NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
26589 | 2nnz | 7271 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 1 H MET 1 -2.137 17.428 -18.361 2 HA MET 1 HA MET 1 -0.335 17.187 -16.048 3 HB2 MET 1 1HB MET 1 -0.142 18.916 -18.084 4 HB3 MET 1 2HB MET 1 -1.360 19.761 -17.137 5 HG2 MET 1 1HG MET 1 0.138 19.753 -15.206 6 HG3 MET 1 2HG MET 1 1.359 18.916 -16.162 7 HE1 MET 1 3HE MET 1 3.058 21.358 -15.361 8 HE2 MET 1 1HE MET 1 3.478 21.690 -17.042 9 HE3 MET 1 2HE MET 1 3.213 20.029 -16.509 10 H GLY 2 H GLY 2 -2.630 15.954 -15.590 11 HA2 GLY 2 1HA GLY 2 -4.114 16.087 -13.758 12 HA3 GLY 2 2HA GLY 2 -4.046 17.841 -13.861 13 H GLU 3 H GLU 3 -4.698 15.572 -16.492 14 HA GLU 3 HA GLU 3 -7.375 16.776 -16.739 15 HB2 GLU 3 1HB GLU 3 -5.740 15.526 -18.949 16 HB3 GLU 3 2HB GLU 3 -7.248 16.416 -19.119 17 HG2 GLU 3 1HG GLU 3 -6.241 18.456 -18.767 18 HG3 GLU 3 2HG GLU 3 -4.877 17.753 -17.903 19 H ARG 4 H ARG 4 -6.522 14.392 -15.169 20 HA ARG 4 HA ARG 4 -8.576 12.603 -16.189 21 HE ARG 4 HE ARG 4 -4.293 10.948 -15.125 22 HB2 ARG 4 1HB ARG 4 -6.249 11.045 -15.317 23 HB3 ARG 4 2HB ARG 4 -7.278 10.840 -16.724 24 HG2 ARG 4 1HG ARG 4 -5.162 11.229 -17.605 25 HG3 ARG 4 2HG ARG 4 -5.976 12.785 -17.748 26 HD2 ARG 4 1HD ARG 4 -3.602 12.856 -16.895 27 HD3 ARG 4 2HD ARG 4 -4.798 13.676 -15.894 28 HH11 ARG 4 1HH1 ARG 4 -3.290 14.269 -14.746 29 HH12 ARG 4 2HH1 ARG 4 -2.548 14.000 -13.206 30 HH21 ARG 4 1HH2 ARG 4 -3.317 10.592 -13.098 31 HH22 ARG 4 2HH2 ARG 4 -2.564 11.914 -12.269 32 H GLY 5 H GLY 5 -7.693 10.448 -14.278 33 HA2 GLY 5 1HA GLY 5 -7.533 11.548 -11.672 34 HA3 GLY 5 2HA GLY 5 -9.205 11.178 -12.066 35 H VAL 6 H VAL 6 -9.057 8.867 -13.454 36 HA VAL 6 HA VAL 6 -8.216 7.001 -11.362 37 HB VAL 6 HB VAL 6 -10.465 6.809 -12.361 38 HG11 VAL 6 1HG1 VAL 6 -10.131 5.447 -14.721 39 HG12 VAL 6 2HG1 VAL 6 -8.938 6.740 -14.839 40 HG13 VAL 6 3HG1 VAL 6 -10.637 7.128 -14.566 41 HG21 VAL 6 3HG2 VAL 6 -8.516 4.564 -12.413 42 HG22 VAL 6 1HG2 VAL 6 -10.140 4.281 -13.037 43 HG23 VAL 6 2HG2 VAL 6 -9.918 4.819 -11.374 44 H GLU 7 H GLU 7 -6.007 7.960 -12.313 45 HA GLU 7 HA GLU 7 -4.736 5.696 -13.564 46 HB2 GLU 7 1HB GLU 7 -3.994 8.164 -14.995 47 HB3 GLU 7 2HB GLU 7 -4.206 6.532 -15.605 48 HG2 GLU 7 1HG GLU 7 -6.632 6.858 -15.625 49 HG3 GLU 7 2HG GLU 7 -6.410 8.499 -15.020 50 H MET 8 H MET 8 -4.390 6.569 -11.051 51 HA MET 8 HA MET 8 -1.847 8.042 -11.107 52 HB2 MET 8 1HB MET 8 -4.114 8.607 -9.617 53 HB3 MET 8 2HB MET 8 -3.067 7.781 -8.473 54 HG2 MET 8 1HG MET 8 -1.694 9.803 -10.058 55 HG3 MET 8 2HG MET 8 -3.016 10.437 -9.085 56 HE1 MET 8 3HE MET 8 1.015 10.285 -7.646 57 HE2 MET 8 1HE MET 8 -0.020 11.501 -8.396 58 HE3 MET 8 2HE MET 8 0.457 10.067 -9.306 59 H ARG 9 H ARG 9 -0.497 6.281 -11.472 60 HA ARG 9 HA ARG 9 -0.508 4.193 -9.408 61 HE ARG 9 HE ARG 9 4.391 3.228 -13.126 62 HB2 ARG 9 1HB ARG 9 0.507 2.745 -10.902 63 HB3 ARG 9 2HB ARG 9 -0.541 3.689 -11.947 64 HG2 ARG 9 1HG ARG 9 1.294 3.897 -13.214 65 HG3 ARG 9 2HG ARG 9 1.748 5.148 -12.055 66 HD2 ARG 9 1HD ARG 9 3.413 3.913 -11.192 67 HD3 ARG 9 2HD ARG 9 2.454 2.433 -11.219 68 HH11 ARG 9 1HH1 ARG 9 1.302 1.628 -12.855 69 HH12 ARG 9 2HH1 ARG 9 1.530 0.674 -14.282 70 HH21 ARG 9 1HH2 ARG 9 4.694 1.974 -15.003 71 HH22 ARG 9 2HH2 ARG 9 3.457 0.869 -15.500 72 H LEU 10 H LEU 10 1.266 3.657 -8.222 73 HA LEU 10 HA LEU 10 3.528 5.537 -8.335 74 HG LEU 10 HG LEU 10 0.852 4.283 -6.198 75 HB2 LEU 10 1HB LEU 10 3.360 4.506 -5.696 76 HB3 LEU 10 2HB LEU 10 3.202 6.166 -6.227 77 HD11 LEU 10 1HD1 LEU 10 1.589 4.276 -3.934 78 HD12 LEU 10 2HD1 LEU 10 0.264 5.436 -4.031 79 HD13 LEU 10 3HD1 LEU 10 1.932 6.006 -3.973 80 HD21 LEU 10 3HD2 LEU 10 0.518 7.150 -5.707 81 HD22 LEU 10 1HD2 LEU 10 -0.377 6.066 -6.773 82 HD23 LEU 10 2HD2 LEU 10 1.160 6.755 -7.300 83 H ARG 11 H ARG 11 5.523 4.642 -7.307 84 HA ARG 11 HA ARG 11 5.724 1.766 -7.879 85 HE ARG 11 HE ARG 11 9.047 -0.915 -9.824 86 HB2 ARG 11 1HB ARG 11 7.133 3.890 -8.998 87 HB3 ARG 11 2HB ARG 11 8.261 3.193 -7.844 88 HG2 ARG 11 1HG ARG 11 6.852 1.721 -10.062 89 HG3 ARG 11 2HG ARG 11 8.546 2.215 -10.046 90 HD2 ARG 11 1HD ARG 11 8.341 0.822 -7.707 91 HD3 ARG 11 2HD ARG 11 7.231 -0.063 -8.753 92 HH11 ARG 11 1HH1 ARG 11 9.998 2.082 -8.308 93 HH12 ARG 11 2HH1 ARG 11 11.660 1.931 -8.768 94 HH21 ARG 11 1HH2 ARG 11 11.233 -1.116 -10.428 95 HH22 ARG 11 2HH2 ARG 11 12.362 0.116 -9.971 96 H ILE 12 H ILE 12 6.862 0.442 -6.454 97 HA ILE 12 HA ILE 12 8.014 1.628 -4.058 98 HB ILE 12 HB ILE 12 5.443 0.196 -4.094 99 HG12 ILE 12 1HG1 ILE 12 6.730 1.725 -1.843 100 HG13 ILE 12 2HG1 ILE 12 6.015 2.534 -3.233 101 HG21 ILE 12 1HG2 ILE 12 7.630 -0.713 -2.255 102 HG22 ILE 12 2HG2 ILE 12 6.501 -1.680 -3.206 103 HG23 ILE 12 3HG2 ILE 12 5.931 -0.800 -1.789 104 HD11 ILE 12 3HD1 ILE 12 4.576 0.692 -1.341 105 HD12 ILE 12 1HD1 ILE 12 3.862 1.513 -2.727 106 HD13 ILE 12 2HD1 ILE 12 4.470 2.451 -1.363 107 H ARG 13 H ARG 13 10.008 0.864 -4.364 108 HA ARG 13 HA ARG 13 10.349 -1.952 -5.106 109 HE ARG 13 HE ARG 13 14.456 -0.183 -6.498 110 HB2 ARG 13 1HB ARG 13 12.724 -1.344 -5.517 111 HB3 ARG 13 2HB ARG 13 11.588 -0.440 -6.508 112 HG2 ARG 13 1HG ARG 13 11.800 1.326 -4.574 113 HG3 ARG 13 2HG ARG 13 13.321 0.487 -4.274 114 HD2 ARG 13 1HD ARG 13 12.484 1.621 -6.938 115 HD3 ARG 13 2HD ARG 13 13.540 2.442 -5.789 116 HH11 ARG 13 1HH1 ARG 13 14.438 3.176 -7.446 117 HH12 ARG 13 2HH1 ARG 13 15.896 3.053 -8.370 118 HH21 ARG 13 1HH2 ARG 13 16.375 -0.348 -7.713 119 HH22 ARG 13 2HH2 ARG 13 16.997 1.052 -8.522 120 H PHE 14 H PHE 14 11.913 -3.264 -4.067 121 HA PHE 14 HA PHE 14 12.624 -2.527 -1.324 122 HD1 PHE 14 HD1 PHE 14 9.793 -2.270 -1.469 123 HD2 PHE 14 HD2 PHE 14 11.348 -5.264 1.132 124 HE1 PHE 14 HE1 PHE 14 8.411 -1.390 0.365 125 HE2 PHE 14 HE2 PHE 14 9.967 -4.386 2.969 126 HZ PHE 14 HZ PHE 14 8.495 -2.448 2.586 127 HB2 PHE 14 1HB PHE 14 10.838 -4.722 -2.188 128 HB3 PHE 14 2HB PHE 14 12.085 -5.188 -1.039 129 H GLU 15 H GLU 15 14.598 -3.268 -0.693 130 HA GLU 15 HA GLU 15 16.598 -3.760 -2.455 131 HB2 GLU 15 1HB GLU 15 16.263 -4.260 0.432 132 HB3 GLU 15 2HB GLU 15 17.508 -5.223 -0.343 133 HG2 GLU 15 1HG GLU 15 18.115 -2.945 0.707 134 HG3 GLU 15 2HG GLU 15 18.804 -3.404 -0.846 135 H SER 16 H SER 16 14.323 -6.129 -1.273 136 HA SER 16 HA SER 16 15.682 -8.152 -2.932 137 HG SER 16 HG SER 16 13.955 -9.409 0.521 138 HB2 SER 16 1HB SER 16 15.219 -9.851 -1.351 139 HB3 SER 16 2HB SER 16 15.840 -8.496 -0.409 140 H ALA 17 H ALA 17 13.319 -6.264 -3.411 141 HA ALA 17 HA ALA 17 11.785 -8.065 -4.952 142 HB1 ALA 17 3HB ALA 17 9.986 -7.123 -2.804 143 HB2 ALA 17 1HB ALA 17 11.091 -8.434 -2.393 144 HB3 ALA 17 2HB ALA 17 9.963 -8.619 -3.735 145 H GLU 18 H GLU 18 10.103 -7.087 -6.163 146 HA GLU 18 HA GLU 18 9.755 -4.191 -5.841 147 HB2 GLU 18 1HB GLU 18 10.086 -3.893 -8.313 148 HB3 GLU 18 2HB GLU 18 11.547 -4.277 -7.411 149 HG2 GLU 18 1HG GLU 18 11.317 -6.631 -8.107 150 HG3 GLU 18 2HG GLU 18 9.914 -6.182 -9.074 151 H CYS 19 H CYS 19 7.827 -3.339 -6.662 152 HA CYS 19 HA CYS 19 6.033 -4.928 -8.243 153 HG CYS 19 HG CYS 19 6.610 -6.207 -4.779 154 HB2 CYS 19 1HB CYS 19 4.378 -4.491 -6.008 155 HB3 CYS 19 2HB CYS 19 4.934 -6.039 -6.634 156 H GLU 20 H GLU 20 4.203 -3.756 -8.988 157 HA GLU 20 HA GLU 20 4.304 -0.879 -8.338 158 HB2 GLU 20 1HB GLU 20 3.082 -1.904 -10.872 159 HB3 GLU 20 2HB GLU 20 3.828 -0.346 -10.551 160 HG2 GLU 20 1HG GLU 20 6.017 -1.662 -10.341 161 HG3 GLU 20 2HG GLU 20 5.137 -2.969 -11.127 162 H VAL 21 H VAL 21 2.277 0.277 -8.345 163 HA VAL 21 HA VAL 21 -0.165 -1.287 -8.239 164 HB VAL 21 HB VAL 21 -0.363 -1.450 -6.038 165 HG11 VAL 21 1HG1 VAL 21 1.500 -0.767 -4.537 166 HG12 VAL 21 2HG1 VAL 21 2.267 0.013 -5.922 167 HG13 VAL 21 3HG1 VAL 21 2.001 -1.734 -5.925 168 HG21 VAL 21 3HG2 VAL 21 0.132 1.519 -5.810 169 HG22 VAL 21 1HG2 VAL 21 -0.582 0.480 -4.578 170 HG23 VAL 21 2HG2 VAL 21 -1.435 0.760 -6.096 171 H GLU 22 H GLU 22 -1.997 -0.111 -8.635 172 HA GLU 22 HA GLU 22 -1.574 2.680 -9.429 173 HB2 GLU 22 1HB GLU 22 -3.626 0.614 -10.195 174 HB3 GLU 22 2HB GLU 22 -3.858 2.320 -10.549 175 HG2 GLU 22 1HG GLU 22 -2.338 2.326 -12.206 176 HG3 GLU 22 2HG GLU 22 -1.278 1.183 -11.384 177 H LEU 23 H LEU 23 -3.914 3.898 -9.247 178 HA LEU 23 HA LEU 23 -5.186 3.262 -6.729 179 HG LEU 23 HG LEU 23 -5.632 6.587 -6.568 180 HB2 LEU 23 1HB LEU 23 -3.610 4.539 -5.672 181 HB3 LEU 23 2HB LEU 23 -3.325 5.544 -7.074 182 HD11 LEU 23 1HD1 LEU 23 -5.301 4.760 -4.298 183 HD12 LEU 23 2HD1 LEU 23 -6.754 5.528 -4.939 184 HD13 LEU 23 3HD1 LEU 23 -5.696 6.418 -3.848 185 HD21 LEU 23 3HD2 LEU 23 -4.549 7.973 -4.692 186 HD22 LEU 23 1HD2 LEU 23 -3.771 7.949 -6.275 187 HD23 LEU 23 2HD2 LEU 23 -3.131 6.960 -4.963 188 H TYR 24 H TYR 24 -7.165 4.275 -6.392 189 HA TYR 24 HA TYR 24 -8.202 5.807 -8.683 190 HD1 TYR 24 HD2 TYR 24 -7.847 4.554 -10.240 191 HD2 TYR 24 HD1 TYR 24 -9.964 1.511 -8.151 192 HE1 TYR 24 HE2 TYR 24 -7.049 2.890 -11.866 193 HE2 TYR 24 HE1 TYR 24 -9.170 -0.162 -9.771 194 HH TYR 24 HH TYR 24 -8.322 -0.290 -12.018 195 HB2 TYR 24 1HB TYR 24 -9.706 3.648 -7.171 196 HB3 TYR 24 2HB TYR 24 -10.346 4.629 -8.485 197 H GLU 25 H GLU 25 -9.762 7.374 -8.242 198 HA GLU 25 HA GLU 25 -9.438 8.810 -5.873 199 HB2 GLU 25 1HB GLU 25 -11.707 8.947 -7.859 200 HB3 GLU 25 2HB GLU 25 -11.403 10.136 -6.599 201 HG2 GLU 25 1HG GLU 25 -9.728 11.108 -7.734 202 HG3 GLU 25 2HG GLU 25 -9.113 9.577 -8.358 203 H GLU 26 H GLU 26 -11.236 5.974 -6.216 204 HA GLU 26 HA GLU 26 -13.547 6.293 -4.827 205 HB2 GLU 26 1HB GLU 26 -13.455 3.990 -4.256 206 HB3 GLU 26 2HB GLU 26 -12.621 4.154 -5.793 207 HG2 GLU 26 1HG GLU 26 -10.466 4.205 -4.492 208 HG3 GLU 26 2HG GLU 26 -11.410 3.755 -3.072 209 H TRP 27 H TRP 27 -10.317 6.499 -3.526 210 HA TRP 27 HA TRP 27 -11.199 6.369 -0.781 211 HD1 TRP 27 HD1 TRP 27 -10.360 7.621 1.169 212 HE1 TRP 27 HE1 TRP 27 -8.699 8.413 2.966 213 HE3 TRP 27 HE3 TRP 27 -5.985 6.642 -1.283 214 HZ2 TRP 27 HZ2 TRP 27 -5.901 8.601 3.301 215 HZ3 TRP 27 HZ3 TRP 27 -3.858 7.156 -0.156 216 HH2 TRP 27 HH2 TRP 27 -3.818 8.115 2.089 217 HB2 TRP 27 1HB TRP 27 -8.987 5.536 -1.206 218 HB3 TRP 27 2HB TRP 27 -8.532 7.011 -2.055 219 H ALA 28 H ALA 28 -9.736 8.881 -2.859 220 HA ALA 28 HA ALA 28 -11.387 10.938 -2.636 221 HB1 ALA 28 3HB ALA 28 -10.018 10.639 0.008 222 HB2 ALA 28 1HB ALA 28 -11.701 11.036 -0.348 223 HB3 ALA 28 2HB ALA 28 -10.439 12.244 -0.588 224 HA PRO 29 HA PRO 29 -7.873 12.268 -5.112 225 HB2 PRO 29 1HB PRO 29 -9.043 14.880 -5.258 226 HB3 PRO 29 2HB PRO 29 -8.974 13.647 -6.515 227 HG2 PRO 29 1HG PRO 29 -11.187 14.391 -4.748 228 HG3 PRO 29 2HG PRO 29 -11.218 13.471 -6.258 229 HD2 PRO 29 1HD PRO 29 -11.659 12.381 -3.790 230 HD3 PRO 29 2HD PRO 29 -11.039 11.462 -5.174 231 H GLU 30 H GLU 30 -9.239 14.115 -2.418 232 HA GLU 30 HA GLU 30 -7.172 15.950 -2.059 233 HB2 GLU 30 1HB GLU 30 -9.195 14.762 -0.184 234 HB3 GLU 30 2HB GLU 30 -7.989 15.903 0.391 235 HG2 GLU 30 1HG GLU 30 -9.531 17.438 -0.111 236 HG3 GLU 30 2HG GLU 30 -8.956 17.225 -1.763 237 H THR 31 H THR 31 -7.667 12.827 -0.398 238 HA THR 31 HA THR 31 -5.233 12.934 1.058 239 HB THR 31 HB THR 31 -5.828 10.205 0.621 240 HG1 THR 31 HG1 THR 31 -8.074 10.183 1.020 241 HG21 THR 31 3HG2 THR 31 -6.368 12.122 2.849 242 HG22 THR 31 1HG2 THR 31 -5.286 10.731 2.792 243 HG23 THR 31 2HG2 THR 31 -7.028 10.487 2.900 244 H VAL 32 H VAL 32 -6.063 11.410 -2.039 245 HA VAL 32 HA VAL 32 -3.755 10.066 -2.638 246 HB VAL 32 HB VAL 32 -5.355 11.755 -4.570 247 HG11 VAL 32 1HG1 VAL 32 -4.567 9.773 -6.098 248 HG12 VAL 32 2HG1 VAL 32 -3.254 9.672 -4.925 249 HG13 VAL 32 3HG1 VAL 32 -3.524 11.168 -5.821 250 HG21 VAL 32 3HG2 VAL 32 -6.997 10.379 -3.837 251 HG22 VAL 32 1HG2 VAL 32 -5.866 9.154 -3.262 252 HG23 VAL 32 2HG2 VAL 32 -6.246 9.267 -4.981 253 H ARG 33 H ARG 33 -4.250 13.514 -2.538 254 HA ARG 33 HA ARG 33 -2.061 14.356 -4.072 255 HE ARG 33 HE ARG 33 -2.462 19.862 -4.065 256 HB2 ARG 33 1HB ARG 33 -4.022 15.726 -3.085 257 HB3 ARG 33 2HB ARG 33 -3.021 15.855 -1.647 258 HG2 ARG 33 1HG ARG 33 -1.222 16.823 -3.115 259 HG3 ARG 33 2HG ARG 33 -2.422 16.887 -4.408 260 HD2 ARG 33 1HD ARG 33 -3.836 18.325 -3.058 261 HD3 ARG 33 2HD ARG 33 -2.698 18.215 -1.714 262 HH11 ARG 33 1HH1 ARG 33 -0.737 18.326 -1.449 263 HH12 ARG 33 2HH1 ARG 33 0.599 19.425 -1.519 264 HH21 ARG 33 1HH2 ARG 33 -0.707 21.308 -4.159 265 HH22 ARG 33 2HH2 ARG 33 0.616 21.119 -3.056 266 H ALA 34 H ALA 34 -2.282 13.459 -0.654 267 HA ALA 34 HA ALA 34 0.311 14.313 0.084 268 HB1 ALA 34 3HB ALA 34 -1.783 12.605 1.266 269 HB2 ALA 34 1HB ALA 34 -0.861 13.932 1.973 270 HB3 ALA 34 2HB ALA 34 -0.134 12.333 1.834 271 H ILE 35 H ILE 35 -0.915 11.149 -0.963 272 HA ILE 35 HA ILE 35 1.451 9.690 -0.701 273 HB ILE 35 HB ILE 35 -0.028 9.011 -3.150 274 HG12 ILE 35 1HG1 ILE 35 -1.903 9.980 -1.909 275 HG13 ILE 35 2HG1 ILE 35 -2.055 8.229 -2.000 276 HG21 ILE 35 1HG2 ILE 35 1.613 7.708 -1.496 277 HG22 ILE 35 2HG2 ILE 35 0.414 6.896 -2.502 278 HG23 ILE 35 3HG2 ILE 35 0.065 7.222 -0.804 279 HD11 ILE 35 3HD1 ILE 35 -0.786 9.491 0.385 280 HD12 ILE 35 1HD1 ILE 35 -1.613 7.940 0.242 281 HD13 ILE 35 2HD1 ILE 35 -2.541 9.440 0.229 282 H ALA 36 H ALA 36 0.206 11.483 -3.563 283 HA ALA 36 HA ALA 36 2.456 11.036 -5.203 284 HB1 ALA 36 3HB ALA 36 0.991 13.567 -5.577 285 HB2 ALA 36 1HB ALA 36 0.018 12.098 -5.627 286 HB3 ALA 36 2HB ALA 36 1.377 12.292 -6.733 287 H ASP 37 H ASP 37 1.807 13.307 -2.633 288 HA ASP 37 HA ASP 37 3.917 15.123 -3.303 289 HB2 ASP 37 1HB ASP 37 1.864 15.479 -1.736 290 HB3 ASP 37 2HB ASP 37 2.893 14.758 -0.503 291 H ALA 38 H ALA 38 3.751 12.091 -1.643 292 HA ALA 38 HA ALA 38 6.402 12.369 -0.489 293 HB1 ALA 38 3HB ALA 38 4.134 11.248 0.470 294 HB2 ALA 38 1HB ALA 38 5.760 10.829 1.020 295 HB3 ALA 38 2HB ALA 38 4.953 9.830 -0.191 296 H LEU 39 H LEU 39 6.636 12.386 -3.187 297 HA LEU 39 HA LEU 39 6.896 9.861 -4.423 298 HG LEU 39 HG LEU 39 6.096 13.044 -5.409 299 HB2 LEU 39 1HB LEU 39 8.334 12.436 -5.103 300 HB3 LEU 39 2HB LEU 39 8.180 11.039 -6.142 301 HD11 LEU 39 1HD1 LEU 39 6.767 13.652 -7.459 302 HD12 LEU 39 2HD1 LEU 39 5.742 12.321 -7.998 303 HD13 LEU 39 3HD1 LEU 39 7.477 12.075 -7.806 304 HD21 LEU 39 3HD2 LEU 39 5.617 10.179 -6.204 305 HD22 LEU 39 1HD2 LEU 39 4.446 11.455 -6.518 306 HD23 LEU 39 2HD2 LEU 39 4.910 11.070 -4.863 307 HA PRO 40 HA PRO 40 11.112 8.151 -3.918 308 HB2 PRO 40 1HB PRO 40 12.484 10.709 -4.665 309 HB3 PRO 40 2HB PRO 40 12.990 9.039 -4.951 310 HG2 PRO 40 1HG PRO 40 11.740 10.519 -6.843 311 HG3 PRO 40 2HG PRO 40 11.568 8.761 -6.726 312 HD2 PRO 40 1HD PRO 40 9.590 10.827 -6.247 313 HD3 PRO 40 2HD PRO 40 9.361 9.074 -6.348 314 H ILE 41 H ILE 41 11.027 7.900 -1.788 315 HA ILE 41 HA ILE 41 12.469 9.786 -0.118 316 HB ILE 41 HB ILE 41 9.564 9.088 0.348 317 HG12 ILE 41 1HG1 ILE 41 11.106 11.699 0.336 318 HG13 ILE 41 2HG1 ILE 41 9.997 11.140 -0.909 319 HG21 ILE 41 1HG2 ILE 41 9.792 10.082 2.596 320 HG22 ILE 41 2HG2 ILE 41 11.538 10.156 2.370 321 HG23 ILE 41 3HG2 ILE 41 10.722 8.596 2.422 322 HD11 ILE 41 3HD1 ILE 41 8.252 11.977 0.174 323 HD12 ILE 41 1HD1 ILE 41 9.404 12.766 1.250 324 HD13 ILE 41 2HD1 ILE 41 8.727 11.196 1.682 325 H LYS 42 H LYS 42 13.273 8.806 1.811 326 HA LYS 42 HA LYS 42 13.544 5.937 1.550 327 HB2 LYS 42 1HB LYS 42 15.062 8.084 2.749 328 HB3 LYS 42 2HB LYS 42 14.890 6.739 3.866 329 HG2 LYS 42 1HG LYS 42 16.262 5.422 2.688 330 HG3 LYS 42 2HG LYS 42 15.605 5.953 1.138 331 HD2 LYS 42 1HD LYS 42 17.602 6.961 0.903 332 HD3 LYS 42 2HD LYS 42 16.895 8.197 1.948 333 HE2 LYS 42 1HE LYS 42 17.933 7.274 3.878 334 HE3 LYS 42 2HE LYS 42 18.418 5.823 3.001 335 HZ1 LYS 42 3HZ LYS 42 19.614 7.694 1.545 336 HZ2 LYS 42 1HZ LYS 42 20.355 6.932 2.862 337 HZ3 LYS 42 2HZ LYS 42 19.647 8.454 3.055 338 H SER 43 H SER 43 12.758 4.405 2.860 339 HA SER 43 HA SER 43 11.466 5.110 5.368 340 HG SER 43 HG SER 43 9.505 3.228 2.465 341 HB2 SER 43 1HB SER 43 9.338 4.390 4.845 342 HB3 SER 43 2HB SER 43 9.814 5.109 3.310 343 H THR 44 H THR 44 11.247 3.348 6.814 344 HA THR 44 HA THR 44 12.954 1.055 6.091 345 HB THR 44 HB THR 44 12.089 1.327 8.897 346 HG1 THR 44 HG1 THR 44 13.163 3.157 9.324 347 HG21 THR 44 3HG2 THR 44 13.875 0.040 9.105 348 HG22 THR 44 1HG2 THR 44 14.864 1.446 8.713 349 HG23 THR 44 2HG2 THR 44 14.359 0.340 7.435 350 H ALA 45 H ALA 45 12.092 -0.863 5.751 351 HA ALA 45 HA ALA 45 9.255 -1.246 6.072 352 HB1 ALA 45 3HB ALA 45 11.338 -2.356 4.444 353 HB2 ALA 45 1HB ALA 45 9.589 -2.425 4.224 354 HB3 ALA 45 2HB ALA 45 10.404 -3.646 5.198 355 H ASN 46 H ASN 46 8.203 -2.499 7.452 356 HA ASN 46 HA ASN 46 9.762 -3.911 9.514 357 HB2 ASN 46 1HB ASN 46 7.008 -2.665 9.576 358 HB3 ASN 46 2HB ASN 46 7.584 -3.755 10.834 359 HD21 ASN 46 1HD2 ASN 46 6.942 -1.524 11.855 360 HD22 ASN 46 2HD2 ASN 46 8.278 -0.468 12.145 361 H ARG 47 H ARG 47 9.634 -6.142 9.499 362 HA ARG 47 HA ARG 47 7.868 -7.350 7.567 363 HE ARG 47 HE ARG 47 11.071 -10.377 8.438 364 HB2 ARG 47 1HB ARG 47 10.235 -8.183 9.123 365 HB3 ARG 47 2HB ARG 47 9.116 -9.460 8.662 366 HG2 ARG 47 1HG ARG 47 9.385 -7.999 6.350 367 HG3 ARG 47 2HG ARG 47 11.001 -7.955 7.042 368 HD2 ARG 47 1HD ARG 47 9.382 -10.291 6.134 369 HD3 ARG 47 2HD ARG 47 11.048 -9.866 5.761 370 HH11 ARG 47 1HH1 ARG 47 10.065 -12.165 5.617 371 HH12 ARG 47 2HH1 ARG 47 10.423 -13.709 6.314 372 HH21 ARG 47 1HH2 ARG 47 11.540 -12.406 9.357 373 HH22 ARG 47 2HH2 ARG 47 11.260 -13.847 8.437 374 H TRP 48 H TRP 48 6.107 -8.563 7.898 375 HA TRP 48 HA TRP 48 5.430 -9.577 10.527 376 HD1 TRP 48 HD1 TRP 48 1.652 -9.597 9.339 377 HE1 TRP 48 HE1 TRP 48 0.130 -10.118 11.348 378 HE3 TRP 48 HE3 TRP 48 4.340 -7.277 13.019 379 HZ2 TRP 48 HZ2 TRP 48 0.075 -9.613 14.124 380 HZ3 TRP 48 HZ3 TRP 48 3.482 -7.343 15.325 381 HH2 TRP 48 HH2 TRP 48 1.393 -8.487 15.864 382 HB2 TRP 48 1HB TRP 48 4.500 -7.287 10.564 383 HB3 TRP 48 2HB TRP 48 3.600 -7.633 9.091 384 H GLY 49 H GLY 49 3.855 -11.245 10.447 385 HA2 GLY 49 1HA GLY 49 3.907 -13.106 8.560 386 HA3 GLY 49 2HA GLY 49 2.426 -12.786 9.444 387 H ASP 50 H ASP 50 3.986 -12.726 6.423 388 HA ASP 50 HA ASP 50 3.396 -12.014 4.331 389 HB2 ASP 50 1HB ASP 50 0.542 -12.596 5.001 390 HB3 ASP 50 2HB ASP 50 1.469 -13.026 3.567 391 H GLU 51 H GLU 51 3.360 -9.922 6.344 392 HA GLU 51 HA GLU 51 1.700 -8.008 4.896 393 HB2 GLU 51 1HB GLU 51 0.720 -8.990 7.210 394 HB3 GLU 51 2HB GLU 51 1.703 -7.677 7.843 395 HG2 GLU 51 1HG GLU 51 -0.132 -7.101 5.580 396 HG3 GLU 51 2HG GLU 51 -0.819 -7.326 7.189 397 H ILE 52 H ILE 52 2.562 -5.944 4.821 398 HA ILE 52 HA ILE 52 4.987 -5.432 6.382 399 HB ILE 52 HB ILE 52 5.080 -6.186 3.682 400 HG12 ILE 52 1HG1 ILE 52 7.528 -5.390 3.966 401 HG13 ILE 52 2HG1 ILE 52 7.042 -4.960 5.602 402 HG21 ILE 52 1HG2 ILE 52 4.384 -3.962 2.993 403 HG22 ILE 52 2HG2 ILE 52 6.064 -4.256 2.547 404 HG23 ILE 52 3HG2 ILE 52 5.687 -3.244 3.942 405 HD11 ILE 52 3HD1 ILE 52 6.974 -7.705 4.368 406 HD12 ILE 52 1HD1 ILE 52 6.370 -7.305 5.978 407 HD13 ILE 52 2HD1 ILE 52 8.080 -7.117 5.604 408 H TYR 53 H TYR 53 4.933 -3.477 7.270 409 HA TYR 53 HA TYR 53 3.501 -1.325 5.881 410 HD1 TYR 53 HD1 TYR 53 4.326 -0.351 9.817 411 HD2 TYR 53 HD2 TYR 53 2.271 -3.991 9.008 412 HE1 TYR 53 HE1 TYR 53 5.006 -1.218 12.012 413 HE2 TYR 53 HE2 TYR 53 2.950 -4.867 11.202 414 HH TYR 53 HH TYR 53 5.358 -3.603 13.023 415 HB2 TYR 53 1HB TYR 53 2.548 -0.537 8.029 416 HB3 TYR 53 2HB TYR 53 1.960 -2.135 7.581 417 H PHE 54 H PHE 54 4.628 0.482 5.720 418 HA PHE 54 HA PHE 54 6.793 0.997 7.637 419 HD1 PHE 54 HD1 PHE 54 6.861 3.533 4.677 420 HD2 PHE 54 HD2 PHE 54 7.084 -0.523 3.416 421 HE1 PHE 54 HE1 PHE 54 6.156 4.200 2.419 422 HE2 PHE 54 HE2 PHE 54 6.374 0.136 1.157 423 HZ PHE 54 HZ PHE 54 5.910 2.501 0.656 424 HB2 PHE 54 1HB PHE 54 8.309 1.634 5.861 425 HB3 PHE 54 2HB PHE 54 7.731 0.003 5.556 426 H THR 55 H THR 55 7.243 3.171 8.051 427 HA THR 55 HA THR 55 5.097 5.014 7.268 428 HB THR 55 HB THR 55 7.205 5.977 9.099 429 HG1 THR 55 HG1 THR 55 7.043 4.469 10.538 430 HG21 THR 55 3HG2 THR 55 4.217 5.978 9.050 431 HG22 THR 55 1HG2 THR 55 5.334 7.341 9.043 432 HG23 THR 55 2HG2 THR 55 5.110 6.394 10.513 433 H THR 56 H THR 56 5.498 6.993 6.219 434 HA THR 56 HA THR 56 8.189 7.227 5.043 435 HB THR 56 HB THR 56 6.316 8.586 3.407 436 HG1 THR 56 HG1 THR 56 4.725 7.238 4.334 437 HG21 THR 56 3HG2 THR 56 7.208 5.929 2.540 438 HG22 THR 56 1HG2 THR 56 8.488 7.053 2.995 439 HG23 THR 56 2HG2 THR 56 7.333 7.494 1.735 440 H GLN 57 H GLN 57 6.425 8.592 7.332 441 HA GLN 57 HA GLN 57 6.758 10.560 8.460 442 HB2 GLN 57 1HB GLN 57 8.104 11.814 6.074 443 HB3 GLN 57 2HB GLN 57 8.288 12.210 7.778 444 HG2 GLN 57 1HG GLN 57 9.055 9.488 7.345 445 HG3 GLN 57 2HG GLN 57 9.898 10.534 6.203 446 HE21 GLN 57 1HE2 GLN 57 9.382 9.777 9.560 447 HE22 GLN 57 2HE2 GLN 57 10.742 10.646 10.173 448 H VAL 58 H VAL 58 5.077 10.139 5.581 449 HA VAL 58 HA VAL 58 3.957 12.813 5.505 450 HB VAL 58 HB VAL 58 4.239 11.590 3.391 451 HG11 VAL 58 1HG1 VAL 58 2.095 9.716 4.383 452 HG12 VAL 58 2HG1 VAL 58 3.811 9.319 4.287 453 HG13 VAL 58 3HG1 VAL 58 2.903 9.674 2.816 454 HG21 VAL 58 3HG2 VAL 58 2.585 13.274 3.347 455 HG22 VAL 58 1HG2 VAL 58 1.427 12.267 4.215 456 HG23 VAL 58 2HG2 VAL 58 1.869 11.871 2.554 457 H ALA 59 H ALA 59 2.458 13.423 6.908 458 HA ALA 59 HA ALA 59 0.792 11.356 8.164 459 HB1 ALA 59 3HB ALA 59 1.017 14.210 9.089 460 HB2 ALA 59 1HB ALA 59 2.150 12.951 9.585 461 HB3 ALA 59 2HB ALA 59 0.439 12.806 9.985 462 H VAL 60 H VAL 60 -0.822 11.022 6.720 463 HA VAL 60 HA VAL 60 -2.640 13.302 6.260 464 HB VAL 60 HB VAL 60 -1.650 12.692 4.133 465 HG11 VAL 60 1HG1 VAL 60 -1.609 10.517 3.217 466 HG12 VAL 60 2HG1 VAL 60 -2.695 9.889 4.454 467 HG13 VAL 60 3HG1 VAL 60 -1.045 10.348 4.879 468 HG21 VAL 60 3HG2 VAL 60 -3.704 11.925 2.890 469 HG22 VAL 60 1HG2 VAL 60 -3.924 13.335 3.925 470 HG23 VAL 60 2HG2 VAL 60 -4.491 11.752 4.457 471 H GLU 61 H GLU 61 -4.272 12.989 7.693 472 HA GLU 61 HA GLU 61 -5.544 10.336 7.701 473 HB2 GLU 61 1HB GLU 61 -4.211 11.618 9.887 474 HB3 GLU 61 2HB GLU 61 -5.925 11.495 10.261 475 HG2 GLU 61 1HG GLU 61 -5.759 9.058 9.633 476 HG3 GLU 61 2HG GLU 61 -4.010 9.277 9.605 477 H LYS 62 H LYS 62 -7.707 10.303 7.620 478 HA LYS 62 HA LYS 62 -9.323 12.554 8.373 479 HB2 LYS 62 1HB LYS 62 -8.610 13.334 6.179 480 HB3 LYS 62 2HB LYS 62 -9.072 11.804 5.450 481 HG2 LYS 62 1HG LYS 62 -11.318 12.285 5.527 482 HG3 LYS 62 2HG LYS 62 -11.140 13.423 6.863 483 HD2 LYS 62 1HD LYS 62 -11.464 14.901 5.156 484 HD3 LYS 62 2HD LYS 62 -9.709 14.742 5.070 485 HE2 LYS 62 1HE LYS 62 -10.182 14.385 2.880 486 HE3 LYS 62 2HE LYS 62 -10.371 12.731 3.459 487 HZ1 LYS 62 3HZ LYS 62 -12.552 12.761 3.046 488 HZ2 LYS 62 1HZ LYS 62 -12.227 14.107 2.072 489 HZ3 LYS 62 2HZ LYS 62 -12.765 14.322 3.662 490 H GLU 63 H GLU 63 -11.692 12.040 8.079 491 HA GLU 63 HA GLU 63 -12.078 9.164 8.405 492 HB2 GLU 63 1HB GLU 63 -12.996 10.338 