53 -15.754 9.900 -0.096 418 HH11 ARG 53 2HH1 ARG 53 -16.523 10.985 1.536 419 HH12 ARG 53 1HH1 ARG 53 -17.567 12.338 2.123 420 HH21 ARG 53 1HH2 ARG 53 -16.907 14.145 -0.767 421 HH22 ARG 53 2HH2 ARG 53 -17.764 14.072 0.850 422 H ASP 54 H ASP 54 -13.033 7.854 3.355 423 HA ASP 54 HA ASP 54 -14.288 9.353 5.677 424 HB2 ASP 54 2HB ASP 54 -14.921 6.715 4.384 425 HB3 ASP 54 1HB ASP 54 -14.649 6.535 6.106 426 H ASP 55 H ASP 55 -12.326 6.335 5.900 427 HA ASP 55 HA ASP 55 -10.762 7.642 8.008 428 HB2 ASP 55 2HB ASP 55 -11.499 4.910 7.309 429 HB3 ASP 55 1HB ASP 55 -9.764 4.953 7.292 430 H LEU 56 H LEU 56 -9.228 9.044 7.597 431 HA LEU 56 HA LEU 56 -7.415 8.935 5.387 432 HG LEU 56 HG LEU 56 -7.718 12.565 6.523 433 HB2 LEU 56 2HB LEU 56 -6.562 10.590 7.772 434 HB3 LEU 56 1HB LEU 56 -6.341 10.863 6.084 435 HD11 LEU 56 1HD1 LEU 56 -8.979 11.331 4.722 436 HD12 LEU 56 2HD1 LEU 56 -10.037 12.274 5.773 437 HD13 LEU 56 3HD1 LEU 56 -9.953 10.517 5.964 438 HD21 LEU 56 3HD2 LEU 56 -9.502 12.695 8.194 439 HD22 LEU 56 1HD2 LEU 56 -8.025 12.046 8.929 440 HD23 LEU 56 2HD2 LEU 56 -9.377 10.948 8.532 441 HA PRO 57 HA PRO 57 -4.049 6.296 7.105 442 HB2 PRO 57 2HB PRO 57 -2.096 6.581 5.246 443 HB3 PRO 57 1HB PRO 57 -3.655 5.853 4.881 444 HG2 PRO 57 2HG PRO 57 -2.699 8.695 4.237 445 HG3 PRO 57 1HG PRO 57 -3.618 7.584 3.196 446 HD2 PRO 57 2HD PRO 57 -4.703 9.648 4.808 447 HD3 PRO 57 1HD PRO 57 -5.664 8.290 4.148 448 H GLY 58 H GLY 58 -1.787 8.710 6.002 449 HA2 GLY 58 2HA GLY 58 -0.705 9.046 8.869 450 HA3 GLY 58 1HA GLY 58 0.242 9.099 7.404 451 H SER 59 H SER 59 1.079 11.020 8.484 452 HA SER 59 HA SER 59 -0.093 13.613 8.239 453 HG SER 59 HG SER 59 3.209 14.831 8.284 454 HB2 SER 59 2HB SER 59 2.271 12.898 9.028 455 HB3 SER 59 1HB SER 59 2.738 12.810 7.327 456 H ALA 60 H ALA 60 0.255 11.501 5.500 457 HA ALA 60 HA ALA 60 -1.123 13.535 3.863 458 HB1 ALA 60 3HB ALA 60 1.755 12.787 3.058 459 HB2 ALA 60 1HB ALA 60 1.082 14.380 3.422 460 HB3 ALA 60 2HB ALA 60 0.605 13.542 1.924 461 H GLN 61 H GLN 61 -1.882 12.970 1.837 462 HA GLN 61 HA GLN 61 -2.349 9.964 1.364 463 HB2 GLN 61 2HB GLN 61 -4.007 11.343 2.878 464 HB3 GLN 61 1HB GLN 61 -4.492 12.175 1.407 465 HG2 GLN 61 2HG GLN 61 -5.147 9.870 0.434 466 HG3 GLN 61 1HG GLN 61 -4.740 9.139 1.937 467 HE21 GLN 61 1HE2 GLN 61 -5.993 11.031 3.783 468 HE22 GLN 61 2HE2 GLN 61 -7.775 10.644 3.489 469 H ILE 62 H ILE 62 -0.997 9.995 -0.364 470 HA ILE 62 HA ILE 62 -1.266 11.900 -2.675 471 HB ILE 62 HB ILE 62 0.664 9.648 -1.902 472 HG12 ILE 62 2HG1 ILE 62 1.493 12.470 -2.473 473 HG13 ILE 62 1HG1 ILE 62 0.671 12.191 -0.944 474 HG21 ILE 62 1HG2 ILE 62 2.131 10.299 -3.858 475 HG22 ILE 62 2HG2 ILE 62 0.728 11.229 -4.515 476 HG23 ILE 62 3HG2 ILE 62 0.651 9.453 -4.345 477 HD11 ILE 62 3HD1 ILE 62 3.061 12.101 -0.547 478 HD12 ILE 62 1HD1 ILE 62 3.341 10.992 -1.900 479 HD13 ILE 62 2HD1 ILE 62 2.514 10.423 -0.408 480 H VAL 63 H VAL 63 -2.723 11.429 -4.382 481 HA VAL 63 HA VAL 63 -3.009 8.526 -5.203 482 HB VAL 63 HB VAL 63 -4.631 10.895 -6.054 483 HG11 VAL 63 1HG1 VAL 63 -6.065 9.215 -7.401 484 HG12 VAL 63 2HG1 VAL 63 -4.805 7.992 -7.141 485 HG13 VAL 63 3HG1 VAL 63 -4.451 9.425 -8.115 486 HG21 VAL 63 3HG2 VAL 63 -5.275 8.225 -4.605 487 HG22 VAL 63 1HG2 VAL 63 -6.471 9.520 -4.937 488 HG23 VAL 63 2HG2 VAL 63 -5.111 9.819 -3.853 489 H MET 64 H MET 64 -1.653 7.574 -6.382 490 HA MET 64 HA MET 64 -0.170 8.747 -8.725 491 HB2 MET 64 2HB MET 64 -0.392 6.014 -7.287 492 HB3 MET 64 1HB MET 64 0.141 6.023 -8.925 493 HG2 MET 64 2HG MET 64 1.710 8.145 -7.662 494 HG3 MET 64 1HG MET 64 1.678 6.788 -6.558 495 HE1 MET 64 3HE MET 64 3.180 6.671 -10.999 496 HE2 MET 64 1HE MET 64 2.279 8.028 -10.256 497 HE3 MET 64 2HE MET 64 1.428 6.526 -10.719 498 H SER 65 H SER 65 -1.742 9.574 -9.984 499 HA SER 65 HA SER 65 -2.874 7.800 -12.047 500 HG SER 65 HG SER 65 -5.602 7.083 -11.953 501 HB2 SER 65 2HB SER 65 -4.636 7.557 -10.137 502 HB3 SER 65 1HB SER 65 -5.007 9.264 -10.338 503 H ARG 66 H ARG 66 -4.544 9.315 -13.398 504 HA ARG 66 HA ARG 66 -3.270 12.119 -13.704 505 HE ARG 66 HE ARG 66 -5.567 13.610 -16.792 506 HB2 ARG 66 2HB ARG 66 -2.829 10.287 -15.567 507 HB3 ARG 66 1HB ARG 66 -4.457 10.619 -16.084 508 HG2 ARG 66 2HG ARG 66 -2.799 13.132 -15.672 509 HG3 ARG 66 1HG ARG 66 -1.971 11.973 -16.632 510 HD2 ARG 66 2HD ARG 66 -3.058 12.902 -18.422 511 HD3 ARG 66 1HD ARG 66 -4.344 11.822 -18.019 512 HH11 ARG 66 2HH1 ARG 66 -2.580 14.817 -18.084 513 HH12 ARG 66 1HH1 ARG 66 -3.131 16.547 -18.015 514 HH21 ARG 66 1HH2 ARG 66 -6.211 15.563 -16.807 515 HH22 ARG 66 2HH2 ARG 66 -5.139 16.943 -17.312 516 H SER 67 H SER 67 -5.266 11.544 -11.928 517 HA SER 67 HA SER 67 -7.776 12.988 -12.791 518 HG SER 67 HG SER 67 -6.897 11.372 -9.120 519 HB2 SER 67 2HB SER 67 -8.371 12.636 -10.369 520 HB3 SER 67 1HB SER 67 -7.910 11.149 -11.179 521 H GLU 68 H GLU 68 -8.282 14.835 -10.809 522 HA GLU 68 HA GLU 68 -6.724 17.083 -11.950 523 HB2 GLU 68 2HB GLU 68 -9.125 17.102 -10.045 524 HB3 GLU 68 1HB GLU 68 -8.357 18.524 -10.713 525 HG2 GLU 68 2HG GLU 68 -8.848 17.495 -13.106 526 HG3 GLU 68 1HG GLU 68 -9.912 16.371 -12.251 527 H ARG 69 H ARG 69 -7.511 17.541 -8.598 528 HA ARG 69 HA ARG 69 -4.915 16.937 -7.525 529 HE ARG 69 HE ARG 69 -0.708 17.638 -9.042 530 HB2 ARG 69 2HB ARG 69 -4.667 19.350 -8.884 531 HB3 ARG 69 1HB ARG 69 -5.068 19.979 -7.333 532 HG2 ARG 69 2HG ARG 69 -3.000 19.433 -6.416 533 HG3 ARG 69 1HG ARG 69 -3.005 17.813 -7.028 534 HD2 ARG 69 2HD ARG 69 -2.529 19.130 -9.415 535 HD3 ARG 69 1HD ARG 69 -1.841 20.311 -8.335 536 HH11 ARG 69 2HH1 ARG 69 -0.698 19.828 -6.336 537 HH12 ARG 69 1HH1 ARG 69 0.955 19.255 -5.846 538 HH21 ARG 69 1HH2 ARG 69 1.093 16.987 -8.389 539 HH22 ARG 69 2HH2 ARG 69 1.941 17.784 -7.008 540 H SER 70 H SER 70 -7.785 18.961 -6.796 541 HA SER 70 HA SER 70 -7.413 18.527 -3.836 542 HG SER 70 HG SER 70 -10.509 20.694 -5.328 543 HB2 SER 70 2HB SER 70 -9.375 20.011 -3.604 544 HB3 SER 70 1HB SER 70 -8.139 20.760 -4.605 545 H PHE 71 H PHE 71 -8.760 17.343 -2.528 546 HA PHE 71 HA PHE 71 -10.762 15.409 -3.835 547 HD1 PHE 71 HD1 PHE 71 -10.121 13.414 -5.170 548 HD2 PHE 71 HD2 PHE 71 -6.357 14.221 -3.258 549 HE1 PHE 71 HE1 PHE 71 -8.939 12.218 -6.971 550 HE2 PHE 71 HE2 PHE 71 -5.194 13.014 -5.047 551 HZ PHE 71 HZ PHE 71 -6.469 11.999 -6.901 552 HB2 PHE 71 2HB PHE 71 -8.356 14.694 -2.054 553 HB3 PHE 71 1HB PHE 71 -9.649 13.616 -2.478 554 H SER 72 H SER 72 -9.647 15.699 -0.403 555 HA SER 72 HA SER 72 -12.377 16.401 0.481 556 HG SER 72 HG SER 72 -14.000 15.123 0.851 557 HB2 SER 72 2HB SER 72 -11.701 13.476 0.492 558 HB3 SER 72 1HB SER 72 -12.284 14.050 2.032 559 H VAL 73 H VAL 73 -9.444 14.948 1.978 560 HA VAL 73 HA VAL 73 -9.744 16.884 4.316 561 HB VAL 73 HB VAL 73 -9.283 14.514 4.840 562 HG11 VAL 73 1HG1 VAL 73 -6.531 14.868 3.516 563 HG12 VAL 73 2HG1 VAL 73 -7.828 13.730 3.041 564 HG13 VAL 73 3HG1 VAL 73 -6.991 13.512 4.569 565 HG21 VAL 73 3HG2 VAL 73 -7.351 14.839 6.462 566 HG22 VAL 73 1HG2 VAL 73 -8.641 16.044 6.589 567 HG23 VAL 73 2HG2 VAL 73 -7.082 16.450 5.814 568 H ASP 74 H ASP 74 -7.793 18.125 4.928 569 HA ASP 74 HA ASP 74 -6.590 19.658 2.687 570 HB2 ASP 74 2HB ASP 74 -7.204 20.290 5.374 571 HB3 ASP 74 1HB ASP 74 -5.480 20.056 5.466 572 H THR 75 H THR 75 -5.167 17.317 5.108 573 HA THR 75 HA THR 75 -2.613 17.013 3.624 574 HB THR 75 HB THR 75 -2.280 14.977 4.990 575 HG1 THR 75 HG1 THR 75 -3.804 14.417 6.520 576 HG21 THR 75 3HG2 THR 75 -2.095 15.853 7.209 577 HG22 THR 75 1HG2 THR 75 -3.290 17.128 6.916 578 HG23 THR 75 2HG2 THR 75 -1.704 17.181 6.098 579 H ALA 76 H ALA 76 -4.432 16.886 1.599 580 HA ALA 76 HA ALA 76 -3.951 14.105 0.478 581 HB1 ALA 76 3HB ALA 76 -6.176 13.886 1.456 582 HB2 ALA 76 1HB ALA 76 -6.330 13.845 -0.303 583 HB3 ALA 76 2HB ALA 76 -6.785 15.318 0.590 584 H HIS 77 H HIS 77 -3.619 13.979 -1.570 585 HA HIS 77 HA HIS 77 -3.336 16.487 -3.297 586 HD1 HIS 77 HD1 HIS 77 -0.873 15.793 0.617 587 HD2 HIS 77 HD2 HIS 77 -1.932 18.882 -2.139 588 HE1 HIS 77 HE1 HIS 77 -0.778 18.082 1.777 589 HB2 HIS 77 2HB HIS 77 -1.028 15.013 -1.835 590 HB3 HIS 77 1HB HIS 77 -0.798 16.295 -3.041 591 H ARG 78 H ARG 78 -2.074 15.950 -5.319 592 HA ARG 78 HA ARG 78 -2.439 13.006 -6.137 593 HE ARG 78 HE ARG 78 -4.222 14.259 -10.905 594 HB2 ARG 78 2HB ARG 78 -4.304 14.716 -6.757 595 HB3 ARG 78 1HB ARG 78 -3.224 15.312 -7.990 596 HG2 ARG 78 2HG ARG 78 -4.128 12.362 -7.681 597 HG3 ARG 78 1HG ARG 78 -5.042 13.536 -8.605 598 HD2 ARG 78 2HD ARG 78 -2.152 12.670 -9.216 599 HD3 ARG 78 1HD ARG 78 -3.578 11.969 -9.961 600 HH11 ARG 78 2HH1 ARG 78 -0.892 13.605 -10.275 601 HH12 ARG 78 1HH1 ARG 78 -0.330 14.923 -11.383 602 HH21 ARG 78 1HH2 ARG 78 -3.661 15.689 -12.009 603 HH22 ARG 78 2HH2 ARG 78 -1.896 16.102 -12.387 604 H ALA 79 H ALA 79 -0.602 12.119 -6.555 605 HA ALA 79 HA ALA 79 1.734 13.416 -7.926 606 HB1 ALA 79 3HB ALA 79 2.073 11.664 -6.198 607 HB2 ALA 79 1HB ALA 79 2.617 11.002 -7.754 608 HB3 ALA 79 2HB ALA 79 1.050 10.497 -7.106 609 H ALA 80 H ALA 80 2.551 12.801 -9.972 610 HA ALA 80 HA ALA 80 0.607 11.510 -11.981 611 HB1 ALA 80 3HB ALA 80 0.775 13.666 -12.786 612 HB2 ALA 80 1HB ALA 80 2.045 12.822 -13.748 613 HB3 ALA 80 2HB ALA 80 2.474 13.881 -12.362 614 H SER 81 H SER 81 4.085 11.473 -11.083 615 HA SER 81 HA SER 81 4.249 8.603 -12.162 616 HG SER 81 HG SER 81 7.753 9.698 -12.357 617 HB2 SER 81 2HB SER 81 5.476 10.344 -13.443 618 HB3 SER 81 1HB SER 81 6.225 10.995 -11.981 619 H VAL 82 H VAL 82 6.578 7.847 -11.044 620 HA VAL 82 HA VAL 82 6.130 7.572 -8.041 621 HB VAL 82 HB VAL 82 8.333 6.246 -9.716 622 HG11 VAL 82 1HG1 VAL 82 9.418 6.516 -7.611 623 HG12 VAL 82 2HG1 VAL 82 8.655 4.949 -7.431 624 HG13 VAL 82 3HG1 VAL 82 7.926 6.374 -6.677 625 HG21 VAL 82 3HG2 VAL 82 6.419 4.960 -10.186 626 HG22 VAL 82 1HG2 VAL 82 5.648 5.247 -8.606 627 HG23 VAL 82 2HG2 VAL 82 6.988 4.113 -8.737 628 H GLU 83 H GLU 83 9.042 8.722 -9.939 629 HA GLU 83 HA GLU 83 10.097 10.480 -8.193 630 HB2 GLU 83 2HB GLU 83 9.641 11.327 -11.080 631 HB3 GLU 83 1HB GLU 83 10.915 11.828 -10.017 632 HG2 GLU 83 2HG GLU 83 10.821 8.818 -10.625 633 HG3 GLU 83 1HG GLU 83 11.248 9.877 -11.933 634 H GLU 84 H GLU 84 7.152 11.811 -10.013 635 HA GLU 84 HA GLU 84 6.789 14.044 -8.145 636 HB2 GLU 84 2HB GLU 84 4.811 12.514 -9.926 637 HB3 GLU 84 1HB GLU 84 4.297 13.877 -8.984 638 HG2 GLU 84 2HG GLU 84 4.837 15.288 -10.575 639 HG3 GLU 84 1HG GLU 84 6.533 14.958 -10.393 640 H ALA 85 H ALA 85 6.100 10.809 -7.448 641 HA ALA 85 HA ALA 85 4.201 11.408 -5.151 642 HB1 ALA 85 3HB ALA 85 5.370 8.674 -5.918 643 HB2 ALA 85 1HB ALA 85 3.815 9.273 -6.550 644 HB3 ALA 85 2HB ALA 85 4.032 8.999 -4.808 645 H VAL 86 H VAL 86 7.599 10.530 -5.736 646 HA VAL 86 HA VAL 86 8.323 10.585 -2.798 647 HB VAL 86 HB VAL 86 9.901 10.146 -5.383 648 HG11 VAL 86 1HG1 VAL 86 11.156 10.482 -2.587 649 HG12 VAL 86 2HG1 VAL 86 11.448 11.505 -4.021 650 HG13 VAL 86 3HG1 VAL 86 11.980 9.821 -4.029 651 HG21 VAL 86 3HG2 VAL 86 8.686 8.131 -4.354 652 HG22 VAL 86 1HG2 VAL 86 9.554 8.408 -2.830 653 HG23 VAL 86 2HG2 VAL 86 10.441 7.926 -4.287 654 H ASP 87 H ASP 87 8.972 12.896 -5.566 655 HA ASP 87 HA ASP 87 9.880 15.050 -3.933 656 HB2 ASP 87 2HB ASP 87 8.740 14.812 -6.731 657 HB3 ASP 87 1HB ASP 87 8.486 16.373 -6.013 658 H ILE 88 H ILE 88 6.405 14.270 -4.455 659 HA ILE 88 HA ILE 88 5.727 16.678 -2.777 660 HB ILE 88 HB ILE 88 3.607 16.589 -2.761 661 HG12 ILE 88 2HG1 ILE 88 3.051 13.966 -4.240 662 HG13 ILE 88 1HG1 ILE 88 3.329 13.944 -2.528 663 HG21 ILE 88 1HG2 ILE 88 4.607 17.251 -5.050 664 HG22 ILE 88 2HG2 ILE 88 2.856 16.900 -5.034 665 HG23 ILE 88 3HG2 ILE 88 4.021 15.697 -5.666 666 HD11 ILE 88 3HD1 ILE 88 1.504 16.106 -2.635 667 HD12 ILE 88 1HD1 ILE 88 1.143 14.465 -2.204 668 HD13 ILE 88 2HD1 ILE 88 0.893 14.982 -3.883 669 H ALA 89 H ALA 89 6.108 13.252 -2.043 670 HA ALA 89 HA ALA 89 5.171 13.490 0.782 671 HB1 ALA 89 3HB ALA 89 6.540 11.369 1.093 672 HB2 ALA 89 1HB ALA 89 7.028 11.461 -0.613 673 HB3 ALA 89 2HB ALA 89 5.316 11.252 -0.178 674 H ALA 90 H ALA 90 8.520 13.626 -0.579 675 HA ALA 90 HA ALA 90 9.738 14.582 1.933 676 HB1 ALA 90 3HB ALA 90 11.003 13.383 0.242 677 HB2 ALA 90 1HB ALA 90 11.717 15.006 0.346 678 HB3 ALA 90 2HB ALA 90 10.652 14.593 -1.015 679 H SER 91 H SER 91 8.128 16.448 -0.555 680 HA SER 91 HA SER 91 9.050 19.125 0.481 681 HG SER 91 HG SER 91 7.088 20.519 -0.302 682 HB2 SER 91 2HB SER 91 8.465 18.704 -1.931 683 HB3 SER 91 1HB SER 91 6.805 18.311 -1.457 684 H LEU 92 H LEU 92 6.770 17.011 1.855 685 HA LEU 92 HA LEU 92 5.103 19.314 2.950 686 HG LEU 92 HG LEU 92 4.715 15.914 1.678 687 HB2 LEU 92 2HB LEU 92 3.395 17.681 3.801 688 HB3 LEU 92 1HB LEU 92 3.444 18.223 2.158 689 HD11 LEU 92 1HD1 LEU 92 3.166 15.225 4.249 690 HD12 LEU 92 2HD1 LEU 92 4.931 15.119 3.984 691 HD13 LEU 92 3HD1 LEU 92 3.852 14.070 3.071 692 HD21 LEU 92 3HD2 LEU 92 2.502 16.574 0.666 693 HD22 LEU 92 1HD2 LEU 92 1.663 16.081 2.148 694 HD23 LEU 92 2HD2 LEU 92 2.512 14.876 1.147 695 H ASP 93 H ASP 93 6.305 16.289 4.463 696 HA ASP 93 HA ASP 93 8.474 17.547 5.715 697 HB2 ASP 93 2HB ASP 93 6.055 17.956 7.487 698 HB3 ASP 93 1HB ASP 93 7.377 17.204 8.315 699 H ALA 94 H ALA 94 9.297 15.472 4.907 700 HA ALA 94 HA ALA 94 9.093 13.145 6.739 701 HB1 ALA 94 3HB ALA 94 7.826 11.607 5.180 702 HB2 ALA 94 1HB ALA 94 7.602 12.951 4.032 703 HB3 ALA 94 2HB ALA 94 6.837 12.997 5.638 704 H GLU 95 H GLU 95 10.170 11.220 6.058 705 HA GLU 95 HA GLU 95 12.374 11.605 3.968 706 HB2 GLU 95 2HB GLU 95 12.996 9.827 6.337 707 HB3 GLU 95 1HB GLU 95 14.064 10.667 5.233 708 HG2 GLU 95 2HG GLU 95 13.395 12.885 6.469 709 HG3 GLU 95 1HG GLU 95 12.518 11.867 7.607 710 H THR 96 H THR 96 11.151 8.745 5.825 711 HA THR 96 HA THR 96 10.863 7.048 3.400 712 HB THR 96 HB THR 96 9.375 5.616 5.145 713 HG1 THR 96 HG1 THR 96 9.168 7.196 6.764 714 HG21 THR 96 3HG2 THR 96 11.688 4.910 4.415 715 HG22 THR 96 1HG2 THR 96 11.308 4.550 6.107 716 HG23 THR 96 2HG2 THR 96 12.368 5.921 5.713 717 H ALA 97 H ALA 97 8.793 6.017 2.877 718 HA ALA 97 HA ALA 97 6.269 7.178 3.825 719 HB1 ALA 97 3HB ALA 97 5.300 7.833 1.509 720 HB2 ALA 97 1HB ALA 97 6.943 7.657 0.826 721 HB3 ALA 97 2HB ALA 97 6.618 8.863 2.092 722 H TYR 98 H TYR 98 4.286 6.089 2.750 723 HA TYR 98 HA TYR 98 4.885 3.146 2.126 724 HD1 TYR 98 HD1 TYR 98 4.950 0.994 4.211 725 HD2 TYR 98 HD2 TYR 98 4.648 4.958 5.769 726 HE1 TYR 98 HE1 TYR 98 6.777 0.509 5.808 727 HE2 TYR 98 HE2 TYR 98 6.419 4.447 7.410 728 HH TYR 98 HH TYR 98 8.050 3.023 7.945 729 HB2 TYR 98 2HB TYR 98 2.910 4.132 4.273 730 HB3 TYR 98 1HB TYR 98 2.965 2.478 3.695 731 H VAL 99 H VAL 99 2.794 1.933 1.509 732 HA VAL 99 HA VAL 99 0.950 3.616 -0.258 733 HB VAL 99 HB VAL 99 1.872 3.192 -2.152 734 HG11 VAL 99 1HG1 VAL 99 4.087 1.411 -1.117 735 HG12 VAL 99 2HG1 VAL 99 4.102 3.153 -1.191 736 HG13 VAL 99 3HG1 VAL 99 3.990 2.227 -2.693 737 HG21 VAL 99 3HG2 VAL 99 2.007 1.076 -3.415 738 HG22 VAL 99 1HG2 VAL 99 0.443 1.349 -2.608 739 HG23 VAL 99 2HG2 VAL 99 1.605 0.205 -1.916 740 H ILE 100 H ILE 100 -1.093 3.008 0.746 741 HA ILE 100 HA ILE 100 -1.674 0.227 1.243 742 HB ILE 100 HB ILE 100 -3.993 2.049 0.449 743 HG12 ILE 100 2HG1 ILE 100 -3.093 3.275 2.208 744 HG13 ILE 100 1HG1 ILE 100 -4.323 2.305 2.960 745 HG21 ILE 100 1HG2 ILE 100 -3.926 -0.461 2.235 746 HG22 ILE 100 2HG2 ILE 100 -4.609 -0.400 0.601 747 HG23 ILE 100 3HG2 ILE 100 -5.360 0.521 1.904 748 HD11 ILE 100 3HD1 ILE 100 -2.141 2.555 4.297 749 HD12 ILE 100 1HD1 ILE 100 -1.352 1.492 3.122 750 HD13 ILE 100 2HD1 ILE 100 -2.718 0.852 4.066 751 H GLY 101 H GLY 101 -2.425 1.762 -1.670 752 HA2 GLY 101 2HA GLY 101 -2.374 0.963 -3.878 753 HA3 GLY 101 1HA GLY 101 -1.400 -0.307 -3.309 754 H GLY 102 H GLY 102 -2.412 -2.209 -4.775 755 HA2 GLY 102 2HA GLY 102 -4.540 -0.215 -5.837 756 HA3 GLY 102 1HA GLY 102 -2.904 -0.226 -6.371 757 H ALA 103 H ALA 103 -5.961 -1.540 -7.095 758 HA ALA 103 HA ALA 103 -5.655 -2.918 -9.442 759 HB1 ALA 103 3HB ALA 103 -7.439 -1.353 -10.360 760 HB2 ALA 103 1HB ALA 103 -6.894 -0.021 -9.373 761 HB3 ALA 103 2HB ALA 103 -7.660 -1.399 -8.618 762 H ALA 104 H ALA 104 -4.407 0.402 -9.389 763 HA ALA 104 HA ALA 104 -2.528 -0.301 -11.714 764 HB1 ALA 104 3HB ALA 104 -2.211 2.101 -12.138 765 HB2 ALA 104 1HB ALA 104 -3.357 2.521 -10.841 766 HB3 ALA 104 2HB ALA 104 -3.931 1.647 -12.297 767 H ILE 105 H ILE 105 -2.617 0.603 -8.291 768 HA ILE 105 HA ILE 105 0.013 1.905 -8.310 769 HB ILE 105 HB ILE 105 -1.173 1.033 -5.705 770 HG12 ILE 105 2HG1 ILE 105 -3.147 2.062 -6.572 771 HG13 ILE 105 1HG1 ILE 105 -2.367 3.142 -5.497 772 HG21 ILE 105 1HG2 ILE 105 0.401 3.574 -6.337 773 HG22 ILE 105 2HG2 ILE 105 1.117 2.094 -5.671 774 HG23 ILE 105 3HG2 ILE 105 -0.120 2.959 -4.766 775 HD11 ILE 105 3HD1 ILE 105 -2.386 4.763 -7.214 776 HD12 ILE 105 1HD1 ILE 105 -3.210 3.546 -8.234 777 HD13 ILE 105 2HD1 ILE 105 -1.436 3.714 -8.297 778 H TYR 106 H TYR 106 -0.584 -1.012 -6.203 779 HA TYR 106 HA TYR 106 2.175 -1.887 -6.054 780 HD1 TYR 106 HD1 TYR 106 2.634 -4.768 -4.565 781 HD2 TYR 106 HD2 TYR 106 -0.637 -2.214 -3.455 782 HE1 TYR 106 HE1 TYR 106 3.055 -5.246 -2.200 783 HE2 TYR 106 HE2 TYR 106 -0.184 -2.699 -1.081 784 HH TYR 106 HH TYR 106 2.446 -4.329 0.107 785 HB2 TYR 106 2HB TYR 106 -0.544 -3.231 -5.715 786 HB3 TYR 106 1HB TYR 106 0.758 -4.304 -6.087 787 H ALA 107 H ALA 107 0.079 -2.303 -8.850 788 HA ALA 107 HA ALA 107 1.945 -4.148 -10.318 789 HB1 ALA 107 3HB ALA 107 -0.539 -2.551 -11.201 790 HB2 ALA 107 1HB ALA 107 -0.508 -4.261 -10.732 791 HB3 ALA 107 2HB ALA 107 0.304 -3.743 -12.213 792 H LEU 108 H LEU 108 1.359 -0.582 -10.414 793 HA LEU 108 HA LEU 108 3.698 -0.262 -12.300 794 HG LEU 108 HG LEU 108 2.437 2.191 -9.776 795 HB2 LEU 108 2HB LEU 108 3.120 1.839 -12.709 796 HB3 LEU 108 1HB LEU 108 1.560 1.259 -12.254 797 HD11 LEU 108 1HD1 LEU 108 3.622 4.259 -11.751 798 HD12 LEU 108 2HD1 LEU 108 4.633 3.023 -10.990 799 HD13 LEU 108 3HD1 LEU 108 3.785 4.200 -9.990 800 HD21 LEU 108 3HD2 LEU 108 1.057 3.849 -11.955 801 HD22 LEU 108 1HD2 LEU 108 1.200 4.318 -10.252 802 HD23 LEU 108 2HD2 LEU 108 0.276 2.871 -10.665 803 H PHE 109 H PHE 109 3.211 0.279 -8.805 804 HA PHE 109 HA PHE 109 5.896 1.354 -8.399 805 HD1 PHE 109 HD2 PHE 109 6.953 2.138 -5.882 806 HD2 PHE 109 HD1 PHE 109 2.884 3.125 -6.771 807 HE1 PHE 109 HE2 PHE 109 7.417 4.459 -5.355 808 HE2 PHE 109 HE1 PHE 109 3.376 5.494 -6.246 809 HZ PHE 109 HZ PHE 109 5.653 6.158 -5.543 810 HB2 PHE 109 2HB PHE 109 3.496 0.790 -6.649 811 HB3 PHE 109 1HB PHE 109 4.935 0.373 -5.813 812 H GLN 110 H GLN 110 4.955 -1.971 -8.347 813 HA GLN 110 HA GLN 110 6.758 -3.274 -6.689 814 HB2 GLN 110 2HB GLN 110 6.738 -5.195 -8.333 815 HB3 GLN 110 1HB GLN 110 5.283 -4.634 -7.604 816 HG2 GLN 110 2HG GLN 110 4.231 -4.610 -9.549 817 HG3 GLN 110 1HG GLN 110 5.147 -3.261 -10.061 818 HE21 GLN 110 1HE2 GLN 110 4.742 -6.702 -10.325 819 HE22 GLN 110 2HE2 GLN 110 5.762 -6.834 -11.853 820 HA PRO 111 HA PRO 111 10.978 -3.059 -8.888 821 HB2 PRO 111 2HB PRO 111 11.052 -1.229 -11.179 822 HB3 PRO 111 1HB PRO 111 11.253 -2.988 -11.154 823 HG2 PRO 111 2HG PRO 111 9.034 -1.659 -12.327 824 HG3 PRO 111 1HG PRO 111 9.090 -3.379 -11.857 825 HD2 PRO 111 2HD PRO 111 7.917 -1.032 -10.261 826 HD3 PRO 111 1HD PRO 111 7.242 -2.641 -10.523 827 H HIS 112 H HIS 112 9.149 -0.456 -7.927 828 HA HIS 112 HA HIS 112 11.562 1.426 -7.539 829 HD1 HIS 112 HD1 HIS 112 11.679 3.254 -9.815 830 HD2 HIS 112 HD2 HIS 112 7.614 1.965 -10.058 831 HE1 HIS 112 HE1 HIS 112 10.831 3.394 -12.271 832 HB2 HIS 112 2HB HIS 112 8.612 2.277 -7.600 833 HB3 HIS 112 1HB HIS 112 10.041 3.292 -7.526 834 H LEU 113 H LEU 113 9.423 -0.539 -5.634 835 HA LEU 113 HA LEU 113 9.431 1.174 -3.211 836 HG LEU 113 HG LEU 113 6.863 -1.237 -2.148 837 HB2 LEU 113 2HB LEU 113 9.165 -1.915 -3.357 838 HB3 LEU 113 1HB LEU 113 8.978 -0.961 -1.903 839 HD11 LEU 113 1HD1 LEU 113 5.624 0.631 -3.411 840 HD12 LEU 113 2HD1 LEU 113 7.211 1.127 -4.036 841 HD13 LEU 113 3HD1 LEU 113 6.894 1.173 -2.297 842 HD21 LEU 113 3HD2 LEU 113 7.019 -2.812 -3.974 843 HD22 LEU 113 1HD2 LEU 113 7.120 -1.511 -5.180 844 HD23 LEU 113 2HD2 LEU 113 5.618 -1.752 -4.223 845 H ASP 114 H ASP 114 10.665 1.140 -1.337 846 HA ASP 114 HA ASP 114 13.212 -0.379 -0.979 847 HB2 ASP 114 2HB ASP 114 12.719 1.700 0.265 848 HB3 ASP 114 1HB ASP 114 11.287 1.015 0.994 849 H ARG 115 H ARG 115 10.000 -0.909 0.576 850 HA ARG 115 HA ARG 115 10.402 -3.935 0.241 851 HE ARG 115 HE ARG 115 13.336 -4.794 4.115 852 HB2 ARG 115 2HB ARG 115 9.709 -2.355 2.773 853 HB3 ARG 115 1HB ARG 115 9.247 -4.046 2.654 854 HG2 ARG 115 2HG ARG 115 11.495 -4.822 2.571 855 HG3 ARG 115 1HG ARG 115 12.152 -3.224 2.146 856 HD2 ARG 115 2HD ARG 115 11.584 -2.315 4.336 857 HD3 ARG 115 1HD ARG 115 10.820 -3.849 4.869 858 HH11 ARG 115 2HH1 ARG 115 12.390 -2.341 6.279 859 HH12 ARG 115 1HH1 ARG 115 13.961 -2.400 7.195 860 HH21 ARG 115 1HH2 ARG 115 14.965 -4.982 5.164 861 HH22 ARG 115 2HH2 ARG 115 15.480 -3.805 6.453 862 H MET 116 H MET 116 8.626 -5.316 0.447 863 HA MET 116 HA MET 116 5.890 -4.206 -0.462 864 HB2 MET 116 2HB MET 116 7.621 -6.470 -1.468 865 HB3 MET 116 1HB MET 116 5.938 -6.923 -1.212 866 HG2 MET 116 2HG MET 116 5.242 -5.045 -2.763 867 HG3 MET 116 1HG MET 116 6.967 -4.739 -3.079 868 HE1 MET 116 3HE MET 116 4.010 -6.630 -4.592 869 HE2 MET 116 1HE MET 116 5.073 -6.990 -5.991 870 HE3 MET 116 2HE MET 116 5.047 -5.344 -5.296 871 H VAL 117 H VAL 117 5.153 -3.959 1.714 872 HA VAL 117 HA VAL 117 4.996 -6.364 3.539 873 HB VAL 117 HB VAL 117 4.176 -3.497 4.069 874 HG11 VAL 117 1HG1 VAL 117 3.988 -6.009 5.714 875 HG12 VAL 117 2HG1 VAL 117 3.046 -4.510 5.848 876 HG13 VAL 117 3HG1 VAL 117 4.654 -4.654 6.602 877 HG21 VAL 117 3HG2 VAL 117 6.282 -3.304 5.450 878 HG22 VAL 117 1HG2 VAL 117 6.658 -3.666 3.743 879 HG23 VAL 117 2HG2 VAL 117 6.755 -4.934 4.957 880 H LEU 118 H LEU 118 3.651 -7.433 2.004 881 HA LEU 118 HA LEU 118 0.722 -6.944 1.807 882 HG LEU 118 HG LEU 118 -0.367 -9.283 0.981 883 HB2 LEU 118 2HB LEU 118 1.964 -8.165 0.135 884 HB3 LEU 118 1HB LEU 118 2.667 -9.274 1.273 885 HD11 LEU 118 1HD1 LEU 118 0.153 -11.181 -0.839 886 HD12 LEU 118 2HD1 LEU 118 1.671 -10.275 -1.105 887 HD13 LEU 118 3HD1 LEU 118 0.066 -9.497 -1.307 888 HD21 LEU 118 3HD2 LEU 118 0.630 -10.771 2.724 889 HD22 LEU 118 1HD2 LEU 118 1.727 -11.496 1.540 890 HD23 LEU 118 2HD2 LEU 118 -0.044 -11.729 1.409 891 H SER 119 H SER 119 -0.906 -7.614 3.048 892 HA SER 119 HA SER 119 -0.442 -9.516 5.449 893 HG SER 119 HG SER 119 -1.529 -6.569 6.885 894 HB2 SER 119 2HB SER 119 -2.381 -7.195 4.943 895 HB3 SER 119 1HB SER 119 -2.752 -8.422 6.152 896 H ARG 120 H ARG 120 -0.964 -11.571 5.020 897 HA ARG 120 HA ARG 120 -2.902 -12.279 2.794 898 HE ARG 120 HE ARG 120 0.825 -14.666 1.403 899 HB2 ARG 120 2HB ARG 120 -1.948 -14.752 3.719 900 HB3 ARG 120 1HB ARG 120 -1.537 -13.903 2.257 901 HG2 ARG 120 2HG ARG 120 0.545 -12.938 3.398 902 HG3 ARG 120 1HG ARG 120 0.032 -13.669 4.891 903 HD2 ARG 120 2HD ARG 120 1.819 -14.959 4.009 904 HD3 ARG 120 1HD ARG 120 0.358 -15.932 4.093 905 HH11 ARG 120 2HH1 ARG 120 1.923 -17.262 3.365 906 HH12 ARG 120 1HH1 ARG 120 2.191 -18.378 1.957 907 HH21 ARG 120 1HH2 ARG 120 1.085 -15.945 -0.224 908 HH22 ARG 120 2HH2 ARG 120 1.698 -17.644 -0.007 909 H VAL 121 H VAL 121 -4.985 -12.421 3.317 910 HA VAL 121 HA VAL 121 -5.833 -13.033 6.145 911 HB VAL 121 HB VAL 121 -7.426 -11.662 3.951 912 HG11 VAL 121 1HG1 VAL 121 -7.746 -11.519 7.015 913 HG12 VAL 121 2HG1 VAL 121 -8.842 -12.392 5.912 914 HG13 VAL 121 3HG1 VAL 121 -8.713 -10.633 5.849 915 HG21 VAL 121 3HG2 VAL 121 -6.629 -9.567 5.714 916 HG22 VAL 121 1HG2 VAL 121 -6.045 -9.889 4.100 917 HG23 VAL 121 2HG2 VAL 121 -5.136 -10.494 5.472 918 HA PRO 122 HA PRO 122 -7.868 -16.886 4.416 919 HB2 PRO 122 2HB PRO 122 -8.381 -17.421 7.374 920 HB3 PRO 122 1HB PRO 122 -7.695 -18.479 6.124 921 HG2 PRO 122 2HG PRO 122 -6.052 -17.348 7.992 922 HG3 PRO 122 1HG PRO 122 -5.522 -17.392 6.285 923 HD2 PRO 122 2HD PRO 122 -6.804 -15.015 7.741 924 HD3 PRO 122 1HD PRO 122 -5.325 -15.097 6.721 925 H GLY 123 H GLY 123 -9.503 -14.600 4.346 926 HA2 GLY 123 2HA GLY 123 -12.277 -15.712 5.183 927 HA3 GLY 123 1HA GLY 123 -12.038 -14.049 4.790 928 H GLU 124 H GLU 124 -10.451 -15.817 2.540 929 HA GLU 124 HA GLU 124 -10.798 -16.337 0.232 930 HB2 GLU 124 2HB GLU 124 -12.730 -18.055 1.818 931 HB3 GLU 124 1HB GLU 124 -12.261 -18.388 0.168 932 HG2 GLU 124 2HG GLU 124 -9.865 -18.644 0.821 933 HG3 GLU 124 1HG GLU 124 -10.237 -18.226 2.484 934 H TYR 125 H TYR 125 -11.359 -14.560 -0.954 935 HA TYR 125 HA TYR 125 -14.342 -14.135 -1.563 936 HD1 TYR 125 HD1 TYR 125 -15.691 -12.566 0.149 937 HD2 TYR 125 HD2 TYR 125 -11.551 -11.863 1.020 938 HE1 TYR 125 HE1 TYR 125 -16.203 -12.484 2.556 939 HE2 TYR 125 HE2 TYR 125 -12.072 -11.805 3.419 940 HH TYR 125 HH TYR 125 -13.616 -12.144 4.934 941 HB2 TYR 125 2HB TYR 125 -12.191 -11.943 -1.266 942 HB3 TYR 125 1HB TYR 125 -13.848 -11.659 -1.673 943 H GLU 126 H GLU 126 -14.856 -14.262 -3.698 944 HA GLU 126 HA GLU 126 -13.196 -14.261 -5.938 945 HB2 GLU 126 2HB GLU 126 -15.997 -13.068 -6.111 946 HB3 GLU 126 1HB GLU 126 -15.127 -13.925 -7.347 947 HG2 GLU 126 2HG GLU 126 -15.619 -16.101 -6.401 948 HG3 GLU 126 1HG GLU 126 -15.977 -15.462 -4.802 949 H GLY 127 H GLY 127 -14.930 -11.267 -5.044 950 HA2 GLY 127 2HA GLY 127 -13.985 -9.047 -4.792 951 HA3 GLY 127 1HA GLY 127 -12.447 -9.675 -5.312 952 H ASP 128 H ASP 128 -13.578 -7.164 -5.774 953 HA ASP 128 HA ASP 128 -13.577 -6.962 -8.810 954 HB2 ASP 128 2HB ASP 128 -14.296 -4.929 -6.583 955 HB3 ASP 128 1HB ASP 128 -14.377 -4.610 -8.300 956 H THR 129 H THR 129 -11.505 -6.146 -6.120 957 HA THR 129 HA THR 129 -9.568 -4.622 -7.943 958 HB THR 129 HB THR 129 -9.120 -4.821 -4.938 959 HG1 THR 129 HG1 THR 129 -11.226 -4.081 -5.215 960 HG21 THR 129 3HG2 THR 129 -7.980 -2.674 -5.203 961 HG22 THR 129 1HG2 THR 129 -8.615 -2.465 -6.851 962 HG23 THR 129 2HG2 THR 129 -7.381 -3.707 -6.528 963 H TYR 130 H TYR 130 -7.888 -5.835 -8.644 964 HA TYR 130 HA TYR 130 -6.993 -8.317 -7.109 965 HD1 TYR 130 HD1 TYR 130 -9.633 -7.464 -9.727 966 HD2 TYR 130 HD2 TYR 130 -7.377 -11.020 -8.833 967 HE1 TYR 130 HE1 TYR 130 -11.690 -8.815 -9.808 968 HE2 TYR 130 HE2 TYR 130 -9.436 -12.358 -9.038 969 HH TYR 130 HH TYR 130 -12.170 -11.482 -8.552 970 HB2 TYR 130 2HB TYR 130 -6.987 -7.612 -10.095 971 HB3 TYR 130 1HB TYR 130 -6.168 -9.003 -9.435 972 H TYR 131 H TYR 131 -5.076 -8.628 -6.371 973 HA TYR 131 HA TYR 131 -2.925 -6.567 -6.492 974 HD1 TYR 131 HD2 TYR 131 -0.655 -9.722 -5.274 975 HD2 TYR 131 HD1 TYR 131 -2.192 -6.350 -3.133 976 HE1 TYR 131 HE2 TYR 131 1.502 -9.435 -4.249 977 HE2 TYR 131 HE1 TYR 131 -0.053 -6.203 -1.915 978 HH TYR 131 HH TYR 131 2.671 -8.357 -2.789 979 HB2 TYR 131 2HB TYR 131 -3.739 -7.885 -4.427 980 HB3 TYR 131 1HB TYR 131 -3.101 -9.320 -5.117 981 HA PRO 132 HA PRO 132 -0.554 -8.877 -9.695 982 HB2 PRO 132 2HB PRO 132 2.018 -7.681 -9.227 983 HB3 PRO 132 1HB PRO 132 0.757 -7.173 -10.345 984 HG2 PRO 132 2HG PRO 132 1.569 -5.762 -7.960 985 HG3 PRO 132 1HG PRO 132 0.203 -5.388 -9.016 986 HD2 PRO 132 2HD PRO 132 0.120 -6.735 -6.359 987 HD3 PRO 132 1HD PRO 132 -1.121 -5.795 -7.242 988 H GLU 133 H GLU 133 1.603 -10.038 -10.098 989 HA GLU 133 HA GLU 133 1.832 -12.272 -8.160 990 HB2 GLU 133 2HB GLU 133 3.461 -13.222 -9.848 991 HB3 GLU 133 1HB GLU 133 1.812 -13.002 -10.363 992 HG2 GLU 133 2HG GLU 133 3.942 -10.895 -11.125 993 HG3 GLU 133 1HG GLU 133 3.766 -12.384 -12.046 994 H TRP 134 H TRP 134 3.787 -13.106 -7.367 995 HA TRP 134 HA TRP 134 5.805 -11.034 -6.421 996 HD1 TRP 134 HD1 TRP 134 5.349 -15.248 -5.098 997 HE1 TRP 134 HE1 TRP 134 3.135 -16.612 -4.627 998 HE3 TRP 134 HE3 TRP 134 2.538 -11.293 -3.595 999 HZ2 TRP 134 HZ2 TRP 134 0.555 -15.881 -3.689 1000 HZ3 TRP 134 HZ3 TRP 134 0.143 -11.645 -3.096 1001 HH2 TRP 134 HH2 TRP 134 -0.825 -13.921 -3.079 1002 HB2 TRP 134 2HB TRP 134 6.114 -12.395 -4.285 1003 HB3 TRP 134 1HB TRP 134 4.727 -11.372 -4.399 1004 H ASP 135 H ASP 135 7.883 -11.489 -6.923 1005 HA ASP 135 HA ASP 135 8.446 -14.181 -8.207 1006 HB2 ASP 135 2HB ASP 135 8.679 -11.469 -9.205 1007 HB3 ASP 135 1HB ASP 135 10.313 -11.889 -8.771 1008 H ALA 136 H ALA 136 11.025 -14.214 -8.334 1009 HA ALA 136 HA ALA 136 11.981 -14.539 -5.383 1010 HB1 ALA 136 3HB ALA 136 12.687 -16.379 -7.773 1011 HB2 ALA 136 1HB ALA 136 11.319 -16.673 -6.655 1012 HB3 ALA 136 2HB ALA 136 12.988 -16.677 -6.031 1013 H ALA 137 H ALA 137 13.114 -13.468 -8.476 1014 HA ALA 137 HA ALA 137 15.817 -12.708 -7.233 1015 HB1 ALA 137 3HB ALA 137 16.646 -12.275 -9.533 1016 HB2 ALA 137 1HB ALA 137 15.091 -12.779 -10.229 1017 HB3 ALA 137 2HB ALA 137 16.102 -13.960 -9.345 1018 H GLU 138 H GLU 138 12.893 -11.148 -8.640 1019 HA GLU 138 HA GLU 138 13.956 -8.431 -8.365 1020 HB2 GLU 138 2HB GLU 138 11.041 -9.357 -8.354 1021 HB3 GLU 138 1HB GLU 138 11.635 -7.730 -8.559 1022 HG2 GLU 138 2HG GLU 138 12.164 -9.970 -10.595 1023 HG3 GLU 138 1HG GLU 138 10.907 -8.767 -10.716 1024 H TRP 139 H TRP 139 11.912 -10.297 -6.035 1025 HA TRP 139 HA TRP 139 13.067 -8.662 -3.740 1026 HD1 TRP 139 HD1 TRP 139 8.707 -10.413 -4.084 1027 HE1 TRP 139 HE1 TRP 139 7.152 -9.969 -6.239 1028 HE3 TRP 139 HE3 TRP 139 11.032 -6.213 -5.674 1029 HZ2 TRP 139 HZ2 TRP 139 7.436 -8.260 -8.456 1030 HZ3 TRP 139 HZ3 TRP 139 10.414 -5.229 -7.866 1031 HH2 TRP 139 HH2 TRP 139 8.666 -6.262 -9.255 1032 HB2 TRP 139 2HB TRP 139 10.574 -8.739 -2.696 1033 HB3 TRP 139 1HB TRP 139 11.211 -7.416 -3.611 1034 H GLU 140 H GLU 140 13.515 -9.684 -1.932 1035 HA GLU 140 HA GLU 140 12.733 -12.620 -1.621 1036 HB2 GLU 140 2HB GLU 140 14.737 -13.103 -0.663 1037 HB3 GLU 140 1HB GLU 140 15.208 -11.917 -1.835 1038 HG2 GLU 140 2HG GLU 140 15.210 -10.173 0.186 1039 HG3 GLU 140 1HG GLU 140 15.029 -11.590 1.230 1040 H LEU 141 H LEU 141 13.029 -12.943 1.144 1041 HA LEU 141 HA LEU 141 10.461 -11.557 2.090 1042 HG LEU 141 HG LEU 141 9.123 -14.784 3.449 1043 HB2 LEU 141 2HB LEU 141 10.773 -14.241 1.707 1044 HB3 LEU 141 1HB LEU 141 11.417 -14.156 3.313 1045 HD11 LEU 141 1HD1 LEU 141 9.660 -13.012 5.190 1046 HD12 LEU 141 2HD1 LEU 141 7.940 -13.121 4.773 1047 HD13 LEU 141 3HD1 LEU 141 8.928 -11.786 4.144 1048 HD21 LEU 141 3HD2 LEU 141 7.238 -13.646 2.327 1049 HD22 LEU 141 1HD2 LEU 141 8.452 -14.083 1.121 1050 HD23 LEU 141 2HD2 LEU 141 8.320 -12.405 1.685 1051 H ASP 142 H ASP 142 10.914 -9.985 3.595 1052 HA ASP 142 HA ASP 142 13.487 -9.878 5.162 1053 HB2 ASP 142 2HB ASP 142 12.343 -7.891 3.898 1054 HB3 ASP 142 1HB ASP 142 11.186 -7.849 5.184 1055 H ALA 143 H ALA 143 9.920 -9.898 5.910 1056 HA ALA 143 HA ALA 143 10.507 -11.601 8.375 1057 HB1 ALA 143 3HB ALA 143 8.920 -8.941 8.515 1058 HB2 ALA 143 1HB ALA 143 10.595 -9.150 9.071 1059 HB3 ALA 143 2HB ALA 143 9.274 -10.027 9.883 1060 H GLU 144 H GLU 144 9.142 -13.289 8.479 1061 HA GLU 144 HA GLU 144 6.198 -12.895 7.736 1062 HB2 GLU 144 2HB GLU 144 7.730 -14.781 6.621 1063 HB3 GLU 144 1HB GLU 144 7.353 -15.700 8.076 1064 HG2 GLU 144 2HG GLU 144 4.852 -15.381 7.594 1065 HG3 GLU 144 1HG GLU 144 5.265 -14.316 6.276 1066 H THR 145 H THR 145 4.821 -12.590 9.326 1067 HA THR 145 HA THR 145 4.966 -14.354 11.764 1068 HB THR 145 HB THR 145 6.106 -12.333 12.564 1069 HG1 THR 145 HG1 THR 145 3.610 -12.979 13.761 1070 HG21 THR 145 3HG2 THR 145 4.600 -10.403 13.406 1071 HG22 THR 145 1HG2 THR 145 3.427 -10.854 12.138 1072 HG23 THR 145 2HG2 THR 145 5.078 -10.332 11.713 1073 H ASP 146 H ASP 146 3.090 -14.895 12.796 1074 HA ASP 146 HA ASP 146 0.519 -14.532 11.416 1075 HB2 ASP 146 2HB ASP 146 -0.329 -15.987 13.212 1076 HB3 ASP 146 1HB ASP 146 1.075 -16.645 12.410 1077 H HIS 147 H HIS 147 -1.334 -13.500 12.091 1078 HA HIS 147 HA HIS 147 -1.312 -11.531 14.387 1079 HD1 HIS 147 HD1 HIS 147 1.259 -10.785 13.457 1080 HD2 HIS 147 HD2 HIS 147 -1.468 -7.549 13.061 1081 HE1 HIS 147 HE1 HIS 147 2.351 -8.622 14.322 1082 HB2 HIS 147 2HB HIS 147 -1.019 -10.764 11.453 1083 HB3 HIS 147 1HB HIS 147 -2.333 -9.942 12.252 1084 H GLU 148 H GLU 148 -3.725 -10.285 14.123 1085 HA GLU 148 HA GLU 148 -5.317 -12.397 15.293 1086 HB2 GLU 148 2HB GLU 148 -6.171 -9.546 14.587 1087 HB3 GLU 148 1HB GLU 148 -7.193 -10.638 15.451 1088 HG2 GLU 148 2HG GLU 148 -5.578 -10.792 17.355 1089 HG3 GLU 148 1HG GLU 148 -4.436 -9.752 16.533 1090 H GLY 149 H GLY 149 -6.223 -10.717 12.249 1091 HA2 GLY 149 2HA GLY 149 -8.036 -13.132 11.500 1092 HA3 GLY 149 1HA GLY 149 -8.231 -11.544 10.825 1093 H PHE 150 H PHE 150 -4.893 -12.629 11.006 1094 HA PHE 150 HA PHE 150 -4.703 -13.477 8.150 1095 HD1 PHE 150 HD2 PHE 150 -5.587 -9.694 10.000 1096 HD2 PHE 150 HD1 PHE 150 -1.873 -10.270 7.933 1097 HE1 PHE 150 HE2 PHE 150 -4.642 -7.743 11.152 1098 HE2 PHE 150 HE1 PHE 150 -0.912 -8.336 9.137 1099 HZ PHE 150 HZ PHE 150 -2.303 -7.060 10.741 1100 HB2 PHE 150 2HB PHE 150 -3.892 -11.431 7.164 1101 HB3 PHE 150 1HB PHE 150 -5.426 -11.102 7.878 1102 H THR 151 H THR 151 -2.453 -13.452 7.297 1103 HA THR 151 HA THR 151 -0.294 -13.389 9.480 1104 HB THR 151 HB THR 151 0.032 -15.514 9.012 1105 HG1 THR 151 HG1 THR 151 1.919 -14.361 8.240 1106 HG21 THR 151 3HG2 THR 151 -1.701 -16.068 7.360 1107 HG22 THR 151 1HG2 THR 151 -0.152 -16.756 6.846 1108 HG23 THR 151 2HG2 THR 151 -0.778 -15.289 6.073 1109 H LEU 152 H LEU 152 1.230 -12.016 9.322 1110 HA LEU 152 HA LEU 152 1.272 -9.800 7.277 1111 HG LEU 152 HG LEU 152 3.255 -8.077 10.139 1112 HB2 LEU 152 2HB LEU 152 1.355 -9.295 9.661 1113 HB3 LEU 152 1HB LEU 152 2.630 -10.434 9.959 1114 HD11 LEU 152 1HD1 LEU 152 5.067 -9.246 7.997 1115 HD12 LEU 152 2HD1 LEU 152 4.883 -10.081 9.542 1116 HD13 LEU 152 3HD1 LEU 152 5.466 -8.403 9.508 1117 HD21 LEU 152 3HD2 LEU 152 2.129 -6.891 8.340 1118 HD22 LEU 152 1HD2 LEU 152 2.835 -7.914 7.084 1119 HD23 LEU 152 2HD2 LEU 152 3.863 -6.797 7.995 1120 H GLN 153 H GLN 153 2.664 -9.743 5.588 1121 HA GLN 153 HA GLN 153 5.296 -11.331 5.593 1122 HB2 GLN 153 2HB GLN 153 2.920 -11.632 3.816 1123 HB3 GLN 153 1HB GLN 153 4.206 -10.944 2.862 1124 HG2 GLN 153 2HG GLN 153 5.764 -12.788 3.700 1125 HG3 GLN 153 1HG GLN 153 4.408 -13.483 4.585 1126 HE21 GLN 153 1HE2 GLN 153 5.394 -15.215 3.160 1127 HE22 GLN 153 2HE2 GLN 153 4.724 -15.336 1.451 1128 H GLU 154 H GLU 154 6.804 -9.753 5.910 1129 HA GLU 154 HA GLU 154 6.724 -7.189 4.266 1130 HB2 GLU 154 2HB GLU 154 8.786 -7.789 6.413 1131 HB3 GLU 154 1HB GLU 154 8.417 -6.270 5.678 1132 HG2 GLU 154 2HG GLU 154 5.935 -6.823 6.786 1133 HG3 GLU 154 1HG GLU 154 6.923 -7.818 7.810 1134 H TRP 155 H TRP 155 7.542 -7.456 2.227 1135 HA TRP 155 HA TRP 155 9.898 -9.334 1.742 1136 HD1 TRP 155 HD1 TRP 155 5.825 -9.319 1.074 1137 HE1 TRP 155 HE1 TRP 155 4.670 -11.559 0.285 1138 HE3 TRP 155 HE3 TRP 155 9.808 -11.135 -1.574 1139 HZ2 TRP 155 HZ2 TRP 155 5.474 -13.652 -1.416 1140 HZ3 TRP 155 HZ3 TRP 155 9.515 -13.245 -2.834 1141 HH2 TRP 155 HH2 TRP 155 7.385 -14.467 -2.770 1142 HB2 TRP 155 2HB TRP 155 7.941 -7.980 -0.157 1143 HB3 TRP 155 1HB TRP 155 9.272 -8.932 -0.738 1144 H VAL 156 H VAL 156 12.007 -8.570 1.355 1145 HA VAL 156 HA VAL 156 12.382 -5.597 0.683 1146 HB VAL 156 HB VAL 156 13.448 -6.373 2.770 1147 HG11 VAL 156 1HG1 VAL 156 15.348 -8.020 0.987 1148 HG12 VAL 156 2HG1 VAL 156 14.212 -8.666 2.189 1149 HG13 VAL 156 3HG1 VAL 156 15.597 -7.683 2.721 1150 HG21 VAL 156 3HG2 VAL 156 15.542 -5.147 2.521 1151 HG22 VAL 156 1HG2 VAL 156 14.314 -4.327 1.537 1152 HG23 VAL 156 2HG2 VAL 156 15.530 -5.357 0.748 1153 H ARG 157 H ARG 157 13.250 -4.863 -1.125 1154 HA ARG 157 HA ARG 157 13.709 -6.474 -3.505 1155 HE ARG 157 HE ARG 157 13.848 -3.961 -6.853 1156 HB2 ARG 157 2HB ARG 157 14.443 -3.597 -2.758 1157 HB3 ARG 157 1HB ARG 157 15.071 -4.274 -4.250 1158 HG2 ARG 157 2HG ARG 157 12.560 -4.971 -4.816 1159 HG3 ARG 157 1HG ARG 157 12.145 -3.912 -3.470 1160 HD2 ARG 157 2HD ARG 157 11.984 -2.499 -5.376 1161 HD3 ARG 157 1HD ARG 157 13.478 -2.075 -4.520 1162 HH11 ARG 157 2HH1 ARG 157 13.900 -0.682 -5.728 1163 HH12 ARG 157 1HH1 ARG 157 14.796 -0.072 -7.168 1164 HH21 ARG 157 1HH2 ARG 157 14.839 -3.263 -8.512 1165 HH22 ARG 157 2HH2 ARG 157 15.294 -1.505 -8.710 1166 H SER 158 H SER 158 15.292 -7.088 -4.677 1167 HA SER 158 HA SER 158 17.153 -8.805 -3.943 1168 HG SER 158 HG SER 158 18.413 -6.195 -5.865 1169 HB2 SER 158 2HB SER 158 18.178 -8.613 -6.149 1170 HB3 SER 158 1HB SER 158 16.473 -8.240 -6.281 1171 H ALA 159 H ALA 159 18.469 -8.574 -2.146 1172 HA ALA 159 HA ALA 159 20.738 -6.584 -2.142 1173 HB1 ALA 159 3HB ALA 159 21.035 -7.491 0.178 1174 HB2 ALA 159 1HB ALA 159 19.826 -8.750 -0.139 1175 HB3 ALA 159 2HB ALA 159 19.348 -7.033 -0.116 1176 H SER 160 H SER 160 21.146 -8.516 -4.255 1177 HA SER 160 HA SER 160 23.785 -9.767 -3.287 1178 HG SER 160 HG SER 160 20.772 -10.859 -4.899 1179 HB2 SER 160 2HB SER 160 23.376 -11.879 -4.322 1180 HB3 SER 160 1HB SER 160 22.130 -11.500 -3.148 1181 H SER 161 H SER 161 25.092 -8.401 -4.185 1182 HA SER 161 HA SER 161 26.648 -7.620 -5.757 1183 HG SER 161 HG SER 161 26.998 -8.712 -9.125 1184 HB2 SER 161 2HB SER 161 26.585 -9.776 -6.963 1185 HB3 SER 161 1HB SER 161 25.240 -9.185 -7.961 1186 H ARG 162 H ARG 162 26.895 -5.961 -7.396 1187 HA ARG 162 HA ARG 162 24.491 -4.508 -8.330 1188 HE ARG 162 HE ARG 162 22.346 -0.188 -7.017 1189 HB2 ARG 162 1HB ARG 162 24.881 -3.750 -5.836 1190 HB3 ARG 162 2HB ARG 162 26.259 -2.837 -6.430 1191 HG2 ARG 162 1HG ARG 162 24.743 -1.441 -7.881 1192 HG3 ARG 162 2HG ARG 162 23.383 -2.540 -7.573 1193 HD2 ARG 162 1HD ARG 162 23.492 -1.990 -5.084 1194 HD3 ARG 162 2HD ARG 162 24.803 -0.851 -5.407 1195 HH11 ARG 162 2HH1 ARG 162 23.530 0.092 -3.706 1196 HH12 ARG 162 1HH1 ARG 162 22.467 1.558 -3.501 1197 HH21 ARG 162 1HH2 ARG 162 21.225 1.563 -6.638 1198 HH22 ARG 162 2HH2 ARG 162 21.320 2.276 -4.983 Start of MODEL 16 1 HA MET 1 HA MET 1 16.580 4.937 1.570 2 H1 MET 1 1H MET 1 15.971 7.121 2.670 3 H2 MET 1 2H MET 1 15.192 6.266 3.813 4 HB2 MET 1 1HB MET 1 14.240 3.906 3.250 5 HB3 MET 1 2HB MET 1 15.166 3.029 2.064 6 HG2 MET 1 1HG MET 1 15.995 2.198 4.095 7 HG3 MET 1 2HG MET 1 17.264 3.347 3.611 8 HE1 MET 1 3HE MET 1 17.589 2.807 6.595 9 HE2 MET 1 1HE MET 1 15.985 2.000 6.511 10 HE3 MET 1 2HE MET 1 16.262 3.310 7.695 11 H GLU 2 H GLU 2 13.643 3.938 1.005 12 HA GLU 2 HA GLU 2 12.312 6.400 0.088 13 HB2 GLU 2 2HB GLU 2 12.074 6.052 -2.264 14 HB3 GLU 2 1HB GLU 2 13.763 6.106 -1.842 15 HG2 GLU 2 2HG GLU 2 13.816 3.511 -1.994 16 HG3 GLU 2 1HG GLU 2 12.179 3.558 -2.646 17 H LEU 3 H LEU 3 10.576 4.373 -1.646 18 HA LEU 3 HA LEU 3 8.693 4.247 0.725 19 HG LEU 3 HG LEU 3 8.937 6.159 -2.418 20 HB2 LEU 3 2HB LEU 3 6.787 4.404 -1.077 21 HB3 LEU 3 1HB LEU 3 7.645 5.760 -0.446 22 HD11 LEU 3 1HD1 LEU 3 8.789 4.767 -4.468 23 HD12 LEU 3 2HD1 LEU 3 7.678 3.604 -3.667 24 HD13 LEU 3 3HD1 LEU 3 9.373 3.770 -3.162 25 HD21 LEU 3 3HD2 LEU 3 5.932 5.637 -2.899 26 HD22 LEU 3 1HD2 LEU 3 6.963 6.545 -4.038 27 HD23 LEU 3 2HD2 LEU 3 6.717 7.156 -2.386 28 H VAL 4 H VAL 4 7.173 2.796 1.130 29 HA VAL 4 HA VAL 4 7.635 -0.027 0.052 30 HB VAL 4 HB VAL 4 7.297 1.010 2.898 31 HG11 VAL 4 1HG1 VAL 4 6.339 -1.243 2.884 32 HG12 VAL 4 2HG1 VAL 4 7.946 -1.372 3.658 33 HG13 VAL 4 3HG1 VAL 4 7.692 -1.896 1.979 34 HG21 VAL 4 3HG2 VAL 4 9.513 1.620 2.299 35 HG22 VAL 4 1HG2 VAL 4 9.895 0.042 1.614 36 HG23 VAL 4 2HG2 VAL 4 9.644 0.240 3.372 37 H SER 5 H SER 5 5.880 -1.360 -0.358 38 HA SER 5 HA SER 5 3.152 0.001 -0.234 39 HG SER 5 HG SER 5 5.277 -2.208 -2.515 40 HB2 SER 5 2HB SER 5 2.635 -1.524 -2.145 41 HB3 SER 5 1HB SER 5 4.019 -0.511 -2.414 42 H VAL 6 H VAL 6 1.298 -0.741 0.715 43 HA VAL 6 HA VAL 6 1.559 -3.202 2.452 44 HB VAL 6 HB VAL 6 1.469 -2.324 4.463 45 HG11 VAL 6 1HG1 VAL 6 2.621 0.209 3.186 46 HG12 VAL 6 2HG1 VAL 6 3.542 -1.277 3.383 47 HG13 VAL 6 3HG1 VAL 6 2.948 -0.406 4.815 48 HG21 VAL 6 3HG2 VAL 6 0.175 0.349 3.758 49 HG22 VAL 6 1HG2 VAL 6 0.634 -0.222 5.373 50 HG23 VAL 6 2HG2 VAL 6 -0.668 -1.033 4.507 51 H ALA 7 H ALA 7 0.122 -4.300 1.089 52 HA ALA 7 HA ALA 7 -2.858 -3.540 1.473 53 HB1 ALA 7 3HB ALA 7 -3.249 -4.829 -0.665 54 HB2 ALA 7 1HB ALA 7 -1.488 -5.075 -0.838 55 HB3 ALA 7 2HB ALA 7 -2.179 -3.449 -0.892 56 H ALA 8 H ALA 8 -4.138 -4.923 2.725 57 HA ALA 8 HA ALA 8 -3.406 -7.795 3.135 58 HB1 ALA 8 3HB ALA 8 -5.465 -7.840 4.554 59 HB2 ALA 8 1HB ALA 8 -5.901 -6.211 4.043 60 HB3 ALA 8 2HB ALA 8 -4.426 -6.466 4.971 61 H LEU 9 H LEU 9 -4.174 -9.584 2.082 62 HA LEU 9 HA LEU 9 -6.476 -9.502 0.212 63 HG LEU 9 HG LEU 9 -3.170 -9.333 -2.492 64 HB2 LEU 9 2HB LEU 9 -5.330 -9.995 -1.882 65 HB3 LEU 9 1HB LEU 9 -5.147 -8.404 -1.292 66 HD11 LEU 9 1HD1 LEU 9 -2.522 -8.474 0.402 67 HD12 LEU 9 2HD1 LEU 9 -2.949 -7.367 -0.913 68 HD13 LEU 9 3HD1 LEU 9 -1.458 -8.305 -0.979 69 HD21 LEU 9 3HD2 LEU 9 -3.180 -11.676 -1.585 70 HD22 LEU 9 1HD2 LEU 9 -2.674 -11.025 0.018 71 HD23 LEU 9 2HD2 LEU 9 -1.589 -10.891 -1.375 72 H ALA 10 H ALA 10 -7.283 -11.361 -0.604 73 HA ALA 10 HA ALA 10 -6.554 -13.830 1.075 74 HB1 ALA 10 3HB ALA 10 -9.022 -13.969 1.336 75 HB2 ALA 10 1HB ALA 10 -9.285 -12.724 0.106 76 HB3 ALA 10 2HB ALA 10 -8.549 -12.294 1.665 77 H GLU 11 H GLU 11 -9.039 -14.886 -0.671 78 HA GLU 11 HA GLU 11 -7.379 -16.456 -2.600 79 HB2 GLU 11 2HB GLU 11 -9.170 -17.530 -1.314 80 HB3 GLU 11 1HB GLU 11 -10.387 -16.525 -2.070 81 HG2 GLU 11 2HG GLU 11 -10.312 -18.850 -2.999 82 HG3 GLU 11 1HG GLU 11 -10.141 -17.646 -4.244 83 H ASN 12 H ASN 12 -7.728 -16.534 -4.720 84 HA ASN 12 HA ASN 12 -7.134 -15.545 -6.698 85 HB2 ASN 12 2HB ASN 12 -9.880 -15.221 -6.534 86 HB3 ASN 12 1HB ASN 12 -9.443 -13.563 -6.805 87 HD21 ASN 12 1HD2 ASN 12 -7.767 -13.382 -8.726 88 HD22 ASN 12 2HD2 ASN 12 -8.354 -14.333 -10.200 89 H ARG 13 H ARG 13 -6.296 -14.114 -4.218 90 HA ARG 13 HA ARG 13 -5.305 -12.255 -3.368 91 HE ARG 13 HE ARG 13 -2.278 -14.337 -6.732 92 HB2 ARG 13 2HB ARG 13 -3.337 -11.374 -4.352 93 HB3 ARG 13 1HB ARG 13 -3.451 -13.119 -4.597 94 HG2 ARG 13 2HG ARG 13 -4.304 -12.547 -7.039 95 HG3 ARG 13 1HG ARG 13 -3.892 -10.900 -6.688 96 HD2 ARG 13 2HD ARG 13 -1.936 -11.407 -7.623 97 HD3 ARG 13 1HD ARG 13 -1.438 -11.916 -6.033 98 HH11 ARG 13 2HH1 ARG 13 -1.106 -12.109 -9.125 99 HH12 ARG 13 1HH1 ARG 13 -0.791 -13.423 -10.330 100 HH21 ARG 13 1HH2 ARG 13 -1.977 -15.792 -8.124 101 HH22 ARG 13 2HH2 ARG 13 -1.278 -15.412 -9.780 102 H VAL 14 H VAL 14 -7.476 -11.470 -3.305 103 HA VAL 14 HA VAL 14 -8.064 -8.927 -4.791 104 HB VAL 14 HB VAL 14 -9.570 -10.859 -2.927 105 HG11 VAL 14 1HG1 VAL 14 -10.507 -8.661 -2.240 106 HG12 VAL 14 2HG1 VAL 14 -11.654 -9.667 -3.132 107 HG13 VAL 14 3HG1 VAL 14 -10.884 -8.263 -3.942 108 HG21 VAL 14 3HG2 VAL 14 -10.100 -9.917 -5.845 109 HG22 VAL 14 1HG2 VAL 14 -10.983 -11.181 -4.929 110 HG23 VAL 14 2HG2 VAL 14 -9.287 -11.431 -5.379 111 H ILE 15 H ILE 15 -7.404 -6.938 -4.081 112 HA ILE 15 HA ILE 15 -6.688 -6.335 -1.221 113 HB ILE 15 HB ILE 15 -7.282 -4.180 -3.318 114 HG12 ILE 15 2HG1 ILE 15 -4.384 -4.376 -3.180 115 HG13 ILE 15 1HG1 ILE 15 -4.936 -6.003 -3.438 116 HG21 ILE 15 1HG2 ILE 15 -5.406 -4.050 -0.882 117 HG22 ILE 15 2HG2 ILE 15 -7.022 -3.323 -0.975 118 HG23 ILE 15 3HG2 ILE 15 -5.727 -2.714 -2.008 119 HD11 ILE 15 3HD1 ILE 15 -4.554 -4.770 -5.643 120 HD12 ILE 15 1HD1 ILE 15 -5.727 -3.535 -5.173 121 HD13 ILE 15 2HD1 ILE 15 -6.270 -5.186 -5.504 122 H GLY 16 H GLY 16 -9.444 -5.466 -3.247 123 HA2 GLY 16 2HA GLY 16 -11.028 -4.299 -0.865 124 HA3 GLY 16 1HA GLY 16 -10.487 -3.203 -2.107 125 H ARG 17 H ARG 17 -13.222 -3.771 -1.457 126 HA ARG 17 HA ARG 17 -14.235 -4.532 -4.224 127 HE ARG 17 HE ARG 17 -18.948 -7.786 -3.102 128 HB2 ARG 17 2HB ARG 17 -14.089 -6.674 -2.939 129 HB3 ARG 17 1HB ARG 17 -15.166 -6.029 -1.721 130 HG2 ARG 17 2HG ARG 17 -16.915 -5.717 -3.730 131 HG3 ARG 17 1HG ARG 17 -15.829 -6.642 -4.700 132 HD2 ARG 17 2HD ARG 17 -16.877 -8.512 -3.989 133 HD3 ARG 17 1HD ARG 17 -16.082 -8.381 -2.446 134 HH11 ARG 17 2HH1 ARG 17 -16.546 -6.666 -0.820 135 HH12 ARG 17 1HH1 ARG 17 -17.849 -5.795 0.112 136 HH21 ARG 17 1HH2 ARG 17 -20.310 -6.885 -1.859 137 HH22 ARG 17 2HH2 ARG 17 -19.731 -6.006 -0.342 138 H ASP 18 H ASP 18 -15.626 -3.609 -1.035 139 HA ASP 18 HA ASP 18 -17.456 -1.692 -2.523 140 HB2 ASP 18 2HB ASP 18 -18.718 -1.456 -0.361 141 HB3 ASP 18 1HB ASP 18 -18.929 -2.886 -1.347 142 H GLY 19 H GLY 19 -15.377 -1.530 0.427 143 HA2 GLY 19 2HA GLY 19 -14.265 1.131 -0.766 144 HA3 GLY 19 1HA GLY 19 -14.625 0.999 0.943 145 H GLU 20 H GLU 20 -12.794 0.614 2.162 146 HA GLU 20 HA GLU 20 -10.210 0.136 0.880 147 HB2 GLU 20 2HB GLU 20 -9.161 0.092 3.054 148 HB3 GLU 20 1HB GLU 20 -10.147 1.512 2.744 149 HG2 GLU 20 2HG GLU 20 -11.970 0.500 4.340 150 HG3 GLU 20 1HG GLU 20 -10.866 -0.831 4.591 151 H LEU 21 H LEU 21 -12.078 -2.130 2.896 152 HA LEU 21 HA LEU 21 -10.356 -4.429 1.792 153 HG LEU 21 HG LEU 21 -9.546 -2.358 4.309 154 HB2 LEU 21 2HB LEU 21 -11.158 -4.405 4.741 155 HB3 LEU 21 1HB LEU 21 -9.944 -5.354 3.907 156 HD11 LEU 21 1HD1 LEU 21 -10.186 -3.404 6.555 157 HD12 LEU 21 2HD1 LEU 21 -8.579 -2.654 6.500 158 HD13 LEU 21 3HD1 LEU 21 -8.729 -4.422 6.426 159 HD21 LEU 21 3HD2 LEU 21 -7.898 -3.574 2.816 160 HD22 LEU 21 1HD2 LEU 21 -7.425 -4.545 4.235 161 HD23 LEU 21 2HD2 LEU 21 -7.180 -2.788 4.250 162 HA PRO 22 HA PRO 22 -14.694 -6.205 1.853 163 HB2 PRO 22 2HB PRO 22 -13.756 -8.915 1.204 164 HB3 PRO 22 1HB PRO 22 -14.578 -7.732 0.182 165 HG2 PRO 22 2HG PRO 22 -11.850 -8.553 -0.075 166 HG3 PRO 22 1HG PRO 22 -12.572 -7.137 -0.863 167 HD2 PRO 22 2HD PRO 22 -10.862 -7.203 1.651 168 HD3 PRO 22 1HD PRO 22 -10.991 -5.979 0.400 169 H TRP 23 H TRP 23 -12.238 -7.167 3.972 170 HA TRP 23 HA TRP 23 -14.063 -8.819 5.747 171 HD1 TRP 23 HD1 TRP 23 -10.125 -6.732 7.038 172 HE1 TRP 23 HE1 TRP 23 -8.177 -6.147 5.392 173 HE3 TRP 23 HE3 TRP 23 -11.203 -10.287 3.616 174 HZ2 TRP 23 HZ2 TRP 23 -7.509 -7.059 2.826 175 HZ3 TRP 23 HZ3 TRP 23 -10.004 -10.261 1.451 176 HH2 TRP 23 HH2 TRP 23 -8.219 -8.593 1.050 177 HB2 TRP 23 2HB TRP 23 -11.882 -9.013 7.260 178 HB3 TRP 23 1HB TRP 23 -12.066 -9.957 5.799 179 HA PRO 24 HA PRO 24 -15.597 -5.672 8.167 180 HB2 PRO 24 2HB PRO 24 -15.666 -6.567 10.842 181 HB3 PRO 24 1HB PRO 24 -16.692 -7.132 9.520 182 HG2 PRO 24 2HG PRO 24 -14.021 -8.354 10.480 183 HG3 PRO 24 1HG PRO 24 -15.568 -9.211 10.280 184 HD2 PRO 24 2HD PRO 24 -13.737 -9.356 8.336 185 HD3 PRO 24 1HD PRO 24 -15.408 -9.038 7.819 186 H SER 25 H SER 25 -12.686 -6.401 10.037 187 HA SER 25 HA SER 25 -11.040 -4.356 9.768 188 HG SER 25 HG SER 25 -11.518 -2.033 9.312 189 HB2 SER 25 2HB SER 25 -13.091 -2.978 11.560 190 HB3 SER 25 1HB SER 25 -11.386 -2.502 11.571 191 H ILE 26 H ILE 26 -9.582 -5.719 10.636 192 HA ILE 26 HA ILE 26 -9.898 -6.756 13.437 193 HB ILE 26 HB ILE 26 -7.537 -7.885 12.790 194 HG12 ILE 26 2HG1 ILE 26 -7.426 -7.006 10.486 195 HG13 ILE 26 1HG1 ILE 26 -7.313 -8.728 10.641 196 HG21 ILE 26 1HG2 ILE 26 -10.225 -9.178 12.140 197 HG22 ILE 26 2HG2 ILE 26 -9.456 -9.096 13.738 198 HG23 ILE 26 3HG2 ILE 26 -8.664 -9.986 12.425 199 HD11 ILE 26 3HD1 ILE 26 -9.149 -7.206 8.982 200 HD12 ILE 26 1HD1 ILE 26 -10.131 -8.222 10.060 201 HD13 ILE 26 2HD1 ILE 26 -8.892 -8.948 9.006 202 HA PRO 27 HA PRO 27 -7.117 -3.609 15.250 203 HB2 PRO 27 2HB PRO 27 -6.555 -5.836 17.292 204 HB3 PRO 27 1HB PRO 27 -6.902 -4.106 17.555 205 HG2 PRO 27 2HG PRO 27 -8.938 -5.863 17.906 206 HG3 PRO 27 1HG PRO 27 -9.258 -4.409 16.920 207 HD2 PRO 27 2HD PRO 27 -8.539 -7.203 15.845 208 HD3 PRO 27 1HD PRO 27 -9.928 -6.136 15.432 209 H ALA 28 H ALA 28 -5.709 -6.752 14.464 210 HA ALA 28 HA ALA 28 -2.890 -5.755 14.563 211 HB1 ALA 28 3HB ALA 28 -3.317 -8.179 14.756 212 HB2 ALA 28 1HB ALA 28 -2.336 -7.842 13.326 213 HB3 ALA 28 2HB ALA 28 -4.046 -8.209 13.120 214 H ASP 29 H ASP 29 -5.390 -5.607 12.032 215 HA ASP 29 HA ASP 29 -3.504 -4.644 9.891 216 HB2 ASP 29 2HB ASP 29 -5.564 -5.926 9.344 217 HB3 ASP 29 1HB ASP 29 -6.586 -4.723 10.113 218 H LYS 30 H LYS 30 -6.289 -2.896 11.204 219 HA LYS 30 HA LYS 30 -5.204 -0.337 11.000 220 HB2 LYS 30 2HB LYS 30 -7.667 -1.395 11.843 221 HB3 LYS 30 1HB LYS 30 -7.144 -0.530 13.250 222 HG2 LYS 30 2HG LYS 30 -8.481 0.989 12.065 223 HG3 LYS 30 1HG LYS 30 -6.860 1.594 11.744 224 HD2 LYS 30 2HD LYS 30 -6.965 0.577 9.414 225 HD3 LYS 30 1HD LYS 30 -8.498 -0.182 9.805 226 HE2 LYS 30 2HE LYS 30 -9.572 2.138 10.153 227 HE3 LYS 30 1HE LYS 30 -8.045 2.909 9.783 228 HZ1 LYS 30 3HZ LYS 30 -9.678 2.540 7.795 229 HZ2 LYS 30 1HZ LYS 30 -9.362 0.999 7.783 230 HZ3 LYS 30 2HZ LYS 30 -8.181 2.038 7.462 231 H LYS 31 H LYS 31 -3.960 -2.367 13.267 232 HA LYS 31 HA LYS 31 -2.357 -0.163 14.662 233 HB2 LYS 31 2HB LYS 31 -3.193 -1.881 16.294 234 HB3 LYS 31 1HB LYS 31 -2.453 -3.134 15.316 235 HG2 LYS 31 2HG LYS 31 -1.062 -2.868 17.239 236 HG3 LYS 31 1HG LYS 31 -0.216 -2.489 15.767 237 HD2 LYS 31 2HD LYS 31 -0.721 0.055 16.293 238 HD3 LYS 31 1HD LYS 31 -1.211 -0.496 17.905 239 HE2 LYS 31 2HE LYS 31 1.078 -1.610 18.217 240 HE3 LYS 31 1HE LYS 31 1.527 -1.141 16.569 241 HZ1 LYS 31 3HZ LYS 31 0.908 0.873 18.774 242 HZ2 LYS 31 1HZ LYS 31 1.237 1.229 17.186 243 HZ3 LYS 31 2HZ LYS 31 2.392 0.552 18.074 244 H GLN 32 H GLN 32 -1.872 -2.941 12.365 245 HA GLN 32 HA GLN 32 1.114 -2.629 12.418 246 HB2 GLN 32 2HB GLN 32 0.305 -4.860 12.046 247 HB3 GLN 32 1HB GLN 32 -0.617 -4.392 10.629 248 HG2 GLN 32 2HG GLN 32 2.419 -3.875 10.631 249 HG3 GLN 32 1HG GLN 32 1.901 -5.534 10.506 250 HE21 GLN 32 1HE2 GLN 32 -0.090 -5.654 8.776 251 HE22 GLN 32 2HE2 GLN 32 0.457 -4.990 7.157 252 H TYR 33 H TYR 33 -1.499 -1.917 10.053 253 HA TYR 33 HA TYR 33 -0.028 0.000 8.417 254 HD1 TYR 33 HD1 TYR 33 -3.760 0.888 10.196 255 HD2 TYR 33 HD2 TYR 33 -2.613 1.760 6.177 256 HE1 TYR 33 HE1 TYR 33 -5.436 2.701 10.118 257 HE2 TYR 33 HE2 TYR 33 -4.234 3.656 6.137 258 HH TYR 33 HH TYR 33 -5.561 5.097 7.734 259 HB2 TYR 33 2HB TYR 33 -1.980 -0.458 7.341 260 HB3 TYR 33 1HB TYR 33 -2.856 -0.835 8.751 261 H ARG 34 H ARG 34 -1.534 0.666 11.645 262 HA ARG 34 HA ARG 34 -0.597 3.532 11.389 263 HE ARG 34 HE ARG 34 -5.415 4.448 11.913 264 HB2 ARG 34 2HB ARG 34 -1.958 2.097 13.702 265 HB3 ARG 34 1HB ARG 34 -1.272 3.721 13.878 266 HG2 ARG 34 2HG ARG 34 -2.707 4.584 11.952 267 HG3 ARG 34 1HG ARG 34 -3.387 2.978 11.757 268 HD2 ARG 34 2HD ARG 34 -4.180 3.080 14.207 269 HD3 ARG 34 1HD ARG 34 -3.627 4.778 14.244 270 HH11 ARG 34 2HH1 ARG 34 -5.587 4.535 15.336 271 HH12 ARG 34 1HH1 ARG 34 -7.365 4.972 15.346 272 HH21 ARG 34 1HH2 ARG 34 -7.509 4.981 11.888 273 HH22 ARG 34 2HH2 ARG 34 -8.381 5.145 13.429 274 H SER 35 H SER 35 0.948 0.774 12.971 275 HA SER 35 HA SER 35 3.226 2.665 13.801 276 HG SER 35 HG SER 35 3.354 2.381 15.719 277 HB2 SER 35 2HB SER 35 2.667 -0.196 14.649 278 HB3 SER 35 1HB SER 35 4.307 0.457 14.697 279 H ARG 36 H ARG 36 2.379 0.938 11.146 280 HA ARG 36 HA ARG 36 5.138 1.250 9.895 281 HE ARG 36 HE ARG 36 4.163 -2.692 8.334 282 HB2 ARG 36 2HB ARG 36 3.345 -0.708 9.507 283 HB3 ARG 36 1HB ARG 36 2.430 0.486 8.615 284 HG2 ARG 36 2HG ARG 36 3.543 -0.700 6.953 285 HG3 ARG 36 1HG ARG 36 4.456 0.771 7.096 286 HD2 ARG 36 2HD ARG 36 6.031 -1.103 6.914 287 HD3 ARG 36 1HD ARG 36 6.187 -0.462 8.548 288 HH11 ARG 36 2HH1 ARG 36 7.566 -2.153 8.453 289 HH12 ARG 36 1HH1 ARG 36 7.817 -3.933 8.691 290 HH21 ARG 36 1HH2 ARG 36 4.603 -4.610 8.726 291 HH22 ARG 36 2HH2 ARG 36 6.327 -5.163 9.046 292 H VAL 37 H VAL 37 1.776 2.504 9.106 293 HA VAL 37 HA VAL 37 3.096 4.754 7.628 294 HB VAL 37 HB VAL 37 1.497 4.825 6.126 295 HG11 VAL 37 1HG1 VAL 37 0.931 1.873 6.746 296 HG12 VAL 37 2HG1 VAL 37 2.440 2.445 6.001 297 HG13 VAL 37 3HG1 VAL 37 0.894 2.671 5.144 298 HG21 VAL 37 3HG2 VAL 37 -0.706 3.621 7.898 299 HG22 VAL 37 1HG2 VAL 37 -0.910 3.977 6.186 300 HG23 VAL 37 2HG2 VAL 37 -0.582 5.280 7.341 301 H ALA 38 H ALA 38 1.678 4.876 10.711 302 HA ALA 38 HA ALA 38 -0.046 7.276 10.166 303 HB1 ALA 38 3HB ALA 38 -0.710 5.700 11.930 304 HB2 ALA 38 1HB ALA 38 -0.533 7.355 12.544 305 HB3 ALA 38 2HB ALA 38 0.718 6.154 12.891 306 H ASP 39 H ASP 39 3.280 6.963 11.109 307 HA ASP 39 HA ASP 39 3.671 9.946 11.352 308 HB2 ASP 39 2HB ASP 39 5.438 7.522 11.862 309 HB3 ASP 39 1HB ASP 39 6.223 8.921 11.217 310 H ASP 40 H ASP 40 4.717 7.421 8.988 311 HA ASP 40 HA ASP 40 5.583 9.251 7.096 312 HB2 ASP 40 2HB ASP 40 4.967 6.260 7.127 313 HB3 ASP 40 1HB ASP 40 5.511 6.983 5.643 314 HA PRO 41 HA PRO 41 2.172 10.215 4.090 315 HB2 PRO 41 2HB PRO 41 4.498 10.068 2.071 316 HB3 PRO 41 1HB PRO 41 3.234 11.291 2.176 317 HG2 PRO 41 2HG PRO 41 5.676 11.870 3.199 318 HG3 PRO 41 1HG PRO 41 4.297 12.204 4.270 319 HD2 PRO 41 2HD PRO 41 6.090 9.706 4.338 320 HD3 PRO 41 1HD PRO 41 5.587 10.795 5.662 321 H VAL 42 H VAL 42 0.784 8.991 2.804 322 HA VAL 42 HA VAL 42 1.829 6.376 1.609 323 HB VAL 42 HB VAL 42 -0.961 7.117 2.619 324 HG11 VAL 42 1HG1 VAL 42 0.020 4.308 1.742 325 HG12 VAL 42 2HG1 VAL 42 -1.059 5.319 0.756 326 HG13 VAL 42 3HG1 VAL 42 -1.595 4.750 2.349 327 HG21 VAL 42 3HG2 VAL 42 0.650 6.734 4.511 328 HG22 VAL 42 1HG2 VAL 42 1.296 5.283 3.719 329 HG23 VAL 42 2HG2 VAL 42 -0.357 5.267 4.371 330 H VAL 43 H VAL 43 1.788 5.908 -0.479 331 HA VAL 43 HA VAL 43 0.309 7.712 -2.431 332 HB VAL 43 HB VAL 43 1.862 7.222 -4.116 333 HG11 VAL 43 1HG1 VAL 43 3.607 7.470 -1.571 334 HG12 VAL 43 2HG1 VAL 43 2.838 8.822 -2.366 335 HG13 VAL 43 3HG1 VAL 43 4.087 7.892 -3.213 336 HG21 VAL 43 3HG2 VAL 43 3.832 5.666 -3.903 337 HG22 VAL 43 1HG2 VAL 43 2.316 4.785 -3.857 338 HG23 VAL 43 2HG2 VAL 43 3.219 5.115 -2.343 339 H LEU 44 H LEU 44 -1.687 7.057 -2.986 340 HA LEU 44 HA LEU 44 -2.265 4.071 -3.420 341 HG LEU 44 HG LEU 44 -4.347 6.927 -2.118 342 HB2 LEU 44 2HB LEU 44 -4.144 4.168 -1.942 343 HB3 LEU 44 1HB LEU 44 -2.693 4.539 -1.107 344 HD11 LEU 44 1HD1 LEU 44 -5.105 5.212 0.342 345 HD12 LEU 44 2HD1 LEU 44 -6.092 5.426 -1.113 346 HD13 LEU 44 3HD1 LEU 44 -5.802 6.805 -0.031 347 HD21 LEU 44 3HD2 LEU 44 -2.169 7.223 -0.810 348 HD22 LEU 44 1HD2 LEU 44 -2.995 6.548 0.639 349 HD23 LEU 44 2HD2 LEU 44 -3.576 8.033 -0.121 350 H GLY 45 H GLY 45 -5.062 4.191 -3.688 351 HA2 GLY 45 2HA GLY 45 -5.122 4.972 -6.678 352 HA3 GLY 45 1HA GLY 45 -5.780 3.458 -6.067 353 H ARG 46 H ARG 46 -7.611 4.525 -7.391 354 HA ARG 46 HA ARG 46 -9.334 6.206 -5.517 355 HE ARG 46 HE ARG 46 -12.111 8.869 -6.742 356 HB2 ARG 46 2HB ARG 46 -9.825 5.730 -8.490 357 HB3 ARG 46 1HB ARG 46 -11.097 6.264 -7.437 358 HG2 ARG 46 2HG ARG 46 -8.415 7.743 -7.793 359 HG3 ARG 46 1HG ARG 46 -9.897 8.156 -8.632 360 HD2 ARG 46 2HD ARG 46 -10.118 8.107 -5.559 361 HD3 ARG 46 1HD ARG 46 -9.089 9.337 -6.148 362 HH11 ARG 46 2HH1 ARG 46 -9.475 11.050 -7.016 363 HH12 ARG 46 1HH1 ARG 46 -10.527 12.322 -7.874 364 HH21 ARG 46 1HH2 ARG 46 -13.206 10.193 -7.536 365 HH22 ARG 46 2HH2 ARG 46 -12.597 11.870 -8.106 366 H THR 47 H THR 47 -9.466 2.831 -6.739 367 HA THR 47 HA THR 47 -11.630 2.140 -5.072 368 HB THR 47 HB THR 47 -9.014 0.520 -5.096 369 HG1 THR 47 HG1 THR 47 -11.069 -0.052 -6.860 370 HG21 THR 47 3HG2 THR 47 -11.424 -0.029 -3.726 371 HG22 THR 47 1HG2 THR 47 -10.212 -1.204 -4.228 372 HG23 THR 47 2HG2 THR 47 -11.664 -0.921 -5.242 373 H THR 48 H THR 48 -8.323 1.903 -3.667 374 HA THR 48 HA THR 48 -9.063 2.092 -0.888 375 HB THR 48 HB THR 48 -6.652 2.784 -0.456 376 HG1 THR 48 HG1 THR 48 -6.153 2.182 -3.131 377 HG21 THR 48 3HG2 THR 48 -7.313 0.305 -0.662 378 HG22 THR 48 1HG2 THR 48 -5.638 0.719 -1.112 379 HG23 THR 48 2HG2 THR 48 -6.848 0.399 -2.366 380 H PHE 49 H PHE 49 -8.276 4.968 -2.918 381 HA PHE 49 HA PHE 49 -8.533 6.826 -0.596 382 HD1 PHE 49 HD2 PHE 49 -10.164 9.529 -2.919 383 HD2 PHE 49 HD1 PHE 49 -6.307 9.006 -1.110 384 HE1 PHE 49 HE2 PHE 49 -10.337 11.761 -1.880 385 HE2 PHE 49 HE1 PHE 49 -6.452 11.281 -0.173 386 HZ PHE 49 HZ PHE 49 -8.483 12.607 -0.458 387 HB2 PHE 49 2HB PHE 49 -7.158 7.322 -2.636 388 HB3 PHE 49 1HB PHE 49 -8.621 7.579 -3.570 389 H GLU 50 H GLU 50 -10.963 5.725 -2.934 390 HA GLU 50 HA GLU 50 -13.003 7.698 -1.921 391 HB2 GLU 50 2HB GLU 50 -13.269 5.405 -3.935 392 HB3 GLU 50 1HB GLU 50 -14.608 6.381 -3.415 393 HG2 GLU 50 2HG GLU 50 -13.255 8.515 -4.143 394 HG3 GLU 50 1HG GLU 50 -12.011 7.441 -4.722 395 H SER 51 H SER 51 -11.943 4.590 -0.786 396 HA SER 51 HA SER 51 -13.771 4.766 1.606 397 HG SER 51 HG SER 51 -11.648 2.815 3.411 398 HB2 SER 51 2HB SER 51 -12.602 2.640 0.893 399 HB3 SER 51 1HB SER 51 -11.066 3.339 1.425 400 H MET 52 H MET 52 -10.234 5.566 1.250 401 HA MET 52 HA MET 52 -9.962 6.487 3.922 402 HB2 MET 52 2HB MET 52 -8.263 7.358 1.485 403 HB3 MET 52 1HB MET 52 -7.819 7.634 3.145 404 HG2 MET 52 2HG MET 52 -8.409 4.739 2.822 405 HG3 MET 52 1HG MET 52 -7.209 5.309 1.659 406 HE1 MET 52 3HE MET 52 -5.510 4.074 2.526 407 HE2 MET 52 1HE MET 52 -4.505 4.385 3.965 408 HE3 MET 52 2HE MET 52 -4.541 5.581 2.634 409 H ARG 53 H ARG 53 -11.159 8.410 1.480 410 HA ARG 53 HA ARG 53 -11.546 11.042 2.644 411 HE ARG 53 HE ARG 53 -15.044 12.587 -0.774 412 HB2 ARG 53 2HB ARG 53 -12.406 9.824 0.416 413 HB3 ARG 53 1HB ARG 53 -13.587 9.085 1.481 414 HG2 ARG 53 2HG ARG 53 -14.078 11.801 2.006 415 HG3 ARG 53 1HG ARG 53 -13.282 11.933 0.441 416 HD2 ARG 53 2HD ARG 53 -15.003 9.841 -0.170 417 HD3 ARG 53 1HD ARG 53 -15.873 10.493 1.225 418 HH11 ARG 53 2HH1 ARG 53 -17.496 10.277 -0.047 419 HH12 ARG 53 1HH1 ARG 53 -18.674 10.951 -1.277 420 HH21 ARG 53 1HH2 ARG 53 -16.320 13.285 -2.270 421 HH22 ARG 53 2HH2 ARG 53 -17.996 12.582 -2.491 422 H ASP 54 H ASP 54 -12.687 7.960 3.950 423 HA ASP 54 HA ASP 54 -13.992 9.312 6.316 424 HB2 ASP 54 2HB ASP 54 -14.691 6.988 4.708 425 HB3 ASP 54 1HB ASP 54 -14.131 6.340 6.206 426 H ASP 55 H ASP 55 -11.963 6.251 6.481 427 HA ASP 55 HA ASP 55 -10.338 7.488 8.692 428 HB2 ASP 55 2HB ASP 55 -10.915 4.739 7.940 429 HB3 ASP 55 1HB ASP 55 -9.200 4.905 7.822 430 H LEU 56 H LEU 56 -8.834 8.995 8.091 431 HA LEU 56 HA LEU 56 -7.120 8.827 5.783 432 HG LEU 56 HG LEU 56 -7.204 12.458 7.041 433 HB2 LEU 56 2HB LEU 56 -6.198 10.387 8.227 434 HB3 LEU 56 1HB LEU 56 -5.897 10.678 6.553 435 HD11 LEU 56 1HD1 LEU 56 -8.338 11.325 5.068 436 HD12 LEU 56 2HD1 LEU 56 -9.432 12.309 6.032 437 HD13 LEU 56 3HD1 LEU 56 -9.470 10.544 6.205 438 HD21 LEU 56 3HD2 LEU 56 -9.430 12.257 8.455 439 HD22 LEU 56 1HD2 LEU 56 -7.845 12.254 9.263 440 HD23 LEU 56 2HD2 LEU 56 -8.733 10.725 9.025 441 HA PRO 57 HA PRO 57 -3.673 6.124 7.428 442 HB2 PRO 57 2HB PRO 57 -1.726 6.494 5.578 443 HB3 PRO 57 1HB PRO 57 -3.261 5.722 5.193 444 HG2 PRO 57 2HG PRO 57 -2.385 8.595 4.584 445 HG3 PRO 57 1HG PRO 57 -3.285 7.471 3.538 446 HD2 PRO 57 2HD PRO 57 -4.405 9.494 5.205 447 HD3 PRO 57 1HD PRO 57 -5.342 8.136 4.496 448 H GLY 58 H GLY 58 -1.400 8.601 6.369 449 HA2 GLY 58 2HA GLY 58 -0.615 9.204 9.309 450 HA3 GLY 58 1HA GLY 58 0.550 8.943 8.014 451 H SER 59 H SER 59 1.508 10.954 8.604 452 HA SER 59 HA SER 59 0.395 13.553 8.405 453 HG SER 59 HG SER 59 3.721 14.724 8.205 454 HB2 SER 59 2HB SER 59 2.682 12.961 9.153 455 HB3 SER 59 1HB SER 59 3.176 12.586 7.497 456 H ALA 60 H ALA 60 0.474 11.518 5.634 457 HA ALA 60 HA ALA 60 -0.795 13.674 4.041 458 HB1 ALA 60 3HB ALA 60 2.049 12.786 3.231 459 HB2 ALA 60 1HB ALA 60 1.451 14.409 3.577 460 HB3 ALA 60 2HB ALA 60 0.943 13.584 2.085 461 H GLN 61 H GLN 61 -1.600 13.170 2.016 462 HA GLN 61 HA GLN 61 -2.030 10.205 1.352 463 HB2 GLN 61 2HB GLN 61 -3.975 12.156 2.324 464 HB3 GLN 61 1HB GLN 61 -4.352 11.948 0.648 465 HG2 GLN 61 2HG GLN 61 -4.751 9.541 0.953 466 HG3 GLN 61 1HG GLN 61 -3.999 9.534 2.534 467 HE21 GLN 61 1HE2 GLN 61 -5.164 11.293 4.046 468 HE22 GLN 61 2HE2 GLN 61 -6.973 10.914 4.113 469 H ILE 62 H ILE 62 -1.045 9.920 -0.504 470 HA ILE 62 HA ILE 62 -1.187 11.950 -2.813 471 HB ILE 62 HB ILE 62 0.719 9.684 -2.046 472 HG12 ILE 62 2HG1 ILE 62 1.597 12.514 -2.620 473 HG13 ILE 62 1HG1 ILE 62 0.840 12.225 -1.058 474 HG21 ILE 62 1HG2 ILE 62 0.511 9.612 -4.559 475 HG22 ILE 62 2HG2 ILE 62 2.105 10.191 -4.041 476 HG23 ILE 62 3HG2 ILE 62 0.869 11.361 -4.617 477 HD11 ILE 62 3HD1 ILE 62 2.668 10.451 -0.592 478 HD12 ILE 62 1HD1 ILE 62 3.220 12.119 -0.750 479 HD13 ILE 62 2HD1 ILE 62 3.461 11.021 -2.109 480 H VAL 63 H VAL 63 -2.688 11.414 -4.398 481 HA VAL 63 HA VAL 63 -3.153 8.421 -4.935 482 HB VAL 63 HB VAL 63 -4.884 10.617 -6.111 483 HG11 VAL 63 1HG1 VAL 63 -4.808 8.372 -7.450 484 HG12 VAL 63 2HG1 VAL 63 -6.398 8.535 -6.634 485 HG13 VAL 63 3HG1 VAL 63 -5.139 7.515 -5.947 486 HG21 VAL 63 3HG2 VAL 63 -5.366 8.733 -3.711 487 HG22 VAL 63 1HG2 VAL 63 -6.679 9.655 -4.511 488 HG23 VAL 63 2HG2 VAL 63 -5.362 10.486 -3.682 489 H MET 64 H MET 64 -1.865 7.519 -6.328 490 HA MET 64 HA MET 64 -0.616 8.834 -8.692 491 HB2 MET 64 2HB MET 64 -0.766 6.006 -7.466 492 HB3 MET 64 1HB MET 64 -0.366 6.113 -9.137 493 HG2 MET 64 2HG MET 64 1.364 8.109 -7.989 494 HG3 MET 64 1HG MET 64 1.331 6.783 -6.829 495 HE1 MET 64 3HE MET 64 0.950 6.528 -11.019 496 HE2 MET 64 1HE MET 64 2.708 6.691 -11.261 497 HE3 MET 64 2HE MET 64 1.787 7.999 -10.448 498 H SER 65 H SER 65 -2.232 9.739 -9.840 499 HA SER 65 HA SER 65 -2.931 8.151 -12.106 500 HG SER 65 HG SER 65 -5.140 6.787 -12.474 501 HB2 SER 65 2HB SER 65 -5.026 7.563 -10.474 502 HB3 SER 65 1HB SER 65 -5.613 9.135 -10.995 503 H ARG 66 H ARG 66 -3.823 9.358 -13.888 504 HA ARG 66 HA ARG 66 -2.894 12.231 -13.814 505 HE ARG 66 HE ARG 66 -2.378 12.100 -18.467 506 HB2 ARG 66 2HB ARG 66 -3.246 10.097 -15.903 507 HB3 ARG 66 1HB ARG 66 -3.844 11.610 -16.466 508 HG2 ARG 66 2HG ARG 66 -1.062 11.534 -15.122 509 HG3 ARG 66 1HG ARG 66 -1.207 10.840 -16.698 510 HD2 ARG 66 2HD ARG 66 -2.035 13.737 -16.003 511 HD3 ARG 66 1HD ARG 66 -0.456 13.278 -16.688 512 HH11 ARG 66 2HH1 ARG 66 -1.549 15.334 -17.557 513 HH12 ARG 66 1HH1 ARG 66 -2.436 16.058 -18.977 514 HH21 ARG 66 1HH2 ARG 66 -3.412 12.928 -20.046 515 HH22 ARG 66 2HH2 ARG 66 -3.462 14.731 -20.321 516 H SER 67 H SER 67 -4.011 13.981 -13.888 517 HA SER 67 HA SER 67 -5.715 15.608 -14.172 518 HG SER 67 HG SER 67 -7.599 14.416 -16.769 519 HB2 SER 67 2HB SER 67 -7.627 13.362 -14.937 520 HB3 SER 67 1HB SER 67 -8.270 14.884 -14.419 521 H GLU 68 H GLU 68 -7.978 16.004 -12.839 522 HA GLU 68 HA GLU 68 -8.282 17.205 -10.899 523 HB2 GLU 68 2HB GLU 68 -8.204 14.499 -9.506 524 HB3 GLU 68 1HB GLU 68 -9.039 15.946 -8.994 525 HG2 GLU 68 2HG GLU 68 -10.461 15.830 -11.176 526 HG3 GLU 68 1HG GLU 68 -9.755 14.229 -11.439 527 H ARG 69 H ARG 69 -7.860 17.904 -8.690 528 HA ARG 69 HA ARG 69 -5.204 17.431 -7.553 529 HE ARG 69 HE ARG 69 -4.577 21.707 -10.392 530 HB2 ARG 69 2HB ARG 69 -5.632 20.368 -8.421 531 HB3 ARG 69 1HB ARG 69 -4.317 19.704 -7.505 532 HG2 ARG 69 2HG ARG 69 -3.185 19.828 -9.498 533 HG3 ARG 69 1HG ARG 69 -3.772 18.207 -9.629 534 HD2 ARG 69 2HD ARG 69 -4.120 19.338 -11.769 535 HD3 ARG 69 1HD ARG 69 -5.698 18.974 -11.070 536 HH11 ARG 69 2HH1 ARG 69 -6.726 19.970 -12.482 537 HH12 ARG 69 1HH1 ARG 69 -7.767 21.442 -12.778 538 HH21 ARG 69 1HH2 ARG 69 -5.779 23.351 -10.720 539 HH22 ARG 69 2HH2 ARG 69 -7.231 23.280 -11.813 540 H SER 70 H SER 70 -5.480 17.482 -5.417 541 HA SER 70 HA SER 70 -5.924 18.268 -3.255 542 HG SER 70 HG SER 70 -4.876 20.214 -4.113 543 HB2 SER 70 2HB SER 70 -7.668 20.586 -4.201 544 HB3 SER 70 1HB SER 70 -6.919 20.348 -2.620 545 H PHE 71 H PHE 71 -7.367 17.575 -1.710 546 HA PHE 71 HA PHE 71 -9.946 16.347 -2.853 547 HD1 PHE 71 HD2 PHE 71 -9.740 14.805 -4.494 548 HD2 PHE 71 HD1 PHE 71 -6.145 13.655 -2.444 549 HE1 PHE 71 HE2 PHE 71 -8.965 13.604 -6.503 550 HE2 PHE 71 HE1 PHE 71 -5.366 12.501 -4.461 551 HZ PHE 71 HZ PHE 71 -6.798 12.397 -6.462 552 HB2 PHE 71 2HB PHE 71 -7.706 14.985 -1.254 553 HB3 PHE 71 1HB PHE 71 -9.245 14.250 -1.666 554 H SER 72 H SER 72 -9.866 14.946 -0.003 555 HA SER 72 HA SER 72 -12.082 16.838 0.952 556 HG SER 72 HG SER 72 -12.649 15.052 -0.611 557 HB2 SER 72 2HB SER 72 -11.702 13.862 1.610 558 HB3 SER 72 1HB SER 72 -13.054 14.865 2.080 559 H VAL 73 H VAL 73 -9.076 15.482 2.124 560 HA VAL 73 HA VAL 73 -9.370 17.127 4.667 561 HB VAL 73 HB VAL 73 -9.174 14.732 5.233 562 HG11 VAL 73 1HG1 VAL 73 -6.319 14.743 4.049 563 HG12 VAL 73 2HG1 VAL 73 -7.702 13.786 3.453 564 HG13 VAL 73 3HG1 VAL 73 -7.042 13.472 5.052 565 HG21 VAL 73 3HG2 VAL 73 -6.661 16.271 6.136 566 HG22 VAL 73 1HG2 VAL 73 -7.542 14.995 7.018 567 HG23 VAL 73 2HG2 VAL 73 -8.305 16.580 6.750 568 H ASP 74 H ASP 74 -7.498 18.378 5.242 569 HA ASP 74 HA ASP 74 -6.232 19.692 2.940 570 HB2 ASP 74 2HB ASP 74 -6.934 20.561 5.477 571 HB3 ASP 74 1HB ASP 74 -5.229 20.254 5.761 572 H THR 75 H THR 75 -4.884 17.380 5.308 573 HA THR 75 HA THR 75 -2.270 17.023 3.875 574 HB THR 75 HB THR 75 -2.219 14.868 5.304 575 HG1 THR 75 HG1 THR 75 -3.637 15.111 7.150 576 HG21 THR 75 3HG2 THR 75 -1.676 15.878 7.408 577 HG22 THR 75 1HG2 THR 75 -2.622 17.340 7.078 578 HG23 THR 75 2HG2 THR 75 -1.121 17.010 6.167 579 H ALA 76 H ALA 76 -4.237 16.979 1.876 580 HA ALA 76 HA ALA 76 -3.761 14.221 0.744 581 HB1 ALA 76 3HB ALA 76 -5.814 13.801 1.912 582 HB2 ALA 76 1HB ALA 76 -6.226 13.810 0.185 583 HB3 ALA 76 2HB ALA 76 -6.633 15.204 1.220 584 H HIS 77 H HIS 77 -3.371 14.133 -1.216 585 HA HIS 77 HA HIS 77 -3.407 16.595 -3.044 586 HD1 HIS 77 HD1 HIS 77 -0.747 15.647 0.642 587 HD2 HIS 77 HD2 HIS 77 -1.735 18.925 -1.919 588 HE1 HIS 77 HE1 HIS 77 -0.480 17.879 1.905 589 HB2 HIS 77 2HB HIS 77 -1.038 15.019 -1.824 590 HB3 HIS 77 1HB HIS 77 -0.863 16.348 -2.961 591 H ARG 78 H ARG 78 -1.745 15.969 -5.059 592 HA ARG 78 HA ARG 78 -2.645 13.289 -6.178 593 HE ARG 78 HE ARG 78 -4.464 10.872 -8.044 594 HB2 ARG 78 2HB ARG 78 -3.774 15.826 -7.111 595 HB3 ARG 78 1HB ARG 78 -2.803 15.223 -8.405 596 HG2 ARG 78 2HG ARG 78 -4.870 13.499 -6.926 597 HG3 ARG 78 1HG ARG 78 -5.334 14.504 -8.263 598 HD2 ARG 78 2HD ARG 78 -4.213 13.207 -9.931 599 HD3 ARG 78 1HD ARG 78 -3.032 12.587 -8.813 600 HH11 ARG 78 2HH1 ARG 78 -6.189 12.816 -10.376 601 HH12 ARG 78 1HH1 ARG 78 -7.588 11.649 -10.412 602 HH21 ARG 78 1HH2 ARG 78 -6.098 9.676 -8.067 603 HH22 ARG 78 2HH2 ARG 78 -7.520 9.939 -9.212 604 H ALA 79 H ALA 79 -0.989 12.166 -6.867 605 HA ALA 79 HA ALA 79 1.441 13.505 -8.181 606 HB1 ALA 79 3HB ALA 79 2.334 11.100 -8.051 607 HB2 ALA 79 1HB ALA 79 0.848 10.603 -7.219 608 HB3 ALA 79 2HB ALA 79 1.955 11.799 -6.465 609 H ALA 80 H ALA 80 1.635 13.414 -10.410 610 HA ALA 80 HA ALA 80 -0.172 11.596 -12.056 611 HB1 ALA 80 3HB ALA 80 1.892 13.699 -12.924 612 HB2 ALA 80 1HB ALA 80 0.155 13.974 -12.735 613 HB3 ALA 80 2HB ALA 80 0.772 12.865 -13.997 614 H SER 81 H SER 81 3.120 11.330 -10.903 615 HA SER 81 HA SER 81 3.345 8.668 -12.296 616 HG SER 81 HG SER 81 4.097 9.375 -14.487 617 HB2 SER 81 2HB SER 81 4.728 11.097 -13.264 618 HB3 SER 81 1HB SER 81 5.963 10.157 -12.494 619 H VAL 82 H VAL 82 5.946 7.961 -11.557 620 HA VAL 82 HA VAL 82 5.729 7.641 -8.529 621 HB VAL 82 HB VAL 82 7.811 6.355 -10.375 622 HG11 VAL 82 1HG1 VAL 82 8.287 4.983 -8.171 623 HG12 VAL 82 2HG1 VAL 82 7.538 6.354 -7.313 624 HG13 VAL 82 3HG1 VAL 82 8.992 6.589 -8.292 625 HG21 VAL 82 3HG2 VAL 82 5.195 5.310 -9.150 626 HG22 VAL 82 1HG2 VAL 82 6.542 4.190 -9.349 627 HG23 VAL 82 2HG2 VAL 82 5.902 5.038 -10.767 628 H GLU 83 H GLU 83 8.260 8.945 -10.819 629 HA GLU 83 HA GLU 83 9.692 10.602 -8.982 630 HB2 GLU 83 2HB GLU 83 8.871 11.138 -11.891 631 HB3 GLU 83 1HB GLU 83 10.108 12.024 -11.035 632 HG2 GLU 83 2HG GLU 83 11.698 10.228 -11.128 633 HG3 GLU 83 1HG GLU 83 10.493 8.976 -11.212 634 H GLU 84 H GLU 84 6.484 11.587 -10.475 635 HA GLU 84 HA GLU 84 6.333 14.060 -8.832 636 HB2 GLU 84 2HB GLU 84 3.926 12.473 -9.859 637 HB3 GLU 84 1HB GLU 84 3.936 14.140 -9.349 638 HG2 GLU 84 2HG GLU 84 5.780 13.982 -11.646 639 HG3 GLU 84 1HG GLU 84 4.365 13.036 -12.037 640 H ALA 85 H ALA 85 5.660 10.796 -7.960 641 HA ALA 85 HA ALA 85 4.068 11.495 -5.472 642 HB1 ALA 85 3HB ALA 85 3.478 9.353 -6.762 643 HB2 ALA 85 1HB ALA 85 3.957 9.049 -5.072 644 HB3 ALA 85 2HB ALA 85 5.104 8.727 -6.372 645 H VAL 86 H VAL 86 7.395 10.578 -6.309 646 HA VAL 86 HA VAL 86 8.286 10.517 -3.418 647 HB VAL 86 HB VAL 86 9.719 10.048 -6.073 648 HG11 VAL 86 1HG1 VAL 86 11.351 11.439 -4.834 649 HG12 VAL 86 2HG1 VAL 86 11.888 9.750 -4.858 650 HG13 VAL 86 3HG1 VAL 86 11.158 10.434 -3.371 651 HG21 VAL 86 3HG2 VAL 86 10.311 7.844 -4.986 652 HG22 VAL 86 1HG2 VAL 86 8.553 8.071 -4.903 653 HG23 VAL 86 2HG2 VAL 86 9.556 8.365 -3.466 654 H ASP 87 H ASP 87 8.797 12.877 -6.167 655 HA ASP 87 HA ASP 87 9.881 14.929 -4.495 656 HB2 ASP 87 2HB ASP 87 8.518 14.878 -7.228 657 HB3 ASP 87 1HB ASP 87 8.571 16.422 -6.441 658 H ILE 88 H ILE 88 6.306 14.355 -4.969 659 HA ILE 88 HA ILE 88 5.817 16.642 -3.114 660 HB ILE 88 HB ILE 88 3.713 16.629 -2.982 661 HG12 ILE 88 2HG1 ILE 88 2.911 14.033 -4.365 662 HG13 ILE 88 1HG1 ILE 88 3.372 13.974 -2.694 663 HG21 ILE 88 1HG2 ILE 88 4.504 17.266 -5.316 664 HG22 ILE 88 2HG2 ILE 88 2.777 16.842 -5.223 665 HG23 ILE 88 3HG2 ILE 88 3.949 15.688 -5.889 666 HD11 ILE 88 3HD1 ILE 88 1.174 14.504 -2.230 667 HD12 ILE 88 1HD1 ILE 88 0.894 15.233 -3.829 668 HD13 ILE 88 2HD1 ILE 88 1.641 16.166 -2.501 669 H ALA 89 H ALA 89 6.155 13.192 -2.398 670 HA ALA 89 HA ALA 89 5.421 13.483 0.482 671 HB1 ALA 89 3HB ALA 89 7.193 11.408 -0.952 672 HB2 ALA 89 1HB ALA 89 5.480 11.224 -0.495 673 HB3 ALA 89 2HB ALA 89 6.725 11.340 0.759 674 H ALA 90 H ALA 90 8.653 13.590 -1.123 675 HA ALA 90 HA ALA 90 10.066 14.556 1.305 676 HB1 ALA 90 3HB ALA 90 10.746 14.554 -1.713 677 HB2 ALA 90 1HB ALA 90 11.207 13.341 -0.498 678 HB3 ALA 90 2HB ALA 90 11.912 14.975 -0.451 679 H SER 91 H SER 91 8.091 16.328 -0.838 680 HA SER 91 HA SER 91 9.257 19.054 -0.198 681 HG SER 91 HG SER 91 8.281 17.730 -2.909 682 HB2 SER 91 2HB SER 91 6.589 18.291 -1.543 683 HB3 SER 91 1HB SER 91 7.233 19.931 -1.430 684 H LEU 92 H LEU 92 6.850 16.952 1.243 685 HA LEU 92 HA LEU 92 5.679 19.252 2.846 686 HG LEU 92 HG LEU 92 5.040 15.875 1.439 687 HB2 LEU 92 2HB LEU 92 3.861 17.729 3.594 688 HB3 LEU 92 1HB LEU 92 3.936 18.242 1.938 689 HD11 LEU 92 1HD1 LEU 92 3.633 15.263 4.112 690 HD12 LEU 92 2HD1 LEU 92 5.365 15.088 3.745 691 HD13 LEU 92 3HD1 LEU 92 4.202 14.067 2.912 692 HD21 LEU 92 3HD2 LEU 92 2.030 16.077 2.103 693 HD22 LEU 92 1HD2 LEU 92 2.811 14.905 1.015 694 HD23 LEU 92 2HD2 LEU 92 2.786 16.615 0.578 695 H ASP 93 H ASP 93 7.109 16.099 3.738 696 HA ASP 93 HA ASP 93 9.275 16.908 5.046 697 HB2 ASP 93 2HB ASP 93 7.164 17.511 7.159 698 HB3 ASP 93 1HB ASP 93 8.622 16.732 7.692 699 H ALA 94 H ALA 94 9.846 14.827 4.322 700 HA ALA 94 HA ALA 94 9.558 12.642 6.340 701 HB1 ALA 94 3HB ALA 94 8.406 10.980 4.846 702 HB2 ALA 94 1HB ALA 94 8.232 12.218 3.570 703 HB3 ALA 94 2HB ALA 94 7.384 12.394 5.124 704 H GLU 95 H GLU 95 10.991 11.012 6.215 705 HA GLU 95 HA GLU 95 13.115 11.012 4.042 706 HB2 GLU 95 2HB GLU 95 13.425 8.971 6.225 707 HB3 GLU 95 1HB GLU 95 14.599 9.794 5.229 708 HG2 GLU 95 2HG GLU 95 14.243 11.910 6.724 709 HG3 GLU 95 1HG GLU 95 13.225 10.896 7.746 710 H THR 96 H THR 96 11.249 8.301 5.639 711 HA THR 96 HA THR 96 10.938 6.937 2.951 712 HB THR 96 HB THR 96 9.771 5.108 4.352 713 HG1 THR 96 HG1 THR 96 9.241 6.213 6.202 714 HG21 THR 96 3HG2 THR 96 11.814 4.167 5.309 715 HG22 THR 96 1HG2 THR 96 12.670 5.717 5.149 716 HG23 THR 96 2HG2 THR 96 12.157 4.828 3.692 717 H ALA 97 H ALA 97 8.927 6.089 2.264 718 HA ALA 97 HA ALA 97 6.361 7.169 3.466 719 HB1 ALA 97 3HB ALA 97 7.206 7.646 0.519 720 HB2 ALA 97 1HB ALA 97 6.713 8.830 1.743 721 HB3 ALA 97 2HB ALA 97 5.506 7.730 1.031 722 H TYR 98 H TYR 98 4.404 6.074 2.436 723 HA TYR 98 HA TYR 98 4.964 3.146 1.783 724 HD1 TYR 98 HD1 TYR 98 5.073 0.926 3.784 725 HD2 TYR 98 HD2 TYR 98 4.652 4.774 5.587 726 HE1 TYR 98 HE1 TYR 98 6.939 0.412 5.313 727 HE2 TYR 98 HE2 TYR 98 6.402 4.215 7.211 728 HH TYR 98 HH TYR 98 8.113 2.855 7.590 729 HB2 TYR 98 2HB TYR 98 3.049 4.112 3.978 730 HB3 TYR 98 1HB TYR 98 3.018 2.480 3.364 731 H VAL 99 H VAL 99 2.822 1.954 1.215 732 HA VAL 99 HA VAL 99 0.940 3.658 -0.486 733 HB VAL 99 HB VAL 99 1.870 3.334 -2.403 734 HG11 VAL 99 1HG1 VAL 99 3.945 2.352 -3.041 735 HG12 VAL 99 2HG1 VAL 99 4.074 1.504 -1.502 736 HG13 VAL 99 3HG1 VAL 99 4.092 3.250 -1.532 737 HG21 VAL 99 3HG2 VAL 99 0.384 1.492 -2.887 738 HG22 VAL 99 1HG2 VAL 99 1.611 0.339 -2.366 739 HG23 VAL 99 2HG2 VAL 99 1.902 1.316 -3.801 740 H ILE 100 H ILE 100 -1.017 2.981 0.650 741 HA ILE 100 HA ILE 100 -1.596 0.225 1.115 742 HB ILE 100 HB ILE 100 -4.015 1.926 0.366 743 HG12 ILE 100 2HG1 ILE 100 -3.097 3.306 2.007 744 HG13 ILE 100 1HG1 ILE 100 -4.262 2.321 2.867 745 HG21 ILE 100 1HG2 ILE 100 -5.201 0.394 2.007 746 HG22 ILE 100 2HG2 ILE 100 -3.678 -0.473 2.282 747 HG23 ILE 100 3HG2 ILE 100 -4.470 -0.547 0.692 748 HD11 ILE 100 3HD1 ILE 100 -2.500 0.903 3.869 749 HD12 ILE 100 1HD1 ILE 100 -2.075 2.644 4.142 750 HD13 ILE 100 2HD1 ILE 100 -1.228 1.697 2.918 751 H GLY 101 H GLY 101 -2.400 1.777 -1.817 752 HA2 GLY 101 2HA GLY 101 -2.295 0.910 -3.980 753 HA3 GLY 101 1HA GLY 101 -1.607 -0.529 -3.390 754 H GLY 102 H GLY 102 -2.648 -1.951 -4.915 755 HA2 GLY 102 2HA GLY 102 -4.769 -0.049 -6.051 756 HA3 GLY 102 1HA GLY 102 -3.176 -0.316 -6.626 757 H ALA 103 H ALA 103 -6.399 -1.515 -7.184 758 HA ALA 103 HA ALA 103 -6.186 -2.749 -9.594 759 HB1 ALA 103 3HB ALA 103 -8.071 -1.139 -8.673 760 HB2 ALA 103 1HB ALA 103 -7.869 -0.994 -10.402 761 HB3 ALA 103 2HB ALA 103 -7.208 0.210 -9.332 762 H ALA 104 H ALA 104 -4.893 0.585 -9.609 763 HA ALA 104 HA ALA 104 -3.006 -0.204 -11.906 764 HB1 ALA 104 3HB ALA 104 -2.676 2.212 -12.312 765 HB2 ALA 104 1HB ALA 104 -3.789 2.618 -10.977 766 HB3 ALA 104 2HB ALA 104 -4.406 1.765 -12.433 767 H ILE 105 H ILE 105 -3.003 0.615 -8.483 768 HA ILE 105 HA ILE 105 -0.402 1.963 -8.532 769 HB ILE 105 HB ILE 105 -1.506 1.001 -5.938 770 HG12 ILE 105 2HG1 ILE 105 -3.525 1.998 -6.732 771 HG13 ILE 105 1HG1 ILE 105 -2.769 3.089 -5.658 772 HG21 ILE 105 1HG2 ILE 105 -0.483 2.962 -4.976 773 HG22 ILE 105 2HG2 ILE 105 0.017 3.601 -6.534 774 HG23 ILE 105 3HG2 ILE 105 0.757 2.121 -5.904 775 HD11 ILE 105 3HD1 ILE 105 -1.951 3.674 -8.525 776 HD12 ILE 105 1HD1 ILE 105 -2.776 4.739 -7.370 777 HD13 ILE 105 2HD1 ILE 105 -3.719 3.555 -8.316 778 H TYR 106 H TYR 106 -0.831 -1.052 -6.435 779 HA TYR 106 HA TYR 106 1.982 -1.771 -6.445 780 HD1 TYR 106 HD1 TYR 106 2.701 -4.626 -5.017 781 HD2 TYR 106 HD2 TYR 106 -0.710 -2.371 -3.684 782 HE1 TYR 106 HE1 TYR 106 3.226 -5.170 -2.700 783 HE2 TYR 106 HE2 TYR 106 -0.101 -2.857 -1.336 784 HH TYR 106 HH TYR 106 2.646 -4.110 -0.305 785 HB2 TYR 106 2HB TYR 106 -0.605 -3.355 -6.024 786 HB3 TYR 106 1HB TYR 106 0.794 -4.268 -6.449 787 H ALA 107 H ALA 107 -0.346 -2.445 -9.080 788 HA ALA 107 HA ALA 107 1.483 -4.089 -10.725 789 HB1 ALA 107 3HB ALA 107 -1.009 -2.387 -11.398 790 HB2 ALA 107 1HB ALA 107 -1.008 -4.105 -10.991 791 HB3 ALA 107 2HB ALA 107 -0.281 -3.563 -12.505 792 H LEU 108 H LEU 108 0.892 -0.542 -10.761 793 HA LEU 108 HA LEU 108 3.181 -0.168 -12.687 794 HG LEU 108 HG LEU 108 1.953 2.255 -10.115 795 HB2 LEU 108 2HB LEU 108 2.567 1.917 -13.076 796 HB3 LEU 108 1HB LEU 108 1.023 1.321 -12.576 797 HD11 LEU 108 1HD1 LEU 108 3.307 4.245 -10.359 798 HD12 LEU 108 2HD1 LEU 108 3.091 4.326 -12.117 799 HD13 LEU 108 3HD1 LEU 108 4.126 3.081 -11.398 800 HD21 LEU 108 3HD2 LEU 108 0.532 3.909 -12.263 801 HD22 LEU 108 1HD2 LEU 108 0.683 4.352 -10.544 802 HD23 LEU 108 2HD2 LEU 108 -0.230 2.908 -10.981 803 H PHE 109 H PHE 109 2.766 0.360 -9.175 804 HA PHE 109 HA PHE 109 5.435 1.449 -8.812 805 HD1 PHE 109 HD2 PHE 109 6.635 2.037 -6.200 806 HD2 PHE 109 HD1 PHE 109 2.567 3.083 -7.098 807 HE1 PHE 109 HE2 PHE 109 7.176 4.381 -5.875 808 HE2 PHE 109 HE1 PHE 109 3.129 5.471 -6.702 809 HZ PHE 109 HZ PHE 109 5.453 6.117 -6.150 810 HB2 PHE 109 2HB PHE 109 3.137 0.769 -6.987 811 HB3 PHE 109 1HB PHE 109 4.599 0.281 -6.231 812 H GLN 110 H GLN 110 4.525 -1.943 -8.708 813 HA GLN 110 HA GLN 110 6.399 -3.180 -7.161 814 HB2 GLN 110 2HB GLN 110 6.280 -5.168 -8.574 815 HB3 GLN 110 1HB GLN 110 4.752 -4.403 -8.256 816 HG2 GLN 110 2HG GLN 110 4.854 -3.337 -10.607 817 HG3 GLN 110 1HG GLN 110 6.287 -4.310 -10.929 818 HE21 GLN 110 1HE2 GLN 110 5.277 -5.423 -12.572 819 HE22 GLN 110 2HE2 GLN 110 4.012 -6.697 -12.158 820 HA PRO 111 HA PRO 111 10.529 -3.094 -9.528 821 HB2 PRO 111 2HB PRO 111 10.595 -1.068 -11.644 822 HB3 PRO 111 1HB PRO 111 10.753 -2.826 -11.795 823 HG2 PRO 111 2HG PRO 111 8.538 -1.404 -12.801 824 HG3 PRO 111 1HG PRO 111 8.496 -3.121 -12.327 825 HD2 PRO 111 2HD PRO 111 7.707 -0.694 -10.601 826 HD3 PRO 111 1HD PRO 111 6.748 -2.127 -10.929 827 H HIS 112 H HIS 112 8.817 -0.343 -8.471 828 HA HIS 112 HA HIS 112 11.317 1.417 -8.115 829 HD1 HIS 112 HD1 HIS 112 11.150 3.555 -10.388 830 HD2 HIS 112 HD2 HIS 112 7.267 1.808 -10.412 831 HE1 HIS 112 HE1 HIS 112 10.120 3.709 -12.768 832 HB2 HIS 112 2HB HIS 112 8.357 2.267 -8.037 833 HB3 HIS 112 1HB HIS 112 9.756 3.306 -8.022 834 H LEU 113 H LEU 113 9.517 -0.613 -6.090 835 HA LEU 113 HA LEU 113 9.466 1.211 -3.685 836 HG LEU 113 HG LEU 113 6.895 -1.377 -2.696 837 HB2 LEU 113 2HB LEU 113 9.171 -1.873 -3.828 838 HB3 LEU 113 1HB LEU 113 9.006 -0.908 -2.377 839 HD11 LEU 113 1HD1 LEU 113 5.628 0.677 -3.562 840 HD12 LEU 113 2HD1 LEU 113 7.177 1.309 -4.145 841 HD13 LEU 113 3HD1 LEU 113 6.929 1.047 -2.409 842 HD21 LEU 113 3HD2 LEU 113 7.089 -1.030 -5.713 843 HD22 LEU 113 1HD2 LEU 113 5.606 -1.521 -4.826 844 HD23 LEU 113 2HD2 LEU 113 7.055 -2.572 -4.846 845 H ASP 114 H ASP 114 10.801 1.157 -1.844 846 HA ASP 114 HA ASP 114 13.305 -0.497 -1.629 847 HB2 ASP 114 2HB ASP 114 13.181 1.517 -0.316 848 HB3 ASP 114 1HB ASP 114 11.607 1.140 0.342 849 H ARG 115 H ARG 115 10.165 -0.894 0.056 850 HA ARG 115 HA ARG 115 10.391 -3.927 -0.343 851 HE ARG 115 HE ARG 115 13.847 -3.809 2.915 852 HB2 ARG 115 2HB ARG 115 9.843 -2.231 2.162 853 HB3 ARG 115 1HB ARG 115 9.370 -3.928 2.133 854 HG2 ARG 115 2HG ARG 115 11.619 -4.702 2.022 855 HG3 ARG 115 1HG ARG 115 12.232 -3.148 1.421 856 HD2 ARG 115 2HD ARG 115 11.752 -2.058 3.641 857 HD3 ARG 115 1HD ARG 115 11.180 -3.612 4.291 858 HH11 ARG 115 2HH1 ARG 115 12.443 -2.976 5.861 859 HH12 ARG 115 1HH1 ARG 115 13.780 -3.785 6.827 860 HH21 ARG 115 1HH2 ARG 115 15.092 -4.890 4.060 861 HH22 ARG 115 2HH2 ARG 115 15.317 -4.596 5.806 862 H MET 116 H MET 116 8.592 -5.239 -0.156 863 HA MET 116 HA MET 116 5.804 -3.961 -0.622 864 HB2 MET 116 2HB MET 116 7.137 -6.377 -1.886 865 HB3 MET 116 1HB MET 116 5.389 -6.315 -1.777 866 HG2 MET 116 2HG MET 116 5.338 -4.427 -3.327 867 HG3 MET 116 1HG MET 116 7.042 -4.032 -3.026 868 HE1 MET 116 3HE MET 116 4.936 -5.365 -5.762 869 HE2 MET 116 1HE MET 116 4.531 -6.654 -4.578 870 HE3 MET 116 2HE MET 116 5.461 -7.048 -6.054 871 H VAL 117 H VAL 117 5.388 -3.802 1.535 872 HA VAL 117 HA VAL 117 5.149 -6.119 3.424 873 HB VAL 117 HB VAL 117 4.454 -3.154 3.549 874 HG11 VAL 117 1HG1 VAL 117 4.479 -5.044 5.994 875 HG12 VAL 117 2HG1 VAL 117 2.995 -4.429 5.268 876 HG13 VAL 117 3HG1 VAL 117 4.086 -3.285 5.973 877 HG21 VAL 117 3HG2 VAL 117 6.433 -2.870 4.978 878 HG22 VAL 117 1HG2 VAL 117 6.968 -3.798 3.566 879 HG23 VAL 117 2HG2 VAL 117 6.686 -4.620 5.100 880 H LEU 118 H LEU 118 3.821 -7.276 1.714 881 HA LEU 118 HA LEU 118 0.856 -6.720 1.727 882 HG LEU 118 HG LEU 118 0.263 -9.875 0.694 883 HB2 LEU 118 2HB LEU 118 0.998 -7.630 -0.238 884 HB3 LEU 118 1HB LEU 118 2.657 -8.092 -0.054 885 HD11 LEU 118 1HD1 LEU 118 0.361 -9.500 -1.737 886 HD12 LEU 118 2HD1 LEU 118 0.916 -11.139 -1.374 887 HD13 LEU 118 3HD1 LEU 118 2.115 -9.887 -1.775 888 HD21 LEU 118 3HD2 LEU 118 3.308 -10.369 0.757 889 HD22 LEU 118 1HD2 LEU 118 2.194 -11.712 0.493 890 HD23 LEU 118 2HD2 LEU 118 1.991 -10.739 1.930 891 H SER 119 H SER 119 -0.742 -8.338 2.316 892 HA SER 119 HA SER 119 -0.066 -9.972 4.800 893 HG SER 119 HG SER 119 -1.073 -6.962 3.975 894 HB2 SER 119 2HB SER 119 -2.440 -8.727 5.621 895 HB3 SER 119 1HB SER 119 -0.809 -8.362 6.155 896 H ARG 120 H ARG 120 -0.945 -11.916 4.790 897 HA ARG 120 HA ARG 120 -2.904 -12.591 2.539 898 HE ARG 120 HE ARG 120 0.903 -14.959 -0.097 899 HB2 ARG 120 2HB ARG 120 -1.116 -14.492 4.091 900 HB3 ARG 120 1HB ARG 120 -2.041 -14.891 2.673 901 HG2 ARG 120 2HG ARG 120 0.290 -12.842 2.690 902 HG3 ARG 120 1HG ARG 120 0.536 -14.534 2.458 903 HD2 ARG 120 2HD ARG 120 -1.520 -13.171 0.595 904 HD3 ARG 120 1HD ARG 120 0.131 -12.689 0.420 905 HH11 ARG 120 2HH1 ARG 120 -2.583 -14.783 0.065 906 HH12 ARG 120 1HH1 ARG 120 -2.777 -16.394 -0.755 907 HH21 ARG 120 1HH2 ARG 120 0.656 -16.755 -0.950 908 HH22 ARG 120 2HH2 ARG 120 -0.989 -17.488 -1.276 909 H VAL 121 H VAL 121 -5.018 -12.849 3.111 910 HA VAL 121 HA VAL 121 -5.783 -13.328 5.981 911 HB VAL 121 HB VAL 121 -7.656 -12.564 3.713 912 HG11 VAL 121 1HG1 VAL 121 -7.953 -11.857 6.697 913 HG12 VAL 121 2HG1 VAL 121 -8.747 -13.253 5.934 914 HG13 VAL 121 3HG1 VAL 121 -9.123 -11.613 5.390 915 HG21 VAL 121 3HG2 VAL 121 -6.331 -10.685 3.470 916 HG22 VAL 121 1HG2 VAL 121 -5.667 -10.737 5.119 917 HG23 VAL 121 2HG2 VAL 121 -7.298 -10.110 4.810 918 HA PRO 122 HA PRO 122 -7.088 -17.662 4.825 919 HB2 PRO 122 2HB PRO 122 -7.783 -17.807 7.792 920 HB3 PRO 122 1HB PRO 122 -6.870 -18.946 6.790 921 HG2 PRO 122 2HG PRO 122 -5.574 -17.271 8.530 922 HG3 PRO 122 1HG PRO 122 -4.869 -17.596 6.925 923 HD2 PRO 122 2HD PRO 122 -6.439 -15.124 7.792 924 HD3 PRO 122 1HD PRO 122 -4.970 -15.285 6.774 925 H GLY 123 H GLY 123 -9.101 -15.780 4.250 926 HA2 GLY 123 2HA GLY 123 -11.561 -17.612 4.635 927 HA3 GLY 123 1HA GLY 123 -11.813 -15.882 4.510 928 H GLU 124 H GLU 124 -12.868 -15.876 2.584 929 HA GLU 124 HA GLU 124 -11.456 -16.482 0.035 930 HB2 GLU 124 2HB GLU 124 -13.427 -18.066 -0.726 931 HB3 GLU 124 1HB GLU 124 -12.049 -18.664 0.136 932 HG2 GLU 124 2HG GLU 124 -13.242 -19.497 1.865 933 HG3 GLU 124 1HG GLU 124 -14.180 -18.029 2.111 934 H TYR 125 H TYR 125 -12.174 -15.172 -1.600 935 HA TYR 125 HA TYR 125 -14.708 -13.552 -1.351 936 HD1 TYR 125 HD1 TYR 125 -15.195 -11.253 0.695 937 HD2 TYR 125 HD2 TYR 125 -11.383 -13.126 1.270 938 HE1 TYR 125 HE1 TYR 125 -15.478 -11.091 3.148 939 HE2 TYR 125 HE2 TYR 125 -11.686 -12.979 3.717 940 HH TYR 125 HH TYR 125 -12.974 -12.350 5.335 941 HB2 TYR 125 2HB TYR 125 -11.946 -12.225 -0.917 942 HB3 TYR 125 1HB TYR 125 -13.412 -11.339 -1.170 943 H GLU 126 H GLU 126 -14.966 -14.255 -3.655 944 HA GLU 126 HA GLU 126 -13.577 -13.909 -5.786 945 HB2 GLU 126 2HB GLU 126 -16.325 -12.599 -6.068 946 HB3 GLU 126 1HB GLU 126 -15.395 -13.483 -7.253 947 HG2 GLU 126 2HG GLU 126 -16.768 -14.806 -4.823 948 HG3 GLU 126 1HG GLU 126 -17.376 -14.774 -6.472 949 H GLY 127 H GLY 127 -15.168 -10.853 -4.865 950 HA2 GLY 127 2HA GLY 127 -13.981 -8.699 -4.627 951 HA3 GLY 127 1HA GLY 127 -12.621 -9.355 -5.501 952 H ASP 128 H ASP 128 -13.580 -6.788 -5.715 953 HA ASP 128 HA ASP 128 -13.938 -6.683 -8.766 954 HB2 ASP 128 2HB ASP 128 -14.542 -4.425 -6.736 955 HB3 ASP 128 1HB ASP 128 -14.463 -4.225 -8.472 956 H THR 129 H THR 129 -11.780 -5.822 -6.099 957 HA THR 129 HA THR 129 -9.828 -4.501 -8.047 958 HB THR 129 HB THR 129 -9.249 -4.551 -5.043 959 HG1 THR 129 HG1 THR 129 -11.297 -3.831 -5.061 960 HG21 THR 129 3HG2 THR 129 -8.138 -2.462 -5.455 961 HG22 THR 129 1HG2 THR 129 -8.935 -2.245 -7.029 962 HG23 THR 129 2HG2 THR 129 -7.658 -3.478 -6.851 963 H TYR 130 H TYR 130 -8.295 -5.817 -8.799 964 HA TYR 130 HA TYR 130 -7.329 -8.214 -7.196 965 HD1 TYR 130 HD1 TYR 130 -9.880 -7.325 -10.234 966 HD2 TYR 130 HD2 TYR 130 -8.007 -10.846 -8.633 967 HE1 TYR 130 HE1 TYR 130 -11.924 -8.626 -10.682 968 HE2 TYR 130 HE2 TYR 130 -10.072 -12.130 -9.077 969 HH TYR 130 HH TYR 130 -12.643 -11.358 -9.098 970 HB2 TYR 130 2HB TYR 130 -7.259 -7.607 -10.202 971 HB3 TYR 130 1HB TYR 130 -6.589 -9.030 -9.444 972 H TYR 131 H TYR 131 -5.364 -8.542 -6.615 973 HA TYR 131 HA TYR 131 -3.230 -6.452 -6.851 974 HD1 TYR 131 HD2 TYR 131 -1.130 -9.688 -5.711 975 HD2 TYR 131 HD1 TYR 131 -2.236 -6.179 -3.508 976 HE1 TYR 131 HE2 TYR 131 1.182 -9.468 -4.948 977 HE2 TYR 131 HE1 TYR 131 0.027 -6.132 -2.519 978 HH TYR 131 HH TYR 131 2.149 -7.145 -2.489 979 HB2 TYR 131 2HB TYR 131 -3.952 -7.549 -4.710 980 HB3 TYR 131 1HB TYR 131 -3.521 -9.111 -5.289 981 HA PRO 132 HA PRO 132 -0.887 -8.732 -10.089 982 HB2 PRO 132 2HB PRO 132 1.756 -7.663 -9.291 983 HB3 PRO 132 1HB PRO 132 0.733 -7.228 -10.666 984 HG2 PRO 132 2HG PRO 132 1.191 -5.555 -8.496 985 HG3 PRO 132 1HG PRO 132 -0.242 -5.454 -9.529 986 HD2 PRO 132 2HD PRO 132 -0.052 -6.690 -6.772 987 HD3 PRO 132 1HD PRO 132 -1.356 -5.719 -7.524 988 H GLU 133 H GLU 133 1.293 -10.053 -10.482 989 HA GLU 133 HA GLU 133 1.389 -12.260 -8.430 990 HB2 GLU 133 2HB GLU 133 2.829 -13.523 -10.024 991 HB3 GLU 133 1HB GLU 133 1.189 -13.253 -10.464 992 HG2 GLU 133 2HG GLU 133 2.684 -11.163 -11.817 993 HG3 GLU 133 1HG GLU 133 3.656 -12.610 -11.924 994 H TRP 134 H TRP 134 3.410 -13.173 -7.792 995 HA TRP 134 HA TRP 134 5.484 -11.094 -6.995 996 HD1 TRP 134 HD1 TRP 134 5.102 -15.163 -5.392 997 HE1 TRP 134 HE1 TRP 134 2.900 -16.548 -4.950 998 HE3 TRP 134 HE3 TRP 134 2.183 -11.224 -4.018 999 HZ2 TRP 134 HZ2 TRP 134 0.315 -15.861 -4.015 1000 HZ3 TRP 134 HZ3 TRP 134 -0.190 -11.622 -3.481 1001 HH2 TRP 134 HH2 TRP 134 -1.114 -13.919 -3.441 1002 HB2 TRP 134 2HB TRP 134 5.774 -12.254 -4.764 1003 HB3 TRP 134 1HB TRP 134 4.348 -11.287 -4.961 1004 H ASP 135 H ASP 135 7.569 -11.672 -7.172 1005 HA ASP 135 HA ASP 135 8.194 -14.337 -8.539 1006 HB2 ASP 135 2HB ASP 135 8.755 -11.375 -9.211 1007 HB3 ASP 135 1HB ASP 135 10.010 -12.505 -9.588 1008 H ALA 136 H ALA 136 10.794 -14.152 -8.721 1009 HA ALA 136 HA ALA 136 11.840 -14.392 -5.807 1010 HB1 ALA 136 3HB ALA 136 12.318 -16.441 -8.086 1011 HB2 ALA 136 1HB ALA 136 10.979 -16.580 -6.908 1012 HB3 ALA 136 2HB ALA 136 12.666 -16.650 -6.346 1013 H ALA 137 H ALA 137 12.827 -13.409 -8.930 1014 HA ALA 137 HA ALA 137 15.673 -12.887 -7.932 1015 HB1 ALA 137 3HB ALA 137 14.695 -12.998 -10.862 1016 HB2 ALA 137 1HB ALA 137 15.691 -14.219 -10.028 1017 HB3 ALA 137 2HB ALA 137 16.336 -12.585 -10.328 1018 H GLU 138 H GLU 138 12.925 -11.142 -9.539 1019 HA GLU 138 HA GLU 138 13.759 -8.560 -9.019 1020 HB2 GLU 138 2HB GLU 138 11.013 -9.952 -9.059 1021 HB3 GLU 138 1HB GLU 138 11.148 -8.247 -8.871 1022 HG2 GLU 138 2HG GLU 138 10.680 -9.138 -11.240 1023 HG3 GLU 138 1HG GLU 138 11.840 -7.840 -11.121 1024 H TRP 139 H TRP 139 11.915 -10.488 -6.566 1025 HA TRP 139 HA TRP 139 13.056 -8.770 -4.334 1026 HD1 TRP 139 HD1 TRP 139 8.758 -10.648 -4.727 1027 HE1 TRP 139 HE1 TRP 139 7.188 -10.132 -6.864 1028 HE3 TRP 139 HE3 TRP 139 10.983 -6.327 -6.104 1029 HZ2 TRP 139 HZ2 TRP 139 7.279 -8.210 -8.872 1030 HZ3 TRP 139 HZ3 TRP 139 10.260 -5.186 -8.191 1031 HH2 TRP 139 HH2 TRP 139 8.429 -6.121 -9.558 1032 HB2 TRP 139 2HB TRP 139 10.553 -8.996 -3.251 1033 HB3 TRP 139 1HB TRP 139 11.165 -7.612 -4.084 1034 H GLU 140 H GLU 140 13.456 -9.627 -2.439 1035 HA GLU 140 HA GLU 140 13.162 -12.637 -1.980 1036 HB2 GLU 140 2HB GLU 140 15.408 -12.496 -1.846 1037 HB3 GLU 140 1HB GLU 140 15.455 -10.777 -1.907 1038 HG2 GLU 140 2HG GLU 140 16.463 -10.842 0.096 1039 HG3 GLU 140 1HG GLU 140 14.917 -11.152 0.841 1040 H LEU 141 H LEU 141 13.317 -12.961 0.634 1041 HA LEU 141 HA LEU 141 10.660 -11.740 1.607 1042 HG LEU 141 HG LEU 141 9.645 -15.110 2.847 1043 HB2 LEU 141 2HB LEU 141 11.418 -14.439 1.266 1044 HB3 LEU 141 1HB LEU 141 11.809 -14.202 2.919 1045 HD11 LEU 141 1HD1 LEU 141 9.018 -12.135 3.320 1046 HD12 LEU 141 2HD1 LEU 141 9.732 -13.246 4.504 1047 HD13 LEU 141 3HD1 LEU 141 8.097 -13.552 3.897 1048 HD21 LEU 141 3HD2 LEU 141 7.761 -14.363 1.406 1049 HD22 LEU 141 1HD2 LEU 141 9.184 -14.777 0.444 1050 HD23 LEU 141 2HD2 LEU 141 8.775 -13.076 0.695 1051 H ASP 142 H ASP 142 11.152 -9.966 2.957 1052 HA ASP 142 HA ASP 142 13.664 -9.817 4.626 1053 HB2 ASP 142 2HB ASP 142 12.413 -7.838 3.319 1054 HB3 ASP 142 1HB ASP 142 11.405 -7.760 4.735 1055 H ALA 143 H ALA 143 10.101 -9.987 5.263 1056 HA ALA 143 HA ALA 143 10.688 -11.539 7.780 1057 HB1 ALA 143 3HB ALA 143 10.701 -9.118 8.542 1058 HB2 ALA 143 1HB ALA 143 9.343 -10.011 9.277 1059 HB3 ALA 143 2HB ALA 143 9.058 -8.892 7.915 1060 H GLU 144 H GLU 144 9.229 -13.021 8.310 1061 HA GLU 144 HA GLU 144 6.351 -12.877 7.207 1062 HB2 GLU 144 2HB GLU 144 8.000 -14.612 6.201 1063 HB3 GLU 144 1HB GLU 144 7.939 -15.454 7.752 1064 HG2 GLU 144 2HG GLU 144 5.389 -15.687 7.468 1065 HG3 GLU 144 1HG GLU 144 5.509 -14.820 5.939 1066 H THR 145 H THR 145 4.885 -12.581 8.797 1067 HA THR 145 HA THR 145 5.303 -13.929 11.479 1068 HB THR 145 HB THR 145 5.049 -12.202 12.964 1069 HG1 THR 145 HG1 THR 145 4.421 -10.477 10.831 1070 HG21 THR 145 3HG2 THR 145 7.383 -12.037 11.969 1071 HG22 THR 145 1HG2 THR 145 6.780 -10.467 12.575 1072 HG23 THR 145 2HG2 THR 145 6.785 -10.817 10.832 1073 H ASP 146 H ASP 146 3.521 -14.673 12.513 1074 HA ASP 146 HA ASP 146 0.838 -14.511 11.332 1075 HB2 ASP 146 2HB ASP 146 2.029 -15.641 13.941 1076 HB3 ASP 146 1HB ASP 146 0.296 -15.502 13.795 1077 H HIS 147 H HIS 147 -0.824 -13.161 11.673 1078 HA HIS 147 HA HIS 147 -0.868 -11.199 14.026 1079 HD1 HIS 147 HD1 HIS 147 1.604 -10.685 13.250 1080 HD2 HIS 147 HD2 HIS 147 -0.582 -7.337 11.797 1081 HE1 HIS 147 HE1 HIS 147 3.029 -8.546 13.460 1082 HB2 HIS 147 2HB HIS 147 -0.830 -10.581 11.011 1083 HB3 HIS 147 1HB HIS 147 -1.917 -9.649 11.960 1084 H GLU 148 H GLU 148 -3.090 -9.999 14.061 1085 HA GLU 148 HA GLU 148 -5.108 -12.112 14.621 1086 HB2 GLU 148 2HB GLU 148 -5.700 -9.117 14.593 1087 HB3 GLU 148 1HB GLU 148 -6.672 -10.393 15.270 1088 HG2 GLU 148 2HG GLU 148 -4.229 -10.640 16.756 1089 HG3 GLU 148 1HG GLU 148 -4.413 -8.907 16.521 1090 H GLY 149 H GLY 149 -5.985 -13.069 12.940 1091 HA2 GLY 149 2HA GLY 149 -7.754 -13.320 11.170 1092 HA3 GLY 149 1HA GLY 149 -7.721 -11.609 10.865 1093 H PHE 150 H PHE 150 -4.504 -12.460 10.724 1094 HA PHE 150 HA PHE 150 -4.327 -13.601 7.978 1095 HD1 PHE 150 HD1 PHE 150 -1.736 -10.356 7.565 1096 HD2 PHE 150 HD2 PHE 150 -5.619 -9.607 9.217 1097 HE1 PHE 150 HE1 PHE 150 -0.855 -8.365 8.728 1098 HE2 PHE 150 HE2 PHE 150 -4.730 -7.677 10.435 1099 HZ PHE 150 HZ PHE 150 -2.343 -7.048 10.217 1100 HB2 PHE 150 2HB PHE 150 -3.757 -11.606 6.729 1101 HB3 PHE 150 1HB PHE 150 -5.303 -11.346 7.456 1102 H THR 151 H THR 151 -2.155 -13.715 7.137 1103 HA THR 151 HA THR 151 0.023 -13.347 9.238 1104 HB THR 151 HB THR 151 0.133 -15.543 8.442 1105 HG1 THR 151 HG1 THR 151 2.079 -14.171 8.781 1106 HG21 THR 151 3HG2 THR 151 0.738 -14.511 5.597 1107 HG22 THR 151 1HG2 THR 151 -0.723 -15.451 6.080 1108 HG23 THR 151 2HG2 THR 151 0.899 -16.180 6.171 1109 H LEU 152 H LEU 152 1.219 -11.730 9.226 1110 HA LEU 152 HA LEU 152 1.410 -9.542 7.177 1111 HG LEU 152 HG LEU 152 3.255 -7.739 10.027 1112 HB2 LEU 152 2HB LEU 152 1.441 -9.011 9.530 1113 HB3 LEU 152 1HB LEU 152 2.676 -10.178 9.895 1114 HD11 LEU 152 1HD1 LEU 152 5.073 -9.602 9.770 1115 HD12 LEU 152 2HD1 LEU 152 5.577 -7.959 9.346 1116 HD13 LEU 152 3HD1 LEU 152 5.203 -9.138 8.084 1117 HD21 LEU 152 3HD2 LEU 152 2.128 -7.142 7.723 1118 HD22 LEU 152 1HD2 LEU 152 3.641 -7.646 6.970 1119 HD23 LEU 152 2HD2 LEU 152 3.655 -6.337 8.149 1120 H GLN 153 H GLN 153 2.938 -9.310 5.710 1121 HA GLN 153 HA GLN 153 5.300 -11.247 5.434 1122 HB2 GLN 153 2HB GLN 153 2.682 -11.516 4.282 1123 HB3 GLN 153 1HB GLN 153 3.575 -10.615 3.084 1124 HG2 GLN 153 2HG GLN 153 4.778 -13.234 4.200 1125 HG3 GLN 153 1HG GLN 153 3.385 -13.334 3.176 1126 HE21 GLN 153 1HE2 GLN 153 6.522 -11.597 3.040 1127 HE22 GLN 153 2HE2 GLN 153 6.764 -12.025 1.271 1128 H GLU 154 H GLU 154 7.056 -9.969 5.184 1129 HA GLU 154 HA GLU 154 6.866 -7.289 3.700 1130 HB2 GLU 154 2HB GLU 154 9.083 -7.968 5.670 1131 HB3 GLU 154 1HB GLU 154 8.717 -6.432 4.947 1132 HG2 GLU 154 2HG GLU 154 6.380 -6.616 6.227 1133 HG3 GLU 154 1HG GLU 154 7.148 -7.915 7.108 1134 H TRP 155 H TRP 155 7.491 -7.592 1.634 1135 HA TRP 155 HA TRP 155 9.801 -9.433 0.883 1136 HD1 TRP 155 HD1 TRP 155 5.539 -9.034 -0.132 1137 HE1 TRP 155 HE1 TRP 155 4.474 -11.301 -0.985 1138 HE3 TRP 155 HE3 TRP 155 9.854 -11.056 -1.901 1139 HZ2 TRP 155 HZ2 TRP 155 5.555 -13.609 -2.191 1140 HZ3 TRP 155 HZ3 TRP 155 9.753 -13.274 -3.027 1141 HH2 TRP 155 HH2 TRP 155 7.641 -14.511 -3.171 1142 HB2 TRP 155 2HB TRP 155 7.760 -7.789 -0.686 1143 HB3 TRP 155 1HB TRP 155 9.029 -8.647 -1.519 1144 H VAL 156 H VAL 156 11.916 -8.614 0.562 1145 HA VAL 156 HA VAL 156 12.281 -5.613 0.005 1146 HB VAL 156 HB VAL 156 13.405 -6.377 2.050 1147 HG11 VAL 156 1HG1 VAL 156 15.196 -8.098 0.222 1148 HG12 VAL 156 2HG1 VAL 156 14.120 -8.690 1.502 1149 HG13 VAL 156 3HG1 VAL 156 15.550 -7.730 1.935 1150 HG21 VAL 156 3HG2 VAL 156 15.543 -5.226 1.697 1151 HG22 VAL 156 1HG2 VAL 156 14.270 -4.362 0.797 1152 HG23 VAL 156 2HG2 VAL 156 15.406 -5.415 -0.070 1153 H ARG 157 H ARG 157 12.986 -4.897 -1.908 1154 HA ARG 157 HA ARG 157 13.428 -6.502 -4.321 1155 HE ARG 157 HE ARG 157 12.694 -2.728 -7.998 1156 HB2 ARG 157 2HB ARG 157 14.307 -3.673 -3.500 1157 HB3 ARG 157 1HB ARG 157 14.927 -4.402 -4.968 1158 HG2 ARG 157 2HG ARG 157 12.441 -4.770 -5.731 1159 HG3 ARG 157 1HG ARG 157 11.999 -3.808 -4.326 1160 HD2 ARG 157 2HD ARG 157 12.034 -2.130 -5.868 1161 HD3 ARG 157 1HD ARG 157 13.669 -1.953 -5.302 1162 HH11 ARG 157 2HH1 ARG 157 15.494 -2.750 -6.013 1163 HH12 ARG 157 1HH1 ARG 157 16.626 -3.031 -7.418 1164 HH21 ARG 157 1HH2 ARG 157 13.880 -3.184 -9.515 1165 HH22 ARG 157 2HH2 ARG 157 15.701 -3.300 -9.383 1166 H SER 158 H SER 158 15.154 -7.361 -5.333 1167 HA SER 158 HA SER 158 17.422 -8.503 -4.234 1168 HG SER 158 HG SER 158 16.122 -7.079 -7.388 1169 HB2 SER 158 2HB SER 158 18.311 -8.642 -6.561 1170 HB3 SER 158 1HB SER 158 16.598 -8.986 -6.454 1171 H ALA 159 H ALA 159 17.491 -5.224 -4.028 1172 HA ALA 159 HA ALA 159 20.484 -4.816 -4.538 1173 HB1 ALA 159 3HB ALA 159 19.001 -3.108 -5.587 1174 HB2 ALA 159 1HB ALA 159 19.864 -2.350 -4.224 1175 HB3 ALA 159 2HB ALA 159 18.168 -2.811 -4.032 1176 H SER 160 H SER 160 20.563 -6.423 -2.595 1177 HA SER 160 HA SER 160 20.914 -4.753 -0.028 1178 HG SER 160 HG SER 160 19.119 -6.719 1.946 1179 HB2 SER 160 2HB SER 160 18.912 -6.364 -0.158 1180 HB3 SER 160 1HB SER 160 20.061 -7.712 -0.083 1181 H SER 161 H SER 161 22.394 -5.455 1.535 1182 HA SER 161 HA SER 161 24.642 -7.354 0.793 1183 HG SER 161 HG SER 161 24.609 -5.775 -1.052 1184 HB2 SER 161 2HB SER 161 25.213 -4.331 0.976 1185 HB3 SER 161 1HB SER 161 26.459 -5.571 1.059 1186 H ARG 162 H ARG 162 24.650 -8.529 2.610 1187 HA ARG 162 HA ARG 162 25.534 -7.140 5.179 1188 HE ARG 162 HE ARG 162 23.095 -7.593 9.556 1189 HB2 ARG 162 1HB ARG 162 22.944 -7.585 5.062 1190 HB3 ARG 162 2HB ARG 162 23.311 -9.288 5.195 1191 HG2 ARG 162 1HG ARG 162 24.351 -8.888 7.480 1192 HG3 ARG 162 2HG ARG 162 24.193 -7.132 7.252 1193 HD2 ARG 162 1HD ARG 162 21.650 -7.404 7.056 1194 HD3 ARG 162 2HD ARG 162 21.830 -9.138 7.341 1195 HH11 ARG 162 2HH1 ARG 162 19.855 -8.450 8.430 1196 HH12 ARG 162 1HH1 ARG 162 19.261 -8.319 10.142 1197 HH21 ARG 162 1HH2 ARG 162 22.266 -7.527 11.502 1198 HH22 ARG 162 2HH2 ARG 162 20.489 -7.855 11.665 Start of MODEL 17 1 HA MET 1 HA MET 1 16.337 5.637 1.745 2 H1 MET 1 1H MET 1 15.560 7.860 2.667 3 H2 MET 1 2H MET 1 14.974 7.056 3.946 4 HB2 MET 1 1HB MET 1 14.193 4.712 3.743 5 HB3 MET 1 2HB MET 1 14.861 3.739 2.458 6 HG2 MET 1 1HG MET 1 17.205 3.990 3.521 7 HG3 MET 1 2HG MET 1 16.377 4.638 4.955 8 HE1 MET 1 3HE MET 1 17.594 2.089 6.067 9 HE2 MET 1 1HE MET 1 18.112 1.820 4.366 10 HE3 MET 1 2HE MET 1 17.205 0.547 5.242 11 H GLU 2 H GLU 2 13.419 4.432 1.418 12 HA GLU 2 HA GLU 2 11.948 6.597 0.148 13 HB2 GLU 2 2HB GLU 2 11.930 6.055 -2.189 14 HB3 GLU 2 1HB GLU 2 13.566 6.279 -1.656 15 HG2 GLU 2 2HG GLU 2 13.707 3.636 -1.517 16 HG3 GLU 2 1HG GLU 2 12.230 3.620 -2.489 17 H LEU 3 H LEU 3 10.363 4.479 -1.505 18 HA LEU 3 HA LEU 3 8.513 4.362 0.893 19 HG LEU 3 HG LEU 3 8.751 6.191 -2.228 20 HB2 LEU 3 2HB LEU 3 6.595 4.404 -0.930 21 HB3 LEU 3 1HB LEU 3 7.392 5.784 -0.268 22 HD11 LEU 3 1HD1 LEU 3 8.524 4.828 -4.309 23 HD12 LEU 3 2HD1 LEU 3 7.362 3.721 -3.521 24 HD13 LEU 3 3HD1 LEU 3 9.065 3.776 -3.018 25 HD21 LEU 3 3HD2 LEU 3 6.727 6.656 -3.817 26 HD22 LEU 3 1HD2 LEU 3 6.598 7.276 -2.158 27 HD23 LEU 3 2HD2 LEU 3 5.724 5.798 -2.623 28 H VAL 4 H VAL 4 7.131 2.868 1.446 29 HA VAL 4 HA VAL 4 7.553 0.040 0.407 30 HB VAL 4 HB VAL 4 7.154 1.116 3.226 31 HG11 VAL 4 1HG1 VAL 4 6.259 -1.175 3.225 32 HG12 VAL 4 2HG1 VAL 4 7.852 -1.250 4.033 33 HG13 VAL 4 3HG1 VAL 4 7.650 -1.788 2.357 34 HG21 VAL 4 3HG2 VAL 4 9.374 1.763 2.618 35 HG22 VAL 4 1HG2 VAL 4 9.774 0.175 1.978 36 HG23 VAL 4 2HG2 VAL 4 9.519 0.415 3.732 37 H SER 5 H SER 5 5.787 -1.231 -0.098 38 HA SER 5 HA SER 5 3.065 0.085 0.046 39 HG SER 5 HG SER 5 4.484 -2.657 -2.614 40 HB2 SER 5 2HB SER 5 2.652 -1.491 -1.840 41 HB3 SER 5 1HB SER 5 4.042 -0.503 -2.075 42 H VAL 6 H VAL 6 1.238 -0.646 1.092 43 HA VAL 6 HA VAL 6 1.475 -3.117 2.824 44 HB VAL 6 HB VAL 6 1.245 -2.310 4.860 45 HG11 VAL 6 1HG1 VAL 6 3.449 -1.372 4.083 46 HG12 VAL 6 2HG1 VAL 6 2.730 -0.312 5.298 47 HG13 VAL 6 3HG1 VAL 6 2.648 0.106 3.589 48 HG21 VAL 6 3HG2 VAL 6 -0.823 -0.922 4.771 49 HG22 VAL 6 1HG2 VAL 6 0.179 0.428 4.145 50 HG23 VAL 6 2HG2 VAL 6 0.444 -0.204 5.762 51 H ALA 7 H ALA 7 0.065 -4.132 1.242 52 HA ALA 7 HA ALA 7 -2.923 -3.431 1.613 53 HB1 ALA 7 3HB ALA 7 -1.536 -5.034 -0.651 54 HB2 ALA 7 1HB ALA 7 -2.085 -3.363 -0.734 55 HB3 ALA 7 2HB ALA 7 -3.279 -4.641 -0.544 56 H ALA 8 H ALA 8 -4.472 -4.900 2.323 57 HA ALA 8 HA ALA 8 -3.548 -7.653 3.259 58 HB1 ALA 8 3HB ALA 8 -4.368 -6.018 4.984 59 HB2 ALA 8 1HB ALA 8 -5.403 -7.447 4.897 60 HB3 ALA 8 2HB ALA 8 -5.942 -5.935 4.180 61 H LEU 9 H LEU 9 -4.005 -9.355 2.076 62 HA LEU 9 HA LEU 9 -6.556 -9.466 0.475 63 HG LEU 9 HG LEU 9 -3.207 -9.334 -2.229 64 HB2 LEU 9 2HB LEU 9 -5.361 -9.913 -1.624 65 HB3 LEU 9 1HB LEU 9 -5.163 -8.323 -1.006 66 HD11 LEU 9 1HD1 LEU 9 -1.459 -8.269 -0.777 67 HD12 LEU 9 2HD1 LEU 9 -2.556 -8.301 0.598 68 HD13 LEU 9 3HD1 LEU 9 -2.906 -7.290 -0.819 69 HD21 LEU 9 3HD2 LEU 9 -3.191 -11.624 -1.246 70 HD22 LEU 9 1HD2 LEU 9 -2.640 -10.930 0.329 71 HD23 LEU 9 2HD2 LEU 9 -1.604 -10.828 -1.107 72 H ALA 10 H ALA 10 -7.275 -11.250 -0.427 73 HA ALA 10 HA ALA 10 -6.715 -13.712 1.241 74 HB1 ALA 10 3HB ALA 10 -9.253 -12.530 -0.127 75 HB2 ALA 10 1HB ALA 10 -8.723 -12.236 1.542 76 HB3 ALA 10 2HB ALA 10 -9.235 -13.851 1.070 77 H GLU 11 H GLU 11 -8.881 -15.054 -0.618 78 HA GLU 11 HA GLU 11 -6.968 -16.532 -2.395 79 HB2 GLU 11 2HB GLU 11 -8.751 -17.760 -1.198 80 HB3 GLU 11 1HB GLU 11 -9.999 -16.897 -2.081 81 HG2 GLU 11 2HG GLU 11 -9.792 -18.266 -3.959 82 HG3 GLU 11 1HG GLU 11 -8.027 -18.313 -3.892 83 H ASN 12 H ASN 12 -7.871 -16.831 -4.756 84 HA ASN 12 HA ASN 12 -6.602 -15.796 -6.497 85 HB2 ASN 12 2HB ASN 12 -9.408 -15.518 -6.577 86 HB3 ASN 12 1HB ASN 12 -8.933 -13.900 -6.941 87 HD21 ASN 12 1HD2 ASN 12 -7.115 -13.875 -8.704 88 HD22 ASN 12 2HD2 ASN 12 -7.568 -14.957 -10.123 89 H ARG 13 H ARG 13 -5.921 -14.331 -4.034 90 HA ARG 13 HA ARG 13 -4.959 -12.452 -3.188 91 HE ARG 13 HE ARG 13 -1.521 -14.276 -6.999 92 HB2 ARG 13 2HB ARG 13 -3.083 -11.426 -4.179 93 HB3 ARG 13 1HB ARG 13 -3.050 -13.167 -4.390 94 HG2 ARG 13 2HG ARG 13 -3.874 -12.771 -6.853 95 HG3 ARG 13 1HG ARG 13 -3.643 -11.071 -6.571 96 HD2 ARG 13 2HD ARG 13 -1.459 -11.201 -7.052 97 HD3 ARG 13 1HD ARG 13 -1.138 -12.170 -5.667 98 HH11 ARG 13 2HH1 ARG 13 -1.147 -11.402 -8.895 99 HH12 ARG 13 1HH1 ARG 13 -0.693 -12.317 -10.394 100 HH21 ARG 13 1HH2 ARG 13 -1.311 -15.302 -8.749 101 HH22 ARG 13 2HH2 ARG 13 -0.936 -14.452 -10.332 102 H VAL 14 H VAL 14 -7.269 -11.988 -3.266 103 HA VAL 14 HA VAL 14 -8.145 -9.518 -4.698 104 HB VAL 14 HB VAL 14 -9.386 -11.463 -2.655 105 HG11 VAL 14 1HG1 VAL 14 -11.575 -10.363 -2.779 106 HG12 VAL 14 2HG1 VAL 14 -10.881 -8.932 -3.593 107 HG13 VAL 14 3HG1 VAL 14 -10.433 -9.341 -1.918 108 HG21 VAL 14 3HG2 VAL 14 -10.166 -10.601 -5.546 109 HG22 VAL 14 1HG2 VAL 14 -10.940 -11.880 -4.562 110 HG23 VAL 14 2HG2 VAL 14 -9.258 -12.061 -5.118 111 H ILE 15 H ILE 15 -7.460 -7.576 -4.132 112 HA ILE 15 HA ILE 15 -6.718 -6.643 -1.364 113 HB ILE 15 HB ILE 15 -7.481 -4.986 -3.812 114 HG12 ILE 15 2HG1 ILE 15 -4.562 -5.301 -2.889 115 HG13 ILE 15 1HG1 ILE 15 -5.296 -6.492 -3.944 116 HG21 ILE 15 1HG2 ILE 15 -5.926 -4.010 -1.296 117 HG22 ILE 15 2HG2 ILE 15 -7.630 -3.647 -1.644 118 HG23 ILE 15 3HG2 ILE 15 -6.385 -3.018 -2.693 119 HD11 ILE 15 3HD1 ILE 15 -5.734 -4.880 -5.730 120 HD12 ILE 15 1HD1 ILE 15 -4.051 -4.672 -5.243 121 HD13 ILE 15 2HD1 ILE 15 -5.284 -3.516 -4.690 122 H GLY 16 H GLY 16 -9.600 -5.863 -3.392 123 HA2 GLY 16 2HA GLY 16 -11.439 -6.458 -1.204 124 HA3 GLY 16 1HA GLY 16 -11.190 -4.709 -1.224 125 H ARG 17 H ARG 17 -13.268 -4.392 -1.562 126 HA ARG 17 HA ARG 17 -14.526 -4.931 -4.260 127 HE ARG 17 HE ARG 17 -17.675 -8.777 -3.100 128 HB2 ARG 17 2HB ARG 17 -15.779 -5.845 -1.607 129 HB3 ARG 17 1HB ARG 17 -16.769 -5.491 -2.996 130 HG2 ARG 17 2HG ARG 17 -16.174 -7.390 -4.223 131 HG3 ARG 17 1HG ARG 17 -14.528 -7.316 -3.757 132 HD2 ARG 17 2HD ARG 17 -14.847 -9.149 -2.511 133 HD3 ARG 17 1HD ARG 17 -15.492 -8.056 -1.285 134 HH11 ARG 17 2HH1 ARG 17 -15.691 -10.248 -0.650 135 HH12 ARG 17 1HH1 ARG 17 -16.940 -11.501 -0.252 136 HH21 ARG 17 1HH2 ARG 17 -19.084 -10.224 -2.638 137 HH22 ARG 17 2HH2 ARG 17 -18.799 -11.480 -1.346 138 H ASP 18 H ASP 18 -15.642 -3.365 -1.180 139 HA ASP 18 HA ASP 18 -16.469 -0.994 -2.586 140 HB2 ASP 18 2HB ASP 18 -16.072 -1.540 0.419 141 HB3 ASP 18 1HB ASP 18 -16.839 -0.102 -0.238 142 H GLY 19 H GLY 19 -13.417 -1.285 -0.690 143 HA2 GLY 19 2HA GLY 19 -12.158 0.681 -2.593 144 HA3 GLY 19 1HA GLY 19 -12.286 1.360 -1.012 145 H GLU 20 H GLU 20 -10.961 0.422 0.725 146 HA GLU 20 HA GLU 20 -8.572 -1.110 -0.272 147 HB2 GLU 20 2HB GLU 20 -7.588 -1.045 1.931 148 HB3 GLU 20 1HB GLU 20 -7.852 0.514 1.227 149 HG2 GLU 20 2HG GLU 20 -9.652 -0.635 3.457 150 HG3 GLU 20 1HG GLU 20 -8.246 0.362 3.765 151 H LEU 21 H LEU 21 -11.244 -2.085 1.923 152 HA LEU 21 HA LEU 21 -10.554 -4.873 1.089 153 HG LEU 21 HG LEU 21 -9.127 -2.713 3.544 154 HB2 LEU 21 2HB LEU 21 -10.443 -5.495 3.736 155 HB3 LEU 21 1HB LEU 21 -9.119 -5.194 2.648 156 HD11 LEU 21 1HD1 LEU 21 -10.623 -2.143 5.182 157 HD12 LEU 21 2HD1 LEU 21 -9.985 -3.441 6.219 158 HD13 LEU 21 3HD1 LEU 21 -11.340 -3.766 5.129 159 HD21 LEU 21 3HD2 LEU 21 -8.098 -5.027 5.242 160 HD22 LEU 21 1HD2 LEU 21 -7.648 -3.321 5.445 161 HD23 LEU 21 2HD2 LEU 21 -7.270 -4.155 3.934 162 HA PRO 22 HA PRO 22 -14.708 -6.200 1.051 163 HB2 PRO 22 2HB PRO 22 -13.815 -8.849 2.344 164 HB3 PRO 22 1HB PRO 22 -14.705 -8.576 0.834 165 HG2 PRO 22 2HG PRO 22 -12.039 -9.256 0.786 166 HG3 PRO 22 1HG PRO 22 -12.643 -8.014 -0.339 167 HD2 PRO 22 2HD PRO 22 -11.244 -7.523 2.375 168 HD3 PRO 22 1HD PRO 22 -10.881 -6.857 0.792 169 H TRP 23 H TRP 23 -13.223 -6.408 4.029 170 HA TRP 23 HA TRP 23 -15.776 -6.480 5.680 171 HD1 TRP 23 HD1 TRP 23 -11.982 -5.498 7.632 172 HE1 TRP 23 HE1 TRP 23 -9.631 -5.687 6.486 173 HE3 TRP 23 HE3 TRP 23 -12.910 -9.666 4.877 174 HZ2 TRP 23 HZ2 TRP 23 -8.404 -7.493 4.798 175 HZ3 TRP 23 HZ3 TRP 23 -11.134 -10.446 3.326 176 HH2 TRP 23 HH2 TRP 23 -8.924 -9.350 3.274 177 HB2 TRP 23 2HB TRP 23 -14.328 -7.147 7.650 178 HB3 TRP 23 1HB TRP 23 -14.364 -8.358 6.383 179 HA PRO 24 HA PRO 24 -14.864 -2.149 6.324 180 HB2 PRO 24 2HB PRO 24 -15.304 -2.172 9.305 181 HB3 PRO 24 1HB PRO 24 -16.164 -1.309 8.024 182 HG2 PRO 24 2HG PRO 24 -17.311 -3.500 9.246 183 HG3 PRO 24 1HG PRO 24 -17.531 -3.213 7.510 184 HD2 PRO 24 2HD PRO 24 -15.541 -5.152 8.812 185 HD3 PRO 24 1HD PRO 24 -16.642 -5.406 7.425 186 H SER 25 H SER 25 -13.094 -3.665 8.998 187 HA SER 25 HA SER 25 -10.483 -3.052 8.362 188 HG SER 25 HG SER 25 -11.097 -0.706 7.437 189 HB2 SER 25 2HB SER 25 -11.500 -0.551 9.807 190 HB3 SER 25 1HB SER 25 -9.823 -1.099 9.956 191 H ILE 26 H ILE 26 -10.156 -4.926 9.460 192 HA ILE 26 HA ILE 26 -11.034 -5.440 12.204 193 HB ILE 26 HB ILE 26 -9.361 -7.328 12.276 194 HG12 ILE 26 2HG1 ILE 26 -8.357 -6.135 9.738 195 HG13 ILE 26 1HG1 ILE 26 -7.551 -7.044 10.961 196 HG21 ILE 26 1HG2 ILE 26 -11.742 -7.661 11.695 197 HG22 ILE 26 2HG2 ILE 26 -10.684 -8.822 10.881 198 HG23 ILE 26 3HG2 ILE 26 -11.370 -7.469 9.967 199 HD11 ILE 26 3HD1 ILE 26 -8.423 -9.200 9.887 200 HD12 ILE 26 1HD1 ILE 26 -7.467 -8.186 8.766 201 HD13 ILE 26 2HD1 ILE 26 -9.231 -8.205 8.639 202 HA PRO 27 HA PRO 27 -8.069 -2.973 14.595 203 HB2 PRO 27 2HB PRO 27 -8.342 -5.179 16.703 204 HB3 PRO 27 1HB PRO 27 -8.393 -3.411 16.904 205 HG2 PRO 27 2HG PRO 27 -10.755 -4.750 16.817 206 HG3 PRO 27 1HG PRO 27 -10.597 -3.279 15.824 207 HD2 PRO 27 2HD PRO 27 -10.282 -6.184 14.855 208 HD3 PRO 27 1HD PRO 27 -11.258 -4.834 14.179 209 H ALA 28 H ALA 28 -6.931 -6.432 14.689 210 HA ALA 28 HA ALA 28 -4.167 -5.860 14.838 211 HB1 ALA 28 3HB ALA 28 -3.805 -7.988 13.468 212 HB2 ALA 28 1HB ALA 28 -5.560 -8.038 13.192 213 HB3 ALA 28 2HB ALA 28 -4.897 -8.078 14.857 214 H ASP 29 H ASP 29 -6.058 -5.456 11.864 215 HA ASP 29 HA ASP 29 -3.729 -4.974 10.039 216 HB2 ASP 29 2HB ASP 29 -5.921 -5.935 9.233 217 HB3 ASP 29 1HB ASP 29 -6.759 -4.457 9.687 218 H LYS 30 H LYS 30 -6.389 -2.840 11.001 219 HA LYS 30 HA LYS 30 -5.016 -0.451 10.982 220 HB2 LYS 30 2HB LYS 30 -7.183 -0.011 11.068 221 HB3 LYS 30 1HB LYS 30 -7.564 -1.379 12.085 222 HG2 LYS 30 2HG LYS 30 -6.615 0.167 14.063 223 HG3 LYS 30 1HG LYS 30 -6.927 1.485 12.950 224 HD2 LYS 30 2HD LYS 30 -9.290 -0.346 12.951 225 HD3 LYS 30 1HD LYS 30 -8.745 -0.170 14.585 226 HE2 LYS 30 2HE LYS 30 -10.409 1.513 14.378 227 HE3 LYS 30 1HE LYS 30 -8.924 2.438 14.308 228 HZ1 LYS 30 3HZ LYS 30 -9.139 2.205 11.688 229 HZ2 LYS 30 1HZ LYS 30 -10.354 3.105 12.309 230 HZ3 LYS 30 2HZ LYS 30 -10.590 1.549 11.890 231 H LYS 31 H LYS 31 -4.261 -2.621 13.384 232 HA LYS 31 HA LYS 31 -2.585 -0.657 14.995 233 HB2 LYS 31 2HB LYS 31 -3.737 -2.435 16.251 234 HB3 LYS 31 1HB LYS 31 -3.062 -3.666 15.238 235 HG2 LYS 31 2HG LYS 31 -1.940 -3.834 17.262 236 HG3 LYS 31 1HG LYS 31 -0.759 -3.277 16.135 237 HD2 LYS 31 2HD LYS 31 -2.293 -1.465 18.149 238 HD3 LYS 31 1HD LYS 31 -0.810 -2.268 18.577 239 HE2 LYS 31 2HE LYS 31 -1.099 -0.007 16.491 240 HE3 LYS 31 1HE LYS 31 -0.343 0.113 18.066 241 HZ1 LYS 31 3HZ LYS 31 1.368 -1.639 17.206 242 HZ2 LYS 31 1HZ LYS 31 1.343 -0.212 16.356 243 HZ3 LYS 31 2HZ LYS 31 0.614 -1.511 15.735 244 H GLN 32 H GLN 32 -2.034 -3.109 12.406 245 HA GLN 32 HA GLN 32 0.946 -2.641 12.490 246 HB2 GLN 32 2HB GLN 32 0.037 -4.886 12.033 247 HB3 GLN 32 1HB GLN 32 -0.738 -4.337 10.565 248 HG2 GLN 32 2HG GLN 32 2.316 -4.117 11.071 249 HG3 GLN 32 1HG GLN 32 1.609 -5.593 10.464 250 HE21 GLN 32 1HE2 GLN 32 0.138 -5.119 8.373 251 HE22 GLN 32 2HE2 GLN 32 1.079 -4.099 7.169 252 H TYR 33 H TYR 33 -1.753 -1.893 10.168 253 HA TYR 33 HA TYR 33 -0.514 0.171 8.622 254 HD1 TYR 33 HD2 TYR 33 -2.597 1.871 6.682 255 HD2 TYR 33 HD1 TYR 33 -4.320 1.249 10.498 256 HE1 TYR 33 HE2 TYR 33 -3.709 4.086 6.557 257 HE2 TYR 33 HE1 TYR 33 -5.727 3.162 10.249 258 HH TYR 33 HH TYR 33 -5.671 5.536 7.721 259 HB2 TYR 33 2HB TYR 33 -2.558 -0.511 7.826 260 HB3 TYR 33 1HB TYR 33 -3.311 -0.649 9.331 261 H ARG 34 H ARG 34 -1.811 0.757 11.988 262 HA ARG 34 HA ARG 34 -0.889 3.659 11.652 263 HE ARG 34 HE ARG 34 -5.346 5.225 10.600 264 HB2 ARG 34 2HB ARG 34 -2.295 2.452 14.073 265 HB3 ARG 34 1HB ARG 34 -1.862 4.138 13.875 266 HG2 ARG 34 2HG ARG 34 -3.746 2.785 11.901 267 HG3 ARG 34 1HG ARG 34 -4.353 3.343 13.409 268 HD2 ARG 34 2HD ARG 34 -3.314 5.738 12.688 269 HD3 ARG 34 1HD ARG 34 -3.078 4.964 11.121 270 HH11 ARG 34 2HH1 ARG 34 -5.047 5.541 13.981 271 HH12 ARG 34 1HH1 ARG 34 -6.721 6.248 14.211 272 HH21 ARG 34 1HH2 ARG 34 -7.252 5.927 10.780 273 HH22 ARG 34 2HH2 ARG 34 -7.946 6.455 12.366 274 H SER 35 H SER 35 0.677 0.954 12.793 275 HA SER 35 HA SER 35 2.825 2.742 14.048 276 HG SER 35 HG SER 35 2.410 2.208 16.165 277 HB2 SER 35 2HB SER 35 2.439 -0.248 14.614 278 HB3 SER 35 1HB SER 35 3.850 0.685 15.089 279 H ARG 36 H ARG 36 1.954 1.585 11.315 280 HA ARG 36 HA ARG 36 4.823 1.462 10.213 281 HE ARG 36 HE ARG 36 4.203 -2.447 8.981 282 HB2 ARG 36 2HB ARG 36 3.091 -0.535 9.879 283 HB3 ARG 36 1HB ARG 36 2.161 0.577 8.904 284 HG2 ARG 36 2HG ARG 36 3.336 -0.773 7.376 285 HG3 ARG 36 1HG ARG 36 4.088 0.797 7.312 286 HD2 ARG 36 2HD ARG 36 5.836 -0.899 7.244 287 HD3 ARG 36 1HD ARG 36 5.997 -0.074 8.794 288 HH11 ARG 36 2HH1 ARG 36 7.532 -1.806 8.423 289 HH12 ARG 36 1HH1 ARG 36 7.860 -3.581 8.681 290 HH21 ARG 36 1HH2 ARG 36 4.804 -4.300 9.547 291 HH22 ARG 36 2HH2 ARG 36 6.556 -4.813 9.538 292 H VAL 37 H VAL 37 1.469 2.703 9.372 293 HA VAL 37 HA VAL 37 2.802 4.975 7.869 294 HB VAL 37 HB VAL 37 1.376 4.875 6.235 295 HG11 VAL 37 1HG1 VAL 37 0.748 1.953 6.936 296 HG12 VAL 37 2HG1 VAL 37 2.302 2.499 6.280 297 HG13 VAL 37 3HG1 VAL 37 0.825 2.687 5.304 298 HG21 VAL 37 3HG2 VAL 37 -0.781 5.409 7.114 299 HG22 VAL 37 1HG2 VAL 37 -0.923 3.879 7.985 300 HG23 VAL 37 2HG2 VAL 37 -1.052 3.904 6.213 301 H ALA 38 H ALA 38 1.299 5.026 10.847 302 HA ALA 38 HA ALA 38 -0.576 7.332 10.285 303 HB1 ALA 38 3HB ALA 38 -1.132 5.747 12.103 304 HB2 ALA 38 1HB ALA 38 -1.057 7.430 12.643 305 HB3 ALA 38 2HB ALA 38 0.266 6.305 13.027 306 H ASP 39 H ASP 39 2.618 6.989 11.881 307 HA ASP 39 HA ASP 39 3.398 9.756 11.753 308 HB2 ASP 39 2HB ASP 39 5.717 8.145 11.471 309 HB3 ASP 39 1HB ASP 39 5.101 8.952 12.868 310 H ASP 40 H ASP 40 4.311 7.275 9.192 311 HA ASP 40 HA ASP 40 5.191 9.409 7.499 312 HB2 ASP 40 2HB ASP 40 5.108 6.394 7.415 313 HB3 ASP 40 1HB ASP 40 5.345 7.167 5.879 314 HA PRO 41 HA PRO 41 2.019 10.280 4.282 315 HB2 PRO 41 2HB PRO 41 4.408 10.034 2.339 316 HB3 PRO 41 1HB PRO 41 3.178 11.290 2.383 317 HG2 PRO 41 2HG PRO 41 5.602 11.812 3.454 318 HG3 PRO 41 1HG PRO 41 4.210 12.228 4.477 319 HD2 PRO 41 2HD PRO 41 5.912 9.669 4.650 320 HD3 PRO 41 1HD PRO 41 5.422 10.794 5.936 321 H VAL 42 H VAL 42 0.651 9.143 2.892 322 HA VAL 42 HA VAL 42 1.674 6.476 1.764 323 HB VAL 42 HB VAL 42 -1.136 7.187 2.731 324 HG11 VAL 42 1HG1 VAL 42 -1.620 4.768 2.573 325 HG12 VAL 42 2HG1 VAL 42 0.028 4.403 1.988 326 HG13 VAL 42 3HG1 VAL 42 -1.114 5.324 0.971 327 HG21 VAL 42 3HG2 VAL 42 -0.427 5.342 4.541 328 HG22 VAL 42 1HG2 VAL 42 0.225 6.978 4.746 329 HG23 VAL 42 2HG2 VAL 42 1.240 5.708 4.061 330 H VAL 43 H VAL 43 1.651 5.987 -0.261 331 HA VAL 43 HA VAL 43 0.218 7.730 -2.309 332 HB VAL 43 HB VAL 43 1.773 7.090 -3.975 333 HG11 VAL 43 1HG1 VAL 43 3.993 7.800 -3.122 334 HG12 VAL 43 2HG1 VAL 43 3.521 7.515 -1.447 335 HG13 VAL 43 3HG1 VAL 43 2.756 8.816 -2.334 336 HG21 VAL 43 3HG2 VAL 43 3.038 5.101 -2.006 337 HG22 VAL 43 1HG2 VAL 43 3.740 5.531 -3.562 338 HG23 VAL 43 2HG2 VAL 43 2.203 4.691 -3.545 339 H LEU 44 H LEU 44 -1.678 7.117 -3.055 340 HA LEU 44 HA LEU 44 -2.353 4.158 -3.482 341 HG LEU 44 HG LEU 44 -4.107 7.129 -2.115 342 HB2 LEU 44 2HB LEU 44 -4.185 4.207 -1.949 343 HB3 LEU 44 1HB LEU 44 -2.737 4.610 -1.144 344 HD11 LEU 44 1HD1 LEU 44 -6.057 6.978 -0.470 345 HD12 LEU 44 2HD1 LEU 44 -5.698 5.257 -0.222 346 HD13 LEU 44 3HD1 LEU 44 -6.203 5.839 -1.815 347 HD21 LEU 44 3HD2 LEU 44 -3.761 7.900 0.125 348 HD22 LEU 44 1HD2 LEU 44 -2.308 6.996 -0.330 349 HD23 LEU 44 2HD2 LEU 44 -3.486 6.249 0.765 350 H GLY 45 H GLY 45 -4.917 3.926 -3.937 351 HA2 GLY 45 2HA GLY 45 -5.075 5.128 -6.754 352 HA3 GLY 45 1HA GLY 45 -5.833 3.628 -6.232 353 H ARG 46 H ARG 46 -7.497 4.926 -7.539 354 HA ARG 46 HA ARG 46 -9.345 6.491 -5.633 355 HE ARG 46 HE ARG 46 -11.741 8.924 -7.339 356 HB2 ARG 46 2HB ARG 46 -9.607 6.080 -8.653 357 HB3 ARG 46 1HB ARG 46 -10.895 6.689 -7.667 358 HG2 ARG 46 2HG ARG 46 -8.138 8.039 -7.918 359 HG3 ARG 46 1HG ARG 46 -9.548 8.517 -8.840 360 HD2 ARG 46 2HD ARG 46 -9.317 8.705 -5.755 361 HD3 ARG 46 1HD ARG 46 -9.043 10.029 -6.893 362 HH11 ARG 46 2HH1 ARG 46 -10.082 10.515 -4.835 363 HH12 ARG 46 1HH1 ARG 46 -11.597 11.263 -4.129 364 HH21 ARG 46 1HH2 ARG 46 -13.455 9.721 -6.529 365 HH22 ARG 46 2HH2 ARG 46 -13.412 10.893 -5.143 366 H THR 47 H THR 47 -8.885 3.208 -6.580 367 HA THR 47 HA THR 47 -11.518 2.388 -5.443 368 HB THR 47 HB THR 47 -8.960 0.695 -5.791 369 HG1 THR 47 HG1 THR 47 -11.027 0.027 -7.264 370 HG21 THR 47 3HG2 THR 47 -10.396 -0.533 -4.265 371 HG22 THR 47 1HG2 THR 47 -10.723 -1.178 -5.872 372 HG23 THR 47 2HG2 THR 47 -11.898 -0.075 -5.104 373 H THR 48 H THR 48 -8.402 1.625 -3.749 374 HA THR 48 HA THR 48 -9.141 2.028 -1.100 375 HB THR 48 HB THR 48 -6.775 2.662 -0.590 376 HG1 THR 48 HG1 THR 48 -6.346 3.986 -2.236 377 HG21 THR 48 3HG2 THR 48 -5.526 0.799 -1.476 378 HG22 THR 48 1HG2 THR 48 -6.791 0.383 -2.658 379 HG23 THR 48 2HG2 THR 48 -7.102 0.267 -0.918 380 H PHE 49 H PHE 49 -8.607 4.895 -3.161 381 HA PHE 49 HA PHE 49 -8.744 6.739 -0.760 382 HD1 PHE 49 HD2 PHE 49 -10.433 9.556 -2.319 383 HD2 PHE 49 HD1 PHE 49 -6.230 8.961 -1.709 384 HE1 PHE 49 HE2 PHE 49 -10.257 11.800 -1.299 385 HE2 PHE 49 HE1 PHE 49 -6.040 11.265 -0.860 386 HZ PHE 49 HZ PHE 49 -8.041 12.634 -0.557 387 HB2 PHE 49 2HB PHE 49 -7.416 7.333 -2.871 388 HB3 PHE 49 1HB PHE 49 -8.924 7.694 -3.664 389 H GLU 50 H GLU 50 -11.108 5.632 -3.167 390 HA GLU 50 HA GLU 50 -13.231 7.538 -2.176 391 HB2 GLU 50 2HB GLU 50 -13.437 5.192 -4.168 392 HB3 GLU 50 1HB GLU 50 -14.803 6.167 -3.648 393 HG2 GLU 50 2HG GLU 50 -13.687 8.276 -4.416 394 HG3 GLU 50 1HG GLU 50 -12.275 7.405 -4.923 395 H SER 51 H SER 51 -12.130 4.403 -1.072 396 HA SER 51 HA SER 51 -13.914 4.845 1.328 397 HG SER 51 HG SER 51 -13.968 2.678 0.482 398 HB2 SER 51 2HB SER 51 -11.349 3.189 1.162 399 HB3 SER 51 1HB SER 51 -12.406 3.297 2.551 400 H MET 52 H MET 52 -10.343 5.063 1.705 401 HA MET 52 HA MET 52 -10.178 6.568 3.817 402 HB2 MET 52 2HB MET 52 -8.428 7.149 1.371 403 HB3 MET 52 1HB MET 52 -8.021 7.702 3.005 404 HG2 MET 52 2HG MET 52 -7.804 5.477 3.883 405 HG3 MET 52 1HG MET 52 -8.162 4.765 2.270 406 HE1 MET 52 3HE MET 52 -5.452 4.268 3.549 407 HE2 MET 52 1HE MET 52 -4.386 4.625 2.144 408 HE3 MET 52 2HE MET 52 -5.952 3.770 1.898 409 H ARG 53 H ARG 53 -11.094 8.428 1.098 410 HA ARG 53 HA ARG 53 -11.232 11.152 2.119 411 HE ARG 53 HE ARG 53 -16.684 11.755 -0.132 412 HB2 ARG 53 2HB ARG 53 -11.908 10.360 -0.148 413 HB3 ARG 53 1HB ARG 53 -13.121 9.304 0.522 414 HG2 ARG 53 2HG ARG 53 -13.302 12.318 0.985 415 HG3 ARG 53 1HG ARG 53 -13.777 11.691 -0.558 416 HD2 ARG 53 2HD ARG 53 -14.981 10.162 1.759 417 HD3 ARG 53 1HD ARG 53 -15.313 11.827 1.893 418 HH11 ARG 53 2HH1 ARG 53 -15.510 8.607 0.725 419 HH12 ARG 53 1HH1 ARG 53 -16.288 7.775 -0.669 420 HH21 ARG 53 1HH2 ARG 53 -17.776 10.793 -1.573 421 HH22 ARG 53 2HH2 ARG 53 -17.637 8.980 -1.831 422 H ASP 54 H ASP 54 -12.971 8.298 3.294 423 HA ASP 54 HA ASP 54 -14.402 9.939 5.395 424 HB2 ASP 54 2HB ASP 54 -14.828 7.119 4.273 425 HB3 ASP 54 1HB ASP 54 -15.510 7.602 5.815 426 H ASP 55 H ASP 55 -12.092 6.970 5.670 427 HA ASP 55 HA ASP 55 -10.971 8.636 7.905 428 HB2 ASP 55 2HB ASP 55 -10.411 7.210 9.510 429 HB3 ASP 55 1HB ASP 55 -12.111 7.147 9.180 430 H LEU 56 H LEU 56 -9.181 9.420 7.699 431 HA LEU 56 HA LEU 56 -7.549 8.966 5.432 432 HG LEU 56 HG LEU 56 -7.585 12.689 6.504 433 HB2 LEU 56 2HB LEU 56 -6.523 10.672 7.733 434 HB3 LEU 56 1HB LEU 56 -6.306 10.885 6.035 435 HD11 LEU 56 1HD1 LEU 56 -9.943 12.491 5.749 436 HD12 LEU 56 2HD1 LEU 56 -9.887 10.735 5.889 437 HD13 LEU 56 3HD1 LEU 56 -8.869 11.568 4.688 438 HD21 LEU 56 3HD2 LEU 56 -7.921 12.189 8.899 439 HD22 LEU 56 1HD2 LEU 56 -9.351 11.196 8.512 440 HD23 LEU 56 2HD2 LEU 56 -9.343 12.941 8.162 441 HA PRO 57 HA PRO 57 -4.211 6.232 6.977 442 HB2 PRO 57 2HB PRO 57 -2.271 6.466 5.081 443 HB3 PRO 57 1HB PRO 57 -3.858 5.787 4.760 444 HG2 PRO 57 2HG PRO 57 -2.918 8.643 4.174 445 HG3 PRO 57 1HG PRO 57 -3.769 7.515 3.085 446 HD2 PRO 57 2HD PRO 57 -5.094 9.458 4.537 447 HD3 PRO 57 1HD PRO 57 -5.872 7.898 4.136 448 H GLY 58 H GLY 58 -2.073 8.950 6.078 449 HA2 GLY 58 2HA GLY 58 -0.949 8.921 8.974 450 HA3 GLY 58 1HA GLY 58 0.114 8.808 7.574 451 H SER 59 H SER 59 1.184 10.608 8.551 452 HA SER 59 HA SER 59 0.209 13.313 8.556 453 HG SER 59 HG SER 59 3.654 14.246 8.616 454 HB2 SER 59 2HB SER 59 2.405 12.438 9.428 455 HB3 SER 59 1HB SER 59 3.005 12.285 7.774 456 H ALA 60 H ALA 60 0.414 11.429 5.674 457 HA ALA 60 HA ALA 60 -0.812 13.671 4.200 458 HB1 ALA 60 3HB ALA 60 2.050 12.880 3.413 459 HB2 ALA 60 1HB ALA 60 1.360 14.490 3.692 460 HB3 ALA 60 2HB ALA 60 0.939 13.590 2.217 461 H GLN 61 H GLN 61 -1.526 13.210 2.014 462 HA GLN 61 HA GLN 61 -2.077 10.241 1.511 463 HB2 GLN 61 2HB GLN 61 -3.827 11.525 3.017 464 HB3 GLN 61 1HB GLN 61 -4.289 12.374 1.548 465 HG2 GLN 61 2HG GLN 61 -4.742 10.061 0.463 466 HG3 GLN 61 1HG GLN 61 -4.312 9.315 1.947 467 HE21 GLN 61 1HE2 GLN 61 -6.033 11.548 3.437 468 HE22 GLN 61 2HE2 GLN 61 -7.633 10.654 3.259 469 H ILE 62 H ILE 62 -1.201 9.937 -0.368 470 HA ILE 62 HA ILE 62 -1.316 11.996 -2.611 471 HB ILE 62 HB ILE 62 0.558 9.688 -1.851 472 HG12 ILE 62 2HG1 ILE 62 1.442 12.530 -2.301 473 HG13 ILE 62 1HG1 ILE 62 0.641 12.178 -0.782 474 HG21 ILE 62 1HG2 ILE 62 0.679 11.411 -4.382 475 HG22 ILE 62 2HG2 ILE 62 0.494 9.632 -4.335 476 HG23 ILE 62 3HG2 ILE 62 2.021 10.354 -3.796 477 HD11 ILE 62 3HD1 ILE 62 3.295 11.044 -1.846 478 HD12 ILE 62 1HD1 ILE 62 2.493 10.363 -0.385 479 HD13 ILE 62 2HD1 ILE 62 3.027 12.048 -0.412 480 H VAL 63 H VAL 63 -2.868 11.537 -4.200 481 HA VAL 63 HA VAL 63 -3.274 8.620 -4.977 482 HB VAL 63 HB VAL 63 -4.815 11.047 -5.883 483 HG11 VAL 63 1HG1 VAL 63 -5.159 8.100 -6.829 484 HG12 VAL 63 2HG1 VAL 63 -4.687 9.449 -7.862 485 HG13 VAL 63 3HG1 VAL 63 -6.320 9.411 -7.168 486 HG21 VAL 63 3HG2 VAL 63 -5.546 8.460 -4.309 487 HG22 VAL 63 1HG2 VAL 63 -6.708 9.769 -4.704 488 HG23 VAL 63 2HG2 VAL 63 -5.339 10.084 -3.634 489 H MET 64 H MET 64 -1.914 7.632 -6.207 490 HA MET 64 HA MET 64 -0.683 8.864 -8.661 491 HB2 MET 64 2HB MET 64 -0.663 6.072 -7.353 492 HB3 MET 64 1HB MET 64 -0.280 6.233 -9.040 493 HG2 MET 64 2HG MET 64 1.366 8.288 -8.020 494 HG3 MET 64 1HG MET 64 1.364 7.133 -6.686 495 HE1 MET 64 3HE MET 64 1.174 6.439 -10.838 496 HE2 MET 64 1HE MET 64 2.943 6.609 -10.995 497 HE3 MET 64 2HE MET 64 1.966 7.974 -10.366 498 H SER 65 H SER 65 -2.266 9.648 -9.793 499 HA SER 65 HA SER 65 -3.380 7.777 -11.791 500 HG SER 65 HG SER 65 -4.957 9.970 -9.527 501 HB2 SER 65 2HB SER 65 -5.781 8.494 -11.814 502 HB3 SER 65 1HB SER 65 -5.388 7.792 -10.266 503 H ARG 66 H ARG 66 -4.752 9.390 -13.483 504 HA ARG 66 HA ARG 66 -3.059 11.966 -13.830 505 HE ARG 66 HE ARG 66 -6.473 10.501 -15.437 506 HB2 ARG 66 2HB ARG 66 -3.070 11.760 -16.219 507 HB3 ARG 66 1HB ARG 66 -2.368 10.398 -15.418 508 HG2 ARG 66 2HG ARG 66 -3.446 9.444 -17.216 509 HG3 ARG 66 1HG ARG 66 -4.446 8.985 -15.884 510 HD2 ARG 66 2HD ARG 66 -5.060 11.467 -17.684 511 HD3 ARG 66 1HD ARG 66 -5.494 9.829 -18.189 512 HH11 ARG 66 2HH1 ARG 66 -7.287 10.908 -18.775 513 HH12 ARG 66 1HH1 ARG 66 -9.053 11.150 -18.382 514 HH21 ARG 66 1HH2 ARG 66 -8.467 10.723 -15.026 515 HH22 ARG 66 2HH2 ARG 66 -9.681 11.050 -16.337 516 H SER 67 H SER 67 -5.487 11.822 -12.287 517 HA SER 67 HA SER 67 -7.122 14.007 -13.751 518 HG SER 67 HG SER 67 -9.689 13.516 -11.696 519 HB2 SER 67 2HB SER 67 -8.269 11.757 -13.203 520 HB3 SER 67 1HB SER 67 -8.085 12.136 -11.493 521 H GLU 68 H GLU 68 -5.985 15.862 -13.037 522 HA GLU 68 HA GLU 68 -5.178 16.297 -10.220 523 HB2 GLU 68 2HB GLU 68 -5.374 18.155 -12.674 524 HB3 GLU 68 1HB GLU 68 -5.193 18.823 -11.068 525 HG2 GLU 68 2HG GLU 68 -3.101 17.212 -10.794 526 HG3 GLU 68 1HG GLU 68 -3.148 17.165 -12.579 527 H ARG 69 H ARG 69 -6.570 16.561 -8.595 528 HA ARG 69 HA ARG 69 -8.515 18.727 -8.610 529 HE ARG 69 HE ARG 69 -13.115 16.683 -8.522 530 HB2 ARG 69 2HB ARG 69 -9.603 16.353 -9.743 531 HB3 ARG 69 1HB ARG 69 -10.158 16.196 -8.122 532 HG2 ARG 69 2HG ARG 69 -10.469 18.856 -9.712 533 HG3 ARG 69 1HG ARG 69 -11.536 17.552 -10.077 534 HD2 ARG 69 2HD ARG 69 -11.195 18.622 -7.197 535 HD3 ARG 69 1HD ARG 69 -12.314 19.364 -8.331 536 HH11 ARG 69 2HH1 ARG 69 -12.403 18.464 -5.660 537 HH12 ARG 69 1HH1 ARG 69 -13.711 17.660 -4.726 538 HH21 ARG 69 1HH2 ARG 69 -14.596 15.746 -7.413 539 HH22 ARG 69 2HH2 ARG 69 -14.904 16.209 -5.680 540 H SER 70 H SER 70 -8.858 19.526 -6.635 541 HA SER 70 HA SER 70 -7.819 18.568 -4.140 542 HG SER 70 HG SER 70 -11.028 21.069 -4.081 543 HB2 SER 70 2HB SER 70 -9.286 20.222 -3.080 544 HB3 SER 70 1HB SER 70 -8.667 20.913 -4.573 545 H PHE 71 H PHE 71 -8.755 17.560 -2.228 546 HA PHE 71 HA PHE 71 -10.867 15.461 -3.010 547 HD1 PHE 71 HD1 PHE 71 -10.259 13.742 -4.398 548 HD2 PHE 71 HD2 PHE 71 -6.344 14.357 -2.716 549 HE1 PHE 71 HE1 PHE 71 -9.217 12.613 -6.344 550 HE2 PHE 71 HE2 PHE 71 -5.352 13.194 -4.636 551 HZ PHE 71 HZ PHE 71 -6.769 12.342 -6.452 552 HB2 PHE 71 2HB PHE 71 -8.257 15.123 -1.446 553 HB3 PHE 71 1HB PHE 71 -9.502 13.928 -1.634 554 H SER 72 H SER 72 -9.610 15.802 0.271 555 HA SER 72 HA SER 72 -12.264 16.748 1.289 556 HG SER 72 HG SER 72 -14.077 15.053 1.912 557 HB2 SER 72 2HB SER 72 -11.601 13.803 1.482 558 HB3 SER 72 1HB SER 72 -12.283 14.544 2.914 559 H VAL 73 H VAL 73 -9.304 15.193 2.638 560 HA VAL 73 HA VAL 73 -9.381 17.150 4.964 561 HB VAL 73 HB VAL 73 -8.802 14.824 5.495 562 HG11 VAL 73 1HG1 VAL 73 -7.546 13.973 3.567 563 HG12 VAL 73 2HG1 VAL 73 -6.490 13.878 4.974 564 HG13 VAL 73 3HG1 VAL 73 -6.249 15.179 3.796 565 HG21 VAL 73 3HG2 VAL 73 -6.988 15.215 7.027 566 HG22 VAL 73 1HG2 VAL 73 -7.832 16.770 6.900 567 HG23 VAL 73 2HG2 VAL 73 -6.300 16.521 6.052 568 H ASP 74 H ASP 74 -7.527 18.513 5.431 569 HA ASP 74 HA ASP 74 -6.493 20.043 3.159 570 HB2 ASP 74 2HB ASP 74 -6.965 20.722 5.722 571 HB3 ASP 74 1HB ASP 74 -5.303 20.209 5.985 572 H THR 75 H THR 75 -4.762 17.700 5.331 573 HA THR 75 HA THR 75 -2.411 17.506 3.502 574 HB THR 75 HB THR 75 -2.411 17.133 6.028 575 HG1 THR 75 HG1 THR 75 -0.847 15.240 5.504 576 HG21 THR 75 3HG2 THR 75 -4.076 15.142 6.241 577 HG22 THR 75 1HG2 THR 75 -2.446 14.848 6.926 578 HG23 THR 75 2HG2 THR 75 -2.877 14.147 5.383 579 H ALA 76 H ALA 76 -4.286 17.225 1.687 580 HA ALA 76 HA ALA 76 -3.886 14.391 0.701 581 HB1 ALA 76 3HB ALA 76 -6.309 14.080 0.022 582 HB2 ALA 76 1HB ALA 76 -6.718 15.544 0.972 583 HB3 ALA 76 2HB ALA 76 -6.003 14.119 1.768 584 H HIS 77 H HIS 77 -3.464 14.228 -1.301 585 HA HIS 77 HA HIS 77 -3.362 16.673 -3.155 586 HD1 HIS 77 HD1 HIS 77 -0.593 15.836 0.574 587 HD2 HIS 77 HD2 HIS 77 -1.788 19.030 -2.000 588 HE1 HIS 77 HE1 HIS 77 -0.349 18.081 1.794 589 HB2 HIS 77 2HB HIS 77 -1.023 15.140 -1.839 590 HB3 HIS 77 1HB HIS 77 -0.845 16.453 -3.016 591 H ARG 78 H ARG 78 -1.969 16.011 -5.173 592 HA ARG 78 HA ARG 78 -2.704 13.149 -6.008 593 HE ARG 78 HE ARG 78 -3.908 13.432 -11.356 594 HB2 ARG 78 2HB ARG 78 -4.401 15.028 -6.712 595 HB3 ARG 78 1HB ARG 78 -3.245 15.517 -7.910 596 HG2 ARG 78 2HG ARG 78 -4.467 12.697 -7.531 597 HG3 ARG 78 1HG ARG 78 -5.145 13.875 -8.624 598 HD2 ARG 78 2HD ARG 78 -2.305 12.682 -8.934 599 HD3 ARG 78 1HD ARG 78 -3.720 11.904 -9.564 600 HH11 ARG 78 2HH1 ARG 78 -1.372 14.715 -9.263 601 HH12 ARG 78 1HH1 ARG 78 -0.558 15.458 -10.679 602 HH21 ARG 78 1HH2 ARG 78 -3.003 14.382 -12.850 603 HH22 ARG 78 2HH2 ARG 78 -1.436 15.298 -12.571 604 H ALA 79 H ALA 79 -0.812 12.145 -6.405 605 HA ALA 79 HA ALA 79 1.450 13.464 -7.904 606 HB1 ALA 79 3HB ALA 79 1.912 11.796 -6.149 607 HB2 ALA 79 1HB ALA 79 2.391 11.079 -7.699 608 HB3 ALA 79 2HB ALA 79 0.883 10.555 -6.941 609 H ALA 80 H ALA 80 1.940 13.245 -10.085 610 HA ALA 80 HA ALA 80 0.157 11.587 -11.921 611 HB1 ALA 80 3HB ALA 80 0.551 13.895 -12.587 612 HB2 ALA 80 1HB ALA 80 1.359 12.841 -13.767 613 HB3 ALA 80 2HB ALA 80 2.308 13.681 -12.528 614 H SER 81 H SER 81 3.598 11.377 -10.905 615 HA SER 81 HA SER 81 3.646 8.570 -12.115 616 HG SER 81 HG SER 81 6.889 9.125 -13.592 617 HB2 SER 81 2HB SER 81 4.869 10.296 -13.578 618 HB3 SER 81 1HB SER 81 5.944 10.660 -12.213 619 H VAL 82 H VAL 82 6.166 7.879 -11.196 620 HA VAL 82 HA VAL 82 5.811 7.605 -8.175 621 HB VAL 82 HB VAL 82 7.951 6.246 -9.900 622 HG11 VAL 82 1HG1 VAL 82 7.540 6.400 -6.862 623 HG12 VAL 82 2HG1 VAL 82 9.046 6.429 -7.787 624 HG13 VAL 82 3HG1 VAL 82 8.183 4.911 -7.567 625 HG21 VAL 82 3HG2 VAL 82 6.613 4.109 -8.975 626 HG22 VAL 82 1HG2 VAL 82 5.994 5.004 -10.370 627 HG23 VAL 82 2HG2 VAL 82 5.277 5.241 -8.749 628 H GLU 83 H GLU 83 8.435 8.834 -10.402 629 HA GLU 83 HA GLU 83 9.854 10.467 -8.541 630 HB2 GLU 83 2HB GLU 83 9.113 10.992 -11.480 631 HB3 GLU 83 1HB GLU 83 10.295 11.914 -10.600 632 HG2 GLU 83 2HG GLU 83 11.944 10.219 -10.664 633 HG3 GLU 83 1HG GLU 83 10.802 8.909 -10.604 634 H GLU 84 H GLU 84 6.734 11.524 -10.103 635 HA GLU 84 HA GLU 84 6.560 14.029 -8.517 636 HB2 GLU 84 2HB GLU 84 4.297 12.337 -9.688 637 HB3 GLU 84 1HB GLU 84 4.139 14.001 -9.189 638 HG2 GLU 84 2HG GLU 84 6.168 13.686 -11.421 639 HG3 GLU 84 1HG GLU 84 4.591 13.094 -11.840 640 H ALA 85 H ALA 85 5.736 10.771 -7.668 641 HA ALA 85 HA ALA 85 4.100 11.534 -5.237 642 HB1 ALA 85 3HB ALA 85 3.527 9.384 -6.561 643 HB2 ALA 85 1HB ALA 85 3.870 9.121 -4.838 644 HB3 ALA 85 2HB ALA 85 5.094 8.722 -6.040 645 H VAL 86 H VAL 86 7.448 10.597 -5.953 646 HA VAL 86 HA VAL 86 8.222 10.500 -3.020 647 HB VAL 86 HB VAL 86 9.716 10.009 -5.633 648 HG11 VAL 86 1HG1 VAL 86 11.338 11.405 -4.412 649 HG12 VAL 86 2HG1 VAL 86 11.862 9.714 -4.375 650 HG13 VAL 86 3HG1 VAL 86 11.117 10.447 -2.924 651 HG21 VAL 86 3HG2 VAL 86 8.541 8.052 -4.444 652 HG22 VAL 86 1HG2 VAL 86 9.524 8.374 -3.002 653 HG23 VAL 86 2HG2 VAL 86 10.295 7.824 -4.499 654 H ASP 87 H ASP 87 8.863 12.871 -5.730 655 HA ASP 87 HA ASP 87 9.869 14.926 -4.004 656 HB2 ASP 87 2HB ASP 87 8.706 14.840 -6.821 657 HB3 ASP 87 1HB ASP 87 8.674 16.394 -6.043 658 H ILE 88 H ILE 88 6.352 14.267 -4.584 659 HA ILE 88 HA ILE 88 5.745 16.645 -2.902 660 HB ILE 88 HB ILE 88 3.657 16.617 -2.750 661 HG12 ILE 88 2HG1 ILE 88 2.976 13.930 -4.048 662 HG13 ILE 88 1HG1 ILE 88 3.273 14.059 -2.338 663 HG21 ILE 88 1HG2 ILE 88 2.777 16.820 -5.027 664 HG22 ILE 88 2HG2 ILE 88 3.965 15.653 -5.653 665 HG23 ILE 88 3HG2 ILE 88 4.509 17.233 -5.073 666 HD11 ILE 88 3HD1 ILE 88 0.929 15.254 -3.829 667 HD12 ILE 88 1HD1 ILE 88 1.543 16.179 -2.442 668 HD13 ILE 88 2HD1 ILE 88 1.023 14.528 -2.212 669 H ALA 89 H ALA 89 6.073 13.226 -2.079 670 HA ALA 89 HA ALA 89 5.311 13.511 0.779 671 HB1 ALA 89 3HB ALA 89 6.631 11.357 1.024 672 HB2 ALA 89 1HB ALA 89 7.097 11.461 -0.686 673 HB3 ALA 89 2HB ALA 89 5.383 11.283 -0.231 674 H ALA 90 H ALA 90 8.556 13.665 -0.768 675 HA ALA 90 HA ALA 90 9.965 14.493 1.704 676 HB1 ALA 90 3HB ALA 90 10.634 14.688 -1.314 677 HB2 ALA 90 1HB ALA 90 11.072 13.371 -0.197 678 HB3 ALA 90 2HB ALA 90 11.815 14.980 -0.023 679 H SER 91 H SER 91 8.300 16.439 -0.736 680 HA SER 91 HA SER 91 9.281 19.080 0.257 681 HG SER 91 HG SER 91 6.364 17.486 -1.018 682 HB2 SER 91 2HB SER 91 7.645 20.017 -1.236 683 HB3 SER 91 1HB SER 91 8.305 18.623 -2.052 684 H LEU 92 H LEU 92 6.961 16.980 1.724 685 HA LEU 92 HA LEU 92 5.597 19.315 3.108 686 HG LEU 92 HG LEU 92 5.009 15.953 1.711 687 HB2 LEU 92 2HB LEU 92 3.758 17.807 3.825 688 HB3 LEU 92 1HB LEU 92 3.903 18.314 2.171 689 HD11 LEU 92 1HD1 LEU 92 4.148 14.132 3.126 690 HD12 LEU 92 2HD1 LEU 92 3.476 15.296 4.304 691 HD13 LEU 92 3HD1 LEU 92 5.231 15.153 4.037 692 HD21 LEU 92 3HD2 LEU 92 2.785 16.696 0.771 693 HD22 LEU 92 1HD2 LEU 92 1.978 16.161 2.269 694 HD23 LEU 92 2HD2 LEU 92 2.786 14.987 1.206 695 H ASP 93 H ASP 93 6.669 16.125 4.333 696 HA ASP 93 HA ASP 93 8.901 17.018 5.678 697 HB2 ASP 93 2HB ASP 93 6.588 17.550 7.568 698 HB3 ASP 93 1HB ASP 93 7.937 16.706 8.266 699 H ALA 94 H ALA 94 9.552 14.967 4.865 700 HA ALA 94 HA ALA 94 9.244 12.683 6.769 701 HB1 ALA 94 3HB ALA 94 8.176 11.061 5.228 702 HB2 ALA 94 1HB ALA 94 8.082 12.283 3.927 703 HB3 ALA 94 2HB ALA 94 7.124 12.468 5.415 704 H GLU 95 H GLU 95 10.619 11.012 6.586 705 HA GLU 95 HA GLU 95 12.951 11.178 4.635 706 HB2 GLU 95 2HB GLU 95 13.193 9.130 6.815 707 HB3 GLU 95 1HB GLU 95 14.401 10.031 5.949 708 HG2 GLU 95 2HG GLU 95 13.729 12.088 7.478 709 HG3 GLU 95 1HG GLU 95 12.764 10.922 8.385 710 H THR 96 H THR 96 11.026 8.454 6.103 711 HA THR 96 HA THR 96 10.951 7.018 3.449 712 HB THR 96 HB THR 96 9.406 5.301 4.857 713 HG1 THR 96 HG1 THR 96 9.043 6.379 6.731 714 HG21 THR 96 3HG2 THR 96 12.320 5.772 5.517 715 HG22 THR 96 1HG2 THR 96 11.753 4.650 4.222 716 HG23 THR 96 2HG2 THR 96 11.407 4.299 5.927 717 H ALA 97 H ALA 97 8.867 5.944 2.824 718 HA ALA 97 HA ALA 97 6.349 7.156 3.760 719 HB1 ALA 97 3HB ALA 97 5.464 7.806 1.362 720 HB2 ALA 97 1HB ALA 97 7.159 7.656 0.801 721 HB3 ALA 97 2HB ALA 97 6.733 8.836 2.055 722 H TYR 98 H TYR 98 4.338 6.141 2.658 723 HA TYR 98 HA TYR 98 4.813 3.179 2.099 724 HD1 TYR 98 HD1 TYR 98 4.730 0.968 4.146 725 HD2 TYR 98 HD2 TYR 98 4.731 4.934 5.748 726 HE1 TYR 98 HE1 TYR 98 6.638 0.385 5.588 727 HE2 TYR 98 HE2 TYR 98 6.550 4.321 7.256 728 HH TYR 98 HH TYR 98 7.997 2.833 7.842 729 HB2 TYR 98 2HB TYR 98 2.958 4.310 4.285 730 HB3 TYR 98 1HB TYR 98 2.794 2.669 3.713 731 H VAL 99 H VAL 99 2.771 1.968 1.460 732 HA VAL 99 HA VAL 99 0.823 3.628 -0.208 733 HB VAL 99 HB VAL 99 1.675 3.254 -2.152 734 HG11 VAL 99 1HG1 VAL 99 3.933 3.282 -1.285 735 HG12 VAL 99 2HG1 VAL 99 3.800 2.379 -2.790 736 HG13 VAL 99 3HG1 VAL 99 3.991 1.537 -1.254 737 HG21 VAL 99 3HG2 VAL 99 0.287 1.392 -2.625 738 HG22 VAL 99 1HG2 VAL 99 1.502 0.278 -2.003 739 HG23 VAL 99 2HG2 VAL 99 1.838 1.192 -3.485 740 H ILE 100 H ILE 100 -1.115 3.018 0.885 741 HA ILE 100 HA ILE 100 -1.772 0.269 1.343 742 HB ILE 100 HB ILE 100 -4.006 2.241 0.683 743 HG12 ILE 100 2HG1 ILE 100 -2.925 3.220 2.541 744 HG13 ILE 100 1HG1 ILE 100 -4.252 2.348 3.247 745 HG21 ILE 100 1HG2 ILE 100 -4.826 -0.160 0.666 746 HG22 ILE 100 2HG2 ILE 100 -5.492 0.746 2.031 747 HG23 ILE 100 3HG2 ILE 100 -4.147 -0.377 2.295 748 HD11 ILE 100 3HD1 ILE 100 -1.364 1.345 3.235 749 HD12 ILE 100 1HD1 ILE 100 -2.730 0.614 4.117 750 HD13 ILE 100 2HD1 ILE 100 -2.083 2.242 4.570 751 H GLY 101 H GLY 101 -2.601 1.806 -1.589 752 HA2 GLY 101 2HA GLY 101 -2.607 0.888 -3.803 753 HA3 GLY 101 1HA GLY 101 -1.556 -0.301 -3.195 754 H GLY 102 H GLY 102 -2.753 -2.410 -4.593 755 HA2 GLY 102 2HA GLY 102 -4.800 -0.320 -5.580 756 HA3 GLY 102 1HA GLY 102 -3.144 -0.194 -6.094 757 H ALA 103 H ALA 103 -6.096 -1.637 -6.875 758 HA ALA 103 HA ALA 103 -5.784 -3.073 -9.177 759 HB1 ALA 103 3HB ALA 103 -7.188 -0.240 -9.175 760 HB2 ALA 103 1HB ALA 103 -7.828 -1.625 -8.325 761 HB3 ALA 103 2HB ALA 103 -7.690 -1.660 -10.064 762 H ALA 104 H ALA 104 -4.537 0.208 -9.204 763 HA ALA 104 HA ALA 104 -2.760 -0.556 -11.570 764 HB1 ALA 104 3HB ALA 104 -4.134 1.349 -12.293 765 HB2 ALA 104 1HB ALA 104 -2.423 1.816 -12.136 766 HB3 ALA 104 2HB ALA 104 -3.588 2.307 -10.886 767 H ILE 105 H ILE 105 -2.813 0.477 -8.199 768 HA ILE 105 HA ILE 105 -0.281 1.969 -8.308 769 HB ILE 105 HB ILE 105 -1.418 1.047 -5.685 770 HG12 ILE 105 2HG1 ILE 105 -3.416 1.985 -6.682 771 HG13 ILE 105 1HG1 ILE 105 -2.779 3.062 -5.519 772 HG21 ILE 105 1HG2 ILE 105 -0.565 3.099 -4.741 773 HG22 ILE 105 2HG2 ILE 105 0.090 3.618 -6.294 774 HG23 ILE 105 3HG2 ILE 105 0.739 2.179 -5.475 775 HD11 ILE 105 3HD1 ILE 105 -1.762 3.711 -8.316 776 HD12 ILE 105 1HD1 ILE 105 -2.693 4.746 -7.189 777 HD13 ILE 105 2HD1 ILE 105 -3.525 3.546 -8.235 778 H TYR 106 H TYR 106 -0.744 -1.056 -6.387 779 HA TYR 106 HA TYR 106 2.107 -1.632 -6.036 780 HD1 TYR 106 HD1 TYR 106 2.847 -4.502 -4.865 781 HD2 TYR 106 HD2 TYR 106 -0.563 -2.369 -3.346 782 HE1 TYR 106 HE1 TYR 106 3.468 -5.113 -2.593 783 HE2 TYR 106 HE2 TYR 106 0.092 -2.976 -1.049 784 HH TYR 106 HH TYR 106 2.742 -4.010 -0.011 785 HB2 TYR 106 2HB TYR 106 -0.492 -3.170 -5.712 786 HB3 TYR 106 1HB TYR 106 0.832 -4.161 -6.207 787 H ALA 107 H ALA 107 0.033 -2.438 -8.789 788 HA ALA 107 HA ALA 107 1.944 -4.099 -10.330 789 HB1 ALA 107 3HB ALA 107 -0.506 -2.427 -11.150 790 HB2 ALA 107 1HB ALA 107 -0.530 -4.123 -10.675 791 HB3 ALA 107 2HB ALA 107 0.263 -3.659 -12.170 792 H LEU 108 H LEU 108 1.303 -0.604 -10.415 793 HA LEU 108 HA LEU 108 3.554 -0.140 -12.368 794 HG LEU 108 HG LEU 108 2.197 2.209 -9.799 795 HB2 LEU 108 2HB LEU 108 2.791 1.921 -12.761 796 HB3 LEU 108 1HB LEU 108 1.294 1.240 -12.227 797 HD11 LEU 108 1HD1 LEU 108 4.329 3.163 -11.002 798 HD12 LEU 108 2HD1 LEU 108 3.396 4.307 -10.047 799 HD13 LEU 108 3HD1 LEU 108 3.251 4.311 -11.814 800 HD21 LEU 108 3HD2 LEU 108 0.714 3.795 -11.961 801 HD22 LEU 108 1HD2 LEU 108 0.852 4.291 -10.263 802 HD23 LEU 108 2HD2 LEU 108 -0.020 2.800 -10.644 803 H PHE 109 H PHE 109 3.074 0.235 -8.859 804 HA PHE 109 HA PHE 109 5.739 1.333 -8.392 805 HD1 PHE 109 HD2 PHE 109 6.583 2.352 -5.946 806 HD2 PHE 109 HD1 PHE 109 2.415 2.536 -6.875 807 HE1 PHE 109 HE2 PHE 109 6.629 4.756 -5.586 808 HE2 PHE 109 HE1 PHE 109 2.444 4.958 -6.502 809 HZ PHE 109 HZ PHE 109 4.592 6.100 -5.915 810 HB2 PHE 109 2HB PHE 109 3.485 0.310 -6.565 811 HB3 PHE 109 1HB PHE 109 5.080 0.277 -5.891 812 H GLN 110 H GLN 110 4.864 -2.097 -8.383 813 HA GLN 110 HA GLN 110 6.735 -3.536 -7.093 814 HB2 GLN 110 2HB GLN 110 5.715 -3.768 -9.928 815 HB3 GLN 110 1HB GLN 110 7.110 -4.738 -9.597 816 HG2 GLN 110 2HG GLN 110 5.976 -6.006 -7.796 817 HG3 GLN 110 1HG GLN 110 4.627 -4.905 -7.787 818 HE21 GLN 110 1HE2 GLN 110 6.079 -7.549 -9.499 819 HE22 GLN 110 2HE2 GLN 110 4.598 -7.828 -10.566 820 HA PRO 111 HA PRO 111 11.015 -2.880 -9.209 821 HB2 PRO 111 2HB PRO 111 10.882 -0.631 -11.160 822 HB3 PRO 111 1HB PRO 111 11.415 -2.300 -11.393 823 HG2 PRO 111 2HG PRO 111 9.045 -1.326 -12.517 824 HG3 PRO 111 1HG PRO 111 9.307 -3.036 -12.086 825 HD2 PRO 111 2HD PRO 111 7.848 -0.898 -10.432 826 HD3 PRO 111 1HD PRO 111 7.332 -2.541 -10.826 827 H HIS 112 H HIS 112 9.106 -0.243 -8.144 828 HA HIS 112 HA HIS 112 11.483 1.625 -7.606 829 HD1 HIS 112 HD1 HIS 112 11.188 4.160 -9.579 830 HD2 HIS 112 HD2 HIS 112 7.684 1.790 -10.075 831 HE1 HIS 112 HE1 HIS 112 10.248 4.454 -11.985 832 HB2 HIS 112 2HB HIS 112 8.478 2.318 -7.568 833 HB3 HIS 112 1HB HIS 112 9.830 3.419 -7.384 834 H LEU 113 H LEU 113 9.329 -0.459 -5.802 835 HA LEU 113 HA LEU 113 9.363 1.134 -3.325 836 HG LEU 113 HG LEU 113 6.800 -1.281 -2.371 837 HB2 LEU 113 2HB LEU 113 9.052 -1.940 -3.638 838 HB3 LEU 113 1HB LEU 113 8.912 -1.098 -2.114 839 HD11 LEU 113 1HD1 LEU 113 7.100 1.191 -4.166 840 HD12 LEU 113 2HD1 LEU 113 7.070 1.191 -2.401 841 HD13 LEU 113 3HD1 LEU 113 5.611 0.759 -3.290 842 HD21 LEU 113 3HD2 LEU 113 5.544 -1.565 -4.511 843 HD22 LEU 113 1HD2 LEU 113 6.929 -2.665 -4.397 844 HD23 LEU 113 2HD2 LEU 113 7.064 -1.236 -5.425 845 H ASP 114 H ASP 114 10.552 1.130 -1.602 846 HA ASP 114 HA ASP 114 13.188 -0.262 -1.186 847 HB2 ASP 114 2HB ASP 114 12.807 1.911 -0.209 848 HB3 ASP 114 1HB ASP 114 11.272 1.475 0.510 849 H ARG 115 H ARG 115 9.936 -0.805 0.302 850 HA ARG 115 HA ARG 115 10.475 -3.823 0.223 851 HE ARG 115 HE ARG 115 12.348 -1.310 3.472 852 HB2 ARG 115 2HB ARG 115 9.939 -2.088 2.666 853 HB3 ARG 115 1HB ARG 115 9.061 -3.601 2.628 854 HG2 ARG 115 2HG ARG 115 10.928 -4.939 2.879 855 HG3 ARG 115 1HG ARG 115 12.012 -3.858 2.046 856 HD2 ARG 115 2HD ARG 115 10.846 -3.021 4.777 857 HD3 ARG 115 1HD ARG 115 12.130 -4.192 4.700 858 HH11 ARG 115 2HH1 ARG 115 13.985 -4.105 4.771 859 HH12 ARG 115 1HH1 ARG 115 15.605 -3.339 4.484 860 HH21 ARG 115 1HH2 ARG 115 14.155 -0.582 2.955 861 HH22 ARG 115 2HH2 ARG 115 15.679 -1.481 3.322 862 H MET 116 H MET 116 8.727 -5.197 0.165 863 HA MET 116 HA MET 116 5.949 -4.021 -0.513 864 HB2 MET 116 2HB MET 116 7.401 -6.459 -1.617 865 HB3 MET 116 1HB MET 116 5.643 -6.394 -1.606 866 HG2 MET 116 2HG MET 116 5.712 -4.415 -3.142 867 HG3 MET 116 1HG MET 116 7.459 -4.245 -2.885 868 HE1 MET 116 3HE MET 116 4.806 -7.046 -3.776 869 HE2 MET 116 1HE MET 116 5.395 -7.528 -5.394 870 HE3 MET 116 2HE MET 116 4.787 -5.862 -5.128 871 H VAL 117 H VAL 117 5.585 -3.795 1.747 872 HA VAL 117 HA VAL 117 5.099 -6.088 3.555 873 HB VAL 117 HB VAL 117 4.230 -3.185 3.574 874 HG11 VAL 117 1HG1 VAL 117 3.807 -5.172 5.902 875 HG12 VAL 117 2HG1 VAL 117 2.515 -4.391 4.957 876 HG13 VAL 117 3HG1 VAL 117 3.558 -3.404 5.987 877 HG21 VAL 117 3HG2 VAL 117 6.245 -4.671 5.396 878 HG22 VAL 117 1HG2 VAL 117 5.917 -2.918 5.415 879 HG23 VAL 117 2HG2 VAL 117 6.702 -3.664 4.003 880 H LEU 118 H LEU 118 3.556 -7.539 3.473 881 HA LEU 118 HA LEU 118 0.809 -6.918 2.248 882 HG LEU 118 HG LEU 118 -0.025 -9.326 0.949 883 HB2 LEU 118 2HB LEU 118 2.024 -7.669 0.462 884 HB3 LEU 118 1HB LEU 118 2.986 -8.832 1.306 885 HD11 LEU 118 1HD1 LEU 118 0.720 -8.861 -1.255 886 HD12 LEU 118 2HD1 LEU 118 0.632 -10.615 -1.164 887 HD13 LEU 118 3HD1 LEU 118 2.236 -9.815 -1.124 888 HD21 LEU 118 3HD2 LEU 118 0.857 -11.732 0.886 889 HD22 LEU 118 1HD2 LEU 118 1.166 -10.917 2.439 890 HD23 LEU 118 2HD2 LEU 118 2.486 -11.141 1.250 891 H SER 119 H SER 119 -0.867 -8.315 2.816 892 HA SER 119 HA SER 119 -0.586 -9.760 5.510 893 HG SER 119 HG SER 119 -3.623 -7.693 6.355 894 HB2 SER 119 2HB SER 119 -1.320 -7.737 6.209 895 HB3 SER 119 1HB SER 119 -2.052 -7.250 4.714 896 H ARG 120 H ARG 120 -1.111 -11.803 5.294 897 HA ARG 120 HA ARG 120 -2.732 -12.809 2.986 898 HE ARG 120 HE ARG 120 0.491 -16.017 1.481 899 HB2 ARG 120 2HB ARG 120 -1.403 -14.380 5.243 900 HB3 ARG 120 1HB ARG 120 -1.990 -15.073 3.759 901 HG2 ARG 120 2HG ARG 120 0.381 -13.103 4.007 902 HG3 ARG 120 1HG ARG 120 0.535 -14.831 3.981 903 HD2 ARG 120 2HD ARG 120 -0.615 -13.158 1.655 904 HD3 ARG 120 1HD ARG 120 1.054 -13.680 1.816 905 HH11 ARG 120 2HH1 ARG 120 -2.328 -13.998 1.027 906 HH12 ARG 120 1HH1 ARG 120 -3.071 -15.173 -0.136 907 HH21 ARG 120 1HH2 ARG 120 -0.339 -17.270 0.138 908 HH22 ARG 120 2HH2 ARG 120 -1.969 -16.962 -0.621 909 H VAL 121 H VAL 121 -4.911 -12.130 3.534 910 HA VAL 121 HA VAL 121 -6.083 -12.943 6.128 911 HB VAL 121 HB VAL 121 -7.897 -11.605 4.179 912 HG11 VAL 121 1HG1 VAL 121 -8.492 -12.195 6.675 913 HG12 VAL 121 2HG1 VAL 121 -8.816 -10.541 6.120 914 HG13 VAL 121 3HG1 VAL 121 -7.402 -10.867 7.129 915 HG21 VAL 121 3HG2 VAL 121 -6.982 -9.319 4.836 916 HG22 VAL 121 1HG2 VAL 121 -6.065 -10.219 3.669 917 HG23 VAL 121 2HG2 VAL 121 -5.463 -10.116 5.331 918 HA PRO 122 HA PRO 122 -8.151 -16.561 4.107 919 HB2 PRO 122 2HB PRO 122 -8.771 -17.365 6.981 920 HB3 PRO 122 1HB PRO 122 -8.036 -18.323 5.690 921 HG2 PRO 122 2HG PRO 122 -6.439 -17.359 7.661 922 HG3 PRO 122 1HG PRO 122 -5.870 -17.189 5.984 923 HD2 PRO 122 2HD PRO 122 -7.344 -15.031 7.630 924 HD3 PRO 122 1HD PRO 122 -5.782 -14.954 6.773 925 H GLY 123 H GLY 123 -10.191 -17.831 4.355 926 HA2 GLY 123 2HA GLY 123 -12.672 -17.743 4.869 927 HA3 GLY 123 1HA GLY 123 -12.652 -16.001 4.795 928 H GLU 124 H GLU 124 -10.835 -16.988 2.296 929 HA GLU 124 HA GLU 124 -11.022 -17.320 -0.031 930 HB2 GLU 124 2HB GLU 124 -13.122 -19.215 1.065 931 HB3 GLU 124 1HB GLU 124 -12.448 -19.323 -0.539 932 HG2 GLU 124 2HG GLU 124 -10.587 -20.450 0.183 933 HG3 GLU 124 1HG GLU 124 -10.177 -19.216 1.348 934 H TYR 125 H TYR 125 -11.510 -15.639 -1.302 935 HA TYR 125 HA TYR 125 -14.447 -14.969 -1.872 936 HD1 TYR 125 HD2 TYR 125 -15.477 -14.057 0.555 937 HD2 TYR 125 HD1 TYR 125 -11.431 -12.634 0.821 938 HE1 TYR 125 HE2 TYR 125 -15.604 -14.096 3.024 939 HE2 TYR 125 HE1 TYR 125 -11.555 -12.770 3.262 940 HH TYR 125 HH TYR 125 -12.727 -13.559 4.965 941 HB2 TYR 125 2HB TYR 125 -12.336 -12.819 -1.302 942 HB3 TYR 125 1HB TYR 125 -14.055 -12.599 -1.457 943 H GLU 126 H GLU 126 -14.590 -15.223 -4.164 944 HA GLU 126 HA GLU 126 -13.019 -14.661 -6.146 945 HB2 GLU 126 2HB GLU 126 -15.763 -13.466 -6.657 946 HB3 GLU 126 1HB GLU 126 -14.736 -14.418 -7.684 947 HG2 GLU 126 2HG GLU 126 -16.284 -15.647 -5.294 948 HG3 GLU 126 1HG GLU 126 -16.921 -15.474 -6.920 949 H GLY 127 H GLY 127 -14.993 -11.803 -5.281 950 HA2 GLY 127 2HA GLY 127 -14.104 -9.540 -4.783 951 HA3 GLY 127 1HA GLY 127 -12.530 -10.048 -5.334 952 H ASP 128 H ASP 128 -13.376 -7.594 -5.716 953 HA ASP 128 HA ASP 128 -13.686 -7.331 -8.761 954 HB2 ASP 128 2HB ASP 128 -14.419 -5.257 -6.577 955 HB3 ASP 128 1HB ASP 128 -14.423 -4.959 -8.307 956 H THR 129 H THR 129 -11.881 -5.943 -5.957 957 HA THR 129 HA THR 129 -9.815 -4.748 -7.805 958 HB THR 129 HB THR 129 -9.574 -4.871 -4.779 959 HG1 THR 129 HG1 THR 129 -10.740 -3.054 -4.599 960 HG21 THR 129 3HG2 THR 129 -8.796 -2.570 -6.656 961 HG22 THR 129 1HG2 THR 129 -7.642 -3.872 -6.281 962 HG23 THR 129 2HG2 THR 129 -8.261 -2.827 -4.973 963 H TYR 130 H TYR 130 -8.244 -6.021 -8.585 964 HA TYR 130 HA TYR 130 -7.183 -8.435 -7.069 965 HD1 TYR 130 HD1 TYR 130 -9.761 -7.803 -9.849 966 HD2 TYR 130 HD2 TYR 130 -7.189 -11.073 -8.804 967 HE1 TYR 130 HE1 TYR 130 -11.673 -9.353 -9.974 968 HE2 TYR 130 HE2 TYR 130 -9.110 -12.629 -9.014 969 HH TYR 130 HH TYR 130 -12.143 -11.704 -8.768 970 HB2 TYR 130 2HB TYR 130 -7.166 -7.598 -10.031 971 HB3 TYR 130 1HB TYR 130 -6.201 -8.922 -9.440 972 H TYR 131 H TYR 131 -5.175 -8.775 -6.472 973 HA TYR 131 HA TYR 131 -3.118 -6.594 -6.547 974 HD1 TYR 131 HD2 TYR 131 -0.851 -9.867 -5.327 975 HD2 TYR 131 HD1 TYR 131 -2.130 -6.264 -3.416 976 HE1 TYR 131 HE2 TYR 131 1.430 -9.483 -4.573 977 HE2 TYR 131 HE1 TYR 131 0.124 -6.009 -2.453 978 HH TYR 131 HH TYR 131 2.294 -7.052 -2.224 979 HB2 TYR 131 2HB TYR 131 -3.782 -7.867 -4.461 980 HB3 TYR 131 1HB TYR 131 -3.247 -9.344 -5.131 981 HA PRO 132 HA PRO 132 -0.537 -8.739 -9.725 982 HB2 PRO 132 2HB PRO 132 1.991 -7.501 -8.827 983 HB3 PRO 132 1HB PRO 132 1.019 -7.129 -10.248 984 HG2 PRO 132 2HG PRO 132 1.279 -5.424 -8.082 985 HG3 PRO 132 1HG PRO 132 -0.157 -5.427 -9.114 986 HD2 PRO 132 2HD PRO 132 0.121 -6.704 -6.385 987 HD3 PRO 132 1HD PRO 132 -1.243 -5.780 -7.099 988 H GLU 133 H GLU 133 1.706 -9.844 -10.086 989 HA GLU 133 HA GLU 133 1.908 -12.122 -8.168 990 HB2 GLU 133 2HB GLU 133 3.652 -13.003 -9.861 991 HB3 GLU 133 1HB GLU 133 1.968 -13.000 -10.258 992 HG2 GLU 133 2HG GLU 133 3.761 -10.701 -11.268 993 HG3 GLU 133 1HG GLU 133 3.747 -12.251 -12.098 994 H TRP 134 H TRP 134 3.791 -12.948 -7.335 995 HA TRP 134 HA TRP 134 5.998 -10.977 -6.553 996 HD1 TRP 134 HD1 TRP 134 5.540 -15.099 -5.122 997 HE1 TRP 134 HE1 TRP 134 3.347 -16.514 -4.698 998 HE3 TRP 134 HE3 TRP 134 2.595 -11.212 -3.617 999 HZ2 TRP 134 HZ2 TRP 134 0.765 -15.867 -3.762 1000 HZ3 TRP 134 HZ3 TRP 134 0.221 -11.657 -3.091 1001 HH2 TRP 134 HH2 TRP 134 -0.678 -13.960 -3.126 1002 HB2 TRP 134 2HB TRP 134 6.224 -12.227 -4.371 1003 HB3 TRP 134 1HB TRP 134 4.811 -11.248 -4.541 1004 H ASP 135 H ASP 135 8.115 -11.597 -7.032 1005 HA ASP 135 HA ASP 135 8.540 -14.386 -8.230 1006 HB2 ASP 135 2HB ASP 135 8.499 -12.473 -9.852 1007 HB3 ASP 135 1HB ASP 135 9.802 -11.669 -8.975 1008 H ALA 136 H ALA 136 11.340 -13.644 -8.233 1009 HA ALA 136 HA ALA 136 12.235 -14.153 -5.342 1010 HB1 ALA 136 3HB ALA 136 13.222 -16.370 -5.975 1011 HB2 ALA 136 1HB ALA 136 12.857 -16.086 -7.702 1012 HB3 ALA 136 2HB ALA 136 11.530 -16.374 -6.543 1013 H ALA 137 H ALA 137 13.196 -13.214 -8.588 1014 HA ALA 137 HA ALA 137 15.875 -12.246 -7.431 1015 HB1 ALA 137 3HB ALA 137 16.283 -13.764 -9.329 1016 HB2 ALA 137 1HB ALA 137 16.745 -12.102 -9.766 1017 HB3 ALA 137 2HB ALA 137 15.237 -12.798 -10.399 1018 H GLU 138 H GLU 138 12.833 -10.966 -8.443 1019 HA GLU 138 HA GLU 138 13.958 -8.156 -8.568 1020 HB2 GLU 138 2HB GLU 138 11.025 -8.955 -8.421 1021 HB3 GLU 138 1HB GLU 138 11.727 -7.376 -8.716 1022 HG2 GLU 138 2HG GLU 138 12.814 -8.653 -10.886 1023 HG3 GLU 138 1HG GLU 138 11.414 -9.687 -10.636 1024 H TRP 139 H TRP 139 11.884 -9.971 -6.215 1025 HA TRP 139 HA TRP 139 13.180 -8.446 -3.900 1026 HD1 TRP 139 HD1 TRP 139 8.972 -10.377 -4.272 1027 HE1 TRP 139 HE1 TRP 139 7.475 -10.006 -6.482 1028 HE3 TRP 139 HE3 TRP 139 10.993 -5.945 -5.641 1029 HZ2 TRP 139 HZ2 TRP 139 7.756 -8.257 -8.648 1030 HZ3 TRP 139 HZ3 TRP 139 10.442 -5.015 -7.869 1031 HH2 TRP 139 HH2 TRP 139 8.859 -6.166 -9.356 1032 HB2 TRP 139 2HB TRP 139 10.725 -8.584 -2.791 1033 HB3 TRP 139 1HB TRP 139 11.301 -7.240 -3.710 1034 H GLU 140 H GLU 140 13.585 -9.448 -2.062 1035 HA GLU 140 HA GLU 140 12.967 -12.434 -1.811 1036 HB2 GLU 140 2HB GLU 140 15.029 -12.895 -1.040 1037 HB3 GLU 140 1HB GLU 140 15.431 -11.587 -2.110 1038 HG2 GLU 140 2HG GLU 140 15.536 -10.064 0.056 1039 HG3 GLU 140 1HG GLU 140 15.336 -11.548 0.986 1040 H LEU 141 H LEU 141 13.333 -12.751 0.988 1041 HA LEU 141 HA LEU 141 10.724 -11.452 1.948 1042 HG LEU 141 HG LEU 141 9.496 -14.746 3.130 1043 HB2 LEU 141 2HB LEU 141 11.445 -14.208 1.813 1044 HB3 LEU 141 1HB LEU 141 11.657 -13.815 3.480 1045 HD11 LEU 141 1HD1 LEU 141 7.932 -13.208 4.105 1046 HD12 LEU 141 2HD1 LEU 141 8.825 -11.789 3.533 1047 HD13 LEU 141 3HD1 LEU 141 9.514 -12.822 4.800 1048 HD21 LEU 141 3HD2 LEU 141 9.268 -14.244 0.661 1049 HD22 LEU 141 1HD2 LEU 141 8.760 -12.598 1.066 1050 HD23 LEU 141 2HD2 LEU 141 7.774 -13.970 1.583 1051 H ASP 142 H ASP 142 11.013 -9.880 3.460 1052 HA ASP 142 HA ASP 142 13.573 -9.537 5.044 1053 HB2 ASP 142 2HB ASP 142 12.331 -7.650 3.747 1054 HB3 ASP 142 1HB ASP 142 11.129 -7.690 5.009 1055 H ALA 143 H ALA 143 10.001 -9.771 5.744 1056 HA ALA 143 HA ALA 143 10.628 -11.529 8.143 1057 HB1 ALA 143 3HB ALA 143 8.985 -8.896 8.391 1058 HB2 ALA 143 1HB ALA 143 10.652 -9.113 8.957 1059 HB3 ALA 143 2HB ALA 143 9.331 -10.038 9.713 1060 H GLU 144 H GLU 144 9.168 -13.140 8.509 1061 HA GLU 144 HA GLU 144 6.255 -12.778 7.586 1062 HB2 GLU 144 2HB GLU 144 7.761 -14.407 6.261 1063 HB3 GLU 144 1HB GLU 144 7.694 -15.482 7.661 1064 HG2 GLU 144 2HG GLU 144 5.128 -15.483 7.462 1065 HG3 GLU 144 1HG GLU 144 5.257 -14.387 6.085 1066 H THR 145 H THR 145 4.895 -12.530 9.218 1067 HA THR 145 HA THR 145 5.024 -14.426 11.568 1068 HB THR 145 HB THR 145 6.236 -12.393 12.356 1069 HG1 THR 145 HG1 THR 145 3.810 -13.056 13.676 1070 HG21 THR 145 3HG2 THR 145 4.404 -10.620 13.381 1071 HG22 THR 145 1HG2 THR 145 3.636 -10.914 11.803 1072 HG23 THR 145 2HG2 THR 145 5.302 -10.302 11.902 1073 H ASP 146 H ASP 146 3.116 -14.920 12.652 1074 HA ASP 146 HA ASP 146 0.565 -14.407 11.319 1075 HB2 ASP 146 2HB ASP 146 -0.397 -15.785 13.092 1076 HB3 ASP 146 1HB ASP 146 0.990 -16.525 12.328 1077 H HIS 147 H HIS 147 -1.264 -13.388 12.027 1078 HA HIS 147 HA HIS 147 -1.193 -11.317 14.243 1079 HD1 HIS 147 HD1 HIS 147 1.245 -10.586 13.152 1080 HD2 HIS 147 HD2 HIS 147 -1.526 -7.411 12.607 1081 HE1 HIS 147 HE1 HIS 147 2.436 -8.310 13.487 1082 HB2 HIS 147 2HB HIS 147 -1.212 -10.702 11.249 1083 HB3 HIS 147 1HB HIS 147 -2.445 -9.871 12.155 1084 H GLU 148 H GLU 148 -3.654 -10.229 14.155 1085 HA GLU 148 HA GLU 148 -5.187 -12.440 15.270 1086 HB2 GLU 148 2HB GLU 148 -6.315 -9.668 14.694 1087 HB3 GLU 148 1HB GLU 148 -7.051 -10.851 15.699 1088 HG2 GLU 148 2HG GLU 148 -5.244 -10.679 17.423 1089 HG3 GLU 148 1HG GLU 148 -4.326 -9.574 16.435 1090 H GLY 149 H GLY 149 -6.001 -10.663 12.236 1091 HA2 GLY 149 2HA GLY 149 -7.962 -12.935 11.416 1092 HA3 GLY 149 1HA GLY 149 -7.982 -11.333 10.735 1093 H PHE 150 H PHE 150 -4.775 -12.466 10.919 1094 HA PHE 150 HA PHE 150 -4.600 -13.588 8.160 1095 HD1 PHE 150 HD2 PHE 150 -5.634 -9.667 9.491 1096 HD2 PHE 150 HD1 PHE 150 -1.737 -10.360 7.883 1097 HE1 PHE 150 HE2 PHE 150 -4.831 -7.618 10.553 1098 HE2 PHE 150 HE1 PHE 150 -0.914 -8.299 8.975 1099 HZ PHE 150 HZ PHE 150 -2.487 -6.907 10.307 1100 HB2 PHE 150 2HB PHE 150 -3.754 -11.583 6.999 1101 HB3 PHE 150 1HB PHE 150 -5.314 -11.269 7.640 1102 H THR 151 H THR 151 -2.299 -13.324 7.198 1103 HA THR 151 HA THR 151 -0.184 -13.398 9.429 1104 HB THR 151 HB THR 151 1.176 -14.928 8.566 1105 HG1 THR 151 HG1 THR 151 1.545 -14.127 6.581 1106 HG21 THR 151 3HG2 THR 151 -1.360 -16.026 7.213 1107 HG22 THR 151 1HG2 THR 151 -1.067 -16.128 8.959 1108 HG23 THR 151 2HG2 THR 151 0.027 -16.951 7.814 1109 H LEU 152 H LEU 152 1.133 -11.818 9.451 1110 HA LEU 152 HA LEU 152 1.287 -9.629 7.412 1111 HG LEU 152 HG LEU 152 3.121 -7.716 10.248 1112 HB2 LEU 152 2HB LEU 152 1.228 -8.907 9.655 1113 HB3 LEU 152 1HB LEU 152 2.405 -10.059 10.198 1114 HD11 LEU 152 1HD1 LEU 152 5.395 -8.118 9.748 1115 HD12 LEU 152 2HD1 LEU 152 5.055 -9.014 8.268 1116 HD13 LEU 152 3HD1 LEU 152 4.780 -9.789 9.819 1117 HD21 LEU 152 3HD2 LEU 152 2.005 -6.902 8.104 1118 HD22 LEU 152 1HD2 LEU 152 3.303 -7.651 7.167 1119 HD23 LEU 152 2HD2 LEU 152 3.687 -6.376 8.322 1120 H GLN 153 H GLN 153 2.785 -9.383 6.092 1121 HA GLN 153 HA GLN 153 5.178 -11.254 5.651 1122 HB2 GLN 153 2HB GLN 153 2.632 -10.760 4.071 1123 HB3 GLN 153 1HB GLN 153 4.034 -10.415 3.117 1124 HG2 GLN 153 2HG GLN 153 3.998 -13.085 4.665 1125 HG3 GLN 153 1HG GLN 153 2.874 -12.888 3.330 1126 HE21 GLN 153 1HE2 GLN 153 4.596 -14.796 2.754 1127 HE22 GLN 153 2HE2 GLN 153 5.690 -14.092 1.508 1128 H GLU 154 H GLU 154 6.973 -10.082 5.380 1129 HA GLU 154 HA GLU 154 6.811 -7.289 4.100 1130 HB2 GLU 154 2HB GLU 154 8.913 -8.027 6.185 1131 HB3 GLU 154 1HB GLU 154 8.624 -6.484 5.455 1132 HG2 GLU 154 2HG GLU 154 6.213 -6.633 6.605 1133 HG3 GLU 154 1HG GLU 154 6.924 -7.946 7.520 1134 H TRP 155 H TRP 155 7.552 -7.522 2.124 1135 HA TRP 155 HA TRP 155 9.878 -9.375 1.409 1136 HD1 TRP 155 HD1 TRP 155 5.649 -9.148 0.570 1137 HE1 TRP 155 HE1 TRP 155 4.624 -11.364 -0.405 1138 HE3 TRP 155 HE3 TRP 155 9.926 -10.823 -1.641 1139 HZ2 TRP 155 HZ2 TRP 155 5.733 -13.575 -1.760 1140 HZ3 TRP 155 HZ3 TRP 155 9.861 -13.010 -2.829 1141 HH2 TRP 155 HH2 TRP 155 7.798 -14.336 -2.908 1142 HB2 TRP 155 2HB TRP 155 7.831 -7.731 -0.157 1143 HB3 TRP 155 1HB TRP 155 9.118 -8.559 -0.989 1144 H VAL 156 H VAL 156 12.027 -8.533 0.970 1145 HA VAL 156 HA VAL 156 12.285 -5.495 0.522 1146 HB VAL 156 HB VAL 156 13.397 -6.193 2.548 1147 HG11 VAL 156 1HG1 VAL 156 15.531 -7.532 2.529 1148 HG12 VAL 156 2HG1 VAL 156 15.299 -7.857 0.783 1149 HG13 VAL 156 3HG1 VAL 156 14.154 -8.511 1.973 1150 HG21 VAL 156 3HG2 VAL 156 15.451 -5.213 0.493 1151 HG22 VAL 156 1HG2 VAL 156 15.514 -5.018 2.267 1152 HG23 VAL 156 2HG2 VAL 156 14.269 -4.177 1.325 1153 H ARG 157 H ARG 157 13.035 -4.668 -1.326 1154 HA ARG 157 HA ARG 157 13.646 -6.170 -3.754 1155 HE ARG 157 HE ARG 157 14.792 -3.420 -6.751 1156 HB2 ARG 157 2HB ARG 157 13.847 -3.291 -2.845 1157 HB3 ARG 157 1HB ARG 157 15.032 -3.717 -4.043 1158 HG2 ARG 157 2HG ARG 157 12.962 -4.742 -5.449 1159 HG3 ARG 157 1HG ARG 157 11.985 -3.849 -4.285 1160 HD2 ARG 157 2HD ARG 157 12.263 -2.339 -6.163 1161 HD3 ARG 157 1HD ARG 157 13.249 -1.776 -4.816 1162 HH11 ARG 157 2HH1 ARG 157 13.813 -0.191 -5.898 1163 HH12 ARG 157 1HH1 ARG 157 15.412 0.539 -6.282 1164 HH21 ARG 157 1HH2 ARG 157 16.639 -2.625 -7.072 1165 HH22 ARG 157 2HH2 ARG 157 16.973 -0.824 -6.940 1166 H SER 158 H SER 158 15.356 -6.701 -4.868 1167 HA SER 158 HA SER 158 17.139 -8.276 -3.614 1168 HG SER 158 HG SER 158 18.055 -9.783 -5.814 1169 HB2 SER 158 2HB SER 158 16.421 -8.502 -5.932 1170 HB3 SER 158 1HB SER 158 17.457 -7.157 -6.446 1171 H ALA 159 H ALA 159 18.846 -8.228 -2.459 1172 HA ALA 159 HA ALA 159 20.624 -6.058 -1.910 1173 HB1 ALA 159 3HB ALA 159 21.090 -9.090 -1.467 1174 HB2 ALA 159 1HB ALA 159 19.999 -8.102 -0.477 1175 HB3 ALA 159 2HB ALA 159 21.742 -7.762 -0.472 1176 H SER 160 H SER 160 21.231 -8.606 -4.154 1177 HA SER 160 HA SER 160 23.081 -9.187 -5.628 1178 HG SER 160 HG SER 160 23.120 -6.516 -8.042 1179 HB2 SER 160 2HB SER 160 21.446 -7.666 -6.640 1180 HB3 SER 160 1HB SER 160 22.355 -6.256 -6.072 1181 H SER 161 H SER 161 24.721 -9.419 -3.805 1182 HA SER 161 HA SER 161 27.147 -7.592 -4.285 1183 HG SER 161 HG SER 161 27.908 -6.855 -1.639 1184 HB2 SER 161 2HB SER 161 25.954 -7.424 -2.105 1185 HB3 SER 161 1HB SER 161 26.369 -9.123 -1.738 1186 H ARG 162 H ARG 162 28.978 -8.393 -5.105 1187 HA ARG 162 HA ARG 162 29.924 -11.151 -4.345 1188 HE ARG 162 HE ARG 162 30.787 -15.069 -7.208 1189 HB2 ARG 162 1HB ARG 162 28.437 -11.300 -6.511 1190 HB3 ARG 162 2HB ARG 162 29.755 -10.505 -7.356 1191 HG2 ARG 162 1HG ARG 162 31.305 -12.422 -6.789 1192 HG3 ARG 162 2HG ARG 162 30.075 -13.118 -5.708 1193 HD2 ARG 162 1HD ARG 162 28.487 -13.388 -7.692 1194 HD3 ARG 162 2HD ARG 162 29.742 -12.755 -8.764 1195 HH11 ARG 162 2HH1 ARG 162 28.621 -14.457 -9.916 1196 HH12 ARG 162 1HH1 ARG 162 29.030 -16.099 -10.601 1197 HH21 ARG 162 1HH2 ARG 162 31.205 -16.944 -8.148 1198 HH22 ARG 162 2HH2 ARG 162 30.331 -17.328 -9.693 Start of MODEL 18 1 HA MET 1 HA MET 1 16.341 4.340 1.862 2 H1 MET 1 1H MET 1 15.912 6.602 2.975 3 H2 MET 1 2H MET 1 15.333 5.763 4.235 4 HB2 MET 1 1HB MET 1 14.139 3.662 3.886 5 HB3 MET 1 2HB MET 1 14.629 2.629 2.579 6 HG2 MET 1 1HG MET 1 16.417 3.402 4.967 7 HG3 MET 1 2HG MET 1 15.586 1.859 4.732 8 HE1 MET 1 3HE MET 1 17.779 0.680 5.206 9 HE2 MET 1 1HE MET 1 18.782 2.161 5.263 10 HE3 MET 1 2HE MET 1 19.267 0.782 4.220 11 H GLU 2 H GLU 2 13.668 3.428 1.091 12 HA GLU 2 HA GLU 2 12.220 5.943 0.264 13 HB2 GLU 2 2HB GLU 2 12.142 5.517 -2.094 14 HB3 GLU 2 1HB GLU 2 13.785 5.647 -1.524 15 HG2 GLU 2 2HG GLU 2 13.690 2.924 -1.525 16 HG3 GLU 2 1HG GLU 2 12.361 3.171 -2.662 17 H LEU 3 H LEU 3 10.581 3.687 -1.458 18 HA LEU 3 HA LEU 3 8.629 3.740 0.876 19 HG LEU 3 HG LEU 3 8.980 5.748 -2.173 20 HB2 LEU 3 2HB LEU 3 6.741 4.067 -0.903 21 HB3 LEU 3 1HB LEU 3 7.688 5.338 -0.218 22 HD11 LEU 3 1HD1 LEU 3 7.540 3.403 -3.633 23 HD12 LEU 3 2HD1 LEU 3 9.206 3.321 -3.025 24 HD13 LEU 3 3HD1 LEU 3 8.818 4.475 -4.276 25 HD21 LEU 3 3HD2 LEU 3 6.981 6.297 -3.772 26 HD22 LEU 3 1HD2 LEU 3 6.833 6.872 -2.097 27 HD23 LEU 3 2HD2 LEU 3 5.944 5.421 -2.625 28 H VAL 4 H VAL 4 7.113 2.410 1.374 29 HA VAL 4 HA VAL 4 7.460 -0.446 0.374 30 HB VAL 4 HB VAL 4 7.092 0.654 3.180 31 HG11 VAL 4 1HG1 VAL 4 6.188 -1.617 3.168 32 HG12 VAL 4 2HG1 VAL 4 7.812 -1.746 3.909 33 HG13 VAL 4 3HG1 VAL 4 7.529 -2.214 2.220 34 HG21 VAL 4 3HG2 VAL 4 9.316 1.289 2.555 35 HG22 VAL 4 1HG2 VAL 4 9.707 -0.292 1.890 36 HG23 VAL 4 2HG2 VAL 4 9.463 -0.077 3.651 37 H SER 5 H SER 5 5.749 -1.556 -0.295 38 HA SER 5 HA SER 5 3.012 -0.338 -0.034 39 HG SER 5 HG SER 5 4.277 -3.355 -1.020 40 HB2 SER 5 2HB SER 5 2.502 -1.756 -1.988 41 HB3 SER 5 1HB SER 5 4.009 -0.861 -2.218 42 H VAL 6 H VAL 6 1.315 -0.993 1.050 43 HA VAL 6 HA VAL 6 1.389 -3.650 2.506 44 HB VAL 6 HB VAL 6 1.412 -2.888 4.531 45 HG11 VAL 6 1HG1 VAL 6 2.299 -0.085 3.641 46 HG12 VAL 6 2HG1 VAL 6 3.365 -1.479 3.516 47 HG13 VAL 6 3HG1 VAL 6 2.752 -0.976 5.102 48 HG21 VAL 6 3HG2 VAL 6 0.382 -1.010 5.668 49 HG22 VAL 6 1HG2 VAL 6 -0.842 -1.828 4.680 50 HG23 VAL 6 2HG2 VAL 6 -0.106 -0.311 4.128 51 H ALA 7 H ALA 7 -0.054 -4.673 1.205 52 HA ALA 7 HA ALA 7 -2.986 -3.727 1.457 53 HB1 ALA 7 3HB ALA 7 -1.675 -5.170 -0.941 54 HB2 ALA 7 1HB ALA 7 -2.318 -3.520 -0.914 55 HB3 ALA 7 2HB ALA 7 -3.422 -4.884 -0.762 56 H ALA 8 H ALA 8 -4.391 -5.139 2.370 57 HA ALA 8 HA ALA 8 -3.558 -7.960 2.974 58 HB1 ALA 8 3HB ALA 8 -4.389 -6.360 4.766 59 HB2 ALA 8 1HB ALA 8 -5.459 -7.752 4.640 60 HB3 ALA 8 2HB ALA 8 -5.916 -6.190 3.933 61 H LEU 9 H LEU 9 -4.245 -9.791 2.006 62 HA LEU 9 HA LEU 9 -6.785 -9.911 0.424 63 HG LEU 9 HG LEU 9 -3.702 -9.605 -2.535 64 HB2 LEU 9 2HB LEU 9 -5.760 -10.278 -1.753 65 HB3 LEU 9 1HB LEU 9 -5.518 -8.709 -1.122 66 HD11 LEU 9 1HD1 LEU 9 -2.813 -8.687 0.263 67 HD12 LEU 9 2HD1 LEU 9 -3.271 -7.648 -1.106 68 HD13 LEU 9 3HD1 LEU 9 -1.817 -8.631 -1.181 69 HD21 LEU 9 3HD2 LEU 9 -2.846 -11.398 -0.188 70 HD22 LEU 9 1HD2 LEU 9 -2.010 -11.197 -1.737 71 HD23 LEU 9 2HD2 LEU 9 -3.607 -11.967 -1.708 72 H ALA 10 H ALA 10 -7.413 -11.822 -0.596 73 HA ALA 10 HA ALA 10 -6.312 -14.412 0.642 74 HB1 ALA 10 3HB ALA 10 -9.218 -13.414 0.048 75 HB2 ALA 10 1HB ALA 10 -8.436 -13.426 1.640 76 HB3 ALA 10 2HB ALA 10 -8.818 -14.943 0.835 77 H GLU 11 H GLU 11 -8.785 -15.495 -1.147 78 HA GLU 11 HA GLU 11 -6.974 -16.738 -3.171 79 HB2 GLU 11 2HB GLU 11 -8.667 -18.081 -1.918 80 HB3 GLU 11 1HB GLU 11 -9.971 -17.149 -2.636 81 HG2 GLU 11 2HG GLU 11 -9.776 -19.348 -3.736 82 HG3 GLU 11 1HG GLU 11 -9.514 -18.061 -4.885 83 H ASN 12 H ASN 12 -7.443 -16.827 -5.390 84 HA ASN 12 HA ASN 12 -6.834 -15.531 -7.215 85 HB2 ASN 12 2HB ASN 12 -9.702 -15.309 -7.011 86 HB3 ASN 12 1HB ASN 12 -9.203 -13.702 -7.401 87 HD21 ASN 12 1HD2 ASN 12 -7.444 -13.726 -9.279 88 HD22 ASN 12 2HD2 ASN 12 -7.990 -14.788 -10.689 89 H ARG 13 H ARG 13 -6.148 -14.267 -4.555 90 HA ARG 13 HA ARG 13 -5.143 -12.394 -3.683 91 HE ARG 13 HE ARG 13 -2.573 -11.803 -9.417 92 HB2 ARG 13 2HB ARG 13 -3.335 -11.351 -4.860 93 HB3 ARG 13 1HB ARG 13 -3.323 -13.090 -4.958 94 HG2 ARG 13 2HG ARG 13 -4.161 -13.012 -7.322 95 HG3 ARG 13 1HG ARG 13 -4.176 -11.240 -7.313 96 HD2 ARG 13 2HD ARG 13 -1.744 -11.148 -7.040 97 HD3 ARG 13 1HD ARG 13 -1.631 -12.853 -6.663 98 HH11 ARG 13 2HH1 ARG 13 -0.319 -13.696 -7.634 99 HH12 ARG 13 1HH1 ARG 13 0.267 -14.573 -9.129 100 HH21 ARG 13 1HH2 ARG 13 -1.929 -12.822 -11.102 101 HH22 ARG 13 2HH2 ARG 13 -0.591 -14.034 -11.029 102 H VAL 14 H VAL 14 -7.402 -11.856 -3.573 103 HA VAL 14 HA VAL 14 -8.260 -9.312 -4.928 104 HB VAL 14 HB VAL 14 -9.577 -11.483 -3.199 105 HG11 VAL 14 1HG1 VAL 14 -11.732 -10.364 -3.132 106 HG12 VAL 14 2HG1 VAL 14 -11.055 -8.858 -3.820 107 HG13 VAL 14 3HG1 VAL 14 -10.566 -9.425 -2.209 108 HG21 VAL 14 3HG2 VAL 14 -11.095 -11.584 -5.229 109 HG22 VAL 14 1HG2 VAL 14 -9.381 -11.770 -5.682 110 HG23 VAL 14 2HG2 VAL 14 -10.216 -10.214 -5.966 111 H ILE 15 H ILE 15 -7.513 -7.484 -4.193 112 HA ILE 15 HA ILE 15 -6.723 -6.832 -1.379 113 HB ILE 15 HB ILE 15 -7.395 -4.897 -3.657 114 HG12 ILE 15 2HG1 ILE 15 -4.487 -5.488 -2.873 115 HG13 ILE 15 1HG1 ILE 15 -5.291 -6.609 -3.935 116 HG21 ILE 15 1HG2 ILE 15 -7.355 -3.783 -1.358 117 HG22 ILE 15 2HG2 ILE 15 -6.076 -3.163 -2.388 118 HG23 ILE 15 3HG2 ILE 15 -5.687 -4.338 -1.117 119 HD11 ILE 15 3HD1 ILE 15 -4.011 -4.768 -5.197 120 HD12 ILE 15 1HD1 ILE 15 -5.238 -3.609 -4.628 121 HD13 ILE 15 2HD1 ILE 15 -5.698 -4.960 -5.683 122 H GLY 16 H GLY 16 -9.579 -5.824 -3.301 123 HA2 GLY 16 2HA GLY 16 -11.429 -6.475 -1.178 124 HA3 GLY 16 1HA GLY 16 -11.164 -4.730 -1.071 125 H ARG 17 H ARG 17 -13.128 -4.185 -1.620 126 HA ARG 17 HA ARG 17 -14.459 -5.050 -4.229 127 HE ARG 17 HE ARG 17 -17.896 -7.256 -3.669 128 HB2 ARG 17 2HB ARG 17 -15.460 -5.649 -1.365 129 HB3 ARG 17 1HB ARG 17 -16.594 -5.416 -2.668 130 HG2 ARG 17 2HG ARG 17 -15.426 -7.369 -3.961 131 HG3 ARG 17 1HG ARG 17 -14.428 -7.630 -2.554 132 HD2 ARG 17 2HD ARG 17 -16.304 -9.203 -2.429 133 HD3 ARG 17 1HD ARG 17 -16.445 -8.021 -1.129 134 HH11 ARG 17 2HH1 ARG 17 -18.246 -8.879 -0.674 135 HH12 ARG 17 1HH1 ARG 17 -19.980 -8.379 -0.448 136 HH21 ARG 17 1HH2 ARG 17 -19.850 -6.618 -3.430 137 HH22 ARG 17 2HH2 ARG 17 -20.846 -7.126 -1.992 138 H ASP 18 H ASP 18 -15.362 -3.164 -1.272 139 HA ASP 18 HA ASP 18 -16.572 -1.030 -2.989 140 HB2 ASP 18 2HB ASP 18 -17.107 0.108 -0.820 141 HB3 ASP 18 1HB ASP 18 -17.894 -1.416 -1.159 142 H GLY 19 H GLY 19 -13.787 -0.947 -0.734 143 HA2 GLY 19 2HA GLY 19 -12.285 0.767 -2.792 144 HA3 GLY 19 1HA GLY 19 -12.614 1.531 -1.278 145 H GLU 20 H GLU 20 -11.541 0.547 0.642 146 HA GLU 20 HA GLU 20 -8.864 -0.642 -0.027 147 HB2 GLU 20 2HB GLU 20 -8.064 -0.557 2.214 148 HB3 GLU 20 1HB GLU 20 -8.413 0.986 1.477 149 HG2 GLU 20 2HG GLU 20 -10.481 1.203 2.949 150 HG3 GLU 20 1HG GLU 20 -10.075 -0.345 3.698 151 H LEU 21 H LEU 21 -11.304 -1.935 2.230 152 HA LEU 21 HA LEU 21 -10.219 -4.677 1.393 153 HG LEU 21 HG LEU 21 -8.948 -2.470 3.452 154 HB2 LEU 21 2HB LEU 21 -10.879 -4.554 4.277 155 HB3 LEU 21 1HB LEU 21 -9.628 -5.358 3.426 156 HD11 LEU 21 1HD1 LEU 21 -10.580 -2.476 5.406 157 HD12 LEU 21 2HD1 LEU 21 -8.918 -1.978 5.815 158 HD13 LEU 21 3HD1 LEU 21 -9.497 -3.609 6.242 159 HD21 LEU 21 3HD2 LEU 21 -6.873 -3.119 4.307 160 HD22 LEU 21 1HD2 LEU 21 -7.340 -4.457 3.240 161 HD23 LEU 21 2HD2 LEU 21 -7.479 -4.626 5.011 162 HA PRO 22 HA PRO 22 -14.722 -5.653 1.431 163 HB2 PRO 22 2HB PRO 22 -14.636 -8.406 1.245 164 HB3 PRO 22 1HB PRO 22 -14.185 -7.309 -0.084 165 HG2 PRO 22 2HG PRO 22 -12.368 -8.985 1.660 166 HG3 PRO 22 1HG PRO 22 -12.113 -8.438 -0.007 167 HD2 PRO 22 2HD PRO 22 -11.144 -7.193 2.472 168 HD3 PRO 22 1HD PRO 22 -10.819 -6.696 0.826 169 H TRP 23 H TRP 23 -12.664 -6.724 3.917 170 HA TRP 23 HA TRP 23 -14.905 -7.367 5.854 171 HD1 TRP 23 HD1 TRP 23 -10.977 -5.986 7.418 172 HE1 TRP 23 HE1 TRP 23 -8.735 -5.805 6.062 173 HE3 TRP 23 HE3 TRP 23 -11.871 -9.851 4.326 174 HZ2 TRP 23 HZ2 TRP 23 -7.667 -7.247 3.921 175 HZ3 TRP 23 HZ3 TRP 23 -10.239 -10.358 2.512 176 HH2 TRP 23 HH2 TRP 23 -8.166 -9.012 2.302 177 HB2 TRP 23 2HB TRP 23 -13.116 -8.039 7.501 178 HB3 TRP 23 1HB TRP 23 -13.174 -9.039 6.080 179 HA PRO 24 HA PRO 24 -14.813 -3.189 7.342 180 HB2 PRO 24 2HB PRO 24 -14.856 -4.040 10.250 181 HB3 PRO 24 1HB PRO 24 -15.997 -3.047 9.338 182 HG2 PRO 24 2HG PRO 24 -16.622 -5.663 9.986 183 HG3 PRO 24 1HG PRO 24 -17.098 -4.992 8.414 184 HD2 PRO 24 2HD PRO 24 -14.680 -6.776 8.995 185 HD3 PRO 24 1HD PRO 24 -15.885 -6.876 7.686 186 H SER 25 H SER 25 -12.379 -5.004 9.122 187 HA SER 25 HA SER 25 -10.014 -3.919 9.021 188 HG SER 25 HG SER 25 -11.245 -1.572 8.261 189 HB2 SER 25 2HB SER 25 -11.323 -1.647 10.610 190 HB3 SER 25 1HB SER 25 -9.587 -1.959 10.542 191 H ILE 26 H ILE 26 -9.505 -5.769 10.115 192 HA ILE 26 HA ILE 26 -10.345 -6.289 12.908 193 HB ILE 26 HB ILE 26 -8.197 -7.837 12.979 194 HG12 ILE 26 2HG1 ILE 26 -7.334 -6.984 10.708 195 HG13 ILE 26 1HG1 ILE 26 -7.197 -8.675 11.126 196 HG21 ILE 26 1HG2 ILE 26 -10.505 -8.703 13.196 197 HG22 ILE 26 2HG2 ILE 26 -9.426 -9.771 12.276 198 HG23 ILE 26 3HG2 ILE 26 -10.628 -8.789 11.422 199 HD11 ILE 26 3HD1 ILE 26 -9.047 -9.322 9.626 200 HD12 ILE 26 1HD1 ILE 26 -7.868 -8.361 8.726 201 HD13 ILE 26 2HD1 ILE 26 -9.402 -7.625 9.239 202 HA PRO 27 HA PRO 27 -7.512 -3.584 15.235 203 HB2 PRO 27 2HB PRO 27 -7.132 -6.004 17.079 204 HB3 PRO 27 1HB PRO 27 -7.480 -4.308 17.497 205 HG2 PRO 27 2HG PRO 27 -9.533 -6.081 17.533 206 HG3 PRO 27 1HG PRO 27 -9.804 -4.533 16.675 207 HD2 PRO 27 2HD PRO 27 -8.966 -7.208 15.400 208 HD3 PRO 27 1HD PRO 27 -10.356 -6.141 14.997 209 H ALA 28 H ALA 28 -6.168 -6.701 14.306 210 HA ALA 28 HA ALA 28 -3.320 -5.724 14.459 211 HB1 ALA 28 3HB ALA 28 -2.759 -7.820 13.213 212 HB2 ALA 28 1HB ALA 28 -4.471 -8.227 13.091 213 HB3 ALA 28 2HB ALA 28 -3.646 -8.158 14.694 214 H ASP 29 H ASP 29 -5.808 -5.480 11.964 215 HA ASP 29 HA ASP 29 -3.844 -4.912 9.742 216 HB2 ASP 29 2HB ASP 29 -6.109 -5.951 9.219 217 HB3 ASP 29 1HB ASP 29 -6.922 -4.526 9.836 218 H LYS 30 H LYS 30 -6.459 -2.875 11.000 219 HA LYS 30 HA LYS 30 -5.174 -0.402 10.843 220 HB2 LYS 30 2HB LYS 30 -7.618 -1.343 12.101 221 HB3 LYS 30 1HB LYS 30 -6.823 -0.355 13.277 222 HG2 LYS 30 2HG LYS 30 -8.371 1.028 12.034 223 HG3 LYS 30 1HG LYS 30 -6.753 1.607 11.694 224 HD2 LYS 30 2HD LYS 30 -6.813 0.559 9.412 225 HD3 LYS 30 1HD LYS 30 -8.332 -0.232 9.764 226 HE2 LYS 30 2HE LYS 30 -9.511 2.037 9.905 227 HE3 LYS 30 1HE LYS 30 -7.986 2.854 9.576 228 HZ1 LYS 30 3HZ LYS 30 -9.226 0.882 7.598 229 HZ2 LYS 30 1HZ LYS 30 -7.942 1.726 7.293 230 HZ3 LYS 30 2HZ LYS 30 -9.358 2.461 7.477 231 H LYS 31 H LYS 31 -4.457 -2.542 13.692 232 HA LYS 31 HA LYS 31 -2.552 -0.515 14.823 233 HB2 LYS 31 2HB LYS 31 -3.464 -2.205 16.371 234 HB3 LYS 31 1HB LYS 31 -2.715 -3.482 15.437 235 HG2 LYS 31 2HG LYS 31 -1.436 -3.108 17.480 236 HG3 LYS 31 1HG LYS 31 -0.483 -2.893 16.024 237 HD2 LYS 31 2HD LYS 31 -0.675 -0.380 16.232 238 HD3 LYS 31 1HD LYS 31 -1.650 -0.554 17.691 239 HE2 LYS 31 2HE LYS 31 0.233 -1.653 18.908 240 HE3 LYS 31 1HE LYS 31 1.185 -1.799 17.415 241 HZ1 LYS 31 3HZ LYS 31 1.293 0.650 17.231 242 HZ2 LYS 31 1HZ LYS 31 1.880 0.234 18.704 243 HZ3 LYS 31 2HZ LYS 31 0.362 0.888 18.579 244 H GLN 32 H GLN 32 -2.033 -3.125 12.393 245 HA GLN 32 HA GLN 32 0.930 -2.751 12.391 246 HB2 GLN 32 2HB GLN 32 -0.035 -4.895 11.857 247 HB3 GLN 32 1HB GLN 32 -0.961 -4.252 10.518 248 HG2 GLN 32 2HG GLN 32 2.134 -4.066 10.513 249 HG3 GLN 32 1HG GLN 32 1.352 -5.585 10.163 250 HE21 GLN 32 1HE2 GLN 32 -0.073 -5.673 8.237 251 HE22 GLN 32 2HE2 GLN 32 0.305 -4.488 6.882 252 H TYR 33 H TYR 33 -1.645 -1.807 10.044 253 HA TYR 33 HA TYR 33 -0.306 0.338 8.702 254 HD1 TYR 33 HD1 TYR 33 -3.830 1.395 10.533 255 HD2 TYR 33 HD2 TYR 33 -3.064 1.581 6.357 256 HE1 TYR 33 HE1 TYR 33 -5.377 3.273 10.383 257 HE2 TYR 33 HE2 TYR 33 -4.609 3.505 6.164 258 HH TYR 33 HH TYR 33 -6.389 4.716 7.352 259 HB2 TYR 33 2HB TYR 33 -2.232 -0.325 7.703 260 HB3 TYR 33 1HB TYR 33 -3.117 -0.611 9.141 261 H ARG 34 H ARG 34 -1.645 0.700 12.058 262 HA ARG 34 HA ARG 34 -0.827 3.610 11.922 263 HE ARG 34 HE ARG 34 -5.227 4.845 11.941 264 HB2 ARG 34 2HB ARG 34 -1.695 2.434 14.565 265 HB3 ARG 34 1HB ARG 34 -1.656 4.108 14.046 266 HG2 ARG 34 2HG ARG 34 -3.490 2.820 12.218 267 HG3 ARG 34 1HG ARG 34 -3.708 2.032 13.753 268 HD2 ARG 34 2HD ARG 34 -5.357 3.469 13.983 269 HD3 ARG 34 1HD ARG 34 -4.127 4.394 14.802 270 HH11 ARG 34 2HH1 ARG 34 -3.147 6.093 14.409 271 HH12 ARG 34 1HH1 ARG 34 -3.002 7.693 13.531 272 HH21 ARG 34 1HH2 ARG 34 -5.014 6.601 10.971 273 HH22 ARG 34 2HH2 ARG 34 -4.044 7.951 11.668 274 H SER 35 H SER 35 0.836 0.796 13.201 275 HA SER 35 HA SER 35 3.157 2.554 14.184 276 HG SER 35 HG SER 35 3.731 1.481 16.067 277 HB2 SER 35 2HB SER 35 2.586 -0.456 14.287 278 HB3 SER 35 1HB SER 35 4.251 0.102 14.365 279 H ARG 36 H ARG 36 2.161 1.065 11.285 280 HA ARG 36 HA ARG 36 4.939 1.223 9.975 281 HE ARG 36 HE ARG 36 5.872 -3.416 8.169 282 HB2 ARG 36 2HB ARG 36 3.311 -0.873 9.907 283 HB3 ARG 36 1HB ARG 36 2.311 0.090 8.871 284 HG2 ARG 36 2HG ARG 36 3.458 -1.346 7.441 285 HG3 ARG 36 1HG ARG 36 4.148 0.224 7.178 286 HD2 ARG 36 2HD ARG 36 5.879 -1.393 7.022 287 HD3 ARG 36 1HD ARG 36 6.261 -0.513 8.457 288 HH11 ARG 36 2HH1 ARG 36 5.521 -0.947 10.521 289 HH12 ARG 36 1HH1 ARG 36 5.980 -2.121 11.844 290 HH21 ARG 36 1HH2 ARG 36 6.145 -4.744 9.635 291 HH22 ARG 36 2HH2 ARG 36 6.167 -4.208 11.362 292 H VAL 37 H VAL 37 1.541 2.357 9.125 293 HA VAL 37 HA VAL 37 2.834 4.476 7.363 294 HB VAL 37 HB VAL 37 1.167 4.449 5.929 295 HG11 VAL 37 1HG1 VAL 37 2.218 2.135 5.975 296 HG12 VAL 37 2HG1 VAL 37 0.681 2.228 5.075 297 HG13 VAL 37 3HG1 VAL 37 0.739 1.527 6.723 298 HG21 VAL 37 3HG2 VAL 37 -0.944 3.271 7.816 299 HG22 VAL 37 1HG2 VAL 37 -1.212 3.599 6.095 300 HG23 VAL 37 2HG2 VAL 37 -0.882 4.924 7.211 301 H ALA 38 H ALA 38 1.445 4.699 10.421 302 HA ALA 38 HA ALA 38 -0.114 7.217 9.757 303 HB1 ALA 38 3HB ALA 38 -1.201 5.702 11.264 304 HB2 ALA 38 1HB ALA 38 -0.840 7.232 12.101 305 HB3 ALA 38 2HB ALA 38 0.150 5.799 12.427 306 H ASP 39 H ASP 39 3.030 6.724 11.295 307 HA ASP 39 HA ASP 39 3.503 9.675 11.554 308 HB2 ASP 39 2HB ASP 39 5.093 7.137 12.081 309 HB3 ASP 39 1HB ASP 39 6.000 8.501 11.529 310 H ASP 40 H ASP 40 4.546 7.146 9.159 311 HA ASP 40 HA ASP 40 5.628 9.075 7.368 312 HB2 ASP 40 2HB ASP 40 5.093 6.069 7.233 313 HB3 ASP 40 1HB ASP 40 5.931 6.906 5.945 314 HA PRO 41 HA PRO 41 2.333 9.988 4.241 315 HB2 PRO 41 2HB PRO 41 4.664 9.789 2.232 316 HB3 PRO 41 1HB PRO 41 3.410 11.017 2.320 317 HG2 PRO 41 2HG PRO 41 5.827 11.602 3.373 318 HG3 PRO 41 1HG PRO 41 4.434 11.922 4.432 319 HD2 PRO 41 2HD PRO 41 6.227 9.416 4.494 320 HD3 PRO 41 1HD PRO 41 5.739 10.501 5.825 321 H VAL 42 H VAL 42 0.898 8.881 2.934 322 HA VAL 42 HA VAL 42 1.746 6.167 1.835 323 HB VAL 42 HB VAL 42 -1.038 7.153 2.602 324 HG11 VAL 42 1HG1 VAL 42 -0.028 4.251 2.111 325 HG12 VAL 42 2HG1 VAL 42 -1.044 5.173 0.970 326 HG13 VAL 42 3HG1 VAL 42 -1.676 4.765 2.572 327 HG21 VAL 42 3HG2 VAL 42 0.161 6.993 4.716 328 HG22 VAL 42 1HG2 VAL 42 1.159 5.642 4.162 329 HG23 VAL 42 2HG2 VAL 42 -0.543 5.367 4.562 330 H VAL 43 H VAL 43 1.798 5.708 -0.247 331 HA VAL 43 HA VAL 43 0.449 7.518 -2.294 332 HB VAL 43 HB VAL 43 1.978 6.850 -3.958 333 HG11 VAL 43 1HG1 VAL 43 4.203 7.519 -3.111 334 HG12 VAL 43 2HG1 VAL 43 3.741 7.204 -1.438 335 HG13 VAL 43 3HG1 VAL 43 2.990 8.531 -2.290 336 HG21 VAL 43 3HG2 VAL 43 3.906 5.256 -3.608 337 HG22 VAL 43 1HG2 VAL 43 2.351 4.439 -3.578 338 HG23 VAL 43 2HG2 VAL 43 3.228 4.789 -2.050 339 H LEU 44 H LEU 44 -1.514 6.973 -2.965 340 HA LEU 44 HA LEU 44 -2.241 4.035 -3.405 341 HG LEU 44 HG LEU 44 -3.981 6.997 -1.955 342 HB2 LEU 44 2HB LEU 44 -4.091 4.102 -1.901 343 HB3 LEU 44 1HB LEU 44 -2.626 4.422 -1.064 344 HD11 LEU 44 1HD1 LEU 44 -5.493 5.151 0.015 345 HD12 LEU 44 2HD1 LEU 44 -6.040 5.567 -1.610 346 HD13 LEU 44 3HD1 LEU 44 -5.924 6.841 -0.372 347 HD21 LEU 44 3HD2 LEU 44 -3.278 6.070 0.896 348 HD22 LEU 44 1HD2 LEU 44 -3.625 7.704 0.302 349 HD23 LEU 44 2HD2 LEU 44 -2.147 6.892 -0.218 350 H GLY 45 H GLY 45 -4.985 4.077 -3.736 351 HA2 GLY 45 2HA GLY 45 -4.884 4.941 -6.688 352 HA3 GLY 45 1HA GLY 45 -5.705 3.498 -6.100 353 H ARG 46 H ARG 46 -7.330 4.683 -7.549 354 HA ARG 46 HA ARG 46 -9.081 6.473 -5.797 355 HE ARG 46 HE ARG 46 -11.695 9.123 -7.004 356 HB2 ARG 46 2HB ARG 46 -9.411 5.955 -8.786 357 HB3 ARG 46 1HB ARG 46 -10.714 6.573 -7.811 358 HG2 ARG 46 2HG ARG 46 -7.950 7.931 -8.062 359 HG3 ARG 46 1HG ARG 46 -9.361 8.378 -8.994 360 HD2 ARG 46 2HD ARG 46 -9.633 8.474 -5.899 361 HD3 ARG 46 1HD ARG 46 -8.709 9.707 -6.631 362 HH11 ARG 46 2HH1 ARG 46 -9.143 10.937 -8.348 363 HH12 ARG 46 1HH1 ARG 46 -10.228 12.335 -8.792 364 HH21 ARG 46 1HH2 ARG 46 -12.822 10.583 -7.306 365 HH22 ARG 46 2HH2 ARG 46 -12.326 12.231 -8.005 366 H THR 47 H THR 47 -9.130 3.130 -7.024 367 HA THR 47 HA THR 47 -11.467 2.432 -5.508 368 HB THR 47 HB THR 47 -8.956 0.701 -5.923 369 HG1 THR 47 HG1 THR 47 -11.278 0.556 -7.477 370 HG21 THR 47 3HG2 THR 47 -10.651 -1.160 -5.993 371 HG22 THR 47 1HG2 THR 47 -11.943 -0.056 -5.452 372 HG23 THR 47 2HG2 THR 47 -10.584 -0.428 -4.385 373 H THR 48 H THR 48 -8.162 1.804 -4.019 374 HA THR 48 HA THR 48 -9.043 2.017 -1.338 375 HB THR 48 HB THR 48 -6.693 2.497 -0.660 376 HG1 THR 48 HG1 THR 48 -5.198 2.141 -2.443 377 HG21 THR 48 3HG2 THR 48 -6.768 0.197 -2.686 378 HG22 THR 48 1HG2 THR 48 -7.324 0.087 -1.033 379 HG23 THR 48 2HG2 THR 48 -5.649 0.461 -1.313 380 H PHE 49 H PHE 49 -8.323 4.954 -3.245 381 HA PHE 49 HA PHE 49 -8.408 6.703 -0.784 382 HD1 PHE 49 HD2 PHE 49 -10.105 9.497 -3.050 383 HD2 PHE 49 HD1 PHE 49 -6.169 9.023 -1.411 384 HE1 PHE 49 HE2 PHE 49 -10.198 11.797 -2.143 385 HE2 PHE 49 HE1 PHE 49 -6.215 11.354 -0.634 386 HZ PHE 49 HZ PHE 49 -8.249 12.702 -0.892 387 HB2 PHE 49 2HB PHE 49 -7.081 7.309 -2.823 388 HB3 PHE 49 1HB PHE 49 -8.561 7.564 -3.726 389 H GLU 50 H GLU 50 -10.889 5.727 -3.160 390 HA GLU 50 HA GLU 50 -12.832 7.761 -2.088 391 HB2 GLU 50 2HB GLU 50 -13.084 5.670 -4.305 392 HB3 GLU 50 1HB GLU 50 -14.442 6.595 -3.744 393 HG2 GLU 50 2HG GLU 50 -13.166 8.785 -4.204 394 HG3 GLU 50 1HG GLU 50 -11.784 7.872 -4.764 395 H SER 51 H SER 51 -12.141 4.456 -1.133 396 HA SER 51 HA SER 51 -13.754 4.667 1.376 397 HG SER 51 HG SER 51 -13.103 1.901 1.836 398 HB2 SER 51 2HB SER 51 -11.015 3.389 0.768 399 HB3 SER 51 1HB SER 51 -11.696 3.383 2.379 400 H MET 52 H MET 52 -10.218 5.269 1.504 401 HA MET 52 HA MET 52 -10.213 6.618 3.882 402 HB2 MET 52 2HB MET 52 -8.336 7.068 1.476 403 HB3 MET 52 1HB MET 52 -7.949 7.609 3.120 404 HG2 MET 52 2HG MET 52 -7.888 5.298 3.979 405 HG3 MET 52 1HG MET 52 -8.145 4.681 2.310 406 HE1 MET 52 3HE MET 52 -4.415 4.371 2.159 407 HE2 MET 52 1HE MET 52 -6.037 3.603 2.057 408 HE3 MET 52 2HE MET 52 -5.348 4.012 3.653 409 H ARG 53 H ARG 53 -11.063 8.360 1.132 410 HA ARG 53 HA ARG 53 -10.944 11.128 2.032 411 HE ARG 53 HE ARG 53 -14.777 13.553 -0.040 412 HB2 ARG 53 2HB ARG 53 -11.539 10.232 -0.228 413 HB3 ARG 53 1HB ARG 53 -12.957 9.427 0.404 414 HG2 ARG 53 2HG ARG 53 -12.603 12.494 0.501 415 HG3 ARG 53 1HG ARG 53 -13.179 11.648 -0.945 416 HD2 ARG 53 2HD ARG 53 -15.030 10.574 0.381 417 HD3 ARG 53 1HD ARG 53 -14.577 11.505 1.817 418 HH11 ARG 53 2HH1 ARG 53 -16.935 11.105 1.106 419 HH12 ARG 53 1HH1 ARG 53 -18.431 12.041 0.663 420 HH21 ARG 53 1HH2 ARG 53 -16.451 14.608 -0.574 421 HH22 ARG 53 2HH2 ARG 53 -18.147 13.975 -0.281 422 H ASP 54 H ASP 54 -12.832 8.499 3.383 423 HA ASP 54 HA ASP 54 -13.848 10.394 5.532 424 HB2 ASP 54 2HB ASP 54 -14.946 7.811 4.484 425 HB3 ASP 54 1HB ASP 54 -14.770 7.806 6.216 426 H ASP 55 H ASP 55 -12.453 7.062 6.031 427 HA ASP 55 HA ASP 55 -10.768 8.133 8.209 428 HB2 ASP 55 2HB ASP 55 -11.467 5.375 7.156 429 HB3 ASP 55 1HB ASP 55 -9.882 5.487 7.857 430 H LEU 56 H LEU 56 -8.991 9.288 7.890 431 HA LEU 56 HA LEU 56 -7.270 8.988 5.563 432 HG LEU 56 HG LEU 56 -7.073 12.646 6.902 433 HB2 LEU 56 2HB LEU 56 -6.175 10.522 7.934 434 HB3 LEU 56 1HB LEU 56 -5.976 10.769 6.231 435 HD11 LEU 56 1HD1 LEU 56 -9.469 10.921 6.002 436 HD12 LEU 56 2HD1 LEU 56 -8.343 11.770 4.923 437 HD13 LEU 56 3HD1 LEU 56 -9.405 12.685 6.008 438 HD21 LEU 56 3HD2 LEU 56 -9.065 11.088 8.645 439 HD22 LEU 56 1HD2 LEU 56 -8.966 12.848 8.438 440 HD23 LEU 56 2HD2 LEU 56 -7.625 11.985 9.213 441 HA PRO 57 HA PRO 57 -4.217 6.017 7.252 442 HB2 PRO 57 2HB PRO 57 -2.244 6.130 5.433 443 HB3 PRO 57 1HB PRO 57 -3.845 5.498 5.043 444 HG2 PRO 57 2HG PRO 57 -2.751 8.293 4.404 445 HG3 PRO 57 1HG PRO 57 -3.644 7.189 3.326 446 HD2 PRO 57 2HD PRO 57 -4.884 9.244 4.727 447 HD3 PRO 57 1HD PRO 57 -5.741 7.723 4.323 448 H GLY 58 H GLY 58 -1.979 8.646 6.239 449 HA2 GLY 58 2HA GLY 58 -1.128 9.125 9.169 450 HA3 GLY 58 1HA GLY 58 0.097 8.673 7.983 451 H SER 59 H SER 59 1.133 10.659 8.580 452 HA SER 59 HA SER 59 0.178 13.283 8.236 453 HG SER 59 HG SER 59 3.169 14.442 7.410 454 HB2 SER 59 2HB SER 59 2.389 12.524 9.233 455 HB3 SER 59 1HB SER 59 3.042 12.322 7.614 456 H ALA 60 H ALA 60 0.467 11.296 5.496 457 HA ALA 60 HA ALA 60 -0.703 13.454 3.919 458 HB1 ALA 60 3HB ALA 60 1.536 14.214 3.469 459 HB2 ALA 60 1HB ALA 60 1.011 13.424 1.961 460 HB3 ALA 60 2HB ALA 60 2.134 12.596 3.070 461 H GLN 61 H GLN 61 -1.573 12.923 1.920 462 HA GLN 61 HA GLN 61 -2.053 9.921 1.430 463 HB2 GLN 61 2HB GLN 61 -3.723 11.201 3.001 464 HB3 GLN 61 1HB GLN 61 -4.257 12.072 1.574 465 HG2 GLN 61 2HG GLN 61 -4.758 9.804 0.465 466 HG3 GLN 61 1HG GLN 61 -4.326 9.015 1.960 467 HE21 GLN 61 1HE2 GLN 61 -5.972 11.270 3.512 468 HE22 GLN 61 2HE2 GLN 61 -7.632 10.480 3.258 469 H ILE 62 H ILE 62 -0.827 9.885 -0.337 470 HA ILE 62 HA ILE 62 -1.066 11.831 -2.621 471 HB ILE 62 HB ILE 62 0.772 9.488 -1.869 472 HG12 ILE 62 2HG1 ILE 62 1.709 12.293 -2.426 473 HG13 ILE 62 1HG1 ILE 62 0.927 12.008 -0.878 474 HG21 ILE 62 1HG2 ILE 62 0.869 11.072 -4.478 475 HG22 ILE 62 2HG2 ILE 62 0.716 9.301 -4.311 476 HG23 ILE 62 3HG2 ILE 62 2.240 10.074 -3.850 477 HD11 ILE 62 3HD1 ILE 62 3.325 11.852 -0.560 478 HD12 ILE 62 1HD1 ILE 62 3.535 10.750 -1.926 479 HD13 ILE 62 2HD1 ILE 62 2.730 10.194 -0.412 480 H VAL 63 H VAL 63 -2.648 11.392 -4.261 481 HA VAL 63 HA VAL 63 -3.116 8.500 -5.017 482 HB VAL 63 HB VAL 63 -4.613 10.845 -6.184 483 HG11 VAL 63 1HG1 VAL 63 -6.246 9.048 -6.925 484 HG12 VAL 63 2HG1 VAL 63 -5.223 7.799 -6.182 485 HG13 VAL 63 3HG1 VAL 63 -4.657 8.653 -7.613 486 HG21 VAL 63 3HG2 VAL 63 -5.468 8.839 -3.982 487 HG22 VAL 63 1HG2 VAL 63 -6.468 10.169 -4.626 488 HG23 VAL 63 2HG2 VAL 63 -5.035 10.527 -3.674 489 H MET 64 H MET 64 -1.939 7.474 -6.392 490 HA MET 64 HA MET 64 -0.460 8.751 -8.698 491 HB2 MET 64 2HB MET 64 -0.590 5.983 -7.371 492 HB3 MET 64 1HB MET 64 -0.079 6.070 -9.013 493 HG2 MET 64 2HG MET 64 1.464 8.181 -7.787 494 HG3 MET 64 1HG MET 64 1.454 6.861 -6.630 495 HE1 MET 64 3HE MET 64 2.139 8.091 -10.285 496 HE2 MET 64 1HE MET 64 1.194 6.647 -10.764 497 HE3 MET 64 2HE MET 64 2.953 6.689 -11.058 498 H SER 65 H SER 65 -2.107 9.595 -9.829 499 HA SER 65 HA SER 65 -3.147 7.814 -12.016 500 HG SER 65 HG SER 65 -4.649 9.757 -9.504 501 HB2 SER 65 2HB SER 65 -5.567 8.425 -11.838 502 HB3 SER 65 1HB SER 65 -5.056 7.598 -10.379 503 H ARG 66 H ARG 66 -4.885 9.711 -13.278 504 HA ARG 66 HA ARG 66 -3.501 12.347 -13.175 505 HE ARG 66 HE ARG 66 -0.804 11.422 -17.370 506 HB2 ARG 66 2HB ARG 66 -2.715 10.505 -15.306 507 HB3 ARG 66 1HB ARG 66 -3.621 11.747 -16.084 508 HG2 ARG 66 2HG ARG 66 -1.917 13.322 -15.835 509 HG3 ARG 66 1HG ARG 66 -1.767 13.017 -14.130 510 HD2 ARG 66 2HD ARG 66 0.317 12.568 -15.076 511 HD3 ARG 66 1HD ARG 66 -0.354 11.060 -14.416 512 HH11 ARG 66 2HH1 ARG 66 1.571 10.271 -15.009 513 HH12 ARG 66 1HH1 ARG 66 2.359 9.234 -16.243 514 HH21 ARG 66 1HH2 ARG 66 0.128 10.132 -18.704 515 HH22 ARG 66 2HH2 ARG 66 1.576 9.144 -18.198 516 H SER 67 H SER 67 -5.779 12.039 -12.213 517 HA SER 67 HA SER 67 -7.386 14.033 -13.925 518 HG SER 67 HG SER 67 -7.983 12.931 -10.836 519 HB2 SER 67 2HB SER 67 -9.357 13.206 -12.950 520 HB3 SER 67 1HB SER 67 -8.437 11.752 -13.340 521 H GLU 68 H GLU 68 -6.865 15.973 -13.326 522 HA GLU 68 HA GLU 68 -6.238 17.920 -12.086 523 HB2 GLU 68 2HB GLU 68 -8.794 16.744 -10.887 524 HB3 GLU 68 1HB GLU 68 -8.276 18.360 -10.510 525 HG2 GLU 68 2HG GLU 68 -8.456 19.176 -12.774 526 HG3 GLU 68 1HG GLU 68 -8.636 17.551 -13.450 527 H ARG 69 H ARG 69 -6.863 18.621 -9.427 528 HA ARG 69 HA ARG 69 -5.082 17.107 -7.638 529 HE ARG 69 HE ARG 69 -5.770 22.379 -9.016 530 HB2 ARG 69 2HB ARG 69 -3.504 18.783 -7.005 531 HB3 ARG 69 1HB ARG 69 -3.342 18.588 -8.717 532 HG2 ARG 69 2HG ARG 69 -5.107 20.856 -7.551 533 HG3 ARG 69 1HG ARG 69 -3.375 21.024 -7.457 534 HD2 ARG 69 2HD ARG 69 -3.016 21.298 -9.730 535 HD3 ARG 69 1HD ARG 69 -4.410 20.311 -10.223 536 HH11 ARG 69 2HH1 ARG 69 -3.182 22.596 -11.317 537 HH12 ARG 69 1HH1 ARG 69 -3.987 23.981 -12.181 538 HH21 ARG 69 1HH2 ARG 69 -6.667 23.894 -10.045 539 HH22 ARG 69 2HH2 ARG 69 -5.885 24.670 -11.495 540 H SER 70 H SER 70 -5.245 17.815 -5.389 541 HA SER 70 HA SER 70 -6.349 18.569 -3.491 542 HG SER 70 HG SER 70 -5.669 20.813 -3.459 543 HB2 SER 70 2HB SER 70 -7.975 20.546 -5.149 544 HB3 SER 70 1HB SER 70 -7.982 20.439 -3.408 545 H PHE 71 H PHE 71 -7.745 17.529 -2.281 546 HA PHE 71 HA PHE 71 -10.091 16.079 -3.648 547 HD1 PHE 71 HD2 PHE 71 -9.604 14.529 -5.233 548 HD2 PHE 71 HD1 PHE 71 -6.163 13.771 -2.769 549 HE1 PHE 71 HE2 PHE 71 -8.447 13.464 -7.142 550 HE2 PHE 71 HE1 PHE 71 -5.057 12.682 -4.675 551 HZ PHE 71 HZ PHE 71 -6.226 12.459 -6.824 552 HB2 PHE 71 2HB PHE 71 -8.006 14.859 -1.760 553 HB3 PHE 71 1HB PHE 71 -9.438 14.055 -2.350 554 H SER 72 H SER 72 -9.094 16.337 -0.152 555 HA SER 72 HA SER 72 -11.763 17.358 0.579 556 HG SER 72 HG SER 72 -12.406 15.438 -0.834 557 HB2 SER 72 2HB SER 72 -11.323 14.405 1.279 558 HB3 SER 72 1HB SER 72 -12.575 15.434 1.958 559 H VAL 73 H VAL 73 -9.087 15.499 2.196 560 HA VAL 73 HA VAL 73 -9.110 17.519 4.477 561 HB VAL 73 HB VAL 73 -9.028 15.182 5.148 562 HG11 VAL 73 1HG1 VAL 73 -7.733 14.066 3.330 563 HG12 VAL 73 2HG1 VAL 73 -7.048 13.729 4.912 564 HG13 VAL 73 3HG1 VAL 73 -6.246 14.913 3.854 565 HG21 VAL 73 3HG2 VAL 73 -7.954 16.839 6.685 566 HG22 VAL 73 1HG2 VAL 73 -6.379 16.578 5.925 567 HG23 VAL 73 2HG2 VAL 73 -7.151 15.256 6.794 568 H ASP 74 H ASP 74 -7.094 18.519 5.170 569 HA ASP 74 HA ASP 74 -5.539 19.869 3.081 570 HB2 ASP 74 2HB ASP 74 -4.259 20.812 5.033 571 HB3 ASP 74 1HB ASP 74 -5.962 21.175 4.926 572 H THR 75 H THR 75 -4.405 17.396 5.507 573 HA THR 75 HA THR 75 -2.025 16.672 3.908 574 HB THR 75 HB THR 75 -1.880 14.627 5.278 575 HG1 THR 75 HG1 THR 75 -3.888 13.998 5.565 576 HG21 THR 75 3HG2 THR 75 -2.596 16.894 7.212 577 HG22 THR 75 1HG2 THR 75 -1.017 16.728 6.385 578 HG23 THR 75 2HG2 THR 75 -1.592 15.458 7.491 579 H ALA 76 H ALA 76 -3.789 16.771 1.890 580 HA ALA 76 HA ALA 76 -3.652 13.983 0.778 581 HB1 ALA 76 3HB ALA 76 -5.845 13.861 1.843 582 HB2 ALA 76 1HB ALA 76 -6.090 13.869 0.088 583 HB3 ALA 76 2HB ALA 76 -6.406 15.348 1.046 584 H HIS 77 H HIS 77 -3.314 13.900 -1.268 585 HA HIS 77 HA HIS 77 -3.106 16.415 -2.998 586 HD1 HIS 77 HD1 HIS 77 -0.465 15.645 0.736 587 HD2 HIS 77 HD2 HIS 77 -1.495 18.781 -1.983 588 HE1 HIS 77 HE1 HIS 77 -0.320 17.928 1.915 589 HB2 HIS 77 2HB HIS 77 -0.746 14.884 -1.716 590 HB3 HIS 77 1HB HIS 77 -0.565 16.160 -2.923 591 H ARG 78 H ARG 78 -1.636 15.733 -5.042 592 HA ARG 78 HA ARG 78 -2.466 12.939 -5.959 593 HE ARG 78 HE ARG 78 -4.138 14.478 -10.706 594 HB2 ARG 78 2HB ARG 78 -4.242 14.716 -6.593 595 HB3 ARG 78 1HB ARG 78 -3.123 15.333 -7.776 596 HG2 ARG 78 2HG ARG 78 -4.088 12.391 -7.620 597 HG3 ARG 78 1HG ARG 78 -5.000 13.611 -8.480 598 HD2 ARG 78 2HD ARG 78 -2.180 12.604 -9.207 599 HD3 ARG 78 1HD ARG 78 -3.678 12.069 -9.943 600 HH11 ARG 78 2HH1 ARG 78 -0.858 13.782 -9.844 601 HH12 ARG 78 1HH1 ARG 78 -0.187 15.106 -10.860 602 HH21 ARG 78 1HH2 ARG 78 -3.428 15.942 -11.804 603 HH22 ARG 78 2HH2 ARG 78 -1.615 16.272 -11.989 604 H ALA 79 H ALA 79 -0.647 11.981 -6.490 605 HA ALA 79 HA ALA 79 1.630 13.347 -7.933 606 HB1 ALA 79 3HB ALA 79 1.086 10.430 -6.999 607 HB2 ALA 79 1HB ALA 79 2.090 11.674 -6.176 608 HB3 ALA 79 2HB ALA 79 2.606 10.973 -7.725 609 H ALA 80 H ALA 80 2.245 13.031 -10.052 610 HA ALA 80 HA ALA 80 0.408 11.448 -11.960 611 HB1 ALA 80 3HB ALA 80 1.842 12.835 -13.704 612 HB2 ALA 80 1HB ALA 80 2.411 13.725 -12.345 613 HB3 ALA 80 2HB ALA 80 0.679 13.723 -12.674 614 H SER 81 H SER 81 3.609 11.037 -10.674 615 HA SER 81 HA SER 81 3.918 8.502 -12.294 616 HG SER 81 HG SER 81 6.927 9.149 -13.842 617 HB2 SER 81 2HB SER 81 5.130 10.770 -13.351 618 HB3 SER 81 1HB SER 81 6.354 10.392 -12.151 619 H VAL 82 H VAL 82 6.428 7.683 -11.366 620 HA VAL 82 HA VAL 82 6.031 7.373 -8.363 621 HB VAL 82 HB VAL 82 8.172 6.091 -10.142 622 HG11 VAL 82 1HG1 VAL 82 7.906 6.137 -7.083 623 HG12 VAL 82 2HG1 VAL 82 9.354 6.335 -8.071 624 HG13 VAL 82 3HG1 VAL 82 8.625 4.743 -7.913 625 HG21 VAL 82 3HG2 VAL 82 6.190 4.839 -10.520 626 HG22 VAL 82 1HG2 VAL 82 5.572 5.044 -8.861 627 HG23 VAL 82 2HG2 VAL 82 6.898 3.937 -9.170 628 H GLU 83 H GLU 83 8.946 8.537 -10.234 629 HA GLU 83 HA GLU 83 10.016 10.273 -8.436 630 HB2 GLU 83 2HB GLU 83 9.538 11.193 -11.308 631 HB3 GLU 83 1HB GLU 83 10.841 11.628 -10.237 632 HG2 GLU 83 2HG GLU 83 10.776 8.642 -10.829 633 HG3 GLU 83 1HG GLU 83 10.950 9.642 -12.248 634 H GLU 84 H GLU 84 6.847 11.163 -9.934 635 HA GLU 84 HA GLU 84 6.746 13.817 -8.499 636 HB2 GLU 84 2HB GLU 84 4.432 12.212 -9.682 637 HB3 GLU 84 1HB GLU 84 4.352 13.873 -9.149 638 HG2 GLU 84 2HG GLU 84 6.350 13.740 -11.336 639 HG3 GLU 84 1HG GLU 84 4.954 12.828 -11.802 640 H ALA 85 H ALA 85 5.983 10.595 -7.652 641 HA ALA 85 HA ALA 85 4.294 11.297 -5.237 642 HB1 ALA 85 3HB ALA 85 5.322 8.525 -6.131 643 HB2 ALA 85 1HB ALA 85 3.729 9.175 -6.597 644 HB3 ALA 85 2HB ALA 85 4.116 8.854 -4.887 645 H VAL 86 H VAL 86 7.655 10.322 -5.997 646 HA VAL 86 HA VAL 86 8.427 10.263 -3.073 647 HB VAL 86 HB VAL 86 9.924 9.705 -5.663 648 HG11 VAL 86 1HG1 VAL 86 12.048 9.355 -4.407 649 HG12 VAL 86 2HG1 VAL 86 11.329 10.087 -2.943 650 HG13 VAL 86 3HG1 VAL 86 11.579 11.060 -4.415 651 HG21 VAL 86 3HG2 VAL 86 10.399 7.508 -4.526 652 HG22 VAL 86 1HG2 VAL 86 8.653 7.810 -4.469 653 HG23 VAL 86 2HG2 VAL 86 9.651 8.085 -3.028 654 H ASP 87 H ASP 87 9.104 12.617 -5.805 655 HA ASP 87 HA ASP 87 10.142 14.649 -4.101 656 HB2 ASP 87 2HB ASP 87 8.902 14.625 -6.869 657 HB3 ASP 87 1HB ASP 87 8.778 16.149 -6.057 658 H ILE 88 H ILE 88 6.592 14.051 -4.585 659 HA ILE 88 HA ILE 88 6.059 16.400 -2.812 660 HB ILE 88 HB ILE 88 3.939 16.383 -2.726 661 HG12 ILE 88 2HG1 ILE 88 3.190 13.848 -4.248 662 HG13 ILE 88 1HG1 ILE 88 3.609 13.695 -2.579 663 HG21 ILE 88 1HG2 ILE 88 4.857 17.080 -5.008 664 HG22 ILE 88 2HG2 ILE 88 3.115 16.702 -4.999 665 HG23 ILE 88 3HG2 ILE 88 4.292 15.536 -5.654 666 HD11 ILE 88 3HD1 ILE 88 1.852 15.943 -2.429 667 HD12 ILE 88 1HD1 ILE 88 1.472 14.297 -2.024 668 HD13 ILE 88 2HD1 ILE 88 1.124 14.887 -3.665 669 H ALA 89 H ALA 89 6.393 12.984 -2.097 670 HA ALA 89 HA ALA 89 5.525 13.226 0.761 671 HB1 ALA 89 3HB ALA 89 6.828 11.066 1.014 672 HB2 ALA 89 1HB ALA 89 7.321 11.179 -0.689 673 HB3 ALA 89 2HB ALA 89 5.604 10.989 -0.259 674 H ALA 90 H ALA 90 8.820 13.299 -0.726 675 HA ALA 90 HA ALA 90 10.140 14.231 1.760 676 HB1 ALA 90 3HB ALA 90 10.950 14.263 -1.229 677 HB2 ALA 90 1HB ALA 90 11.347 13.025 -0.011 678 HB3 ALA 90 2HB ALA 90 12.064 14.648 0.097 679 H SER 91 H SER 91 8.343 16.071 -0.553 680 HA SER 91 HA SER 91 9.485 18.766 0.236 681 HG SER 91 HG SER 91 8.816 17.454 -2.453 682 HB2 SER 91 2HB SER 91 6.925 18.056 -1.331 683 HB3 SER 91 1HB SER 91 7.576 19.680 -1.147 684 H LEU 92 H LEU 92 7.127 16.715 1.721 685 HA LEU 92 HA LEU 92 5.722 19.078 3.015 686 HG LEU 92 HG LEU 92 5.195 15.710 1.686 687 HB2 LEU 92 2HB LEU 92 3.994 17.442 3.910 688 HB3 LEU 92 1HB LEU 92 3.985 18.047 2.288 689 HD11 LEU 92 1HD1 LEU 92 5.441 14.846 3.975 690 HD12 LEU 92 2HD1 LEU 92 4.323 13.848 3.049 691 HD13 LEU 92 3HD1 LEU 92 3.685 14.981 4.269 692 HD21 LEU 92 3HD2 LEU 92 2.998 16.477 0.753 693 HD22 LEU 92 1HD2 LEU 92 2.167 15.983 2.243 694 HD23 LEU 92 2HD2 LEU 92 2.931 14.768 1.186 695 H ASP 93 H ASP 93 6.991 15.996 4.315 696 HA ASP 93 HA ASP 93 9.206 17.067 5.538 697 HB2 ASP 93 2HB ASP 93 6.946 17.544 7.524 698 HB3 ASP 93 1HB ASP 93 8.392 16.837 8.182 699 H ALA 94 H ALA 94 9.921 14.967 4.801 700 HA ALA 94 HA ALA 94 9.475 12.655 6.620 701 HB1 ALA 94 3HB ALA 94 8.099 12.579 3.846 702 HB2 ALA 94 1HB ALA 94 7.277 12.642 5.424 703 HB3 ALA 94 2HB ALA 94 8.204 11.205 4.974 704 H GLU 95 H GLU 95 10.529 10.715 6.126 705 HA GLU 95 HA GLU 95 12.790 10.925 4.082 706 HB2 GLU 95 2HB GLU 95 13.369 9.033 6.294 707 HB3 GLU 95 1HB GLU 95 14.405 10.060 5.328 708 HG2 GLU 95 2HG GLU 95 13.692 12.067 6.819 709 HG3 GLU 95 1HG GLU 95 12.807 10.918 7.819 710 H THR 96 H THR 96 11.356 8.062 5.787 711 HA THR 96 HA THR 96 10.976 6.540 3.218 712 HB THR 96 HB THR 96 9.625 4.858 4.633 713 HG1 THR 96 HG1 THR 96 9.339 6.316 6.622 714 HG21 THR 96 3HG2 THR 96 12.460 5.318 5.556 715 HG22 THR 96 1HG2 THR 96 11.982 4.394 4.079 716 HG23 THR 96 2HG2 THR 96 11.516 3.831 5.720 717 H ALA 97 H ALA 97 8.941 5.657 2.531 718 HA ALA 97 HA ALA 97 6.433 6.837 3.649 719 HB1 ALA 97 3HB ALA 97 6.875 8.511 1.953 720 HB2 ALA 97 1HB ALA 97 5.575 7.514 1.257 721 HB3 ALA 97 2HB ALA 97 7.254 7.313 0.691 722 H TYR 98 H TYR 98 4.447 5.835 2.563 723 HA TYR 98 HA TYR 98 4.896 2.844 2.044 724 HD1 TYR 98 HD1 TYR 98 4.759 0.673 4.218 725 HD2 TYR 98 HD2 TYR 98 5.021 4.710 5.587 726 HE1 TYR 98 HE1 TYR 98 6.682 0.069 5.640 727 HE2 TYR 98 HE2 TYR 98 6.875 4.083 7.094 728 HH TYR 98 HH TYR 98 8.498 2.502 7.349 729 HB2 TYR 98 2HB TYR 98 3.059 3.986 4.251 730 HB3 TYR 98 1HB TYR 98 2.983 2.332 3.685 731 H VAL 99 H VAL 99 2.760 1.742 1.543 732 HA VAL 99 HA VAL 99 0.886 3.434 -0.171 733 HB VAL 99 HB VAL 99 1.795 3.060 -2.079 734 HG11 VAL 99 1HG1 VAL 99 3.987 1.159 -1.241 735 HG12 VAL 99 2HG1 VAL 99 4.033 2.893 -1.153 736 HG13 VAL 99 3HG1 VAL 99 3.864 2.110 -2.714 737 HG21 VAL 99 3HG2 VAL 99 1.850 0.971 -3.422 738 HG22 VAL 99 1HG2 VAL 99 0.292 1.306 -2.624 739 HG23 VAL 99 2HG2 VAL 99 1.382 0.086 -1.958 740 H ILE 100 H ILE 100 -1.111 2.838 0.844 741 HA ILE 100 HA ILE 100 -1.766 0.061 1.209 742 HB ILE 100 HB ILE 100 -3.938 2.126 0.715 743 HG12 ILE 100 2HG1 ILE 100 -2.804 3.051 2.558 744 HG13 ILE 100 1HG1 ILE 100 -4.069 2.127 3.299 745 HG21 ILE 100 1HG2 ILE 100 -4.697 -0.369 0.680 746 HG22 ILE 100 2HG2 ILE 100 -5.469 0.667 1.887 747 HG23 ILE 100 3HG2 ILE 100 -4.178 -0.441 2.382 748 HD11 ILE 100 3HD1 ILE 100 -2.499 0.431 4.081 749 HD12 ILE 100 1HD1 ILE 100 -1.804 2.048 4.458 750 HD13 ILE 100 2HD1 ILE 100 -1.167 1.117 3.095 751 H GLY 101 H GLY 101 -2.339 1.750 -1.642 752 HA2 GLY 101 2HA GLY 101 -2.608 0.945 -3.927 753 HA3 GLY 101 1HA GLY 101 -1.560 -0.274 -3.361 754 H GLY 102 H GLY 102 -2.879 -2.440 -4.697 755 HA2 GLY 102 2HA GLY 102 -4.767 -0.203 -5.707 756 HA3 GLY 102 1HA GLY 102 -3.140 -0.182 -6.256 757 H ALA 103 H ALA 103 -6.202 -1.585 -6.939 758 HA ALA 103 HA ALA 103 -5.930 -2.886 -9.318 759 HB1 ALA 103 3HB ALA 103 -7.240 -0.017 -9.170 760 HB2 ALA 103 1HB ALA 103 -7.946 -1.429 -8.447 761 HB3 ALA 103 2HB ALA 103 -7.766 -1.328 -10.178 762 H ALA 104 H ALA 104 -4.731 0.484 -9.319 763 HA ALA 104 HA ALA 104 -2.894 -0.266 -11.678 764 HB1 ALA 104 3HB ALA 104 -4.291 1.708 -12.199 765 HB2 ALA 104 1HB ALA 104 -2.566 2.146 -12.073 766 HB3 ALA 104 2HB ALA 104 -3.674 2.544 -10.744 767 H ILE 105 H ILE 105 -2.835 0.539 -8.247 768 HA ILE 105 HA ILE 105 -0.266 1.992 -8.366 769 HB ILE 105 HB ILE 105 -1.412 1.075 -5.754 770 HG12 ILE 105 2HG1 ILE 105 -3.395 2.080 -6.642 771 HG13 ILE 105 1HG1 ILE 105 -2.661 3.173 -5.555 772 HG21 ILE 105 1HG2 ILE 105 0.818 2.172 -5.594 773 HG22 ILE 105 2HG2 ILE 105 -0.472 3.053 -4.773 774 HG23 ILE 105 3HG2 ILE 105 0.135 3.644 -6.328 775 HD11 ILE 105 3HD1 ILE 105 -1.680 3.749 -8.345 776 HD12 ILE 105 1HD1 ILE 105 -2.676 4.785 -7.290 777 HD13 ILE 105 2HD1 ILE 105 -3.456 3.542 -8.315 778 H TYR 106 H TYR 106 -0.807 -0.947 -6.438 779 HA TYR 106 HA TYR 106 1.956 -1.817 -6.159 780 HD1 TYR 106 HD1 TYR 106 2.351 -4.746 -5.163 781 HD2 TYR 106 HD2 TYR 106 -0.751 -2.319 -3.427 782 HE1 TYR 106 HE1 TYR 106 2.948 -5.548 -2.970 783 HE2 TYR 106 HE2 TYR 106 -0.138 -3.149 -1.192 784 HH TYR 106 HH TYR 106 2.079 -4.340 -0.120 785 HB2 TYR 106 2HB TYR 106 -0.836 -2.985 -5.818 786 HB3 TYR 106 1HB TYR 106 0.294 -4.139 -6.400 787 H ALA 107 H ALA 107 -0.254 -2.431 -8.904 788 HA ALA 107 HA ALA 107 1.632 -4.081 -10.482 789 HB1 ALA 107 3HB ALA 107 -0.109 -3.603 -12.304 790 HB2 ALA 107 1HB ALA 107 -0.864 -2.423 -11.215 791 HB3 ALA 107 2HB ALA 107 -0.836 -4.142 -10.776 792 H LEU 108 H LEU 108 1.219 -0.556 -10.353 793 HA LEU 108 HA LEU 108 3.414 -0.219 -12.417 794 HG LEU 108 HG LEU 108 2.237 2.190 -9.811 795 HB2 LEU 108 2HB LEU 108 2.888 1.902 -12.757 796 HB3 LEU 108 1HB LEU 108 1.323 1.323 -12.289 797 HD11 LEU 108 1HD1 LEU 108 4.426 3.042 -10.997 798 HD12 LEU 108 2HD1 LEU 108 3.569 4.207 -9.983 799 HD13 LEU 108 3HD1 LEU 108 3.416 4.294 -11.745 800 HD21 LEU 108 3HD2 LEU 108 0.064 2.911 -10.686 801 HD22 LEU 108 1HD2 LEU 108 0.856 3.881 -11.968 802 HD23 LEU 108 2HD2 LEU 108 0.998 4.356 -10.265 803 H PHE 109 H PHE 109 3.079 0.241 -8.886 804 HA PHE 109 HA PHE 109 5.895 1.061 -8.503 805 HD1 PHE 109 HD2 PHE 109 6.811 2.187 -6.133 806 HD2 PHE 109 HD1 PHE 109 2.612 2.649 -6.923 807 HE1 PHE 109 HE2 PHE 109 7.021 4.576 -5.774 808 HE2 PHE 109 HE1 PHE 109 2.825 5.065 -6.490 809 HZ PHE 109 HZ PHE 109 5.058 6.051 -5.992 810 HB2 PHE 109 2HB PHE 109 3.520 0.381 -6.663 811 HB3 PHE 109 1HB PHE 109 5.084 0.230 -5.972 812 H GLN 110 H GLN 110 4.707 -2.209 -8.732 813 HA GLN 110 HA GLN 110 6.390 -3.683 -7.077 814 HB2 GLN 110 2HB GLN 110 6.467 -5.493 -8.852 815 HB3 GLN 110 1HB GLN 110 4.955 -5.027 -8.152 816 HG2 GLN 110 2HG GLN 110 4.080 -4.033 -10.090 817 HG3 GLN 110 1HG GLN 110 5.591 -3.767 -10.859 818 HE21 GLN 110 1HE2 GLN 110 6.767 -5.935 -11.285 819 HE22 GLN 110 2HE2 GLN 110 5.686 -7.278 -11.925 820 HA PRO 111 HA PRO 111 10.707 -3.443 -9.190 821 HB2 PRO 111 2HB PRO 111 11.192 -1.752 -11.297 822 HB3 PRO 111 1HB PRO 111 10.540 -3.388 -11.504 823 HG2 PRO 111 2HG PRO 111 8.957 -0.756 -11.413 824 HG3 PRO 111 1HG PRO 111 8.868 -2.048 -12.655 825 HD2 PRO 111 2HD PRO 111 7.074 -1.920 -10.580 826 HD3 PRO 111 1HD PRO 111 7.634 -3.485 -11.257 827 H HIS 112 H HIS 112 8.840 -0.790 -8.167 828 HA HIS 112 HA HIS 112 11.291 1.027 -7.727 829 HD1 HIS 112 HD1 HIS 112 11.611 2.572 -10.094 830 HD2 HIS 112 HD2 HIS 112 7.426 1.807 -10.422 831 HE1 HIS 112 HE1 HIS 112 10.848 2.792 -12.570 832 HB2 HIS 112 2HB HIS 112 8.390 1.998 -7.938 833 HB3 HIS 112 1HB HIS 112 9.858 2.953 -7.845 834 H LEU 113 H LEU 113 9.192 -0.881 -5.823 835 HA LEU 113 HA LEU 113 9.197 0.837 -3.383 836 HG LEU 113 HG LEU 113 6.695 -1.454 -2.281 837 HB2 LEU 113 2HB LEU 113 8.907 -2.228 -3.779 838 HB3 LEU 113 1HB LEU 113 8.807 -1.465 -2.217 839 HD11 LEU 113 1HD1 LEU 113 6.848 0.941 -2.805 840 HD12 LEU 113 2HD1 LEU 113 5.377 0.276 -3.543 841 HD13 LEU 113 3HD1 LEU 113 6.812 0.592 -4.547 842 HD21 LEU 113 3HD2 LEU 113 6.701 -2.100 -5.295 843 HD22 LEU 113 1HD2 LEU 113 5.296 -2.199 -4.185 844 HD23 LEU 113 2HD2 LEU 113 6.701 -3.252 -3.928 845 H ASP 114 H ASP 114 10.638 0.814 -1.523 846 HA ASP 114 HA ASP 114 13.102 -0.900 -1.419 847 HB2 ASP 114 2HB ASP 114 13.098 1.091 -0.043 848 HB3 ASP 114 1HB ASP 114 11.538 0.767 0.629 849 H ARG 115 H ARG 115 9.804 -1.273 0.039 850 HA ARG 115 HA ARG 115 10.214 -4.283 -0.031 851 HE ARG 115 HE ARG 115 12.114 -2.190 3.419 852 HB2 ARG 115 2HB ARG 115 10.017 -2.476 2.399 853 HB3 ARG 115 1HB ARG 115 8.996 -3.889 2.522 854 HG2 ARG 115 2HG ARG 115 10.846 -5.423 2.293 855 HG3 ARG 115 1HG ARG 115 11.966 -4.161 1.839 856 HD2 ARG 115 2HD ARG 115 10.523 -4.140 4.604 857 HD3 ARG 115 1HD ARG 115 11.947 -5.118 4.294 858 HH11 ARG 115 2HH1 ARG 115 13.511 -4.721 5.448 859 HH12 ARG 115 1HH1 ARG 115 14.967 -3.663 5.687 860 HH21 ARG 115 1HH2 ARG 115 13.627 -1.184 3.702 861 HH22 ARG 115 2HH2 ARG 115 15.005 -1.613 4.810 862 H MET 116 H MET 116 8.464 -5.640 0.366 863 HA MET 116 HA MET 116 5.701 -4.565 -0.454 864 HB2 MET 116 2HB MET 116 7.463 -6.277 -1.803 865 HB3 MET 116 1HB MET 116 6.410 -7.435 -0.993 866 HG2 MET 116 2HG MET 116 4.525 -6.822 -2.224 867 HG3 MET 116 1HG MET 116 5.171 -5.215 -2.682 868 HE1 MET 116 3HE MET 116 5.107 -7.550 -6.011 869 HE2 MET 116 1HE MET 116 4.671 -5.899 -5.467 870 HE3 MET 116 2HE MET 116 3.933 -7.336 -4.672 871 H VAL 117 H VAL 117 5.256 -4.239 1.804 872 HA VAL 117 HA VAL 117 4.801 -6.423 3.722 873 HB VAL 117 HB VAL 117 4.153 -3.441 3.632 874 HG11 VAL 117 1HG1 VAL 117 3.930 -3.482 6.143 875 HG12 VAL 117 2HG1 VAL 117 4.062 -5.259 6.123 876 HG13 VAL 117 3HG1 VAL 117 2.666 -4.442 5.412 877 HG21 VAL 117 3HG2 VAL 117 6.378 -4.956 5.156 878 HG22 VAL 117 1HG2 VAL 117 6.168 -3.211 5.142 879 HG23 VAL 117 2HG2 VAL 117 6.640 -4.072 3.658 880 H LEU 118 H LEU 118 3.558 -7.573 1.931 881 HA LEU 118 HA LEU 118 0.620 -7.196 1.688 882 HG LEU 118 HG LEU 118 -0.381 -9.537 0.627 883 HB2 LEU 118 2HB LEU 118 1.839 -8.258 -0.045 884 HB3 LEU 118 1HB LEU 118 2.657 -9.393 0.995 885 HD11 LEU 118 1HD1 LEU 118 1.790 -10.462 -1.367 886 HD12 LEU 118 2HD1 LEU 118 0.162 -9.794 -1.654 887 HD13 LEU 118 3HD1 LEU 118 0.321 -11.461 -1.168 888 HD21 LEU 118 3HD2 LEU 118 0.849 -10.999 2.393 889 HD22 LEU 118 1HD2 LEU 118 1.649 -11.816 1.045 890 HD23 LEU 118 2HD2 LEU 118 -0.133 -11.856 1.198 891 H SER 119 H SER 119 -1.061 -8.056 2.863 892 HA SER 119 HA SER 119 -0.460 -9.769 5.363 893 HG SER 119 HG SER 119 -2.131 -6.542 5.501 894 HB2 SER 119 2HB SER 119 -3.129 -8.350 4.972 895 HB3 SER 119 1HB SER 119 -2.433 -8.994 6.370 896 H ARG 120 H ARG 120 -1.053 -11.874 5.272 897 HA ARG 120 HA ARG 120 -2.602 -12.929 2.917 898 HE ARG 120 HE ARG 120 0.351 -16.540 3.149 899 HB2 ARG 120 2HB ARG 120 -1.031 -14.275 5.188 900 HB3 ARG 120 1HB ARG 120 -1.729 -15.196 3.889 901 HG2 ARG 120 2HG ARG 120 0.197 -12.928 3.202 902 HG3 ARG 120 1HG ARG 120 0.886 -14.282 3.981 903 HD2 ARG 120 2HD ARG 120 -0.832 -14.684 1.407 904 HD3 ARG 120 1HD ARG 120 0.859 -14.177 1.362 905 HH11 ARG 120 2HH1 ARG 120 1.407 -15.651 -0.008 906 HH12 ARG 120 1HH1 ARG 120 2.685 -16.954 -0.037 907 HH21 ARG 120 1HH2 ARG 120 1.855 -17.906 3.152 908 HH22 ARG 120 2HH2 ARG 120 2.931 -18.152 1.729 909 H VAL 121 H VAL 121 -4.871 -12.976 3.168 910 HA VAL 121 HA VAL 121 -6.026 -13.408 5.901 911 HB VAL 121 HB VAL 121 -7.451 -12.392 3.446 912 HG11 VAL 121 1HG1 VAL 121 -9.080 -13.166 5.190 913 HG12 VAL 121 2HG1 VAL 121 -9.076 -11.407 5.126 914 HG13 VAL 121 3HG1 VAL 121 -8.229 -12.221 6.438 915 HG21 VAL 121 3HG2 VAL 121 -5.479 -10.970 5.180 916 HG22 VAL 121 1HG2 VAL 121 -7.069 -10.187 5.269 917 HG23 VAL 121 2HG2 VAL 121 -6.306 -10.430 3.718 918 HA PRO 122 HA PRO 122 -7.076 -17.770 4.850 919 HB2 PRO 122 2HB PRO 122 -8.681 -17.617 7.455 920 HB3 PRO 122 1HB PRO 122 -7.524 -18.855 6.928 921 HG2 PRO 122 2HG PRO 122 -6.784 -16.937 8.759 922 HG3 PRO 122 1HG PRO 122 -5.639 -17.436 7.494 923 HD2 PRO 122 2HD PRO 122 -7.315 -14.903 7.567 924 HD3 PRO 122 1HD PRO 122 -5.645 -15.211 6.996 925 H GLY 123 H GLY 123 -9.757 -15.641 5.185 926 HA2 GLY 123 2HA GLY 123 -11.656 -17.677 3.873 927 HA3 GLY 123 1HA GLY 123 -12.301 -16.646 5.150 928 H GLU 124 H GLU 124 -13.449 -15.071 4.225 929 HA GLU 124 HA GLU 124 -14.186 -13.381 2.737 930 HB2 GLU 124 2HB GLU 124 -11.411 -12.462 3.507 931 HB3 GLU 124 1HB GLU 124 -12.827 -11.476 3.222 932 HG2 GLU 124 2HG GLU 124 -12.344 -13.364 5.632 933 HG3 GLU 124 1HG GLU 124 -12.363 -11.621 5.669 934 H TYR 125 H TYR 125 -13.946 -14.894 0.777 935 HA TYR 125 HA TYR 125 -11.848 -14.103 -1.203 936 HD1 TYR 125 HD1 TYR 125 -10.498 -16.435 -0.536 937 HD2 TYR 125 HD2 TYR 125 -14.576 -17.709 -0.149 938 HE1 TYR 125 HE1 TYR 125 -9.806 -18.196 1.043 939 HE2 TYR 125 HE2 TYR 125 -13.861 -19.499 1.402 940 HH TYR 125 HH TYR 125 -10.507 -19.763 2.449 941 HB2 TYR 125 2HB TYR 125 -14.086 -16.086 -1.792 942 HB3 TYR 125 1HB TYR 125 -12.492 -16.054 -2.442 943 H GLU 126 H GLU 126 -12.321 -13.825 -3.508 944 HA GLU 126 HA GLU 126 -13.320 -13.047 -5.431 945 HB2 GLU 126 2HB GLU 126 -15.830 -13.869 -3.928 946 HB3 GLU 126 1HB GLU 126 -15.975 -13.063 -5.462 947 HG2 GLU 126 2HG GLU 126 -14.605 -14.808 -6.606 948 HG3 GLU 126 1HG GLU 126 -14.429 -15.701 -5.084 949 H GLY 127 H GLY 127 -13.227 -11.132 -6.371 950 HA2 GLY 127 2HA GLY 127 -15.143 -8.909 -5.698 951 HA3 GLY 127 1HA GLY 127 -13.494 -8.605 -5.132 952 H ASP 128 H ASP 128 -14.476 -6.707 -6.472 953 HA ASP 128 HA ASP 128 -13.520 -6.676 -9.319 954 HB2 ASP 128 2HB ASP 128 -14.883 -4.664 -7.455 955 HB3 ASP 128 1HB ASP 128 -13.849 -3.984 -8.679 956 H THR 129 H THR 129 -11.935 -5.640 -6.251 957 HA THR 129 HA THR 129 -9.717 -4.354 -7.784 958 HB THR 129 HB THR 129 -9.654 -4.912 -4.796 959 HG1 THR 129 HG1 THR 129 -10.822 -3.086 -4.443 960 HG21 THR 129 3HG2 THR 129 -7.615 -3.751 -5.992 961 HG22 THR 129 1HG2 THR 129 -8.340 -2.812 -4.671 962 HG23 THR 129 2HG2 THR 129 -8.721 -2.414 -6.370 963 H TYR 130 H TYR 130 -8.135 -5.585 -8.685 964 HA TYR 130 HA TYR 130 -7.208 -8.184 -7.382 965 HD1 TYR 130 HD1 TYR 130 -9.783 -7.219 -10.093 966 HD2 TYR 130 HD2 TYR 130 -7.478 -10.733 -9.209 967 HE1 TYR 130 HE1 TYR 130 -11.802 -8.598 -10.302 968 HE2 TYR 130 HE2 TYR 130 -9.509 -12.111 -9.446 969 HH TYR 130 HH TYR 130 -12.617 -10.664 -9.563 970 HB2 TYR 130 2HB TYR 130 -7.169 -7.233 -10.303 971 HB3 TYR 130 1HB TYR 130 -6.331 -8.655 -9.749 972 H TYR 131 H TYR 131 -5.220 -8.658 -6.832 973 HA TYR 131 HA TYR 131 -3.081 -6.569 -6.797 974 HD1 TYR 131 HD2 TYR 131 -0.857 -9.876 -5.666 975 HD2 TYR 131 HD1 TYR 131 -2.411 -6.539 -3.485 976 HE1 TYR 131 HE2 TYR 131 1.285 -9.630 -4.575 977 HE2 TYR 131 HE1 TYR 131 -0.307 -6.450 -2.193 978 HH TYR 131 HH TYR 131 1.781 -7.114 -2.080 979 HB2 TYR 131 2HB TYR 131 -3.929 -8.054 -4.836 980 HB3 TYR 131 1HB TYR 131 -3.282 -9.420 -5.645 981 HA PRO 132 HA PRO 132 -0.496 -8.614 -10.064 982 HB2 PRO 132 2HB PRO 132 2.062 -7.555 -9.057 983 HB3 PRO 132 1HB PRO 132 1.080 -6.971 -10.396 984 HG2 PRO 132 2HG PRO 132 1.424 -5.545 -8.032 985 HG3 PRO 132 1HG PRO 132 0.010 -5.363 -9.091 986 HD2 PRO 132 2HD PRO 132 0.203 -6.999 -6.544 987 HD3 PRO 132 1HD PRO 132 -1.096 -5.895 -7.088 988 H GLU 133 H GLU 133 1.669 -9.854 -10.423 989 HA GLU 133 HA GLU 133 1.660 -12.194 -8.529 990 HB2 GLU 133 2HB GLU 133 2.839 -13.503 -10.213 991 HB3 GLU 133 1HB GLU 133 1.282 -12.871 -10.671 992 HG2 GLU 133 2HG GLU 133 2.823 -10.992 -11.949 993 HG3 GLU 133 1HG GLU 133 3.988 -12.320 -11.893 994 H TRP 134 H TRP 134 3.708 -13.312 -8.044 995 HA TRP 134 HA TRP 134 5.664 -11.337 -6.811 996 HD1 TRP 134 HD1 TRP 134 5.276 -15.542 -5.473 997 HE1 TRP 134 HE1 TRP 134 3.124 -17.063 -5.355 998 HE3 TRP 134 HE3 TRP 134 1.983 -11.804 -4.409 999 HZ2 TRP 134 HZ2 TRP 134 0.397 -16.537 -4.766 1000 HZ3 TRP 134 HZ3 TRP 134 -0.404 -12.370 -4.058 1001 HH2 TRP 134 HH2 TRP 134 -1.197 -14.699 -4.308 1002 HB2 TRP 134 2HB TRP 134 5.730 -12.706 -4.678 1003 HB3 TRP 134 1HB TRP 134 4.312 -11.730 -4.928 1004 H ASP 135 H ASP 135 7.776 -11.863 -7.102 1005 HA ASP 135 HA ASP 135 8.334 -14.463 -8.571 1006 HB2 ASP 135 2HB ASP 135 8.735 -11.701 -9.313 1007 HB3 ASP 135 1HB ASP 135 10.317 -12.214 -8.794 1008 H ALA 136 H ALA 136 10.837 -14.711 -8.545 1009 HA ALA 136 HA ALA 136 11.740 -15.078 -5.587 1010 HB1 ALA 136 3HB ALA 136 12.788 -17.211 -6.241 1011 HB2 ALA 136 1HB ALA 136 12.426 -16.932 -7.970 1012 HB3 ALA 136 2HB ALA 136 11.099 -17.223 -6.806 1013 H ALA 137 H ALA 137 12.880 -13.974 -8.690 1014 HA ALA 137 HA ALA 137 15.551 -13.196 -7.388 1015 HB1 ALA 137 3HB ALA 137 15.913 -14.552 -9.394 1016 HB2 ALA 137 1HB ALA 137 16.464 -12.886 -9.691 1017 HB3 ALA 137 2HB ALA 137 14.932 -13.446 -10.398 1018 H GLU 138 H GLU 138 12.666 -11.639 -8.819 1019 HA GLU 138 HA GLU 138 13.796 -8.907 -8.672 1020 HB2 GLU 138 2HB GLU 138 10.877 -9.838 -8.632 1021 HB3 GLU 138 1HB GLU 138 11.423 -8.183 -8.697 1022 HG2 GLU 138 2HG GLU 138 12.015 -10.200 -10.934 1023 HG3 GLU 138 1HG GLU 138 10.717 -9.026 -10.932 1024 H TRP 139 H TRP 139 11.800 -10.728 -6.288 1025 HA TRP 139 HA TRP 139 12.973 -9.054 -4.035 1026 HD1 TRP 139 HD1 TRP 139 8.666 -10.839 -4.435 1027 HE1 TRP 139 HE1 TRP 139 7.066 -10.365 -6.545 1028 HE3 TRP 139 HE3 TRP 139 10.926 -6.581 -5.969 1029 HZ2 TRP 139 HZ2 TRP 139 7.214 -8.551 -8.674 1030 HZ3 TRP 139 HZ3 TRP 139 10.235 -5.556 -8.122 1031 HH2 TRP 139 HH2 TRP 139 8.431 -6.536 -9.460 1032 HB2 TRP 139 2HB TRP 139 10.471 -9.107 -2.995 1033 HB3 TRP 139 1HB TRP 139 11.123 -7.800 -3.915 1034 H GLU 140 H GLU 140 13.336 -9.993 -2.141 1035 HA GLU 140 HA GLU 140 12.555 -12.931 -1.767 1036 HB2 GLU 140 2HB GLU 140 14.553 -13.470 -0.899 1037 HB3 GLU 140 1HB GLU 140 15.070 -12.264 -2.040 1038 HG2 GLU 140 2HG GLU 140 15.223 -10.603 0.019 1039 HG3 GLU 140 1HG GLU 140 14.859 -11.986 1.050 1040 H LEU 141 H LEU 141 13.007 -13.106 1.070 1041 HA LEU 141 HA LEU 141 10.411 -11.743 1.981 1042 HG LEU 141 HG LEU 141 9.102 -14.944 3.430 1043 HB2 LEU 141 2HB LEU 141 10.691 -14.419 1.630 1044 HB3 LEU 141 1HB LEU 141 11.378 -14.329 3.222 1045 HD11 LEU 141 1HD1 LEU 141 7.931 -13.265 4.749 1046 HD12 LEU 141 2HD1 LEU 141 8.902 -11.940 4.079 1047 HD13 LEU 141 3HD1 LEU 141 9.658 -13.148 5.126 1048 HD21 LEU 141 3HD2 LEU 141 7.164 -13.836 2.337 1049 HD22 LEU 141 1HD2 LEU 141 8.343 -14.342 1.122 1050 HD23 LEU 141 2HD2 LEU 141 8.237 -12.639 1.585 1051 H ASP 142 H ASP 142 10.883 -10.155 3.461 1052 HA ASP 142 HA ASP 142 13.485 -10.016 4.991 1053 HB2 ASP 142 2HB ASP 142 12.347 -8.047 3.699 1054 HB3 ASP 142 1HB ASP 142 11.163 -8.001 4.992 1055 H ALA 143 H ALA 143 9.924 -9.934 5.789 1056 HA ALA 143 HA ALA 143 10.505 -11.594 8.289 1057 HB1 ALA 143 3HB ALA 143 10.643 -9.127 8.897 1058 HB2 ALA 143 1HB ALA 143 9.306 -9.943 