10.206 493 HB3 GLU 63 2HB GLU 63 -13.702 11.572 9.176 494 HG2 GLU 63 1HG GLU 63 -15.582 10.402 8.880 495 HG3 GLU 63 2HG GLU 63 -14.714 8.885 8.652 496 H GLU 64 H GLU 64 -12.190 8.333 6.392 497 HA GLU 64 HA GLU 64 -14.637 8.571 4.987 498 HB2 GLU 64 1HB GLU 64 -13.839 10.600 4.075 499 HB3 GLU 64 2HB GLU 64 -12.220 9.958 3.847 500 HG2 GLU 64 1HG GLU 64 -12.713 9.076 1.850 501 HG3 GLU 64 2HG GLU 64 -14.310 8.538 2.365 502 H ASN 65 H ASN 65 -14.869 6.949 3.342 503 HA ASN 65 HA ASN 65 -14.475 4.953 2.333 504 HB2 ASN 65 1HB ASN 65 -12.618 6.184 1.255 505 HB3 ASN 65 2HB ASN 65 -11.558 5.742 2.593 506 HD21 ASN 65 1HD2 ASN 65 -10.498 5.017 0.433 507 HD22 ASN 65 2HD2 ASN 65 -10.743 3.354 0.030 508 H SER 66 H SER 66 -11.499 4.949 4.215 509 HA SER 66 HA SER 66 -10.631 3.197 5.481 510 HG SER 66 HG SER 66 -10.044 4.355 7.194 511 HB2 SER 66 1HB SER 66 -12.852 4.576 6.921 512 HB3 SER 66 2HB SER 66 -12.073 3.197 7.699 513 H LYS 67 H LYS 67 -11.104 1.299 4.148 514 HA LYS 67 HA LYS 67 -13.495 -0.196 4.995 515 HB2 LYS 67 1HB LYS 67 -12.921 -1.777 3.120 516 HB3 LYS 67 2HB LYS 67 -13.382 -0.164 2.610 517 HG2 LYS 67 1HG LYS 67 -11.597 -0.657 1.248 518 HG3 LYS 67 2HG LYS 67 -10.836 0.284 2.525 519 HD2 LYS 67 1HD LYS 67 -10.297 -1.928 3.642 520 HD3 LYS 67 2HD LYS 67 -10.820 -2.705 2.150 521 HE2 LYS 67 1HE LYS 67 -9.121 -1.527 0.904 522 HE3 LYS 67 2HE LYS 67 -8.642 -0.635 2.345 523 HZ1 LYS 67 3HZ LYS 67 -7.588 -3.007 1.476 524 HZ2 LYS 67 1HZ LYS 67 -8.573 -3.454 2.776 525 HZ3 LYS 67 2HZ LYS 67 -7.353 -2.308 2.994 526 H ASP 68 H ASP 68 -13.283 -2.491 5.540 527 HA ASP 68 HA ASP 68 -10.648 -3.065 6.751 528 HB2 ASP 68 1HB ASP 68 -11.959 -4.358 8.487 529 HB3 ASP 68 2HB ASP 68 -12.139 -2.606 8.539 530 H VAL 69 H VAL 69 -12.753 -4.119 4.379 531 HA VAL 69 HA VAL 69 -11.622 -6.834 4.568 532 HB VAL 69 HB VAL 69 -14.120 -6.686 5.097 533 HG11 VAL 69 1HG1 VAL 69 -15.614 -5.971 3.595 534 HG12 VAL 69 2HG1 VAL 69 -14.820 -6.819 2.268 535 HG13 VAL 69 3HG1 VAL 69 -14.243 -5.232 2.768 536 HG21 VAL 69 3HG2 VAL 69 -13.497 -8.487 2.777 537 HG22 VAL 69 1HG2 VAL 69 -14.510 -8.807 4.185 538 HG23 VAL 69 2HG2 VAL 69 -12.757 -8.718 4.360 539 H VAL 70 H VAL 70 -10.877 -7.760 2.702 540 HA VAL 70 HA VAL 70 -11.410 -6.593 0.120 541 HB VAL 70 HB VAL 70 -9.079 -6.058 -0.436 542 HG11 VAL 70 1HG1 VAL 70 -9.925 -4.505 1.989 543 HG12 VAL 70 2HG1 VAL 70 -10.703 -4.352 0.414 544 HG13 VAL 70 3HG1 VAL 70 -9.000 -3.932 0.601 545 HG21 VAL 70 3HG2 VAL 70 -8.025 -7.533 1.315 546 HG22 VAL 70 1HG2 VAL 70 -8.442 -6.292 2.499 547 HG23 VAL 70 2HG2 VAL 70 -7.336 -5.911 1.183 548 H GLU 71 H GLU 71 -10.449 -7.797 -1.656 549 HA GLU 71 HA GLU 71 -10.076 -10.603 -0.913 550 HB2 GLU 71 1HB GLU 71 -10.334 -9.675 -3.759 551 HB3 GLU 71 2HB GLU 71 -10.795 -11.212 -3.044 552 HG2 GLU 71 1HG GLU 71 -12.724 -10.351 -2.101 553 HG3 GLU 71 2HG GLU 71 -12.178 -8.685 -2.265 554 H LEU 72 H LEU 72 -8.460 -11.894 -1.748 555 HA LEU 72 HA LEU 72 -5.875 -11.075 -1.545 556 HG LEU 72 HG LEU 72 -4.337 -12.537 -3.399 557 HB2 LEU 72 1HB LEU 72 -6.535 -13.419 -1.635 558 HB3 LEU 72 2HB LEU 72 -6.976 -13.262 -3.320 559 HD11 LEU 72 1HD1 LEU 72 -4.465 -14.854 -1.489 560 HD12 LEU 72 2HD1 LEU 72 -4.233 -13.195 -0.944 561 HD13 LEU 72 3HD1 LEU 72 -3.052 -13.943 -2.017 562 HD21 LEU 72 3HD2 LEU 72 -5.158 -15.411 -3.567 563 HD22 LEU 72 1HD2 LEU 72 -4.025 -14.512 -4.576 564 HD23 LEU 72 2HD2 LEU 72 -5.759 -14.228 -4.728 565 H GLY 73 H GLY 73 -4.491 -9.846 -2.716 566 HA2 GLY 73 1HA GLY 73 -3.445 -9.459 -4.901 567 HA3 GLY 73 2HA GLY 73 -5.046 -9.561 -5.608 568 H ASP 74 H ASP 74 -6.163 -7.780 -3.424 569 HA ASP 74 HA ASP 74 -5.549 -5.329 -4.797 570 HB2 ASP 74 1HB ASP 74 -7.264 -4.379 -3.124 571 HB3 ASP 74 2HB ASP 74 -7.829 -5.519 -4.339 572 H VAL 75 H VAL 75 -4.987 -3.353 -3.765 573 HA VAL 75 HA VAL 75 -3.194 -3.759 -1.441 574 HB VAL 75 HB VAL 75 -2.980 -1.536 -3.502 575 HG11 VAL 75 1HG1 VAL 75 -0.805 -2.569 -1.700 576 HG12 VAL 75 2HG1 VAL 75 -1.907 -1.280 -1.207 577 HG13 VAL 75 3HG1 VAL 75 -0.867 -1.062 -2.615 578 HG21 VAL 75 3HG2 VAL 75 -2.460 -4.266 -3.920 579 HG22 VAL 75 1HG2 VAL 75 -0.890 -3.489 -3.720 580 HG23 VAL 75 2HG2 VAL 75 -2.010 -2.908 -4.950 581 H ALA 76 H ALA 76 -3.147 -2.027 0.217 582 HA ALA 76 HA ALA 76 -5.109 0.088 -0.025 583 HB1 ALA 76 3HB ALA 76 -6.741 -0.978 1.038 584 HB2 ALA 76 1HB ALA 76 -5.745 -0.898 2.491 585 HB3 ALA 76 2HB ALA 76 -5.689 -2.325 1.453 586 H TYR 77 H TYR 77 -4.924 1.727 1.562 587 HA TYR 77 HA TYR 77 -2.291 1.760 2.858 588 HD1 TYR 77 HD1 TYR 77 -1.140 4.387 3.850 589 HD2 TYR 77 HD2 TYR 77 -5.146 5.348 2.808 590 HE1 TYR 77 HE1 TYR 77 -1.120 6.208 5.491 591 HE2 TYR 77 HE2 TYR 77 -5.141 7.175 4.455 592 HH TYR 77 HH TYR 77 -3.605 8.574 5.648 593 HB2 TYR 77 1HB TYR 77 -2.213 3.682 1.648 594 HB3 TYR 77 2HB TYR 77 -3.963 3.788 1.513 595 H TRP 78 H TRP 78 -2.109 1.863 5.021 596 HA TRP 78 HA TRP 78 -4.457 1.514 6.624 597 HD1 TRP 78 HD1 TRP 78 -5.026 1.948 8.805 598 HE1 TRP 78 HE1 TRP 78 -5.321 0.817 11.098 599 HE3 TRP 78 HE3 TRP 78 -0.537 -0.474 9.084 600 HZ2 TRP 78 HZ2 TRP 78 -3.839 -0.886 12.798 601 HZ3 TRP 78 HZ3 TRP 78 -0.053 -1.833 11.077 602 HH2 TRP 78 HH2 TRP 78 -1.670 -2.034 12.894 603 HB2 TRP 78 1HB TRP 78 -2.101 0.536 7.025 604 HB3 TRP 78 2HB TRP 78 -1.718 2.106 7.722 605 H ILE 79 H ILE 79 -5.780 3.201 7.039 606 HA ILE 79 HA ILE 79 -4.924 5.891 6.998 607 HB ILE 79 HB ILE 79 -7.464 4.531 7.765 608 HG12 ILE 79 1HG1 ILE 79 -6.385 6.161 5.594 609 HG13 ILE 79 2HG1 ILE 79 -7.700 4.996 5.582 610 HG21 ILE 79 1HG2 ILE 79 -6.881 7.432 8.356 611 HG22 ILE 79 2HG2 ILE 79 -7.244 6.173 9.536 612 HG23 ILE 79 3HG2 ILE 79 -8.481 6.688 8.389 613 HD11 ILE 79 3HD1 ILE 79 -9.148 6.781 6.592 614 HD12 ILE 79 1HD1 ILE 79 -8.601 7.086 4.943 615 HD13 ILE 79 2HD1 ILE 79 -7.826 7.910 6.296 616 HA PRO 80 HA PRO 80 -5.191 5.941 11.846 617 HB2 PRO 80 1HB PRO 80 -5.349 3.056 12.499 618 HB3 PRO 80 2HB PRO 80 -6.202 4.421 13.226 619 HG2 PRO 80 1HG PRO 80 -7.454 2.686 11.619 620 HG3 PRO 80 2HG PRO 80 -7.858 4.413 11.622 621 HD2 PRO 80 1HD PRO 80 -6.256 2.843 9.654 622 HD3 PRO 80 2HD PRO 80 -7.391 4.174 9.386 623 H GLY 81 H GLY 81 -3.015 6.350 10.932 624 HA2 GLY 81 1HA GLY 81 -0.877 5.731 12.251 625 HA3 GLY 81 2HA GLY 81 -1.074 4.187 11.431 626 H LYS 82 H LYS 82 -2.227 6.183 9.187 627 HA LYS 82 HA LYS 82 -1.404 6.901 7.162 628 HB2 LYS 82 1HB LYS 82 1.017 8.085 8.385 629 HB3 LYS 82 2HB LYS 82 -0.167 8.802 7.307 630 HG2 LYS 82 1HG LYS 82 -0.835 9.965 9.083 631 HG3 LYS 82 2HG LYS 82 -1.600 8.473 9.631 632 HD2 LYS 82 1HD LYS 82 0.643 7.912 10.701 633 HD3 LYS 82 2HD LYS 82 1.070 9.599 10.416 634 HE2 LYS 82 1HE LYS 82 -1.339 8.663 11.970 635 HE3 LYS 82 2HE LYS 82 0.181 9.193 12.689 636 HZ1 LYS 82 3HZ LYS 82 -1.079 11.022 10.807 637 HZ2 LYS 82 1HZ LYS 82 -0.256 11.349 12.248 638 HZ3 LYS 82 2HZ LYS 82 -1.861 10.819 12.291 639 H ALA 83 H ALA 83 -0.638 4.276 7.797 640 HA ALA 83 HA ALA 83 2.045 4.128 6.577 641 HB1 ALA 83 3HB ALA 83 2.643 2.951 8.369 642 HB2 ALA 83 1HB ALA 83 1.556 1.673 7.818 643 HB3 ALA 83 2HB ALA 83 0.982 2.892 8.955 644 H ILE 84 H ILE 84 2.312 2.896 4.762 645 HA ILE 84 HA ILE 84 -0.092 1.814 3.517 646 HB ILE 84 HB ILE 84 2.471 1.413 2.121 647 HG12 ILE 84 1HG1 ILE 84 1.452 4.193 2.726 648 HG13 ILE 84 2HG1 ILE 84 3.055 3.547 3.048 649 HG21 ILE 84 1HG2 ILE 84 -0.169 1.368 1.456 650 HG22 ILE 84 2HG2 ILE 84 1.166 1.480 0.310 651 HG23 ILE 84 3HG2 ILE 84 0.336 2.943 0.841 652 HD11 ILE 84 3HD1 ILE 84 3.717 4.408 1.118 653 HD12 ILE 84 1HD1 ILE 84 2.064 4.875 0.712 654 HD13 ILE 84 2HD1 ILE 84 2.657 3.269 0.290 655 H CYS 85 H CYS 85 -0.340 -0.377 2.880 656 HA CYS 85 HA CYS 85 1.695 -2.254 3.831 657 HG CYS 85 HG CYS 85 -0.074 -1.609 6.947 658 HB2 CYS 85 1HB CYS 85 -1.132 -2.902 4.542 659 HB3 CYS 85 2HB CYS 85 0.358 -3.386 5.344 660 H LEU 86 H LEU 86 1.948 -4.070 2.610 661 HA LEU 86 HA LEU 86 0.354 -4.308 0.179 662 HG LEU 86 HG LEU 86 1.831 -4.270 -1.402 663 HB2 LEU 86 1HB LEU 86 3.008 -5.012 1.000 664 HB3 LEU 86 2HB LEU 86 2.197 -6.475 0.473 665 HD11 LEU 86 1HD1 LEU 86 3.989 -3.856 -2.058 666 HD12 LEU 86 2HD1 LEU 86 4.607 -5.350 -1.350 667 HD13 LEU 86 3HD1 LEU 86 4.205 -3.980 -0.313 668 HD21 LEU 86 3HD2 LEU 86 2.906 -7.086 -1.585 669 HD22 LEU 86 1HD2 LEU 86 2.635 -6.022 -2.969 670 HD23 LEU 86 2HD2 LEU 86 1.273 -6.539 -1.974 671 H PHE 87 H PHE 87 -0.516 -6.460 -0.469 672 HA PHE 87 HA PHE 87 -1.200 -8.160 1.820 673 HD1 PHE 87 HD1 PHE 87 -2.785 -7.348 3.494 674 HD2 PHE 87 HD2 PHE 87 -3.705 -4.962 0.098 675 HE1 PHE 87 HE1 PHE 87 -3.211 -5.430 4.973 676 HE2 PHE 87 HE2 PHE 87 -4.128 -3.038 1.574 677 HZ PHE 87 HZ PHE 87 -3.886 -3.266 4.009 678 HB2 PHE 87 1HB PHE 87 -3.216 -7.173 -0.201 679 HB3 PHE 87 2HB PHE 87 -3.537 -8.276 1.136 680 H PHE 88 H PHE 88 -0.508 -10.105 1.402 681 HA PHE 88 HA PHE 88 -1.215 -11.403 -1.089 682 HD1 PHE 88 HD1 PHE 88 0.445 -9.162 -2.547 683 HD2 PHE 88 HD2 PHE 88 1.328 -13.323 -2.678 684 HE1 PHE 88 HE1 PHE 88 0.396 -9.091 -5.006 685 HE2 PHE 88 HE2 PHE 88 1.281 -13.260 -5.137 686 HZ PHE 88 HZ PHE 88 0.815 -11.142 -6.304 687 HB2 PHE 88 1HB PHE 88 1.437 -10.405 -0.599 688 HB3 PHE 88 2HB PHE 88 1.472 -12.164 -0.647 689 H GLY 89 H GLY 89 -1.993 -11.624 1.695 690 HA2 GLY 89 1HA GLY 89 -2.312 -14.286 2.063 691 HA3 GLY 89 2HA GLY 89 -0.717 -13.999 2.740 692 H LYS 90 H LYS 90 -1.459 -14.619 4.810 693 HA LYS 90 HA LYS 90 -3.661 -13.680 6.170 694 HB2 LYS 90 1HB LYS 90 -2.630 -14.388 8.175 695 HB3 LYS 90 2HB LYS 90 -2.055 -15.476 6.928 696 HG2 LYS 90 1HG LYS 90 -0.054 -15.065 7.858 697 HG3 LYS 90 2HG LYS 90 -0.111 -13.594 6.885 698 HD2 LYS 90 1HD LYS 90 -0.101 -12.346 8.727 699 HD3 LYS 90 2HD LYS 90 -1.533 -13.175 9.331 700 HE2 LYS 90 1HE LYS 90 -0.275 -14.764 10.484 701 HE3 LYS 90 2HE LYS 90 1.186 -14.405 9.566 702 HZ1 LYS 90 3HZ LYS 90 0.992 -12.107 10.656 703 HZ2 LYS 90 1HZ LYS 90 1.559 -13.393 11.597 704 HZ3 LYS 90 2HZ LYS 90 -0.039 -12.866 11.762 705 H THR 91 H THR 91 -3.100 -12.478 8.424 706 HA THR 91 HA THR 91 -1.560 -10.074 8.126 707 HB THR 91 HB THR 91 -4.158 -9.109 8.786 708 HG1 THR 91 HG1 THR 91 -5.232 -10.604 7.684 709 HG21 THR 91 3HG2 THR 91 -2.817 -7.544 7.786 710 HG22 THR 91 1HG2 THR 91 -3.856 -8.013 6.442 711 HG23 THR 91 2HG2 THR 91 -2.227 -8.673 6.568 712 HA PRO 92 HA PRO 92 -1.521 -9.674 12.560 713 HB2 PRO 92 1HB PRO 92 -3.944 -7.907 12.546 714 HB3 PRO 92 2HB PRO 92 -2.445 -7.748 13.471 715 HG2 PRO 92 1HG PRO 92 -2.822 -6.280 11.296 716 HG3 PRO 92 2HG PRO 92 -1.234 -6.999 11.629 717 HD2 PRO 92 1HD PRO 92 -3.283 -7.778 9.626 718 HD3 PRO 92 2HD PRO 92 -1.516 -7.928 9.548 719 H ILE 93 H ILE 93 -4.643 -10.319 11.077 720 HA ILE 93 HA ILE 93 -5.163 -12.292 13.174 721 HB ILE 93 HB ILE 93 -7.328 -10.420 12.224 722 HG12 ILE 93 1HG1 ILE 93 -7.029 -9.824 14.847 723 HG13 ILE 93 2HG1 ILE 93 -5.357 -10.168 14.418 724 HG21 ILE 93 1HG2 ILE 93 -7.731 -12.840 13.140 725 HG22 ILE 93 2HG2 ILE 93 -8.754 -11.500 13.662 726 HG23 ILE 93 3HG2 ILE 93 -7.448 -12.071 14.701 727 HD11 ILE 93 3HD1 ILE 93 -7.148 -7.989 13.475 728 HD12 ILE 93 1HD1 ILE 93 -5.848 -8.555 12.428 729 HD13 ILE 93 2HD1 ILE 93 -5.474 -7.918 14.029 730 H SER 94 H SER 94 -4.380 -13.593 11.249 731 HA SER 94 HA SER 94 -5.881 -13.828 8.883 732 HG SER 94 HG SER 94 -3.064 -14.162 10.022 733 HB2 SER 94 1HB SER 94 -4.790 -16.382 9.633 734 HB3 SER 94 2HB SER 94 -4.248 -15.268 8.379 735 H ASP 95 H ASP 95 -5.752 -16.362 11.372 736 HA ASP 95 HA ASP 95 -7.313 -17.776 12.210 737 HB2 ASP 95 1HB ASP 95 -8.770 -15.221 11.884 738 HB3 ASP 95 2HB ASP 95 -9.770 -16.656 12.080 739 H ASP 96 H ASP 96 -9.734 -16.390 10.076 740 HA ASP 96 HA ASP 96 -9.625 -18.850 8.459 741 HB2 ASP 96 1HB ASP 96 -12.130 -18.425 8.125 742 HB3 ASP 96 2HB ASP 96 -11.622 -19.018 9.704 743 H LYS 97 H LYS 97 -10.012 -15.385 8.502 744 HA LYS 97 HA LYS 97 -9.806 -15.372 5.565 745 HB2 LYS 97 1HB LYS 97 -11.254 -13.282 7.197 746 HB3 LYS 97 2HB LYS 97 -11.231 -13.443 5.446 747 HG2 LYS 97 1HG LYS 97 -12.298 -15.779 5.951 748 HG3 LYS 97 2HG LYS 97 -12.742 -15.011 7.476 749 HD2 LYS 97 1HD LYS 97 -13.309 -13.236 5.293 750 HD3 LYS 97 2HD LYS 97 -14.049 -14.810 4.989 751 HE2 LYS 97 1HE LYS 97 -14.651 -14.434 7.612 752 HE3 LYS 97 2HE LYS 97 -14.685 -12.776 7.012 753 HZ1 LYS 97 3HZ LYS 97 -16.820 -13.447 6.615 754 HZ2 LYS 97 1HZ LYS 97 -16.392 -15.050 6.281 755 HZ3 LYS 97 2HZ LYS 97 -16.109 -13.842 5.132 756 H ILE 98 H ILE 98 -9.501 -12.565 5.329 757 HA ILE 98 HA ILE 98 -6.914 -12.175 6.686 758 HB ILE 98 HB ILE 98 -7.728 -11.268 3.922 759 HG12 ILE 98 1HG1 ILE 98 -5.565 -13.199 4.783 760 HG13 ILE 98 2HG1 ILE 98 -7.144 -13.679 4.163 761 HG21 ILE 98 1HG2 ILE 98 -6.220 -9.711 5.313 762 HG22 ILE 98 2HG2 ILE 98 -5.695 -10.156 3.691 763 HG23 ILE 98 3HG2 ILE 98 -4.989 -10.955 5.095 764 HD11 ILE 98 3HD1 ILE 98 -6.116 -11.874 2.292 765 HD12 ILE 98 1HD1 ILE 98 -6.288 -13.624 2.129 766 HD13 ILE 98 2HD1 ILE 98 -4.778 -12.941 2.734 767 H ARG 99 H ARG 99 -7.160 -10.701 8.227 768 HA ARG 99 HA ARG 99 -8.879 -8.370 7.682 769 HE ARG 99 HE ARG 99 -10.448 -10.456 11.220 770 HB2 ARG 99 1HB ARG 99 -8.904 -10.087 9.849 771 HB3 ARG 99 2HB ARG 99 -7.980 -8.715 10.446 772 HG2 ARG 99 1HG ARG 99 -10.000 -7.904 10.974 773 HG3 ARG 99 2HG ARG 99 -10.051 -7.439 9.272 774 HD2 ARG 99 1HD ARG 99 -12.105 -8.555 9.854 775 HD3 ARG 99 2HD ARG 99 -11.176 -9.579 8.761 776 HH11 ARG 99 1HH1 ARG 99 -13.531 -9.974 9.655 777 HH12 ARG 99 2HH1 ARG 99 -14.315 -11.246 10.530 778 HH21 ARG 99 1HH2 ARG 99 -11.478 -12.129 12.371 779 HH22 ARG 99 2HH2 ARG 99 -13.150 -12.469 12.073 780 HA PRO 100 HA PRO 100 -4.718 -6.532 7.427 781 HB2 PRO 100 1HB PRO 100 -5.481 -4.331 6.047 782 HB3 PRO 100 2HB PRO 100 -5.231 -5.903 5.277 783 HG2 PRO 100 1HG PRO 100 -7.790 -4.627 6.169 784 HG3 PRO 100 2HG PRO 100 -7.424 -5.448 4.636 785 HD2 PRO 100 1HD PRO 100 -8.742 -6.676 6.646 786 HD3 PRO 100 2HD PRO 100 -7.630 -7.550 5.572 787 H ALA 101 H ALA 101 -7.730 -5.023 8.466 788 HA ALA 101 HA ALA 101 -6.677 -4.001 10.859 789 HB1 ALA 101 3HB ALA 101 -5.931 -2.438 8.622 790 HB2 ALA 101 1HB ALA 101 -5.676 -2.093 10.332 791 HB3 ALA 101 2HB ALA 101 -7.135 -1.518 9.526 792 H SER 102 H SER 102 -8.197 -1.660 11.155 793 HA SER 102 HA SER 102 -10.916 -2.747 10.884 794 HG SER 102 HG SER 102 -9.312 -2.934 13.583 795 HB2 SER 102 1HB SER 102 -10.672 -0.599 12.824 796 HB3 SER 102 2HB SER 102 -11.290 -2.236 13.035 797 H ALA 103 H ALA 103 -8.919 -0.383 9.612 798 HA ALA 103 HA ALA 103 -11.099 0.899 8.299 799 HB1 ALA 103 3HB ALA 103 -11.351 2.036 10.402 800 HB2 ALA 103 1HB ALA 103 -10.727 3.167 9.202 801 HB3 ALA 103 2HB ALA 103 -9.643 2.475 10.411 802 H VAL 104 H VAL 104 -9.458 -0.091 6.724 803 HA VAL 104 HA VAL 104 -7.452 1.979 6.078 804 HB VAL 104 HB VAL 104 -5.981 0.348 5.102 805 HG11 VAL 104 1HG1 VAL 104 -5.990 0.739 7.587 806 HG12 VAL 104 2HG1 VAL 104 -5.259 -0.777 7.059 807 HG13 VAL 104 3HG1 VAL 104 -6.884 -0.772 7.742 808 HG21 VAL 104 3HG2 VAL 104 -6.437 -1.881 4.750 809 HG22 VAL 104 1HG2 VAL 104 -8.015 -1.162 4.435 810 HG23 VAL 104 2HG2 VAL 104 -7.692 -1.936 5.987 811 H ASN 105 H ASN 105 -7.249 2.722 4.046 812 HA ASN 105 HA ASN 105 -9.554 2.393 2.339 813 HB2 ASN 105 1HB ASN 105 -7.135 4.054 1.675 814 HB3 ASN 105 2HB ASN 105 -8.811 4.323 1.216 815 HD21 ASN 105 1HD2 ASN 105 -9.926 3.866 3.790 816 HD22 ASN 105 2HD2 ASN 105 -9.497 5.212 4.784 817 H VAL 106 H VAL 106 -9.514 1.853 0.130 818 HA VAL 106 HA VAL 106 -7.458 -0.094 -0.583 819 HB VAL 106 HB VAL 106 -9.209 0.178 -2.765 820 HG11 VAL 106 1HG1 VAL 106 -9.350 -2.046 -2.558 821 HG12 VAL 106 2HG1 VAL 106 -9.804 -1.969 -0.855 822 HG13 VAL 106 3HG1 VAL 106 -8.108 -1.819 -1.326 823 HG21 VAL 106 3HG2 VAL 106 -11.416 -0.325 -1.616 824 HG22 VAL 106 1HG2 VAL 106 -10.877 1.355 -1.603 825 HG23 VAL 106 2HG2 VAL 106 -10.692 0.358 -0.160 826 H ILE 107 H ILE 107 -5.673 1.067 -1.145 827 HA ILE 107 HA ILE 107 -5.846 3.392 -2.823 828 HB ILE 107 HB ILE 107 -4.178 3.018 -0.943 829 HG12 ILE 107 1HG1 ILE 107 -3.680 4.130 -3.651 830 HG13 ILE 107 2HG1 ILE 107 -3.693 4.937 -2.088 831 HG21 ILE 107 1HG2 ILE 107 -2.088 1.881 -1.535 832 HG22 ILE 107 2HG2 ILE 107 -2.788 1.393 -3.074 833 HG23 ILE 107 3HG2 ILE 107 -3.456 0.771 -1.565 834 HD11 ILE 107 3HD1 ILE 107 -1.483 3.210 -3.160 835 HD12 ILE 107 1HD1 ILE 107 -1.483 4.049 -1.608 836 HD13 ILE 107 2HD1 ILE 107 -1.493 4.975 -3.111 837 H GLY 108 H GLY 108 -6.581 0.602 -3.851 838 HA2 GLY 108 1HA GLY 108 -6.582 0.287 -6.273 839 HA3 GLY 108 2HA GLY 108 -4.887 0.742 -6.260 840 H ARG 109 H ARG 109 -4.230 -1.158 -7.284 841 HA ARG 109 HA ARG 109 -3.860 -3.387 -5.494 842 HE ARG 109 HE ARG 109 -6.473 -6.285 -6.248 843 HB2 ARG 109 1HB ARG 109 -5.218 -3.959 -8.122 844 HB3 ARG 109 2HB ARG 109 -4.939 -5.064 -6.785 845 HG2 ARG 109 1HG ARG 109 -6.539 -3.794 -5.418 846 HG3 ARG 109 2HG ARG 109 -6.836 -2.723 -6.788 847 HD2 ARG 109 1HD ARG 109 -8.581 -4.372 -6.696 848 HD3 ARG 109 2HD ARG 109 -7.569 -4.680 -8.105 849 HH11 ARG 109 1HH1 ARG 109 -9.768 -5.831 -7.307 850 HH12 ARG 109 2HH1 ARG 109 -10.236 -7.461 -6.959 851 HH21 ARG 109 1HH2 ARG 109 -7.088 -8.429 -5.792 852 HH22 ARG 109 2HH2 ARG 109 -8.715 -8.936 -6.099 853 H ILE 110 H ILE 110 -2.566 -5.154 -6.577 854 HA ILE 110 HA ILE 110 -0.451 -3.894 -8.150 855 HB ILE 110 HB ILE 110 -0.537 -6.660 -6.928 856 HG12 ILE 110 1HG1 ILE 110 1.353 -5.047 -5.602 857 HG13 ILE 110 2HG1 ILE 110 -0.090 -4.051 -5.743 858 HG21 ILE 110 1HG2 ILE 110 1.835 -6.736 -7.327 859 HG22 ILE 110 2HG2 ILE 110 1.822 -5.091 -7.961 860 HG23 ILE 110 3HG2 ILE 110 1.009 -6.382 -8.844 861 HD11 ILE 110 3HD1 ILE 110 -0.047 -5.270 -3.644 862 HD12 ILE 110 1HD1 ILE 110 0.043 -6.798 -4.515 863 HD13 ILE 110 2HD1 ILE 110 -1.400 -5.791 -4.643 864 H VAL 111 H VAL 111 -0.653 -3.981 -10.306 865 HA VAL 111 HA VAL 111 -1.928 -6.349 -11.501 866 HB VAL 111 HB VAL 111 -1.846 -4.682 -13.600 867 HG11 VAL 111 1HG1 VAL 111 -4.191 -3.888 -12.584 868 HG12 VAL 111 2HG1 VAL 111 -3.841 -5.226 -11.488 869 HG13 VAL 111 3HG1 VAL 111 -3.919 -5.507 -13.228 870 HG21 VAL 111 3HG2 VAL 111 -2.041 -2.438 -13.113 871 HG22 VAL 111 1HG2 VAL 111 -0.831 -2.943 -11.934 872 HG23 VAL 111 2HG2 VAL 111 -2.510 -2.733 -11.438 873 H ASN 112 H ASN 112 0.191 -4.047 -13.162 874 HA ASN 112 HA ASN 112 1.639 -6.138 -14.433 875 HB2 ASN 112 1HB ASN 112 3.135 -4.272 -15.207 876 HB3 ASN 112 2HB ASN 112 1.426 -4.026 -15.559 877 HD21 ASN 112 1HD2 ASN 112 0.322 -2.389 -14.561 878 HD22 ASN 112 2HD2 ASN 112 1.096 -1.164 -13.621 879 H SER 113 H SER 113 2.199 -7.310 -12.429 880 HA SER 113 HA SER 113 4.914 -7.063 -11.818 881 HG SER 113 HG SER 113 5.246 -4.944 -11.206 882 HB2 SER 113 1HB SER 113 3.130 -5.464 -10.138 883 HB3 SER 113 2HB SER 113 4.120 -6.588 -9.207 884 H MET 114 H MET 114 2.130 -7.811 -9.717 885 HA MET 114 HA MET 114 1.523 -9.722 -8.634 886 HB2 MET 114 1HB MET 114 1.538 -10.285 -11.288 887 HB3 MET 114 2HB MET 114 2.661 -11.503 -10.699 888 HG2 MET 114 1HG MET 114 1.048 -12.527 -9.373 889 HG3 MET 114 2HG MET 114 -0.009 -11.118 -9.408 890 HE1 MET 114 3HE MET 114 -1.734 -10.872 -12.360 891 HE2 MET 114 1HE MET 114 -1.621 -10.665 -10.612 892 HE3 MET 114 2HE MET 114 -2.561 -11.998 -11.283 893 H GLU 115 H GLU 115 4.101 -8.663 -8.017 894 HA GLU 115 HA GLU 115 5.947 -10.859 -7.794 895 HB2 GLU 115 1HB GLU 115 6.231 -8.141 -7.816 896 HB3 GLU 115 2HB GLU 115 6.415 -8.497 -6.105 897 HG2 GLU 115 1HG GLU 115 8.582 -8.580 -6.914 898 HG3 GLU 115 2HG GLU 115 8.100 -10.276 -6.859 899 H GLY 116 H GLY 116 6.708 -11.778 -5.846 900 HA2 GLY 116 1HA GLY 116 4.613 -12.006 -3.816 901 HA3 GLY 116 2HA GLY 116 5.968 -13.102 -4.035 902 H LEU 117 H LEU 117 5.890 -9.569 -3.669 903 HA LEU 117 HA LEU 117 8.144 -9.214 -2.224 904 HG LEU 117 HG LEU 117 8.163 -7.224 -0.649 905 HB2 LEU 117 1HB LEU 117 6.799 -7.351 -2.987 906 HB3 LEU 117 2HB LEU 117 5.522 -7.762 -1.858 907 HD11 LEU 117 1HD1 LEU 117 6.567 -5.084 -2.021 908 HD12 LEU 117 2HD1 LEU 117 8.272 -5.484 -2.246 909 HD13 LEU 117 3HD1 LEU 117 7.727 -4.760 -0.732 910 HD21 LEU 117 3HD2 LEU 117 5.683 -7.598 0.330 911 HD22 LEU 117 1HD2 LEU 117 5.716 -5.838 0.219 912 HD23 LEU 117 2HD2 LEU 117 6.940 -6.685 1.163 913 H LYS 118 H LYS 118 5.052 -10.339 -0.963 914 HA LYS 118 HA LYS 118 5.305 -10.085 1.722 915 HB2 LYS 118 1HB LYS 118 4.202 -12.416 1.860 916 HB3 LYS 118 2HB LYS 118 3.348 -11.120 1.041 917 HG2 LYS 118 1HG LYS 118 3.105 -12.492 -0.677 918 HG3 LYS 118 2HG LYS 118 4.831 -12.357 -0.964 919 HD2 LYS 118 1HD LYS 118 4.056 -14.263 1.137 920 HD3 LYS 118 2HD LYS 118 3.528 -14.687 -0.492 921 HE2 LYS 118 1HE LYS 118 6.344 -14.129 0.425 922 HE3 LYS 118 2HE LYS 118 5.679 -15.682 -0.074 923 HZ1 LYS 118 3HZ LYS 118 6.755 -13.581 -1.672 924 HZ2 LYS 118 1HZ LYS 118 5.200 -14.008 -2.189 925 HZ3 LYS 118 2HZ LYS 118 6.414 -15.182 -2.094 926 H GLY 119 H GLY 119 7.441 -11.987 -0.255 927 HA2 GLY 119 1HA GLY 119 8.440 -13.480 2.047 928 HA3 GLY 119 2HA GLY 119 8.928 -13.701 0.374 929 H VAL 120 H VAL 120 8.771 -10.615 2.027 930 HA VAL 120 HA VAL 120 11.445 -9.929 1.289 931 HB VAL 120 HB VAL 120 11.057 -7.931 2.800 932 HG11 VAL 120 1HG1 VAL 120 10.225 -6.880 1.025 933 HG12 VAL 120 2HG1 VAL 120 8.728 -7.804 1.074 934 HG13 VAL 120 3HG1 VAL 120 10.144 -8.463 0.254 935 HG21 VAL 120 3HG2 VAL 120 8.175 -8.423 2.894 936 HG22 VAL 120 1HG2 VAL 120 9.253 -7.725 4.105 937 HG23 VAL 120 2HG2 VAL 120 9.127 -9.477 3.942 938 H ALA 121 H ALA 121 13.206 -9.409 2.753 939 HA ALA 121 HA ALA 121 13.428 -11.318 4.921 940 HB1 ALA 121 3HB ALA 121 15.699 -10.930 4.891 941 HB2 ALA 121 1HB ALA 121 15.516 -9.247 4.401 942 HB3 ALA 121 2HB ALA 121 15.281 -10.540 3.224 943 H ASP 122 H ASP 122 13.745 -10.774 7.130 944 HA ASP 122 HA ASP 122 12.131 -8.750 8.108 945 HB2 ASP 122 1HB ASP 122 12.892 -9.274 10.276 946 HB3 ASP 122 2HB ASP 122 12.920 -10.781 9.361 947 H GLY 123 H GLY 123 12.301 -6.654 8.096 948 HA2 GLY 123 1HA GLY 123 13.165 -4.542 8.264 949 HA3 GLY 123 2HA GLY 123 14.532 -5.258 9.096 950 H GLU 124 H GLU 124 13.387 -3.855 6.197 951 HA GLU 124 HA GLU 124 16.096 -3.763 5.172 952 HB2 GLU 124 1HB GLU 124 14.550 -4.322 2.863 953 HB3 GLU 124 2HB GLU 124 15.868 -5.264 3.533 954 HG2 GLU 124 1HG GLU 124 14.075 -6.336 5.033 955 HG3 GLU 124 2HG GLU 124 12.921 -5.629 3.900 956 H SER 125 H SER 125 16.393 -2.165 3.516 957 HA SER 125 HA SER 125 15.109 0.242 4.039 958 HG SER 125 HG SER 125 16.277 1.965 2.921 959 HB2 SER 125 1HB SER 125 17.349 -0.075 2.921 960 HB3 SER 125 2HB SER 125 16.478 -0.446 1.433 961 H VAL 126 H VAL 126 13.948 1.612 2.459 962 HA VAL 126 HA VAL 126 12.305 0.330 0.473 963 HB VAL 126 HB VAL 126 10.930 1.534 2.884 964 HG11 VAL 126 1HG1 VAL 126 9.625 1.937 0.945 965 HG12 VAL 126 2HG1 VAL 126 8.897 0.571 1.787 966 HG13 VAL 126 3HG1 VAL 126 9.883 0.295 0.354 967 HG21 VAL 126 3HG2 VAL 126 11.801 -0.583 3.543 968 HG22 VAL 126 1HG2 VAL 126 