9.746 1059 HB3 ALA 143 2HB ALA 143 8.969 -8.893 8.339 1060 H GLU 144 H GLU 144 9.116 -13.197 8.596 1061 HA GLU 144 HA GLU 144 6.183 -12.956 7.715 1062 HB2 GLU 144 2HB GLU 144 7.862 -14.911 6.946 1063 HB3 GLU 144 1HB GLU 144 7.484 -15.611 8.515 1064 HG2 GLU 144 2HG GLU 144 4.919 -15.249 7.768 1065 HG3 GLU 144 1HG GLU 144 5.609 -14.976 6.170 1066 H THR 145 H THR 145 4.675 -12.592 9.279 1067 HA THR 145 HA THR 145 5.057 -13.803 12.036 1068 HB THR 145 HB THR 145 4.770 -11.945 13.407 1069 HG1 THR 145 HG1 THR 145 4.161 -10.509 11.070 1070 HG21 THR 145 3HG2 THR 145 7.152 -11.937 12.429 1071 HG22 THR 145 1HG2 THR 145 6.587 -10.337 12.966 1072 HG23 THR 145 2HG2 THR 145 6.603 -10.749 11.238 1073 H ASP 146 H ASP 146 3.217 -14.147 13.368 1074 HA ASP 146 HA ASP 146 0.666 -14.392 11.836 1075 HB2 ASP 146 2HB ASP 146 -0.077 -15.778 13.678 1076 HB3 ASP 146 1HB ASP 146 1.420 -16.328 12.971 1077 H HIS 147 H HIS 147 -1.195 -13.287 12.118 1078 HA HIS 147 HA HIS 147 -1.426 -11.097 14.242 1079 HD1 HIS 147 HD1 HIS 147 1.196 -10.698 13.500 1080 HD2 HIS 147 HD2 HIS 147 -0.950 -7.420 11.842 1081 HE1 HIS 147 HE1 HIS 147 2.690 -8.601 13.441 1082 HB2 HIS 147 2HB HIS 147 -1.147 -10.771 11.201 1083 HB3 HIS 147 1HB HIS 147 -2.279 -9.729 12.003 1084 H GLU 148 H GLU 148 -3.754 -9.965 13.871 1085 HA GLU 148 HA GLU 148 -5.349 -11.979 15.134 1086 HB2 GLU 148 2HB GLU 148 -6.295 -9.227 14.154 1087 HB3 GLU 148 1HB GLU 148 -7.275 -10.270 15.118 1088 HG2 GLU 148 2HG GLU 148 -4.764 -9.889 16.621 1089 HG3 GLU 148 1HG GLU 148 -5.309 -8.343 16.009 1090 H GLY 149 H GLY 149 -6.153 -10.651 11.883 1091 HA2 GLY 149 2HA GLY 149 -7.888 -13.175 11.387 1092 HA3 GLY 149 1HA GLY 149 -8.288 -11.649 10.654 1093 H PHE 150 H PHE 150 -4.905 -12.839 10.850 1094 HA PHE 150 HA PHE 150 -4.621 -13.734 8.061 1095 HD1 PHE 150 HD1 PHE 150 -1.774 -10.739 8.201 1096 HD2 PHE 150 HD2 PHE 150 -5.802 -9.541 8.983 1097 HE1 PHE 150 HE1 PHE 150 -0.949 -8.634 9.176 1098 HE2 PHE 150 HE2 PHE 150 -4.981 -7.491 10.028 1099 HZ PHE 150 HZ PHE 150 -2.564 -7.003 10.124 1100 HB2 PHE 150 2HB PHE 150 -3.767 -11.736 6.952 1101 HB3 PHE 150 1HB PHE 150 -5.360 -11.432 7.518 1102 H THR 151 H THR 151 -2.369 -13.660 7.194 1103 HA THR 151 HA THR 151 -0.256 -13.588 9.433 1104 HB THR 151 HB THR 151 1.038 -15.190 8.687 1105 HG1 THR 151 HG1 THR 151 1.756 -14.557 6.811 1106 HG21 THR 151 3HG2 THR 151 -0.072 -17.166 7.811 1107 HG22 THR 151 1HG2 THR 151 -1.319 -16.200 6.990 1108 HG23 THR 151 2HG2 THR 151 -1.310 -16.313 8.763 1109 H LEU 152 H LEU 152 1.183 -12.043 9.417 1110 HA LEU 152 HA LEU 152 1.212 -9.805 7.393 1111 HG LEU 152 HG LEU 152 3.052 -7.987 10.283 1112 HB2 LEU 152 2HB LEU 152 1.221 -9.262 9.746 1113 HB3 LEU 152 1HB LEU 152 2.483 -10.392 10.123 1114 HD11 LEU 152 1HD1 LEU 152 4.866 -9.855 9.864 1115 HD12 LEU 152 2HD1 LEU 152 5.317 -8.190 9.580 1116 HD13 LEU 152 3HD1 LEU 152 4.948 -9.246 8.216 1117 HD21 LEU 152 3HD2 LEU 152 1.862 -7.093 8.276 1118 HD22 LEU 152 1HD2 LEU 152 3.011 -7.885 7.192 1119 HD23 LEU 152 2HD2 LEU 152 3.575 -6.619 8.290 1120 H GLN 153 H GLN 153 2.730 -9.613 5.803 1121 HA GLN 153 HA GLN 153 5.249 -11.352 5.778 1122 HB2 GLN 153 2HB GLN 153 2.816 -12.067 4.482 1123 HB3 GLN 153 1HB GLN 153 3.631 -11.151 3.234 1124 HG2 GLN 153 2HG GLN 153 5.671 -12.695 3.510 1125 HG3 GLN 153 1HG GLN 153 4.802 -13.587 4.746 1126 HE21 GLN 153 1HE2 GLN 153 3.839 -12.365 1.646 1127 HE22 GLN 153 2HE2 GLN 153 3.632 -14.019 0.864 1128 H GLU 154 H GLU 154 6.850 -9.938 5.621 1129 HA GLU 154 HA GLU 154 6.619 -7.446 3.857 1130 HB2 GLU 154 2HB GLU 154 8.706 -7.825 6.058 1131 HB3 GLU 154 1HB GLU 154 8.190 -6.351 5.294 1132 HG2 GLU 154 2HG GLU 154 5.774 -6.996 6.364 1133 HG3 GLU 154 1HG GLU 154 6.706 -8.077 7.350 1134 H TRP 155 H TRP 155 7.486 -7.734 1.894 1135 HA TRP 155 HA TRP 155 9.905 -9.574 1.525 1136 HD1 TRP 155 HD1 TRP 155 5.998 -9.636 0.932 1137 HE1 TRP 155 HE1 TRP 155 4.751 -11.806 0.099 1138 HE3 TRP 155 HE3 TRP 155 9.810 -11.466 -1.917 1139 HZ2 TRP 155 HZ2 TRP 155 5.502 -13.997 -1.533 1140 HZ3 TRP 155 HZ3 TRP 155 9.464 -13.587 -3.157 1141 HH2 TRP 155 HH2 TRP 155 7.342 -14.810 -2.989 1142 HB2 TRP 155 2HB TRP 155 8.186 -8.325 -0.674 1143 HB3 TRP 155 1HB TRP 155 9.485 -9.407 -0.921 1144 H VAL 156 H VAL 156 11.979 -8.694 1.369 1145 HA VAL 156 HA VAL 156 12.313 -5.835 0.414 1146 HB VAL 156 HB VAL 156 13.437 -6.513 2.485 1147 HG11 VAL 156 1HG1 VAL 156 15.268 -8.269 0.728 1148 HG12 VAL 156 2HG1 VAL 156 14.173 -8.837 2.007 1149 HG13 VAL 156 3HG1 VAL 156 15.579 -7.845 2.436 1150 HG21 VAL 156 3HG2 VAL 156 15.496 -5.636 0.388 1151 HG22 VAL 156 1HG2 VAL 156 15.509 -5.313 2.143 1152 HG23 VAL 156 2HG2 VAL 156 14.292 -4.543 1.108 1153 H ARG 157 H ARG 157 13.077 -5.134 -1.445 1154 HA ARG 157 HA ARG 157 13.413 -6.746 -3.820 1155 HE ARG 157 HE ARG 157 14.896 -2.176 -6.042 1156 HB2 ARG 157 2HB ARG 157 13.928 -3.853 -3.053 1157 HB3 ARG 157 1HB ARG 157 14.947 -4.422 -4.339 1158 HG2 ARG 157 2HG ARG 157 12.819 -5.291 -5.565 1159 HG3 ARG 157 1HG ARG 157 11.880 -4.423 -4.353 1160 HD2 ARG 157 2HD ARG 157 12.113 -2.976 -6.382 1161 HD3 ARG 157 1HD ARG 157 12.913 -2.276 -5.021 1162 HH11 ARG 157 2HH1 ARG 157 13.140 -4.681 -7.683 1163 HH12 ARG 157 1HH1 ARG 157 14.511 -5.074 -8.795 1164 HH21 ARG 157 1HH2 ARG 157 16.440 -2.672 -7.169 1165 HH22 ARG 157 2HH2 ARG 157 16.392 -3.964 -8.466 1166 H SER 158 H SER 158 15.034 -7.218 -5.169 1167 HA SER 158 HA SER 158 16.851 -8.939 -4.317 1168 HG SER 158 HG SER 158 16.965 -10.113 -7.048 1169 HB2 SER 158 2HB SER 158 16.002 -8.369 -6.731 1170 HB3 SER 158 1HB SER 158 17.543 -7.521 -6.937 1171 H ALA 159 H ALA 159 18.319 -8.736 -2.853 1172 HA ALA 159 HA ALA 159 20.359 -8.505 -1.794 1173 HB1 ALA 159 3HB ALA 159 22.441 -7.722 -3.014 1174 HB2 ALA 159 1HB ALA 159 21.408 -7.181 -4.373 1175 HB3 ALA 159 2HB ALA 159 21.510 -8.911 -3.950 1176 H SER 160 H SER 160 21.973 -5.875 -2.076 1177 HA SER 160 HA SER 160 19.961 -4.027 -0.736 1178 HG SER 160 HG SER 160 23.127 -5.342 0.479 1179 HB2 SER 160 2HB SER 160 21.322 -3.227 1.037 1180 HB3 SER 160 1HB SER 160 21.040 -4.949 1.212 1181 H SER 161 H SER 161 19.779 -2.529 -2.124 1182 HA SER 161 HA SER 161 21.821 -1.909 -4.171 1183 HG SER 161 HG SER 161 19.125 -2.959 -4.535 1184 HB2 SER 161 2HB SER 161 18.967 -0.932 -3.558 1185 HB3 SER 161 1HB SER 161 19.921 -0.240 -4.864 1186 H ARG 162 H ARG 162 23.502 -0.719 -3.717 1187 HA ARG 162 HA ARG 162 23.268 1.936 -2.222 1188 HE ARG 162 HE ARG 162 25.525 2.659 2.002 1189 HB2 ARG 162 1HB ARG 162 23.762 -0.227 -0.800 1190 HB3 ARG 162 2HB ARG 162 25.323 -0.292 -1.600 1191 HG2 ARG 162 1HG ARG 162 25.941 1.946 -0.645 1192 HG3 ARG 162 2HG ARG 162 24.276 2.179 -0.056 1193 HD2 ARG 162 1HD ARG 162 24.526 0.071 1.407 1194 HD3 ARG 162 2HD ARG 162 26.212 -0.048 0.876 1195 HH11 ARG 162 2HH1 ARG 162 26.380 -0.583 3.043 1196 HH12 ARG 162 1HH1 ARG 162 27.150 0.096 4.555 1197 HH21 ARG 162 1HH2 ARG 162 26.514 3.337 3.777 1198 HH22 ARG 162 2HH2 ARG 162 27.206 2.088 4.899 Start of MODEL 19 1 HA MET 1 HA MET 1 16.361 5.012 1.834 2 H1 MET 1 1H MET 1 15.681 7.217 2.999 3 H2 MET 1 2H MET 1 15.153 6.270 4.196 4 HB2 MET 1 1HB MET 1 14.182 4.181 3.837 5 HB3 MET 1 2HB MET 1 14.658 3.203 2.475 6 HG2 MET 1 1HG MET 1 16.928 2.865 3.313 7 HG3 MET 1 2HG MET 1 16.669 3.985 4.666 8 HE1 MET 1 3HE MET 1 15.583 3.520 6.733 9 HE2 MET 1 1HE MET 1 16.861 2.269 6.886 10 HE3 MET 1 2HE MET 1 15.168 1.905 7.362 11 H GLU 2 H GLU 2 13.921 3.914 0.846 12 HA GLU 2 HA GLU 2 12.264 6.323 0.004 13 HB2 GLU 2 2HB GLU 2 12.212 5.842 -2.303 14 HB3 GLU 2 1HB GLU 2 13.859 5.958 -1.787 15 HG2 GLU 2 2HG GLU 2 13.793 3.280 -1.715 16 HG3 GLU 2 1HG GLU 2 12.362 3.460 -2.736 17 H LEU 3 H LEU 3 10.510 4.344 -1.587 18 HA LEU 3 HA LEU 3 8.752 4.222 0.875 19 HG LEU 3 HG LEU 3 8.893 6.191 -2.228 20 HB2 LEU 3 2HB LEU 3 6.771 4.469 -0.819 21 HB3 LEU 3 1HB LEU 3 7.719 5.780 -0.212 22 HD11 LEU 3 1HD1 LEU 3 8.706 4.841 -4.281 23 HD12 LEU 3 2HD1 LEU 3 7.503 3.734 -3.546 24 HD13 LEU 3 3HD1 LEU 3 9.194 3.742 -3.014 25 HD21 LEU 3 3HD2 LEU 3 6.670 7.197 -2.087 26 HD22 LEU 3 1HD2 LEU 3 5.863 5.695 -2.604 27 HD23 LEU 3 2HD2 LEU 3 6.835 6.633 -3.760 28 H VAL 4 H VAL 4 7.249 2.809 1.453 29 HA VAL 4 HA VAL 4 7.612 -0.023 0.370 30 HB VAL 4 HB VAL 4 7.242 0.973 3.212 31 HG11 VAL 4 1HG1 VAL 4 6.288 -1.293 3.127 32 HG12 VAL 4 2HG1 VAL 4 7.881 -1.436 3.933 33 HG13 VAL 4 3HG1 VAL 4 7.664 -1.904 2.237 34 HG21 VAL 4 3HG2 VAL 4 9.877 -0.095 2.061 35 HG22 VAL 4 1HG2 VAL 4 9.540 0.338 3.759 36 HG23 VAL 4 2HG2 VAL 4 9.508 1.570 2.509 37 H SER 5 H SER 5 5.853 -1.261 -0.150 38 HA SER 5 HA SER 5 3.142 0.054 0.043 39 HG SER 5 HG SER 5 4.233 -2.811 -2.623 40 HB2 SER 5 2HB SER 5 2.622 -1.487 -1.821 41 HB3 SER 5 1HB SER 5 4.033 -0.537 -2.115 42 H VAL 6 H VAL 6 1.331 -0.660 0.962 43 HA VAL 6 HA VAL 6 1.415 -3.152 2.658 44 HB VAL 6 HB VAL 6 1.203 -2.331 4.699 45 HG11 VAL 6 1HG1 VAL 6 2.802 -0.471 5.199 46 HG12 VAL 6 2HG1 VAL 6 2.753 0.049 3.513 47 HG13 VAL 6 3HG1 VAL 6 3.439 -1.520 3.916 48 HG21 VAL 6 3HG2 VAL 6 -0.791 -0.867 4.633 49 HG22 VAL 6 1HG2 VAL 6 0.183 0.444 3.923 50 HG23 VAL 6 2HG2 VAL 6 0.492 -0.129 5.574 51 H ALA 7 H ALA 7 0.068 -4.060 1.151 52 HA ALA 7 HA ALA 7 -2.904 -3.254 1.390 53 HB1 ALA 7 3HB ALA 7 -1.602 -5.054 -0.760 54 HB2 ALA 7 1HB ALA 7 -2.097 -3.354 -0.975 55 HB3 ALA 7 2HB ALA 7 -3.316 -4.583 -0.645 56 H ALA 8 H ALA 8 -4.229 -4.541 2.598 57 HA ALA 8 HA ALA 8 -3.504 -7.393 3.208 58 HB1 ALA 8 3HB ALA 8 -4.273 -5.993 5.057 59 HB2 ALA 8 1HB ALA 8 -5.483 -7.241 4.763 60 HB3 ALA 8 2HB ALA 8 -5.779 -5.584 4.240 61 H LEU 9 H LEU 9 -4.329 -9.203 2.355 62 HA LEU 9 HA LEU 9 -6.790 -9.247 0.640 63 HG LEU 9 HG LEU 9 -3.582 -9.296 -2.197 64 HB2 LEU 9 2HB LEU 9 -5.708 -9.692 -1.475 65 HB3 LEU 9 1HB LEU 9 -5.371 -8.129 -0.866 66 HD11 LEU 9 1HD1 LEU 9 -1.685 -8.328 -0.879 67 HD12 LEU 9 2HD1 LEU 9 -2.712 -8.225 0.552 68 HD13 LEU 9 3HD1 LEU 9 -3.060 -7.247 -0.894 69 HD21 LEU 9 3HD2 LEU 9 -3.616 -11.569 -1.197 70 HD22 LEU 9 1HD2 LEU 9 -2.989 -10.900 0.355 71 HD23 LEU 9 2HD2 LEU 9 -1.994 -10.850 -1.108 72 H ALA 10 H ALA 10 -7.460 -11.106 -0.365 73 HA ALA 10 HA ALA 10 -6.733 -13.665 1.149 74 HB1 ALA 10 3HB ALA 10 -9.390 -12.554 -0.016 75 HB2 ALA 10 1HB ALA 10 -8.823 -12.264 1.653 76 HB3 ALA 10 2HB ALA 10 -9.232 -13.900 1.136 77 H GLU 11 H GLU 11 -8.931 -14.985 -0.589 78 HA GLU 11 HA GLU 11 -7.147 -16.371 -2.514 79 HB2 GLU 11 2HB GLU 11 -8.917 -17.593 -1.303 80 HB3 GLU 11 1HB GLU 11 -10.157 -16.574 -2.013 81 HG2 GLU 11 2HG GLU 11 -10.191 -18.780 -3.061 82 HG3 GLU 11 1HG GLU 11 -9.865 -17.550 -4.252 83 H ASN 12 H ASN 12 -7.597 -16.601 -4.720 84 HA ASN 12 HA ASN 12 -6.820 -15.510 -6.614 85 HB2 ASN 12 2HB ASN 12 -9.671 -15.110 -6.527 86 HB3 ASN 12 1HB ASN 12 -9.072 -13.577 -7.043 87 HD21 ASN 12 1HD2 ASN 12 -7.205 -13.949 -8.829 88 HD22 ASN 12 2HD2 ASN 12 -7.883 -15.018 -10.179 89 H ARG 13 H ARG 13 -6.042 -14.147 -4.120 90 HA ARG 13 HA ARG 13 -5.035 -12.271 -3.266 91 HE ARG 13 HE ARG 13 -1.444 -14.069 -7.722 92 HB2 ARG 13 2HB ARG 13 -3.176 -11.281 -4.409 93 HB3 ARG 13 1HB ARG 13 -3.203 -13.021 -4.481 94 HG2 ARG 13 2HG ARG 13 -4.031 -12.923 -6.883 95 HG3 ARG 13 1HG ARG 13 -3.912 -11.167 -6.839 96 HD2 ARG 13 2HD ARG 13 -1.575 -11.150 -6.982 97 HD3 ARG 13 1HD ARG 13 -1.356 -12.490 -5.922 98 HH11 ARG 13 2HH1 ARG 13 -2.267 -10.915 -9.019 99 HH12 ARG 13 1HH1 ARG 13 -1.738 -11.466 -10.690 100 HH21 ARG 13 1HH2 ARG 13 -0.931 -14.568 -9.618 101 HH22 ARG 13 2HH2 ARG 13 -0.899 -13.369 -10.977 102 H VAL 14 H VAL 14 -7.241 -11.665 -3.143 103 HA VAL 14 HA VAL 14 -8.137 -9.235 -4.684 104 HB VAL 14 HB VAL 14 -9.421 -11.352 -2.878 105 HG11 VAL 14 1HG1 VAL 14 -11.644 -10.266 -2.984 106 HG12 VAL 14 2HG1 VAL 14 -10.906 -8.733 -3.537 107 HG13 VAL 14 3HG1 VAL 14 -10.524 -9.409 -1.931 108 HG21 VAL 14 3HG2 VAL 14 -9.182 -11.666 -5.384 109 HG22 VAL 14 1HG2 VAL 14 -10.170 -10.215 -5.668 110 HG23 VAL 14 2HG2 VAL 14 -10.878 -11.650 -4.854 111 H ILE 15 H ILE 15 -7.311 -7.336 -4.066 112 HA ILE 15 HA ILE 15 -6.729 -6.427 -1.305 113 HB ILE 15 HB ILE 15 -7.267 -4.848 -3.853 114 HG12 ILE 15 2HG1 ILE 15 -4.508 -5.083 -2.515 115 HG13 ILE 15 1HG1 ILE 15 -5.091 -6.402 -3.471 116 HG21 ILE 15 1HG2 ILE 15 -6.348 -2.782 -2.868 117 HG22 ILE 15 2HG2 ILE 15 -5.956 -3.584 -1.337 118 HG23 ILE 15 3HG2 ILE 15 -7.648 -3.305 -1.813 119 HD11 ILE 15 3HD1 ILE 15 -3.729 -4.866 -4.911 120 HD12 ILE 15 1HD1 ILE 15 -4.815 -3.519 -4.505 121 HD13 ILE 15 2HD1 ILE 15 -5.411 -4.870 -5.491 122 H GLY 16 H GLY 16 -9.592 -5.646 -3.316 123 HA2 GLY 16 2HA GLY 16 -11.291 -5.165 -0.875 124 HA3 GLY 16 1HA GLY 16 -10.843 -3.667 -1.719 125 H ARG 17 H ARG 17 -13.303 -3.859 -1.552 126 HA ARG 17 HA ARG 17 -14.529 -4.914 -4.101 127 HE ARG 17 HE ARG 17 -17.041 -9.757 -4.160 128 HB2 ARG 17 2HB ARG 17 -14.197 -6.860 -2.395 129 HB3 ARG 17 1HB ARG 17 -15.424 -6.097 -1.384 130 HG2 ARG 17 2HG ARG 17 -17.061 -6.322 -3.300 131 HG3 ARG 17 1HG ARG 17 -15.814 -7.021 -4.331 132 HD2 ARG 17 2HD ARG 17 -15.451 -8.890 -2.589 133 HD3 ARG 17 1HD ARG 17 -16.730 -8.210 -1.586 134 HH11 ARG 17 2HH1 ARG 17 -18.677 -7.426 -2.155 135 HH12 ARG 17 1HH1 ARG 17 -20.310 -7.935 -2.743 136 HH21 ARG 17 1HH2 ARG 17 -18.849 -10.326 -4.794 137 HH22 ARG 17 2HH2 ARG 17 -20.400 -9.549 -4.217 138 H ASP 18 H ASP 18 -15.857 -3.966 -0.882 139 HA ASP 18 HA ASP 18 -17.749 -2.070 -2.235 140 HB2 ASP 18 2HB ASP 18 -17.373 -2.853 0.720 141 HB3 ASP 18 1HB ASP 18 -18.563 -1.712 0.129 142 H GLY 19 H GLY 19 -14.761 -1.642 -0.424 143 HA2 GLY 19 2HA GLY 19 -14.319 0.917 -1.894 144 HA3 GLY 19 1HA GLY 19 -14.475 1.238 -0.173 145 H GLU 20 H GLU 20 -12.720 0.552 1.188 146 HA GLU 20 HA GLU 20 -10.076 0.128 -0.110 147 HB2 GLU 20 2HB GLU 20 -9.065 0.067 2.125 148 HB3 GLU 20 1HB GLU 20 -9.928 1.532 1.781 149 HG2 GLU 20 2HG GLU 20 -11.731 0.966 3.388 150 HG3 GLU 20 1HG GLU 20 -11.176 -0.689 3.529 151 H LEU 21 H LEU 21 -11.979 -1.974 2.043 152 HA LEU 21 HA LEU 21 -10.361 -4.393 1.084 153 HG LEU 21 HG LEU 21 -9.481 -2.117 3.247 154 HB2 LEU 21 2HB LEU 21 -11.192 -4.093 3.995 155 HB3 LEU 21 1HB LEU 21 -9.978 -5.144 3.315 156 HD11 LEU 21 1HD1 LEU 21 -8.876 -3.737 5.763 157 HD12 LEU 21 2HD1 LEU 21 -10.323 -2.693 5.577 158 HD13 LEU 21 3HD1 LEU 21 -8.709 -1.984 5.470 159 HD21 LEU 21 3HD2 LEU 21 -7.123 -2.733 3.507 160 HD22 LEU 21 1HD2 LEU 21 -7.800 -3.604 2.105 161 HD23 LEU 21 2HD2 LEU 21 -7.555 -4.453 3.649 162 HA PRO 22 HA PRO 22 -14.523 -6.381 1.091 163 HB2 PRO 22 2HB PRO 22 -13.590 -9.119 1.348 164 HB3 PRO 22 1HB PRO 22 -13.918 -8.211 -0.131 165 HG2 PRO 22 2HG PRO 22 -11.322 -9.078 0.704 166 HG3 PRO 22 1HG PRO 22 -11.653 -7.853 -0.542 167 HD2 PRO 22 2HD PRO 22 -10.969 -7.373 2.393 168 HD3 PRO 22 1HD PRO 22 -10.422 -6.530 0.958 169 H TRP 23 H TRP 23 -12.569 -7.055 3.869 170 HA TRP 23 HA TRP 23 -14.930 -8.025 5.534 171 HD1 TRP 23 HD1 TRP 23 -11.509 -6.231 7.637 172 HE1 TRP 23 HE1 TRP 23 -9.179 -5.618 6.538 173 HE3 TRP 23 HE3 TRP 23 -11.394 -10.044 4.293 174 HZ2 TRP 23 HZ2 TRP 23 -7.719 -6.671 4.450 175 HZ3 TRP 23 HZ3 TRP 23 -9.545 -10.108 2.642 176 HH2 TRP 23 HH2 TRP 23 -7.763 -8.414 2.695 177 HB2 TRP 23 2HB TRP 23 -13.286 -8.579 7.350 178 HB3 TRP 23 1HB TRP 23 -13.011 -9.479 5.888 179 HA PRO 24 HA PRO 24 -15.649 -4.054 7.210 180 HB2 PRO 24 2HB PRO 24 -15.623 -4.919 10.107 181 HB3 PRO 24 1HB PRO 24 -16.927 -4.224 9.137 182 HG2 PRO 24 2HG PRO 24 -16.951 -6.904 9.772 183 HG3 PRO 24 1HG PRO 24 -17.484 -6.367 8.167 184 HD2 PRO 24 2HD PRO 24 -14.732 -7.484 8.910 185 HD3 PRO 24 1HD PRO 24 -15.797 -7.922 7.553 186 H SER 25 H SER 25 -13.021 -5.251 9.261 187 HA SER 25 HA SER 25 -10.951 -3.579 8.955 188 HG SER 25 HG SER 25 -12.079 -1.413 8.210 189 HB2 SER 25 2HB SER 25 -12.933 -1.789 10.424 190 HB3 SER 25 1HB SER 25 -11.260 -1.727 10.933 191 H ILE 26 H ILE 26 -10.002 -5.437 9.877 192 HA ILE 26 HA ILE 26 -10.497 -6.186 12.710 193 HB ILE 26 HB ILE 26 -8.305 -7.513 12.555 194 HG12 ILE 26 2HG1 ILE 26 -8.003 -6.361 10.015 195 HG13 ILE 26 1HG1 ILE 26 -7.032 -7.573 10.777 196 HG21 ILE 26 1HG2 ILE 26 -10.787 -8.521 11.110 197 HG22 ILE 26 2HG2 ILE 26 -10.466 -8.533 12.856 198 HG23 ILE 26 3HG2 ILE 26 -9.444 -9.493 11.773 199 HD11 ILE 26 3HD1 ILE 26 -9.391 -8.244 8.901 200 HD12 ILE 26 1HD1 ILE 26 -8.217 -9.402 9.580 201 HD13 ILE 26 2HD1 ILE 26 -7.689 -8.143 8.435 202 HA PRO 27 HA PRO 27 -7.787 -2.978 14.511 203 HB2 PRO 27 2HB PRO 27 -7.868 -4.865 16.926 204 HB3 PRO 27 1HB PRO 27 -8.035 -3.085 16.875 205 HG2 PRO 27 2HG PRO 27 -10.303 -4.575 17.050 206 HG3 PRO 27 1HG PRO 27 -10.272 -3.262 15.841 207 HD2 PRO 27 2HD PRO 27 -9.758 -6.256 15.324 208 HD3 PRO 27 1HD PRO 27 -10.840 -5.087 14.475 209 H ALA 28 H ALA 28 -6.449 -6.316 14.837 210 HA ALA 28 HA ALA 28 -3.678 -5.487 15.048 211 HB1 ALA 28 3HB ALA 28 -4.120 -7.763 15.382 212 HB2 ALA 28 1HB ALA 28 -3.188 -7.754 13.869 213 HB3 ALA 28 2HB ALA 28 -4.936 -7.939 13.804 214 H ASP 29 H ASP 29 -5.635 -5.469 12.144 215 HA ASP 29 HA ASP 29 -3.436 -4.931 10.167 216 HB2 ASP 29 2HB ASP 29 -5.580 -6.047 9.526 217 HB3 ASP 29 1HB ASP 29 -6.515 -4.667 10.085 218 H LYS 30 H LYS 30 -6.123 -2.771 11.067 219 HA LYS 30 HA LYS 30 -4.680 -0.455 10.924 220 HB2 LYS 30 2HB LYS 30 -6.494 0.692 11.297 221 HB3 LYS 30 1HB LYS 30 -7.272 -0.875 11.270 222 HG2 LYS 30 2HG LYS 30 -7.107 -0.829 13.883 223 HG3 LYS 30 1HG LYS 30 -6.635 0.848 13.719 224 HD2 LYS 30 2HD LYS 30 -9.331 -0.460 12.914 225 HD3 LYS 30 1HD LYS 30 -9.035 0.642 14.207 226 HE2 LYS 30 2HE LYS 30 -9.991 2.196 12.783 227 HE3 LYS 30 1HE LYS 30 -8.340 2.420 12.283 228 HZ1 LYS 30 3HZ LYS 30 -9.899 2.092 10.351 229 HZ2 LYS 30 1HZ LYS 30 -10.301 0.585 10.837 230 HZ3 LYS 30 2HZ LYS 30 -8.790 0.891 10.320 231 H LYS 31 H LYS 31 -3.880 -2.436 13.312 232 HA LYS 31 HA LYS 31 -2.213 -0.418 14.917 233 HB2 LYS 31 2HB LYS 31 -3.369 -2.140 16.268 234 HB3 LYS 31 1HB LYS 31 -2.812 -3.417 15.229 235 HG2 LYS 31 2HG LYS 31 -1.560 -3.681 17.183 236 HG3 LYS 31 1HG LYS 31 -0.449 -3.130 15.978 237 HD2 LYS 31 2HD LYS 31 -1.211 -0.649 17.098 238 HD3 LYS 31 1HD LYS 31 -1.526 -1.705 18.444 239 HE2 LYS 31 2HE LYS 31 0.737 -0.980 18.833 240 HE3 LYS 31 1HE LYS 31 0.922 -2.619 18.232 241 HZ1 LYS 31 3HZ LYS 31 1.334 -0.065 16.664 242 HZ2 LYS 31 1HZ LYS 31 0.993 -1.416 15.859 243 HZ3 LYS 31 2HZ LYS 31 2.373 -1.337 16.757 244 H GLN 32 H GLN 32 -1.733 -2.969 12.421 245 HA GLN 32 HA GLN 32 1.267 -2.583 12.483 246 HB2 GLN 32 2HB GLN 32 0.375 -4.853 12.164 247 HB3 GLN 32 1HB GLN 32 -0.452 -4.379 10.691 248 HG2 GLN 32 2HG GLN 32 2.624 -4.249 11.112 249 HG3 GLN 32 1HG GLN 32 1.819 -5.657 10.475 250 HE21 GLN 32 1HE2 GLN 32 0.320 -5.005 8.418 251 HE22 GLN 32 2HE2 GLN 32 1.316 -4.036 7.222 252 H TYR 33 H TYR 33 -1.475 -1.926 10.179 253 HA TYR 33 HA TYR 33 -0.170 0.045 8.535 254 HD1 TYR 33 HD1 TYR 33 -3.716 1.269 10.466 255 HD2 TYR 33 HD2 TYR 33 -2.767 1.589 6.338 256 HE1 TYR 33 HE1 TYR 33 -5.282 3.160 10.275 257 HE2 TYR 33 HE2 TYR 33 -4.165 3.636 6.172 258 HH TYR 33 HH TYR 33 -6.070 4.718 7.271 259 HB2 TYR 33 2HB TYR 33 -2.147 -0.482 7.617 260 HB3 TYR 33 1HB TYR 33 -2.974 -0.764 9.072 261 H ARG 34 H ARG 34 -1.776 0.955 11.741 262 HA ARG 34 HA ARG 34 -0.650 3.692 11.333 263 HE ARG 34 HE ARG 34 -5.390 4.927 11.598 264 HB2 ARG 34 2HB ARG 34 -2.070 2.490 13.770 265 HB3 ARG 34 1HB ARG 34 -1.429 4.134 13.759 266 HG2 ARG 34 2HG ARG 34 -2.843 4.682 11.683 267 HG3 ARG 34 1HG ARG 34 -3.501 3.053 11.799 268 HD2 ARG 34 2HD ARG 34 -4.465 3.459 14.017 269 HD3 ARG 34 1HD ARG 34 -3.776 5.109 14.045 270 HH11 ARG 34 2HH1 ARG 34 -5.864 5.046 14.993 271 HH12 ARG 34 1HH1 ARG 34 -7.527 5.791 14.829 272 HH21 ARG 34 1HH2 ARG 34 -7.385 5.629 11.389 273 HH22 ARG 34 2HH2 ARG 34 -8.351 6.052 12.799 274 H SER 35 H SER 35 0.948 1.065 12.803 275 HA SER 35 HA SER 35 3.040 2.986 14.007 276 HG SER 35 HG SER 35 4.898 1.656 14.580 277 HB2 SER 35 2HB SER 35 2.317 1.130 15.482 278 HB3 SER 35 1HB SER 35 2.956 -0.051 14.303 279 H ARG 36 H ARG 36 2.408 1.210 11.264 280 HA ARG 36 HA ARG 36 5.191 1.425 10.049 281 HE ARG 36 HE ARG 36 4.434 -2.429 8.748 282 HB2 ARG 36 2HB ARG 36 3.454 -0.572 9.727 283 HB3 ARG 36 1HB ARG 36 2.466 0.560 8.850 284 HG2 ARG 36 2HG ARG 36 3.564 -0.725 7.223 285 HG3 ARG 36 1HG ARG 36 4.318 0.837 7.165 286 HD2 ARG 36 2HD ARG 36 6.030 -0.931 6.952 287 HD3 ARG 36 1HD ARG 36 6.322 -0.108 8.486 288 HH11 ARG 36 2HH1 ARG 36 7.808 -1.888 8.216 289 HH12 ARG 36 1HH1 ARG 36 8.069 -3.656 8.525 290 HH21 ARG 36 1HH2 ARG 36 4.965 -4.287 9.310 291 HH22 ARG 36 2HH2 ARG 36 6.720 -4.823 9.433 292 H VAL 37 H VAL 37 1.795 2.704 9.357 293 HA VAL 37 HA VAL 37 3.103 4.907 7.743 294 HB VAL 37 HB VAL 37 1.490 4.907 6.245 295 HG11 VAL 37 1HG1 VAL 37 0.964 2.713 5.310 296 HG12 VAL 37 2HG1 VAL 37 1.047 1.947 6.929 297 HG13 VAL 37 3HG1 VAL 37 2.520 2.575 6.164 298 HG21 VAL 37 3HG2 VAL 37 -0.592 5.324 7.423 299 HG22 VAL 37 1HG2 VAL 37 -0.636 3.688 8.090 300 HG23 VAL 37 2HG2 VAL 37 -0.891 3.945 6.353 301 H ALA 38 H ALA 38 1.533 5.003 10.800 302 HA ALA 38 HA ALA 38 -0.191 7.346 10.159 303 HB1 ALA 38 3HB ALA 38 0.497 6.471 12.974 304 HB2 ALA 38 1HB ALA 38 -0.873 5.889 11.995 305 HB3 ALA 38 2HB ALA 38 -0.771 7.594 12.454 306 H ASP 39 H ASP 39 3.097 7.135 11.294 307 HA ASP 39 HA ASP 39 3.495 10.112 11.492 308 HB2 ASP 39 2HB ASP 39 5.111 7.645 12.177 309 HB3 ASP 39 1HB ASP 39 6.032 8.897 11.429 310 H ASP 40 H ASP 40 4.766 7.578 9.212 311 HA ASP 40 HA ASP 40 5.607 9.459 7.299 312 HB2 ASP 40 2HB ASP 40 5.172 6.443 7.287 313 HB3 ASP 40 1HB ASP 40 5.805 7.232 5.869 314 HA PRO 41 HA PRO 41 2.205 10.272 4.236 315 HB2 PRO 41 2HB PRO 41 4.519 10.075 2.215 316 HB3 PRO 41 1HB PRO 41 3.231 11.275 2.283 317 HG2 PRO 41 2HG PRO 41 5.635 11.957 3.292 318 HG3 PRO 41 1HG PRO 41 4.238 12.269 4.347 319 HD2 PRO 41 2HD PRO 41 6.119 9.830 4.513 320 HD3 PRO 41 1HD PRO 41 5.577 10.951 5.791 321 H VAL 42 H VAL 42 0.851 9.177 2.793 322 HA VAL 42 HA VAL 42 1.775 6.435 1.775 323 HB VAL 42 HB VAL 42 -0.963 7.315 2.792 324 HG11 VAL 42 1HG1 VAL 42 -1.149 5.445 1.030 325 HG12 VAL 42 2HG1 VAL 42 -1.668 4.975 2.662 326 HG13 VAL 42 3HG1 VAL 42 -0.083 4.436 2.038 327 HG21 VAL 42 3HG2 VAL 42 1.366 5.715 4.037 328 HG22 VAL 42 1HG2 VAL 42 -0.299 5.378 4.570 329 HG23 VAL 42 2HG2 VAL 42 0.401 6.999 4.773 330 H VAL 43 H VAL 43 1.783 5.971 -0.297 331 HA VAL 43 HA VAL 43 0.317 7.713 -2.304 332 HB VAL 43 HB VAL 43 1.839 7.085 -4.003 333 HG11 VAL 43 1HG1 VAL 43 4.080 7.775 -3.179 334 HG12 VAL 43 2HG1 VAL 43 3.645 7.426 -1.505 335 HG13 VAL 43 3HG1 VAL 43 2.863 8.761 -2.343 336 HG21 VAL 43 3HG2 VAL 43 3.100 5.034 -2.112 337 HG22 VAL 43 1HG2 VAL 43 3.813 5.504 -3.652 338 HG23 VAL 43 2HG2 VAL 43 2.261 4.679 -3.663 339 H LEU 44 H LEU 44 -1.633 7.110 -2.996 340 HA LEU 44 HA LEU 44 -2.282 4.153 -3.442 341 HG LEU 44 HG LEU 44 -4.120 7.103 -2.048 342 HB2 LEU 44 2HB LEU 44 -4.177 4.223 -1.986 343 HB3 LEU 44 1HB LEU 44 -2.746 4.566 -1.112 344 HD11 LEU 44 1HD1 LEU 44 -6.152 5.745 -1.687 345 HD12 LEU 44 2HD1 LEU 44 -5.999 6.881 -0.324 346 HD13 LEU 44 3HD1 LEU 44 -5.564 5.159 -0.118 347 HD21 LEU 44 3HD2 LEU 44 -3.826 7.802 0.296 348 HD22 LEU 44 1HD2 LEU 44 -2.316 7.145 -0.360 349 HD23 LEU 44 2HD2 LEU 44 -3.320 6.189 0.796 350 H GLY 45 H GLY 45 -4.923 4.070 -3.822 351 HA2 GLY 45 2HA GLY 45 -5.017 5.128 -6.724 352 HA3 GLY 45 1HA GLY 45 -5.697 3.592 -6.185 353 H ARG 46 H ARG 46 -7.454 4.726 -7.527 354 HA ARG 46 HA ARG 46 -9.289 6.395 -5.723 355 HE ARG 46 HE ARG 46 -11.808 8.564 -7.349 356 HB2 ARG 46 2HB ARG 46 -9.561 5.902 -8.717 357 HB3 ARG 46 1HB ARG 46 -10.865 6.489 -7.737 358 HG2 ARG 46 2HG ARG 46 -8.142 7.919 -7.997 359 HG3 ARG 46 1HG ARG 46 -9.560 8.336 -8.937 360 HD2 ARG 46 2HD ARG 46 -9.339 8.614 -5.858 361 HD3 ARG 46 1HD ARG 46 -9.159 9.906 -7.046 362 HH11 ARG 46 2HH1 ARG 46 -10.181 10.700 -5.198 363 HH12 ARG 46 1HH1 ARG 46 -11.758 11.443 -4.622 364 HH21 ARG 46 1HH2 ARG 46 -13.517 9.384 -6.709 365 HH22 ARG 46 2HH2 ARG 46 -13.566 10.726 -5.472 366 H THR 47 H THR 47 -9.092 3.008 -6.892 367 HA THR 47 HA THR 47 -11.486 2.285 -5.418 368 HB THR 47 HB THR 47 -8.975 0.547 -5.882 369 HG1 THR 47 HG1 THR 47 -10.910 -0.345 -7.152 370 HG21 THR 47 3HG2 THR 47 -10.860 -1.251 -5.657 371 HG22 THR 47 1HG2 THR 47 -11.819 -0.049 -4.785 372 HG23 THR 47 2HG2 THR 47 -10.247 -0.601 -4.134 373 H THR 48 H THR 48 -8.460 1.355 -3.694 374 HA THR 48 HA THR 48 -9.028 1.950 -1.168 375 HB THR 48 HB THR 48 -6.605 2.599 -0.711 376 HG1 THR 48 HG1 THR 48 -6.883 3.232 -3.264 377 HG21 THR 48 3HG2 THR 48 -5.586 0.524 -1.400 378 HG22 THR 48 1HG2 THR 48 -6.799 0.218 -2.647 379 HG23 THR 48 2HG2 THR 48 -7.253 0.139 -0.930 380 H PHE 49 H PHE 49 -8.341 4.922 -3.197 381 HA PHE 49 HA PHE 49 -8.608 6.696 -0.815 382 HD1 PHE 49 HD2 PHE 49 -10.363 9.482 -2.667 383 HD2 PHE 49 HD1 PHE 49 -6.245 9.049 -1.545 384 HE1 PHE 49 HE2 PHE 49 -10.411 11.710 -1.592 385 HE2 PHE 49 HE1 PHE 49 -6.255 11.348 -0.658 386 HZ PHE 49 HZ PHE 49 -8.354 12.603 -0.529 387 HB2 PHE 49 2HB PHE 49 -7.265 7.343 -2.862 388 HB3 PHE 49 1HB PHE 49 -8.748 7.645 -3.725 389 H GLU 50 H GLU 50 -10.984 5.590 -3.206 390 HA GLU 50 HA GLU 50 -13.061 7.559 -2.328 391 HB2 GLU 50 2HB GLU 50 -13.252 5.022 -4.070 392 HB3 GLU 50 1HB GLU 50 -14.656 5.958 -3.584 393 HG2 GLU 50 2HG GLU 50 -13.836 8.009 -4.637 394 HG3 GLU 50 1HG GLU 50 -12.247 7.340 -4.941 395 H SER 51 H SER 51 -11.971 4.521 -0.977 396 HA SER 51 HA SER 51 -13.926 4.872 1.322 397 HG SER 51 HG SER 51 -12.719 3.060 3.332 398 HB2 SER 51 2HB SER 51 -12.867 2.611 0.544 399 HB3 SER 51 1HB SER 51 -11.468 3.101 1.516 400 H MET 52 H MET 52 -10.342 5.318 0.928 401 HA MET 52 HA MET 52 -9.762 6.204 3.559 402 HB2 MET 52 2HB MET 52 -8.125 5.687 1.531 403 HB3 MET 52 1HB MET 52 -8.296 7.405 1.121 404 HG2 MET 52 2HG MET 52 -6.352 7.407 2.452 405 HG3 MET 52 1HG MET 52 -7.555 7.878 3.627 406 HE1 MET 52 3HE MET 52 -4.819 4.550 3.577 407 HE2 MET 52 1HE MET 52 -5.320 5.474 2.147 408 HE3 MET 52 2HE MET 52 -6.121 3.910 2.507 409 H ARG 53 H ARG 53 -10.995 8.206 1.127 410 HA ARG 53 HA ARG 53 -11.253 10.865 2.226 411 HE ARG 53 HE ARG 53 -15.952 11.780 -1.116 412 HB2 ARG 53 2HB ARG 53 -11.906 9.834 -0.039 413 HB3 ARG 53 1HB ARG 53 -13.141 8.892 0.789 414 HG2 ARG 53 2HG ARG 53 -13.430 11.813 1.306 415 HG3 ARG 53 1HG ARG 53 -13.226 11.522 -0.403 416 HD2 ARG 53 2HD ARG 53 -15.104 9.706 -0.224 417 HD3 ARG 53 1HD ARG 53 -15.384 10.217 1.421 418 HH11 ARG 53 2HH1 ARG 53 -15.644 12.083 2.337 419 HH12 ARG 53 1HH1 ARG 53 -16.315 13.776 2.341 420 HH21 ARG 53 1HH2 ARG 53 -16.556 13.717 -1.119 421 HH22 ARG 53 2HH2 ARG 53 -16.800 14.667 0.423 422 H ASP 54 H ASP 54 -12.531 7.963 3.691 423 HA ASP 54 HA ASP 54 -13.872 9.599 5.856 424 HB2 ASP 54 2HB ASP 54 -14.568 6.976 4.578 425 HB3 ASP 54 1HB ASP 54 -14.414 6.814 6.310 426 H ASP 55 H ASP 55 -12.017 6.455 6.214 427 HA ASP 55 HA ASP 55 -10.561 7.666 8.573 428 HB2 ASP 55 2HB ASP 55 -11.033 4.872 7.754 429 HB3 ASP 55 1HB ASP 55 -9.331 5.108 7.910 430 H LEU 56 H LEU 56 -8.929 9.030 8.185 431 HA LEU 56 HA LEU 56 -7.282 8.961 5.765 432 HG LEU 56 HG LEU 56 -7.468 12.539 6.664 433 HB2 LEU 56 2HB LEU 56 -6.549 10.559 8.257 434 HB3 LEU 56 1HB LEU 56 -6.053 10.834 6.627 435 HD11 LEU 56 1HD1 LEU 56 -9.744 10.503 6.239 436 HD12 LEU 56 2HD1 LEU 56 -8.706 11.157 4.954 437 HD13 LEU 56 3HD1 LEU 56 -9.776 12.230 5.862 438 HD21 LEU 56 3HD2 LEU 56 -7.894 12.317 9.097 439 HD22 LEU 56 1HD2 LEU 56 -9.267 11.218 8.769 440 HD23 LEU 56 2HD2 LEU 56 -9.313 12.922 8.225 441 HA PRO 57 HA PRO 57 -4.010 6.218 7.359 442 HB2 PRO 57 2HB PRO 57 -2.206 6.242 5.361 443 HB3 PRO 57 1HB PRO 57 -3.885 5.768 5.128 444 HG2 PRO 57 2HG PRO 57 -2.590 8.432 4.362 445 HG3 PRO 57 1HG PRO 57 -3.770 7.457 3.438 446 HD2 PRO 57 2HD PRO 57 -4.361 9.658 5.180 447 HD3 PRO 57 1HD PRO 57 -5.558 8.484 4.536 448 H GLY 58 H GLY 58 -1.864 8.815 6.198 449 HA2 GLY 58 2HA GLY 58 -0.537 8.954 8.991 450 HA3 GLY 58 1HA GLY 58 0.436 8.895 7.523 451 H SER 59 H SER 59 1.267 10.800 8.700 452 HA SER 59 HA SER 59 0.250 13.414 8.482 453 HG SER 59 HG SER 59 3.614 14.426 8.545 454 HB2 SER 59 2HB SER 59 2.522 12.628 9.261 455 HB3 SER 59 1HB SER 59 3.015 12.399 7.577 456 H ALA 60 H ALA 60 0.649 11.396 5.609 457 HA ALA 60 HA ALA 60 -0.897 13.492 4.170 458 HB1 ALA 60 3HB ALA 60 1.955 12.811 3.215 459 HB2 ALA 60 1HB ALA 60 1.240 14.382 3.600 460 HB3 ALA 60 2HB ALA 60 0.751 13.532 2.123 461 H GLN 61 H GLN 61 -1.615 13.085 2.055 462 HA GLN 61 HA GLN 61 -2.258 10.144 1.448 463 HB2 GLN 61 2HB GLN 61 -3.999 12.001 2.704 464 HB3 GLN 61 1HB GLN 61 -4.436 12.217 1.030 465 HG2 GLN 61 2HG GLN 61 -4.983 9.797 0.785 466 HG3 GLN 61 1HG GLN 61 -4.390 9.459 2.386 467 HE21 GLN 61 1HE2 GLN 61 -5.590 11.115 4.089 468 HE22 GLN 61 2HE2 GLN 61 -7.385 10.750 3.934 469 H ILE 62 H ILE 62 -1.155 9.873 -0.413 470 HA ILE 62 HA ILE 62 -1.277 11.937 -2.679 471 HB ILE 62 HB ILE 62 0.637 9.664 -1.947 472 HG12 ILE 62 2HG1 ILE 62 1.465 12.530 -2.314 473 HG13 ILE 62 1HG1 ILE 62 0.749 12.035 -0.782 474 HG21 ILE 62 1HG2 ILE 62 0.847 9.426 -4.280 475 HG22 ILE 62 2HG2 ILE 62 2.089 10.629 -3.961 476 HG23 ILE 62 3HG2 ILE 62 0.494 11.152 -4.603 477 HD11 ILE 62 3HD1 ILE 62 2.631 10.315 -0.531 478 HD12 ILE 62 1HD1 ILE 62 3.174 11.996 -0.604 479 HD13 ILE 62 2HD1 ILE 62 3.366 10.975 -2.029 480 H VAL 63 H VAL 63 -2.994 11.444 -4.126 481 HA VAL 63 HA VAL 63 -3.318 8.584 -4.978 482 HB VAL 63 HB VAL 63 -4.814 11.020 -5.909 483 HG11 VAL 63 1HG1 VAL 63 -5.226 8.070 -6.762 484 HG12 VAL 63 2HG1 VAL 63 -4.719 9.370 -7.842 485 HG13 VAL 63 3HG1 VAL 63 -6.351 9.403 -7.153 486 HG21 VAL 63 3HG2 VAL 63 -5.347 10.159 -3.626 487 HG22 VAL 63 1HG2 VAL 63 -5.569 8.513 -4.249 488 HG23 VAL 63 2HG2 VAL 63 -6.719 9.813 -4.691 489 H MET 64 H MET 64 -1.917 7.633 -6.154 490 HA MET 64 HA MET 64 -0.667 8.804 -8.629 491 HB2 MET 64 2HB MET 64 -0.609 6.099 -7.157 492 HB3 MET 64 1HB MET 64 -0.271 6.109 -8.858 493 HG2 MET 64 2HG MET 64 1.332 8.317 -7.888 494 HG3 MET 64 1HG MET 64 1.464 7.082 -6.653 495 HE1 MET 64 3HE MET 64 0.949 6.749 -10.764 496 HE2 MET 64 1HE MET 64 2.692 6.914 -11.123 497 HE3 MET 64 2HE MET 64 1.828 8.237 -10.293 498 H SER 65 H SER 65 -2.221 9.557 -9.816 499 HA SER 65 HA SER 65 -3.394 7.648 -11.712 500 HG SER 65 HG SER 65 -4.981 9.941 -9.495 501 HB2 SER 65 2HB SER 65 -5.809 8.212 -11.612 502 HB3 SER 65 1HB SER 65 -5.306 7.669 -10.034 503 H ARG 66 H ARG 66 -4.726 8.944 -13.451 504 HA ARG 66 HA ARG 66 -3.056 11.384 -14.275 505 HE ARG 66 HE ARG 66 -7.862 9.201 -16.926 506 HB2 ARG 66 2HB ARG 66 -3.823 11.051 -16.498 507 HB3 ARG 66 1HB ARG 66 -3.209 9.550 -15.886 508 HG2 ARG 66 2HG ARG 66 -5.231 8.418 -16.113 509 HG3 ARG 66 1HG ARG 66 -6.147 9.741 -15.408 510 HD2 ARG 66 2HD ARG 66 -5.539 10.892 -17.867 511 HD3 ARG 66 1HD ARG 66 -5.430 9.188 -18.340 512 HH11 ARG 66 2HH1 ARG 66 -6.794 11.277 -19.466 513 HH12 ARG 66 1HH1 ARG 66 -8.444 12.033 -19.665 514 HH21 ARG 66 1HH2 ARG 66 -9.708 10.101 -17.103 515 HH22 ARG 66 2HH2 ARG 66 -10.022 11.376 -18.366 516 H SER 67 H SER 67 -5.310 11.551 -12.212 517 HA SER 67 HA SER 67 -7.165 13.572 -13.519 518 HG SER 67 HG SER 67 -9.199 13.487 -12.408 519 HB2 SER 67 2HB SER 67 -7.935 11.433 -12.335 520 HB3 SER 67 1HB SER 67 -7.286 12.066 -10.824 521 H GLU 68 H GLU 68 -7.796 14.596 -10.738 522 HA GLU 68 HA GLU 68 -5.745 16.878 -10.669 523 HB2 GLU 68 2HB GLU 68 -8.829 16.919 -10.698 524 HB3 GLU 68 1HB GLU 68 -8.006 18.177 -9.841 525 HG2 GLU 68 2HG GLU 68 -7.396 17.591 -12.799 526 HG3 GLU 68 1HG GLU 68 -8.591 18.748 -12.242 527 H ARG 69 H ARG 69 -5.958 18.140 -8.607 528 HA ARG 69 HA ARG 69 -5.830 16.173 -6.246 529 HE ARG 69 HE ARG 69 -2.112 20.927 -7.305 530 HB2 ARG 69 2HB ARG 69 -3.950 17.247 -5.335 531 HB3 ARG 69 1HB ARG 69 -3.562 16.728 -6.940 532 HG2 ARG 69 2HG ARG 69 -4.385 19.670 -6.392 533 HG3 ARG 69 1HG ARG 69 -2.787 19.103 -5.895 534 HD2 ARG 69 2HD ARG 69 -2.418 18.253 -8.323 535 HD3 ARG 69 1HD ARG 69 -3.935 19.090 -8.763 536 HH11 ARG 69 2HH1 ARG 69 -2.614 19.564 -10.462 537 HH12 ARG 69 1HH1 ARG 69 -1.414 20.699 -11.219 538 HH21 ARG 69 1HH2 ARG 69 -0.789 22.223 -8.203 539 HH22 ARG 69 2HH2 ARG 69 -0.442 22.143 -9.991 540 H SER 70 H SER 70 -5.723 17.339 -4.109 541 HA SER 70 HA SER 70 -6.868 18.404 -2.378 542 HG SER 70 HG SER 70 -5.836 20.445 -2.348 543 HB2 SER 70 2HB SER 70 -7.843 20.465 -4.407 544 HB3 SER 70 1HB SER 70 -8.162 20.535 -2.679 545 H PHE 71 H PHE 71 -7.879 16.345 -2.356 546 HA PHE 71 HA PHE 71 -10.680 16.122 -3.449 547 HD1 PHE 71 HD2 PHE 71 -10.451 13.946 -5.473 548 HD2 PHE 71 HD1 PHE 71 -6.937 13.768 -2.990 549 HE1 PHE 71 HE2 PHE 71 -9.175 12.899 -7.319 550 HE2 PHE 71 HE1 PHE 71 -5.732 12.680 -4.823 551 HZ PHE 71 HZ PHE 71 -6.811 12.278 -6.982 552 HB2 PHE 71 2HB PHE 71 -9.068 14.043 -1.952 553 HB3 PHE 71 1HB PHE 71 -10.516 13.740 -2.848 554 H SER 72 H SER 72 -9.424 16.044 -0.052 555 HA SER 72 HA SER 72 -12.115 16.407 1.015 556 HG SER 72 HG SER 72 -13.588 15.117 1.505 557 HB2 SER 72 2HB SER 72 -11.343 13.534 0.774 558 HB3 SER 72 1HB SER 72 -11.729 13.961 2.420 559 H VAL 73 H VAL 73 -9.116 14.988 2.446 560 HA VAL 73 HA VAL 73 -9.345 17.013 4.713 561 HB VAL 73 HB VAL 73 -8.747 14.759 5.397 562 HG11 VAL 73 1HG1 VAL 73 -7.401 13.776 3.619 563 HG12 VAL 73 2HG1 VAL 73 -6.388 13.842 5.062 564 HG13 VAL 73 3HG1 VAL 73 -6.142 15.038 3.766 565 HG21 VAL 73 3HG2 VAL 73 -6.979 15.297 6.969 566 HG22 VAL 73 1HG2 VAL 73 -7.885 16.802 6.725 567 HG23 VAL 73 2HG2 VAL 73 -6.320 16.579 5.945 568 H ASP 74 H ASP 74 -7.524 18.435 5.195 569 HA ASP 74 HA ASP 74 -6.491 19.949 2.936 570 HB2 ASP 74 2HB ASP 74 -5.200 21.208 4.653 571 HB3 ASP 74 1HB ASP 74 -6.938 21.198 4.806 572 H THR 75 H THR 75 -4.567 17.754 5.161 573 HA THR 75 HA THR 75 -2.407 17.546 3.164 574 HB THR 75 HB THR 75 -2.102 17.160 5.611 575 HG1 THR 75 HG1 THR 75 -0.540 15.492 5.149 576 HG21 THR 75 3HG2 THR 75 -3.006 14.241 5.052 577 HG22 THR 75 1HG2 THR 75 -3.888 15.376 6.089 578 HG23 THR 75 2HG2 THR 75 -2.255 14.857 6.527 579 H ALA 76 H ALA 76 -4.785 17.006 1.721 580 HA ALA 76 HA ALA 76 -4.096 14.250 0.585 581 HB1 ALA 76 3HB ALA 76 -6.525 13.960 -0.097 582 HB2 ALA 76 1HB ALA 76 -6.918 15.392 0.908 583 HB3 ALA 76 2HB ALA 76 -6.194 13.939 1.648 584 H HIS 77 H HIS 77 -3.446 14.151 -1.293 585 HA HIS 77 HA HIS 77 -3.641 16.486 -3.289 586 HD1 HIS 77 HD1 HIS 77 -0.753 15.821 0.306 587 HD2 HIS 77 HD2 HIS 77 -2.064 18.907 -2.345 588 HE1 HIS 77 HE1 HIS 77 -0.470 18.105 1.419 589 HB2 HIS 77 2HB HIS 77 -1.167 15.045 -2.167 590 HB3 HIS 77 1HB HIS 77 -1.110 16.341 -3.371 591 H ARG 78 H ARG 78 -1.793 15.518 -5.243 592 HA ARG 78 HA ARG 78 -2.352 12.728 -5.850 593 HE ARG 78 HE ARG 78 -3.459 12.902 -11.782 594 HB2 ARG 78 2HB ARG 78 -4.104 12.542 -7.081 595 HB3 ARG 78 1HB ARG 78 -4.537 14.149 -6.699 596 HG2 ARG 78 2HG ARG 78 -4.937 13.802 -9.017 597 HG3 ARG 78 1HG ARG 78 -3.606 14.927 -8.913 598 HD2 ARG 78 2HD ARG 78 -2.083 12.650 -9.242 599 HD3 ARG 78 1HD ARG 78 -3.572 11.900 -9.643 600 HH11 ARG 78 2HH1 ARG 78 -1.282 14.704 -9.756 601 HH12 ARG 78 1HH1 ARG 78 -0.428 15.348 -11.228 602 HH21 ARG 78 1HH2 ARG 78 -2.725 13.905 -13.306 603 HH22 ARG 78 2HH2 ARG 78 -1.259 14.996 -13.125 604 H ALA 79 H ALA 79 -0.634 11.921 -6.622 605 HA ALA 79 HA ALA 79 1.532 13.394 -8.103 606 HB1 ALA 79 3HB ALA 79 1.018 10.423 -7.290 607 HB2 ALA 79 1HB ALA 79 1.920 11.634 -6.335 608 HB3 ALA 79 2HB ALA 79 2.549 11.058 -7.898 609 H ALA 80 H ALA 80 1.902 13.355 -10.285 610 HA ALA 80 HA ALA 80 0.305 11.615 -12.210 611 HB1 ALA 80 3HB ALA 80 2.186 13.978 -12.461 612 HB2 ALA 80 1HB ALA 80 0.617 13.687 -13.211 613 HB3 ALA 80 2HB ALA 80 2.084 12.910 -13.849 614 H SER 81 H SER 81 3.630 11.426 -10.961 615 HA SER 81 HA SER 81 3.872 8.671 -12.312 616 HG SER 81 HG SER 81 7.273 9.471 -13.304 617 HB2 SER 81 2HB SER 81 5.043 10.491 -13.627 618 HB3 SER 81 1HB SER 81 6.018 10.921 -12.209 619 H VAL 82 H VAL 82 6.295 7.941 -11.305 620 HA VAL 82 HA VAL 82 5.921 7.632 -8.284 621 HB VAL 82 HB VAL 82 8.023 6.315 -10.098 622 HG11 VAL 82 1HG1 VAL 82 9.256 6.530 -8.087 623 HG12 VAL 82 2HG1 VAL 82 8.429 5.003 -7.790 624 HG13 VAL 82 3HG1 VAL 82 7.823 6.494 -7.049 625 HG21 VAL 82 3HG2 VAL 82 6.739 4.182 -9.012 626 HG22 VAL 82 1HG2 VAL 82 6.126 4.987 -10.462 627 HG23 VAL 82 2HG2 VAL 82 5.399 5.317 -8.869 628 H GLU 83 H GLU 83 8.465 8.974 -10.505 629 HA GLU 83 HA GLU 83 9.866 10.663 -8.670 630 HB2 GLU 83 2HB GLU 83 8.998 11.204 -11.568 631 HB3 GLU 83 1HB GLU 83 10.199 12.130 -10.712 632 HG2 GLU 83 2HG GLU 83 11.888 10.486 -10.912 633 HG3 GLU 83 1HG GLU 83 10.785 9.140 -10.860 634 H GLU 84 H GLU 84 6.667 11.612 -10.202 635 HA GLU 84 HA GLU 84 6.477 14.083 -8.536 636 HB2 GLU 84 2HB GLU 84 4.186 12.532 -9.856 637 HB3 GLU 84 1HB GLU 84 4.064 14.129 -9.169 638 HG2 GLU 84 2HG GLU 84 6.099 14.423 -11.209 639 HG3 GLU 84 1HG GLU 84 4.908 13.362 -11.903 640 H ALA 85 H ALA 85 5.834 10.847 -7.710 641 HA ALA 85 HA ALA 85 4.083 11.542 -5.324 642 HB1 ALA 85 3HB ALA 85 3.574 9.381 -6.634 643 HB2 ALA 85 1HB ALA 85 3.921 9.131 -4.908 644 HB3 ALA 85 2HB ALA 85 5.162 8.769 -6.113 645 H VAL 86 H VAL 86 7.452 10.621 -6.036 646 HA VAL 86 HA VAL 86 8.226 10.611 -3.119 647 HB VAL 86 HB VAL 86 9.737 10.125 -5.724 648 HG11 VAL 86 1HG1 VAL 86 11.352 11.484 -4.441 649 HG12 VAL 86 2HG1 VAL 86 11.856 9.786 -4.441 650 HG13 VAL 86 3HG1 VAL 86 11.100 10.490 -2.979 651 HG21 VAL 86 3HG2 VAL 86 8.509 8.165 -4.582 652 HG22 VAL 86 1HG2 VAL 86 9.487 8.440 -3.123 653 HG23 VAL 86 2HG2 VAL 86 10.264 7.916 -4.632 654 H ASP 87 H ASP 87 8.790 12.965 -5.854 655 HA ASP 87 HA ASP 87 9.766 15.062 -4.170 656 HB2 ASP 87 2HB ASP 87 8.512 14.940 -6.949 657 HB3 ASP 87 1HB ASP 87 8.534 16.502 -6.179 658 H ILE 88 H ILE 88 6.233 14.346 -4.642 659 HA ILE 88 HA ILE 88 5.658 16.728 -2.899 660 HB ILE 88 HB ILE 88 3.536 16.659 -2.742 661 HG12 ILE 88 2HG1 ILE 88 3.020 13.926 -4.024 662 HG13 ILE 88 1HG1 ILE 88 3.139 14.188 -2.297 663 HG21 ILE 88 1HG2 ILE 88 2.653 16.922 -5.001 664 HG22 ILE 88 2HG2 ILE 88 3.833 15.767 -5.669 665 HG23 ILE 88 3HG2 ILE 88 4.383 17.339 -5.065 666 HD11 ILE 88 3HD1 ILE 88 0.920 15.248 -4.093 667 HD12 ILE 88 1HD1 ILE 88 1.333 16.143 -2.612 668 HD13 ILE 88 2HD1 ILE 88 0.849 14.459 -2.503 669 H ALA 89 H ALA 89 6.060 13.301 -2.165 670 HA ALA 89 HA ALA 89 5.291 13.555 0.704 671 HB1 ALA 89 3HB ALA 89 7.061 11.531 -0.805 672 HB2 ALA 89 1HB ALA 89 5.386 11.318 -0.240 673 HB3 ALA 89 2HB ALA 89 6.699 11.440 0.939 674 H ALA 90 H ALA 90 8.563 13.728 -0.833 675 HA ALA 90 HA ALA 90 9.893 14.682 1.625 676 HB1 ALA 90 3HB ALA 90 11.779 15.147 -0.068 677 HB2 ALA 90 1HB ALA 90 10.647 14.723 -1.369 678 HB3 ALA 90 2HB ALA 90 11.086 13.512 -0.140 679 H SER 91 H SER 91 8.101 16.529 -0.732 680 HA SER 91 HA SER 91 9.086 19.215 0.232 681 HG SER 91 HG SER 91 7.062 20.593 -0.453 682 HB2 SER 91 2HB SER 91 8.364 18.771 -2.147 683 HB3 SER 91 1HB SER 91 6.736 18.389 -1.575 684 H LEU 92 H LEU 92 6.849 17.073 1.675 685 HA LEU 92 HA LEU 92 5.243 19.367 2.873 686 HG LEU 92 HG LEU 92 4.808 15.957 1.604 687 HB2 LEU 92 2HB LEU 92 3.556 17.754 3.747 688 HB3 LEU 92 1HB LEU 92 3.576 18.267 2.094 689 HD11 LEU 92 1HD1 LEU 92 3.368 15.278 4.243 690 HD12 LEU 92 2HD1 LEU 92 5.124 15.201 3.929 691 HD13 LEU 92 3HD1 LEU 92 4.041 14.123 3.059 692 HD21 LEU 92 3HD2 LEU 92 2.533 16.602 0.707 693 HD22 LEU 92 1HD2 LEU 92 1.780 16.085 2.233 694 HD23 LEU 92 2HD2 LEU 92 2.594 14.902 1.180 695 H ASP 93 H ASP 93 6.521 16.334 4.300 696 HA ASP 93 HA ASP 93 8.759 17.563 5.420 697 HB2 ASP 93 2HB ASP 93 6.491 17.927 7.414 698 HB3 ASP 93 1HB ASP 93 7.948 17.263 8.081 699 H ALA 94 H ALA 94 9.553 15.488 4.620 700 HA ALA 94 HA ALA 94 9.350 13.169 6.471 701 HB1 ALA 94 3HB ALA 94 7.084 13.033 5.396 702 HB2 ALA 94 1HB ALA 94 8.060 11.631 4.928 703 HB3 ALA 94 2HB ALA 94 7.829 12.974 3.778 704 H GLU 95 H GLU 95 10.403 11.217 5.830 705 HA GLU 95 HA GLU 95 12.601 11.595 3.735 706 HB2 GLU 95 2HB GLU 95 13.237 9.742 6.013 707 HB3 GLU 95 1HB GLU 95 14.272 10.632 4.922 708 HG2 GLU 95 2HG GLU 95 13.732 12.794 6.237 709 HG3 GLU 95 1HG GLU 95 12.803 11.807 7.358 710 H THR 96 H THR 96 11.316 8.683 5.460 711 HA THR 96 HA THR 96 10.947 7.122 2.911 712 HB THR 96 HB THR 96 9.749 5.391 4.361 713 HG1 THR 96 HG1 THR 96 9.323 6.886 6.312 714 HG21 THR 96 3HG2 THR 96 11.678 4.500 5.476 715 HG22 THR 96 1HG2 THR 96 12.532 6.040 5.325 716 HG23 THR 96 2HG2 THR 96 12.143 5.086 3.847 717 H ALA 97 H ALA 97 8.873 6.061 2.445 718 HA ALA 97 HA ALA 97 6.412 7.204 3.591 719 HB1 ALA 97 3HB ALA 97 6.721 8.910 1.868 720 HB2 ALA 97 1HB ALA 97 5.374 7.907 1.300 721 HB3 ALA 97 2HB ALA 97 6.997 7.720 0.576 722 H TYR 98 H TYR 98 4.404 6.139 2.565 723 HA TYR 98 HA TYR 98 4.954 3.203 1.924 724 HD1 TYR 98 HD1 TYR 98 4.979 1.046 4.160 725 HD2 TYR 98 HD2 TYR 98 4.899 5.086 5.547 726 HE1 TYR 98 HE1 TYR 98 6.880 0.572 5.657 727 HE2 TYR 98 HE2 TYR 98 6.712 4.566 7.145 728 HH TYR 98 HH TYR 98 8.299 3.121 7.663 729 HB2 TYR 98 2HB TYR 98 3.054 4.224 4.136 730 HB3 TYR 98 1HB TYR 98 3.103 2.560 3.582 731 H VAL 99 H VAL 99 2.785 2.023 1.456 732 HA VAL 99 HA VAL 99 0.927 3.719 -0.277 733 HB VAL 99 HB VAL 99 1.753 3.239 -2.221 734 HG11 VAL 99 1HG1 VAL 99 4.002 3.235 -1.334 735 HG12 VAL 99 2HG1 VAL 99 3.828 2.338 -2.838 736 HG13 VAL 99 3HG1 VAL 99 4.026 1.498 -1.288 737 HG21 VAL 99 3HG2 VAL 99 0.299 1.423 -2.610 738 HG22 VAL 99 1HG2 VAL 99 1.466 0.271 -1.962 739 HG23 VAL 99 2HG2 VAL 99 1.838 1.130 -3.467 740 H ILE 100 H ILE 100 -1.121 3.144 0.724 741 HA ILE 100 HA ILE 100 -1.689 0.393 1.315 742 HB ILE 100 HB ILE 100 -4.025 2.178 0.556 743 HG12 ILE 100 2HG1 ILE 100 -3.113 3.490 2.249 744 HG13 ILE 100 1HG1 ILE 100 -4.252 2.486 3.097 745 HG21 ILE 100 1HG2 ILE 100 -4.505 -0.368 0.876 746 HG22 ILE 100 2HG2 ILE 100 -5.362 0.726 1.977 747 HG23 ILE 100 3HG2 ILE 100 -3.930 -0.161 2.541 748 HD11 ILE 100 3HD1 ILE 100 -1.990 2.782 4.333 749 HD12 ILE 100 1HD1 ILE 100 -1.240 1.757 3.093 750 HD13 ILE 100 2HD1 ILE 100 -2.547 1.072 4.077 751 H GLY 101 H GLY 101 -2.723 1.841 -1.589 752 HA2 GLY 101 2HA GLY 101 -2.672 1.012 -3.820 753 HA3 GLY 101 1HA GLY 101 -1.451 -0.054 -3.228 754 H GLY 102 H GLY 102 -3.275 -2.594 -4.660 755 HA2 GLY 102 2HA GLY 102 -4.728 -0.345 -5.415 756 HA3 GLY 102 1HA GLY 102 -3.196 -0.045 -6.115 757 H ALA 103 H ALA 103 -6.070 -1.704 -6.783 758 HA ALA 103 HA ALA 103 -5.835 -2.917 -9.128 759 HB1 ALA 103 3HB ALA 103 -7.179 -0.069 -9.107 760 HB2 ALA 103 1HB ALA 103 -7.858 -1.436 -8.292 761 HB3 ALA 103 2HB ALA 103 -7.693 -1.451 -10.022 762 H ALA 104 H ALA 104 -4.637 0.374 -9.153 763 HA ALA 104 HA ALA 104 -2.857 -0.320 -11.541 764 HB1 ALA 104 3HB ALA 104 -2.530 2.069 -12.008 765 HB2 ALA 104 1HB ALA 104 -3.664 2.515 -10.704 766 HB3 ALA 104 2HB ALA 104 -4.253 1.622 -12.145 767 H ILE 105 H ILE 105 -2.779 0.309 -8.089 768 HA ILE 105 HA ILE 105 -0.264 1.902 -8.255 769 HB ILE 105 HB ILE 105 -1.379 1.113 -5.606 770 HG12 ILE 105 2HG1 ILE 105 -3.398 2.089 -6.516 771 HG13 ILE 105 1HG1 ILE 105 -2.626 3.246 -5.526 772 HG21 ILE 105 1HG2 ILE 105 0.861 2.266 -5.596 773 HG22 ILE 105 2HG2 ILE 105 -0.409 3.168 -4.776 774 HG23 ILE 105 3HG2 ILE 105 0.133 3.672 -6.390 775 HD11 ILE 105 3HD1 ILE 105 -1.687 3.687 -8.322 776 HD12 ILE 105 1HD1 ILE 105 -2.766 4.731 -7.354 777 HD13 ILE 105 2HD1 ILE 105 -3.451 3.392 -8.328 778 H TYR 106 H TYR 106 -0.689 -1.063 -6.148 779 HA TYR 106 HA TYR 106 2.137 -1.766 -6.077 780 HD1 TYR 106 HD1 TYR 106 2.800 -4.687 -4.797 781 HD2 TYR 106 HD2 TYR 106 -0.508 -2.354 -3.315 782 HE1 TYR 106 HE1 TYR 106 3.413 -5.232 -2.496 783 HE2 TYR 106 HE2 TYR 106 0.114 -2.938 -1.017 784 HH TYR 106 HH TYR 106 2.770 -3.999 0.025 785 HB2 TYR 106 2HB TYR 106 -0.485 -3.282 -5.687 786 HB3 TYR 106 1HB TYR 106 0.860 -4.247 -6.169 787 H ALA 107 H ALA 107 -0.135 -2.332 -8.743 788 HA ALA 107 HA ALA 107 1.687 -3.995 -10.400 789 HB1 ALA 107 3HB ALA 107 -0.806 -4.060 -10.648 790 HB2 ALA 107 1HB ALA 107 -0.093 -3.502 -12.167 791 HB3 ALA 107 2HB ALA 107 -0.839 -2.339 -11.058 792 H LEU 108 H LEU 108 1.187 -0.462 -10.269 793 HA LEU 108 HA LEU 108 3.335 -0.086 -12.386 794 HG LEU 108 HG LEU 108 2.195 2.395 -9.814 795 HB2 LEU 108 2HB LEU 108 2.678 1.983 -12.785 796 HB3 LEU 108 1HB LEU 108 1.166 1.379 -12.219 797 HD11 LEU 108 1HD1 LEU 108 3.175 4.414 -11.953 798 HD12 LEU 108 2HD1 LEU 108 4.273 3.273 -11.159 799 HD13 LEU 108 3HD1 LEU 108 3.400 4.474 -10.204 800 HD21 LEU 108 3HD2 LEU 108 -0.056 2.960 -10.601 801 HD22 LEU 108 1HD2 LEU 108 0.635 3.942 -11.948 802 HD23 LEU 108 2HD2 LEU 108 0.832 4.456 -10.261 803 H PHE 109 H PHE 109 2.990 0.445 -8.887 804 HA PHE 109 HA PHE 109 5.685 1.554 -8.563 805 HD1 PHE 109 HD2 PHE 109 6.770 2.418 -6.108 806 HD2 PHE 109 HD1 PHE 109 2.596 3.074 -6.882 807 HE1 PHE 109 HE2 PHE 109 7.081 4.802 -5.736 808 HE2 PHE 109 HE1 PHE 109 2.928 5.489 -6.486 809 HZ PHE 109 HZ PHE 109 5.189 6.365 -5.964 810 HB2 PHE 109 2HB PHE 109 3.424 0.772 -6.661 811 HB3 PHE 109 1HB PHE 109 4.978 0.524 -5.982 812 H GLN 110 H GLN 110 4.763 -1.802 -8.599 813 HA GLN 110 HA GLN 110 6.590 -3.075 -7.023 814 HB2 GLN 110 2HB GLN 110 6.496 -5.049 -8.477 815 HB3 GLN 110 1HB GLN 110 4.997 -4.319 -8.034 816 HG2 GLN 110 2HG GLN 110 4.820 -3.255 -10.347 817 HG3 GLN 110 1HG GLN 110 6.261 -4.139 -10.839 818 HE21 GLN 110 1HE2 GLN 110 5.081 -5.219 -12.425 819 HE22 GLN 110 2HE2 GLN 110 4.026 -6.635 -11.883 820 HA PRO 111 HA PRO 111 10.836 -2.932 -9.205 821 HB2 PRO 111 2HB PRO 111 10.908 -0.870 -11.315 822 HB3 PRO 111 1HB PRO 111 11.198 -2.613 -11.445 823 HG2 PRO 111 2HG PRO 111 8.965 -1.387 -12.606 824 HG3 PRO 111 1HG PRO 111 8.990 -3.082 -12.060 825 HD2 PRO 111 2HD PRO 111 7.968 -0.646 -10.468 826 HD3 PRO 111 1HD PRO 111 7.096 -2.143 -10.807 827 H HIS 112 H HIS 112 9.017 -0.314 -8.197 828 HA HIS 112 HA HIS 112 11.411 1.547 -7.657 829 HD1 HIS 112 HD1 HIS 112 11.378 3.551 -10.069 830 HD2 HIS 112 HD2 HIS 112 7.449 1.885 -10.158 831 HE1 HIS 112 HE1 HIS 112 10.389 3.702 -12.467 832 HB2 HIS 112 2HB HIS 112 8.462 2.390 -7.747 833 HB3 HIS 112 1HB HIS 112 9.889 3.407 -7.695 834 H LEU 113 H LEU 113 9.047 -0.374 -5.906 835 HA LEU 113 HA LEU 113 9.086 1.160 -3.378 836 HG LEU 113 HG LEU 113 6.476 -1.200 -2.449 837 HB2 LEU 113 2HB LEU 113 8.680 -1.888 -3.890 838 HB3 LEU 113 1HB LEU 113 8.595 -1.181 -2.295 839 HD11 LEU 113 1HD1 LEU 113 5.313 0.802 -3.468 840 HD12 LEU 113 2HD1 LEU 113 6.803 1.168 -4.357 841 HD13 LEU 113 3HD1 LEU 113 6.788 1.252 -2.589 842 HD21 LEU 113 3HD2 LEU 113 6.499 -2.672 -4.421 843 HD22 LEU 113 1HD2 LEU 113 6.587 -1.283 -5.510 844 HD23 LEU 113 2HD2 LEU 113 5.124 -1.552 -4.511 845 H ASP 114 H ASP 114 10.527 1.217 -1.679 846 HA ASP 114 HA ASP 114 13.060 -0.334 -1.444 847 HB2 ASP 114 2HB ASP 114 12.740 1.788 -0.251 848 HB3 ASP 114 1HB ASP 114 11.338 1.191 0.596 849 H ARG 115 H ARG 115 9.913 -0.874 0.268 850 HA ARG 115 HA ARG 115 10.362 -3.872 -0.141 851 HE ARG 115 HE ARG 115 13.879 -3.801 3.080 852 HB2 ARG 115 2HB ARG 115 9.758 -2.339 2.469 853 HB3 ARG 115 1HB ARG 115 9.369 -4.050 2.337 854 HG2 ARG 115 2HG ARG 115 11.561 -4.751 2.421 855 HG3 ARG 115 1HG ARG 115 12.196 -3.348 1.550 856 HD2 ARG 115 2HD ARG 115 11.864 -1.895 3.608 857 HD3 ARG 115 1HD ARG 115 11.257 -3.322 4.475 858 HH11 ARG 115 2HH1 ARG 115 12.595 -2.635 5.977 859 HH12 ARG 115 1HH1 ARG 115 13.604 -3.800 6.969 860 HH21 ARG 115 1HH2 ARG 115 14.891 -5.102 4.254 861 HH22 ARG 115 2HH2 ARG 115 14.967 -4.934 6.004 862 H MET 116 H MET 116 8.605 -5.258 0.031 863 HA MET 116 HA MET 116 5.802 -4.058 -0.499 864 HB2 MET 116 2HB MET 116 7.096 -6.581 -1.639 865 HB3 MET 116 1HB MET 116 5.362 -6.363 -1.614 866 HG2 MET 116 2HG MET 116 5.527 -4.500 -3.216 867 HG3 MET 116 1HG MET 116 7.254 -4.291 -2.898 868 HE1 MET 116 3HE MET 116 4.791 -5.872 -5.353 869 HE2 MET 116 1HE MET 116 4.615 -7.036 -3.993 870 HE3 MET 116 2HE MET 116 5.355 -7.557 -5.535 871 H VAL 117 H VAL 117 5.392 -3.837 1.638 872 HA VAL 117 HA VAL 117 5.172 -6.162 3.557 873 HB VAL 117 HB VAL 117 4.668 -3.168 3.742 874 HG11 VAL 117 1HG1 VAL 117 3.085 -4.214 5.412 875 HG12 VAL 117 2HG1 VAL 117 4.415 -3.447 6.255 876 HG13 VAL 117 3HG1 VAL 117 4.404 -5.217 6.039 877 HG21 VAL 117 3HG2 VAL 117 6.672 -3.201 5.289 878 HG22 VAL 117 1HG2 VAL 117 7.099 -3.900 3.711 879 HG23 VAL 117 2HG2 VAL 117 6.797 -4.958 5.099 880 H LEU 118 H LEU 118 3.823 -7.266 1.934 881 HA LEU 118 HA LEU 118 0.887 -6.744 1.769 882 HG LEU 118 HG LEU 118 -0.236 -9.103 0.807 883 HB2 LEU 118 2HB LEU 118 2.005 -7.889 0.002 884 HB3 LEU 118 1HB LEU 118 2.817 -9.028 1.047 885 HD11 LEU 118 1HD1 LEU 118 0.265 -10.989 -0.992 886 HD12 LEU 118 2HD1 LEU 118 1.831 -10.183 -1.235 887 HD13 LEU 118 3HD1 LEU 118 0.297 -9.312 -1.507 888 HD21 LEU 118 3HD2 LEU 118 1.832 -11.359 1.216 889 HD22 LEU 118 1HD2 LEU 118 0.066 -11.489 1.360 890 HD23 LEU 118 2HD2 LEU 118 0.992 -10.579 2.558 891 H SER 119 H SER 119 -0.817 -7.662 2.845 892 HA SER 119 HA SER 119 -0.291 -9.439 5.332 893 HG SER 119 HG SER 119 -0.636 -7.899 7.140 894 HB2 SER 119 2HB SER 119 -2.146 -7.042 4.898 895 HB3 SER 119 1HB SER 119 -2.584 -8.240 6.082 896 H ARG 120 H ARG 120 -0.936 -11.475 4.997 897 HA ARG 120 HA ARG 120 -2.915 -12.129 2.821 898 HE ARG 120 HE ARG 120 1.544 -14.699 1.397 899 HB2 ARG 120 2HB ARG 120 -1.990 -14.594 3.887 900 HB3 ARG 120 1HB ARG 120 -1.688 -13.854 2.338 901 HG2 ARG 120 2HG ARG 120 0.432 -12.783 3.250 902 HG3 ARG 120 1HG ARG 120 0.074 -13.488 4.817 903 HD2 ARG 120 2HD ARG 120 1.819 -14.750 3.779 904 HD3 ARG 120 1HD ARG 120 0.452 -15.775 4.031 905 HH11 ARG 120 2HH1 ARG 120 -0.979 -16.536 2.866 906 HH12 ARG 120 1HH1 ARG 120 -1.447 -17.378 1.313 907 HH21 ARG 120 1HH2 ARG 120 1.034 -15.649 -0.360 908 HH22 ARG 120 2HH2 ARG 120 -0.315 -16.877 -0.455 909 H VAL 121 H VAL 121 -4.988 -11.973 3.427 910 HA VAL 121 HA VAL 121 -5.891 -12.789 6.201 911 HB VAL 121 HB VAL 121 -7.506 -11.119 4.255 912 HG11 VAL 121 1HG1 VAL 121 -8.545 -10.163 6.310 913 HG12 VAL 121 2HG1 VAL 121 -7.527 -11.142 7.354 914 HG13 VAL 121 3HG1 VAL 121 -8.748 -11.912 6.311 915 HG21 VAL 121 3HG2 VAL 121 -6.573 -9.078 5.733 916 HG22 VAL 121 1HG2 VAL 121 -5.729 -9.652 4.300 917 HG23 VAL 121 2HG2 VAL 121 -5.135 -10.108 5.884 918 HA PRO 122 HA PRO 122 -8.235 -16.180 4.046 919 HB2 PRO 122 2HB PRO 122 -8.853 -17.018 6.921 920 HB3 PRO 122 1HB PRO 122 -8.266 -18.006 5.571 921 HG2 PRO 122 2HG PRO 122 -6.498 -17.251 7.487 922 HG3 PRO 122 1HG PRO 122 -5.999 -17.087 5.782 923 HD2 PRO 122 2HD PRO 122 -7.166 -14.896 7.574 924 HD3 PRO 122 1HD PRO 122 -5.651 -14.881 6.608 925 H GLY 123 H GLY 123 -10.362 -17.351 4.394 926 HA2 GLY 123 2HA GLY 123 -12.867 -16.971 4.920 927 HA3 GLY 123 1HA GLY 123 -12.651 -15.273 4.622 928 H GLU 124 H GLU 124 -10.903 -16.269 2.250 929 HA GLU 124 HA GLU 124 -11.052 -16.799 -0.036 930 HB2 GLU 124 2HB GLU 124 -13.050 -18.755 1.130 931 HB3 GLU 124 1HB GLU 124 -12.445 -18.878 -0.498 932 HG2 GLU 124 2HG GLU 124 -10.284 -19.578 0.144 933 HG3 GLU 124 1HG GLU 124 -10.296 -18.679 1.644 934 H TYR 125 H TYR 125 -11.587 -14.922 -1.052 935 HA TYR 125 HA TYR 125 -14.538 -14.427 -1.743 936 HD1 TYR 125 HD2 TYR 125 -15.270 -13.486 0.777 937 HD2 TYR 125 HD1 TYR 125 -11.361 -11.733 0.403 938 HE1 TYR 125 HE2 TYR 125 -14.997 -13.503 3.231 939 HE2 TYR 125 HE1 TYR 125 -11.071 -11.890 2.843 940 HH TYR 125 HH TYR 125 -11.902 -13.050 4.697 941 HB2 TYR 125 2HB TYR 125 -12.495 -12.174 -1.560 942 HB3 TYR 125 1HB TYR 125 -14.224 -12.079 -1.488 943 H GLU 126 H GLU 126 -15.071 -14.414 -3.890 944 HA GLU 126 HA GLU 126 -13.320 -14.430 -6.103 945 HB2 GLU 126 2HB GLU 126 -16.173 -13.298 -6.236 946 HB3 GLU 126 1HB GLU 126 -15.246 -13.976 -7.566 947 HG2 GLU 126 2HG GLU 126 -15.484 -16.290 -6.647 948 HG3 GLU 126 1HG GLU 126 -16.203 -15.675 -5.164 949 H GLY 127 H GLY 127 -14.971 -11.445 -5.104 950 HA2 GLY 127 2HA GLY 127 -13.953 -9.216 -4.966 951 HA3 GLY 127 1HA GLY 127 -12.522 -9.852 -5.725 952 H ASP 128 H ASP 128 -13.351 -7.375 -6.097 953 HA ASP 128 HA ASP 128 -13.489 -7.370 -9.144 954 HB2 ASP 128 2HB ASP 128 -14.412 -5.010 -9.090 955 HB3 ASP 128 1HB ASP 128 -15.505 -6.322 -8.674 956 H THR 129 H THR 129 -12.126 -5.507 -6.430 957 HA THR 129 HA THR 129 -9.791 -4.589 -7.991 958 HB THR 129 HB THR 129 -9.649 -4.955 -4.964 959 HG1 THR 129 HG1 THR 129 -11.603 -4.021 -5.300 960 HG21 THR 129 3HG2 THR 129 -8.714 -2.586 -6.680 961 HG22 THR 129 1HG2 THR 129 -7.626 -3.941 -6.283 962 HG23 THR 129 2HG2 THR 129 -8.311 -2.918 -4.984 963 H TYR 130 H TYR 130 -8.152 -5.843 -8.715 964 HA TYR 130 HA TYR 130 -7.243 -8.311 -7.168 965 HD1 TYR 130 HD1 TYR 130 -9.697 -7.607 -10.156 966 HD2 TYR 130 HD2 TYR 130 -7.405 -10.967 -8.776 967 HE1 TYR 130 HE1 TYR 130 -11.708 -9.037 -10.263 968 HE2 TYR 130 HE2 TYR 130 -9.410 -12.401 -8.990 969 HH TYR 130 HH TYR 130 -12.274 -11.450 -8.792 970 HB2 TYR 130 2HB TYR 130 -7.116 -7.535 -10.137 971 HB3 TYR 130 1HB TYR 130 -6.241 -8.896 -9.487 972 H TYR 131 H TYR 131 -5.284 -8.603 -6.456 973 HA TYR 131 HA TYR 131 -3.163 -6.493 -6.523 974 HD1 TYR 131 HD1 TYR 131 -2.231 -6.267 -3.407 975 HD2 TYR 131 HD2 TYR 131 -1.003 -9.910 -5.282 976 HE1 TYR 131 HE1 TYR 131 0.032 -5.999 -2.496 977 HE2 TYR 131 HE2 TYR 131 1.304 -9.505 -4.604 978 HH TYR 131 HH TYR 131 2.164 -7.053 -2.266 979 HB2 TYR 131 2HB TYR 131 -3.909 -7.833 -4.478 980 HB3 TYR 131 1HB TYR 131 -3.375 -9.285 -5.210 981 HA PRO 132 HA PRO 132 -0.746 -8.722 -9.798 982 HB2 PRO 132 2HB PRO 132 1.814 -7.505 -9.267 983 HB3 PRO 132 1HB PRO 132 0.563 -6.969 -10.393 984 HG2 PRO 132 2HG PRO 132 1.346 -5.593 -8.027 985 HG3 PRO 132 1HG PRO 132 -0.073 -5.258 -9.022 986 HD2 PRO 132 2HD PRO 132 0.020 -6.744 -6.418 987 HD3 PRO 132 1HD PRO 132 -1.266 -5.717 -7.127 988 H GLU 133 H GLU 133 1.399 -9.990 -10.186 989 HA GLU 133 HA GLU 133 1.581 -12.065 -8.008 990 HB2 GLU 133 2HB GLU 133 2.817 -13.476 -9.673 991 HB3 GLU 133 1HB GLU 133 1.163 -13.112 -9.900 992 HG2 GLU 133 2HG GLU 133 2.461 -11.167 -11.572 993 HG3 GLU 133 1HG GLU 133 3.432 -12.616 -11.721 994 H TRP 134 H TRP 134 3.596 -13.049 -7.390 995 HA TRP 134 HA TRP 134 5.675 -10.914 -6.701 996 HD1 TRP 134 HD1 TRP 134 5.484 -15.066 -5.209 997 HE1 TRP 134 HE1 TRP 134 3.353 -16.532 -4.720 998 HE3 TRP 134 HE3 TRP 134 2.486 -11.246 -3.662 999 HZ2 TRP 134 HZ2 TRP 134 0.750 -15.934 -3.794 1000 HZ3 TRP 134 HZ3 TRP 134 0.130 -11.736 -3.112 1001 HH2 TRP 134 HH2 TRP 134 -0.731 -14.050 -3.159 1002 HB2 TRP 134 2HB TRP 134 6.067 -12.126 -4.517 1003 HB3 TRP 134 1HB TRP 134 4.604 -11.214 -4.664 1004 H ASP 135 H ASP 135 7.765 -11.299 -7.225 1005 HA ASP 135 HA ASP 135 8.381 -13.965 -8.531 1006 HB2 ASP 135 2HB ASP 135 8.441 -11.369 -9.583 1007 HB3 ASP 135 1HB ASP 135 10.076 -11.486 -8.971 1008 H ALA 136 H ALA 136 10.986 -13.887 -8.704 1009 HA ALA 136 HA ALA 136 12.104 -14.108 -5.805 1010 HB1 ALA 136 3HB ALA 136 13.259 -16.248 -6.620 1011 HB2 ALA 136 1HB ALA 136 12.421 -16.077 -8.193 1012 HB3 ALA 136 2HB ALA 136 11.481 -16.329 -6.690 1013 H ALA 137 H ALA 137 12.977 -13.048 -8.970 1014 HA ALA 137 HA ALA 137 15.656 -12.088 -7.804 1015 HB1 ALA 137 3HB ALA 137 16.603 -11.995 -10.105 1016 HB2 ALA 137 1HB ALA 137 15.112 -12.688 -10.780 1017 HB3 ALA 137 2HB ALA 137 16.118 -13.647 -9.661 1018 H GLU 138 H GLU 138 12.635 -10.931 -8.785 1019 HA GLU 138 HA GLU 138 13.562 -8.053 -8.921 1020 HB2 GLU 138 2HB GLU 138 10.791 -9.349 -8.748 1021 HB3 GLU 138 1HB GLU 138 11.118 -7.648 -8.732 1022 HG2 GLU 138 2HG GLU 138 12.088 -9.216 -11.155 1023 HG3 GLU 138 1HG GLU 138 10.400 -8.787 -10.986 1024 H TRP 139 H TRP 139 11.671 -10.008 -6.497 1025 HA TRP 139 HA TRP 139 13.032 -8.499 -4.210 1026 HD1 TRP 139 HD1 TRP 139 8.665 -10.277 -4.438 1027 HE1 TRP 139 HE1 TRP 139 7.059 -9.765 -6.542 1028 HE3 TRP 139 HE3 TRP 139 10.944 -5.999 -5.930 1029 HZ2 TRP 139 HZ2 TRP 139 7.326 -8.011 -8.722 1030 HZ3 TRP 139 HZ3 TRP 139 10.287 -4.975 -8.087 1031 HH2 TRP 139 HH2 TRP 139 8.538 -5.984 -9.480 1032 HB2 TRP 139 2HB TRP 139 10.583 -8.629 -3.048 1033 HB3 TRP 139 1HB TRP 139 11.180 -7.278 -3.949 1034 H GLU 140 H GLU 140 13.453 -9.478 -2.369 1035 HA GLU 140 HA GLU 140 12.796 -12.453 -2.078 1036 HB2 GLU 140 2HB GLU 140 14.854 -12.902 -1.325 1037 HB3 GLU 140 1HB GLU 140 15.273 -11.553 -2.325 1038 HG2 GLU 140 2HG GLU 140 15.271 -10.119 -0.081 1039 HG3 GLU 140 1HG GLU 140 15.102 -11.659 0.759 1040 H LEU 141 H LEU 141 13.098 -12.882 0.639 1041 HA LEU 141 HA LEU 141 10.572 -11.500 1.693 1042 HG LEU 141 HG LEU 141 9.255 -14.745 3.016 1043 HB2 LEU 141 2HB LEU 141 10.911 -14.190 1.293 1044 HB3 LEU 141 1HB LEU 141 11.546 -14.087 2.902 1045 HD11 LEU 141 1HD1 LEU 141 8.059 -13.071 4.347 1046 HD12 LEU 141 2HD1 LEU 141 9.079 -11.769 3.734 1047 HD13 LEU 141 3HD1 LEU 141 9.785 -12.997 4.786 1048 HD21 LEU 141 3HD2 LEU 141 7.363 -13.715 1.901 1049 HD22 LEU 141 1HD2 LEU 141 8.625 -13.919 0.669 1050 HD23 LEU 141 2HD2 LEU 141 8.333 -12.322 1.388 1051 H ASP 142 H ASP 142 11.000 -9.982 3.261 1052 HA ASP 142 HA ASP 142 13.614 -9.896 4.764 1053 HB2 ASP 142 2HB ASP 142 12.436 -7.867 3.591 1054 HB3 ASP 142 1HB ASP 142 11.315 -7.863 4.943 1055 H ALA 143 H ALA 143 10.077 -9.996 5.589 1056 HA ALA 143 HA ALA 143 10.725 -11.732 7.986 1057 HB1 ALA 143 3HB ALA 143 9.241 -9.020 8.325 1058 HB2 ALA 143 1HB ALA 143 10.924 -9.322 8.808 1059 HB3 ALA 143 2HB ALA 143 9.597 -10.189 9.625 1060 H GLU 144 H GLU 144 9.296 -13.340 8.145 1061 HA GLU 144 HA GLU 144 6.373 -12.903 7.338 1062 HB2 GLU 144 2HB GLU 144 7.933 -14.601 6.167 1063 HB3 GLU 144 1HB GLU 144 7.758 -15.630 7.590 1064 HG2 GLU 144 2HG GLU 144 5.288 -15.785 7.223 1065 HG3 GLU 144 1HG GLU 144 5.341 -14.471 6.054 1066 H THR 145 H THR 145 4.940 -12.597 8.894 1067 HA THR 145 HA THR 145 5.153 -14.170 11.501 1068 HB THR 145 HB THR 145 4.954 -12.488 13.004 1069 HG1 THR 145 HG1 THR 145 4.546 -10.303 12.441 1070 HG21 THR 145 3HG2 THR 145 6.661 -11.027 10.884 1071 HG22 THR 145 1HG2 THR 145 7.257 -12.251 12.019 1072 HG23 THR 145 2HG2 THR 145 6.654 -10.677 12.627 1073 H ASP 146 H ASP 146 3.212 -15.096 12.196 1074 HA ASP 146 HA ASP 146 0.638 -14.464 11.240 1075 HB2 ASP 146 2HB ASP 146 1.536 -15.754 13.892 1076 HB3 ASP 146 1HB ASP 146 -0.111 -15.783 13.290 1077 H HIS 147 H HIS 147 -1.067 -13.200 11.839 1078 HA HIS 147 HA HIS 147 -0.975 -11.429 14.345 1079 HD1 HIS 147 HD1 HIS 147 1.496 -10.847 13.131 1080 HD2 HIS 147 HD2 HIS 147 -0.940 -7.363 12.808 1081 HE1 HIS 147 HE1 HIS 147 2.933 -8.720 13.451 1082 HB2 HIS 147 2HB HIS 147 -1.187 -10.549 11.411 1083 HB3 HIS 147 1HB HIS 147 -2.180 -9.701 12.558 1084 H GLU 148 H GLU 148 -3.624 -10.212 13.801 1085 HA GLU 148 HA GLU 148 -5.098 -12.360 15.258 1086 HB2 GLU 148 2HB GLU 148 -5.980 -9.524 14.545 1087 HB3 GLU 148 1HB GLU 148 -6.994 -10.626 15.388 1088 HG2 GLU 148 2HG GLU 148 -5.401 -10.767 17.316 1089 HG3 GLU 148 1HG GLU 148 -4.257 -9.717 16.516 1090 H GLY 149 H GLY 149 -6.101 -10.656 12.221 1091 HA2 GLY 149 2HA GLY 149 -7.860 -13.096 11.466 1092 HA3 GLY 149 1HA GLY 149 -7.975 -11.527 10.736 1093 H PHE 150 H PHE 150 -4.664 -12.635 10.971 1094 HA PHE 150 HA PHE 150 -4.485 -13.493 8.110 1095 HD1 PHE 150 HD2 PHE 150 -5.494 -9.690 9.913 1096 HD2 PHE 150 HD1 PHE 150 -1.766 -10.201 7.863 1097 HE1 PHE 150 HE2 PHE 150 -4.565 -7.793 11.148 1098 HE2 PHE 150 HE1 PHE 150 -0.827 -8.272 9.100 1099 HZ PHE 150 HZ PHE 150 -2.231 -7.060 10.747 1100 HB2 PHE 150 2HB PHE 150 -3.779 -11.405 7.116 1101 HB3 PHE 150 1HB PHE 150 -5.306 -11.135 7.872 1102 H THR 151 H THR 151 -2.302 -13.420 7.196 1103 HA THR 151 HA THR 151 -0.064 -13.350 9.289 1104 HB THR 151 HB THR 151 0.730 -15.245 8.652 1105 HG1 THR 151 HG1 THR 151 2.118 -14.249 7.281 1106 HG21 THR 151 3HG2 THR 151 -0.089 -16.762 6.932 1107 HG22 THR 151 1HG2 THR 151 -1.024 -15.465 6.142 1108 HG23 THR 151 2HG2 THR 151 -1.483 -16.044 7.758 1109 H LEU 152 H LEU 152 1.429 -11.910 9.178 1110 HA LEU 152 HA LEU 152 1.428 -9.614 7.215 1111 HG LEU 152 HG LEU 152 3.362 -7.840 10.050 1112 HB2 LEU 152 2HB LEU 152 1.514 -9.100 9.585 1113 HB3 LEU 152 1HB LEU 152 2.766 -10.259 9.899 1114 HD11 LEU 152 1HD1 LEU 152 5.174 -9.342 8.069 1115 HD12 LEU 152 2HD1 LEU 152 5.102 -9.675 9.809 1116 HD13 LEU 152 3HD1 LEU 152 5.645 -8.086 9.233 1117 HD21 LEU 152 3HD2 LEU 152 3.923 -6.523 8.042 1118 HD22 LEU 152 1HD2 LEU 152 2.201 -6.954 8.011 1119 HD23 LEU 152 2HD2 LEU 152 3.348 -7.807 6.956 1120 H GLN 153 H GLN 153 2.729 -9.675 5.462 1121 HA GLN 153 HA GLN 153 5.380 -11.254 5.509 1122 HB2 GLN 153 2HB GLN 153 3.142 -11.270 3.459 1123 HB3 GLN 153 1HB GLN 153 4.705 -10.916 2.768 1124 HG2 GLN 153 2HG GLN 153 5.676 -13.019 3.736 1125 HG3 GLN 153 1HG GLN 153 4.128 -13.424 4.469 1126 HE21 GLN 153 1HE2 GLN 153 5.199 -15.201 2.833 1127 HE22 GLN 153 2HE2 GLN 153 4.460 -15.146 1.126 1128 H GLU 154 H GLU 154 6.989 -9.855 5.620 1129 HA GLU 154 HA GLU 154 6.928 -7.151 4.178 1130 HB2 GLU 154 2HB GLU 154 9.130 -8.037 6.085 1131 HB3 GLU 154 1HB GLU 154 8.881 -6.465 5.403 1132 HG2 GLU 154 2HG GLU 154 6.566 -6.507 6.747 1133 HG3 GLU 154 1HG GLU 154 7.285 -7.859 7.602 1134 H TRP 155 H TRP 155 7.635 -7.375 2.100 1135 HA TRP 155 HA TRP 155 9.903 -9.301 1.361 1136 HD1 TRP 155 HD1 TRP 155 5.693 -9.240 0.844 1137 HE1 TRP 155 HE1 TRP 155 4.620 -11.470 -0.056 1138 HE3 TRP 155 HE3 TRP 155 9.742 -10.779 -1.843 1139 HZ2 TRP 155 HZ2 TRP 155 5.562 -13.543 -1.699 1140 HZ3 TRP 155 HZ3 TRP 155 9.554 -12.873 -3.158 1141 HH2 TRP 155 HH2 TRP 155 7.495 -14.212 -3.103 1142 HB2 TRP 155 2HB TRP 155 7.770 -7.770 -0.195 1143 HB3 TRP 155 1HB TRP 155 9.026 -8.612 -1.038 1144 H VAL 156 H VAL 156 11.990 -8.530 0.642 1145 HA VAL 156 HA VAL 156 12.287 -5.481 0.216 1146 HB VAL 156 HB VAL 156 13.380 -6.278 2.288 1147 HG11 VAL 156 1HG1 VAL 156 14.158 -8.539 1.673 1148 HG12 VAL 156 2HG1 VAL 156 15.555 -7.568 2.186 1149 HG13 VAL 156 3HG1 VAL 156 15.260 -7.875 0.450 1150 HG21 VAL 156 3HG2 VAL 156 15.497 -5.044 2.044 1151 HG22 VAL 156 1HG2 VAL 156 14.263 -4.192 1.089 1152 HG23 VAL 156 2HG2 VAL 156 15.455 -5.212 0.274 1153 H ARG 157 H ARG 157 13.093 -4.682 -1.667 1154 HA ARG 157 HA ARG 157 13.655 -6.188 -4.061 1155 HE ARG 157 HE ARG 157 12.790 -1.357 -4.229 1156 HB2 ARG 157 2HB ARG 157 14.208 -3.361 -3.120 1157 HB3 ARG 157 1HB ARG 157 15.341 -3.903 -4.317 1158 HG2 ARG 157 2HG ARG 157 13.295 -4.587 -5.810 1159 HG3 ARG 157 1HG ARG 157 12.306 -3.688 -4.679 1160 HD2 ARG 157 2HD ARG 157 14.799 -2.547 -6.196 1161 HD3 ARG 157 1HD ARG 157 13.112 -2.379 -6.761 1162 HH11 ARG 157 2HH1 ARG 157 15.106 -0.426 -6.645 1163 HH12 ARG 157 1HH1 ARG 157 15.083 1.292 -5.961 1164 HH21 ARG 157 1HH2 ARG 157 12.896 0.489 -3.547 1165 HH22 ARG 157 2HH2 ARG 157 13.820 1.810 -4.386 1166 H SER 158 H SER 158 15.347 -6.735 -5.245 1167 HA SER 158 HA SER 158 17.029 -8.526 -4.089 1168 HG SER 158 HG SER 158 18.588 -9.489 -5.681 1169 HB2 SER 158 2HB SER 158 16.448 -8.730 -6.360 1170 HB3 SER 158 1HB SER 158 17.262 -7.251 -6.863 1171 H ALA 159 H ALA 159 18.548 -8.420 -2.666 1172 HA ALA 159 HA ALA 159 20.524 -6.349 -2.295 1173 HB1 ALA 159 3HB ALA 159 20.643 -9.294 -1.348 1174 HB2 ALA 159 1HB ALA 159 19.668 -8.043 -0.567 1175 HB3 ALA 159 2HB ALA 159 21.450 -7.896 -0.583 1176 H SER 160 H SER 160 22.050 -5.888 -3.897 1177 HA SER 160 HA SER 160 23.523 -7.696 -5.521 1178 HG SER 160 HG SER 160 25.999 -6.209 -5.551 1179 HB2 SER 160 2HB SER 160 23.339 -5.202 -5.835 1180 HB3 SER 160 1HB SER 160 24.418 -4.947 -4.460 1181 H SER 161 H SER 161 23.771 -9.002 -3.101 1182 HA SER 161 HA SER 161 25.266 -10.219 -1.733 1183 HG SER 161 HG SER 161 25.080 -10.993 -4.363 1184 HB2 SER 161 2HB SER 161 27.083 -9.816 -4.146 1185 HB3 SER 161 1HB SER 161 27.470 -10.893 -2.802 1186 H ARG 162 H ARG 162 25.215 -8.816 -0.063 1187 HA ARG 162 HA ARG 162 27.953 -7.711 0.710 1188 HE ARG 162 HE ARG 162 28.415 -3.012 2.542 1189 HB2 ARG 162 1HB ARG 162 26.249 -5.890 -0.163 1190 HB3 ARG 162 2HB ARG 162 25.317 -6.193 1.290 1191 HG2 ARG 162 1HG ARG 162 27.284 -5.433 2.710 1192 HG3 ARG 162 2HG ARG 162 28.287 -5.298 1.245 1193 HD2 ARG 162 1HD ARG 162 26.641 -3.596 0.278 1194 HD3 ARG 162 2HD ARG 162 25.675 -3.700 1.753 1195 HH11 ARG 162 2HH1 ARG 162 25.725 -1.467 0.864 1196 HH12 ARG 162 1HH1 ARG 162 26.372 0.163 1.361 1197 HH21 ARG 162 1HH2 ARG 162 29.056 -1.053 3.050 1198 HH22 ARG 162 2HH2 ARG 162 28.054 0.342 2.458 Start of MODEL 20 1 HA MET 1 HA MET 1 16.485 5.506 2.235 2 H1 MET 1 1H MET 1 15.472 7.734 2.980 3 H2 MET 1 2H MET 1 14.774 6.902 4.183 4 HB2 MET 1 1HB MET 1 14.067 4.633 3.926 5 HB3 MET 1 2HB MET 1 14.910 3.600 2.786 6 HG2 MET 1 1HG MET 1 17.028 3.739 4.189 7 HG3 MET 1 2HG MET 1 16.082 4.617 5.422 8 HE1 MET 1 3HE MET 1 15.752 2.813 7.444 9 HE2 MET 1 1HE MET 1 17.197 2.151 6.606 10 HE3 MET 1 2HE MET 1 15.859 1.062 7.087 11 H GLU 2 H GLU 2 13.579 4.283 1.645 12 HA GLU 2 HA GLU 2 12.264 6.395 0.127 13 HB2 GLU 2 2HB GLU 2 12.328 5.550 -2.152 14 HB3 GLU 2 1HB GLU 2 13.924 5.901 -1.560 15 HG2 GLU 2 2HG GLU 2 14.199 3.331 -1.105 16 HG3 GLU 2 1HG GLU 2 12.756 3.092 -2.072 17 H LEU 3 H LEU 3 10.596 4.286 -1.379 18 HA LEU 3 HA LEU 3 8.756 4.165 1.041 19 HG LEU 3 HG LEU 3 8.985 6.205 -1.963 20 HB2 LEU 3 2HB LEU 3 6.845 4.327 -0.815 21 HB3 LEU 3 1HB LEU 3 7.636 5.654 -0.054 22 HD11 LEU 3 1HD1 LEU 3 9.513 3.994 -2.961 23 HD12 LEU 3 2HD1 LEU 3 8.743 4.998 -4.173 24 HD13 LEU 3 3HD1 LEU 3 7.819 3.689 -3.359 25 HD21 LEU 3 3HD2 LEU 3 5.969 5.772 -2.399 26 HD22 LEU 3 1HD2 LEU 3 6.962 6.627 -3.609 27 HD23 LEU 3 2HD2 LEU 3 6.840 7.252 -1.953 28 H VAL 4 H VAL 4 7.126 2.783 1.410 29 HA VAL 4 HA VAL 4 7.610 -0.068 0.437 30 HB VAL 4 HB VAL 4 7.165 1.041 3.232 31 HG11 VAL 4 1HG1 VAL 4 7.655 -1.895 2.447 32 HG12 VAL 4 2HG1 VAL 4 6.215 -1.248 3.222 33 HG13 VAL 4 3HG1 VAL 4 7.751 -1.296 4.116 34 HG21 VAL 4 3HG2 VAL 4 9.798 -0.071 2.142 35 HG22 VAL 4 1HG2 VAL 4 9.407 0.334 3.834 36 HG23 VAL 4 2HG2 VAL 4 9.431 1.600 2.611 37 H SER 5 H SER 5 5.866 -1.282 -0.152 38 HA SER 5 HA SER 5 3.146 0.028 -0.053 39 HG SER 5 HG SER 5 4.304 -2.917 -2.603 40 HB2 SER 5 2HB SER 5 2.744 -1.540 -1.950 41 HB3 SER 5 1HB SER 5 4.175 -0.578 -2.153 42 H VAL 6 H VAL 6 1.362 -0.548 1.023 43 HA VAL 6 HA VAL 6 1.472 -2.987 2.739 44 HB VAL 6 HB VAL 6 1.401 -2.227 4.758 45 HG11 VAL 6 1HG1 VAL 6 2.699 0.217 3.425 46 HG12 VAL 6 2HG1 VAL 6 3.550 -1.205 3.962 47 HG13 VAL 6 3HG1 VAL 6 2.815 -0.115 5.142 48 HG21 VAL 6 3HG2 VAL 6 0.237 0.502 4.134 49 HG22 VAL 6 1HG2 VAL 6 0.532 -0.192 5.727 50 HG23 VAL 6 2HG2 VAL 6 -0.729 -0.887 4.720 51 H ALA 7 H ALA 7 0.139 -4.011 1.175 52 HA ALA 7 HA ALA 7 -2.853 -3.295 1.394 53 HB1 ALA 7 3HB ALA 7 -1.374 -5.055 -0.676 54 HB2 ALA 7 1HB ALA 7 -2.003 -3.407 -0.927 55 HB3 ALA 7 2HB ALA 7 -3.130 -4.739 -0.653 56 H ALA 8 H ALA 8 -4.329 -4.655 2.376 57 HA ALA 8 HA ALA 8 -3.496 -7.460 3.220 58 HB1 ALA 8 3HB ALA 8 -5.871 -5.698 4.102 59 HB2 ALA 8 1HB ALA 8 -4.342 -5.863 4.974 60 HB3 ALA 8 2HB ALA 8 -5.402 -7.262 4.792 61 H LEU 9 H LEU 9 -4.430 -9.328 2.502 62 HA LEU 9 HA LEU 9 -6.789 -9.373 0.696 63 HG LEU 9 HG LEU 9 -3.556 -9.349 -2.113 64 HB2 LEU 9 2HB LEU 9 -5.671 -9.924 -1.405 65 HB3 LEU 9 1HB LEU 9 -5.437 -8.307 -0.879 66 HD11 LEU 9 1HD1 LEU 9 -1.724 -8.295 -0.777 67 HD12 LEU 9 2HD1 LEU 9 -2.751 -8.254 0.651 68 HD13 LEU 9 3HD1 LEU 9 -3.170 -7.294 -0.777 69 HD21 LEU 9 3HD2 LEU 9 -2.866 -10.912 0.449 70 HD22 LEU 9 1HD2 LEU 9 -1.959 -10.867 -1.077 71 HD23 LEU 9 2HD2 LEU 9 -3.557 -11.633 -1.045 72 H ALA 10 H ALA 10 -7.415 -11.335 -0.254 73 HA ALA 10 HA ALA 10 -6.633 -13.756 1.472 74 HB1 ALA 10 3HB ALA 10 -9.124 -14.060 1.536 75 HB2 ALA 10 1HB ALA 10 -9.340 -12.750 0.370 76 HB3 ALA 10 2HB ALA 10 -8.716 -12.415 2.007 77 H GLU 11 H GLU 11 -8.960 -15.044 -0.351 78 HA GLU 11 HA GLU 11 -7.174 -16.543 -2.206 79 HB2 GLU 11 2HB GLU 11 -9.106 -17.724 -1.245 80 HB3 GLU 11 1HB GLU 11 -10.239 -16.637 -2.032 81 HG2 GLU 11 2HG GLU 11 -9.647 -17.506 -4.277 82 HG3 GLU 11 1HG GLU 11 -8.264 -18.414 -3.644 83 H ASN 12 H ASN 12 -7.852 -16.620 -4.546 84 HA ASN 12 HA ASN 12 -6.750 -15.523 -6.385 85 HB2 ASN 12 2HB ASN 12 -9.588 -14.645 -5.927 86 HB3 ASN 12 1HB ASN 12 -8.738 -13.475 -6.861 87 HD21 ASN 12 1HD2 ASN 12 -10.837 -15.394 -7.581 88 HD22 ASN 12 2HD2 ASN 12 -10.150 -16.133 -9.119 89 H ARG 13 H ARG 13 -5.916 -14.168 -3.829 90 HA ARG 13 HA ARG 13 -4.901 -12.289 -2.996 91 HE ARG 13 HE ARG 13 -1.396 -14.394 -7.049 92 HB2 ARG 13 2HB ARG 13 -2.965 -11.353 -4.058 93 HB3 ARG 13 1HB ARG 13 -3.009 -13.109 -4.113 94 HG2 ARG 13 2HG ARG 13 -3.772 -12.957 -6.573 95 HG3 ARG 13 1HG ARG 13 -3.554 -11.226 -6.501 96 HD2 ARG 13 2HD ARG 13 -1.255 -11.361 -6.717 97 HD3 ARG 13 1HD ARG 13 -1.071 -12.530 -5.467 98 HH11 ARG 13 2HH1 ARG 13 -1.363 -11.310 -8.691 99 HH12 ARG 13 1HH1 ARG 13 -1.066 -12.110 -10.297 100 HH21 ARG 13 1HH2 ARG 13 -1.437 -15.221 -8.889 101 HH22 ARG 13 2HH2 ARG 13 -1.259 -14.209 -10.412 102 H VAL 14 H VAL 14 -7.227 -11.740 -3.195 103 HA VAL 14 HA VAL 14 -7.884 -9.298 -4.774 104 HB VAL 14 HB VAL 14 -9.382 -11.233 -2.924 105 HG11 VAL 14 1HG1 VAL 14 -10.729 -8.705 -4.068 106 HG12 VAL 14 2HG1 VAL 14 -10.482 -9.087 -2.350 107 HG13 VAL 14 3HG1 VAL 14 -11.533 -10.118 -3.316 108 HG21 VAL 14 3HG2 VAL 14 -8.904 -11.816 -5.348 109 HG22 VAL 14 1HG2 VAL 14 -9.832 -10.399 -5.885 110 HG23 VAL 14 2HG2 VAL 14 -10.637 -11.730 -4.997 111 H ILE 15 H ILE 15 -7.064 -7.382 -4.148 112 HA ILE 15 HA ILE 15 -6.682 -6.452 -1.356 113 HB ILE 15 HB ILE 15 -7.223 -4.552 -3.677 114 HG12 ILE 15 2HG1 ILE 15 -4.295 -4.782 -3.101 115 HG13 ILE 15 1HG1 ILE 15 -4.926 -6.310 -3.604 116 HG21 ILE 15 1HG2 ILE 15 -5.408 -3.953 -1.245 117 HG22 ILE 15 2HG2 ILE 15 -7.132 -3.595 -1.225 118 HG23 ILE 15 3HG2 ILE 15 -6.107 -2.819 -2.409 119 HD11 ILE 15 3HD1 ILE 15 -5.864 -5.296 -5.720 120 HD12 ILE 15 1HD1 ILE 15 -4.139 -4.922 -5.586 121 HD13 ILE 15 2HD1 ILE 15 -5.344 -3.680 -5.192 122 H GLY 16 H GLY 16 -9.440 -5.845 -3.598 123 HA2 GLY 16 2HA GLY 16 -11.220 -5.157 -1.252 124 HA3 GLY 16 1HA GLY 16 -10.763 -3.754 -2.230 125 H ARG 17 H ARG 17 -13.277 -4.184 -1.914 126 HA ARG 17 HA ARG 17 -14.420 -5.367 -4.444 127 HE ARG 17 HE ARG 17 -16.964 -9.168 -5.195 128 HB2 ARG 17 2HB ARG 17 -14.262 -7.203 -2.610 129 HB3 ARG 17 1HB ARG 17 -15.564 -6.366 -1.763 130 HG2 ARG 17 2HG ARG 17 -17.062 -6.722 -3.793 131 HG3 ARG 17 1HG ARG 17 -15.702 -7.396 -4.686 132 HD2 ARG 17 2HD ARG 17 -15.607 -9.158 -2.589 133 HD3 ARG 17 1HD ARG 17 -17.281 -8.610 -2.332 134 HH11 ARG 17 2HH1 ARG 17 -17.075 -11.056 -2.253 135 HH12 ARG 17 1HH1 ARG 17 -17.370 -12.587 -3.233 136 HH21 ARG 17 1HH2 ARG 17 -17.242 -10.956 -6.180 137 HH22 ARG 17 2HH2 ARG 17 -17.555 -12.530 -5.290 138 H ASP 18 H ASP 18 -15.900 -3.983 -1.378 139 HA ASP 18 HA ASP 18 -17.261 -1.913 -3.039 140 HB2 ASP 18 2HB ASP 18 -17.085 -2.420 -0.025 141 HB3 ASP 18 1HB ASP 18 -17.670 -0.887 -0.638 142 H GLY 19 H GLY 19 -14.534 -1.444 -0.686 143 HA2 GLY 19 2HA GLY 19 -13.505 0.831 -2.507 144 HA3 GLY 19 1HA GLY 19 -13.918 1.240 -0.867 145 H GLU 20 H GLU 20 -12.476 0.520 0.809 146 HA GLU 20 HA GLU 20 -9.656 0.041 0.081 147 HB2 GLU 20 2HB GLU 20 -9.236 -0.288 2.504 148 HB3 GLU 20 1HB GLU 20 -9.860 1.258 2.072 149 HG2 GLU 20 2HG GLU 20 -11.880 0.993 3.289 150 HG3 GLU 20 1HG GLU 20 -11.917 -0.753 3.130 151 H LEU 21 H LEU 21 -11.730 -2.139 1.955 152 HA LEU 21 HA LEU 21 -10.545 -4.534 0.639 153 HG LEU 21 HG LEU 21 -9.760 -2.347 3.520 154 HB2 LEU 21 2HB LEU 21 -9.627 -5.370 2.885 155 HB3 LEU 21 1HB LEU 21 -8.794 -4.152 1.964 156 HD11 LEU 21 1HD1 LEU 21 -11.648 -3.501 4.550 157 HD12 LEU 21 2HD1 LEU 21 -10.478 -3.134 5.818 158 HD13 LEU 21 3HD1 LEU 21 -10.603 -4.798 5.166 159 HD21 LEU 21 3HD2 LEU 21 -7.843 -4.402 4.717 160 HD22 LEU 21 1HD2 LEU 21 -8.036 -2.710 5.230 161 HD23 LEU 21 2HD2 LEU 21 -7.418 -3.078 3.612 162 HA PRO 22 HA PRO 22 -14.461 -6.251 1.093 163 HB2 PRO 22 2HB PRO 22 -13.567 -9.094 1.099 164 HB3 PRO 22 1HB PRO 22 -14.260 -8.144 -0.216 165 HG2 PRO 22 2HG PRO 22 -11.571 -8.955 -0.170 166 HG3 PRO 22 1HG PRO 22 -12.104 -7.480 -1.000 167 HD2 PRO 22 2HD PRO 22 -10.906 -7.695 1.812 168 HD3 PRO 22 1HD PRO 22 -10.483 -6.607 0.504 169 H TRP 23 H TRP 23 -12.622 -7.001 3.750 170 HA TRP 23 HA TRP 23 -15.035 -7.876 5.408 171 HD1 TRP 23 HD1 TRP 23 -11.864 -6.443 8.009 172 HE1 TRP 23 HE1 TRP 23 -9.437 -5.641 7.271 173 HE3 TRP 23 HE3 TRP 23 -11.302 -9.516 4.063 174 HZ2 TRP 23 HZ2 TRP 23 -7.597 -6.484 5.468 175 HZ3 TRP 23 HZ3 TRP 23 -9.222 -9.361 2.712 176 HH2 TRP 23 HH2 TRP 23 -7.446 -7.802 3.363 177 HB2 TRP 23 2HB TRP 23 -13.542 -8.612 7.193 178 HB3 TRP 23 1HB TRP 23 -13.085 -9.411 5.725 179 HA PRO 24 HA PRO 24 -15.293 -3.633 6.683 180 HB2 PRO 24 2HB PRO 24 -15.952 -3.608 9.393 181 HB3 PRO 24 1HB PRO 24 -17.027 -4.106 8.071 182 HG2 PRO 24 2HG PRO 24 -15.256 -5.935 9.816 183 HG3 PRO 24 1HG PRO 24 -17.001 -6.117 9.510 184 HD2 PRO 24 2HD PRO 24 -15.215 -7.549 8.052 185 HD3 PRO 24 1HD PRO 24 -16.599 -6.827 7.192 186 H SER 25 H SER 25 -13.195 -5.008 9.217 187 HA SER 25 HA SER 25 -10.776 -3.877 8.709 188 HG SER 25 HG SER 25 -11.239 -1.411 7.671 189 HB2 SER 25 2HB SER 25 -12.404 -1.516 9.647 190 HB3 SER 25 1HB SER 25 -10.883 -1.718 10.497 191 H ILE 26 H ILE 26 -10.065 -5.660 9.909 192 HA ILE 26 HA ILE 26 -10.900 -6.113 12.700 193 HB ILE 26 HB ILE 26 -8.754 -7.526 12.990 194 HG12 ILE 26 2HG1 ILE 26 -7.823 -6.639 10.692 195 HG13 ILE 26 1HG1 ILE 26 -7.368 -8.167 11.386 196 HG21 ILE 26 1HG2 ILE 26 -10.936 -8.507 13.099 197 HG22 ILE 26 2HG2 ILE 26 -9.824 -9.558 12.204 198 HG23 ILE 26 3HG2 ILE 26 -11.054 -8.620 11.330 199 HD11 ILE 26 3HD1 ILE 26 -8.738 -9.448 9.812 200 HD12 ILE 26 1HD1 ILE 26 -7.866 -8.211 8.869 201 HD13 ILE 26 2HD1 ILE 26 -9.582 -8.000 9.259 202 HA PRO 27 HA PRO 27 -8.256 -3.057 14.819 203 HB2 PRO 27 2HB PRO 27 -8.266 -5.142 17.066 204 HB3 PRO 27 1HB PRO 27 -8.524 -3.382 17.169 205 HG2 PRO 27 2HG PRO 27 -10.719 -4.983 17.202 206 HG3 PRO 27 1HG PRO 27 -10.745 -3.586 16.089 207 HD2 PRO 27 2HD PRO 27 -10.062 -6.496 15.354 208 HD3 PRO 27 1HD PRO 27 -11.222 -5.342 14.601 209 H ALA 28 H ALA 28 -6.793 -6.397 15.097 210 HA ALA 28 HA ALA 28 -4.076 -5.563 15.122 211 HB1 ALA 28 3HB ALA 28 -3.605 -7.739 13.908 212 HB2 ALA 28 1HB ALA 28 -5.331 -7.923 13.607 213 HB3 ALA 28 2HB ALA 28 -4.699 -7.888 15.276 214 H ASP 29 H ASP 29 -6.138 -5.332 12.235 215 HA ASP 29 HA ASP 29 -3.895 -4.838 10.316 216 HB2 ASP 29 2HB ASP 29 -5.998 -5.939 9.625 217 HB3 ASP 29 1HB ASP 29 -6.947 -4.507 10.015 218 H LYS 30 H LYS 30 -6.461 -2.377 10.786 219 HA LYS 30 HA LYS 30 -4.867 -0.160 10.962 220 HB2 LYS 30 2HB LYS 30 -7.352 -0.205 10.982 221 HB3 LYS 30 1HB LYS 30 -7.364 -0.517 12.734 222 HG2 LYS 30 2HG LYS 30 -6.491 1.762 13.196 223 HG3 LYS 30 1HG LYS 30 -5.997 1.956 11.526 224 HD2 LYS 30 2HD LYS 30 -7.860 3.375 11.873 225 HD3 LYS 30 1HD LYS 30 -8.278 2.214 10.680 226 HE2 LYS 30 2HE LYS 30 -9.124 1.834 13.663 227 HE3 LYS 30 1HE LYS 30 -10.016 2.909 12.588 228 HZ1 LYS 30 3HZ LYS 30 -10.922 0.523 12.453 229 HZ2 LYS 30 1HZ LYS 30 -9.465 0.026 11.845 230 HZ3 LYS 30 2HZ LYS 30 -10.368 1.054 10.991 231 H LYS 31 H LYS 31 -4.421 -2.337 13.461 232 HA LYS 31 HA LYS 31 -2.712 -0.412 15.077 233 HB2 LYS 31 2HB LYS 31 -3.936 -2.102 16.413 234 HB3 LYS 31 1HB LYS 31 -3.286 -3.400 15.435 235 HG2 LYS 31 2HG LYS 31 -2.101 -3.396 17.558 236 HG3 LYS 31 1HG LYS 31 -1.023 -3.053 16.228 237 HD2 LYS 31 2HD LYS 31 -1.570 -0.453 16.886 238 HD3 LYS 31 1HD LYS 31 -2.056 -1.135 18.420 239 HE2 LYS 31 2HE LYS 31 0.147 -1.760 19.041 240 HE3 LYS 31 1HE LYS 31 0.629 -2.184 17.399 241 HZ1 LYS 31 3HZ LYS 31 0.222 0.709 18.202 242 HZ2 LYS 31 1HZ LYS 31 0.769 0.176 16.775 243 HZ3 LYS 31 2HZ LYS 31 1.706 -0.017 18.081 244 H GLN 32 H GLN 32 -2.266 -2.922 12.587 245 HA GLN 32 HA GLN 32 0.720 -2.542 12.601 246 HB2 GLN 32 2HB GLN 32 -0.355 -4.878 12.086 247 HB3 GLN 32 1HB GLN 32 -0.846 -4.187 10.553 248 HG2 GLN 32 2HG GLN 32 1.245 -5.380 10.216 249 HG3 GLN 32 1HG GLN 32 1.585 -3.687 9.974 250 HE21 GLN 32 1HE2 GLN 32 2.718 -6.398 11.446 251 HE22 GLN 32 2HE2 GLN 32 3.909 -5.557 12.551 252 H TYR 33 H TYR 33 -2.012 -1.972 10.273 253 HA TYR 33 HA TYR 33 -0.644 -0.149 8.534 254 HD1 TYR 33 HD2 TYR 33 -2.179 2.241 7.396 255 HD2 TYR 33 HD1 TYR 33 -5.537 -0.066 8.753 256 HE1 TYR 33 HE2 TYR 33 -3.512 4.264 7.521 257 HE2 TYR 33 HE1 TYR 33 -6.920 2.000 8.756 258 HH TYR 33 HH TYR 33 -6.226 4.831 7.605 259 HB2 TYR 33 2HB TYR 33 -2.505 -0.653 7.453 260 HB3 TYR 33 1HB TYR 33 -3.402 -1.097 8.853 261 H ARG 34 H ARG 34 -2.169 0.890 11.692 262 HA ARG 34 HA ARG 34 -0.962 3.627 11.086 263 HE ARG 34 HE ARG 34 -4.306 6.334 10.382 264 HB2 ARG 34 2HB ARG 34 -2.766 2.878 13.436 265 HB3 ARG 34 1HB ARG 34 -1.931 4.397 13.254 266 HG2 ARG 34 2HG ARG 34 -3.075 4.369 10.755 267 HG3 ARG 34 1HG ARG 34 -4.184 3.288 11.516 268 HD2 ARG 34 2HD ARG 34 -5.339 5.003 12.526 269 HD3 ARG 34 1HD ARG 34 -3.893 5.568 13.346 270 HH11 ARG 34 2HH1 ARG 34 -4.181 7.472 13.660 271 HH12 ARG 34 1HH1 ARG 34 -3.843 9.181 13.071 272 HH21 ARG 34 1HH2 ARG 34 -3.817 8.194 9.874 273 HH22 ARG 34 2HH2 ARG 34 -3.683 9.593 11.025 274 H SER 35 H SER 35 0.295 0.960 12.889 275 HA SER 35 HA SER 35 2.559 2.855 13.793 276 HG SER 35 HG SER 35 1.697 2.746 15.690 277 HB2 SER 35 2HB SER 35 2.032 0.049 14.865 278 HB3 SER 35 1HB SER 35 3.455 1.040 15.206 279 H ARG 36 H ARG 36 1.797 0.899 11.295 280 HA ARG 36 HA ARG 36 4.604 1.158 10.166 281 HE ARG 36 HE ARG 36 6.302 0.019 9.145 282 HB2 ARG 36 2HB ARG 36 2.930 -0.850 9.709 283 HB3 ARG 36 1HB ARG 36 1.975 0.307 8.818 284 HG2 ARG 36 2HG ARG 36 3.132 -0.658 7.128 285 HG3 ARG 36 1HG ARG 36 4.185 0.697 7.393 286 HD2 ARG 36 2HD ARG 36 4.581 -2.286 8.036 287 HD3 ARG 36 1HD ARG 36 5.569 -1.278 7.024 288 HH11 ARG 36 2HH1 ARG 36 5.541 -3.362 9.457 289 HH12 ARG 36 1HH1 ARG 36 5.692 -3.321 11.249 290 HH21 ARG 36 1HH2 ARG 36 6.699 -0.010 11.141 291 HH22 ARG 36 2HH2 ARG 36 6.500 -1.536 12.128 292 H VAL 37 H VAL 37 1.297 2.477 9.162 293 HA VAL 37 HA VAL 37 2.835 4.746 7.910 294 HB VAL 37 HB VAL 37 1.436 4.884 6.233 295 HG11 VAL 37 1HG1 VAL 37 2.261 2.481 6.187 296 HG12 VAL 37 2HG1 VAL 37 0.823 2.781 5.191 297 HG13 VAL 37 3HG1 VAL 37 0.673 1.964 6.775 298 HG21 VAL 37 3HG2 VAL 37 -1.058 3.995 6.153 299 HG22 VAL 37 1HG2 VAL 37 -0.693 5.511 6.989 300 HG23 VAL 37 2HG2 VAL 37 -0.939 4.046 7.932 301 H ALA 38 H ALA 38 1.111 4.968 10.839 302 HA ALA 38 HA ALA 38 -0.532 7.339 10.042 303 HB1 ALA 38 3HB ALA 38 0.038 6.354 12.867 304 HB2 ALA 38 1HB ALA 38 -1.348 5.942 11.811 305 HB3 ALA 38 2HB ALA 38 -1.140 7.594 12.410 306 H ASP 39 H ASP 39 2.673 7.120 11.358 307 HA ASP 39 HA ASP 39 3.095 10.104 11.419 308 HB2 ASP 39 2HB ASP 39 4.841 7.634 11.931 309 HB3 ASP 39 1HB ASP 39 5.595 9.144 11.520 310 H ASP 40 H ASP 40 4.347 7.514 9.209 311 HA ASP 40 HA ASP 40 5.255 9.241 7.319 312 HB2 ASP 40 2HB ASP 40 4.535 6.277 7.328 313 HB3 ASP 40 1HB ASP 40 5.294 6.987 5.927 314 HA PRO 41 HA PRO 41 2.025 10.263 4.107 315 HB2 PRO 41 2HB PRO 41 4.505 10.012 2.285 316 HB3 PRO 41 1HB PRO 41 3.259 11.257 2.242 317 HG2 PRO 41 2HG PRO 41 5.597 11.850 3.464 318 HG3 PRO 41 1HG PRO 41 4.134 12.215 4.407 319 HD2 PRO 41 2HD PRO 41 5.903 9.706 4.676 320 HD3 PRO 41 1HD PRO 41 5.296 10.826 5.927 321 H VAL 42 H VAL 42 0.707 9.110 2.715 322 HA VAL 42 HA VAL 42 1.725 6.421 1.653 323 HB VAL 42 HB VAL 42 -1.065 7.218 2.616 324 HG11 VAL 42 1HG1 VAL 42 -1.211 5.420 0.857 325 HG12 VAL 42 2HG1 VAL 42 -1.580 4.755 2.444 326 HG13 VAL 42 3HG1 VAL 42 0.026 4.462 1.706 327 HG21 VAL 42 3HG2 VAL 42 -0.476 5.369 4.413 328 HG22 VAL 42 1HG2 VAL 42 0.342 6.932 4.601 329 HG23 VAL 42 2HG2 VAL 42 1.214 5.559 3.909 330 H VAL 43 H VAL 43 1.731 5.903 -0.359 331 HA VAL 43 HA VAL 43 0.438 7.686 -2.453 332 HB VAL 43 HB VAL 43 2.084 7.074 -4.014 333 HG11 VAL 43 1HG1 VAL 43 3.003 8.734 -2.283 334 HG12 VAL 43 2HG1 VAL 43 4.256 7.741 -3.044 335 HG13 VAL 43 3HG1 VAL 43 3.709 7.380 -1.403 336 HG21 VAL 43 3HG2 VAL 43 4.010 5.465 -3.495 337 HG22 VAL 43 1HG2 VAL 43 2.459 4.654 -3.658 338 HG23 VAL 43 2HG2 VAL 43 3.133 4.997 -2.037 339 H LEU 44 H LEU 44 -1.529 7.085 -3.064 340 HA LEU 44 HA LEU 44 -2.116 4.110 -3.610 341 HG LEU 44 HG LEU 44 -4.166 6.946 -2.327 342 HB2 LEU 44 2HB LEU 44 -3.991 4.094 -2.155 343 HB3 LEU 44 1HB LEU 44 -2.592 4.539 -1.266 344 HD11 LEU 44 1HD1 LEU 44 -5.998 6.659 -0.580 345 HD12 LEU 44 2HD1 LEU 44 -5.428 5.005 -0.272 346 HD13 LEU 44 3HD1 LEU 44 -6.069 5.445 -1.854 347 HD21 LEU 44 3HD2 LEU 44 -2.284 7.155 -0.618 348 HD22 LEU 44 1HD2 LEU 44 -3.262 6.257 0.541 349 HD23 LEU 44 2HD2 LEU 44 -3.827 7.837 -0.101 350 H GLY 45 H GLY 45 -4.650 3.869 -4.086 351 HA2 GLY 45 2HA GLY 45 -4.816 5.092 -6.906 352 HA3 GLY 45 1HA GLY 45 -5.398 3.489 -6.475 353 H ARG 46 H ARG 46 -7.273 4.624 -7.725 354 HA ARG 46 HA ARG 46 -9.032 6.326 -5.891 355 HE ARG 46 HE ARG 46 -11.410 8.666 -7.650 356 HB2 ARG 46 2HB ARG 46 -9.398 5.785 -8.864 357 HB3 ARG 46 1HB ARG 46 -10.639 6.479 -7.868 358 HG2 ARG 46 2HG ARG 46 -7.821 7.710 -8.166 359 HG3 ARG 46 1HG ARG 46 -9.186 8.193 -9.142 360 HD2 ARG 46 2HD ARG 46 -9.116 8.484 -6.040 361 HD3 ARG 46 1HD ARG 46 -8.598 9.726 -7.175 362 HH11 ARG 46 2HH1 