11.246 -1.338 2.047 969 HG23 VAL 126 2HG2 VAL 126 10.075 -0.777 3.241 970 H VAL 127 H VAL 127 11.946 1.763 -1.139 971 HA VAL 127 HA VAL 127 12.021 4.629 -0.457 972 HB VAL 127 HB VAL 127 13.122 5.070 -2.633 973 HG11 VAL 127 1HG1 VAL 127 14.273 4.268 -0.273 974 HG12 VAL 127 2HG1 VAL 127 15.119 5.002 -1.635 975 HG13 VAL 127 3HG1 VAL 127 15.076 3.247 -1.466 976 HG21 VAL 127 3HG2 VAL 127 12.991 3.453 -4.162 977 HG22 VAL 127 1HG2 VAL 127 12.687 2.209 -2.948 978 HG23 VAL 127 2HG2 VAL 127 14.342 2.702 -3.311 979 H VAL 128 H VAL 128 10.009 5.339 -0.717 980 HA VAL 128 HA VAL 128 8.230 4.212 -2.698 981 HB VAL 128 HB VAL 128 7.394 6.711 -1.376 982 HG11 VAL 128 1HG1 VAL 128 6.240 4.033 -1.981 983 HG12 VAL 128 2HG1 VAL 128 5.619 5.643 -2.356 984 HG13 VAL 128 3HG1 VAL 128 5.500 5.010 -0.716 985 HG21 VAL 128 3HG2 VAL 128 6.933 5.240 0.761 986 HG22 VAL 128 1HG2 VAL 128 8.448 6.124 0.568 987 HG23 VAL 128 2HG2 VAL 128 8.381 4.396 0.213 988 H GLU 129 H GLU 129 7.873 5.050 -4.732 989 HA GLU 129 HA GLU 129 8.348 7.854 -5.262 990 HB2 GLU 129 1HB GLU 129 9.849 7.300 -7.216 991 HB3 GLU 129 2HB GLU 129 10.568 7.083 -5.626 992 HG2 GLU 129 1HG GLU 129 9.866 4.631 -5.861 993 HG3 GLU 129 2HG GLU 129 9.647 5.002 -7.570 994 H ARG 130 H ARG 130 6.884 8.597 -6.688 995 HA ARG 130 HA ARG 130 5.019 6.786 -7.900 996 HE ARG 130 HE ARG 130 4.942 8.754 -11.881 997 HB2 ARG 130 1HB ARG 130 4.279 8.942 -7.024 998 HB3 ARG 130 2HB ARG 130 5.334 9.784 -8.149 999 HG2 ARG 130 1HG ARG 130 3.353 7.928 -9.320 1000 HG3 ARG 130 2HG ARG 130 2.736 9.410 -8.584 1001 HD2 ARG 130 1HD ARG 130 3.259 10.496 -10.445 1002 HD3 ARG 130 2HD ARG 130 4.960 10.177 -10.110 1003 HH11 ARG 130 1HH1 ARG 130 1.688 8.955 -10.636 1004 HH12 ARG 130 2HH1 ARG 130 1.024 7.921 -11.856 1005 HH21 ARG 130 1HH2 ARG 130 4.068 7.397 -13.490 1006 HH22 ARG 130 2HH2 ARG 130 2.375 7.038 -13.476 1007 H ALA 131 H ALA 131 6.211 5.557 -9.365 1008 HA ALA 131 HA ALA 131 7.372 5.045 -11.278 1009 HB1 ALA 131 3HB ALA 131 6.146 5.501 -13.145 1010 HB2 ALA 131 1HB ALA 131 5.869 7.183 -12.691 1011 HB3 ALA 131 2HB ALA 131 4.965 5.893 -11.896 Start of MODEL 2 1 H MET 1 H MET 1 -15.446 10.546 -22.840 2 HA MET 1 HA MET 1 -13.182 8.695 -23.148 3 HB2 MET 1 1HB MET 1 -13.979 10.650 -24.917 4 HB3 MET 1 2HB MET 1 -12.847 11.515 -23.886 5 HG2 MET 1 1HG MET 1 -11.772 8.955 -24.620 6 HG3 MET 1 2HG MET 1 -12.263 9.854 -26.054 7 HE1 MET 1 3HE MET 1 -9.514 10.783 -22.734 8 HE2 MET 1 1HE MET 1 -8.647 9.791 -23.906 9 HE3 MET 1 2HE MET 1 -10.191 9.240 -23.256 10 H GLY 2 H GLY 2 -11.789 8.794 -21.498 11 HA2 GLY 2 1HA GLY 2 -10.502 10.262 -19.990 12 HA3 GLY 2 2HA GLY 2 -12.016 11.078 -19.637 13 H GLU 3 H GLU 3 -9.941 9.446 -18.049 14 HA GLU 3 HA GLU 3 -11.720 7.418 -16.910 15 HB2 GLU 3 1HB GLU 3 -8.849 7.902 -16.141 16 HB3 GLU 3 2HB GLU 3 -9.806 6.448 -15.901 17 HG2 GLU 3 1HG GLU 3 -9.091 5.630 -17.821 18 HG3 GLU 3 2HG GLU 3 -9.732 7.027 -18.684 19 H ARG 4 H ARG 4 -11.872 10.427 -16.507 20 HA ARG 4 HA ARG 4 -12.365 11.886 -14.840 21 HE ARG 4 HE ARG 4 -13.298 7.626 -15.241 22 HB2 ARG 4 1HB ARG 4 -12.833 9.271 -13.410 23 HB3 ARG 4 2HB ARG 4 -13.152 10.830 -12.659 24 HG2 ARG 4 1HG ARG 4 -15.221 10.186 -13.479 25 HG3 ARG 4 2HG ARG 4 -14.621 11.299 -14.707 26 HD2 ARG 4 1HD ARG 4 -15.678 9.151 -15.544 27 HD3 ARG 4 2HD ARG 4 -14.084 9.545 -16.185 28 HH11 ARG 4 1HH1 ARG 4 -16.263 8.502 -13.623 29 HH12 ARG 4 2HH1 ARG 4 -16.308 7.063 -12.660 30 HH21 ARG 4 1HH2 ARG 4 -13.357 5.734 -13.975 31 HH22 ARG 4 2HH2 ARG 4 -14.658 5.492 -12.859 32 H GLY 5 H GLY 5 -11.012 9.491 -12.619 33 HA2 GLY 5 1HA GLY 5 -8.450 10.777 -12.460 34 HA3 GLY 5 2HA GLY 5 -9.492 11.183 -11.108 35 H VAL 6 H VAL 6 -9.670 8.075 -12.671 36 HA VAL 6 HA VAL 6 -8.429 6.871 -10.270 37 HB VAL 6 HB VAL 6 -9.850 4.910 -10.583 38 HG11 VAL 6 1HG1 VAL 6 -12.143 6.312 -10.406 39 HG12 VAL 6 2HG1 VAL 6 -10.967 7.592 -10.108 40 HG13 VAL 6 3HG1 VAL 6 -10.983 6.154 -9.088 41 HG21 VAL 6 3HG2 VAL 6 -11.161 4.495 -12.360 42 HG22 VAL 6 1HG2 VAL 6 -10.127 5.666 -13.176 43 HG23 VAL 6 2HG2 VAL 6 -11.677 6.174 -12.506 44 H GLU 7 H GLU 7 -6.493 7.354 -11.790 45 HA GLU 7 HA GLU 7 -5.671 4.830 -12.879 46 HB2 GLU 7 1HB GLU 7 -4.951 6.104 -15.067 47 HB3 GLU 7 2HB GLU 7 -6.550 5.389 -14.928 48 HG2 GLU 7 1HG GLU 7 -6.589 7.642 -15.903 49 HG3 GLU 7 2HG GLU 7 -7.513 7.533 -14.405 50 H MET 8 H MET 8 -4.781 6.418 -10.731 51 HA MET 8 HA MET 8 -2.210 7.458 -11.707 52 HB2 MET 8 1HB MET 8 -3.930 8.782 -10.160 53 HB3 MET 8 2HB MET 8 -3.079 7.906 -8.895 54 HG2 MET 8 1HG MET 8 -1.541 9.493 -8.929 55 HG3 MET 8 2HG MET 8 -1.075 8.931 -10.533 56 HE1 MET 8 3HE MET 8 -1.107 12.884 -10.584 57 HE2 MET 8 1HE MET 8 -0.216 11.498 -9.955 58 HE3 MET 8 2HE MET 8 -1.446 12.279 -8.962 59 H ARG 9 H ARG 9 -0.658 5.993 -11.646 60 HA ARG 9 HA ARG 9 -0.615 4.086 -9.405 61 HE ARG 9 HE ARG 9 2.877 2.312 -13.766 62 HB2 ARG 9 1HB ARG 9 0.370 2.495 -10.766 63 HB3 ARG 9 2HB ARG 9 -0.732 3.309 -11.868 64 HG2 ARG 9 1HG ARG 9 1.058 3.380 -13.217 65 HG3 ARG 9 2HG ARG 9 1.522 4.771 -12.237 66 HD2 ARG 9 1HD ARG 9 3.202 3.660 -11.213 67 HD3 ARG 9 2HD ARG 9 2.318 2.134 -11.183 68 HH11 ARG 9 1HH1 ARG 9 4.931 2.907 -11.002 69 HH12 ARG 9 2HH1 ARG 9 6.383 2.462 -11.834 70 HH21 ARG 9 1HH2 ARG 9 4.786 1.723 -14.852 71 HH22 ARG 9 2HH2 ARG 9 6.301 1.788 -14.013 72 H LEU 10 H LEU 10 1.200 3.672 -8.244 73 HA LEU 10 HA LEU 10 3.456 5.527 -8.617 74 HG LEU 10 HG LEU 10 0.882 4.451 -6.269 75 HB2 LEU 10 1HB LEU 10 3.409 4.708 -5.899 76 HB3 LEU 10 2HB LEU 10 3.224 6.322 -6.549 77 HD11 LEU 10 1HD1 LEU 10 2.068 6.333 -4.234 78 HD12 LEU 10 2HD1 LEU 10 1.705 4.616 -4.045 79 HD13 LEU 10 3HD1 LEU 10 0.392 5.786 -4.175 80 HD21 LEU 10 3HD2 LEU 10 -0.355 6.172 -6.976 81 HD22 LEU 10 1HD2 LEU 10 1.165 6.859 -7.552 82 HD23 LEU 10 2HD2 LEU 10 0.523 7.330 -5.978 83 H ARG 11 H ARG 11 5.503 4.694 -7.620 84 HA ARG 11 HA ARG 11 5.677 1.807 -8.100 85 HE ARG 11 HE ARG 11 10.019 0.723 -9.861 86 HB2 ARG 11 1HB ARG 11 7.157 3.892 -9.161 87 HB3 ARG 11 2HB ARG 11 8.219 3.225 -7.930 88 HG2 ARG 11 1HG ARG 11 6.913 1.631 -10.126 89 HG3 ARG 11 2HG ARG 11 8.571 2.232 -10.156 90 HD2 ARG 11 1HD ARG 11 8.355 0.908 -7.723 91 HD3 ARG 11 2HD ARG 11 7.470 -0.111 -8.857 92 HH11 ARG 11 1HH1 ARG 11 8.396 -1.621 -7.849 93 HH12 ARG 11 2HH1 ARG 11 9.625 -2.824 -8.043 94 HH21 ARG 11 1HH2 ARG 11 11.639 -0.859 -10.116 95 HH22 ARG 11 2HH2 ARG 11 11.466 -2.392 -9.329 96 H ILE 12 H ILE 12 6.730 0.455 -6.650 97 HA ILE 12 HA ILE 12 7.826 1.564 -4.203 98 HB ILE 12 HB ILE 12 5.205 0.203 -4.336 99 HG12 ILE 12 1HG1 ILE 12 6.485 1.876 -2.173 100 HG13 ILE 12 2HG1 ILE 12 5.640 2.546 -3.565 101 HG21 ILE 12 1HG2 ILE 12 7.315 -0.686 -2.409 102 HG22 ILE 12 2HG2 ILE 12 6.149 -1.650 -3.316 103 HG23 ILE 12 3HG2 ILE 12 5.613 -0.680 -1.945 104 HD11 ILE 12 3HD1 ILE 12 4.254 0.578 -1.808 105 HD12 ILE 12 1HD1 ILE 12 3.579 1.862 -2.810 106 HD13 ILE 12 2HD1 ILE 12 4.405 2.261 -1.304 107 H ARG 13 H ARG 13 9.790 0.703 -4.554 108 HA ARG 13 HA ARG 13 9.946 -2.173 -5.146 109 HE ARG 13 HE ARG 13 14.080 -0.290 -7.776 110 HB2 ARG 13 1HB ARG 13 12.290 -1.732 -5.803 111 HB3 ARG 13 2HB ARG 13 11.129 -0.816 -6.754 112 HG2 ARG 13 1HG ARG 13 11.620 1.037 -4.944 113 HG3 ARG 13 2HG ARG 13 13.118 0.123 -4.755 114 HD2 ARG 13 1HD ARG 13 12.147 0.929 -7.471 115 HD3 ARG 13 2HD ARG 13 13.035 2.069 -6.461 116 HH11 ARG 13 1HH1 ARG 13 14.610 2.174 -5.359 117 HH12 ARG 13 2HH1 ARG 13 16.327 1.965 -5.345 118 HH21 ARG 13 1HH2 ARG 13 16.339 -0.564 -7.756 119 HH22 ARG 13 2HH2 ARG 13 17.309 0.412 -6.704 120 H PHE 14 H PHE 14 11.519 -3.471 -4.100 121 HA PHE 14 HA PHE 14 12.366 -2.533 -1.448 122 HD1 PHE 14 HD1 PHE 14 9.640 -2.284 -1.522 123 HD2 PHE 14 HD2 PHE 14 11.076 -5.296 1.126 124 HE1 PHE 14 HE1 PHE 14 8.232 -1.374 0.271 125 HE2 PHE 14 HE2 PHE 14 9.667 -4.385 2.923 126 HZ PHE 14 HZ PHE 14 8.242 -2.423 2.496 127 HB2 PHE 14 1HB PHE 14 10.666 -4.857 -2.160 128 HB3 PHE 14 2HB PHE 14 11.946 -5.181 -0.997 129 H GLU 15 H GLU 15 14.394 -3.169 -0.851 130 HA GLU 15 HA GLU 15 16.347 -3.660 -2.666 131 HB2 GLU 15 1HB GLU 15 16.138 -4.050 0.251 132 HB3 GLU 15 2HB GLU 15 17.394 -4.995 -0.531 133 HG2 GLU 15 1HG GLU 15 17.945 -2.653 0.401 134 HG3 GLU 15 2HG GLU 15 18.594 -3.148 -1.159 135 H SER 16 H SER 16 14.201 -6.045 -1.311 136 HA SER 16 HA SER 16 15.613 -8.118 -2.863 137 HG SER 16 HG SER 16 16.249 -9.985 -0.390 138 HB2 SER 16 1HB SER 16 14.467 -8.161 -0.119 139 HB3 SER 16 2HB SER 16 14.293 -9.624 -1.088 140 H ALA 17 H ALA 17 13.279 -6.278 -3.581 141 HA ALA 17 HA ALA 17 11.814 -8.194 -5.052 142 HB1 ALA 17 3HB ALA 17 9.968 -7.062 -3.018 143 HB2 ALA 17 1HB ALA 17 10.991 -8.421 -2.550 144 HB3 ALA 17 2HB ALA 17 9.882 -8.580 -3.911 145 H GLU 18 H GLU 18 10.256 -7.333 -6.448 146 HA GLU 18 HA GLU 18 10.098 -4.384 -6.514 147 HB2 GLU 18 1HB GLU 18 10.131 -4.523 -8.980 148 HB3 GLU 18 2HB GLU 18 11.617 -5.122 -8.255 149 HG2 GLU 18 1HG GLU 18 10.562 -7.441 -8.456 150 HG3 GLU 18 2HG GLU 18 9.402 -6.675 -9.538 151 H CYS 19 H CYS 19 8.105 -3.479 -6.927 152 HA CYS 19 HA CYS 19 5.958 -5.009 -8.069 153 HG CYS 19 HG CYS 19 6.935 -4.406 -4.245 154 HB2 CYS 19 1HB CYS 19 4.753 -4.302 -5.621 155 HB3 CYS 19 2HB CYS 19 5.072 -5.923 -6.225 156 H GLU 20 H GLU 20 4.104 -3.767 -8.572 157 HA GLU 20 HA GLU 20 4.371 -0.878 -8.038 158 HB2 GLU 20 1HB GLU 20 3.034 -1.825 -10.534 159 HB3 GLU 20 2HB GLU 20 3.902 -0.328 -10.235 160 HG2 GLU 20 1HG GLU 20 6.006 -1.749 -10.142 161 HG3 GLU 20 2HG GLU 20 5.022 -3.041 -10.826 162 H VAL 21 H VAL 21 2.313 0.311 -8.060 163 HA VAL 21 HA VAL 21 -0.094 -1.293 -7.796 164 HB VAL 21 HB VAL 21 -0.245 -1.281 -5.583 165 HG11 VAL 21 1HG1 VAL 21 1.663 -0.532 -4.198 166 HG12 VAL 21 2HG1 VAL 21 2.380 0.198 -5.636 167 HG13 VAL 21 3HG1 VAL 21 2.137 -1.549 -5.559 168 HG21 VAL 21 3HG2 VAL 21 -0.391 0.765 -4.260 169 HG22 VAL 21 1HG2 VAL 21 -1.324 0.909 -5.751 170 HG23 VAL 21 2HG2 VAL 21 0.248 1.697 -5.614 171 H GLU 22 H GLU 22 -1.955 -0.225 -8.242 172 HA GLU 22 HA GLU 22 -1.663 2.486 -9.302 173 HB2 GLU 22 1HB GLU 22 -3.485 0.200 -9.831 174 HB3 GLU 22 2HB GLU 22 -4.165 1.812 -10.012 175 HG2 GLU 22 1HG GLU 22 -2.828 2.331 -11.797 176 HG3 GLU 22 2HG GLU 22 -1.566 1.196 -11.319 177 H LEU 23 H LEU 23 -4.018 3.674 -9.084 178 HA LEU 23 HA LEU 23 -5.130 3.290 -6.454 179 HG LEU 23 HG LEU 23 -5.611 6.538 -6.344 180 HB2 LEU 23 1HB LEU 23 -3.403 4.607 -5.653 181 HB3 LEU 23 2HB LEU 23 -3.332 5.581 -7.104 182 HD11 LEU 23 1HD1 LEU 23 -4.867 4.846 -4.049 183 HD12 LEU 23 2HD1 LEU 23 -6.448 5.437 -4.563 184 HD13 LEU 23 3HD1 LEU 23 -5.368 6.489 -3.651 185 HD21 LEU 23 3HD2 LEU 23 -3.793 7.988 -6.337 186 HD22 LEU 23 1HD2 LEU 23 -2.947 7.079 -5.085 187 HD23 LEU 23 2HD2 LEU 23 -4.366 8.039 -4.670 188 H TYR 24 H TYR 24 -7.117 4.215 -6.154 189 HA TYR 24 HA TYR 24 -8.226 5.711 -8.434 190 HD1 TYR 24 HD1 TYR 24 -7.829 4.403 -9.981 191 HD2 TYR 24 HD2 TYR 24 -9.848 1.367 -7.788 192 HE1 TYR 24 HE1 TYR 24 -6.977 2.712 -11.548 193 HE2 TYR 24 HE2 TYR 24 -9.000 -0.333 -9.349 194 HH TYR 24 HH TYR 24 -8.155 -0.103 -12.039 195 HB2 TYR 24 1HB TYR 24 -9.672 3.538 -6.887 196 HB3 TYR 24 2HB TYR 24 -10.322 4.470 -8.232 197 H GLU 25 H GLU 25 -9.780 7.273 -7.962 198 HA GLU 25 HA GLU 25 -9.452 8.696 -5.590 199 HB2 GLU 25 1HB GLU 25 -11.735 8.797 -7.560 200 HB3 GLU 25 2HB GLU 25 -11.502 9.958 -6.259 201 HG2 GLU 25 1HG GLU 25 -9.730 10.965 -7.285 202 HG3 GLU 25 2HG GLU 25 -9.252 9.504 -8.149 203 H GLU 26 H GLU 26 -11.218 5.835 -5.917 204 HA GLU 26 HA GLU 26 -13.500 6.108 -4.469 205 HB2 GLU 26 1HB GLU 26 -13.360 3.803 -3.917 206 HB3 GLU 26 2HB GLU 26 -12.563 3.988 -5.473 207 HG2 GLU 26 1HG GLU 26 -10.380 4.049 -4.240 208 HG3 GLU 26 2HG GLU 26 -11.272 3.610 -2.785 209 H TRP 27 H TRP 27 -10.239 6.335 -3.254 210 HA TRP 27 HA TRP 27 -11.033 6.188 -0.485 211 HD1 TRP 27 HD1 TRP 27 -10.117 7.536 1.414 212 HE1 TRP 27 HE1 TRP 27 -8.381 8.311 3.149 213 HE3 TRP 27 HE3 TRP 27 -5.844 6.391 -1.146 214 HZ2 TRP 27 HZ2 TRP 27 -5.572 8.419 3.399 215 HZ3 TRP 27 HZ3 TRP 27 -3.673 6.861 -0.088 216 HH2 TRP 27 HH2 TRP 27 -3.541 7.854 2.137 217 HB2 TRP 27 1HB TRP 27 -8.831 5.378 -0.981 218 HB3 TRP 27 2HB TRP 27 -8.418 6.851 -1.854 219 H ALA 28 H ALA 28 -9.667 8.725 -2.602 220 HA ALA 28 HA ALA 28 -11.355 10.752 -2.292 221 HB1 ALA 28 3HB ALA 28 -9.838 10.468 0.269 222 HB2 ALA 28 1HB ALA 28 -11.540 10.852 0.005 223 HB3 ALA 28 2HB ALA 28 -10.303 12.071 -0.299 224 HA PRO 29 HA PRO 29 -8.033 12.173 -4.973 225 HB2 PRO 29 1HB PRO 29 -9.251 14.769 -4.994 226 HB3 PRO 29 2HB PRO 29 -9.240 13.559 -6.275 227 HG2 PRO 29 1HG PRO 29 -11.352 14.232 -4.365 228 HG3 PRO 29 2HG PRO 29 -11.459 13.330 -5.883 229 HD2 PRO 29 1HD PRO 29 -11.725 12.201 -3.407 230 HD3 PRO 29 2HD PRO 29 -11.176 11.314 -4.840 231 H GLU 30 H GLU 30 -9.251 13.969 -2.173 232 HA GLU 30 HA GLU 30 -7.179 15.821 -1.920 233 HB2 GLU 30 1HB GLU 30 -9.069 14.592 0.070 234 HB3 GLU 30 2HB GLU 30 -7.856 15.768 0.564 235 HG2 GLU 30 1HG GLU 30 -9.671 17.115 0.223 236 HG3 GLU 30 2HG GLU 30 -8.880 17.206 -1.351 237 H THR 31 H THR 31 -7.555 12.668 -0.290 238 HA THR 31 HA THR 31 -5.061 12.768 1.056 239 HB THR 31 HB THR 31 -5.635 10.045 0.561 240 HG1 THR 31 HG1 THR 31 -7.639 10.305 -0.149 241 HG21 THR 31 3HG2 THR 31 -6.698 10.195 2.893 242 HG22 THR 31 1HG2 THR 31 -6.160 11.875 2.874 243 HG23 THR 31 2HG2 THR 31 -4.984 10.568 2.720 244 H VAL 32 H VAL 32 -6.005 11.323 -2.046 245 HA VAL 32 HA VAL 32 -3.705 10.036 -2.786 246 HB VAL 32 HB VAL 32 -5.453 11.727 -4.582 247 HG11 VAL 32 1HG1 VAL 32 -4.650 9.789 -6.197 248 HG12 VAL 32 2HG1 VAL 32 -3.257 9.801 -5.116 249 HG13 VAL 32 3HG1 VAL 32 -3.712 11.268 -5.981 250 HG21 VAL 32 3HG2 VAL 32 -5.766 9.035 -3.380 251 HG22 VAL 32 1HG2 VAL 32 -6.287 9.246 -5.052 252 HG23 VAL 32 2HG2 VAL 32 -6.982 10.248 -3.777 253 H ARG 33 H ARG 33 -4.279 13.477 -2.628 254 HA ARG 33 HA ARG 33 -2.169 14.381 -4.232 255 HE ARG 33 HE ARG 33 -1.476 19.238 -4.031 256 HB2 ARG 33 1HB ARG 33 -4.117 15.699 -3.161 257 HB3 ARG 33 2HB ARG 33 -3.070 15.831 -1.754 258 HG2 ARG 33 1HG ARG 33 -1.329 16.791 -3.365 259 HG3 ARG 33 2HG ARG 33 -2.671 16.969 -4.499 260 HD2 ARG 33 1HD ARG 33 -3.882 18.282 -2.779 261 HD3 ARG 33 2HD ARG 33 -2.455 18.184 -1.747 262 HH11 ARG 33 1HH1 ARG 33 -4.181 20.091 -1.997 263 HH12 ARG 33 2HH1 ARG 33 -4.094 21.779 -2.375 264 HH21 ARG 33 1HH2 ARG 33 -1.359 21.458 -4.529 265 HH22 ARG 33 2HH2 ARG 33 -2.493 22.555 -3.813 266 H ALA 34 H ALA 34 -2.242 13.437 -0.827 267 HA ALA 34 HA ALA 34 0.361 14.336 -0.178 268 HB1 ALA 34 3HB ALA 34 -1.671 12.615 1.078 269 HB2 ALA 34 1HB ALA 34 -0.722 13.940 1.755 270 HB3 ALA 34 2HB ALA 34 -0.003 12.340 1.581 271 H ILE 35 H ILE 35 -0.854 11.154 -1.179 272 HA ILE 35 HA ILE 35 1.517 9.710 -0.986 273 HB ILE 35 HB ILE 35 0.019 9.048 -3.425 274 HG12 ILE 35 1HG1 ILE 35 -1.844 10.012 -2.147 275 HG13 ILE 35 2HG1 ILE 35 -2.004 8.265 -2.283 276 HG21 ILE 35 1HG2 ILE 35 0.727 7.559 -0.908 277 HG22 ILE 35 2HG2 ILE 35 1.583 7.518 -2.449 278 HG23 ILE 35 3HG2 ILE 35 -0.037 6.833 -2.321 279 HD11 ILE 35 3HD1 ILE 35 -1.535 7.917 -0.050 280 HD12 ILE 35 1HD1 ILE 35 -2.482 9.403 -0.024 281 HD13 ILE 35 2HD1 ILE 35 -0.726 9.475 0.128 282 H ALA 36 H ALA 36 0.225 11.503 -3.831 283 HA ALA 36 HA ALA 36 2.455 11.087 -5.500 284 HB1 ALA 36 3HB ALA 36 0.992 13.624 -5.827 285 HB2 ALA 36 1HB ALA 36 0.011 12.159 -5.871 286 HB3 ALA 36 2HB ALA 36 1.353 12.356 -6.999 287 H ASP 37 H ASP 37 1.829 13.361 -2.917 288 HA ASP 37 HA ASP 37 3.937 15.170 -3.589 289 HB2 ASP 37 1HB ASP 37 1.902 15.516 -1.997 290 HB3 ASP 37 2HB ASP 37 2.944 14.781 -0.782 291 H ALA 38 H ALA 38 3.782 12.131 -1.945 292 HA ALA 38 HA ALA 38 6.458 12.393 -0.843 293 HB1 ALA 38 3HB ALA 38 4.210 11.312 0.190 294 HB2 ALA 38 1HB ALA 38 5.843 10.862 0.690 295 HB3 ALA 38 2HB ALA 38 4.979 9.876 -0.489 296 H LEU 39 H LEU 39 6.665 12.391 -3.528 297 HA LEU 39 HA LEU 39 6.848 9.860 -4.768 298 HG LEU 39 HG LEU 39 6.121 13.061 -5.752 299 HB2 LEU 39 1HB LEU 39 8.345 12.399 -5.461 300 HB3 LEU 39 2HB LEU 39 8.149 11.005 -6.497 301 HD11 LEU 39 1HD1 LEU 39 5.727 12.356 -8.334 302 HD12 LEU 39 2HD1 LEU 39 7.455 12.041 -8.159 303 HD13 LEU 39 3HD1 LEU 39 6.811 13.645 -7.807 304 HD21 LEU 39 3HD2 LEU 39 4.406 11.538 -6.809 305 HD22 LEU 39 1HD2 LEU 39 4.923 11.079 -5.189 306 HD23 LEU 39 2HD2 LEU 39 5.551 10.222 -6.590 307 HA PRO 40 HA PRO 40 11.021 8.047 -4.294 308 HB2 PRO 40 1HB PRO 40 12.461 10.562 -5.066 309 HB3 PRO 40 2HB PRO 40 12.913 8.876 -5.353 310 HG2 PRO 40 1HG PRO 40 11.688 10.389 -7.235 311 HG3 PRO 40 2HG PRO 40 11.465 8.638 -7.112 312 HD2 PRO 40 1HD PRO 40 9.557 10.766 -6.616 313 HD3 PRO 40 2HD PRO 40 9.272 9.023 -6.719 314 H ILE 41 H ILE 41 10.911 7.823 -2.156 315 HA ILE 41 HA ILE 41 12.418 9.687 -0.510 316 HB ILE 41 HB ILE 41 9.509 9.030 -0.024 317 HG12 ILE 41 1HG1 ILE 41 11.099 11.610 -0.040 318 HG13 ILE 41 2HG1 ILE 41 9.946 11.086 -1.259 319 HG21 ILE 41 1HG2 ILE 41 10.663 8.499 2.040 320 HG22 ILE 41 2HG2 ILE 41 9.764 10.001 2.234 321 HG23 ILE 41 3HG2 ILE 41 11.511 10.044 1.998 322 HD11 ILE 41 3HD1 ILE 41 8.696 11.124 1.322 323 HD12 ILE 41 1HD1 ILE 41 8.279 12.016 -0.142 324 HD13 ILE 41 2HD1 ILE 41 9.465 12.676 0.986 325 H LYS 42 H LYS 42 13.253 8.701 1.389 326 HA LYS 42 HA LYS 42 13.473 5.828 1.140 327 HB2 LYS 42 1HB LYS 42 15.014 7.969 2.384 328 HB3 LYS 42 2HB LYS 42 14.913 6.532 3.390 329 HG2 LYS 42 1HG LYS 42 16.311 5.390 2.085 330 HG3 LYS 42 2HG LYS 42 15.509 5.924 0.607 331 HD2 LYS 42 1HD LYS 42 17.472 7.003 0.284 332 HD3 LYS 42 2HD LYS 42 16.715 8.217 1.320 333 HE2 LYS 42 1HE LYS 42 18.395 5.978 2.417 334 HE3 LYS 42 2HE LYS 42 19.091 7.515 1.904 335 HZ1 LYS 42 3HZ LYS 42 18.244 7.048 4.373 336 HZ2 LYS 42 1HZ LYS 42 16.819 7.678 3.712 337 HZ3 LYS 42 2HZ LYS 42 18.243 8.589 3.677 338 H SER 43 H SER 43 12.700 4.314 2.482 339 HA SER 43 HA SER 43 11.465 5.055 5.008 340 HG SER 43 HG SER 43 9.391 3.140 2.196 341 HB2 SER 43 1HB SER 43 9.324 4.366 4.530 342 HB3 SER 43 2HB SER 43 9.781 5.035 2.969 343 H THR 44 H THR 44 11.268 3.308 6.476 344 HA THR 44 HA THR 44 12.935 0.991 5.731 345 HB THR 44 HB THR 44 12.147 1.293 8.557 346 HG1 THR 44 HG1 THR 44 13.755 3.242 7.274 347 HG21 THR 44 3HG2 THR 44 14.923 1.390 8.276 348 HG22 THR 44 1HG2 THR 44 14.357 0.260 7.046 349 HG23 THR 44 2HG2 THR 44 13.935 0.006 8.739 350 H ALA 45 H ALA 45 12.097 -0.968 5.546 351 HA ALA 45 HA ALA 45 9.246 -1.308 5.938 352 HB1 ALA 45 3HB ALA 45 9.466 -2.484 4.071 353 HB2 ALA 45 1HB ALA 45 10.337 -3.709 4.989 354 HB3 ALA 45 2HB ALA 45 11.223 -2.415 4.186 355 H ASN 46 H ASN 46 8.262 -2.520 7.376 356 HA ASN 46 HA ASN 46 9.901 -3.985 9.336 357 HB2 ASN 46 1HB ASN 46 7.243 -2.595 9.517 358 HB3 ASN 46 2HB ASN 46 7.643 -3.878 10.655 359 HD21 ASN 46 1HD2 ASN 46 7.287 -0.884 10.855 360 HD22 ASN 46 2HD2 ASN 46 8.690 -0.351 11.711 361 H ARG 47 H ARG 47 9.829 -6.207 9.182 362 HA ARG 47 HA ARG 47 7.945 -7.388 7.361 363 HE ARG 47 HE ARG 47 7.772 -10.013 7.298 364 HB2 ARG 47 1HB ARG 47 10.445 -8.157 8.642 365 HB3 ARG 47 2HB ARG 47 9.295 -9.482 8.546 366 HG2 ARG 47 1HG ARG 47 9.437 -7.994 6.067 367 HG3 ARG 47 2HG ARG 47 11.006 -8.627 6.545 368 HD2 ARG 47 1HD ARG 47 9.318 -10.044 5.100 369 HD3 ARG 47 2HD ARG 47 10.363 -10.796 6.301 370 HH11 ARG 47 1HH1 ARG 47 9.625 -12.543 5.761 371 HH12 ARG 47 2HH1 ARG 47 8.567 -13.809 6.288 372 HH21 ARG 47 1HH2 ARG 47 6.383 -11.681 7.991 373 HH22 ARG 47 2HH2 ARG 47 6.726 -13.320 7.551 374 H TRP 48 H TRP 48 6.227 -8.643 7.762 375 HA TRP 48 HA TRP 48 5.676 -9.719 10.381 376 HD1 TRP 48 HD1 TRP 48 1.957 -9.755 9.310 377 HE1 TRP 48 HE1 TRP 48 0.406 -10.312 11.287 378 HE3 TRP 48 HE3 TRP 48 4.497 -7.351 13.039 379 HZ2 TRP 48 HZ2 TRP 48 0.276 -9.800 14.060 380 HZ3 TRP 48 HZ3 TRP 48 3.592 -7.432 15.326 381 HH2 TRP 48 HH2 TRP 48 1.524 -8.631 15.823 382 HB2 TRP 48 1HB TRP 48 4.786 -7.447 10.636 383 HB3 TRP 48 2HB TRP 48 3.847 -7.634 9.158 384 H GLY 49 H GLY 49 4.091 -11.370 10.307 385 HA2 GLY 49 1HA GLY 49 3.996 -13.114 8.305 386 HA3 GLY 49 2HA GLY 49 2.591 -12.853 9.322 387 H ASP 50 H ASP 50 4.115 -12.077 6.267 388 HA ASP 50 HA ASP 50 3.210 -11.660 4.217 389 HB2 ASP 50 1HB ASP 50 1.316 -13.134 4.974 390 HB3 ASP 50 2HB ASP 50 0.483 -11.680 5.513 391 H GLU 51 H GLU 51 1.932 -9.808 6.940 392 HA GLU 51 HA GLU 51 1.273 -7.532 5.324 393 HB2 GLU 51 1HB GLU 51 0.504 -8.402 7.803 394 HB3 GLU 51 2HB GLU 51 1.617 -7.104 8.214 395 HG2 GLU 51 1HG GLU 51 -0.230 -6.352 6.106 396 HG3 GLU 51 2HG GLU 51 -1.051 -6.842 7.587 397 H ILE 52 H ILE 52 2.408 -5.691 5.008 398 HA ILE 52 HA ILE 52 4.986 -5.386 6.361 399 HB ILE 52 HB ILE 52 4.774 -6.223 3.702 400 HG12 ILE 52 1HG1 ILE 52 7.306 -5.667 3.750 401 HG13 ILE 52 2HG1 ILE 52 7.003 -5.159 5.406 402 HG21 ILE 52 1HG2 ILE 52 5.614 -3.337 3.796 403 HG22 ILE 52 2HG2 ILE 52 4.262 -4.027 2.897 404 HG23 ILE 52 3HG2 ILE 52 5.918 -4.427 2.444 405 HD11 ILE 52 3HD1 ILE 52 6.132 -7.420 5.895 406 HD12 ILE 52 1HD1 ILE 52 7.820 -7.406 5.394 407 HD13 ILE 52 2HD1 ILE 52 6.572 -7.908 4.257 408 H TYR 53 H TYR 53 4.771 -3.566 7.428 409 HA TYR 53 HA TYR 53 3.491 -1.284 6.066 410 HD1 TYR 53 HD2 TYR 53 4.536 -0.022 9.834 411 HD2 TYR 53 HD1 TYR 53 2.790 -3.886 9.430 412 HE1 TYR 53 HE2 TYR 53 5.495 -0.678 11.998 413 HE2 TYR 53 HE1 TYR 53 3.745 -4.547 11.596 414 HH TYR 53 HH TYR 53 4.516 -3.054 13.801 415 HB2 TYR 53 1HB TYR 53 2.684 -0.470 8.215 416 HB3 TYR 53 2HB TYR 53 2.139 -2.127 7.957 417 H PHE 54 H PHE 54 4.612 0.497 5.804 418 HA PHE 54 HA PHE 54 6.912 1.035 7.538 419 HD1 PHE 54 HD2 PHE 54 6.879 3.450 4.454 420 HD2 PHE 54 HD1 PHE 54 6.924 -0.670 3.397 421 HE1 PHE 54 HE2 PHE 54 6.053 4.020 2.212 422 HE2 PHE 54 HE1 PHE 54 6.094 -0.106 1.154 423 HZ PHE 54 HZ PHE 54 5.658 2.242 0.557 424 HB2 PHE 54 1HB PHE 54 8.331 1.597 5.664 425 HB3 PHE 54 2HB PHE 54 7.744 -0.047 5.457 426 H THR 55 H THR 55 7.344 3.212 7.883 427 HA THR 55 HA THR 55 5.157 5.013 7.122 428 HB THR 55 HB THR 55 7.362 6.014 8.830 429 HG1 THR 55 HG1 THR 55 5.582 4.012 9.758 430 HG21 THR 55 3HG2 THR 55 4.997 6.243 10.206 431 HG22 THR 55 1HG2 THR 55 4.507 6.418 8.520 432 HG23 THR 55 2HG2 THR 55 5.740 7.484 9.195 433 H THR 56 H THR 56 5.498 6.994 6.044 434 HA THR 56 HA THR 56 8.117 7.213 4.708 435 HB THR 56 HB THR 56 6.191 8.500 3.110 436 HG1 THR 56 HG1 THR 56 4.621 7.239 4.214 437 HG21 THR 56 3HG2 THR 56 8.233 6.621 2.790 438 HG22 THR 56 1HG2 THR 56 7.310 7.439 1.529 439 HG23 THR 56 2HG2 THR 56 6.774 5.872 2.137 440 H GLN 57 H GLN 57 6.470 8.609 7.047 441 HA GLN 57 HA GLN 57 6.792 10.617 8.105 442 HB2 GLN 57 1HB GLN 57 8.077 11.773 5.627 443 HB3 GLN 57 2HB GLN 57 8.254 12.299 7.294 444 HG2 GLN 57 1HG GLN 57 9.567 10.368 7.833 445 HG3 GLN 57 2HG GLN 57 9.262 9.660 6.250 446 HE21 GLN 57 1HE2 GLN 57 11.545 9.526 6.004 447 HE22 GLN 57 2HE2 GLN 57 12.456 10.917 5.535 448 H VAL 58 H VAL 58 5.011 10.088 5.322 449 HA VAL 