ARG 46 -9.572 11.040 -5.832 363 HH12 ARG 46 1HH1 ARG 46 -11.070 12.027 -5.565 364 HH21 ARG 46 1HH2 ARG 46 -13.087 9.773 -7.123 365 HH22 ARG 46 2HH2 ARG 46 -12.889 11.372 -6.263 366 H THR 47 H THR 47 -9.028 2.951 -7.017 367 HA THR 47 HA THR 47 -11.433 2.263 -5.550 368 HB THR 47 HB THR 47 -8.845 0.619 -5.865 369 HG1 THR 47 HG1 THR 47 -11.088 -0.014 -7.264 370 HG21 THR 47 3HG2 THR 47 -10.180 -0.552 -4.213 371 HG22 THR 47 1HG2 THR 47 -10.565 -1.311 -5.756 372 HG23 THR 47 2HG2 THR 47 -11.723 -0.172 -5.018 373 H THR 48 H THR 48 -8.236 1.651 -4.013 374 HA THR 48 HA THR 48 -8.959 1.971 -1.307 375 HB THR 48 HB THR 48 -6.513 2.550 -0.908 376 HG1 THR 48 HG1 THR 48 -6.456 3.773 -2.884 377 HG21 THR 48 3HG2 THR 48 -6.696 0.232 -2.903 378 HG22 THR 48 1HG2 THR 48 -7.123 0.130 -1.179 379 HG23 THR 48 2HG2 THR 48 -5.475 0.545 -1.659 380 H PHE 49 H PHE 49 -9.029 4.720 -3.344 381 HA PHE 49 HA PHE 49 -8.575 6.658 -0.982 382 HD1 PHE 49 HD2 PHE 49 -9.954 9.437 -3.488 383 HD2 PHE 49 HD1 PHE 49 -6.298 8.764 -1.335 384 HE1 PHE 49 HE2 PHE 49 -10.027 11.745 -2.615 385 HE2 PHE 49 HE1 PHE 49 -6.331 11.104 -0.573 386 HZ PHE 49 HZ PHE 49 -8.193 12.563 -1.145 387 HB2 PHE 49 2HB PHE 49 -7.084 7.106 -2.983 388 HB3 PHE 49 1HB PHE 49 -8.507 7.393 -3.965 389 H GLU 50 H GLU 50 -10.945 5.798 -3.509 390 HA GLU 50 HA GLU 50 -12.953 7.772 -2.469 391 HB2 GLU 50 2HB GLU 50 -13.213 5.429 -4.445 392 HB3 GLU 50 1HB GLU 50 -14.529 6.494 -3.987 393 HG2 GLU 50 2HG GLU 50 -13.168 8.509 -4.863 394 HG3 GLU 50 1HG GLU 50 -11.890 7.417 -5.323 395 H SER 51 H SER 51 -11.909 4.567 -1.399 396 HA SER 51 HA SER 51 -13.776 4.689 0.948 397 HG SER 51 HG SER 51 -10.353 2.976 1.714 398 HB2 SER 51 2HB SER 51 -12.425 3.051 2.003 399 HB3 SER 51 1HB SER 51 -12.557 2.608 0.309 400 H MET 52 H MET 52 -10.286 5.264 1.251 401 HA MET 52 HA MET 52 -10.320 6.602 3.632 402 HB2 MET 52 2HB MET 52 -8.389 7.305 1.326 403 HB3 MET 52 1HB MET 52 -8.109 7.647 3.056 404 HG2 MET 52 2HG MET 52 -7.829 5.394 3.678 405 HG3 MET 52 1HG MET 52 -8.199 4.796 2.035 406 HE1 MET 52 3HE MET 52 -5.695 3.825 1.958 407 HE2 MET 52 1HE MET 52 -5.366 4.503 3.583 408 HE3 MET 52 2HE MET 52 -4.230 4.831 2.235 409 H ARG 53 H ARG 53 -11.547 8.217 1.113 410 HA ARG 53 HA ARG 53 -11.545 11.072 1.932 411 HE ARG 53 HE ARG 53 -14.846 10.455 -2.428 412 HB2 ARG 53 2HB ARG 53 -12.460 10.006 -0.257 413 HB3 ARG 53 1HB ARG 53 -13.710 9.225 0.715 414 HG2 ARG 53 2HG ARG 53 -14.356 11.649 1.519 415 HG3 ARG 53 1HG ARG 53 -13.279 12.243 0.284 416 HD2 ARG 53 2HD ARG 53 -15.635 10.293 -0.217 417 HD3 ARG 53 1HD ARG 53 -15.881 12.011 -0.173 418 HH11 ARG 53 2HH1 ARG 53 -14.062 13.498 -0.996 419 HH12 ARG 53 1HH1 ARG 53 -14.012 14.393 -2.570 420 HH21 ARG 53 1HH2 ARG 53 -15.084 11.499 -4.155 421 HH22 ARG 53 2HH2 ARG 53 -14.691 13.292 -4.292 422 H ASP 54 H ASP 54 -13.176 8.166 3.246 423 HA ASP 54 HA ASP 54 -14.433 9.756 5.466 424 HB2 ASP 54 2HB ASP 54 -15.283 7.408 4.184 425 HB3 ASP 54 1HB ASP 54 -14.470 6.739 5.575 426 H ASP 55 H ASP 55 -12.098 6.907 5.541 427 HA ASP 55 HA ASP 55 -10.883 8.177 7.997 428 HB2 ASP 55 2HB ASP 55 -10.342 6.153 8.834 429 HB3 ASP 55 1HB ASP 55 -11.937 5.925 8.139 430 H LEU 56 H LEU 56 -9.199 9.448 7.585 431 HA LEU 56 HA LEU 56 -7.352 9.102 5.439 432 HG LEU 56 HG LEU 56 -7.382 12.742 6.307 433 HB2 LEU 56 2HB LEU 56 -6.562 10.796 7.822 434 HB3 LEU 56 1HB LEU 56 -6.082 10.919 6.163 435 HD11 LEU 56 1HD1 LEU 56 -8.451 11.553 4.397 436 HD12 LEU 56 2HD1 LEU 56 -9.653 12.508 5.277 437 HD13 LEU 56 3HD1 LEU 56 -9.595 10.761 5.496 438 HD21 LEU 56 3HD2 LEU 56 -9.356 13.120 7.672 439 HD22 LEU 56 1HD2 LEU 56 -8.106 12.361 8.678 440 HD23 LEU 56 2HD2 LEU 56 -9.484 11.391 8.087 441 HA PRO 57 HA PRO 57 -4.374 6.177 7.187 442 HB2 PRO 57 2HB PRO 57 -2.278 6.307 5.406 443 HB3 PRO 57 1HB PRO 57 -3.856 5.575 5.059 444 HG2 PRO 57 2HG PRO 57 -2.878 8.410 4.330 445 HG3 PRO 57 1HG PRO 57 -3.703 7.245 3.277 446 HD2 PRO 57 2HD PRO 57 -5.078 9.280 4.565 447 HD3 PRO 57 1HD PRO 57 -5.870 7.700 4.269 448 H GLY 58 H GLY 58 -2.040 8.759 6.223 449 HA2 GLY 58 2HA GLY 58 -1.340 9.159 9.208 450 HA3 GLY 58 1HA GLY 58 -0.057 8.749 8.064 451 H SER 59 H SER 59 1.030 10.658 8.574 452 HA SER 59 HA SER 59 0.090 13.343 8.383 453 HG SER 59 HG SER 59 3.495 14.242 8.583 454 HB2 SER 59 2HB SER 59 2.298 12.466 9.258 455 HB3 SER 59 1HB SER 59 2.868 12.285 7.589 456 H ALA 60 H ALA 60 0.405 11.301 5.566 457 HA ALA 60 HA ALA 60 -0.890 13.491 4.061 458 HB1 ALA 60 3HB ALA 60 1.295 14.303 3.561 459 HB2 ALA 60 1HB ALA 60 0.852 13.442 2.074 460 HB3 ALA 60 2HB ALA 60 1.974 12.702 3.245 461 H GLN 61 H GLN 61 -1.682 13.164 2.057 462 HA GLN 61 HA GLN 61 -2.181 10.262 1.181 463 HB2 GLN 61 2HB GLN 61 -4.051 12.418 2.038 464 HB3 GLN 61 1HB GLN 61 -4.392 12.030 0.377 465 HG2 GLN 61 2HG GLN 61 -4.787 9.647 0.909 466 HG3 GLN 61 1HG GLN 61 -4.118 9.844 2.515 467 HE21 GLN 61 1HE2 GLN 61 -6.934 9.102 1.452 468 HE22 GLN 61 2HE2 GLN 61 -7.900 10.030 2.698 469 H ILE 62 H ILE 62 -1.205 9.890 -0.624 470 HA ILE 62 HA ILE 62 -0.982 11.967 -2.883 471 HB ILE 62 HB ILE 62 0.784 9.641 -1.931 472 HG12 ILE 62 2HG1 ILE 62 1.703 12.469 -2.338 473 HG13 ILE 62 1HG1 ILE 62 0.879 12.069 -0.841 474 HG21 ILE 62 1HG2 ILE 62 2.374 10.498 -3.869 475 HG22 ILE 62 2HG2 ILE 62 0.868 11.188 -4.562 476 HG23 ILE 62 3HG2 ILE 62 1.029 9.425 -4.306 477 HD11 ILE 62 3HD1 ILE 62 3.284 11.966 -0.481 478 HD12 ILE 62 1HD1 ILE 62 3.546 10.919 -1.882 479 HD13 ILE 62 2HD1 ILE 62 2.719 10.290 -0.419 480 H VAL 63 H VAL 63 -2.609 11.478 -4.413 481 HA VAL 63 HA VAL 63 -3.030 8.568 -5.114 482 HB VAL 63 HB VAL 63 -4.589 10.921 -6.191 483 HG11 VAL 63 1HG1 VAL 63 -4.527 8.846 -7.785 484 HG12 VAL 63 2HG1 VAL 63 -6.138 9.178 -7.130 485 HG13 VAL 63 3HG1 VAL 63 -5.120 7.875 -6.441 486 HG21 VAL 63 3HG2 VAL 63 -5.524 10.718 -4.018 487 HG22 VAL 63 1HG2 VAL 63 -4.892 9.086 -3.786 488 HG23 VAL 63 2HG2 VAL 63 -6.368 9.324 -4.709 489 H MET 64 H MET 64 -1.767 7.522 -6.442 490 HA MET 64 HA MET 64 -0.350 8.758 -8.785 491 HB2 MET 64 2HB MET 64 -0.511 5.957 -7.532 492 HB3 MET 64 1HB MET 64 -0.014 6.110 -9.176 493 HG2 MET 64 2HG MET 64 1.655 8.076 -7.993 494 HG3 MET 64 1HG MET 64 1.520 6.854 -6.730 495 HE1 MET 64 3HE MET 64 3.323 6.418 -10.954 496 HE2 MET 64 1HE MET 64 2.338 7.784 -10.350 497 HE3 MET 64 2HE MET 64 1.545 6.286 -10.927 498 H SER 65 H SER 65 -1.895 9.611 -10.038 499 HA SER 65 HA SER 65 -2.909 7.842 -12.163 500 HG SER 65 HG SER 65 -4.448 9.790 -9.763 501 HB2 SER 65 2HB SER 65 -5.409 8.355 -12.005 502 HB3 SER 65 1HB SER 65 -4.852 7.573 -10.547 503 H ARG 66 H ARG 66 -4.776 9.794 -13.345 504 HA ARG 66 HA ARG 66 -3.024 12.314 -13.600 505 HE ARG 66 HE ARG 66 -1.528 14.604 -17.262 506 HB2 ARG 66 2HB ARG 66 -3.226 10.683 -15.735 507 HB3 ARG 66 1HB ARG 66 -4.758 11.478 -15.954 508 HG2 ARG 66 2HG ARG 66 -3.241 12.724 -17.298 509 HG3 ARG 66 1HG ARG 66 -3.479 13.754 -15.897 510 HD2 ARG 66 2HD ARG 66 -1.231 12.883 -14.932 511 HD3 ARG 66 1HD ARG 66 -1.065 11.830 -16.347 512 HH11 ARG 66 2HH1 ARG 66 1.092 12.640 -15.930 513 HH12 ARG 66 1HH1 ARG 66 2.319 13.713 -16.699 514 HH21 ARG 66 1HH2 ARG 66 -0.066 15.733 -18.130 515 HH22 ARG 66 2HH2 ARG 66 1.700 15.341 -17.899 516 H SER 67 H SER 67 -5.324 11.619 -11.801 517 HA SER 67 HA SER 67 -7.556 13.384 -12.451 518 HG SER 67 HG SER 67 -9.162 11.926 -9.960 519 HB2 SER 67 2HB SER 67 -7.497 11.247 -11.049 520 HB3 SER 67 1HB SER 67 -6.629 12.124 -9.778 521 H GLU 68 H GLU 68 -8.216 14.720 -10.183 522 HA GLU 68 HA GLU 68 -6.811 17.363 -10.459 523 HB2 GLU 68 2HB GLU 68 -9.210 16.475 -8.762 524 HB3 GLU 68 1HB GLU 68 -8.589 18.093 -8.813 525 HG2 GLU 68 2HG GLU 68 -9.034 17.402 -11.617 526 HG3 GLU 68 1HG GLU 68 -10.405 16.781 -10.715 527 H ARG 69 H ARG 69 -6.438 18.587 -8.292 528 HA ARG 69 HA ARG 69 -4.581 16.894 -6.511 529 HE ARG 69 HE ARG 69 -4.000 17.834 -9.493 530 HB2 ARG 69 2HB ARG 69 -4.511 19.921 -7.051 531 HB3 ARG 69 1HB ARG 69 -3.798 19.213 -5.636 532 HG2 ARG 69 2HG ARG 69 -1.902 19.002 -6.769 533 HG3 ARG 69 1HG ARG 69 -2.552 17.548 -7.459 534 HD2 ARG 69 2HD ARG 69 -2.720 20.388 -8.692 535 HD3 ARG 69 1HD ARG 69 -1.489 19.183 -9.108 536 HH11 ARG 69 2HH1 ARG 69 -2.626 20.711 -10.818 537 HH12 ARG 69 1HH1 ARG 69 -3.778 20.710 -12.234 538 HH21 ARG 69 1HH2 ARG 69 -5.217 17.774 -11.169 539 HH22 ARG 69 2HH2 ARG 69 -5.238 19.138 -12.363 540 H SER 70 H SER 70 -7.173 19.386 -6.074 541 HA SER 70 HA SER 70 -6.978 19.015 -3.086 542 HG SER 70 HG SER 70 -6.702 21.481 -2.947 543 HB2 SER 70 2HB SER 70 -8.743 20.829 -4.838 544 HB3 SER 70 1HB SER 70 -8.832 20.786 -3.085 545 H PHE 71 H PHE 71 -7.845 17.252 -2.277 546 HA PHE 71 HA PHE 71 -10.284 15.966 -3.555 547 HD1 PHE 71 HD2 PHE 71 -9.725 14.459 -5.272 548 HD2 PHE 71 HD1 PHE 71 -6.122 14.023 -2.963 549 HE1 PHE 71 HE2 PHE 71 -8.608 13.331 -7.183 550 HE2 PHE 71 HE1 PHE 71 -5.054 12.903 -4.862 551 HZ PHE 71 HZ PHE 71 -6.299 12.494 -6.935 552 HB2 PHE 71 2HB PHE 71 -8.035 14.804 -1.837 553 HB3 PHE 71 1HB PHE 71 -9.405 13.916 -2.439 554 H SER 72 H SER 72 -9.243 16.198 -0.084 555 HA SER 72 HA SER 72 -11.955 16.705 0.796 556 HG SER 72 HG SER 72 -13.698 15.230 1.128 557 HB2 SER 72 2HB SER 72 -11.262 13.770 0.815 558 HB3 SER 72 1HB SER 72 -11.998 14.366 2.285 559 H VAL 73 H VAL 73 -9.013 15.211 2.288 560 HA VAL 73 HA VAL 73 -9.286 17.174 4.605 561 HB VAL 73 HB VAL 73 -8.708 14.821 5.166 562 HG11 VAL 73 1HG1 VAL 73 -7.283 14.016 3.355 563 HG12 VAL 73 2HG1 VAL 73 -6.324 13.954 4.823 564 HG13 VAL 73 3HG1 VAL 73 -6.044 15.255 3.659 565 HG21 VAL 73 3HG2 VAL 73 -6.972 15.280 6.817 566 HG22 VAL 73 1HG2 VAL 73 -8.002 16.715 6.695 567 HG23 VAL 73 2HG2 VAL 73 -6.400 16.709 5.941 568 H ASP 74 H ASP 74 -7.705 18.854 4.959 569 HA ASP 74 HA ASP 74 -6.295 20.058 2.815 570 HB2 ASP 74 2HB ASP 74 -5.798 20.192 5.846 571 HB3 ASP 74 1HB ASP 74 -4.885 21.143 4.691 572 H THR 75 H THR 75 -4.809 17.451 4.865 573 HA THR 75 HA THR 75 -2.273 17.607 3.210 574 HB THR 75 HB THR 75 -2.082 17.077 5.624 575 HG1 THR 75 HG1 THR 75 -0.466 15.481 5.153 576 HG21 THR 75 3HG2 THR 75 -2.222 14.689 6.371 577 HG22 THR 75 1HG2 THR 75 -2.964 14.200 4.845 578 HG23 THR 75 2HG2 THR 75 -3.849 15.260 5.960 579 H ALA 76 H ALA 76 -4.690 17.044 1.692 580 HA ALA 76 HA ALA 76 -3.899 14.337 0.496 581 HB1 ALA 76 3HB ALA 76 -6.224 14.011 -0.270 582 HB2 ALA 76 1HB ALA 76 -6.725 15.486 0.629 583 HB3 ALA 76 2HB ALA 76 -6.039 14.081 1.494 584 H HIS 77 H HIS 77 -3.280 14.238 -1.357 585 HA HIS 77 HA HIS 77 -3.231 16.546 -3.369 586 HD1 HIS 77 HD1 HIS 77 -0.595 15.759 0.427 587 HD2 HIS 77 HD2 HIS 77 -1.602 18.954 -2.225 588 HE1 HIS 77 HE1 HIS 77 -0.166 18.008 1.569 589 HB2 HIS 77 2HB HIS 77 -0.868 15.059 -2.038 590 HB3 HIS 77 1HB HIS 77 -0.710 16.344 -3.230 591 H ARG 78 H ARG 78 -1.764 15.756 -5.301 592 HA ARG 78 HA ARG 78 -2.426 12.841 -6.016 593 HE ARG 78 HE ARG 78 -3.828 14.167 -11.105 594 HB2 ARG 78 2HB ARG 78 -4.237 14.409 -6.775 595 HB3 ARG 78 1HB ARG 78 -3.145 15.159 -7.905 596 HG2 ARG 78 2HG ARG 78 -3.909 12.161 -7.885 597 HG3 ARG 78 1HG ARG 78 -4.807 13.365 -8.774 598 HD2 ARG 78 2HD ARG 78 -1.854 12.625 -9.290 599 HD3 ARG 78 1HD ARG 78 -3.196 11.943 -10.147 600 HH11 ARG 78 2HH1 ARG 78 -0.711 14.180 -9.619 601 HH12 ARG 78 1HH1 ARG 78 0.021 15.292 -10.834 602 HH21 ARG 78 1HH2 ARG 78 -3.073 15.343 -12.473 603 HH22 ARG 78 2HH2 ARG 78 -1.345 16.001 -12.411 604 H ALA 79 H ALA 79 -0.660 11.821 -6.622 605 HA ALA 79 HA ALA 79 1.694 13.221 -7.911 606 HB1 ALA 79 3HB ALA 79 1.237 10.299 -7.019 607 HB2 ALA 79 1HB ALA 79 2.222 11.575 -6.223 608 HB3 ALA 79 2HB ALA 79 2.726 10.896 -7.771 609 H ALA 80 H ALA 80 2.418 12.847 -10.007 610 HA ALA 80 HA ALA 80 0.572 11.409 -11.983 611 HB1 ALA 80 3HB ALA 80 0.803 13.662 -12.745 612 HB2 ALA 80 1HB ALA 80 2.041 12.811 -13.687 613 HB3 ALA 80 2HB ALA 80 2.534 13.731 -12.303 614 H SER 81 H SER 81 3.844 11.096 -10.713 615 HA SER 81 HA SER 81 3.986 8.410 -12.075 616 HG SER 81 HG SER 81 6.504 8.977 -14.258 617 HB2 SER 81 2HB SER 81 5.577 10.739 -13.011 618 HB3 SER 81 1HB SER 81 6.664 9.642 -12.207 619 H VAL 82 H VAL 82 6.568 7.722 -11.148 620 HA VAL 82 HA VAL 82 6.125 7.499 -8.135 621 HB VAL 82 HB VAL 82 8.255 6.016 -9.744 622 HG11 VAL 82 1HG1 VAL 82 8.430 4.719 -7.452 623 HG12 VAL 82 2HG1 VAL 82 7.656 6.141 -6.723 624 HG13 VAL 82 3HG1 VAL 82 9.216 6.294 -7.543 625 HG21 VAL 82 3HG2 VAL 82 6.761 3.972 -8.815 626 HG22 VAL 82 1HG2 VAL 82 6.252 4.849 -10.265 627 HG23 VAL 82 2HG2 VAL 82 5.483 5.183 -8.694 628 H GLU 83 H GLU 83 8.777 8.697 -10.349 629 HA GLU 83 HA GLU 83 10.120 10.338 -8.474 630 HB2 GLU 83 2HB GLU 83 9.534 10.786 -11.452 631 HB3 GLU 83 1HB GLU 83 10.674 11.744 -10.533 632 HG2 GLU 83 2HG GLU 83 12.281 9.993 -10.327 633 HG3 GLU 83 1HG GLU 83 11.110 8.714 -10.426 634 H GLU 84 H GLU 84 7.267 11.853 -10.328 635 HA GLU 84 HA GLU 84 6.836 13.898 -8.341 636 HB2 GLU 84 2HB GLU 84 5.001 12.427 -10.303 637 HB3 GLU 84 1HB GLU 84 4.293 13.613 -9.243 638 HG2 GLU 84 2HG GLU 84 5.092 15.435 -10.364 639 HG3 GLU 84 1HG GLU 84 6.648 14.720 -10.727 640 H ALA 85 H ALA 85 6.211 10.615 -7.631 641 HA ALA 85 HA ALA 85 4.379 11.276 -5.282 642 HB1 ALA 85 3HB ALA 85 4.083 8.923 -4.898 643 HB2 ALA 85 1HB ALA 85 5.415 8.476 -5.975 644 HB3 ALA 85 2HB ALA 85 3.898 9.124 -6.647 645 H VAL 86 H VAL 86 7.746 10.306 -5.888 646 HA VAL 86 HA VAL 86 8.474 10.314 -2.961 647 HB VAL 86 HB VAL 86 10.066 9.955 -5.542 648 HG11 VAL 86 1HG1 VAL 86 11.338 10.293 -2.741 649 HG12 VAL 86 2HG1 VAL 86 11.602 11.329 -4.165 650 HG13 VAL 86 3HG1 VAL 86 12.164 9.654 -4.189 651 HG21 VAL 86 3HG2 VAL 86 9.778 8.199 -2.992 652 HG22 VAL 86 1HG2 VAL 86 10.679 7.748 -4.450 653 HG23 VAL 86 2HG2 VAL 86 8.913 7.902 -4.518 654 H ASP 87 H ASP 87 9.133 12.652 -5.691 655 HA ASP 87 HA ASP 87 10.075 14.768 -4.040 656 HB2 ASP 87 2HB ASP 87 8.774 14.649 -6.804 657 HB3 ASP 87 1HB ASP 87 8.913 16.212 -6.059 658 H ILE 88 H ILE 88 6.555 14.075 -4.524 659 HA ILE 88 HA ILE 88 5.986 16.508 -2.829 660 HB ILE 88 HB ILE 88 3.870 16.521 -2.798 661 HG12 ILE 88 2HG1 ILE 88 3.223 13.816 -4.098 662 HG13 ILE 88 1HG1 ILE 88 3.439 13.982 -2.373 663 HG21 ILE 88 1HG2 ILE 88 4.820 17.090 -5.103 664 HG22 ILE 88 2HG2 ILE 88 3.074 16.742 -5.087 665 HG23 ILE 88 3HG2 ILE 88 4.230 15.523 -5.683 666 HD11 ILE 88 3HD1 ILE 88 1.164 15.161 -3.986 667 HD12 ILE 88 1HD1 ILE 88 1.718 16.074 -2.560 668 HD13 ILE 88 2HD1 ILE 88 1.175 14.431 -2.368 669 H ALA 89 H ALA 89 6.274 13.069 -2.074 670 HA ALA 89 HA ALA 89 5.410 13.377 0.768 671 HB1 ALA 89 3HB ALA 89 7.188 11.286 -0.637 672 HB2 ALA 89 1HB ALA 89 5.486 11.106 -0.140 673 HB3 ALA 89 2HB ALA 89 6.752 11.232 1.091 674 H ALA 90 H ALA 90 8.715 13.448 -0.683 675 HA ALA 90 HA ALA 90 9.995 14.370 1.823 676 HB1 ALA 90 3HB ALA 90 10.877 14.298 -1.142 677 HB2 ALA 90 1HB ALA 90 11.218 13.105 0.139 678 HB3 ALA 90 2HB ALA 90 11.970 14.714 0.199 679 H SER 91 H SER 91 8.400 16.255 -0.653 680 HA SER 91 HA SER 91 9.448 18.916 0.295 681 HG SER 91 HG SER 91 7.432 20.345 -0.421 682 HB2 SER 91 2HB SER 91 8.708 18.465 -2.076 683 HB3 SER 91 1HB SER 91 7.068 18.139 -1.495 684 H LEU 92 H LEU 92 7.085 16.846 1.677 685 HA LEU 92 HA LEU 92 5.654 19.190 3.001 686 HG LEU 92 HG LEU 92 5.009 15.805 1.686 687 HB2 LEU 92 2HB LEU 92 3.860 17.698 3.802 688 HB3 LEU 92 1HB LEU 92 3.925 18.202 2.144 689 HD11 LEU 92 1HD1 LEU 92 3.417 15.228 4.262 690 HD12 LEU 92 2HD1 LEU 92 5.169 15.029 4.035 691 HD13 LEU 92 3HD1 LEU 92 4.066 14.031 3.107 692 HD21 LEU 92 3HD2 LEU 92 2.752 14.906 1.180 693 HD22 LEU 92 1HD2 LEU 92 2.809 16.613 0.723 694 HD23 LEU 92 2HD2 LEU 92 1.978 16.124 2.223 695 H ASP 93 H ASP 93 6.625 16.001 4.337 696 HA ASP 93 HA ASP 93 8.980 16.913 5.532 697 HB2 ASP 93 2HB ASP 93 6.715 17.559 7.449 698 HB3 ASP 93 1HB ASP 93 8.050 16.704 8.159 699 H ALA 94 H ALA 94 9.664 14.833 4.891 700 HA ALA 94 HA ALA 94 9.199 12.610 6.826 701 HB1 ALA 94 3HB ALA 94 8.067 12.253 3.964 702 HB2 ALA 94 1HB ALA 94 7.122 12.414 5.465 703 HB3 ALA 94 2HB ALA 94 8.140 10.988 5.222 704 H GLU 95 H GLU 95 10.622 10.976 6.831 705 HA GLU 95 HA GLU 95 12.901 10.901 4.820 706 HB2 GLU 95 2HB GLU 95 13.018 8.897 7.050 707 HB3 GLU 95 1HB GLU 95 14.272 9.739 6.178 708 HG2 GLU 95 2HG GLU 95 13.713 11.851 7.640 709 HG3 GLU 95 1HG GLU 95 12.640 10.798 8.559 710 H THR 96 H THR 96 10.943 8.198 6.320 711 HA THR 96 HA THR 96 10.802 6.820 3.630 712 HB THR 96 HB THR 96 9.402 5.079 5.008 713 HG1 THR 96 HG1 THR 96 8.906 6.229 6.820 714 HG21 THR 96 3HG2 THR 96 11.397 4.046 6.069 715 HG22 THR 96 1HG2 THR 96 12.323 5.539 5.813 716 HG23 THR 96 2HG2 THR 96 11.757 4.585 4.410 717 H ALA 97 H ALA 97 8.888 6.124 2.684 718 HA ALA 97 HA ALA 97 6.237 7.137 3.783 719 HB1 ALA 97 3HB ALA 97 5.485 7.779 1.390 720 HB2 ALA 97 1HB ALA 97 7.175 7.581 0.854 721 HB3 ALA 97 2HB ALA 97 6.769 8.803 2.077 722 H TYR 98 H TYR 98 4.337 6.062 2.694 723 HA TYR 98 HA TYR 98 4.914 3.139 2.023 724 HD1 TYR 98 HD1 TYR 98 5.006 0.917 4.061 725 HD2 TYR 98 HD2 TYR 98 4.349 4.736 5.838 726 HE1 TYR 98 HE1 TYR 98 6.738 0.415 5.747 727 HE2 TYR 98 HE2 TYR 98 5.973 4.189 7.607 728 HH TYR 98 HH TYR 98 7.772 2.977 7.953 729 HB2 TYR 98 2HB TYR 98 2.875 4.064 4.138 730 HB3 TYR 98 1HB TYR 98 2.937 2.435 3.527 731 H VAL 99 H VAL 99 2.769 1.945 1.392 732 HA VAL 99 HA VAL 99 0.949 3.681 -0.376 733 HB VAL 99 HB VAL 99 1.795 3.157 -2.300 734 HG11 VAL 99 1HG1 VAL 99 4.054 3.189 -1.440 735 HG12 VAL 99 2HG1 VAL 99 3.901 2.153 -2.848 736 HG13 VAL 99 3HG1 VAL 99 4.057 1.487 -1.222 737 HG21 VAL 99 3HG2 VAL 99 0.390 1.287 -2.692 738 HG22 VAL 99 1HG2 VAL 99 1.551 0.181 -1.970 739 HG23 VAL 99 2HG2 VAL 99 1.977 1.004 -3.470 740 H ILE 100 H ILE 100 -1.146 3.091 0.783 741 HA ILE 100 HA ILE 100 -1.710 0.329 1.347 742 HB ILE 100 HB ILE 100 -3.961 2.276 0.662 743 HG12 ILE 100 2HG1 ILE 100 -2.838 3.176 2.593 744 HG13 ILE 100 1HG1 ILE 100 -4.297 2.393 3.161 745 HG21 ILE 100 1HG2 ILE 100 -4.195 -0.344 2.287 746 HG22 ILE 100 2HG2 ILE 100 -4.692 -0.226 0.598 747 HG23 ILE 100 3HG2 ILE 100 -5.498 0.766 1.824 748 HD11 ILE 100 3HD1 ILE 100 -2.493 1.964 4.748 749 HD12 ILE 100 1HD1 ILE 100 -1.478 1.305 3.449 750 HD13 ILE 100 2HD1 ILE 100 -2.940 0.416 3.950 751 H GLY 101 H GLY 101 -2.612 1.770 -1.696 752 HA2 GLY 101 2HA GLY 101 -2.315 0.848 -3.844 753 HA3 GLY 101 1HA GLY 101 -1.401 -0.425 -3.134 754 H GLY 102 H GLY 102 -2.376 -2.340 -4.801 755 HA2 GLY 102 2HA GLY 102 -4.537 -0.372 -5.825 756 HA3 GLY 102 1HA GLY 102 -2.956 -0.290 -6.427 757 H ALA 103 H ALA 103 -5.926 -1.760 -7.125 758 HA ALA 103 HA ALA 103 -5.611 -3.102 -9.423 759 HB1 ALA 103 3HB ALA 103 -7.282 -1.512 -10.493 760 HB2 ALA 103 1HB ALA 103 -6.801 -0.186 -9.469 761 HB3 ALA 103 2HB ALA 103 -7.623 -1.555 -8.776 762 H ALA 104 H ALA 104 -4.415 0.238 -9.600 763 HA ALA 104 HA ALA 104 -2.452 -0.621 -11.799 764 HB1 ALA 104 3HB ALA 104 -2.152 1.792 -12.319 765 HB2 ALA 104 1HB ALA 104 -3.342 2.232 -11.069 766 HB3 ALA 104 2HB ALA 104 -3.850 1.299 -12.505 767 H ILE 105 H ILE 105 -2.651 0.557 -8.448 768 HA ILE 105 HA ILE 105 -0.079 1.846 -8.432 769 HB ILE 105 HB ILE 105 -1.257 0.921 -5.824 770 HG12 ILE 105 2HG1 ILE 105 -3.224 1.912 -6.764 771 HG13 ILE 105 1HG1 ILE 105 -2.520 2.974 -5.622 772 HG21 ILE 105 1HG2 ILE 105 -0.260 2.866 -4.834 773 HG22 ILE 105 2HG2 ILE 105 0.339 3.457 -6.387 774 HG23 ILE 105 3HG2 ILE 105 0.998 1.975 -5.664 775 HD11 ILE 105 3HD1 ILE 105 -1.504 3.637 -8.387 776 HD12 ILE 105 1HD1 ILE 105 -2.477 4.647 -7.282 777 HD13 ILE 105 2HD1 ILE 105 -3.266 3.471 -8.368 778 H TYR 106 H TYR 106 -0.521 -1.003 -6.237 779 HA TYR 106 HA TYR 106 2.230 -1.747 -6.031 780 HD1 TYR 106 HD1 TYR 106 2.890 -4.672 -4.785 781 HD2 TYR 106 HD2 TYR 106 -0.453 -2.372 -3.363 782 HE1 TYR 106 HE1 TYR 106 3.433 -5.274 -2.481 783 HE2 TYR 106 HE2 TYR 106 0.160 -2.925 -1.051 784 HH TYR 106 HH TYR 106 2.632 -4.091 0.148 785 HB2 TYR 106 2HB TYR 106 -0.393 -3.236 -5.736 786 HB3 TYR 106 1HB TYR 106 0.905 -4.258 -6.184 787 H ALA 107 H ALA 107 0.177 -2.667 -8.822 788 HA ALA 107 HA ALA 107 2.174 -4.342 -10.224 789 HB1 ALA 107 3HB ALA 107 -0.285 -2.751 -11.217 790 HB2 ALA 107 1HB ALA 107 -0.293 -4.434 -10.695 791 HB3 ALA 107 2HB ALA 107 0.561 -3.991 -12.164 792 H LEU 108 H LEU 108 1.332 -0.871 -10.795 793 HA LEU 108 HA LEU 108 3.769 -0.411 -12.434 794 HG LEU 108 HG LEU 108 2.401 1.992 -9.903 795 HB2 LEU 108 2HB LEU 108 3.068 1.658 -12.844 796 HB3 LEU 108 1HB LEU 108 1.529 1.031 -12.364 797 HD11 LEU 108 1HD1 LEU 108 4.592 2.843 -11.096 798 HD12 LEU 108 2HD1 LEU 108 3.719 4.009 -10.112 799 HD13 LEU 108 3HD1 LEU 108 3.579 4.064 -11.880 800 HD21 LEU 108 3HD2 LEU 108 0.237 2.653 -10.783 801 HD22 LEU 108 1HD2 LEU 108 0.988 3.643 -12.079 802 HD23 LEU 108 2HD2 LEU 108 1.134 4.114 -10.373 803 H PHE 109 H PHE 109 3.191 -0.053 -8.941 804 HA PHE 109 HA PHE 109 5.835 1.095 -8.460 805 HD1 PHE 109 HD2 PHE 109 6.803 1.900 -5.957 806 HD2 PHE 109 HD1 PHE 109 2.703 2.575 -6.977 807 HE1 PHE 109 HE2 PHE 109 7.081 4.268 -5.456 808 HE2 PHE 109 HE1 PHE 109 2.973 4.969 -6.438 809 HZ PHE 109 HZ PHE 109 5.190 5.823 -5.697 810 HB2 PHE 109 2HB PHE 109 3.525 0.236 -6.694 811 HB3 PHE 109 1HB PHE 109 5.047 -0.007 -5.936 812 H GLN 110 H GLN 110 4.991 -2.332 -8.402 813 HA GLN 110 HA GLN 110 6.818 -3.678 -7.004 814 HB2 GLN 110 2HB GLN 110 6.206 -4.180 -9.972 815 HB3 GLN 110 1HB GLN 110 7.157 -5.258 -9.020 816 HG2 GLN 110 2HG GLN 110 4.874 -5.015 -7.394 817 HG3 GLN 110 1HG GLN 110 4.213 -4.814 -9.001 818 HE21 GLN 110 1HE2 GLN 110 5.216 -6.601 -10.571 819 HE22 GLN 110 2HE2 GLN 110 5.083 -8.278 -9.807 820 HA PRO 111 HA PRO 111 11.145 -3.206 -9.014 821 HB2 PRO 111 2HB PRO 111 11.263 -1.173 -11.143 822 HB3 PRO 111 1HB PRO 111 11.531 -2.924 -11.244 823 HG2 PRO 111 2HG PRO 111 9.315 -1.613 -12.430 824 HG3 PRO 111 1HG PRO 111 9.377 -3.346 -12.007 825 HD2 PRO 111 2HD PRO 111 8.162 -1.062 -10.363 826 HD3 PRO 111 1HD PRO 111 7.464 -2.649 -10.755 827 H HIS 112 H HIS 112 9.257 -0.540 -8.107 828 HA HIS 112 HA HIS 112 11.630 1.360 -7.692 829 HD1 HIS 112 HD1 HIS 112 11.553 2.866 -10.120 830 HD2 HIS 112 HD2 HIS 112 7.409 1.841 -9.906 831 HE1 HIS 112 HE1 HIS 112 10.475 2.960 -12.475 832 HB2 HIS 112 2HB HIS 112 8.639 2.049 -7.574 833 HB3 HIS 112 1HB HIS 112 9.993 3.151 -7.638 834 H LEU 113 H LEU 113 9.508 -0.547 -5.640 835 HA LEU 113 HA LEU 113 9.584 1.188 -3.268 836 HG LEU 113 HG LEU 113 6.972 -1.263 -2.265 837 HB2 LEU 113 2HB LEU 113 9.291 -1.902 -3.443 838 HB3 LEU 113 1HB LEU 113 9.122 -1.001 -1.964 839 HD11 LEU 113 1HD1 LEU 113 5.789 0.697 -3.435 840 HD12 LEU 113 2HD1 LEU 113 7.378 1.201 -4.031 841 HD13 LEU 113 3HD1 LEU 113 7.050 1.179 -2.293 842 HD21 LEU 113 3HD2 LEU 113 7.156 -1.261 -5.316 843 HD22 LEU 113 1HD2 LEU 113 5.752 -1.719 -4.303 844 HD23 LEU 113 2HD2 LEU 113 7.226 -2.698 -4.281 845 H ASP 114 H ASP 114 10.628 0.992 -1.275 846 HA ASP 114 HA ASP 114 13.321 -0.337 -0.984 847 HB2 ASP 114 2HB ASP 114 12.890 1.771 0.215 848 HB3 ASP 114 1HB ASP 114 11.464 1.115 1.000 849 H ARG 115 H ARG 115 10.058 -0.920 0.487 850 HA ARG 115 HA ARG 115 10.548 -3.942 0.256 851 HE ARG 115 HE ARG 115 12.407 -1.321 3.706 852 HB2 ARG 115 2HB ARG 115 9.841 -2.365 2.811 853 HB3 ARG 115 1HB ARG 115 9.395 -4.049 2.678 854 HG2 ARG 115 2HG ARG 115 11.600 -4.846 2.650 855 HG3 ARG 115 1HG ARG 115 12.308 -3.326 2.122 856 HD2 ARG 115 2HD ARG 115 11.252 -3.972 4.935 857 HD3 ARG 115 1HD ARG 115 12.920 -3.844 4.431 858 HH11 ARG 115 2HH1 ARG 115 10.587 -2.773 6.276 859 HH12 ARG 115 1HH1 ARG 115 10.184 -1.116 6.953 860 HH21 ARG 115 1HH2 ARG 115 11.986 0.321 4.412 861 HH22 ARG 115 2HH2 ARG 115 10.908 0.643 5.871 862 H MET 116 H MET 116 8.712 -5.303 0.312 863 HA MET 116 HA MET 116 5.983 -3.985 -0.268 864 HB2 MET 116 2HB MET 116 7.301 -6.500 -1.376 865 HB3 MET 116 1HB MET 116 5.559 -6.323 -1.400 866 HG2 MET 116 2HG MET 116 5.773 -4.358 -2.923 867 HG3 MET 116 1HG MET 116 7.508 -4.247 -2.592 868 HE1 MET 116 3HE MET 116 4.894 -5.944 -5.150 869 HE2 MET 116 1HE MET 116 4.731 -6.795 -3.579 870 HE3 MET 116 2HE MET 116 5.438 -7.631 -4.978 871 H VAL 117 H VAL 117 5.390 -3.768 1.842 872 HA VAL 117 HA VAL 117 4.987 -6.031 3.748 873 HB VAL 117 HB VAL 117 4.166 -3.115 3.736 874 HG11 VAL 117 1HG1 VAL 117 2.621 -4.394 5.357 875 HG12 VAL 117 2HG1 VAL 117 3.690 -3.256 6.172 876 HG13 VAL 117 3HG1 VAL 117 4.074 -4.994 6.182 877 HG21 VAL 117 3HG2 VAL 117 6.335 -4.695 5.277 878 HG22 VAL 117 1HG2 VAL 117 6.089 -2.954 5.487 879 HG23 VAL 117 2HG2 VAL 117 6.676 -3.618 3.935 880 H LEU 118 H LEU 118 3.723 -7.553 2.796 881 HA LEU 118 HA LEU 118 0.826 -6.903 2.021 882 HG LEU 118 HG LEU 118 -0.276 -9.062 1.055 883 HB2 LEU 118 2HB LEU 118 2.134 -8.076 0.385 884 HB3 LEU 118 1HB LEU 118 2.744 -9.259 1.524 885 HD11 LEU 118 1HD1 LEU 118 1.796 -10.244 -0.888 886 HD12 LEU 118 2HD1 LEU 118 0.308 -9.301 -1.195 887 HD13 LEU 118 3HD1 LEU 118 0.187 -10.981 -0.715 888 HD21 LEU 118 3HD2 LEU 118 0.689 -10.629 2.877 889 HD22 LEU 118 1HD2 LEU 118 1.587 -11.473 1.636 890 HD23 LEU 118 2HD2 LEU 118 -0.213 -11.429 1.609 891 H SER 119 H SER 119 -0.914 -8.081 2.938 892 HA SER 119 HA SER 119 -0.413 -9.648 5.561 893 HG SER 119 HG SER 119 -0.193 -6.914 5.853 894 HB2 SER 119 2HB SER 119 -2.367 -7.305 5.132 895 HB3 SER 119 1HB SER 119 -2.539 -8.435 6.446 896 H ARG 120 H ARG 120 -0.934 -11.710 5.034 897 HA ARG 120 HA ARG 120 -2.964 -12.319 2.891 898 HE ARG 120 HE ARG 120 0.681 -16.129 1.416 899 HB2 ARG 120 2HB ARG 120 -1.652 -14.530 4.517 900 HB3 ARG 120 1HB ARG 120 -2.333 -14.615 2.913 901 HG2 ARG 120 2HG ARG 120 0.206 -12.938 3.346 902 HG3 ARG 120 1HG ARG 120 0.350 -14.625 3.554 903 HD2 ARG 120 2HD ARG 120 -0.721 -13.450 0.884 904 HD3 ARG 120 1HD ARG 120 0.964 -13.717 1.240 905 HH11 ARG 120 2HH1 ARG 120 -2.227 -14.572 0.299 906 HH12 ARG 120 1HH1 ARG 120 -2.975 -16.150 -0.215 907 HH21 ARG 120 1HH2 ARG 120 -0.202 -17.863 0.904 908 HH22 ARG 120 2HH2 ARG 120 -1.858 -17.959 0.140 909 H VAL 121 H VAL 121 -5.087 -12.389 3.457 910 HA VAL 121 HA VAL 121 -5.956 -12.982 6.290 911 HB VAL 121 HB VAL 121 -7.574 -11.725 4.036 912 HG11 VAL 121 1HG1 VAL 121 -8.934 -10.703 5.880 913 HG12 VAL 121 2HG1 VAL 121 -7.979 -11.541 7.092 914 HG13 VAL 121 3HG1 VAL 121 -9.016 -12.462 5.982 915 HG21 VAL 121 3HG2 VAL 121 -6.098 -9.969 4.185 916 HG22 VAL 121 1HG2 VAL 121 -5.415 -10.455 5.735 917 HG23 VAL 121 2HG2 VAL 121 -6.920 -9.548 5.676 918 HA PRO 122 HA PRO 122 -7.892 -16.926 4.656 919 HB2 PRO 122 2HB PRO 122 -8.477 -17.380 7.607 920 HB3 PRO 122 1HB PRO 122 -7.747 -18.465 6.416 921 HG2 PRO 122 2HG PRO 122 -6.166 -17.248 8.286 922 HG3 PRO 122 1HG PRO 122 -5.584 -17.342 6.602 923 HD2 PRO 122 2HD PRO 122 -6.941 -14.939 7.949 924 HD3 PRO 122 1HD PRO 122 -5.436 -15.019 6.972 925 H GLY 123 H GLY 123 -9.524 -14.619 4.500 926 HA2 GLY 123 2HA GLY 123 -12.327 -15.682 5.291 927 HA3 GLY 123 1HA GLY 123 -12.054 -14.041 4.836 928 H GLU 124 H GLU 124 -10.404 -15.819 2.698 929 HA GLU 124 HA GLU 124 -10.658 -16.356 0.370 930 HB2 GLU 124 2HB GLU 124 -12.469 -18.135 2.033 931 HB3 GLU 124 1HB GLU 124 -12.119 -18.484 0.357 932 HG2 GLU 124 2HG GLU 124 -9.747 -18.812 0.748 933 HG3 GLU 124 1HG GLU 124 -9.805 -18.075 2.343 934 H TYR 125 H TYR 125 -11.246 -14.729 -0.973 935 HA TYR 125 HA TYR 125 -14.235 -14.346 -1.563 936 HD1 TYR 125 HD2 TYR 125 -15.367 -12.745 0.655 937 HD2 TYR 125 HD1 TYR 125 -11.207 -11.691 0.450 938 HE1 TYR 125 HE2 TYR 125 -15.328 -12.333 3.093 939 HE2 TYR 125 HE1 TYR 125 -11.162 -11.404 2.879 940 HH TYR 125 HH TYR 125 -12.321 -11.346 4.704 941 HB2 TYR 125 2HB TYR 125 -12.335 -11.942 -1.558 942 HB3 TYR 125 1HB TYR 125 -14.064 -11.939 -1.624 943 H GLU 126 H GLU 126 -14.680 -14.544 -3.709 944 HA GLU 126 HA GLU 126 -13.003 -14.557 -5.912 945 HB2 GLU 126 2HB GLU 126 -15.727 -13.282 -6.263 946 HB3 GLU 126 1HB GLU 126 -14.874 -14.283 -7.380 947 HG2 GLU 126 2HG GLU 126 -15.736 -16.297 -6.480 948 HG3 GLU 126 1HG GLU 126 -15.789 -15.717 -4.827 949 H GLY 127 H GLY 127 -14.668 -11.528 -5.021 950 HA2 GLY 127 2HA GLY 127 -13.778 -9.286 -4.957 951 HA3 GLY 127 1HA GLY 127 -12.233 -9.923 -5.477 952 H ASP 128 H ASP 128 -13.403 -7.451 -6.050 953 HA ASP 128 HA ASP 128 -13.346 -7.475 -9.112 954 HB2 ASP 128 2HB ASP 128 -14.366 -5.375 -7.083 955 HB3 ASP 128 1HB ASP 128 -14.312 -5.138 -8.812 956 H THR 129 H THR 129 -11.446 -6.344 -6.386 957 HA THR 129 HA THR 129 -9.488 -4.894 -8.249 958 HB THR 129 HB THR 129 -9.248 -4.886 -5.200 959 HG1 THR 129 HG1 THR 129 -11.278 -4.169 -5.592 960 HG21 THR 129 3HG2 THR 129 -8.012 -2.845 -5.490 961 HG22 THR 129 1HG2 THR 129 -8.594 -2.623 -7.157 962 HG23 THR 129 2HG2 THR 129 -7.388 -3.878 -6.798 963 H TYR 130 H TYR 130 -7.809 -6.126 -8.868 964 HA TYR 130 HA TYR 130 -6.874 -8.490 -7.183 965 HD1 TYR 130 HD1 TYR 130 -9.462 -7.766 -9.949 966 HD2 TYR 130 HD2 TYR 130 -7.259 -11.264 -8.734 967 HE1 TYR 130 HE1 TYR 130 -11.516 -9.121 -10.061 968 HE2 TYR 130 HE2 TYR 130 -9.318 -12.605 -8.943 969 HH TYR 130 HH TYR 130 -12.163 -11.592 -8.792 970 HB2 TYR 130 2HB TYR 130 -6.810 -7.940 -10.204 971 HB3 TYR 130 1HB TYR 130 -6.022 -9.298 -9.452 972 H TYR 131 H TYR 131 -4.933 -8.811 -6.512 973 HA TYR 131 HA TYR 131 -2.849 -6.674 -6.646 974 HD1 TYR 131 HD2 TYR 131 -0.689 -9.868 -5.260 975 HD2 TYR 131 HD1 TYR 131 -2.075 -6.310 -3.326 976 HE1 TYR 131 HE2 TYR 131 1.508 -9.592 -4.240 977 HE2 TYR 131 HE1 TYR 131 0.071 -6.158 -2.139 978 HH TYR 131 HH TYR 131 2.126 -7.022 -1.868 979 HB2 TYR 131 2HB TYR 131 -3.667 -7.818 -4.543 980 HB3 TYR 131 1HB TYR 131 -3.111 -9.343 -5.114 981 HA PRO 132 HA PRO 132 -0.298 -8.951 -9.684 982 HB2 PRO 132 2HB PRO 132 2.240 -7.703 -8.996 983 HB3 PRO 132 1HB PRO 132 1.109 -7.282 -10.283 984 HG2 PRO 132 2HG PRO 132 1.629 -5.694 -7.986 985 HG3 PRO 132 1HG PRO 132 0.204 -5.544 -9.021 986 HD2 PRO 132 2HD PRO 132 0.367 -6.881 -6.349 987 HD3 PRO 132 1HD PRO 132 -0.948 -5.931 -7.099 988 H GLU 133 H GLU 133 1.764 -10.194 -10.086 989 HA GLU 133 HA GLU 133 1.935 -12.389 -8.086 990 HB2 GLU 133 2HB GLU 133 3.427 -13.467 -9.857 991 HB3 GLU 133 1HB GLU 133 1.734 -13.240 -10.190 992 HG2 GLU 133 2HG GLU 133 3.772 -11.206 -11.315 993 HG3 GLU 133 1HG GLU 133 3.522 -12.754 -12.109 994 H TRP 134 H TRP 134 3.478 -12.908 -6.739 995 HA TRP 134 HA TRP 134 5.910 -11.151 -6.365 996 HD1 TRP 134 HD1 TRP 134 5.453 -15.372 -4.989 997 HE1 TRP 134 HE1 TRP 134 3.238 -16.688 -4.408 998 HE3 TRP 134 HE3 TRP 134 2.777 -11.337 -3.404 999 HZ2 TRP 134 HZ2 TRP 134 0.724 -15.897 -3.383 1000 HZ3 TRP 134 HZ3 TRP 134 0.400 -11.648 -2.824 1001 HH2 TRP 134 HH2 TRP 134 -0.616 -13.898 -2.773 1002 HB2 TRP 134 2HB TRP 134 6.296 -12.522 -4.260 1003 HB3 TRP 134 1HB TRP 134 4.930 -11.471 -4.297 1004 H ASP 135 H ASP 135 7.947 -11.650 -6.970 1005 HA ASP 135 HA ASP 135 8.468 -14.388 -8.190 1006 HB2 ASP 135 2HB ASP 135 8.620 -11.877 -9.363 1007 HB3 ASP 135 1HB ASP 135 10.228 -11.942 -8.668 1008 H ALA 136 H ALA 136 11.189 -14.258 -8.249 1009 HA ALA 136 HA ALA 136 12.089 -14.425 -5.274 1010 HB1 ALA 136 3HB ALA 136 12.798 -16.401 -7.565 1011 HB2 ALA 136 1HB ALA 136 11.553 -16.677 -6.312 1012 HB3 ALA 136 2HB ALA 136 13.267 -16.555 -5.843 1013 H ALA 137 H ALA 137 13.232 -13.485 -8.423 1014 HA ALA 137 HA ALA 137 15.854 -12.536 -7.132 1015 HB1 ALA 137 3HB ALA 137 15.364 -13.038 -10.133 1016 HB2 ALA 137 1HB ALA 137 16.344 -14.038 -9.018 1017 HB3 ALA 137 2HB ALA 137 16.846 -12.374 -9.406 1018 H GLU 138 H GLU 138 12.885 -11.301 -8.297 1019 HA GLU 138 HA GLU 138 13.830 -8.438 -8.380 1020 HB2 GLU 138 2HB GLU 138 11.078 -9.805 -8.348 1021 HB3 GLU 138 1HB GLU 138 11.314 -8.103 -8.199 1022 HG2 GLU 138 2HG GLU 138 12.299 -9.589 -10.693 1023 HG3 GLU 138 1HG GLU 138 10.706 -8.882 -10.527 1024 H TRP 139 H TRP 139 11.800 -10.283 -6.008 1025 HA TRP 139 HA TRP 139 13.082 -8.732 -3.698 1026 HD1 TRP 139 HD1 TRP 139 8.753 -10.516 -4.131 1027 HE1 TRP 139 HE1 TRP 139 7.276 -10.026 -6.332 1028 HE3 TRP 139 HE3 TRP 139 11.043 -6.216 -5.455 1029 HZ2 TRP 139 HZ2 TRP 139 7.702 -8.304 -8.509 1030 HZ3 TRP 139 HZ3 TRP 139 10.603 -5.247 -7.694 1031 HH2 TRP 139 HH2 TRP 139 9.034 -6.331 -9.231 1032 HB2 TRP 139 2HB TRP 139 10.575 -8.859 -2.635 1033 HB3 TRP 139 1HB TRP 139 11.216 -7.504 -3.487 1034 H GLU 140 H GLU 140 13.485 -9.723 -1.868 1035 HA GLU 140 HA GLU 140 12.718 -12.667 -1.543 1036 HB2 GLU 140 2HB GLU 140 14.715 -13.130 -0.538 1037 HB3 GLU 140 1HB GLU 140 15.195 -11.996 -1.764 1038 HG2 GLU 140 2HG GLU 140 15.134 -10.183 0.249 1039 HG3 GLU 140 1HG GLU 140 15.065 -11.598 1.295 1040 H LEU 141 H LEU 141 13.016 -12.947 1.242 1041 HA LEU 141 HA LEU 141 10.434 -11.549 2.140 1042 HG LEU 141 HG LEU 141 9.101 -14.758 3.558 1043 HB2 LEU 141 2HB LEU 141 10.758 -14.243 1.829 1044 HB3 LEU 141 1HB LEU 141 11.383 -14.106 3.440 1045 HD11 LEU 141 1HD1 LEU 141 9.625 -12.965 5.282 1046 HD12 LEU 141 2HD1 LEU 141 7.905 -13.064 4.853 1047 HD13 LEU 141 3HD1 LEU 141 8.905 -11.757 4.211 1048 HD21 LEU 141 3HD2 LEU 141 8.241 -12.402 1.784 1049 HD22 LEU 141 1HD2 LEU 141 7.197 -13.675 2.444 1050 HD23 LEU 141 2HD2 LEU 141 8.413 -14.075 1.224 1051 H ASP 142 H ASP 142 10.812 -9.995 3.624 1052 HA ASP 142 HA ASP 142 13.385 -9.728 5.183 1053 HB2 ASP 142 2HB ASP 142 12.215 -7.829 3.897 1054 HB3 ASP 142 1HB ASP 142 10.907 -7.898 5.041 1055 H ALA 143 H ALA 143 9.862 -9.733 6.012 1056 HA ALA 143 HA ALA 143 10.472 -11.479 8.457 1057 HB1 ALA 143 3HB ALA 143 9.284 -9.882 9.964 1058 HB2 ALA 143 1HB ALA 143 8.919 -8.803 8.589 1059 HB3 ALA 143 2HB ALA 143 10.604 -9.026 9.116 1060 H GLU 144 H GLU 144 9.149 -13.206 8.444 1061 HA GLU 144 HA GLU 144 6.192 -12.839 7.732 1062 HB2 GLU 144 2HB GLU 144 7.725 -14.643 6.604 1063 HB3 GLU 144 1HB GLU 144 7.503 -15.583 8.077 1064 HG2 GLU 144 2HG GLU 144 4.988 -15.555 7.727 1065 HG3 GLU 144 1HG GLU 144 5.165 -14.399 6.430 1066 H THR 145 H THR 145 4.736 -12.655 9.289 1067 HA THR 145 HA THR 145 4.987 -14.231 11.846 1068 HB THR 145 HB THR 145 6.272 -12.023 12.155 1069 HG1 THR 145 HG1 THR 145 4.563 -12.075 14.214 1070 HG21 THR 145 3HG2 THR 145 3.598 -10.728 11.873 1071 HG22 THR 145 1HG2 THR 145 5.213 -10.005 12.006 1072 HG23 THR 145 2HG2 THR 145 4.309 -10.427 13.461 1073 H ASP 146 H ASP 146 3.158 -14.667 13.037 1074 HA ASP 146 HA ASP 146 0.590 -14.364 11.618 1075 HB2 ASP 146 2HB ASP 146 -0.257 -15.971 13.224 1076 HB3 ASP 146 1HB ASP 146 1.217 -16.503 12.464 1077 H HIS 147 H HIS 147 -1.293 -13.408 12.232 1078 HA HIS 147 HA HIS 147 -1.380 -11.447 14.557 1079 HD1 HIS 147 HD1 HIS 147 1.215 -10.755 13.443 1080 HD2 HIS 147 HD2 HIS 147 -1.562 -7.560 13.287 1081 HE1 HIS 147 HE1 HIS 147 2.386 -8.551 14.109 1082 HB2 HIS 147 2HB HIS 147 -1.180 -10.774 11.581 1083 HB3 HIS 147 1HB HIS 147 -2.437 -9.923 12.418 1084 H GLU 148 H GLU 148 -3.765 -10.271 14.329 1085 HA GLU 148 HA GLU 148 -5.348 -12.384 15.485 1086 HB2 GLU 148 2HB GLU 148 -6.253 -9.551 14.771 1087 HB3 GLU 148 1HB GLU 148 -7.211 -10.653 15.701 1088 HG2 GLU 148 2HG GLU 148 -5.504 -10.728 17.548 1089 HG3 GLU 148 1HG GLU 148 -4.442 -9.664 16.660 1090 H GLY 149 H GLY 149 -6.189 -10.739 12.418 1091 HA2 GLY 149 2HA GLY 149 -8.019 -13.141 11.671 1092 HA3 GLY 149 1HA GLY 149 -8.259 -11.546 11.016 1093 H PHE 150 H PHE 150 -4.917 -12.619 11.176 1094 HA PHE 150 HA PHE 150 -4.691 -13.431 8.322 1095 HD1 PHE 150 HD2 PHE 150 -5.668 -9.634 10.132 1096 HD2 PHE 150 HD1 PHE 150 -1.925 -10.183 8.121 1097 HE1 PHE 150 HE2 PHE 150 -4.757 -7.665 11.274 1098 HE2 PHE 150 HE1 PHE 150 -1.018 -8.196 9.257 1099 HZ PHE 150 HZ PHE 150 -2.448 -6.905 10.821 1100 HB2 PHE 150 2HB PHE 150 -3.936 -11.362 7.330 1101 HB3 PHE 150 1HB PHE 150 -5.480 -11.058 8.040 1102 H THR 151 H THR 151 -2.449 -13.348 7.453 1103 HA THR 151 HA THR 151 -0.289 -13.144 9.625 1104 HB THR 151 HB THR 151 -0.168 -15.352 9.206 1105 HG1 THR 151 HG1 THR 151 1.846 -14.004 8.917 1106 HG21 THR 151 3HG2 THR 151 -1.383 -15.703 7.035 1107 HG22 THR 151 1HG2 THR 151 0.201 -16.499 7.055 1108 HG23 THR 151 2HG2 THR 151 -0.008 -14.979 6.151 1109 H LEU 152 H LEU 152 1.018 -11.656 9.494 1110 HA LEU 152 HA LEU 152 1.223 -9.579 7.355 1111 HG LEU 152 HG LEU 152 3.108 -7.807 10.294 1112 HB2 LEU 152 2HB LEU 152 1.227 -9.003 9.729 1113 HB3 LEU 152 1HB LEU 152 2.473 -10.149 10.097 1114 HD11 LEU 152 1HD1 LEU 152 4.965 -9.041 8.194 1115 HD12 LEU 152 2HD1 LEU 152 4.824 -9.720 9.810 1116 HD13 LEU 152 3HD1 LEU 152 5.369 -8.040 9.595 1117 HD21 LEU 152 3HD2 LEU 152 1.914 -6.812 8.303 1118 HD22 LEU 152 1HD2 LEU 152 3.081 -7.602 7.214 1119 HD23 LEU 152 2HD2 LEU 152 3.638 -6.370 8.362 1120 H GLN 153 H GLN 153 2.636 -9.576 5.763 1121 HA GLN 153 HA GLN 153 5.255 -11.191 5.854 1122 HB2 GLN 153 2HB GLN 153 3.026 -11.267 3.799 1123 HB3 GLN 153 1HB GLN 153 4.540 -10.765 3.083 1124 HG2 GLN 153 2HG GLN 153 5.704 -12.784 3.921 1125 HG3 GLN 153 1HG GLN 153 4.273 -13.320 4.784 1126 HE21 GLN 153 1HE2 GLN 153 4.885 -15.221 3.412 1127 HE22 GLN 153 2HE2 GLN 153 4.381 -15.208 1.636 1128 H GLU 154 H GLU 154 6.945 -9.809 5.794 1129 HA GLU 154 HA GLU 154 6.697 -7.149 4.246 1130 HB2 GLU 154 2HB GLU 154 8.741 -7.647 6.454 1131 HB3 GLU 154 1HB GLU 154 8.443 -6.168 5.594 1132 HG2 GLU 154 2HG GLU 154 5.897 -6.571 6.700 1133 HG3 GLU 154 1HG GLU 154 6.853 -7.485 7.823 1134 H TRP 155 H TRP 155 7.572 -7.295 2.260 1135 HA TRP 155 HA TRP 155 9.756 -9.348 1.620 1136 HD1 TRP 155 HD1 TRP 155 5.586 -9.319 1.030 1137 HE1 TRP 155 HE1 TRP 155 4.582 -11.696 0.370 1138 HE3 TRP 155 HE3 TRP 155 9.688 -10.982 -1.499 1139 HZ2 TRP 155 HZ2 TRP 155 5.517 -13.761 -1.302 1140 HZ3 TRP 155 HZ3 TRP 155 9.527 -13.130 -2.739 1141 HH2 TRP 155 HH2 TRP 155 7.479 -14.483 -2.650 1142 HB2 TRP 155 2HB TRP 155 7.608 -7.920 -0.008 1143 HB3 TRP 155 1HB TRP 155 8.889 -8.755 -0.824 1144 H VAL 156 H VAL 156 11.876 -8.474 1.603 1145 HA VAL 156 HA VAL 156 12.273 -5.623 0.697 1146 HB VAL 156 HB VAL 156 13.334 -6.356 2.778 1147 HG11 VAL 156 1HG1 VAL 156 15.263 -8.046 1.072 1148 HG12 VAL 156 2HG1 VAL 156 14.104 -8.667 2.268 1149 HG13 VAL 156 3HG1 VAL 156 15.460 -7.660 2.800 1150 HG21 VAL 156 3HG2 VAL 156 14.205 -4.361 1.453 1151 HG22 VAL 156 1HG2 VAL 156 15.455 -5.417 0.770 1152 HG23 VAL 156 2HG2 VAL 156 15.385 -5.121 2.532 1153 H ARG 157 H ARG 157 13.069 -4.878 -1.120 1154 HA ARG 157 HA ARG 157 13.537 -6.494 -3.527 1155 HE ARG 157 HE ARG 157 14.484 -3.944 -6.831 1156 HB2 ARG 157 2HB ARG 157 13.766 -3.568 -2.777 1157 HB3 ARG 157 1HB ARG 157 14.927 -4.045 -3.982 1158 HG2 ARG 157 2HG ARG 157 12.949 -5.193 -5.305 1159 HG3 ARG 157 1HG ARG 157 11.889 -4.335 -4.178 1160 HD2 ARG 157 2HD ARG 157 12.028 -2.896 -6.098 1161 HD3 ARG 157 1HD ARG 157 13.023 -2.182 -4.831 1162 HH11 ARG 157 2HH1 ARG 157 13.604 -0.747 -5.964 1163 HH12 ARG 157 1HH1 ARG 157 14.982 0.050 -6.817 1164 HH21 ARG 157 1HH2 ARG 157 16.131 -3.117 -7.744 1165 HH22 ARG 157 2HH2 ARG 157 16.409 -1.304 -7.790 1166 H SER 158 H SER 158 15.231 -7.209 -4.587 1167 HA SER 158 HA SER 158 16.991 -8.669 -3.283 1168 HG SER 158 HG SER 158 18.235 -10.152 -5.327 1169 HB2 SER 158 2HB SER 158 16.502 -8.888 -5.689 1170 HB3 SER 158 1HB SER 158 17.558 -7.537 -6.083 1171 H ALA 159 H ALA 159 18.523 -8.546 -1.906 1172 HA ALA 159 HA ALA 159 20.452 -6.291 -1.584 1173 HB1 ALA 159 3HB ALA 159 21.143 -7.739 0.398 1174 HB2 ALA 159 1HB ALA 159 20.129 -9.061 -0.222 1175 HB3 ALA 159 2HB ALA 159 19.377 -7.546 0.315 1176 H SER 160 H SER 160 20.860 -7.526 -4.136 1177 HA SER 160 HA SER 160 23.829 -8.186 -3.961 1178 HG SER 160 HG SER 160 23.535 -10.240 -6.457 1179 HB2 SER 160 2HB SER 160 22.775 -10.385 -3.734 1180 HB3 SER 160 1HB SER 160 21.772 -10.130 -5.168 1181 H SER 161 H SER 161 24.628 -6.736 -5.235 1182 HA SER 161 HA SER 161 25.334 -5.642 -7.205 1183 HG SER 161 HG SER 161 24.538 -8.580 -8.066 1184 HB2 SER 161 2HB SER 161 23.230 -7.036 -8.904 1185 HB3 SER 161 1HB SER 161 24.633 -6.124 -9.460 1186 H ARG 162 H ARG 162 24.627 -3.839 -5.969 1187 HA ARG 162 HA ARG 162 22.616 -2.176 -7.566 1188 HE ARG 162 HE ARG 162 19.349 1.010 -4.824 1189 HB2 ARG 162 1HB ARG 162 21.686 -3.013 -5.305 1190 HB3 ARG 162 2HB ARG 162 22.896 -2.035 -4.494 1191 HG2 ARG 162 1HG ARG 162 21.860 0.071 -5.494 1192 HG3 ARG 162 2HG ARG 162 20.724 -0.926 -6.425 1193 HD2 ARG 162 1HD ARG 162 19.804 -1.911 -4.276 1194 HD3 ARG 162 2HD ARG 162 20.933 -0.938 -3.332 1195 HH11 ARG 162 2HH1 ARG 162 18.619 -1.411 -2.339 1196 HH12 ARG 162 1HH1 ARG 162 17.240 -0.316 -1.854 1197 HH21 ARG 162 1HH2 ARG 162 17.714 2.071 -4.162 1198 HH22 ARG 162 2HH2 ARG 162 16.787 1.399 -2.816
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