58 HA VAL 58 3.866 12.756 5.217 450 HB VAL 58 HB VAL 58 4.121 11.510 3.114 451 HG11 VAL 58 1HG1 VAL 58 2.023 9.622 4.169 452 HG12 VAL 58 2HG1 VAL 58 3.742 9.246 4.050 453 HG13 VAL 58 3HG1 VAL 58 2.804 9.570 2.588 454 HG21 VAL 58 3HG2 VAL 58 1.315 12.153 3.982 455 HG22 VAL 58 1HG2 VAL 58 1.738 11.754 2.318 456 HG23 VAL 58 2HG2 VAL 58 2.442 13.174 3.091 457 H ALA 59 H ALA 59 2.392 13.365 6.643 458 HA ALA 59 HA ALA 59 0.736 11.294 7.919 459 HB1 ALA 59 3HB ALA 59 0.512 12.672 9.806 460 HB2 ALA 59 1HB ALA 59 1.068 14.102 8.937 461 HB3 ALA 59 2HB ALA 59 2.204 12.810 9.332 462 H VAL 60 H VAL 60 -0.942 11.067 6.525 463 HA VAL 60 HA VAL 60 -2.702 13.418 6.222 464 HB VAL 60 HB VAL 60 -1.814 12.958 4.039 465 HG11 VAL 60 1HG1 VAL 60 -2.014 10.180 4.893 466 HG12 VAL 60 2HG1 VAL 60 -0.971 10.923 3.685 467 HG13 VAL 60 3HG1 VAL 60 -2.610 10.441 3.254 468 HG21 VAL 60 3HG2 VAL 60 -4.142 13.522 3.999 469 HG22 VAL 60 1HG2 VAL 60 -4.605 11.853 4.336 470 HG23 VAL 60 2HG2 VAL 60 -3.860 12.268 2.793 471 H GLU 61 H GLU 61 -4.311 13.052 7.677 472 HA GLU 61 HA GLU 61 -5.565 10.384 7.628 473 HB2 GLU 61 1HB GLU 61 -4.306 11.686 9.813 474 HB3 GLU 61 2HB GLU 61 -6.033 11.658 10.144 475 HG2 GLU 61 1HG GLU 61 -5.823 9.151 9.435 476 HG3 GLU 61 2HG GLU 61 -4.124 9.397 9.834 477 H LYS 62 H LYS 62 -7.733 10.279 7.534 478 HA LYS 62 HA LYS 62 -9.375 12.607 8.043 479 HB2 LYS 62 1HB LYS 62 -8.717 12.997 5.728 480 HB3 LYS 62 2HB LYS 62 -9.203 11.367 5.286 481 HG2 LYS 62 1HG LYS 62 -11.513 11.886 5.700 482 HG3 LYS 62 2HG LYS 62 -11.082 13.481 6.318 483 HD2 LYS 62 1HD LYS 62 -9.998 13.838 4.004 484 HD3 LYS 62 2HD LYS 62 -10.973 12.454 3.503 485 HE2 LYS 62 1HE LYS 62 -12.999 13.596 4.157 486 HE3 LYS 62 2HE LYS 62 -12.067 14.947 4.799 487 HZ1 LYS 62 3HZ LYS 62 -12.493 15.803 2.778 488 HZ2 LYS 62 1HZ LYS 62 -12.733 14.296 2.049 489 HZ3 LYS 62 2HZ LYS 62 -11.164 14.873 2.302 490 H GLU 63 H GLU 63 -11.750 12.040 7.799 491 HA GLU 63 HA GLU 63 -12.134 9.245 8.608 492 HB2 GLU 63 1HB GLU 63 -14.254 11.336 8.878 493 HB3 GLU 63 2HB GLU 63 -13.969 9.911 9.864 494 HG2 GLU 63 1HG GLU 63 -13.258 11.502 11.311 495 HG3 GLU 63 2HG GLU 63 -11.744 11.205 10.460 496 H GLU 64 H GLU 64 -12.179 8.347 6.526 497 HA GLU 64 HA GLU 64 -14.744 8.259 5.326 498 HB2 GLU 64 1HB GLU 64 -14.359 10.254 4.207 499 HB3 GLU 64 2HB GLU 64 -12.633 9.963 4.063 500 HG2 GLU 64 1HG GLU 64 -12.851 8.765 2.148 501 HG3 GLU 64 2HG GLU 64 -14.442 8.148 2.581 502 H ASN 65 H ASN 65 -14.892 6.626 3.659 503 HA ASN 65 HA ASN 65 -14.341 4.703 2.585 504 HB2 ASN 65 1HB ASN 65 -12.412 6.090 1.733 505 HB3 ASN 65 2HB ASN 65 -11.440 5.430 3.045 506 HD21 ASN 65 1HD2 ASN 65 -10.353 4.933 0.804 507 HD22 ASN 65 2HD2 ASN 65 -10.653 3.339 0.212 508 H SER 66 H SER 66 -11.511 4.791 4.689 509 HA SER 66 HA SER 66 -10.672 2.993 5.931 510 HG SER 66 HG SER 66 -10.799 4.573 8.674 511 HB2 SER 66 1HB SER 66 -12.974 4.303 7.333 512 HB3 SER 66 2HB SER 66 -12.089 2.998 8.122 513 H LYS 67 H LYS 67 -11.132 1.115 4.555 514 HA LYS 67 HA LYS 67 -13.544 -0.374 5.362 515 HB2 LYS 67 1HB LYS 67 -13.036 -1.887 3.427 516 HB3 LYS 67 2HB LYS 67 -13.442 -0.244 2.973 517 HG2 LYS 67 1HG LYS 67 -11.681 -0.757 1.585 518 HG3 LYS 67 2HG LYS 67 -10.881 0.116 2.887 519 HD2 LYS 67 1HD LYS 67 -10.353 -2.100 3.929 520 HD3 LYS 67 2HD LYS 67 -11.016 -2.872 2.491 521 HE2 LYS 67 1HE LYS 67 -9.323 -1.974 1.116 522 HE3 LYS 67 2HE LYS 67 -8.804 -0.845 2.366 523 HZ1 LYS 67 3HZ LYS 67 -7.693 -3.273 1.859 524 HZ2 LYS 67 1HZ LYS 67 -8.661 -3.581 3.210 525 HZ3 LYS 67 2HZ LYS 67 -7.484 -2.373 3.271 526 H ASP 68 H ASP 68 -13.363 -2.680 5.821 527 HA ASP 68 HA ASP 68 -10.736 -3.334 7.013 528 HB2 ASP 68 1HB ASP 68 -12.099 -4.734 8.641 529 HB3 ASP 68 2HB ASP 68 -12.228 -2.985 8.813 530 H VAL 69 H VAL 69 -12.927 -4.278 4.628 531 HA VAL 69 HA VAL 69 -11.758 -6.987 4.632 532 HB VAL 69 HB VAL 69 -14.245 -6.885 5.191 533 HG11 VAL 69 1HG1 VAL 69 -14.380 -5.292 2.937 534 HG12 VAL 69 2HG1 VAL 69 -15.744 -6.030 3.776 535 HG13 VAL 69 3HG1 VAL 69 -15.018 -6.842 2.390 536 HG21 VAL 69 3HG2 VAL 69 -13.239 -8.524 2.873 537 HG22 VAL 69 1HG2 VAL 69 -14.747 -8.842 3.729 538 HG23 VAL 69 2HG2 VAL 69 -13.208 -8.954 4.583 539 H VAL 70 H VAL 70 -11.078 -7.828 2.690 540 HA VAL 70 HA VAL 70 -11.601 -6.472 0.197 541 HB VAL 70 HB VAL 70 -9.253 -5.981 -0.340 542 HG11 VAL 70 1HG1 VAL 70 -9.995 -4.530 2.174 543 HG12 VAL 70 2HG1 VAL 70 -10.849 -4.295 0.650 544 HG13 VAL 70 3HG1 VAL 70 -9.132 -3.913 0.766 545 HG21 VAL 70 3HG2 VAL 70 -8.629 -6.422 2.577 546 HG22 VAL 70 1HG2 VAL 70 -7.512 -5.976 1.295 547 HG23 VAL 70 2HG2 VAL 70 -8.237 -7.584 1.308 548 H GLU 71 H GLU 71 -10.678 -7.571 -1.665 549 HA GLU 71 HA GLU 71 -10.444 -10.435 -1.163 550 HB2 GLU 71 1HB GLU 71 -10.435 -9.238 -3.921 551 HB3 GLU 71 2HB GLU 71 -11.028 -10.803 -3.391 552 HG2 GLU 71 1HG GLU 71 -12.977 -9.928 -2.519 553 HG3 GLU 71 2HG GLU 71 -12.337 -8.288 -2.469 554 H LEU 72 H LEU 72 -8.828 -11.733 -2.024 555 HA LEU 72 HA LEU 72 -6.226 -10.990 -1.568 556 HG LEU 72 HG LEU 72 -4.610 -12.436 -3.380 557 HB2 LEU 72 1HB LEU 72 -6.944 -13.315 -1.780 558 HB3 LEU 72 2HB LEU 72 -7.246 -13.092 -3.491 559 HD11 LEU 72 1HD1 LEU 72 -4.647 -14.830 -1.631 560 HD12 LEU 72 2HD1 LEU 72 -4.905 -13.262 -0.865 561 HD13 LEU 72 3HD1 LEU 72 -3.434 -13.559 -1.791 562 HD21 LEU 72 3HD2 LEU 72 -5.698 -13.991 -4.932 563 HD22 LEU 72 1HD2 LEU 72 -5.752 -15.213 -3.663 564 HD23 LEU 72 2HD2 LEU 72 -4.199 -14.653 -4.282 565 H GLY 73 H GLY 73 -4.764 -9.737 -2.588 566 HA2 GLY 73 1HA GLY 73 -3.553 -9.321 -4.687 567 HA3 GLY 73 2HA GLY 73 -5.109 -9.315 -5.495 568 H ASP 74 H ASP 74 -6.387 -7.618 -3.440 569 HA ASP 74 HA ASP 74 -5.626 -5.118 -4.582 570 HB2 ASP 74 1HB ASP 74 -7.303 -4.206 -2.834 571 HB3 ASP 74 2HB ASP 74 -7.903 -5.223 -4.138 572 H VAL 75 H VAL 75 -5.008 -3.202 -3.444 573 HA VAL 75 HA VAL 75 -3.217 -3.770 -1.155 574 HB VAL 75 HB VAL 75 -2.963 -1.451 -3.103 575 HG11 VAL 75 1HG1 VAL 75 -1.907 -1.283 -0.802 576 HG12 VAL 75 2HG1 VAL 75 -0.835 -1.061 -2.183 577 HG13 VAL 75 3HG1 VAL 75 -0.831 -2.590 -1.305 578 HG21 VAL 75 3HG2 VAL 75 -2.018 -2.780 -4.604 579 HG22 VAL 75 1HG2 VAL 75 -2.450 -4.174 -3.615 580 HG23 VAL 75 2HG2 VAL 75 -0.884 -3.392 -3.403 581 H ALA 76 H ALA 76 -3.111 -2.114 0.587 582 HA ALA 76 HA ALA 76 -5.150 -0.037 0.475 583 HB1 ALA 76 3HB ALA 76 -6.422 -1.842 1.373 584 HB2 ALA 76 1HB ALA 76 -6.063 -0.736 2.697 585 HB3 ALA 76 2HB ALA 76 -5.152 -2.232 2.532 586 H TYR 77 H TYR 77 -4.873 1.660 1.945 587 HA TYR 77 HA TYR 77 -2.214 1.747 3.191 588 HD1 TYR 77 HD1 TYR 77 -5.427 4.688 3.293 589 HD2 TYR 77 HD2 TYR 77 -1.220 5.071 3.786 590 HE1 TYR 77 HE1 TYR 77 -5.780 6.569 4.836 591 HE2 TYR 77 HE2 TYR 77 -1.564 6.950 5.324 592 HH TYR 77 HH TYR 77 -3.257 8.615 5.851 593 HB2 TYR 77 1HB TYR 77 -2.092 3.690 2.058 594 HB3 TYR 77 2HB TYR 77 -3.810 3.663 1.685 595 H TRP 78 H TRP 78 -2.093 1.628 5.345 596 HA TRP 78 HA TRP 78 -4.396 1.378 6.958 597 HD1 TRP 78 HD1 TRP 78 -5.100 1.507 8.998 598 HE1 TRP 78 HE1 TRP 78 -5.359 0.314 11.261 599 HE3 TRP 78 HE3 TRP 78 -0.330 -0.246 9.534 600 HZ2 TRP 78 HZ2 TRP 78 -3.751 -1.183 13.039 601 HZ3 TRP 78 HZ3 TRP 78 0.229 -1.550 11.545 602 HH2 TRP 78 HH2 TRP 78 -1.449 -2.008 13.260 603 HB2 TRP 78 1HB TRP 78 -1.952 0.542 7.357 604 HB3 TRP 78 2HB TRP 78 -1.733 2.109 8.125 605 H ILE 79 H ILE 79 -5.723 2.930 7.692 606 HA ILE 79 HA ILE 79 -5.076 5.683 7.397 607 HB ILE 79 HB ILE 79 -7.434 4.201 8.484 608 HG12 ILE 79 1HG1 ILE 79 -6.685 5.449 6.038 609 HG13 ILE 79 2HG1 ILE 79 -8.153 4.558 6.410 610 HG21 ILE 79 1HG2 ILE 79 -7.219 5.964 10.099 611 HG22 ILE 79 2HG2 ILE 79 -8.540 6.362 8.998 612 HG23 ILE 79 3HG2 ILE 79 -6.975 7.158 8.822 613 HD11 ILE 79 3HD1 ILE 79 -9.201 6.624 7.197 614 HD12 ILE 79 1HD1 ILE 79 -8.662 6.759 5.523 615 HD13 ILE 79 2HD1 ILE 79 -7.727 7.513 6.814 616 HA PRO 80 HA PRO 80 -4.914 5.956 12.222 617 HB2 PRO 80 1HB PRO 80 -4.879 3.134 13.092 618 HB3 PRO 80 2HB PRO 80 -5.783 4.501 13.749 619 HG2 PRO 80 1HG PRO 80 -6.991 2.558 12.354 620 HG3 PRO 80 2HG PRO 80 -7.516 4.249 12.251 621 HD2 PRO 80 1HD PRO 80 -5.883 2.649 10.326 622 HD3 PRO 80 2HD PRO 80 -7.151 3.846 10.015 623 H GLY 81 H GLY 81 -2.828 6.370 11.068 624 HA2 GLY 81 1HA GLY 81 -0.580 5.938 12.291 625 HA3 GLY 81 2HA GLY 81 -0.767 4.333 11.593 626 H LYS 82 H LYS 82 -2.135 6.126 9.292 627 HA LYS 82 HA LYS 82 -1.454 6.739 7.180 628 HB2 LYS 82 1HB LYS 82 1.006 8.035 8.227 629 HB3 LYS 82 2HB LYS 82 -0.201 8.653 7.113 630 HG2 LYS 82 1HG LYS 82 -0.860 9.943 8.801 631 HG3 LYS 82 2HG LYS 82 -1.595 8.491 9.478 632 HD2 LYS 82 1HD LYS 82 0.741 8.075 10.505 633 HD3 LYS 82 2HD LYS 82 1.015 9.783 10.168 634 HE2 LYS 82 1HE LYS 82 -1.449 8.904 11.621 635 HE3 LYS 82 2HE LYS 82 0.082 9.066 12.484 636 HZ1 LYS 82 3HZ LYS 82 0.128 11.383 11.390 637 HZ2 LYS 82 1HZ LYS 82 -0.873 11.134 12.731 638 HZ3 LYS 82 2HZ LYS 82 -1.533 11.152 11.174 639 H ALA 83 H ALA 83 -0.544 4.181 8.040 640 HA ALA 83 HA ALA 83 2.056 3.995 6.662 641 HB1 ALA 83 3HB ALA 83 1.156 2.925 9.155 642 HB2 ALA 83 1HB ALA 83 2.760 2.849 8.427 643 HB3 ALA 83 2HB ALA 83 1.565 1.600 8.068 644 H ILE 84 H ILE 84 2.248 2.727 4.885 645 HA ILE 84 HA ILE 84 -0.171 1.589 3.746 646 HB ILE 84 HB ILE 84 2.611 1.486 2.592 647 HG12 ILE 84 1HG1 ILE 84 0.495 3.600 2.157 648 HG13 ILE 84 2HG1 ILE 84 1.988 3.825 3.065 649 HG21 ILE 84 1HG2 ILE 84 1.515 1.150 0.483 650 HG22 ILE 84 2HG2 ILE 84 -0.068 1.377 1.225 651 HG23 ILE 84 3HG2 ILE 84 0.904 -0.035 1.638 652 HD11 ILE 84 3HD1 ILE 84 1.552 4.245 0.332 653 HD12 ILE 84 1HD1 ILE 84 2.581 2.818 0.448 654 HD13 ILE 84 2HD1 ILE 84 3.082 4.330 1.206 655 H CYS 85 H CYS 85 -0.565 -0.605 3.402 656 HA CYS 85 HA CYS 85 1.497 -2.477 4.349 657 HG CYS 85 HG CYS 85 0.150 -1.798 7.405 658 HB2 CYS 85 1HB CYS 85 -1.382 -2.922 5.077 659 HB3 CYS 85 2HB CYS 85 0.062 -3.633 5.794 660 H LEU 86 H LEU 86 1.821 -4.215 3.089 661 HA LEU 86 HA LEU 86 0.120 -4.576 0.750 662 HG LEU 86 HG LEU 86 1.566 -4.254 -0.836 663 HB2 LEU 86 1HB LEU 86 2.865 -5.093 1.434 664 HB3 LEU 86 2HB LEU 86 2.129 -6.578 0.865 665 HD11 LEU 86 1HD1 LEU 86 3.670 -3.782 -1.607 666 HD12 LEU 86 2HD1 LEU 86 4.331 -5.327 -1.067 667 HD13 LEU 86 3HD1 LEU 86 4.013 -4.044 0.104 668 HD21 LEU 86 3HD2 LEU 86 2.563 -7.067 -1.252 669 HD22 LEU 86 1HD2 LEU 86 2.315 -5.913 -2.564 670 HD23 LEU 86 2HD2 LEU 86 0.949 -6.431 -1.575 671 H PHE 87 H PHE 87 -0.733 -6.701 0.161 672 HA PHE 87 HA PHE 87 -1.046 -8.568 2.403 673 HD1 PHE 87 HD2 PHE 87 -2.653 -7.183 4.217 674 HD2 PHE 87 HD1 PHE 87 -3.813 -5.673 0.420 675 HE1 PHE 87 HE2 PHE 87 -3.107 -4.991 5.236 676 HE2 PHE 87 HE1 PHE 87 -4.275 -3.487 1.427 677 HZ PHE 87 HZ PHE 87 -3.921 -3.135 3.837 678 HB2 PHE 87 1HB PHE 87 -3.408 -7.935 0.664 679 HB3 PHE 87 2HB PHE 87 -3.374 -8.670 2.262 680 H PHE 88 H PHE 88 -0.761 -10.636 1.826 681 HA PHE 88 HA PHE 88 -1.539 -11.661 -0.713 682 HD1 PHE 88 HD2 PHE 88 -0.340 -9.579 -2.588 683 HD2 PHE 88 HD1 PHE 88 1.039 -13.597 -2.400 684 HE1 PHE 88 HE2 PHE 88 -0.687 -9.806 -5.015 685 HE2 PHE 88 HE1 PHE 88 0.695 -13.835 -4.824 686 HZ PHE 88 HZ PHE 88 -0.170 -11.937 -6.135 687 HB2 PHE 88 1HB PHE 88 0.967 -10.435 -0.668 688 HB3 PHE 88 2HB PHE 88 1.318 -12.155 -0.548 689 H GLY 89 H GLY 89 -2.160 -12.402 1.904 690 HA2 GLY 89 1HA GLY 89 -1.951 -15.131 1.872 691 HA3 GLY 89 2HA GLY 89 -0.514 -14.611 2.734 692 H LYS 90 H LYS 90 -0.783 -13.448 4.723 693 HA LYS 90 HA LYS 90 -3.425 -13.765 5.962 694 HB2 LYS 90 1HB LYS 90 -2.548 -14.740 7.899 695 HB3 LYS 90 2HB LYS 90 -1.730 -15.571 6.593 696 HG2 LYS 90 1HG LYS 90 0.193 -15.091 7.598 697 HG3 LYS 90 2HG LYS 90 -0.091 -13.395 7.205 698 HD2 LYS 90 1HD LYS 90 -0.262 -12.937 9.369 699 HD3 LYS 90 2HD LYS 90 -1.667 -14.000 9.470 700 HE2 LYS 90 1HE LYS 90 -0.455 -15.752 10.296 701 HE3 LYS 90 2HE LYS 90 1.029 -15.248 9.489 702 HZ1 LYS 90 3HZ LYS 90 0.813 -13.260 11.165 703 HZ2 LYS 90 1HZ LYS 90 1.526 -14.723 11.633 704 HZ3 LYS 90 2HZ LYS 90 -0.076 -14.388 12.061 705 H THR 91 H THR 91 -2.859 -12.843 8.447 706 HA THR 91 HA THR 91 -1.500 -10.313 8.385 707 HB THR 91 HB THR 91 -4.176 -9.700 9.239 708 HG1 THR 91 HG1 THR 91 -5.359 -10.198 7.522 709 HG21 THR 91 3HG2 THR 91 -2.119 -8.526 7.656 710 HG22 THR 91 1HG2 THR 91 -3.512 -7.762 8.422 711 HG23 THR 91 2HG2 THR 91 -3.655 -8.425 6.797 712 HA PRO 92 HA PRO 92 -1.342 -10.527 12.822 713 HB2 PRO 92 1HB PRO 92 -3.697 -8.713 13.159 714 HB3 PRO 92 2HB PRO 92 -2.120 -8.666 13.958 715 HG2 PRO 92 1HG PRO 92 -2.674 -6.968 11.993 716 HG3 PRO 92 2HG PRO 92 -1.069 -7.714 12.117 717 HD2 PRO 92 1HD PRO 92 -3.299 -8.314 10.236 718 HD3 PRO 92 2HD PRO 92 -1.546 -8.383 9.966 719 H ILE 93 H ILE 93 -4.480 -10.864 11.319 720 HA ILE 93 HA ILE 93 -5.086 -13.080 13.128 721 HB ILE 93 HB ILE 93 -7.267 -11.135 12.425 722 HG12 ILE 93 1HG1 ILE 93 -6.844 -10.568 15.025 723 HG13 ILE 93 2HG1 ILE 93 -5.186 -10.882 14.528 724 HG21 ILE 93 1HG2 ILE 93 -7.568 -13.573 13.280 725 HG22 ILE 93 2HG2 ILE 93 -8.554 -12.276 13.958 726 HG23 ILE 93 3HG2 ILE 93 -7.154 -12.877 14.847 727 HD11 ILE 93 3HD1 ILE 93 -5.700 -9.241 12.604 728 HD12 ILE 93 1HD1 ILE 93 -5.407 -8.605 14.222 729 HD13 ILE 93 2HD1 ILE 93 -7.056 -8.743 13.615 730 H SER 94 H SER 94 -4.263 -13.960 10.918 731 HA SER 94 HA SER 94 -5.569 -13.842 8.532 732 HG SER 94 HG SER 94 -3.395 -16.078 10.564 733 HB2 SER 94 1HB SER 94 -4.973 -16.614 9.254 734 HB3 SER 94 2HB SER 94 -4.282 -15.604 7.986 735 H ASP 95 H ASP 95 -6.651 -15.483 11.439 736 HA ASP 95 HA ASP 95 -8.630 -17.133 10.450 737 HB2 ASP 95 1HB ASP 95 -7.810 -16.313 12.960 738 HB3 ASP 95 2HB ASP 95 -9.465 -15.716 12.870 739 H ASP 96 H ASP 96 -10.832 -16.899 10.007 740 HA ASP 96 HA ASP 96 -12.690 -15.888 9.158 741 HB2 ASP 96 1HB ASP 96 -11.727 -13.883 11.166 742 HB3 ASP 96 2HB ASP 96 -13.053 -13.453 10.089 743 H LYS 97 H LYS 97 -10.704 -15.943 7.387 744 HA LYS 97 HA LYS 97 -9.999 -15.045 5.425 745 HB2 LYS 97 1HB LYS 97 -12.100 -12.987 6.107 746 HB3 LYS 97 2HB LYS 97 -11.167 -12.944 4.618 747 HG2 LYS 97 1HG LYS 97 -12.490 -15.503 5.223 748 HG3 LYS 97 2HG LYS 97 -13.558 -14.145 4.861 749 HD2 LYS 97 1HD LYS 97 -13.089 -15.268 2.806 750 HD3 LYS 97 2HD LYS 97 -12.206 -13.739 2.795 751 HE2 LYS 97 1HE LYS 97 -10.831 -15.585 1.956 752 HE3 LYS 97 2HE LYS 97 -10.164 -14.896 3.437 753 HZ1 LYS 97 3HZ LYS 97 -11.979 -17.141 3.776 754 HZ2 LYS 97 1HZ LYS 97 -10.536 -16.780 4.585 755 HZ3 LYS 97 2HZ LYS 97 -10.491 -17.500 3.056 756 H ILE 98 H ILE 98 -8.757 -13.200 4.513 757 HA ILE 98 HA ILE 98 -6.776 -12.337 6.327 758 HB ILE 98 HB ILE 98 -7.462 -11.319 3.564 759 HG12 ILE 98 1HG1 ILE 98 -5.100 -12.971 4.480 760 HG13 ILE 98 2HG1 ILE 98 -6.588 -13.679 3.853 761 HG21 ILE 98 1HG2 ILE 98 -5.649 -10.214 5.547 762 HG22 ILE 98 2HG2 ILE 98 -6.220 -9.528 4.027 763 HG23 ILE 98 3HG2 ILE 98 -4.837 -10.623 4.038 764 HD11 ILE 98 3HD1 ILE 98 -4.347 -12.742 2.420 765 HD12 ILE 98 1HD1 ILE 98 -5.706 -11.687 2.028 766 HD13 ILE 98 2HD1 ILE 98 -5.843 -13.431 1.790 767 H ARG 99 H ARG 99 -7.155 -11.013 7.972 768 HA ARG 99 HA ARG 99 -8.894 -8.682 7.549 769 HE ARG 99 HE ARG 99 -11.155 -9.844 11.262 770 HB2 ARG 99 1HB ARG 99 -9.313 -10.313 9.474 771 HB3 ARG 99 2HB ARG 99 -7.842 -9.676 10.197 772 HG2 ARG 99 1HG ARG 99 -9.375 -8.353 11.223 773 HG3 ARG 99 2HG ARG 99 -9.055 -7.370 9.793 774 HD2 ARG 99 1HD ARG 99 -11.365 -7.398 9.857 775 HD3 ARG 99 2HD ARG 99 -11.008 -8.718 8.743 776 HH11 ARG 99 1HH1 ARG 99 -13.283 -8.093 9.120 777 HH12 ARG 99 2HH1 ARG 99 -14.717 -8.862 9.713 778 HH21 ARG 99 1HH2 ARG 99 -13.040 -10.855 12.044 779 HH22 ARG 99 2HH2 ARG 99 -14.579 -10.430 11.374 780 HA PRO 100 HA PRO 100 -4.790 -6.721 7.298 781 HB2 PRO 100 1HB PRO 100 -5.683 -4.421 6.152 782 HB3 PRO 100 2HB PRO 100 -5.376 -5.901 5.237 783 HG2 PRO 100 1HG PRO 100 -7.975 -4.837 6.281 784 HG3 PRO 100 2HG PRO 100 -7.607 -5.520 4.682 785 HD2 PRO 100 1HD PRO 100 -8.821 -6.958 6.606 786 HD3 PRO 100 2HD PRO 100 -7.683 -7.695 5.459 787 H ALA 101 H ALA 101 -7.794 -5.386 8.582 788 HA ALA 101 HA ALA 101 -6.720 -4.573 11.029 789 HB1 ALA 101 3HB ALA 101 -7.147 -1.991 9.774 790 HB2 ALA 101 1HB ALA 101 -5.812 -2.873 9.034 791 HB3 ALA 101 2HB ALA 101 -5.806 -2.559 10.769 792 H SER 102 H SER 102 -8.210 -2.167 11.436 793 HA SER 102 HA SER 102 -10.938 -3.233 11.169 794 HG SER 102 HG SER 102 -8.855 -1.806 14.033 795 HB2 SER 102 1HB SER 102 -10.638 -1.137 13.166 796 HB3 SER 102 2HB SER 102 -11.291 -2.766 13.336 797 H ALA 103 H ALA 103 -8.935 -0.812 9.975 798 HA ALA 103 HA ALA 103 -11.111 0.495 8.685 799 HB1 ALA 103 3HB ALA 103 -10.821 2.722 9.683 800 HB2 ALA 103 1HB ALA 103 -9.702 2.031 10.859 801 HB3 ALA 103 2HB ALA 103 -11.393 1.530 10.851 802 H VAL 104 H VAL 104 -9.505 -0.344 7.045 803 HA VAL 104 HA VAL 104 -7.500 1.760 6.531 804 HB VAL 104 HB VAL 104 -5.998 0.173 5.495 805 HG11 VAL 104 1HG1 VAL 104 -6.481 0.365 8.178 806 HG12 VAL 104 2HG1 VAL 104 -5.095 -0.442 7.445 807 HG13 VAL 104 3HG1 VAL 104 -6.513 -1.377 7.917 808 HG21 VAL 104 3HG2 VAL 104 -8.040 -1.356 4.841 809 HG22 VAL 104 1HG2 VAL 104 -7.633 -2.165 6.353 810 HG23 VAL 104 2HG2 VAL 104 -6.430 -2.037 5.072 811 H ASN 105 H ASN 105 -7.266 2.556 4.506 812 HA ASN 105 HA ASN 105 -9.545 2.271 2.762 813 HB2 ASN 105 1HB ASN 105 -7.093 3.931 2.202 814 HB3 ASN 105 2HB ASN 105 -8.746 4.209 1.667 815 HD21 ASN 105 1HD2 ASN 105 -9.951 3.686 4.209 816 HD22 ASN 105 2HD2 ASN 105 -9.585 5.032 5.224 817 H VAL 106 H VAL 106 -9.482 1.797 0.534 818 HA VAL 106 HA VAL 106 -7.443 -0.145 -0.223 819 HB VAL 106 HB VAL 106 -9.193 0.243 -2.400 820 HG11 VAL 106 1HG1 VAL 106 -9.161 -1.972 -2.348 821 HG12 VAL 106 2HG1 VAL 106 -9.894 -2.022 -0.746 822 HG13 VAL 106 3HG1 VAL 106 -8.148 -1.837 -0.913 823 HG21 VAL 106 3HG2 VAL 106 -10.664 0.279 0.218 824 HG22 VAL 106 1HG2 VAL 106 -11.395 -0.324 -1.270 825 HG23 VAL 106 2HG2 VAL 106 -10.857 1.353 -1.169 826 H ILE 107 H ILE 107 -5.639 0.942 -0.789 827 HA ILE 107 HA ILE 107 -5.762 3.376 -2.315 828 HB ILE 107 HB ILE 107 -4.131 2.876 -0.445 829 HG12 ILE 107 1HG1 ILE 107 -3.554 4.107 -3.083 830 HG13 ILE 107 2HG1 ILE 107 -3.575 4.836 -1.483 831 HG21 ILE 107 1HG2 ILE 107 -3.469 0.640 -1.201 832 HG22 ILE 107 2HG2 ILE 107 -2.077 1.707 -1.027 833 HG23 ILE 107 3HG2 ILE 107 -2.717 1.352 -2.630 834 HD11 ILE 107 3HD1 ILE 107 -1.354 4.864 -2.448 835 HD12 ILE 107 1HD1 ILE 107 -1.394 3.108 -2.612 836 HD13 ILE 107 2HD1 ILE 107 -1.404 3.844 -1.008 837 H GLY 108 H GLY 108 -6.554 0.687 -3.527 838 HA2 GLY 108 1HA GLY 108 -6.516 0.592 -5.988 839 HA3 GLY 108 2HA GLY 108 -4.796 0.918 -5.893 840 H ARG 109 H ARG 109 -3.816 -0.841 -6.684 841 HA ARG 109 HA ARG 109 -3.836 -3.252 -5.221 842 HE ARG 109 HE ARG 109 -8.626 -2.882 -9.373 843 HB2 ARG 109 1HB ARG 109 -4.613 -4.552 -7.426 844 HB3 ARG 109 2HB ARG 109 -5.717 -4.132 -6.132 845 HG2 ARG 109 1HG ARG 109 -6.454 -2.173 -7.386 846 HG3 ARG 109 2HG ARG 109 -5.320 -2.573 -8.681 847 HD2 ARG 109 1HD ARG 109 -6.487 -4.754 -8.935 848 HD3 ARG 109 2HD ARG 109 -7.678 -4.204 -7.757 849 HH11 ARG 109 1HH1 ARG 109 -5.494 -3.960 -10.474 850 HH12 ARG 109 2HH1 ARG 109 -5.716 -3.364 -12.084 851 HH21 ARG 109 1HH2 ARG 109 -8.919 -2.095 -11.490 852 HH22 ARG 109 2HH2 ARG 109 -7.659 -2.303 -12.660 853 H ILE 110 H ILE 110 -2.572 -5.002 -6.355 854 HA ILE 110 HA ILE 110 -0.315 -3.753 -7.746 855 HB ILE 110 HB ILE 110 -0.525 -6.476 -6.452 856 HG12 ILE 110 1HG1 ILE 110 1.382 -4.709 -5.224 857 HG13 ILE 110 2HG1 ILE 110 -0.177 -3.898 -5.306 858 HG21 ILE 110 1HG2 ILE 110 1.866 -5.036 -7.594 859 HG22 ILE 110 2HG2 ILE 110 1.094 -6.475 -8.259 860 HG23 ILE 110 3HG2 ILE 110 1.917 -6.555 -6.702 861 HD11 ILE 110 3HD1 ILE 110 -1.217 -5.738 -4.117 862 HD12 ILE 110 1HD1 ILE 110 0.140 -5.083 -3.201 863 HD13 ILE 110 2HD1 ILE 110 0.322 -6.601 -4.080 864 H VAL 111 H VAL 111 -0.315 -3.891 -9.905 865 HA VAL 111 HA VAL 111 -1.712 -6.132 -11.178 866 HB VAL 111 HB VAL 111 -1.066 -4.611 -13.297 867 HG11 VAL 111 1HG1 VAL 111 -3.274 -5.035 -13.251 868 HG12 VAL 111 2HG1 VAL 111 -3.375 -3.401 -12.593 869 HG13 VAL 111 3HG1 VAL 111 -3.394 -4.792 -11.508 870 HG21 VAL 111 3HG2 VAL 111 -1.683 -2.486 -11.286 871 HG22 VAL 111 1HG2 VAL 111 -0.992 -2.335 -12.900 872 HG23 VAL 111 2HG2 VAL 111 -0.012 -2.965 -11.578 873 H ASN 112 H ASN 112 0.973 -4.293 -12.575 874 HA ASN 112 HA ASN 112 2.207 -6.717 -13.491 875 HB2 ASN 112 1HB ASN 112 3.930 -5.202 -14.429 876 HB3 ASN 112 2HB ASN 112 2.295 -4.717 -14.870 877 HD21 ASN 112 1HD2 ASN 112 3.486 -2.689 -15.316 878 HD22 ASN 112 2HD2 ASN 112 3.659 -1.556 -14.024 879 H SER 113 H SER 113 4.822 -6.549 -13.266 880 HA SER 113 HA SER 113 6.600 -6.992 -11.921 881 HG SER 113 HG SER 113 7.388 -4.845 -11.881 882 HB2 SER 113 1HB SER 113 5.157 -5.020 -10.141 883 HB3 SER 113 2HB SER 113 6.748 -5.682 -9.763 884 H MET 114 H MET 114 7.262 -8.086 -9.905 885 HA MET 114 HA MET 114 5.675 -10.314 -9.367 886 HB2 MET 114 1HB MET 114 8.245 -9.705 -8.889 887 HB3 MET 114 2HB MET 114 7.597 -9.453 -7.275 888 HG2 MET 114 1HG MET 114 7.862 -11.626 -6.952 889 HG3 MET 114 2HG MET 114 6.502 -11.867 -8.048 890 HE1 MET 114 3HE MET 114 10.691 -12.198 -8.007 891 HE2 MET 114 1HE MET 114 9.999 -10.599 -8.284 892 HE3 MET 114 2HE MET 114 10.750 -11.479 -9.616 893 H GLU 115 H GLU 115 4.038 -10.701 -8.016 894 HA GLU 115 HA GLU 115 3.274 -8.568 -6.145 895 HB2 GLU 115 1HB GLU 115 1.546 -10.845 -7.113 896 HB3 GLU 115 2HB GLU 115 1.027 -9.388 -6.278 897 HG2 GLU 115 1HG GLU 115 0.544 -8.606 -8.302 898 HG3 GLU 115 2HG GLU 115 2.282 -8.377 -8.485 899 H GLY 116 H GLY 116 5.298 -10.712 -5.673 900 HA2 GLY 116 1HA GLY 116 3.980 -12.072 -3.405 901 HA3 GLY 116 2HA GLY 116 5.370 -12.711 -4.269 902 H LEU 117 H LEU 117 5.031 -9.353 -3.326 903 HA LEU 117 HA LEU 117 7.541 -9.064 -2.253 904 HG LEU 117 HG LEU 117 7.783 -7.138 -0.625 905 HB2 LEU 117 1HB LEU 117 6.111 -7.168 -2.769 906 HB3 LEU 117 2HB LEU 117 5.005 -7.613 -1.486 907 HD11 LEU 117 1HD1 LEU 117 6.098 -4.951 -1.792 908 HD12 LEU 117 2HD1 LEU 117 7.778 -5.354 -2.148 909 HD13 LEU 117 3HD1 LEU 117 7.351 -4.650 -0.588 910 HD21 LEU 117 3HD2 LEU 117 5.546 -7.542 0.713 911 HD22 LEU 117 1HD2 LEU 117 5.396 -5.795 0.523 912 HD23 LEU 117 2HD2 LEU 117 6.808 -6.476 1.329 913 H LYS 118 H LYS 118 4.665 -10.325 -0.729 914 HA LYS 118 HA LYS 118 5.147 -10.173 1.935 915 HB2 LYS 118 1HB LYS 118 4.125 -12.494 2.121 916 HB3 LYS 118 2HB LYS 118 3.176 -11.277 1.281 917 HG2 LYS 118 1HG LYS 118 2.921 -13.059 -0.120 918 HG3 LYS 118 2HG LYS 118 4.334 -12.294 -0.845 919 HD2 LYS 118 1HD LYS 118 4.746 -14.652 -0.692 920 HD3 LYS 118 2HD LYS 118 5.764 -13.839 0.497 921 HE2 LYS 118 1HE LYS 118 3.123 -14.640 1.491 922 HE3 LYS 118 2HE LYS 118 4.167 -15.980 1.018 923 HZ1 LYS 118 3HZ LYS 118 4.232 -14.820 3.416 924 HZ2 LYS 118 1HZ LYS 118 5.428 -13.921 2.625 925 HZ3 LYS 118 2HZ LYS 118 5.560 -15.604 2.722 926 H GLY 119 H GLY 119 7.075 -11.974 -0.338 927 HA2 GLY 119 1HA GLY 119 8.375 -13.534 1.739 928 HA3 GLY 119 2HA GLY 119 8.729 -13.586 0.020 929 H VAL 120 H VAL 120 8.611 -10.611 1.863 930 HA VAL 120 HA VAL 120 11.260 -9.896 1.040 931 HB VAL 120 HB VAL 120 10.887 -7.887 2.532 932 HG11 VAL 120 1HG1 VAL 120 10.083 -6.914 0.710 933 HG12 VAL 120 2HG1 VAL 120 8.527 -7.717 0.903 934 HG13 VAL 120 3HG1 VAL 120 9.829 -8.519 0.026 935 HG21 VAL 120 3HG2 VAL 120 8.666 -9.520 3.389 936 HG22 VAL 120 1HG2 VAL 120 8.117 -7.946 2.819 937 HG23 VAL 120 2HG2 VAL 120 9.321 -8.048 4.104 938 H ALA 121 H ALA 121 13.050 -9.382 2.459 939 HA ALA 121 HA ALA 121 13.349 -11.295 4.593 940 HB1 ALA 121 3HB ALA 121 15.301 -9.126 3.840 941 HB2 ALA 121 1HB ALA 121 15.168 -10.648 2.956 942 HB3 ALA 121 2HB ALA 121 15.632 -10.654 4.656 943 H ASP 122 H ASP 122 13.661 -10.823 6.804 944 HA ASP 122 HA ASP 122 12.077 -8.807 7.880 945 HB2 ASP 122 1HB ASP 122 12.970 -9.393 10.030 946 HB3 ASP 122 2HB ASP 122 12.764 -10.865 9.083 947 H GLY 123 H GLY 123 12.344 -6.706 7.706 948 HA2 GLY 123 1HA GLY 123 13.293 -4.635 8.021 949 HA3 GLY 123 2HA GLY 123 14.674 -5.433 8.749 950 H GLU 124 H GLU 124 13.387 -3.964 5.929 951 HA GLU 124 HA GLU 124 16.029 -3.870 4.771 952 HB2 GLU 124 1HB GLU 124 15.075 -4.577 2.483 953 HB3 GLU 124 2HB GLU 124 15.482 -5.832 3.640 954 HG2 GLU 124 1HG GLU 124 13.213 -6.223 4.156 955 HG3 GLU 124 2HG GLU 124 12.695 -4.764 3.310 956 H SER 125 H SER 125 16.307 -2.227 3.232 957 HA SER 125 HA SER 125 14.971 0.136 3.698 958 HG SER 125 HG SER 125 17.386 1.542 2.368 959 HB2 SER 125 1HB SER 125 17.158 -0.539 2.264 960 HB3 SER 125 2HB SER 125 16.032 -0.187 0.952 961 H VAL 126 H VAL 126 13.792 1.482 2.119 962 HA VAL 126 HA VAL 126 12.080 0.202 0.195 963 HB VAL 126 HB VAL 126 10.802 1.439 2.645 964 HG11 VAL 126 1HG1 VAL 126 9.584 0.161 0.206 965 HG12 VAL 126 2HG1 VAL 126 9.504 1.865 0.656 966 HG13 VAL 126 3HG1 VAL 126 8.698 0.650 1.647 967 HG21 VAL 126 3HG2 VAL 126 11.638 -0.697 3.265 968 HG22 VAL 126 1HG2 VAL 126 11.028 -1.431 1.782 969 HG23 VAL 126 2HG2 VAL 126 9.900 -0.855 3.010 970 H VAL 127 H VAL 127 11.675 1.634 -1.418 971 HA VAL 127 HA VAL 127 11.822 4.501 -0.758 972 HB VAL 127 HB VAL 127 12.956 4.917 -2.919 973 HG11 VAL 127 1HG1 VAL 127 14.065 4.069 -0.551 974 HG12 VAL 127 2HG1 VAL 127 14.936 4.806 -1.896 975 HG13 VAL 127 3HG1 VAL 127 14.862 3.049 -1.749 976 HG21 VAL 127 3HG2 VAL 127 14.061 2.373 -3.452 977 HG22 VAL 127 1HG2 VAL 127 13.008 3.344 -4.480 978 HG23 VAL 127 2HG2 VAL 127 12.312 2.172 -3.360 979 H VAL 128 H VAL 128 9.838 5.267 -1.051 980 HA VAL 128 HA VAL 128 8.054 4.165 -3.050 981 HB VAL 128 HB VAL 128 7.280 6.683 -1.710 982 HG11 VAL 128 1HG1 VAL 128 5.309 5.036 -1.117 983 HG12 VAL 128 2HG1 VAL 128 6.027 4.078 -2.408 984 HG13 VAL 128 3HG1 VAL 128 5.473 5.722 -2.731 985 HG21 VAL 128 3HG2 VAL 128 8.223 6.039 0.259 986 HG22 VAL 128 1HG2 VAL 128 8.188 4.325 -0.155 987 HG23 VAL 128 2HG2 VAL 128 6.714 5.133 0.372 988 H GLU 129 H GLU 129 7.738 5.026 -5.082 989 HA GLU 129 HA GLU 129 8.268 7.820 -5.596 990 HB2 GLU 129 1HB GLU 129 9.805 7.262 -7.516 991 HB3 GLU 129 2HB GLU 129 10.487 7.014 -5.912 992 HG2 GLU 129 1HG GLU 129 9.885 4.594 -6.132 993 HG3 GLU 129 2HG GLU 129 9.468 4.922 -7.814 994 H ARG 130 H ARG 130 6.812 8.579 -7.022 995 HA ARG 130 HA ARG 130 4.939 6.812 -8.260 996 HE ARG 130 HE ARG 130 3.461 11.833 -10.642 997 HB2 ARG 130 1HB ARG 130 4.241 9.003 -7.467 998 HB3 ARG 130 2HB ARG 130 5.372 9.791 -8.555 999 HG2 ARG 130 1HG ARG 130 3.426 7.994 -9.837 1000 HG3 ARG 130 2HG ARG 130 2.759 9.442 -9.079 1001 HD2 ARG 130 1HD ARG 130 5.079 10.217 -10.504 1002 HD3 ARG 130 2HD ARG 130 4.117 9.193 -11.570 1003 HH11 ARG 130 1HH1 ARG 130 2.175 8.830 -11.870 1004 HH12 ARG 130 2HH1 ARG 130 0.727 9.556 -12.479 1005 HH21 ARG 130 1HH2 ARG 130 1.555 12.789 -11.442 1006 HH22 ARG 130 2HH2 ARG 130 0.373 11.804 -12.237 1007 H ALA 131 H ALA 131 6.172 5.501 -9.639 1008 HA ALA 131 HA ALA 131 7.363 4.908 -11.512 1009 HB1 ALA 131 3HB ALA 131 5.191 5.204 -12.451 1010 HB2 ALA 131 1HB ALA 131 6.373 5.837 -13.596 1011 HB3 ALA 131 2HB ALA 131 5.432 6.945 -12.596 Start of MODEL 3 1 H MET 1 H MET 1 -9.000 4.244 -20.606 2 HA MET 1 HA MET 1 -7.387 3.643 -18.874 3 HB2 MET 1 1HB MET 1 -5.680 3.732 -21.146 4 HB3 MET 1 2HB MET 1 -5.166 5.013 -20.056 5 HG2 MET 1 1HG MET 1 -3.956 3.396 -19.103 6 HG3 MET 1 2HG MET 1 -5.475 2.970 -18.316 7 HE1 MET 1 3HE MET 1 -4.088 0.176 -18.177 8 HE2 MET 1 1HE MET 1 -2.913 1.370 -18.731 9 HE3 MET 1 2HE MET 1 -3.143 -0.127 -19.635 10 H GLY 2 H GLY 2 -8.891 5.200 -18.089 11 HA2 GLY 2 1HA GLY 2 -8.464 7.333 -16.862 12 HA3 GLY 2 2HA GLY 2 -7.980 7.993 -18.415 13 H GLU 3 H GLU 3 -10.374 8.070 -16.252 14 HA GLU 3 HA GLU 3 -12.388 8.650 -18.314 15 HB2 GLU 3 1HB GLU 3 -14.116 7.838 -16.642 16 HB3 GLU 3 2HB GLU 3 -13.139 6.597 -17.414 17 HG2 GLU 3 1HG GLU 3 -11.750 7.292 -15.097 18 HG3 GLU 3 2HG GLU 3 -13.446 7.223 -14.625 19 H ARG 4 H ARG 4 -11.299 9.209 -14.995 20 HA ARG 4 HA ARG 4 -12.134 11.986 -15.228 21 HE ARG 4 HE ARG 4 -15.477 12.569 -15.043 22 HB2 ARG 4 1HB ARG 4 -12.865 10.916 -12.594 23 HB3 ARG 4 2HB ARG 4 -13.727 12.036 -13.634 24 HG2 ARG 4 1HG ARG 4 -13.680 9.192 -14.465 25 HG3 ARG 4 2HG ARG 4 -14.636 9.602 -13.046 26 HD2 ARG 4 1HD ARG 4 -14.973 10.498 -15.884 27 HD3 ARG 4 2HD ARG 4 -16.160 9.793 -14.790 28 HH11 ARG 4 1HH1 ARG 4 -16.768 10.131 -12.904 29 HH12 ARG 4 2HH1 ARG 4 -17.653 11.267 -11.942 30 HH21 ARG 4 1HH2 ARG 4 -16.642 14.064 -13.779 31 HH22 ARG 4 2HH2 ARG 4 -17.583 13.498 -12.440 32 H GLY 5 H GLY 5 -11.003 9.730 -12.709 33 HA2 GLY 5 1HA GLY 5 -8.422 10.996 -12.593 34 HA3 GLY 5 2HA GLY 5 -9.443 11.394 -11.219 35 H VAL 6 H VAL 6 -9.643 8.304 -12.818 36 HA VAL 6 HA VAL 6 -8.423 7.066 -10.423 37 HB VAL 6 HB VAL 6 -9.810 5.097 -10.809 38 HG11 VAL 6 1HG1 VAL 6 -10.956 7.752 -10.298 39 HG12 VAL 6 2HG1 VAL 6 -11.032 6.273 -9.340 40 HG13 VAL 6 3HG1 VAL 6 -12.127 6.497 -10.704 41 HG21 VAL 6 3HG2 VAL 6 -10.023 5.901 -13.400 42 HG22 VAL 6 1HG2 VAL 6 -11.605 6.355 -12.762 43 HG23 VAL 6 2HG2 VAL 6 -11.047 4.687 -12.637 44 H GLU 7 H GLU 7 -6.460 7.616 -11.889 45 HA GLU 7 HA GLU 7 -5.598 5.116 -13.037 46 HB2 GLU 7 1HB GLU 7 -5.931 7.583 -14.738 47 HB3 GLU 7 2HB GLU 7 -4.833 6.280 -15.174 48 HG2 GLU 7 1HG GLU 7 -7.819 6.114 -14.858 49 HG3 GLU 7 2HG GLU 7 -6.893 5.991 -16.353 50 H MET 8 H MET 8 -4.784 6.595 -10.779 51 HA MET 8 HA MET 8 -2.165 7.647 -11.597 52 HB2 MET 8 1HB MET 8 -3.929 8.927 -10.073 53 HB3 MET 8 2HB MET 8 -3.163 7.976 -8.810 54 HG2 MET 8 1HG MET 8 -1.592 9.524 -8.688 55 HG3 MET 8 2HG MET 8 -1.059 9.040 -10.297 56 HE1 MET 8 3HE MET 8 -3.678 10.026 -12.063 57 HE2 MET 8 1HE MET 8 -1.968 10.063 -12.498 58 HE3 MET 8 2HE MET 8 -2.940 11.531 -12.613 59 H ARG 9 H ARG 9 -0.627 6.159 -11.534 60 HA ARG 9 HA ARG 9 -0.706 4.155 -9.382 61 HE ARG 9 HE ARG 9 2.632 2.265 -13.668 62 HB2 ARG 9 1HB ARG 9 0.328 2.616 -10.774 63 HB3 ARG 9 2HB ARG 9 -0.728 3.486 -11.877 64 HG2 ARG 9 1HG ARG 9 1.092 3.650 -13.161 65 HG3 ARG 9 2HG ARG 9 1.569 4.942 -12.061 66 HD2 ARG 9 1HD ARG 9 3.289 3.761 -11.283 67 HD3 ARG 9 2HD ARG 9 2.282 2.337 -11.019 68 HH11 ARG 9 1HH1 ARG 9 4.915 2.714 -11.063 69 HH12 ARG 9 2HH1 ARG 9 6.229 1.994 -11.929 70 HH21 ARG 9 1HH2 ARG 9 4.361 1.315 -14.801 71 HH22 ARG 9 2HH2 ARG 9 5.917 1.198 -14.048 72 H LEU 10 H LEU 10 1.054 3.670 -8.158 73 HA LEU 10 HA LEU 10 3.330 5.530 -8.354 74 HG LEU 10 HG LEU 10 0.678 4.338 -6.146 75 HB2 LEU 10 1HB LEU 10 3.184 4.545 -5.690 76 HB3 LEU 10 2HB LEU 10 3.045 6.197 -6.251 77 HD11 LEU 10 1HD1 LEU 10 1.445 4.431 -3.891 78 HD12 LEU 10 2HD1 LEU 10 0.116 5.581 -4.026 79 HD13 LEU 10 3HD1 LEU 10 1.782 6.160 -4.013 80 HD21 LEU 10 3HD2 LEU 10 1.021 6.792 -7.330 81 HD22 LEU 10 1HD2 LEU 10 0.314 7.204 -5.769 82 HD23 LEU 10 2HD2 LEU 10 -0.521 6.087 -6.846 83 H ARG 11 H ARG 11 5.345 4.646 -7.338 84 HA ARG 11 HA ARG 11 5.518 1.768 -7.906 85 HE ARG 11 HE ARG 11 8.350 -1.059 -9.894 86 HB2 ARG 11 1HB ARG 11 6.940 3.853 -9.031 87 HB3 ARG 11 2HB ARG 11 8.059 3.205 -7.840 88 HG2 ARG 11 1HG ARG 11 6.716 1.662 -10.048 89 HG3 ARG 11 2HG ARG 11 8.406 2.165 -9.996 90 HD2 ARG 11 1HD ARG 11 8.425 0.844 -7.743 91 HD3 ARG 11 2HD ARG 11 6.999 0.056 -8.417 92 HH11 ARG 11 1HH1 ARG 11 10.160 1.549 -8.444 93 HH12 ARG 11 2HH1 ARG 11 11.673 1.039 -9.117 94 HH21 ARG 11 1HH2 ARG 11 10.338 -1.731 -10.780 95 HH22 ARG 11 2HH2 ARG 11 11.774 -0.822 -10.444 96 H ILE 12 H ILE 12 6.657 0.419 -6.510 97 HA ILE 12 HA ILE 12 7.803 1.548 -4.088 98 HB ILE 12 HB ILE 12 5.241 0.094 -4.155 99 HG12 ILE 12 1HG1 ILE 12 6.515 1.609 -1.885 100 HG13 ILE 12 2HG1 ILE 12 5.773 2.426 -3.258 101 HG21 ILE 12 1HG2 ILE 12 6.294 -1.787 -3.286 102 HG22 ILE 12 2HG2 ILE 12 5.766 -0.916 -1.848 103 HG23 ILE 12 3HG2 ILE 12 7.452 -0.831 -2.357 104 HD11 ILE 12 3HD1 ILE 12 4.338 0.463 -1.490 105 HD12 ILE 12 1HD1 ILE 12 3.637 1.494 -2.738 106 HD13 ILE 12 2HD1 ILE 12 4.304 2.213 -1.272 107 H ARG 13 H ARG 13 9.797 0.805 -4.487 108 HA ARG 13 HA ARG 13 10.123 -2.023 -5.203 109 HE ARG 13 HE ARG 13 14.620 -0.165 -5.987 110 HB2 ARG 13 1HB ARG 13 12.465 -1.387 -5.764 111 HB3 ARG 13 2HB ARG 13 11.255 -0.543 -6.720 112 HG2 ARG 13 1HG ARG 13 11.498 1.378 -5.095 113 HG3 ARG 13 2HG ARG 13 12.905 0.531 -4.450 114 HD2 ARG 13 1HD ARG 13 12.557 1.302 -7.345 115 HD3 ARG 13 2HD ARG 13 13.443 2.263 -6.162 116 HH11 ARG 13 1HH1 ARG 13 13.912 1.956 -8.667 117 HH12 ARG 13 2HH1 ARG 13 15.271 1.430 -9.604 118 HH21 ARG 13 1HH2 ARG 13 16.407 -0.857 -7.218 119 HH22 ARG 13 2HH2 ARG 13 16.687 -0.167 -8.781 120 H PHE 14 H PHE 14 11.737 -3.290 -4.191 121 HA PHE 14 HA PHE 14 12.530 -2.436 -1.498 122 HD1 PHE 14 HD2 PHE 14 9.803 -2.249 -1.573 123 HD2 PHE 14 HD1 PHE 14 11.297 -5.320 0.967 124 HE1 PHE 14 HE2 PHE 14 8.368 -1.433 0.248 125 HE2 PHE 14 HE1 PHE 14 9.863 -4.510 2.793 126 HZ PHE 14 HZ PHE 14 8.396 -2.564 2.435 127 HB2 PHE 14 1HB PHE 14 10.893 -4.773 -2.299 128 HB3 PHE 14 2HB PHE 14 12.175 -5.107 -1.142 129 H GLU 15 H GLU 15 14.575 -3.007 -0.931 130 HA GLU 15 HA GLU 15 16.550 -3.387 -2.739 131 HB2 GLU 15 1HB GLU 15 16.332 -3.884 0.159 132 HB3 GLU 15 2HB GLU 15 17.618 -4.766 -0.642 133 HG2 GLU 15 1HG GLU 15 18.097 -2.442 0.373 134 HG3 GLU 15 2HG GLU 15 18.772 -2.869 -1.196 135 H SER 16 H SER 16 14.477 -5.891 -1.478 136 HA SER 16 HA SER 16 15.906 -7.835 -3.170 137 HG SER 16 HG SER 16 13.581 -8.264 -0.439 138 HB2 SER 16 1HB SER 16 15.145 -9.579 -1.503 139 HB3 SER 16 2HB SER 16 16.374 -8.460 -0.915 140 H ALA 17 H ALA 17 13.444 -6.087 -3.612 141 HA ALA 17 HA ALA 17 11.932 -8.065 -4.998 142 HB1 ALA 17 3HB ALA 17 10.189 -6.904 -2.898 143 HB2 ALA 17 1HB ALA 17 11.277 -8.212 -2.424 144 HB3 ALA 17 2HB ALA 17 10.103 -8.465 -3.714 145 H GLU 18 H GLU 18 10.250 -7.240 -6.289 146 HA GLU 18 HA GLU 18 10.136 -4.295 -6.453 147 HB2 GLU 18 1HB GLU 18 9.836 -4.591 -8.912 148 HB3 GLU 18 2HB GLU 18 11.415 -5.093 -8.324 149 HG2 GLU 18 1HG GLU 18 10.876 -7.377 -8.524 150 HG3 GLU 18 2HG GLU 18 9.162 -7.028 -8.744 151 H CYS 19 H CYS 19 8.135 -3.344 -6.861 152 HA CYS 19 HA CYS 19 5.841 -4.943 -7.537 153 HG CYS 19 HG CYS 19 7.530 -5.338 -4.395 154 HB2 CYS 19 1HB CYS 19 4.919 -3.813 -5.126 155 HB3 CYS 19 2HB CYS 19 5.135 -5.521 -5.491 156 H GLU 20 H GLU 20 3.981 -3.729 -8.056 157 HA GLU 20 HA GLU 20 4.210 -0.813 -7.826 158 HB2 GLU 20 1HB GLU 20 3.139 -1.909 -10.382 159 HB3 GLU 20 2HB GLU 20 3.964 -0.387 -10.076 160 HG2 GLU 20 1HG GLU 20 6.036 -1.886 -9.663 161 HG3 GLU 20 2HG GLU 20 5.109 -3.094 -10.551 162 H VAL 21 H VAL 21 2.133 0.296 -8.103 163 HA VAL 21 HA VAL 21 -0.261 -1.324 -8.088 164 HB VAL 21 HB VAL 21 -0.499 -1.531 -5.893 165 HG11 VAL 21 1HG1 VAL 21 1.126 -0.474 -4.280 166 HG12 VAL 21 2HG1 VAL 21 1.914 0.249 -5.684 167 HG13 VAL 21 3HG1 VAL 21 1.829 -1.506 -5.526 168 HG21 VAL 21 3HG2 VAL 21 -0.485 1.485 -5.787 169 HG22 VAL 21 1HG2 VAL 21 -1.047 0.419 -4.500 170 HG23 VAL 21 2HG2 VAL 21 -1.889 0.450 -6.048 171 H GLU 22 H GLU 22 -2.144 -0.188 -8.474 172 HA GLU 22 HA GLU 22 -1.760 2.559 -9.422 173 HB2 GLU 22 1HB GLU 22 -3.642 0.347 -10.094 174 HB3 GLU 22 2HB GLU 22 -4.218 1.997 -10.285 175 HG2 GLU 22 1HG GLU 22 -2.856 2.423 -12.040 176 HG3 GLU 22 2HG GLU 22 -1.576 1.365 -11.446 177 H LEU 23 H LEU 23 -4.119 3.776 -9.221 178 HA LEU 23 HA LEU 23 -5.308 3.275 -6.641 179 HG LEU 23 HG LEU 23 -5.777 6.508 -6.378 180 HB2 LEU 23 1HB LEU 23 -3.589 4.539 -5.736 181 HB3 LEU 23 2HB LEU 23 -3.479 5.583 -7.136 182 HD11 LEU 23 1HD1 LEU 23 -5.590 6.343 -3.691 183 HD12 LEU 23 2HD1 LEU 23 -5.063 4.724 -4.141 184 HD13 LEU 23 3HD1 LEU 23 -6.639 5.317 -4.666 185 HD21 LEU 23 3HD2 LEU 23 -3.191 6.994 -4.919 186 HD22 LEU 23 1HD2 LEU 23 -4.622 8.008 -4.727 187 HD23 LEU 23 2HD2 LEU 23 -3.840 7.874 -6.303 188 H TYR 24 H TYR 24 -7.295 4.189 -6.357 189 HA TYR 24 HA TYR 24 -8.339 5.767 -8.615 190 HD1 TYR 24 HD1 TYR 24 -7.879 4.447 -10.111 191 HD2 TYR 24 HD2 TYR 24 -10.165 1.478 -8.095 192 HE1 TYR 24 HE1 TYR 24 -7.059 2.751 -11.691 193 HE2 TYR 24 HE2 TYR 24 -9.353 -0.226 -9.670 194 HH TYR 24 HH TYR 24 -8.411 -0.398 -11.875 195 HB2 TYR 24 1HB TYR 24 -9.856 3.615 -7.105 196 HB3 TYR 24 2HB TYR 24 -10.467 4.579 -8.444 197 H GLU 25 H GLU 25 -9.863 7.357 -8.146 198 HA GLU 25 HA GLU 25 -9.515 8.785 -5.791 199 HB2 GLU 25 1HB GLU 25 -11.806 8.885 -7.751 200 HB3 GLU 25 2HB GLU 25 -11.574 10.049 -6.452 201 HG2 GLU 25 1HG GLU 25 -9.793 11.046 -7.473 202 HG3 GLU 25 2HG GLU 25 -9.329 9.587 -8.346 203 H GLU 26 H GLU 26 -11.310 5.935 -6.059 204 HA GLU 26 HA GLU 26 -13.570 6.249 -4.584 205 HB2 GLU 26 1HB GLU 26 -13.441 3.950 -4.002 206 HB3 GLU 26 2HB GLU 26 -12.671 4.109 -5.574 207 HG2 GLU 26 1HG GLU 26 -10.465 4.186 -4.353 208 HG3 GLU 26 2HG GLU 26 -11.354 3.720 -2.904 209 H TRP 27 H TRP 27 -10.292 6.488 -3.420 210 HA TRP 27 HA TRP 27 -11.042 6.362 -0.639 211 HD1 TRP 27 HD1 TRP 27 -10.088 7.747 1.229 212 HE1 TRP 27 HE1 TRP 27 -8.318 8.549 2.916 213 HE3 TRP 27 HE3 TRP 27 -5.871 6.560 -1.398 214 HZ2 TRP 27 HZ2 TRP 27 -5.501 8.665 3.105 215 HZ3 TRP 27 HZ3 TRP 27 -3.677 7.048 -0.396 216 HH2 TRP 27 HH2 TRP 27 -3.497 8.079 1.811 217 HB2 TRP 27 1HB TRP 27 -8.848 5.552 -1.160 218 HB3 TRP 27 2HB TRP 27 -8.453 7.013 -2.060 219 H ALA 28 H ALA 28 -9.712 8.886 -2.795 220 HA ALA 28 HA ALA 28 -11.376 10.920 -2.509 221 HB1 ALA 28 3HB ALA 28 -9.918 10.639 0.084 222 HB2 ALA 28 1HB ALA 28 -11.612 11.024 -0.217 223 HB3 ALA 28 2HB ALA 28 -10.368 12.242 -0.497 224 HA PRO 29 HA PRO 29 -7.952 12.296 -5.103 225 HB2 PRO 29 1HB PRO 29 -9.203 14.866 -5.277 226 HB3 PRO 29 2HB PRO 29 -9.139 13.602 -6.506 227 HG2 PRO 29 1HG PRO 29 -11.314 14.327 -4.679 228 HG3 PRO 29 2HG PRO 29 -11.374 13.392 -6.179 229 HD2 PRO 29 1HD PRO 29 -11.716 12.311 -3.695 230 HD3 PRO 29 2HD PRO 29 -11.098 11.397 -5.084 231 H GLU 30 H GLU 30 -9.272 13.994 -2.316 232 HA GLU 30 HA GLU 30 -7.243 15.946 -2.072 233 HB2 GLU 30 1HB GLU 30 -9.267 14.800 -0.170 234 HB3 GLU 30 2HB GLU 30 -8.017 15.882 0.423 235 HG2 GLU 30 1HG GLU 30 -9.377 16.933 -1.927 236 HG3 GLU 30 2HG GLU 30 -10.468 16.616 -0.582 237 H THR 31 H THR 31 -7.628 12.751 -0.555 238 HA THR 31 HA THR 31 -5.216 12.929 0.962 239 HB THR 31 HB THR 31 -5.718 10.197 0.517 240 HG1 THR 31 HG1 THR 31 -7.825 9.957 0.388 241 HG21 THR 31 3HG2 THR 31 -5.270 10.722 2.704 242 HG22 THR 31 1HG2 THR 31 -7.011 10.450 2.760 243 HG23 THR 31 2HG2 THR 31 -6.378 12.096 2.724 244 H VAL 32 H VAL 32 -6.004 11.392 -2.141 245 HA VAL 32 HA VAL 32 -3.674 10.121 -2.771 246 HB VAL 32 HB VAL 32 -5.222 11.835 -4.718 247 HG11 VAL 32 1HG1 VAL 32 -3.224 9.647 -4.988 248 HG12 VAL 32 2HG1 VAL 32 -3.429 11.117 -5.942 249 HG13 VAL 32 3HG1 VAL 32 -4.524 9.756 -6.175 250 HG21 VAL 32 3HG2 VAL 32 -6.354 9.522 -5.134 251 HG22 VAL 32 1HG2 VAL 32 -6.909 10.551 -3.813 252 HG23 VAL 32 2HG2 VAL 32 -5.839 9.188 -3.480 253 H ARG 33 H ARG 33 -4.244 13.563 -2.655 254 HA ARG 33 HA ARG 33 -2.057 14.460 -4.153 255 HE ARG 33 HE ARG 33 -4.145 19.388 -3.869 256 HB2 ARG 33 1HB ARG 33 -4.031 15.802 -3.231 257 HB3 ARG 33 2HB ARG 33 -3.132 15.884 -1.724 258 HG2 ARG 33 1HG ARG 33 -2.152 17.711 -2.504 259 HG3 ARG 33 2HG ARG 33 -1.314 16.693 -3.676 260 HD2 ARG 33 1HD ARG 33 -2.449 17.614 -5.351 261 HD3 ARG 33 2HD ARG 33 -3.986 17.219 -4.582 262 HH11 ARG 33 1HH1 ARG 33 -0.866 18.779 -4.896 263 HH12 ARG 33 2HH1 ARG 33 -0.389 20.439 -4.779 264 HH21 ARG 33 1HH2 ARG 33 -3.519 21.572 -3.713 265 HH22 ARG 33 2HH2 ARG 33 -1.894 22.025 -4.107 266 H ALA 34 H ALA 34 -2.260 13.365 -0.815 267 HA ALA 34 HA ALA 34 0.314 14.320 -0.036 268 HB1 ALA 34 3HB ALA 34 -1.776 12.612 1.149 269 HB2 ALA 34 1HB ALA 34 -0.856 13.942 1.852 270 HB3 ALA 34 2HB ALA 34 -0.128 12.342 1.721 271 H ILE 35 H ILE 35 -0.891 11.138 -1.057 272 HA ILE 35 HA ILE 35 1.498 9.709 -0.799 273 HB ILE 35 HB ILE 35 0.033 8.971 -3.229 274 HG12 ILE 35 1HG1 ILE 35 -1.855 9.974 -2.013 275 HG13 ILE 35 2HG1 ILE 35 -2.016 8.224 -2.114 276 HG21 ILE 35 1HG2 ILE 35 0.053 6.789 -2.197 277 HG22 ILE 35 2HG2 ILE 35 0.540 7.495 -0.655 278 HG23 ILE 35 3HG2 ILE 35 1.637 7.547 -2.034 279 HD11 ILE 35 3HD1 ILE 35 -2.486 9.504 0.120 280 HD12 ILE 35 1HD1 ILE 35 -0.735 9.396 0.297 281 HD13 ILE 35 2HD1 ILE 35 -1.696 7.927 0.124 282 H ALA 36 H ALA 36 0.216 11.523 -3.626 283 HA ALA 36 HA ALA 36 2.435 11.071 -5.315 284 HB1 ALA 36 3HB ALA 36 1.327 12.331 -6.818 285 HB2 ALA 36 1HB ALA 36 0.967 13.604 -5.651 286 HB3 ALA 36 2HB ALA 36 -0.012 12.139 -5.686 287 H ASP 37 H ASP 37 1.812 13.348 -2.739 288 HA ASP 37 HA ASP 37 3.915 15.160 -3.422 289 HB2 ASP 37 1HB ASP 37 1.886 15.538 -1.852 290 HB3 ASP 37 2HB ASP 37 2.888 14.771 -0.624 291 H ALA 38 H ALA 38 3.767 12.127 -1.767 292 HA ALA 38 HA ALA 38 6.447 12.399 -0.669 293 HB1 ALA 38 3HB ALA 38 5.829 10.891 0.885 294 HB2 ALA 38 1HB ALA 38 4.965 9.888 -0.282 295 HB3 ALA 38 2HB ALA 38 4.194 11.332 0.377 296 H LEU 39 H LEU 39 6.647 12.368 -3.351 297 HA LEU 39 HA LEU 39 6.810 9.824 -4.568 298 HG LEU 39 HG LEU 39 6.088 13.020 -5.572 299 HB2 LEU 39 1HB LEU 39 8.311 12.349 -5.297 300 HB3 LEU 39 2HB LEU 39 8.098 10.947 -6.319 301 HD11 LEU 39 1HD1 LEU 39 7.413 12.001 -7.974 302 HD12 LEU 39 2HD1 LEU 39 6.724 13.590 -7.641 303 HD13 LEU 39 3HD1 LEU 39 5.678 12.264 -8.152 304 HD21 LEU 39 3HD2 LEU 39 4.866 11.072 -4.984 305 HD22 LEU 39 1HD2 LEU 39 5.506 10.168 -6.352 306 HD23 LEU 39 2HD2 LEU 39 4.367 11.481 -6.624 307 HA PRO 40 HA PRO 40 10.984 7.999 -4.126 308 HB2 PRO 40 1HB PRO 40 12.416 10.515 -4.912 309 HB3 PRO 40 2HB PRO 40 12.870 8.829 -5.196 310 HG2 PRO 40 1HG PRO 40 11.629 10.334 -7.074 311 HG3 PRO 40 2HG PRO 40 11.410 8.582 -6.944 312 HD2 PRO 40 1HD PRO 40 9.500 10.705 -6.444 313 HD3 PRO 40 2HD PRO 40 9.220 8.961 -6.532 314 H ILE 41 H ILE 41 10.927 7.761 -1.992 315 HA ILE 41 HA ILE 41 12.448 9.618 -0.359 316 HB ILE 41 HB ILE 41 9.536 9.000 0.163 317 HG12 ILE 41 1HG1 ILE 41 11.146 11.568 0.100 318 HG13 ILE 41 2HG1 ILE 41 9.994 11.032 -1.116 319 HG21 ILE 41 1HG2 ILE 41 10.709 8.491 2.219 320 HG22 ILE 41 2HG2 ILE 41 9.840 10.014 2.400 321 HG23 ILE 41 3HG2 ILE 41 11.583 10.020 2.137 322 HD11 ILE 41 3HD1 ILE 41 8.780 11.137 1.499 323 HD12 ILE 41 1HD1 ILE 41 8.298 11.926 -0.002 324 HD13 ILE 41 2HD1 ILE 41 9.495 12.684 1.050 325 H LYS 42 H LYS 42 13.268 8.631 1.550 326 HA LYS 42 HA LYS 42 13.454 5.754 1.318 327 HB2 LYS 42 1HB LYS 42 14.984 7.891 2.644 328 HB3 LYS 42 2HB LYS 42 14.936 6.366 3.520 329 HG2 LYS 42 1HG LYS 42 16.389 5.427 2.133 330 HG3 LYS 42 2HG LYS 42 15.478 5.946 0.715 331 HD2 LYS 42 1HD LYS 42 17.424 7.098 0.373 332 HD3 LYS 42 2HD LYS 42 16.535 8.289 1.325 333 HE2 LYS 42 1HE LYS 42 17.647 7.278 3.366 334 HE3 LYS 42 2HE LYS 42 18.696 6.408 2.247 335 HZ1 LYS 42 3HZ LYS 42 18.626 9.250 2.904 336 HZ2 LYS 42 1HZ LYS 42 18.989 8.845 1.301 337 HZ3 LYS 42 2HZ LYS 42 19.947 8.251 2.562 338 H SER 43 H SER 43 12.663 4.255 2.670 339 HA SER 43 HA SER 43 11.441 5.027 5.193 340 HG SER 43 HG SER 43 9.598 3.137 2.299 341 HB2 SER 43 1HB SER 43 9.289 4.330 4.726 342 HB3 SER 43 2HB SER 43 9.745 5.033 3.178 343 H THR 44 H THR 44 11.214 3.293 6.671 344 HA THR 44 HA THR 44 12.864 0.957 5.957 345 HB THR 44 HB THR 44 12.045 1.318 8.772 346 HG1 THR 44 HG1 THR 44 13.763 3.175 7.493 347 HG21 THR 44 3HG2 THR 44 14.789 1.307 8.643 348 HG22 THR 44 1HG2 THR 44 14.312 0.283 7.288 349 HG23 THR 44 2HG2 THR 44 13.752 -0.093 8.917 350 H ALA 45 H ALA 45 11.949 -0.937 5.633 351 HA ALA 45 HA ALA 45 9.118 -1.276 6.071 352 HB1 ALA 45 3HB ALA 45 9.356 -2.422 4.182 353 HB2 ALA 45 1HB ALA 45 10.149 -3.687 5.120 354 HB3 ALA 45 2HB ALA 45 11.111 -2.431 4.348 355 H ASN 46 H ASN 46 8.123 -2.457 7.524 356 HA ASN 46 HA ASN 46 9.740 -3.920 9.501 357 HB2 ASN 46 1HB ASN 46 7.078 -2.541 9.622 358 HB3 ASN 46 2HB ASN 46 7.423 -3.849 10.749 359 HD21 ASN 46 1HD2 ASN 46 7.037 -0.923 11.107 360 HD22 ASN 46 2HD2 ASN 46 8.431 -0.393 11.979 361 H ARG 47 H ARG 47 9.656 -6.152 9.439 362 HA ARG 47 HA ARG 47 7.799 -7.347 7.569 363 HE ARG 47 HE ARG 47 7.746 -9.873 7.278 364 HB2 ARG 47 1HB ARG 47 10.348 -8.086 8.802 365 HB3 ARG 47 2HB ARG 47 9.234 -9.433 8.602 366 HG2 ARG 47 1HG ARG 47 9.317 -7.792 6.233 367 HG3 ARG 47 2HG ARG 47 10.926 -8.350 6.677 368 HD2 ARG 47 1HD ARG 47 9.509 -9.820 5.127 369 HD3 ARG 47 2HD ARG 47 10.342 -10.591 6.473 370 HH11 ARG 47 1HH1 ARG 47 9.376 -12.125 5.169 371 HH12 ARG 47 2HH1 ARG 47 8.132 -13.324 5.281 372 HH21 ARG 47 1HH2 ARG 47 6.108 -11.452 7.427 373 HH22 ARG 47 2HH2 ARG 47 6.277 -12.942 6.562 374 H TRP 48 H TRP 48 6.129 -8.645 7.986 375 HA TRP 48 HA TRP 48 5.698 -9.879 10.549 376 HD1 TRP 48 HD1 TRP 48 1.912 -9.790 9.537 377 HE1 TRP 48 HE1 TRP 48 0.390 -10.538 11.475 378 HE3 TRP 48 HE3 TRP 48 4.563 -7.839 13.452 379 HZ2 TRP 48 HZ2 TRP 48 0.323 -10.328 14.289 380 HZ3 TRP 48 HZ3 TRP 48 3.699 -8.157 15.735 381 HH2 TRP 48 HH2 TRP 48 1.623 -9.375 16.142 382 HB2 TRP 48 1HB TRP 48 4.797 -7.669 11.043 383 HB3 TRP 48 2HB TRP 48 3.833 -7.698 9.570 384 H GLY 49 H GLY 49 4.117 -11.547 10.409 385 HA2 GLY 49 1HA GLY 49 3.954 -13.157 8.328 386 HA3 GLY 49 2HA GLY 49 2.554 -12.927 9.358 387 H ASP 50 H ASP 50 4.105 -11.963 6.359 388 HA ASP 50 HA ASP 50 3.220 -11.384 4.342 389 HB2 ASP 50 1HB ASP 50 1.366 -12.978 4.983 390 HB3 ASP 50 2HB ASP 50 0.473 -11.580 5.574 391 H GLU 51 H GLU 51 1.832 -9.816 7.186 392 HA GLU 51 HA GLU 51 1.053 -7.445 5.805 393 HB2 GLU 51 1HB GLU 51 0.339 -8.490 8.162 394 HB3 GLU 51 2HB GLU 51 1.579 -7.382 8.730 395 HG2 GLU 51 1HG GLU 51 0.412 -5.521 7.673 396 HG3 GLU 51 2HG GLU 51 -0.825 -6.629 7.081 397 H ILE 52 H ILE 52 2.228 -5.724 5.284 398 HA ILE 52 HA ILE 52 4.778 -5.276 6.671 399 HB ILE 52 HB ILE 52 4.560 -6.125 3.987 400 HG12 ILE 52 1HG1 ILE 52 7.110 -5.484 4.092 401 HG13 ILE 52 2HG1 ILE 52 6.751 -5.148 5.781 402 HG21 ILE 52 1HG2 ILE 52 5.431 -3.246 4.149 403 HG22 ILE 52 2HG2 ILE 52 4.051 -3.887 3.258 404 HG23 ILE 52 3HG2 ILE 52 5.689 -4.304 2.764 405 HD11 ILE 52 3HD1 ILE 52 5.931 -7.476 6.016 406 HD12 ILE 52 1HD1 ILE 52 7.632 -7.360 5.581 407 HD13 ILE 52 2HD1 ILE 52 6.445 -7.782 4.355 408 H TYR 53 H TYR 53 4.769 -3.332 7.555 409 HA TYR 53 HA TYR 53 3.367 -1.152 6.164 410 HD1 TYR 53 HD2 TYR 53 4.218 0.112 10.052 411 HD2 TYR 53 HD1 TYR 53 2.597 -3.775 9.415 412 HE1 TYR 53 HE2 TYR 53 5.082 -0.603 12.238 413 HE2 TYR 53 HE1 TYR 53 3.458 -4.495 11.601 414 HH TYR 53 HH TYR 53 5.180 -3.875 13.200 415 HB2 TYR 53 1HB TYR 53 2.523 -0.299 8.309 416 HB3 TYR 53 2HB TYR 53 1.940 -1.934 8.003 417 H PHE 54 H PHE 54 4.592 0.564 5.827 418 HA PHE 54 HA PHE 54 6.833 1.092 7.655 419 HD1 PHE 54 HD1 PHE 54 6.777 3.572 4.665 420 HD2 PHE 54 HD2 PHE 54 6.981 -0.493 3.428 421 HE1 PHE 54 HE1 PHE 54 6.013 4.220 2.425 422 HE2 PHE 54 HE2 PHE 54 6.211 0.148 1.185 423 HZ PHE 54 HZ PHE 54 5.727 2.508 0.678 424 HB2 PHE 54 1HB PHE 54 8.284 1.658 5.814 425 HB3 PHE 54 2HB PHE 54 7.656 0.038 5.554 426 H THR 55 H THR 55 7.332 3.260 8.018 427 HA THR 55 HA THR 55 5.180 5.118 7.292 428 HB THR 55 HB THR 55 7.348 6.113 9.021 429 HG1 THR 55 HG1 THR 55 5.744 3.931 9.860 430 HG21 THR 55 3HG2 THR 55 4.781 6.840 8.598 431 HG22 THR 55 1HG2 THR 55 5.718 7.263 10.031 432 HG23 THR 55 2HG2 THR 55 4.623 5.880 10.070 433 H THR 56 H THR 56 5.554 7.059 6.175 434 HA THR 56 HA THR 56 8.212 7.256 4.918 435 HB THR 56 HB THR 56 6.299 8.586 3.304 436 HG1 THR 56 HG1 THR 56 4.703 7.307 4.256 437 HG21 THR 56 3HG2 THR 56 7.283 7.470 1.637 438 HG22 THR 56 1HG2 THR 56 7.126 5.913 2.450 439 HG23 THR 56 2HG2 THR 56 8.446 7.000 2.878 440 H GLN 57 H GLN 57 6.503 8.677 7.221 441 HA GLN 57 HA GLN 57 6.860 10.669 8.300 442 HB2 GLN 57 1HB GLN 57 8.183 11.862 5.873 443 HB3 GLN 57 2HB GLN 57 8.398 12.284 7.567 444 HG2 GLN 57 1HG GLN 57 9.134 9.557 7.214 445 HG3 GLN 57 2HG GLN 57 9.936 10.526 5.979 446 HE21 GLN 57 1HE2 GLN 57 11.943 10.133 6.954 447 HE22 GLN 57 2HE2 GLN 57 12.419 10.949 8.402 448 H VAL 58 H VAL 58 5.131 10.195 5.465 449 HA VAL 58 HA VAL 58 4.041 12.879 5.336 450 HB VAL 58 HB VAL 58 4.283 11.628 3.244 451 HG11 VAL 58 1HG1 VAL 58 2.195 9.743 4.331 452 HG12 VAL 58 2HG1 VAL 58 3.909 9.368 4.151 453 HG13 VAL 58 3HG1 VAL 58 2.923 9.698 2.724 454 HG21 VAL 58 3HG2 VAL 58 1.945 11.911 2.401 455 HG22 VAL 58 1HG2 VAL 58 2.589 13.308 3.263 456 HG23 VAL 58 2HG2 VAL 58 1.446 12.229 4.062 457 H ALA 59 H ALA 59 2.542 13.546 6.709 458 HA ALA 59 HA ALA 59 0.899 11.540 8.077 459 HB1 ALA 59 3HB ALA 59 2.213 13.254 9.394 460 HB2 ALA 59 1HB ALA 59 0.502 13.104 9.792 461 HB3 ALA 59 2HB ALA 59 1.059 14.453 8.806 462 H VAL 60 H VAL 60 -0.706 11.071 6.653 463 HA VAL 60 HA VAL 60 -2.573 13.273 6.058 464 HB VAL 60 HB VAL 60 -1.507 12.634 3.978 465 HG11 VAL 60 1HG1 VAL 60 -0.887 10.315 4.817 466 HG12 VAL 60 2HG1 VAL 60 -1.371 10.446 3.127 467 HG13 VAL 60 3HG1 VAL 60 -2.505 9.819 4.319 468 HG21 VAL 60 3HG2 VAL 60 -4.347 11.695 4.290 469 HG22 VAL 60 1HG2 VAL 60 -3.533 11.732 2.725 470 HG23 VAL 60 2HG2 VAL 60 -3.757 13.224 3.636 471 H GLU 61 H GLU 61 -4.229 12.958 7.453 472 HA GLU 61 HA GLU 61 -5.450 10.283 7.493 473 HB2 GLU 61 1HB GLU 61 -4.244 11.697 9.709 474 HB3 GLU 61 2HB GLU 61 -5.946 11.390 10.020 475 HG2 GLU 61 1HG GLU 61 -5.516 8.991 9.424 476 HG3 GLU 61 2HG GLU 61 -3.798 9.380 9.403 477 H LYS 62 H LYS 62 -7.600 10.242 7.280 478 HA LYS 62 HA LYS 62 -9.246 12.513 7.957 479 HB2 LYS 62 1HB LYS 62 -8.238 12.797 5.548 480 HB3 LYS 62 2HB LYS 62 -9.438 11.593 5.104 481 HG2 LYS 62 1HG LYS 62 -10.623 13.479 4.684 482 HG3 LYS 62 2HG LYS 62 -11.056 13.254 6.377 483 HD2 LYS 62 1HD LYS 62 -8.645 14.874 5.683 484 HD3 LYS 62 2HD LYS 62 -10.249 15.589 5.507 485 HE2 LYS 62 1HE LYS 62 -10.157 14.274 8.020 486 HE3 LYS 62 2HE LYS 62 -8.697 15.251 7.869 487 HZ1 LYS 62 3HZ LYS 62 -11.196 16.518 7.081 488 HZ2 LYS 62 1HZ LYS 62 -9.864 17.166 7.898 489 HZ3 LYS 62 2HZ LYS 62 -10.994 16.225 8.734 490 H GLU 63 H GLU 63 -11.607 11.985 7.661 491 HA GLU 63 HA GLU 63 -12.003 9.125 8.093 492 HB2 GLU 63 1HB GLU 63 -12.966 10.345 9.826 493 HB3 GLU 63 2HB GLU 63 -13.617 11.569 8.749 494 HG2 GLU 63 1HG GLU 63 -15.328 10.078 9.737 495 HG3 GLU 63 2HG GLU 63 -15.313 10.072 7.974 496 H GLU 64 H GLU 64 -12.015 8.263 6.084 497 HA GLU 64 HA GLU 64 -14.441 8.379 4.624 498 HB2 GLU 64 1HB GLU 64 -13.631 9.327 2.531 499 HB3 GLU 64 2HB GLU 64 -13.439 10.490 3.833 500 HG2 GLU 64 1HG GLU 64 -11.030 9.278 3.900 501 HG3 GLU 64 2HG GLU 64 -11.419 9.138 2.187 502 H ASN 65 H ASN 65 -14.587 6.669 3.054 503 HA ASN 65 HA ASN 65 -14.032 4.717 2.027 504 HB2 ASN 65 1HB ASN 65 -11.980 6.089 1.328 505 HB3 ASN 65 2HB ASN 65 -11.124 5.270 2.632 506 HD21 ASN 65 1HD2 ASN 65 -10.093 4.928 0.249 507 HD22 ASN 65 2HD2 ASN 65 -10.444 3.365 -0.399 508 H SER 66 H SER 66 -11.367 4.842 4.347 509 HA SER 66 HA SER 66 -10.621 3.024 5.649 510 HG SER 66 HG SER 66 -12.339 3.412 8.867 511 HB2 SER 66 1HB SER 66 -11.266 4.646 7.220 512 HB3 SER 66 2HB SER 66 -12.984 4.388 6.920 513 H LYS 67 H LYS 67 -11.065 1.100 4.349 514 HA LYS 67 HA LYS 67 -13.569 -0.272 5.072 515 HB2 LYS 67 1HB LYS 67 -12.944 -1.901 3.240 516 HB3 LYS 67 2HB LYS 67 -13.359 -0.283 2.710 517 HG2 LYS 67 1HG LYS 67 -11.532 -0.795 1.418 518 HG3 LYS 67 2HG LYS 67 -10.801 0.120 2.731 519 HD2 LYS 67 1HD LYS 67 -10.319 -2.076 3.855 520 HD3 LYS 67 2HD LYS 67 -10.865 -2.871 2.380 521 HE2 LYS 67 1HE LYS 67 -9.125 -1.792 1.109 522 HE3 LYS 67 2HE LYS 67 -8.629 -0.859 2.517 523 HZ1 LYS 67 3HZ LYS 67 -7.381 -2.536 3.230 524 HZ2 LYS 67 1HZ LYS 67 -7.640 -3.298 1.744 525 HZ3 LYS 67 2HZ LYS 67 -8.635 -3.657 3.063 526 H ASP 68 H ASP 68 -13.434 -2.639 5.525 527 HA ASP 68 HA ASP 68 -10.921 -3.271 6.951 528 HB2 ASP 68 1HB ASP 68 -12.385 -4.514 8.595 529 HB3 ASP 68 2HB ASP 68 -12.519 -2.760 8.630 530 H VAL 69 H VAL 69 -12.730 -4.223 4.376 531 HA VAL 69 HA VAL 69 -11.678 -6.955 4.594 532 HB VAL 69 HB VAL 69 -14.487 -6.363 3.631 533 HG11 VAL 69 1HG1 VAL 69 -13.064 -8.998 3.987 534 HG12 VAL 69 2HG1 VAL 69 -13.377 -8.207 2.442 535 HG13 VAL 69 3HG1 VAL 69 -14.722 -8.768 3.433 536 HG21 VAL 69 3HG2 VAL 69 -13.442 -6.904 6.268 537 HG22 VAL 69 1HG2 VAL 69 -14.564 -8.166 5.760 538 HG23 VAL 69 2HG2 VAL 69 -15.081 -6.480 5.774 539 H VAL 70 H VAL 70 -10.974 -7.855 2.689 540 HA VAL 70 HA VAL 70 -11.551 -6.613 0.146 541 HB VAL 70 HB VAL 70 -9.226 -6.080 -0.425 542 HG11 VAL 70 1HG1 VAL 70 -10.817 -4.390 0.517 543 HG12 VAL 70 2HG1 VAL 70 -9.107 -3.993 0.686 544 HG13 VAL 70 3HG1 VAL 70 -10.010 -4.608 2.071 545 HG21 VAL 70 3HG2 VAL 70 -7.451 -6.036 1.152 546 HG22 VAL 70 1HG2 VAL 70 -8.178 -7.639 1.269 547 HG23 VAL 70 2HG2 VAL 70 -8.531 -6.411 2.487 548 H GLU 71 H GLU 71 -10.634 -7.761 -1.680 549 HA GLU 71 HA GLU 71 -10.311 -10.599 -1.066 550 HB2 GLU 71 1HB GLU 71 -10.463 -9.531 -3.871 551 HB3 GLU 71 2HB GLU 71 -10.991 -11.083 -3.242 552 HG2 GLU 71 1HG GLU 71 -12.920 -10.209 -2.315 553 HG3 GLU 71 2HG GLU 71 -12.320 -8.554 -2.385 554 H LEU 72 H LEU 72 -8.699 -11.888 -1.968 555 HA LEU 72 HA LEU 72 -6.103 -11.079 -1.652 556 HG LEU 72 HG LEU 72 -4.526 -12.522 -3.494 557 HB2 LEU 72 1HB LEU 72 -6.785 -13.422 -1.802 558 HB3 LEU 72 2HB LEU 72 -7.153 -13.230 -3.503 559 HD11 LEU 72 1HD1 LEU 72 -4.675 -13.280 -0.967 560 HD12 LEU 72 2HD1 LEU 72 -3.266 -13.654 -1.959 561 HD13 LEU 72 3HD1 LEU 72 -4.501 -14.882 -1.685 562 HD21 LEU 72 3HD2 LEU 72 -5.473 -14.064 -5.049 563 HD22 LEU 72 1HD2 LEU 72 -5.774 -15.249 -3.778 564 HD23 LEU 72 2HD2 LEU 72 -4.119 -14.866 -4.252 565 H GLY 73 H GLY 73 -4.706 -9.822 -2.761 566 HA2 GLY 73 1HA GLY 73 -3.608 -9.409 -4.923 567 HA3 GLY 73 2HA GLY 73 -5.203 -9.439 -5.651 568 H ASP 74 H ASP 74 -6.408 -7.750 -3.549 569 HA ASP 74 HA ASP 74 -5.727 -5.241 -4.737 570 HB2 ASP 74 1HB ASP 74 -7.391 -4.351 -2.975 571 HB3 ASP 74 2HB ASP 74 -7.996 -5.404 -4.249 572 H VAL 75 H VAL 75 -5.122 -3.318 -3.622 573 HA VAL 75 HA VAL 75 -3.274 -3.841 -1.367 574 HB VAL 75 HB VAL 75 -3.108 -1.531 -3.335 575 HG11 VAL 75 1HG1 VAL 75 -0.907 -2.618 -1.598 576 HG12 VAL 75 2HG1 VAL 75 -2.000 -1.342 -1.057 577 HG13 VAL 75 3HG1 VAL 75 -0.975 -1.087 -2.468 578 HG21 VAL 75 3HG2 VAL 75 -2.603 -4.229 -3.885 579 HG22 VAL 75 1HG2 VAL 75 -1.020 -3.487 -3.648 580 HG23 VAL 75 2HG2 VAL 75 -2.131 -2.829 -4.847 581 H ALA 76 H ALA 76 -3.170 -2.175 0.366 582 HA ALA 76 HA ALA 76 -5.172 -0.079 0.270 583 HB1 ALA 76 3HB ALA 76 -5.335 -2.374 2.201 584 HB2 ALA 76 1HB ALA 76 -6.579 -1.767 1.110 585 HB3 ALA 76 2HB ALA 76 -6.098 -0.819 2.519 586 H TYR 77 H TYR 77 -4.883 1.567 1.798 587 HA TYR 77 HA TYR 77 -2.240 1.532 3.075 588 HD1 TYR 77 HD1 TYR 77 -1.280 4.106 4.334 589 HD2 TYR 77 HD2 TYR 77 -5.018 5.244 2.657 590 HE1 TYR 77 HE1 TYR 77 -1.431 5.947 5.940 591 HE2 TYR 77 HE2 TYR 77 -5.181 7.093 4.273 592 HH TYR 77 HH TYR 77 -3.768 8.442 5.676 593 HB2 TYR 77 1HB TYR 77 -2.062 3.466 1.924 594 HB3 TYR 77 2HB TYR 77 -3.795 3.553 1.637 595 H TRP 78 H TRP 78 -2.014 1.863 5.244 596 HA TRP 78 HA TRP 78 -4.368 1.520 6.870 597 HD1 TRP 78 HD1 TRP 78 -4.715 2.057 9.366 598 HE1 TRP 78 HE1 TRP 78 -5.172 0.395 11.275 599 HE3 TRP 78 HE3 TRP 78 -0.844 -1.180 8.556 600 HZ2 TRP 78 HZ2 TRP 78 -4.038 -1.979 12.303 601 HZ3 TRP 78 HZ3 TRP 78 -0.600 -3.122 10.049 602 HH2 TRP 78 HH2 TRP 78 -2.164 -3.511 11.883 603 HB2 TRP 78 1HB TRP 78 -1.860 0.670 7.201 604 HB3 TRP 78 2HB TRP 78 -1.738 2.176 8.106 605 H ILE 79 H ILE 79 -5.671 3.235 7.211 606 HA ILE 79 HA ILE 79 -4.829 5.923 7.073 607 HB ILE 79 HB ILE 79 -7.338 4.573 7.980 608 HG12 ILE 79 1HG1 ILE 79 -6.344 6.068 5.677 609 HG13 ILE 79 2HG1 ILE 79 -7.673 4.923 5.786 610 HG21 ILE 79 1HG2 ILE 79 -7.086 6.307 9.646 611 HG22 ILE 79 2HG2 ILE 79 -8.353 6.757 8.507 612 HG23 ILE 79 3HG2 ILE 79 -6.760 7.503 8.392 613 HD11 ILE 79 3HD1 ILE 79 -9.006 6.837 6.814 614 HD12 ILE 79 1HD1 ILE 79 -8.650 6.923 5.089 615 HD13 ILE 79 2HD1 ILE 79 -7.711 7.883 6.233 616 HA PRO 80 HA PRO 80 -5.069 6.089 11.915 617 HB2 PRO 80 1HB PRO 80 -5.160 3.636 13.164 618 HB3 PRO 80 2HB PRO 80 -6.574 4.649 12.856 619 HG2 PRO 80 1HG PRO 80 -5.549 2.304 11.312 620 HG3 PRO 80 2HG PRO 80 -7.220 2.734 11.720 621 HD2 PRO 80 1HD PRO 80 -6.212 3.189 9.275 622 HD3 PRO 80 2HD PRO 80 -7.358 4.314 10.031 623 H GLY 81 H GLY 81 -2.903 6.488 10.935 624 HA2 GLY 81 1HA GLY 81 -0.762 5.955 12.321 625 HA3 GLY 81 2HA GLY 81 -0.913 4.402 11.510 626 H LYS 82 H LYS 82 -2.098 6.336 9.228 627 HA LYS 82 HA LYS 82 -1.276 7.129 7.233 628 HB2 LYS 82 1HB LYS 82 1.178 8.190 8.533 629 HB3 LYS 82 2HB LYS 82 0.092 8.955 7.385 630 HG2 LYS 82 1HG LYS 82 -0.709 10.134 9.083 631 HG3 LYS 82 2HG LYS 82 -1.446 8.647 9.685 632 HD2 LYS 82 1HD LYS 82 0.556 8.161 10.982 633 HD3 LYS 82 2HD LYS 82 1.326 9.623 10.364 634 HE2 LYS 82 1HE LYS 82 -1.306 10.058 11.583 635 HE3 LYS 82 2HE LYS 82 -0.078 9.455 12.697 636 HZ1 LYS 82 3HZ LYS 82 0.344 11.658 12.853 637 HZ2 LYS 82 1HZ LYS 82 -0.225 12.012 11.300 638 HZ3 LYS 82 2HZ LYS 82 1.315 11.343 11.504 639 H ALA 83 H ALA 83 -0.508 4.461 8.005 640 HA ALA 83 HA ALA 83 2.116 4.241 6.676 641 HB1 ALA 83 3HB ALA 83 2.718 3.094 8.485 642 HB2 ALA 83 1HB ALA 83 1.628 1.815 7.947 643 HB3 ALA 83 2HB ALA 83 1.060 3.039 9.081 644 H ILE 84 H ILE 84 2.307 3.032 4.858 645 HA ILE 84 HA ILE 84 -0.119 1.944 3.665 646 HB ILE 84 HB ILE 84 2.611 1.823 2.415 647 HG12 ILE 84 1HG1 ILE 84 0.722 4.187 2.360 648 HG13 ILE 84 2HG1 ILE 84 2.301 4.145 3.140 649 HG21 ILE 84 1HG2 ILE 84 1.396 1.844 0.342 650 HG22 ILE 84 2HG2 ILE 84 -0.121 2.138 1.188 651 HG23 ILE 84 3HG2 ILE 84 0.718 0.600 1.392 652 HD11 ILE 84 3HD1 ILE 84 3.258 4.788 1.254 653 HD12 ILE 84 1HD1 ILE 84 1.670 4.870 0.491 654 HD13 ILE 84 2HD1 ILE 84 2.607 3.378 0.416 655 H CYS 85 H CYS 85 -0.313 -0.260 2.950 656 HA CYS 85 HA CYS 85 1.728 -2.106 3.911 657 HG CYS 85 HG CYS 85 0.704 -4.599 4.823 658 HB2 CYS 85 1HB CYS 85 0.287 -2.007 5.802 659 HB3 CYS 85 2HB CYS 85 -1.151 -2.147 4.795 660 H LEU 86 H LEU 86 1.586 -4.250 3.108 661 HA LEU 86 HA LEU 86 0.106 -4.475 0.558 662 HG LEU 86 HG LEU 86 1.486 -4.219 -1.102 663 HB2 LEU 86 1HB LEU 86 2.876 -4.824 1.173 664 HB3 LEU 86 2HB LEU 86 2.226 -6.395 0.740 665 HD11 LEU 86 1HD1 LEU 86 3.562 -3.818 -2.044 666 HD12 LEU 86 2HD1 LEU 86 4.298 -5.225 -1.275 667 HD13 LEU 86 3HD1 LEU 86 3.920 -3.793 -0.316 668 HD21 LEU 86 3HD2 LEU 86 2.465 -7.056 -1.294 669 HD22 LEU 86 1HD2 LEU 86 2.325 -6.016 -2.714 670 HD23 LEU 86 2HD2 LEU 86 0.893 -6.393 -1.753 671 H PHE 87 H PHE 87 -0.634 -6.670 -0.004 672 HA PHE 87 HA PHE 87 -0.881 -8.479 2.293 673 HD1 PHE 87 HD2 PHE 87 -2.561 -7.149 4.075 674 HD2 PHE 87 HD1 PHE 87 -3.751 -5.758 0.238 675 HE1 PHE 87 HE2 PHE 87 -3.107 -4.956 5.047 676 HE2 PHE 87 HE1 PHE 87 -4.303 -3.572 1.200 677 HZ PHE 87 HZ PHE 87 -3.982 -3.160 3.605 678 HB2 PHE 87 1HB PHE 87 -3.258 -7.994 0.528 679 HB3 PHE 87 2HB PHE 87 -3.201 -8.698 2.140 680 H PHE 88 H PHE 88 -0.803 -10.608 1.824 681 HA PHE 88 HA PHE 88 -1.445 -11.787 -0.629 682 HD1 PHE 88 HD2 PHE 88 -0.396 -9.878 -2.725 683 HD2 PHE 88 HD1 PHE 88 1.219 -13.768 -2.155 684 HE1 PHE 88 HE2 PHE 88 -0.778 -10.377 -5.106 685 HE2 PHE 88 HE1 PHE 88 0.843 -14.281 -4.535 686 HZ PHE 88 HZ PHE 88 -0.158 -12.583 -6.013 687 HB2 PHE 88 1HB PHE 88 0.985 -10.451 -0.761 688 HB3 PHE 88 2HB PHE 88 1.445 -12.126 -0.473 689 H GLY 89 H GLY 89 -2.038 -12.398 1.984 690 HA2 GLY 89 1HA GLY 89 -1.627 -15.115 2.145 691 HA3 GLY 89 2HA GLY 89 -0.292 -14.413 3.046 692 H LYS 90 H LYS 90 -0.714 -13.344 5.012 693 HA LYS 90 HA LYS 90 -3.457 -13.541 6.028 694 HB2 LYS 90 1HB LYS 90 -2.823 -14.567 8.022 695 HB3 LYS 90 2HB LYS 90 -1.973 -15.467 6.790 696 HG2 LYS 90 1HG LYS 90 -0.060 -15.091 7.851 697 HG3 LYS 90 2HG LYS 90 -0.282 -13.353 7.644 698 HD2 LYS 90 1HD LYS 90 -1.991 -13.810 9.665 699 HD3 LYS 90 2HD LYS 90 -0.801 -15.072 9.986 700 HE2 LYS 90 1HE LYS 90 0.604 -12.686 9.372 701 HE3 LYS 90 2HE LYS 90 -0.644 -12.286 10.549 702 HZ1 LYS 90 3HZ LYS 90 1.414 -14.410 10.831 703 HZ2 LYS 90 1HZ LYS 90 0.186 -14.093 11.951 704 HZ3 LYS 90 2HZ LYS 90 1.383 -12.934 11.656 705 H THR 91 H THR 91 -3.073 -12.677 8.550 706 HA THR 91 HA THR 91 -1.514 -10.293 8.718 707 HB THR 91 HB THR 91 -4.226 -9.414 9.127 708 HG1 THR 91 HG1 THR 91 -5.026 -10.648 7.570 709 HG21 THR 91 3HG2 THR 91 -3.346 -7.523 8.404 710 HG22 THR 91 1HG2 THR 91 -3.037 -8.232 6.821 711 HG23 THR 91 2HG2 THR 91 -1.833 -8.376 8.100 712 HA PRO 92 HA PRO 92 -2.115 -10.453 13.125 713 HB2 PRO 92 1HB PRO 92 -4.448 -8.575 13.057 714 HB3 PRO 92 2HB PRO 92 -3.055 -8.594 14.145 715 HG2 PRO 92 1HG PRO 92 -3.149 -6.858 12.145 716 HG3 PRO 92 2HG PRO 92 -1.629 -7.678 12.548 717 HD2 PRO 92 1HD PRO 92 -3.490 -8.143 10.274 718 HD3 PRO 92 2HD PRO 92 -1.724 -8.311 10.337 719 H ILE 93 H ILE 93 -4.966 -10.810 11.119 720 HA ILE 93 HA ILE 93 -5.887 -12.934 12.909 721 HB ILE 93 HB ILE 93 -7.866 -10.984 11.758 722 HG12 ILE 93 1HG1 ILE 93 -7.924 -10.404 14.392 723 HG13 ILE 93 2HG1 ILE 93 -6.212 -10.767 14.212 724 HG21 ILE 93 1HG2 ILE 93 -8.641 -13.245 12.376 725 HG22 ILE 93 2HG2 ILE 93 -9.390 -11.975 13.344 726 HG23 ILE 93 3HG2 ILE 93 -8.091 -12.955 14.027 727 HD11 ILE 93 3HD1 ILE 93 -6.259 -9.127 12.254 728 HD12 ILE 93 1HD1 ILE 93 -6.364 -8.469 13.887 729 HD13 ILE 93 2HD1 ILE 93 -7.818 -8.612 12.898 730 H SER 94 H SER 94 -4.842 -14.129 11.038 731 HA SER 94 HA SER 94 -5.966 -14.100 8.454 732 HG SER 94 HG SER 94 -3.207 -16.167 10.264 733 HB2 SER 94 1HB SER 94 -4.963 -16.713 9.244 734 HB3 SER 94 2HB SER 94 -4.355 -15.595 8.025 735 H ASP 95 H ASP 95 -7.231 -15.227 11.389 736 HA ASP 95 HA ASP 95 -8.560 -17.459 11.261 737 HB2 ASP 95 1HB ASP 95 -8.989 -15.197 12.655 738 HB3 ASP 95 2HB ASP 95 -10.451 -15.222 11.675 739 H ASP 96 H ASP 96 -8.909 -18.371 9.270 740 HA ASP 96 HA ASP 96 -9.868 -18.767 7.227 741 HB2 ASP 96 1HB ASP 96 -11.681 -18.979 9.264 742 HB3 ASP 96 2HB ASP 96 -12.526 -17.914 8.144 743 H LYS 97 H LYS 97 -8.889 -16.039 7.479 744 HA LYS 97 HA LYS 97 -9.817 -14.939 5.120 745 HB2 LYS 97 1HB LYS 97 -11.569 -14.403 7.366 746 HB3 LYS 97 2HB LYS 97 -10.903 -12.905 6.732 747 HG2 LYS 97 1HG LYS 97 -12.307 -14.970 5.046 748 HG3 LYS 97 2HG LYS 97 -13.092 -13.561 5.757 749 HD2 LYS 97 1HD LYS 97 -12.593 -12.689 3.717 750 HD3 LYS 97 2HD LYS 97 -11.087 -12.304 4.551 751 HE2 LYS 97 1HE LYS 97 -9.895 -13.699 3.267 752 HE3 LYS 97 2HE LYS 97 -11.109 -14.975 3.374 753 HZ1 LYS 97 3HZ LYS 97 -11.685 -12.636 1.703 754 HZ2 LYS 97 1HZ LYS 97 -12.176 -14.244 1.514 755 HZ3 LYS 97 2HZ LYS 97 -10.597 -13.790 1.117 756 H ILE 98 H ILE 98 -9.047 -12.695 4.772 757 HA ILE 98 HA ILE 98 -6.620 -12.233 6.360 758 HB ILE 98 HB ILE 98 -7.386 -11.303 3.588 759 HG12 ILE 98 1HG1 ILE 98 -5.011 -12.953 4.470 760 HG13 ILE 98 2HG1 ILE 98 -6.537 -13.666 3.945 761 HG21 ILE 98 1HG2 ILE 98 -6.216 -9.485 4.667 762 HG22 ILE 98 2HG2 ILE 98 -5.157 -10.252 3.482 763 HG23 ILE 98 3HG2 ILE 98 -4.943 -10.582 5.201 764 HD11 ILE 98 3HD1 ILE 98 -4.356 -12.844 2.369 765 HD12 ILE 98 1HD1 ILE 98 -5.697 -11.757 2.004 766 HD13 ILE 98 2HD1 ILE 98 -5.902 -13.502 1.836 767 H ARG 99 H ARG 99 -7.131 -10.939 8.040 768 HA ARG 99 HA ARG 99 -8.797 -8.574 7.536 769 HE ARG 99 HE ARG 99 -10.967 -7.293 10.005 770 HB2 ARG 99 1HB ARG 99 -7.819 -9.795 10.126 771 HB3 ARG 99 2HB ARG 99 -8.807 -8.346 10.017 772 HG2 ARG 99 1HG ARG 99 -9.777 -10.850 8.733 773 HG3 ARG 99 2HG ARG 99 -9.889 -10.679 10.486 774 HD2 ARG 99 1HD ARG 99 -11.098 -8.890 8.385 775 HD3 ARG 99 2HD ARG 99 -11.949 -9.927 9.530 776 HH11 ARG 99 1HH1 ARG 99 -11.587 -10.367 11.538 777 HH12 ARG 99 2HH1 ARG 99 -11.789 -9.681 13.116 778 HH21 ARG 99 1HH2 ARG 99 -11.233 -6.389 12.079 779 HH22 ARG 99 2HH2 ARG 99 -11.588 -7.423 13.423 780 HA PRO 100 HA PRO 100 -4.684 -6.635 7.248 781 HB2 PRO 100 1HB PRO 100 -5.552 -4.375 6.017 782 HB3 PRO 100 2HB PRO 100 -5.262 -5.891 5.154 783 HG2 PRO 100 1HG PRO 100 -7.850 -4.763 6.162 784 HG3 PRO 100 2HG PRO 100 -7.489 -5.494 4.585 785 HD2 PRO 100 1HD PRO 100 -8.716 -6.870 6.547 786 HD3 PRO 100 2HD PRO 100 -7.582 -7.645 5.422 787 H ALA 101 H ALA 101 -7.692 -5.255 8.464 788 HA ALA 101 HA ALA 101 -6.624 -4.351 10.885 789 HB1 ALA 101 3HB ALA 101 -5.798 -2.696 8.777 790 HB2 ALA 101 1HB ALA 101 -5.658 -2.387 10.507 791 HB3 ALA 101 2HB ALA 101 -7.064 -1.804 9.618 792 H SER 102 H SER 102 -8.121 -1.979 11.260 793 HA SER 102 HA SER 102 -10.855 -3.020 10.939 794 HG SER 102 HG SER 102 -9.446 -3.411 13.821 795 HB2 SER 102 1HB SER 102 -10.523 -0.998 13.022 796 HB3 SER 102 2HB SER 102 -11.265 -2.595 13.109 797 H ALA 103 H ALA 103 -8.857 -0.703 9.693 798 HA ALA 103 HA ALA 103 -11.008 0.738 8.534 799 HB1 ALA 103 3HB ALA 103 -10.407 2.967 9.561 800 HB2 ALA 103 1HB ALA 103 -9.526 2.059 10.789 801 HB3 ALA 103 2HB ALA 103 -11.267 1.835 10.603 802 H VAL 104 H VAL 104 -9.384 -0.241 6.901 803 HA VAL 104 HA VAL 104 -7.401 1.854 6.286 804 HB VAL 104 HB VAL 104 -5.915 0.240 5.261 805 HG11 VAL 104 1HG1 VAL 104 -6.661 -0.906 7.930 806 HG12 VAL 104 2HG1 VAL 104 -5.920 0.685 7.768 807 HG13 VAL 104 3HG1 VAL 104 -5.063 -0.749 7.204 808 HG21 VAL 104 3HG2 VAL 104 -7.527 -2.067 6.246 809 HG22 VAL 104 1HG2 VAL 104 -6.336 -1.995 4.950 810 HG23 VAL 104 2HG2 VAL 104 -7.947 -1.325 4.702 811 H ASN 105 H ASN 105 -7.203 2.611 4.259 812 HA ASN 105 HA ASN 105 -9.496 2.301 2.548 813 HB2 ASN 105 1HB ASN 105 -7.033 3.916 1.915 814 HB3 ASN 105 2HB ASN 105 -8.687 4.203 1.395 815 HD21 ASN 105 1HD2 ASN 105 -9.790 3.695 4.038 816 HD22 ASN 105 2HD2 ASN 105 -9.418 5.088 4.985 817 H VAL 106 H VAL 106 -9.473 1.777 0.331 818 HA VAL 106 HA VAL 106 -7.461 -0.202 -0.411 819 HB VAL 106 HB VAL 106 -9.208 0.091 -2.577 820 HG11 VAL 106 1HG1 VAL 106 -9.395 -2.122 -2.344 821 HG12 VAL 106 2HG1 VAL 106 -9.920 -2.004 -0.664 822 HG13 VAL 106 3HG1 VAL 106 -8.201 -1.918 -1.061 823 HG21 VAL 106 3HG2 VAL 106 -11.442 -0.279 -1.482 824 HG22 VAL 106 1HG2 VAL 106 -10.814 1.368 -1.395 825 HG23 VAL 106 2HG2 VAL 106 -10.719 0.310 0.013 826 H ILE 107 H ILE 107 -5.666 0.918 -0.977 827 HA ILE 107 HA ILE 107 -5.798 3.286 -2.594 828 HB ILE 107 HB ILE 107 -4.150 2.862 -0.730 829 HG12 ILE 107 1HG1 ILE 107 -3.578 3.958 -3.425 830 HG13 ILE 107 2HG1 ILE 107 -3.562 4.759 -1.861 831 HG21 ILE 107 1HG2 ILE 107 -2.770 1.212 -2.843 832 HG22 ILE 107 2HG2 ILE 107 -3.529 0.580 -1.381 833 HG23 ILE 107 3HG2 ILE 107 -2.121 1.633 -1.259 834 HD11 ILE 107 3HD1 ILE 107 -1.403 3.727 -1.371 835 HD12 ILE 107 1HD1 ILE 107 -1.352 4.705 -2.839 836 HD13 ILE 107 2HD1 ILE 107 -1.431 2.946 -2.953 837 H GLY 108 H GLY 108 -6.616 0.580 -3.732 838 HA2 GLY 108 1HA GLY 108 -6.611 0.347 -6.159 839 HA3 GLY 108 2HA GLY 108 -4.908 0.765 -6.131 840 H ARG 109 H ARG 109 -4.149 -1.047 -7.149 841 HA ARG 109 HA ARG 109 -3.953 -3.413 -5.512 842 HE ARG 109 HE ARG 109 -8.793 -4.522 -5.820 843 HB2 ARG 109 1HB ARG 109 -5.081 -3.766 -8.284 844 HB3 ARG 109 2HB ARG 109 -4.940 -4.968 -7.010 845 HG2 ARG 109 1HG ARG 109 -6.666 -3.826 -5.724 846 HG3 ARG 109 2HG ARG 109 -6.793 -2.592 -6.977 847 HD2 ARG 109 1HD ARG 109 -8.034 -3.896 -8.308 848 HD3 ARG 109 2HD ARG 109 -7.053 -5.325 -7.981 849 HH11 ARG 109 1HH1 ARG 109 -8.458 -6.478 -8.693 850 HH12 ARG 109 2HH1 ARG 109 -9.703 -7.588 -8.231 851 HH21 ARG 109 1HH2 ARG 109 -10.431 -5.981 -5.214 852 HH22 ARG 109 2HH2 ARG 109 -10.824 -7.306 -6.258 853 H ILE 110 H ILE 110 -2.604 -5.112 -6.612 854 HA ILE 110 HA ILE 110 -0.340 -3.807 -7.914 855 HB ILE 110 HB ILE 110 -0.615 -6.643 -6.886 856 HG12 ILE 110 1HG1 ILE 110 1.208 -5.199 -5.308 857 HG13 ILE 110 2HG1 ILE 110 -0.165 -4.121 -5.522 858 HG21 ILE 110 1HG2 ILE 110 1.834 -5.094 -7.724 859 HG22 ILE 110 2HG2 ILE 110 1.096 -6.429 -8.608 860 HG23 ILE 110 3HG2 ILE 110 1.826 -6.714 -7.029 861 HD11 ILE 110 3HD1 ILE 110 -0.440 -5.395 -3.510 862 HD12 ILE 110 1HD1 ILE 110 -0.221 -6.909 -4.386 863 HD13 ILE 110 2HD1 ILE 110 -1.648 -5.912 -4.684 864 H VAL 111 H VAL 111 -0.267 -3.784 -10.084 865 HA VAL 111 HA VAL 111 -1.845 -5.706 -11.592 866 HB VAL 111 HB VAL 111 -0.675 -4.280 -13.557 867 HG11 VAL 111 1HG1 VAL 111 -3.198 -4.314 -12.212 868 HG12 VAL 111 2HG1 VAL 111 -2.838 -3.959 -13.901 869 HG13 VAL 111 3HG1 VAL 111 -2.817 -2.662 -12.705 870 HG21 VAL 111 3HG2 VAL 111 -0.222 -2.069 -13.016 871 HG22 VAL 111 1HG2 VAL 111 0.520 -2.958 -11.687 872 HG23 VAL 111 2HG2 VAL 111 -1.043 -2.175 -11.459 873 H ASN 112 H ASN 112 1.276 -4.462 -12.703 874 HA ASN 112 HA ASN 112 2.198 -7.253 -12.909 875 HB2 ASN 112 1HB ASN 112 3.490 -6.468 -14.929 876 HB3 ASN 112 2HB ASN 112 1.739 -6.482 -15.122 877 HD21 ASN 112 1HD2 ASN 112 4.587 -4.559 -14.978 878 HD22 ASN 112 2HD2 ASN 112 3.852 -3.049 -15.383 879 H SER 113 H SER 113 4.013 -7.732 -11.893 880 HA SER 113 HA SER 113 6.346 -6.240 -11.821 881 HG SER 113 HG SER 113 6.385 -3.986 -9.312 882 HB2 SER 113 1HB SER 113 4.558 -4.959 -10.220 883 HB3 SER 113 2HB SER 113 5.317 -6.046 -9.059 884 H MET 114 H MET 114 4.586 -7.930 -9.228 885 HA MET 114 HA MET 114 5.955 -10.388 -9.594 886 HB2 MET 114 1HB MET 114 7.583 -8.599 -8.411 887 HB3 MET 114 2HB MET 114 6.756 -9.220 -6.989 888 HG2 MET 114 1HG MET 114 7.356 -11.542 -8.057 889 HG3 MET 114 2HG MET 114 8.603 -10.595 -8.866 890 HE1 MET 114 3HE MET 114 10.549 -10.630 -8.306 891 HE2 MET 114 1HE MET 114 11.238 -11.397 -6.876 892 HE3 MET 114 2HE MET 114 11.055 -9.644 -6.934 893 H GLU 115 H GLU 115 4.308 -8.265 -7.291 894 HA GLU 115 HA GLU 115 2.621 -8.625 -5.808 895 HB2 GLU 115 1HB GLU 115 2.086 -10.618 -7.966 896 HB3 GLU 115 2HB GLU 115 1.139 -10.709 -6.488 897 HG2 GLU 115 1HG GLU 115 0.553 -8.298 -6.823 898 HG3 GLU 115 2HG GLU 115 1.325 -8.402 -8.405 899 H GLY 116 H GLY 116 5.179 -9.771 -5.199 900 HA2 GLY 116 1HA GLY 116 4.263 -11.884 -3.374 901 HA3 GLY 116 2HA GLY 116 5.667 -12.182 -4.384 902 H LEU 117 H LEU 117 5.029 -9.019 -3.036 903 HA LEU 117 HA LEU 117 7.550 -8.677 -1.961 904 HG LEU 117 HG LEU 117 7.276 -7.248 0.352 905 HB2 LEU 117 1HB LEU 117 6.066 -6.799 -2.276 906 HB3 LEU 117 2HB LEU 117 4.942 -7.435 -1.090 907 HD11 LEU 117 1HD1 LEU 117 8.349 -6.015 -1.489 908 HD12 LEU 117 2HD1 LEU 117 8.202 -5.058 -0.017 909 HD13 LEU 117 3HD1 LEU 117 7.096 -4.779 -1.360 910 HD21 LEU 117 3HD2 LEU 117 5.520 -4.873 0.362 911 HD22 LEU 117 1HD2 LEU 117 6.072 -5.889 1.693 912 HD23 LEU 117 2HD2 LEU 117 4.754 -6.434 0.658 913 H LYS 118 H LYS 118 4.718 -10.167 -0.524 914 HA LYS 118 HA LYS 118 5.233 -10.233 2.132 915 HB2 LYS 118 1HB LYS 118 4.291 -12.596 2.129 916 HB3 LYS 118 2HB LYS 118 3.291 -11.345 1.410 917 HG2 LYS 118 1HG LYS 118 3.082 -13.051 -0.108 918 HG3 LYS 118 2HG LYS 118 4.395 -12.114 -0.819 919 HD2 LYS 118 1HD LYS 118 5.478 -14.081 -0.894 920 HD3 LYS 118 2HD LYS 118 5.751 -13.817 0.828 921 HE2 LYS 118 1HE LYS 118 4.846 -16.074 0.249 922 HE3 LYS 118 2HE LYS 118 3.879 -15.169 1.413 923 HZ1 LYS 118 3HZ LYS 118 2.191 -14.891 -0.063 924 HZ2 LYS 118 1HZ LYS 118 2.792 -16.365 -0.637 925 HZ3 LYS 118 2HZ LYS 118 3.198 -14.922 -1.421 926 H GLY 119 H GLY 119 7.147 -11.826 -0.312 927 HA2 GLY 119 1HA GLY 119 8.548 -13.480 1.619 928 HA3 GLY 119 2HA GLY 119 8.867 -13.391 -0.106 929 H VAL 120 H VAL 120 8.706 -10.563 1.961 930 HA VAL 120 HA VAL 120 11.362 -9.780 1.169 931 HB VAL 120 HB VAL 120 10.912 -7.828 2.766 932 HG11 VAL 120 1HG1 VAL 120 10.697 -7.176 0.605 933 HG12 VAL 120 2HG1 VAL 120 9.020 -6.996 1.110 934 HG13 VAL 120 3HG1 VAL 120 9.525 -8.432 0.220 935 HG21 VAL 120 3HG2 VAL 120 8.076 -7.996 2.666 936 HG22 VAL 120 1HG2 VAL 120 9.127 -7.874 4.076 937 HG23 VAL 120 2HG2 VAL 120 8.692 -9.457 3.435 938 H ALA 121 H ALA 121 13.103 -9.270 2.650 939 HA ALA 121 HA ALA 121 13.347 -11.213 4.769 940 HB1 ALA 121 3HB ALA 121 15.213 -10.545 3.193 941 HB2 ALA 121 1HB ALA 121 15.625 -10.570 4.907 942 HB3 ALA 121 2HB ALA 121 15.316 -9.035 4.096 943 H ASP 122 H ASP 122 13.587 -10.754 6.996 944 HA ASP 122 HA ASP 122 11.953 -8.786 8.050 945 HB2 ASP 122 1HB ASP 122 12.836 -9.328 10.209 946 HB3 ASP 122 2HB ASP 122 12.721 -10.812 9.266 947 H GLY 123 H GLY 123 12.138 -6.675 7.879 948 HA2 GLY 123 1HA GLY 123 13.004 -4.562 8.109 949 HA3 GLY 123 2HA GLY 123 14.363 -5.281 8.955 950 H GLU 124 H GLU 124 13.231 -3.925 6.023 951 HA GLU 124 HA GLU 124 15.938 -3.859 5.010 952 HB2 GLU 124 1HB GLU 124 15.150 -4.633 2.705 953 HB3 GLU 124 2HB GLU 124 15.399 -5.866 3.929 954 HG2 GLU 124 1HG GLU 124 13.092 -6.184 4.227 955 HG3 GLU 124 2HG GLU 124 12.692 -4.705 3.352 956 H SER 125 H SER 125 16.313 -2.240 3.475 957 HA SER 125 HA SER 125 15.018 0.149 3.798 958 HG SER 125 HG SER 125 16.427 1.090 0.553 959 HB2 SER 125 1HB SER 125 17.164 0.085 2.736 960 HB3 SER 125 2HB SER 125 16.538 -0.868 1.391 961 H VAL 126 H VAL 126 13.829 1.466 2.242 962 HA VAL 126 HA VAL 126 12.129 0.184 0.304 963 HB VAL 126 HB VAL 126 10.816 1.435 2.725 964 HG11 VAL 126 1HG1 VAL 126 9.498 1.813 0.774 965 HG12 VAL 126 2HG1 VAL 126 8.746 0.513 1.696 966 HG13 VAL 126 3HG1 VAL 126 9.690 0.138 0.256 967 HG21 VAL 126 3HG2 VAL 126 11.102 -1.451 1.935 968 HG22 VAL 126 1HG2 VAL 126 9.939 -0.864 3.124 969 HG23 VAL 126 2HG2 VAL 126 11.668 -0.672 3.414 970 H VAL 127 H VAL 127 11.751 1.616 -1.309 971 HA VAL 127 HA VAL 127 11.892 4.484 -0.645 972 HB VAL 127 HB VAL 127 12.950 4.887 -2.854 973 HG11 VAL 127 1HG1 VAL 127 14.919 3.073 -1.718 974 HG12 VAL 127 2HG1 VAL 127 14.130 4.075 -0.500 975 HG13 VAL 127 3HG1 VAL 127 14.949 4.830 -1.867 976 HG21 VAL 127 3HG2 VAL 127 12.809 3.257 -4.363 977 HG22 VAL 127 1HG2 VAL 127 12.447 2.043 -3.135 978 HG23 VAL 127 2HG2 VAL 127 14.122 2.466 -3.490 979 H VAL 128 H VAL 128 9.891 5.238 -0.869 980 HA VAL 128 HA VAL 128 8.053 4.144 -2.816 981 HB VAL 128 HB VAL 128 7.281 6.656 -1.492 982 HG11 VAL 128 1HG1 VAL 128 6.084 3.996 -2.080 983 HG12 VAL 128 2HG1 VAL 128 5.469 5.614 -2.420 984 HG13 VAL 128 3HG1 VAL 128 5.384 4.964 -0.785 985 HG21 VAL 128 3HG2 VAL 128 6.836 5.198 0.662 986 HG22 VAL 128 1HG2 VAL 128 8.352 6.070 0.443 987 HG23 VAL 128 2HG2 VAL 128 8.271 4.344 0.097 988 H GLU 129 H GLU 129 7.693 4.981 -4.847 989 HA GLU 129 HA GLU 129 8.204 7.774 -5.394 990 HB2 GLU 129 1HB GLU 129 9.687 7.183 -7.358 991 HB3 GLU 129 2HB GLU 129 10.412 6.986 -5.767 992 HG2 GLU 129 1HG GLU 129 9.351 4.514 -6.216 993 HG3 GLU 129 2HG GLU 129 9.841 5.007 -7.836 994 H ARG 130 H ARG 130 6.771 8.535 -6.843 995 HA ARG 130 HA ARG 130 4.857 6.753 -8.021 996 HE ARG 130 HE ARG 130 2.933 11.623 -10.601 997 HB2 ARG 130 1HB ARG 130 4.137 8.919 -7.200 998 HB3 ARG 130 2HB ARG 130 5.259 9.738 -8.276 999 HG2 ARG 130 1HG ARG 130 3.312 7.956 -9.581 1000 HG3 ARG 130 2HG ARG 130 2.648 9.390 -8.796 1001 HD2 ARG 130 1HD ARG 130 4.814 10.409 -10.117 1002 HD3 ARG 130 2HD ARG 130 4.264 9.152 -11.224 1003 HH11 ARG 130 1HH1 ARG 130 2.516 8.361 -11.771 1004 HH12 ARG 130 2HH1 ARG 130 1.060 8.724 -12.636 1005 HH21 ARG 130 1HH2 ARG 130 1.020 12.102 -11.740 1006 HH22 ARG 130 2HH2 ARG 130 0.212 10.847 -12.619 1007 H ALA 131 H ALA 131 6.010 5.464 -9.463 1008 HA ALA 131 HA ALA 131 7.141 4.884 -11.376 1009 HB1 ALA 131 3HB ALA 131 6.151 5.890 -13.415 1010 HB2 ALA 131 1HB ALA 131 5.275 7.021 -12.380 1011 HB3 ALA 131 2HB ALA 131 4.959 5.291 -12.263 Start of MODEL 4 1 H MET 1 H MET 1 -13.364 2.282 -16.361 2 HA MET 1 HA MET 1 -14.580 2.815 -13.751 3 HB2 MET 1 1HB MET 1 -11.857 3.271 -14.987 4 HB3 MET 1 2HB MET 1 -12.308 3.748 -13.356 5 HG2 MET 1 1HG MET 1 -12.848 1.302 -12.953 6 HG3 MET 1 2HG MET 1 -12.006 0.981 -14.468 7 HE1 MET 1 3HE MET 1 -10.859 1.062 -10.482 8 HE2 MET 1 1HE MET 1 -12.112 2.157 -11.066 9 HE3 MET 1 2HE MET 1 -10.518 2.784 -10.650 10 H GLY 2 H GLY 2 -12.709 4.635 -16.183 11 HA2 GLY 2 1HA GLY 2 -14.269 6.467 -17.211 12 HA3 GLY 2 2HA GLY 2 -14.312 7.004 -15.538 13 H GLU 3 H GLU 3 -11.489 6.150 -15.135 14 HA GLU 3 HA GLU 3 -9.416 7.078 -15.190 15 HB2 GLU 3 1HB GLU 3 -10.076 8.090 -17.953 16 HB3 GLU 3 2HB GLU 3 -8.498 7.665 -17.302 17 HG2 GLU 3 1HG GLU 3 -8.942 5.370 -17.421 18 HG3 GLU 3 2HG GLU 3 -10.674 5.629 -17.616 19 H ARG 4 H ARG 4 -8.514 9.475 -16.482 20 HA ARG 4 HA ARG 4 -8.382 11.713 -16.105 21 HE ARG 4 HE ARG 4 -11.360 14.012 -17.577 22 HB2 ARG 4 1HB ARG 4 -11.358 11.690 -15.637 23 HB3 ARG 4 2HB ARG 4 -10.370 13.000 -16.260 24 HG2 ARG 4 1HG ARG 4 -10.264 10.570 -17.889 25 HG3 ARG 4 2HG ARG 4 -11.876 11.264 -17.758 26 HD2 ARG 4 1HD ARG 4 -9.403 12.408 -18.990 27 HD3 ARG 4 2HD ARG 4 -11.045 12.334 -19.625 28 HH11 ARG 4 1HH1 ARG 4 -8.949 13.919 -20.102 29 HH12 ARG 4 2HH1 ARG 4 -8.699 15.632 -20.094 30 HH21 ARG 4 1HH2 ARG 4 -11.030 16.263 -17.569 31 HH22 ARG 4 2HH2 ARG 4 -9.879 16.962 -18.658 32 H GLY 5 H GLY 5 -8.531 9.675 -13.805 33 HA2 GLY 5 1HA GLY 5 -7.969 11.393 -11.697 34 HA3 GLY 5 2HA GLY 5 -9.684 11.026 -11.585 35 H VAL 6 H VAL 6 -9.371 8.327 -12.662 36 HA VAL 6 HA VAL 6 -8.140 7.075 -10.281 37 HB VAL 6 HB VAL 6 -9.682 5.212 -10.535 38 HG11 VAL 6 1HG1 VAL 6 -11.868 6.915 -10.547 39 HG12 VAL 6 2HG1 VAL 6 -10.533 7.929 -10.002 40 HG13 VAL 6 3HG1 VAL 6 -10.915 6.433 -9.146 41 HG21 VAL 6 3HG2 VAL 6 -9.911 5.943 -13.164 42 HG22 VAL 6 1HG2 VAL 6 -11.457 6.465 -12.494 43 HG23 VAL 6 2HG2 VAL 6 -10.947 4.786 -12.333 44 H GLU 7 H GLU 7 -6.206 7.456 -11.874 45 HA GLU 7 HA GLU 7 -5.539 4.857 -12.915 46 HB2 GLU 7 1HB GLU 7 -5.868 7.223 -14.752 47 HB3 GLU 7 2HB GLU 7 -4.840 5.858 -15.161 48 HG2 GLU 7 1HG GLU 7 -7.809 5.834 -14.697 49 HG3 GLU 7 2HG GLU 7 -6.955 5.557 -16.214 50 H MET 8 H MET 8 -4.544 6.514 -10.821 51 HA MET 8 HA MET 8 -1.914 7.320 -11.853 52 HB2 MET 8 1HB MET 8 -3.501 8.860 -10.416 53 HB3 MET 8 2HB MET 8 -2.808 7.957 -9.075 54 HG2 MET 8 1HG MET 8 -1.109 9.367 -9.087 55 HG3 MET 8 2HG MET 8 -0.632 8.699 -10.647 56 HE1 MET 8 3HE MET 8 -3.180 10.792 -12.787 57 HE2 MET 8 1HE MET 8 -2.465 9.203 -12.509 58 HE3 MET 8 2HE MET 8 -1.500 10.489 -13.233 59 H ARG 9 H ARG 9 -0.380 5.840 -11.649 60 HA ARG 9 HA ARG 9 -0.504 4.024 -9.333 61 HE ARG 9 HE ARG 9 3.306 0.850 -12.531 62 HB2 ARG 9 1HB ARG 9 0.382 2.308 -10.602 63 HB3 ARG 9 2HB ARG 9 -0.619 3.146 -11.777 64 HG2 ARG 9 1HG ARG 9 1.216 3.011 -13.058 65 HG3 ARG 9 2HG ARG 9 1.732 4.426 -12.140 66 HD2 ARG 9 1HD ARG 9 3.387 3.300 -11.144 67 HD3 ARG 9 2HD ARG 9 2.340 1.928 -10.780 68 HH11 ARG 9 1HH1 ARG 9 3.547 4.282 -13.123 69 HH12 ARG 9 2HH1 ARG 9 4.428 4.090 -14.601 70 HH21 ARG 9 1HH2 ARG 9 4.463 0.598 -14.476 71 HH22 ARG 9 2HH2 ARG 9 4.948 2.000 -15.369 72 H LEU 10 H LEU 10 1.279 3.578 -8.120 73 HA LEU 10 HA LEU 10 3.596 5.352 -8.529 74 HG LEU 10 HG LEU 10 1.046 4.276 -6.104 75 HB2 LEU 10 1HB LEU 10 3.557 4.510 -5.817 76 HB3 LEU 10 2HB LEU 10 3.398 6.131 -6.456 77 HD11 LEU 10 1HD1 LEU 10 2.187 6.332 -4.213 78 HD12 LEU 10 2HD1 LEU 10 1.966 4.607 -3.914 79 HD13 LEU 10 3HD1 LEU 10 0.561 5.662 -4.078 80 HD21 LEU 10 3HD2 LEU 10 0.633 7.150 -5.971 81 HD22 LEU 10 1HD2 LEU 10 -0.197 5.930 -6.938 82 HD23 LEU 10 2HD2 LEU 10 1.314 6.635 -7.513 83 H ARG 11 H ARG 11 5.635 4.474 -7.536 84 HA ARG 11 HA ARG 11 5.753 1.587 -8.045 85 HE ARG 11 HE ARG 11 10.440 0.664 -8.591 86 HB2 ARG 11 1HB ARG 11 7.250 3.692 -9.104 87 HB3 ARG 11 2HB ARG 11 8.336 2.902 -7.972 88 HG2 ARG 11 1HG ARG 11 6.799 1.389 -10.062 89 HG3 ARG 11 2HG ARG 11 8.392 2.085 -10.362 90 HD2 ARG 11 1HD ARG 11 8.261 0.527 -7.902 91 HD3 ARG 11 2HD ARG 11 7.887 -0.419 -9.341 92 HH11 ARG 11 1HH1 ARG 11 8.471 -0.410 -11.265 93 HH12 ARG 11 2HH1 ARG 11 9.827 -0.768 -12.281 94 HH21 ARG 11 1HH2 ARG 11 12.222 0.196 -9.926 95 HH22 ARG 11 2HH2 ARG 11 11.957 -0.424 -11.521 96 H ILE 12 H ILE 12 6.804 0.209 -6.617 97 HA ILE 12 HA ILE 12 7.965 1.340 -4.192 98 HB ILE 12 HB ILE 12 5.392 -0.095 -4.273 99 HG12 ILE 12 1HG1 ILE 12 6.646 1.361 -1.960 100 HG13 ILE 12 2HG1 ILE 12 6.000 2.230 -3.349 101 HG21 ILE 12 1HG2 ILE 12 7.579 -1.045 -2.454 102 HG22 ILE 12 2HG2 ILE 12 6.440 -1.991 -3.415 103 HG23 ILE 12 3HG2 ILE 12 5.883 -1.133 -1.979 104 HD11 ILE 12 3HD1 ILE 12 4.440 2.039 -1.423 105 HD12 ILE 12 1HD1 ILE 12 4.397 0.298 -1.698 106 HD13 ILE 12 2HD1 ILE 12 3.806 1.401 -2.941 107 H ARG 13 H ARG 13 9.961 0.585 -4.535 108 HA ARG 13 HA ARG 13 10.280 -2.241 -5.265 109 HE ARG 13 HE ARG 13 13.084 2.752 -6.230 110 HB2 ARG 13 1HB ARG 13 12.638 -1.628 -5.765 111 HB3 ARG 13 2HB ARG 13 11.461 -0.755 -6.738 112 HG2 ARG 13 1HG ARG 13 11.755 1.226 -5.446 113 HG3 ARG 13 2HG ARG 13 12.734 0.368 -4.256 114 HD2 ARG 13 1HD ARG 13 14.588 0.658 -5.454 115 HD3 ARG 13 2HD ARG 13 13.812 0.054 -6.916 116 HH11 ARG 13 1HH1 ARG 13 15.377 0.741 -7.925 117 HH12 ARG 13 2HH1 ARG 13 15.866 1.998 -9.009 118 HH21 ARG 13 1HH2 ARG 13 13.727 4.407 -7.655 119 HH22 ARG 13 2HH2 ARG 13 14.931 4.080 -8.856 120 H PHE 14 H PHE 14 11.882 -3.519 -4.234 121 HA PHE 14 HA PHE 14 12.671 -2.688 -1.543 122 HD1 PHE 14 HD1 PHE 14 9.717 -2.529 -1.776 123 HD2 PHE 14 HD2 PHE 14 11.445 -5.166 1.084 124 HE1 PHE 14 HE1 PHE 14 8.305 -1.545 -0.022 125 HE2 PHE 14 HE2 PHE 14 10.036 -4.184 2.844 126 HZ PHE 14 HZ PHE 14 8.463 -2.372 2.293 127 HB2 PHE 14 1HB PHE 14 10.891 -4.943 -2.289 128 HB3 PHE 14 2HB PHE 14 12.133 -5.301 -1.095 129 H GLU 15 H GLU 15 14.671 -3.380 -0.960 130 HA GLU 15 HA GLU 15 16.616 -3.939 -2.749 131 HB2 GLU 15 1HB GLU 15 16.357 -4.354 0.159 132 HB3 GLU 15 2HB GLU 15 17.590 -5.332 -0.621 133 HG2 GLU 15 1HG GLU 15 18.207 -3.021 0.348 134 HG3 GLU 15 2HG GLU 15 18.860 -3.521 -1.208 135 H SER 16 H SER 16 14.382 -6.278 -1.434 136 HA SER 16 HA SER 16 15.721 -8.354 -3.044 137 HG SER 16 HG SER 16 13.199 -9.573 -0.816 138 HB2 SER 16 1HB SER 16 15.283 -9.988 -1.411 139 HB3 SER 16 2HB SER 16 15.826 -8.588 -0.487 140 H ALA 17 H ALA 17 13.389 -6.467 -3.629 141 HA ALA 17 HA ALA 17 11.839 -8.332 -5.083 142 HB1 ALA 17 3HB ALA 17 9.954 -8.724 -3.875 143 HB2 ALA 17 1HB ALA 17 10.081 -7.216 -2.970 144 HB3 ALA 17 2HB ALA 17 11.109 -8.586 -2.551 145 H GLU 18 H GLU 18 10.231 -7.417 -6.395 146 HA GLU 18 HA GLU 18 10.097 -4.468 -6.376 147 HB2 GLU 18 1HB GLU 18 10.176 -4.459 -8.808 148 HB3 GLU 18 2HB GLU 18 11.609 -5.243 -8.159 149 HG2 GLU 18 1HG GLU 18 9.928 -7.357 -8.499 150 HG3 GLU 18 2HG GLU 18 9.473 -6.311 -9.843 151 H CYS 19 H CYS 19 8.116 -3.535 -6.842 152 HA CYS 19 HA CYS 19 5.947 -5.073 -7.936 153 HG CYS 19 HG CYS 19 7.471 -4.766 -4.620 154 HB2 CYS 19 1HB CYS 19 4.765 -4.306 -5.498 155 HB3 CYS 19 2HB CYS 19 5.074 -5.943 -6.063 156 H GLU 20 H GLU 20 4.104 -3.817 -8.458 157 HA GLU 20 HA GLU 20 4.369 -0.934 -7.918 158 HB2 GLU 20 1HB GLU 20 3.113 -1.769 -10.476 159 HB3 GLU 20 2HB GLU 20 4.080 -0.348 -10.115 160 HG2 GLU 20 1HG GLU 20 5.938 -2.291 -9.867 161 HG3 GLU 20 2HG GLU 20 4.889 -2.983 -11.100 162 H VAL 21 H VAL 21 2.300 0.261 -8.087 163 HA VAL 21 HA VAL 21 -0.117 -1.333 -7.954 164 HB VAL 21 HB VAL 21 -0.324 -1.442 -5.751 165 HG11 VAL 21 1HG1 VAL 21 2.034 -1.625 -5.558 166 HG12 VAL 21 2HG1 VAL 21 1.482 -0.583 -4.247 167 HG13 VAL 21 3HG1 VAL 21 2.246 0.123 -5.672 168 HG21 VAL 21 3HG2 VAL 21 -0.573 0.577 -4.356 169 HG22 VAL 21 1HG2 VAL 21 -1.528 0.652 -5.836 170 HG23 VAL 21 2HG2 VAL 21 -0.021 1.560 -5.712 171 H GLU 22 H GLU 22 -1.989 -0.206 -8.319 172 HA GLU 22 HA GLU 22 -1.633 2.503 -9.363 173 HB2 GLU 22 1HB GLU 22 -3.545 0.282 -9.859 174 HB3 GLU 22 2HB GLU 22 -4.157 1.919 -10.046 175 HG2 GLU 22 1HG GLU 22 -2.959 2.302 -11.913 176 HG3 GLU 22 2HG GLU 22 -1.584 1.345 -11.361 177 H LEU 23 H LEU 23 -3.943 3.761 -9.103 178 HA LEU 23 HA LEU 23 -4.984 3.416 -6.424 179 HG LEU 23 HG LEU 23 -5.443 6.706 -6.484 180 HB2 LEU 23 1HB LEU 23 -3.265 4.775 -5.707 181 HB3 LEU 23 2HB LEU 23 -3.192 5.666 -7.211 182 HD11 LEU 23 1HD1 LEU 23 -5.149 6.770 -3.780 183 HD12 LEU 23 2HD1 LEU 23 -4.745 5.092 -4.135 184 HD13 LEU 23 3HD1 LEU 23 -6.300 5.751 -4.640 185 HD21 LEU 23 3HD2 LEU 23 -2.758 7.257 -5.276 186 HD22 LEU 23 1HD2 LEU 23 -4.156 8.261 -4.888 187 HD23 LEU 23 2HD2 LEU 23 -3.605 8.125 -6.558 188 H TYR 24 H TYR 24 -6.954 4.415 -6.062 189 HA TYR 24 HA TYR 24 -8.144 5.794 -8.372 190 HD1 TYR 24 HD1 TYR 24 -7.917 4.473 -9.934 191 HD2 TYR 24 HD2 TYR 24 -9.693 1.486 -7.480 192 HE1 TYR 24 HE1 TYR 24 -7.155 2.739 -11.502 193 HE2 TYR 24 HE2 TYR 24 -8.935 -0.256 -9.039 194 HH TYR 24 HH TYR 24 -6.656 -0.051 -11.060 195 HB2 TYR 24 1HB TYR 24 -9.528 3.689 -6.684 196 HB3 TYR 24 2HB TYR 24 -10.246 4.585 -8.017 197 H GLU 25 H GLU 25 -9.680 7.371 -7.928 198 HA GLU 25 HA GLU 25 -9.281 8.889 -5.616 199 HB2 GLU 25 1HB GLU 25 -11.573 8.959 -7.578 200 HB3 GLU 25 2HB GLU 25 -11.302 10.169 -6.330 201 HG2 GLU 25 1HG GLU 25 -9.495 11.073 -7.401 202 HG3 GLU 25 2HG GLU 25 -9.087 9.571 -8.228 203 H GLU 26 H GLU 26 -11.089 6.046 -5.830 204 HA GLU 26 HA GLU 26 -13.362 6.405 -4.389 205 HB2 GLU 26 1HB GLU 26 -13.254 4.123 -3.748 206 HB3 GLU 26 2HB GLU 26 -12.458 4.237 -5.310 207 HG2 GLU 26 1HG GLU 26 -10.271 4.290 -4.114 208 HG3 GLU 26 2HG GLU 26 -11.147 3.976 -2.616 209 H TRP 27 H TRP 27 -10.090 6.593 -3.179 210 HA TRP 27 HA TRP 27 -10.881 6.587 -0.409 211 HD1 TRP 27 HD1 TRP 27 -6.106 7.608 -0.415 212 HE1 TRP 27 HE1 TRP 27 -5.754 8.698 1.885 213 HE3 TRP 27 HE3 TRP 27 -10.905 7.374 1.347 214 HZ2 TRP 27 HZ2 TRP 27 -7.297 9.376 4.144 215 HZ3 TRP 27 HZ3 TRP 27 -11.377 8.271 3.587 216 HH2 TRP 27 HH2 TRP 27 -9.611 9.247 4.957 217 HB2 TRP 27 1HB TRP 27 -8.704 5.726 -0.829 218 HB3 TRP 27 2HB TRP 27 -8.275 7.097 -1.846 219 H ALA 28 H ALA 28 -9.478 9.007 -2.638 220 HA ALA 28 HA ALA 28 -11.157 11.066 -2.395 221 HB1 ALA 28 3HB ALA 28 -10.041 12.471 -0.501 222 HB2 ALA 28 1HB ALA 28 -9.572 10.893 0.134 223 HB3 ALA 28 2HB ALA 28 -11.278 11.279 -0.101 224 HA PRO 29 HA PRO 29 -7.925 12.357 -5.236 225 HB2 PRO 29 1HB PRO 29 -9.081 14.982 -5.269 226 HB3 PRO 29 2HB PRO 29 -9.156 13.742 -6.520 227 HG2 PRO 29 1HG PRO 29 -11.164 14.512 -4.535 228 HG3 PRO 29 2HG PRO 29 -11.360 13.578 -6.026 229 HD2 PRO 29 1HD PRO 29 -11.544 12.515 -3.513 230 HD3 PRO 29 2HD PRO 29 -11.078 11.579 -4.947 231 H GLU 30 H GLU 30 -8.974 14.247 -2.434 232 HA GLU 30 HA GLU 30 -6.840 16.040 -2.321 233 HB2 GLU 30 1HB GLU 30 -8.931 16.292 -1.029 234 HB3 GLU 30 2HB GLU 30 -8.457 14.931 -0.017 235 HG2 GLU 30 1HG GLU 30 -6.401 16.952 -0.159 236 HG3 GLU 30 2HG GLU 30 -7.927 17.600 0.439 237 H THR 31 H THR 31 -7.264 12.920 -0.648 238 HA THR 31 HA THR 31 -4.755 12.992 0.679 239 HB THR 31 HB THR 31 -5.387 10.275 0.235 240 HG1 THR 31 HG1 THR 31 -7.393 10.597 -0.479 241 HG21 THR 31 3HG2 THR 31 -4.681 10.889 2.374 242 HG22 THR 31 1HG2 THR 31 -6.374 10.445 2.572 243 HG23 THR 31 2HG2 THR 31 -5.912 12.145 2.523 244 H VAL 32 H VAL 32 -5.763 11.557 -2.399 245 HA VAL 32 HA VAL 32 -3.514 10.192 -3.154 246 HB VAL 32 HB VAL 32 -5.211 11.944 -4.943 247 HG11 VAL 32 1HG1 VAL 32 -4.469 9.926 -6.527 248 HG12 VAL 32 2HG1 VAL 32 -3.052 9.993 -5.480 249 HG13 VAL 32 3HG1 VAL 32 -3.545 11.421 -6.389 250 HG21 VAL 32 3HG2 VAL 32 -6.816 10.532 -4.230 251 HG22 VAL 32 1HG2 VAL 32 -5.656 9.332 -3.662 252 HG23 VAL 32 2HG2 VAL 32 -6.065 9.420 -5.376 253 H ARG 33 H ARG 33 -4.025 13.666 -3.145 254 HA ARG 33 HA ARG 33 -1.823 14.449 -4.685 255 HE ARG 33 HE ARG 33 -0.508 18.923 -3.283 256 HB2 ARG 33 1HB ARG 33 -3.785 15.859 -3.778 257 HB3 ARG 33 2HB ARG 33 -2.814 16.027 -2.322 258 HG2 ARG 33 1HG ARG 33 -0.975 16.927 -3.800 259 HG3 ARG 33 2HG ARG 33 -2.172 16.992 -5.094 260 HD2 ARG 33 1HD ARG 33 -3.116 18.836 -4.264 261 HD3 ARG 33 2HD ARG 33 -3.134 18.186 -2.626 262 HH11 ARG 33 1HH1 ARG 33 -3.611 20.383 -2.629 263 HH12 ARG 33 2HH1 ARG 33 -2.930 21.852 -2.014 264 HH21 ARG 33 1HH2 ARG 33 0.389 20.854 -2.473 265 HH22 ARG 33 2HH2 ARG 33 -0.660 22.119 -1.926 266 H ALA 34 H ALA 34 -2.073 13.630 -1.265 267 HA ALA 34 HA ALA 34 0.517 14.516 -0.524 268 HB1 ALA 34 3HB ALA 34 -0.639 14.227 1.379 269 HB2 ALA 34 1HB ALA 34 0.008 12.589 1.291 270 HB3 ALA 34 2HB ALA 34 -1.624 12.927 0.710 271 H ILE 35 H ILE 35 -0.732 11.317 -1.432 272 HA ILE 35 HA ILE 35 1.620 9.852 -1.082 273 HB ILE 35 HB ILE 35 0.166 9.062 -3.509 274 HG12 ILE 35 1HG1 ILE 35 -1.719 10.115 -2.345 275 HG13 ILE 35 2HG1 ILE 35 -1.891 8.364 -2.362 276 HG21 ILE 35 1HG2 ILE 35 0.704 7.678 -0.890 277 HG22 ILE 35 2HG2 ILE 35 1.727 7.622 -2.325 278 HG23 ILE 35 3HG2 ILE 35 0.113 6.911 -2.365 279 HD11 ILE 35 3HD1 ILE 35 -0.624 9.680 -0.011 280 HD12 ILE 35 1HD1 ILE 35 -1.533 8.172 -0.105 281 HD13 ILE 35 2HD1 ILE 35 -2.377 9.718 -0.196 282 H ALA 36 H ALA 36 0.406 11.500 -4.044 283 HA ALA 36 HA ALA 36 2.664 10.966 -5.642 284 HB1 ALA 36 3HB ALA 36 0.238 12.032 -6.128 285 HB2 ALA 36 1HB ALA 36 1.605 12.153 -7.235 286 HB3 ALA 36 2HB ALA 36 1.231 13.490 -6.147 287 H ASP 37 H ASP 37 2.005 13.384 -3.202 288 HA ASP 37 HA ASP 37 4.138 15.139 -3.935 289 HB2 ASP 37 1HB ASP 37 2.083 15.584 -2.394 290 HB3 ASP 37 2HB ASP 37 3.099 14.904 -1.125 291 H ALA 38 H ALA 38 3.927 12.199 -2.120 292 HA ALA 38 HA ALA 38 6.598 12.492 -1.010 293 HB1 ALA 38 3HB ALA 38 5.986 10.979 0.569 294 HB2 ALA 38 1HB ALA 38 5.002 10.041 -0.556 295 HB3 ALA 38 2HB ALA 38 4.374 11.546 0.119 296 H LEU 39 H LEU 39 6.845 12.349 -3.674 297 HA LEU 39 HA LEU 39 6.992 9.762 -4.794 298 HG LEU 39 HG LEU 39 6.331 12.916 -5.935 299 HB2 LEU 39 1HB LEU 39 8.543 12.238 -5.585 300 HB3 LEU 39 2HB LEU 39 8.338 10.798 -6.557 301 HD11 LEU 39 1HD1 LEU 39 6.992 13.399 -8.017 302 HD12 LEU 39 2HD1 LEU 39 5.972 12.040 -8.493 303 HD13 LEU 39 3HD1 LEU 39 7.706 11.805 -8.264 304 HD21 LEU 39 3HD2 LEU 39 4.595 11.385 -6.907 305 HD22 LEU 39 1HD2 LEU 39 5.127 10.949 -5.284 306 HD23 LEU 39 2HD2 LEU 39 5.724 10.055 -6.678 307 HA PRO 40 HA PRO 40 11.121 7.880 -4.207 308 HB2 PRO 40 1HB PRO 40 12.618 10.347 -5.023 309 HB3 PRO 40 2HB PRO 40 13.050 8.645 -5.247 310 HG2 PRO 40 1HG PRO 40 11.887 10.113 -7.203 311 HG3 PRO 40 2HG PRO 40 11.630 8.370 -7.024 312 HD2 PRO 40 1HD PRO 40 9.751 10.548 -6.637 313 HD3 PRO 40 2HD PRO 40 9.436 8.808 -6.685 314 H ILE 41 H ILE 41 10.940 7.722 -2.068 315 HA ILE 41 HA ILE 41 12.446 9.606 -0.436 316 HB ILE 41 HB ILE 41 9.520 8.986 -0.010 317 HG12 ILE 41 1HG1 ILE 41 11.145 11.545 -0.009 318 HG13 ILE 41 2HG1 ILE 41 10.017 11.024 -1.252 319 HG21 ILE 41 1HG2 ILE 41 10.605 8.461 2.093 320 HG22 ILE 41 2HG2 ILE 41 9.729 9.983 2.244 321 HG23 ILE 41 3HG2 ILE 41 11.481 9.990 2.057 322 HD11 ILE 41 3HD1 ILE 41 8.313 11.948 -0.176 323 HD12 ILE 41 1HD1 ILE 41 9.489 12.666 0.923 324 HD13 ILE 41 2HD1 ILE 41 8.732 11.125 1.325 325 H LYS 42 H LYS 42 13.193 8.670 1.536 326 HA LYS 42 HA LYS 42 13.441 5.794 1.353 327 HB2 LYS 42 1HB LYS 42 14.865 7.973 2.731 328 HB3 LYS 42 2HB LYS 42 14.818 6.448 3.601 329 HG2 LYS 42 1HG LYS 42 16.351 5.548 2.274 330 HG3 LYS 42 2HG LYS 42 15.486 6.047 0.821 331 HD2 LYS 42 1HD LYS 42 17.263 7.378 0.481 332 HD3 LYS 42 2HD LYS 42 16.503 8.421 1.686 333 HE2 LYS 42 1HE LYS 42 18.486 8.249 2.733 334 HE3 LYS 42 2HE LYS 42 17.846 6.702 3.285 335 HZ1 LYS 42 3HZ LYS 42 19.211 6.732 0.706 336 HZ2 LYS 42 1HZ LYS 42 19.201 5.545 1.912 337 HZ3 LYS 42 2HZ LYS 42 20.175 6.917 2.083 338 H SER 43 H SER 43 12.583 4.306 2.665 339 HA SER 43 HA SER 43 11.235 5.097 5.123 340 HG SER 43 HG SER 43 9.214 2.381 3.749 341 HB2 SER 43 1HB SER 43 9.132 4.327 4.562 342 HB3 SER 43 2HB SER 43 9.647 5.007 3.023 343 H THR 44 H THR 44 10.992 3.396 6.631 344 HA THR 44 HA THR 44 12.717 1.077 6.048 345 HB THR 44 HB THR 44 11.762 1.505 8.814 346 HG1 THR 44 HG1 THR 44 12.518 3.436 9.046 347 HG21 THR 44 3HG2 THR 44 14.045 0.364 7.482 348 HG22 THR 44 1HG2 THR 44 13.480 0.150 9.139 349 HG23 THR 44 2HG2 THR 44 14.536 1.502 8.737 350 H ALA 45 H ALA 45 11.875 -0.870 5.807 351 HA ALA 45 HA ALA 45 9.019 -1.223 6.117 352 HB1 ALA 45 3HB ALA 45 10.114 -3.626 5.214 353 HB2 ALA 45 1HB ALA 45 11.078 -2.355 4.461 354 HB3 ALA 45 2HB ALA 45 9.328 -2.379 4.249 355 H ASN 46 H ASN 46 7.998 -2.382 7.556 356 HA ASN 46 HA ASN 46 9.552 -3.834 9.589 357 HB2 ASN 46 1HB ASN 46 6.905 -2.433 9.612 358 HB3 ASN 46 2HB ASN 46 7.160 -3.774 10.726 359 HD21 ASN 46 1HD2 ASN 46 6.826 -0.839 11.120 360 HD22 ASN 46 2HD2 ASN 46 8.180 -0.365 12.081 361 H ARG 47 H ARG 47 9.526 -6.059 9.446 362 HA ARG 47 HA ARG 47 7.685 -7.252 7.557 363 HE ARG 47 HE ARG 47 7.721 -9.869 7.236 364 HB2 ARG 47 1HB ARG 47 10.270 -7.927 8.724 365 HB3 ARG 47 2HB ARG 47 9.201 -9.313 8.564 366 HG2 ARG 47 1HG ARG 47 9.137 -7.724 6.170 367 HG3 ARG 47 2HG ARG 47 10.796 -8.144 6.585 368 HD2 ARG 47 1HD ARG 47 9.454 -9.760 5.104 369 HD3 ARG 47 2HD ARG 47 10.389 -10.427 6.438 370 HH11 ARG 47 1HH1 ARG 47 9.642 -12.152 5.425 371 HH12 ARG 47 2HH1 ARG 47 8.548 -13.468 5.684 372 HH21 ARG 47 1HH2 ARG 47 6.283 -11.602 7.579 373 HH22 ARG 47 2HH2 ARG 47 6.642 -13.157 6.907 374 H TRP 48 H TRP 48 6.061 -8.616 7.952 375 HA TRP 48 HA TRP 48 5.707 -9.950 10.473 376 HD1 TRP 48 HD1 TRP 48 4.947 -7.853 13.051 377 HE1 TRP 48 HE1 TRP 48 3.636 -9.140 14.850 378 HE3 TRP 48 HE3 TRP 48 1.816 -10.576 10.019 379 HZ2 TRP 48 HZ2 TRP 48 1.570 -11.046 14.981 380 HZ3 TRP 48 HZ3 TRP 48 0.213 -12.104 11.079 381 HH2 TRP 48 HH2 TRP 48 0.091 -12.333 13.505 382 HB2 TRP 48 1HB TRP 48 4.627 -7.489 10.486 383 HB3 TRP 48 2HB TRP 48 3.318 -8.357 9.688 384 H GLY 49 H GLY 49 4.211 -11.682 10.288 385 HA2 GLY 49 1HA GLY 49 4.108 -13.207 8.121 386 HA3 GLY 49 2HA GLY 49 2.720 -13.109 9.191 387 H ASP 50 H ASP 50 4.145 -11.914 6.217 388 HA ASP 50 HA ASP 50 3.172 -11.287 4.250 389 HB2 ASP 50 1HB ASP 50 1.352 -12.926 4.902 390 HB3 ASP 50 2HB ASP 50 0.469 -11.551 5.562 391 H GLU 51 H GLU 51 1.791 -9.883 7.191 392 HA GLU 51 HA GLU 51 0.957 -7.458 5.975 393 HB2 GLU 51 1HB GLU 51 0.345 -8.603 8.293 394 HB3 GLU 51 2HB GLU 51 1.640 -7.568 8.875 395 HG2 GLU 51 1HG GLU 51 0.233 -5.774 7.461 396 HG3 GLU 51 2HG GLU 51 -1.060 -6.878 7.925 397 H ILE 52 H ILE 52 2.176 -5.851 5.275 398 HA ILE 52 HA ILE 52 4.718 -5.297 6.655 399 HB ILE 52 HB ILE 52 4.436 -6.106 3.919 400 HG12 ILE 52 1HG1 ILE 52 7.066 -5.382 4.243 401 HG13 ILE 52 2HG1 ILE 52 6.544 -5.590 5.908 402 HG21 ILE 52 1HG2 ILE 52 4.069 -3.831 3.272 403 HG22 ILE 52 2HG2 ILE 52 5.717 -4.273 2.830 404 HG23 ILE 52 3HG2 ILE 52 5.426 -3.283 4.257 405 HD11 ILE 52 3HD1 ILE 52 5.814 -7.879 5.367 406 HD12 ILE 52 1HD1 ILE 52 7.531 -7.621 5.076 407 HD13 ILE 52 2HD1 ILE 52 6.408 -7.658 3.719 408 H TYR 53 H TYR 53 4.736 -3.309 7.464 409 HA TYR 53 HA TYR 53 3.279 -1.187 6.050 410 HD1 TYR 53 HD1 TYR 53 4.146 0.046 9.936 411 HD2 TYR 53 HD2 TYR 53 2.372 -3.773 9.303 412 HE1 TYR 53 HE1 TYR 53 4.964 -0.693 12.131 413 HE2 TYR 53 HE2 TYR 53 3.187 -4.518 11.499 414 HH TYR 53 HH TYR 53 3.850 -3.418 13.688 415 HB2 TYR 53 1HB TYR 53 2.414 -0.313 8.190 416 HB3 TYR 53 2HB TYR 53 1.822 -1.939 7.863 417 H PHE 54 H PHE 54 4.433 0.599 5.766 418 HA PHE 54 HA PHE 54 6.647 1.165 7.610 419 HD1 PHE 54 HD2 PHE 54 6.620 3.590 4.584 420 HD2 PHE 54 HD1 PHE 54 6.954 -0.486 3.406 421 HE1 PHE 54 HE2 PHE 54 5.917 4.191 2.309 422 HE2 PHE 54 HE1 PHE 54 6.252 0.111 1.130 423 HZ PHE 54 HZ PHE 54 5.731 2.453 0.577 424 HB2 PHE 54 1HB PHE 54 8.143 1.708 5.800 425 HB3 PHE 54 2HB PHE 54 7.532 0.080 5.548 426 H THR 55 H THR 55 7.117 3.340 7.943 427 HA THR 55 HA THR 55 4.963 5.173 7.178 428 HB THR 55 HB THR 55 7.190 6.181 8.842 429 HG1 THR 55 HG1 THR 55 5.445 4.199 9.869 430 HG21 THR 55 3HG2 THR 55 4.210 6.124 9.254 431 HG22 THR 55 1HG2 THR 55 5.145 7.465 8.595 432 HG23 THR 55 2HG2 THR 55 5.380 6.967 10.270 433 H THR 56 H THR 56 5.324 7.119 6.044 434 HA THR 56 HA THR 56 7.943 7.274 4.697 435 HB THR 56 HB THR 56 6.016 8.553 3.082 436 HG1 THR 56 HG1 THR 56 4.360 7.425 3.994 437 HG21 THR 56 3HG2 THR 56 7.374 7.560 1.643 438 HG22 THR 56 1HG2 THR 56 6.469 6.076 1.937 439 HG23 THR 56 2HG2 THR 56 7.935 6.412 2.860 440 H GLN 57 H GLN 57 6.287 8.759 6.999 441 HA GLN 57 HA GLN 57 6.676 10.780 8.011 442 HB2 GLN 57 1HB GLN 57 7.906 11.914 5.507 443 HB3 GLN 57 2HB GLN 57 8.177 12.384 7.181 444 HG2 GLN 57 1HG GLN 57 8.923 9.655 6.883 445 HG3 GLN 57 2HG GLN 57 9.669 10.590 5.589 446 HE21 GLN 57 1HE2 GLN 57 9.116 10.683 9.087 447 HE22 GLN 57 2HE2 GLN 57 10.648 11.377 9.485 448 H VAL 58 H VAL 58 4.863 10.220 5.243 449 HA VAL 58 HA VAL 58 3.734 12.891 5.103 450 HB VAL 58 HB VAL 58 3.953 11.595 3.026 451 HG11 VAL 58 1HG1 VAL 58 2.647 9.649 2.560 452 HG12 VAL 58 2HG1 VAL 58 1.826 9.764 4.118 453 HG13 VAL 58 3HG1 VAL 58 3.540 9.360 4.056 454 HG21 VAL 58 3HG2 VAL 58 1.196 12.347 3.940 455 HG22 VAL 58 1HG2 VAL 58 1.519 11.811 2.292 456 HG23 VAL 58 2HG2 VAL 58 2.308 13.258 2.919 457 H ALA 59 H ALA 59 2.297 13.535 6.562 458 HA ALA 59 HA ALA 59 0.625 11.500 7.869 459 HB1 ALA 59 3HB ALA 59 2.124 12.990 9.266 460 HB2 ALA 59 1HB ALA 59 0.430 12.900 9.746 461 HB3 ALA 59 2HB ALA 59 1.020 14.307 8.865 462 H VAL 60 H VAL 60 -1.070 11.287 6.492 463 HA VAL 60 HA VAL 60 -2.835 13.638 6.269 464 HB VAL 60 HB VAL 60 -1.883 13.297 4.070 465 HG11 VAL 60 1HG1 VAL 60 -1.854 11.253 2.896 466 HG12 VAL 60 2HG1 VAL 60 -2.936 10.478 4.049 467 HG13 VAL 60 3HG1 VAL 60 -1.281 10.874 4.519 468 HG21 VAL 60 3HG2 VAL 60 -3.933 12.761 2.760 469 HG22 VAL 60 1HG2 VAL 60 -4.192 13.944 4.040 470 HG23 VAL 60 2HG2 VAL 60 -4.714 12.273 4.263 471 H GLU 61 H GLU 61 -4.448 13.161 7.676 472 HA GLU 61 HA GLU 61 -5.635 10.468 7.491 473 HB2 GLU 61 1HB GLU 61 -4.595 11.889 9.777 474 HB3 GLU 61 2HB GLU 61 -6.300 11.531 10.007 475 HG2 GLU 61 1HG GLU 61 -5.866 9.170 9.560 476 HG3 GLU 61 2HG GLU 61 -4.156 9.532 9.325 477 H LYS 62 H LYS 62 -7.769 10.313 7.198 478 HA LYS 62 HA LYS 62 -9.487 12.623 7.662 479 HB2 LYS 62 1HB LYS 62 -8.530 12.343 5.177 480 HB3 LYS 62 2HB LYS 62 -9.862 11.204 5.063 481 HG2 LYS 62 1HG LYS 62 -10.841 13.126 4.301 482 HG3 LYS 62 2HG LYS 62 -11.271 13.191 6.007 483 HD2 LYS 62 1HD LYS 62 -8.777 14.508 4.985 484 HD3 LYS 62 2HD LYS 62 -10.343 15.317 4.886 485 HE2 LYS 62 1HE LYS 62 -10.308 14.428 7.475 486 HE3 LYS 62 2HE LYS 62 -8.614 14.830 7.197 487 HZ1 LYS 62 3HZ LYS 62 -10.933 16.573 7.351 488 HZ2 LYS 62 1HZ LYS 62 -9.801 16.968 6.157 489 HZ3 LYS 62 2HZ LYS 62 -9.323 16.871 7.777 490 H GLU 63 H GLU 63 -11.859 11.968 7.336 491 HA GLU 63 HA GLU 63 -12.187 9.203 8.292 492 HB2 GLU 63 1HB GLU 63 -14.192 11.416 8.621 493 HB3 GLU 63 2HB GLU 63 -14.114 9.891 9.488 494 HG2 GLU 63 1HG GLU 63 -11.699 11.038 10.087 495 HG3 GLU 63 2HG GLU 63 -12.784 12.426 10.029 496 H GLU 64 H GLU 64 -12.324 8.251 6.266 497 HA GLU 64 HA GLU 64 -14.916 8.143 5.136 498 HB2 GLU 64 1HB GLU 64 -14.697 9.971 3.811 499 HB3 GLU 64 2HB GLU 64 -12.944 9.961 3.911 500 HG2 GLU 64 1HG GLU 64 -12.776 8.344 2.175 501 HG3 GLU 64 2HG GLU 64 -14.515 8.059 2.192 502 H ASN 65 H ASN 65 -15.042 6.596 3.324 503 HA ASN 65 HA ASN 65 -14.557 4.607 2.343 504 HB2 ASN 65 1HB ASN 65 -12.689 5.820 1.325 505 HB3 ASN 65 2HB ASN 65 -11.692 5.511 2.747 506 HD21 ASN 65 1HD2 ASN 65 -11.990 4.650 -0.296 507 HD22 ASN 65 2HD2 ASN 65 -11.524 2.988 -0.228 508 H SER 66 H SER 66 -11.698 4.672 4.393 509 HA SER 66 HA SER 66 -10.864 2.917 5.693 510 HG SER 66 HG SER 66 -10.371 4.069 7.486 511 HB2 SER 66 1HB SER 66 -13.162 4.274 7.032 512 HB3 SER 66 2HB SER 66 -12.399 2.909 7.845 513 H LYS 67 H LYS 67 -11.267 1.018 4.337 514 HA LYS 67 HA LYS 67 -13.691 -0.477 5.075 515 HB2 LYS 67 1HB LYS 67 -13.043 -2.037 3.197 516 HB3 LYS 67 2HB LYS 67 -13.513 -0.422 2.706 517 HG2 LYS 67 1HG LYS 67 -11.688 -0.867 1.378 518 HG3 LYS 67 2HG LYS 67 -10.971 0.062 2.689 519 HD2 LYS 67 1HD LYS 67 -10.403 -2.131 3.787 520 HD3 LYS 67 2HD LYS 67 -10.933 -2.925 2.308 521 HE2 LYS 67 1HE LYS 67 -9.248 -1.756 1.036 522 HE3 LYS 67 2HE LYS 67 -8.765 -0.844 2.464 523 HZ1 LYS 67 3HZ LYS 67 -8.689 -3.681 2.876 524 HZ2 LYS 67 1HZ LYS 67 -7.499 -2.518 3.172 525 HZ3 LYS 67 2HZ LYS 67 -7.664 -3.184 1.629 526 H ASP 68 H ASP 68 -13.532 -2.749 5.637 527 HA ASP 68 HA ASP 68 -10.947 -3.372 6.933 528 HB2 ASP 68 1HB ASP 68 -12.362 -4.661 8.604 529 HB3 ASP 68 2HB ASP 68 -12.474 -2.904 8.675 530 H VAL 69 H VAL 69 -12.792 -4.337 4.399 531 HA VAL 69 HA VAL 69 -11.731 -7.067 4.601 532 HB VAL 69 HB VAL 69 -14.540 -6.471 3.641 533 HG11 VAL 69 1HG1 VAL 69 -12.965 -9.030 3.847 534 HG12 VAL 69 2HG1 VAL 69 -13.641 -8.292 2.395 535 HG13 VAL 69 3HG1 VAL 69 -14.712 -8.971 3.621 536 HG21 VAL 69 3HG2 VAL 69 -15.149 -6.617 5.778 537 HG22 VAL 69 1HG2 VAL 69 -13.501 -7.001 6.275 538 HG23 VAL 69 2HG2 VAL 69 -14.591 -8.289 5.769 539 H VAL 70 H VAL 70 -10.996 -7.945 2.715 540 HA VAL 70 HA VAL 70 -11.585 -6.737 0.158 541 HB VAL 70 HB VAL 70 -9.271 -6.173 -0.418 542 HG11 VAL 70 1HG1 VAL 70 -10.853 -4.477 0.467 543 HG12 VAL 70 2HG1 VAL 70 -9.155 -4.082 0.727 544 HG13 VAL 70 3HG1 VAL 70 -10.130 -4.704 2.059 545 HG21 VAL 70 3HG2 VAL 70 -8.198 -7.702 1.292 546 HG22 VAL 70 1HG2 VAL 70 -8.566 -6.464 2.499 547 HG23 VAL 70 2HG2 VAL 70 -7.494 -6.090 1.155 548 H GLU 71 H GLU 71 -10.647 -7.900 -1.650 549 HA GLU 71 HA GLU 71 -10.155 -10.703 -0.941 550 HB2 GLU 71 1HB GLU 71 -10.630 -9.766 -3.759 551 HB3 GLU 71 2HB GLU 71 -10.937 -11.341 -3.045 552 HG2 GLU 71 1HG GLU 71 -12.870 -10.645 -1.993 553 HG3 GLU 71 2HG GLU 71 -12.442 -8.940 -2.113 554 H LEU 72 H LEU 72 -8.508 -11.899 -1.804 555 HA LEU 72 HA LEU 72 -5.970 -10.954 -1.748 556 HG LEU 72 HG LEU 72 -4.470 -12.286 -3.725 557 HB2 LEU 72 1HB LEU 72 -6.416 -13.317 -1.801 558 HB3 LEU 72 2HB LEU 72 -7.077 -13.216 -3.420 559 HD11 LEU 72 1HD1 LEU 72 -4.173 -13.238 -1.351 560 HD12 LEU 72 2HD1 LEU 72 -3.017 -13.714 -2.594 561 HD13 LEU 72 3HD1 LEU 72 -4.311 -14.816 -2.125 562 HD21 LEU 72 3HD2 LEU 72 -4.277 -14.039 -5.188 563 HD22 LEU 72 1HD2 LEU 72 -6.031 -13.945 -5.026 564 HD23 LEU 72 2HD2 LEU 72 -5.128 -15.164 -4.127 565 H GLY 73 H GLY 73 -4.647 -9.735 -2.992 566 HA2 GLY 73 1HA GLY 73 -3.764 -9.309 -5.246 567 HA3 GLY 73 2HA GLY 73 -5.419 -9.339 -5.821 568 H ASP 74 H ASP 74 -6.420 -7.670 -3.600 569 HA ASP 74 HA ASP 74 -5.781 -5.136 -4.809 570 HB2 ASP 74 1HB ASP 74 -7.454 -4.285 -3.035 571 HB3 ASP 74 2HB ASP 74 -8.056 -5.334 -4.313 572 H VAL 75 H VAL 75 -5.198 -3.223 -3.620 573 HA VAL 75 HA VAL 75 -3.382 -3.806 -1.347 574 HB VAL 75 HB VAL 75 -3.099 -1.536 -3.350 575 HG11 VAL 75 1HG1 VAL 75 -1.061 -2.537 -1.376 576 HG12 VAL 75 2HG1 VAL 75 -2.143 -1.179 -1.061 577 HG13 VAL 75 3HG1 VAL 75 -0.985 -1.096 -2.387 578 HG21 VAL 75 3HG2 VAL 75 -1.941 -2.857 -4.718 579 HG22 VAL 75 1HG2 VAL 75 -2.595 -4.220 -3.807 580 HG23 VAL 75 2HG2 VAL 75 -1.017 -3.552 -3.388 581 H ALA 76 H ALA 76 -3.264 -2.136 0.388 582 HA ALA 76 HA ALA 76 -5.245 -0.017 0.267 583 HB1 ALA 76 3HB ALA 76 -6.733 -1.546 1.124 584 HB2 ALA 76 1HB ALA 76 -6.086 -0.823 2.597 585 HB3 ALA 76 2HB ALA 76 -5.494 -2.392 2.051 586 H TYR 77 H TYR 77 -5.009 1.615 1.844 587 HA TYR 77 HA TYR 77 -2.382 1.573 3.170 588 HD1 TYR 77 HD1 TYR 77 -2.106 4.445 4.762 589 HD2 TYR 77 HD2 TYR 77 -5.266 5.060 1.979 590 HE1 TYR 77 HE1 TYR 77 -2.928 6.326 6.114 591 HE2 TYR 77 HE2 TYR 77 -6.089 6.943 3.322 592 HH TYR 77 HH TYR 77 -5.215 8.547 4.978 593 HB2 TYR 77 1HB TYR 77 -2.056 3.605 2.294 594 HB3 TYR 77 2HB TYR 77 -3.612 3.493 1.483 595 H TRP 78 H TRP 78 -2.206 1.916 5.329 596 HA TRP 78 HA TRP 78 -4.564 1.589 6.928 597 HD1 TRP 78 HD1 TRP 78 -5.219 1.850 9.049 598 HE1 TRP 78 HE1 TRP 78 -5.496 0.599 11.278 599 HE3 TRP 78 HE3 TRP 78 -0.564 -0.227 9.390 600 HZ2 TRP 78 HZ2 TRP 78 -3.944 -1.055 12.962 601 HZ3 TRP 78 HZ3 TRP 78 -0.039 -1.632 11.342 602 HH2 TRP 78 HH2 TRP 78 -1.696 -2.035 13.091 603 HB2 TRP 78 1HB TRP 78 -2.109 0.743 7.334 604 HB3 TRP 78 2HB TRP 78 -1.902 2.316 8.093 605 H ILE 79 H ILE 79 -5.903 3.255 7.332 606 HA ILE 79 HA ILE 79 -5.175 5.963 7.067 607 HB ILE 79 HB ILE 79 -7.582 4.574 8.184 608 HG12 ILE 79 1HG1 ILE 79 -6.758 5.767 5.687 609 HG13 ILE 79 2HG1 ILE 79 -8.150 4.750 6.032 610 HG21 ILE 79 1HG2 ILE 79 -8.650 6.777 8.552 611 HG22 ILE 79 2HG2 ILE 79 -7.077 7.541 8.319 612 HG23 ILE 79 3HG2 ILE 79 -7.332 6.446 9.678 613 HD11 ILE 79 3HD1 ILE 79 -7.953 7.740 6.129 614 HD12 ILE 79 1HD1 ILE 79 -9.282 6.860 6.883 615 HD13 ILE 79 2HD1 ILE 79 -9.017 6.737 5.145 616 HA PRO 80 HA PRO 80 -5.179 6.349 11.883 617 HB2 PRO 80 1HB PRO 80 -5.272 4.009 13.306 618 HB3 PRO 80 2HB PRO 80 -6.697 4.982 12.923 619 HG2 PRO 80 1HG PRO 80 -5.646 2.540 11.550 620 HG3 PRO 80 2HG PRO 80 -7.319 2.960 11.959 621 HD2 PRO 80 1HD PRO 80 -6.362 3.265 9.469 622 HD3 PRO 80 2HD PRO 80 -7.526 4.409 10.164 623 H GLY 81 H GLY 81 -3.034 6.626 10.771 624 HA2 GLY 81 1HA GLY 81 -0.870 6.136 12.169 625 HA3 GLY 81 2HA GLY 81 -1.063 4.552 11.429 626 H LYS 82 H LYS 82 -2.249 6.378 9.069 627 HA LYS 82 HA LYS 82 -1.435 7.081 7.035 628 HB2 LYS 82 1HB LYS 82 1.053 8.145 8.272 629 HB3 LYS 82 2HB LYS 82 -0.021 8.882 7.096 630 HG2 LYS 82 1HG LYS 82 -0.830 10.140 8.730 631 HG3 LYS 82 2HG LYS 82 -1.534 8.687 9.441 632 HD2 LYS 82 1HD LYS 82 0.712 8.313 10.556 633 HD3 LYS 82 2HD LYS 82 1.120 9.957 10.058 634 HE2 LYS 82 1HE LYS 82 -1.004 10.690 11.227 635 HE3 LYS 82 2HE LYS 82 -1.075 9.069 11.915 636 HZ1 LYS 82 3HZ LYS 82 1.001 9.418 13.004 637 HZ2 LYS 82 1HZ LYS 82 0.007 10.737 13.365 638 HZ3 LYS 82 2HZ LYS 82 1.242 10.898 12.221 639 H ALA 83 H ALA 83 -0.619 4.441 8.057 640 HA ALA 83 HA ALA 83 1.963 4.126 6.681 641 HB1 ALA 83 3HB ALA 83 0.759 2.858 9.037 642 HB2 ALA 83 1HB ALA 83 2.453 3.119 8.628 643 HB3 ALA 83 2HB ALA 83 1.579 1.752 7.936 644 H ILE 84 H ILE 84 2.089 2.986 4.843 645 HA ILE 84 HA ILE 84 -0.357 1.836 3.746 646 HB ILE 84 HB ILE 84 2.329 1.986 2.385 647 HG12 ILE 84 1HG1 ILE 84 0.122 4.057 2.399 648 HG13 ILE 84 2HG1 ILE 84 1.707 4.238 3.143 649 HG21 ILE 84 1HG2 ILE 84 0.424 2.292 0.474 650 HG22 ILE 84 2HG2 ILE 84 -0.394 1.222 1.612 651 HG23 ILE 84 3HG2 ILE 84 1.158 0.751 0.921 652 HD11 ILE 84 3HD1 ILE 84 1.790 3.557 0.302 653 HD12 ILE 84 1HD1 ILE 84 2.678 4.784 1.208 654 HD13 ILE 84 2HD1 ILE 84 1.031 5.107 0.664 655 H CYS 85 H CYS 85 -0.531 -0.346 3.061 656 HA CYS 85 HA CYS 85 1.640 -2.130 3.863 657 HG CYS 85 HG CYS 85 -0.876 -4.719 5.264 658 HB2 CYS 85 1HB CYS 85 0.214 -2.059 5.800 659 HB3 CYS 85 2HB CYS 85 -1.215 -2.347 4.812 660 H LEU 86 H LEU 86 1.527 -4.270 3.046 661 HA LEU 86 HA LEU 86 0.016 -4.485 0.516 662 HG LEU 86 HG LEU 86 1.394 -4.256 -1.134 663 HB2 LEU 86 1HB LEU 86 2.774 -4.894 1.151 664 HB3 LEU 86 2HB LEU 86 2.093 -6.445 0.697 665 HD11 LEU 86 1HD1 LEU 86 3.506 -3.927 -2.102 666 HD12 LEU 86 2HD1 LEU 86 4.230 -5.240 -1.172 667 HD13 LEU 86 3HD1 LEU 86 3.768 -3.739 -0.367 668 HD21 LEU 86 3HD2 LEU 86 0.814 -6.401 -1.841 669 HD22 LEU 86 1HD2 LEU 86 2.351 -7.097 -1.323 670 HD23 LEU 86 2HD2 LEU 86 2.288 -6.049 -2.742 671 H PHE 87 H PHE 87 -0.639 -6.715 -0.087 672 HA PHE 87 HA PHE 87 -1.049 -8.480 2.222 673 HD1 PHE 87 HD1 PHE 87 -2.742 -7.172 3.850 674 HD2 PHE 87 HD2 PHE 87 -3.856 -5.787 -0.002 675 HE1 PHE 87 HE1 PHE 87 -3.365 -5.001 4.823 676 HE2 PHE 87 HE2 PHE 87 -4.490 -3.619 0.954 677 HZ PHE 87 HZ PHE 87 -4.242 -3.215 3.371 678 HB2 PHE 87 1HB PHE 87 -3.275 -7.990 0.264 679 HB3 PHE 87 2HB PHE 87 -3.356 -8.724 1.862 680 H PHE 88 H PHE 88 -0.943 -10.631 1.783 681 HA PHE 88 HA PHE 88 -1.385 -11.840 -0.693 682 HD1 PHE 88 HD2 PHE 88 -0.298 -9.982 -2.766 683 HD2 PHE 88 HD1 PHE 88 1.496 -13.758 -1.995 684 HE1 PHE 88 HE2 PHE 88 -0.491 -10.552 -5.154 685 HE2 PHE 88 HE1 PHE 88 1.311 -14.341 -4.380 686 HZ PHE 88 HZ PHE 88 0.315 -12.737 -5.963 687 HB2 PHE 88 1HB PHE 88 0.998 -10.435 -0.705 688 HB3 PHE 88 2HB PHE 88 1.508 -12.080 -0.340 689 H GLY 89 H GLY 89 -2.199 -12.567 1.784 690 HA2 GLY 89 1HA GLY 89 -1.806 -15.212 2.018 691 HA3 GLY 89 2HA GLY 89 -0.392 -14.582 2.842 692 H LYS 90 H LYS 90 -0.778 -13.151 4.697 693 HA LYS 90 HA LYS 90 -3.392 -13.458 5.957 694 HB2 LYS 90 1HB LYS 90 -2.554 -14.374 7.968 695 HB3 LYS 90 2HB LYS 90 -1.922 -15.360 6.669 696 HG2 LYS 90 1HG LYS 90 0.095 -15.088 7.537 697 HG3 LYS 90 2HG LYS 90 0.003 -13.379 7.115 698 HD2 LYS 90 1HD LYS 90 0.127 -12.940 9.290 699 HD3 LYS 90 2HD LYS 90 -1.504 -13.596 9.429 700 HE2 LYS 90 1HE LYS 90 -0.589 -15.041 10.876 701 HE3 LYS 90 2HE LYS 90 0.007 -15.865 9.434 702 HZ1 LYS 90 3HZ LYS 90 2.105 -14.940 9.680 703 HZ2 LYS 90 1HZ LYS 90 1.663 -15.293 11.275 704 HZ3 LYS 90 2HZ LYS 90 1.568 -13.704 10.702 705 H THR 91 H THR 91 -2.636 -12.549 8.490 706 HA THR 91 HA THR 91 -1.250 -10.065 8.381 707 HB THR 91 HB THR 91 -3.769 -9.145 9.177 708 HG1 THR 91 HG1 THR 91 -4.090 -10.460 6.698 709 HG21 THR 91 3HG2 THR 91 -3.573 -8.368 6.538 710 HG22 THR 91 1HG2 THR 91 -1.901 -8.598 7.045 711 HG23 THR 91 2HG2 THR 91 -2.955 -7.502 7.940 712 HA PRO 92 HA PRO 92 -1.080 -10.193 12.819 713 HB2 PRO 92 1HB PRO 92 -3.189 -8.416 13.579 714 HB3 PRO 92 2HB PRO 92 -1.454 -8.104 13.573 715 HG2 PRO 92 1HG PRO 92 -3.502 -7.399 11.563 716 HG3 PRO 92 2HG PRO 92 -1.949 -6.620 11.914 717 HD2 PRO 92 1HD PRO 92 -2.320 -8.072 9.697 718 HD3 PRO 92 2HD PRO 92 -0.770 -8.081 10.554 719 H ILE 93 H ILE 93 -4.233 -10.510 11.314 720 HA ILE 93 HA ILE 93 -4.901 -12.557 13.298 721 HB ILE 93 HB ILE 93 -7.293 -11.713 13.270 722 HG12 ILE 93 1HG1 ILE 93 -5.905 -9.245 12.201 723 HG13 ILE 93 2HG1 ILE 93 -7.108 -10.209 11.354 724 HG21 ILE 93 1HG2 ILE 93 -6.744 -9.866 14.939 725 HG22 ILE 93 2HG2 ILE 93 -5.051 -10.216 14.592 726 HG23 ILE 93 3HG2 ILE 93 -6.090 -11.470 15.270 727 HD11 ILE 93 3HD1 ILE 93 -8.842 -9.360 12.569 728 HD12 ILE 93 1HD1 ILE 93 -7.752 -7.974 12.554 729 HD13 ILE 93 2HD1 ILE 93 -7.835 -9.015 13.976 730 H SER 94 H SER 94 -4.089 -13.647 11.151 731 HA SER 94 HA SER 94 -5.630 -13.742 8.833 732 HG SER 94 HG SER 94 -2.945 -15.698 10.664 733 HB2 SER 94 1HB SER 94 -4.613 -16.369 9.579 734 HB3 SER 94 2HB SER 94 -4.149 -15.323 8.238 735 H ASP 95 H ASP 95 -5.644 -16.325 11.286 736 HA ASP 95 HA ASP 95 -7.275 -17.679 12.089 737 HB2 ASP 95 1HB ASP 95 -8.924 -15.259 11.378 738 HB3 ASP 95 2HB ASP 95 -9.657 -16.705 12.062 739 H ASP 96 H ASP 96 -9.778 -16.562 9.977 740 HA ASP 96 HA ASP 96 -9.343 -18.921 8.268 741 HB2 ASP 96 1HB ASP 96 -11.634 -18.142 9.821 742 HB3 ASP 96 2HB ASP 96 -12.064 -18.152 8.112 743 H LYS 97 H LYS 97 -9.505 -15.552 8.354 744 HA LYS 97 HA LYS 97 -9.629 -15.452 5.430 745 HB2 LYS 97 1HB LYS 97 -10.988 -13.399 7.180 746 HB3 LYS 97 2HB LYS 97 -11.066 -13.532 5.430 747 HG2 LYS 97 1HG LYS 97 -11.996 -15.932 6.788 748 HG3 LYS 97 2HG LYS 97 -12.918 -14.492 7.212 749 HD2 LYS 97 1HD LYS 97 -14.071 -14.905 5.336 750 HD3 LYS 97 2HD LYS 97 -12.669 -14.238 4.499 751 HE2 LYS 97 1HE LYS 97 -11.862 -16.788 4.837 752 HE3 LYS 97 2HE LYS 97 -13.604 -17.026 4.717 753 HZ1 LYS 97 3HZ LYS 97 -11.940 -15.568 2.734 754 HZ2 LYS 97 1HZ LYS 97 -13.600 -15.869 2.612 755 HZ3 LYS 97 2HZ LYS 97 -12.502 -17.154 2.555 756 H ILE 98 H ILE 98 -9.371 -12.600 5.315 757 HA ILE 98 HA ILE 98 -6.737 -12.226 6.583 758 HB ILE 98 HB ILE 98 -7.618 -11.466 3.803 759 HG12 ILE 98 1HG1 ILE 98 -5.116 -12.918 4.669 760 HG13 ILE 98 2HG1 ILE 98 -6.626 -13.761 4.321 761 HG21 ILE 98 1HG2 ILE 98 -5.016 -10.635 3.980 762 HG22 ILE 98 2HG2 ILE 98 -5.676 -10.153 5.543 763 HG23 ILE 98 3HG2 ILE 98 -6.433 -9.586 4.055 764 HD11 ILE 98 3HD1 ILE 98 -6.273 -13.653 2.137 765 HD12 ILE 98 1HD1 ILE 98 -4.641 -13.106 2.519 766 HD13 ILE 98 2HD1 ILE 98 -5.918 -11.925 2.205 767 H ARG 99 H ARG 99 -7.247 -10.888 8.242 768 HA ARG 99 HA ARG 99 -8.896 -8.533 7.657 769 HE ARG 99 HE ARG 99 -12.186 -8.445 11.356 770 HB2 ARG 99 1HB ARG 99 -8.776 -10.251 9.873 771 HB3 ARG 99 2HB ARG 99 -8.040 -8.750 10.415 772 HG2 ARG 99 1HG ARG 99 -10.093 -8.007 10.798 773 HG3 ARG 99 2HG ARG 99 -10.303 -7.928 9.047 774 HD2 ARG 99 1HD ARG 99 -11.497 -9.887 8.965 775 HD3 ARG 99 2HD ARG 99 -10.747 -10.530 10.426 776 HH11 ARG 99 1HH1 ARG 99 -12.993 -11.158 9.314 777 HH12 ARG 99 2HH1 ARG 99 -14.641 -11.224 9.840 778 HH21 ARG 99 1HH2 ARG 99 -14.355 -8.530 12.046 779 HH22 ARG 99 2HH2 ARG 99 -15.416 -9.731 11.390 780 HA PRO 100 HA PRO 100 -4.765 -6.636 7.346 781 HB2 PRO 100 1HB PRO 100 -5.634 -4.391 6.074 782 HB3 PRO 100 2HB PRO 100 -5.315 -5.915 5.237 783 HG2 PRO 100 1HG PRO 100 -7.926 -4.788 6.175 784 HG3 PRO 100 2HG PRO 100 -7.534 -5.564 4.627 785 HD2 PRO 100 1HD PRO 100 -8.791 -6.880 6.614 786 HD3 PRO 100 2HD PRO 100 -7.643 -7.688 5.528 787 H ALA 101 H ALA 101 -7.773 -5.264 8.538 788 HA ALA 101 HA ALA 101 -6.708 -4.296 10.937 789 HB1 ALA 101 3HB ALA 101 -5.980 -2.645 8.772 790 HB2 ALA 101 1HB ALA 101 -5.770 -2.333 10.496 791 HB3 ALA 101 2HB ALA 101 -7.226 -1.777 9.669 792 H SER 102 H SER 102 -8.270 -1.980 11.317 793 HA SER 102 HA SER 102 -10.969 -3.114 11.045 794 HG SER 102 HG SER 102 -9.497 -2.380 14.478 795 HB2 SER 102 1HB SER 102 -10.769 -1.008 13.029 796 HB3 SER 102 2HB SER 102 -11.315 -2.675 13.216 797 H ALA 103 H ALA 103 -9.053 -0.733 9.735 798 HA ALA 103 HA ALA 103 -11.250 0.539 8.476 799 HB1 ALA 103 3HB ALA 103 -11.560 1.610 10.609 800 HB2 ALA 103 1HB ALA 103 -10.979 2.793 9.437 801 HB3 ALA 103 2HB ALA 103 -9.872 2.122 10.636 802 H VAL 104 H VAL 104 -9.567 -0.348 6.895 803 HA VAL 104 HA VAL 104 -7.636 1.807 6.310 804 HB VAL 104 HB VAL 104 -6.103 0.241 5.292 805 HG11 VAL 104 1HG1 VAL 104 -5.295 -0.834 7.237 806 HG12 VAL 104 2HG1 VAL 104 -6.905 -0.912 7.948 807 HG13 VAL 104 3HG1 VAL 104 -6.094 0.643 7.776 808 HG21 VAL 104 3HG2 VAL 104 -6.471 -1.997 4.936 809 HG22 VAL 104 1HG2 VAL 104 -8.089 -1.355 4.666 810 HG23 VAL 104 2HG2 VAL 104 -7.686 -2.116 6.206 811 H ASN 105 H ASN 105 -7.444 2.584 4.282 812 HA ASN 105 HA ASN 105 -9.712 2.170 2.547 813 HB2 ASN 105 1HB ASN 105 -7.357 3.931 1.909 814 HB3 ASN 105 2HB ASN 105 -9.044 4.139 1.447 815 HD21 ASN 105 1HD2 ASN 105 -10.109 3.588 4.044 816 HD22 ASN 105 2HD2 ASN 105 -9.755 4.955 5.033 817 H VAL 106 H VAL 106 -9.604 1.689 0.320 818 HA VAL 106 HA VAL 106 -7.529 -0.232 -0.369 819 HB VAL 106 HB VAL 106 -9.225 0.085 -2.588 820 HG11 VAL 106 1HG1 VAL 106 -9.927 -2.097 -0.785 821 HG12 VAL 106 2HG1 VAL 106 -8.195 -1.945 -1.088 822 HG13 VAL 106 3HG1 VAL 106 -9.313 -2.137 -2.438 823 HG21 VAL 106 3HG2 VAL 106 -10.893 1.266 -1.397 824 HG22 VAL 106 1HG2 VAL 106 -10.779 0.173 -0.017 825 HG23 VAL 106 2HG2 VAL 106 -11.461 -0.396 -1.540 826 H ILE 107 H ILE 107 -5.761 1.114 -0.686 827 HA ILE 107 HA ILE 107 -5.840 3.414 -2.362 828 HB ILE 107 HB ILE 107 -4.259 2.895 -0.396 829 HG12 ILE 107 1HG1 ILE 107 -3.820 4.372 -2.895 830 HG13 ILE 107 2HG1 ILE 107 -3.710 4.923 -1.230 831 HG21 ILE 107 1HG2 ILE 107 -3.491 0.730 -1.475 832 HG22 ILE 107 2HG2 ILE 107 -2.230 1.781 -0.833 833 HG23 ILE 107 3HG2 ILE 107 -2.539 1.735 -2.567 834 HD11 ILE 107 3HD1 ILE 107 -1.557 5.169 -2.020 835 HD12 ILE 107 1HD1 ILE 107 -1.624 3.674 -2.955 836 HD13 ILE 107 2HD1 ILE 107 -1.494 3.608 -1.198 837 H GLY 108 H GLY 108 -6.554 0.734 -3.608 838 HA2 GLY 108 1HA GLY 108 -6.356 0.568 -6.041 839 HA3 GLY 108 2HA GLY 108 -4.648 0.926 -5.849 840 H ARG 109 H ARG 109 -4.016 -0.939 -6.953 841 HA ARG 109 HA ARG 109 -3.895 -3.299 -5.298 842 HE ARG 109 HE ARG 109 -6.720 -5.974 -6.275 843 HB2 ARG 109 1HB ARG 109 -5.080 -3.624 -8.050 844 HB3 ARG 109 2HB ARG 109 -4.964 -4.824 -6.771 845 HG2 ARG 109 1HG ARG 109 -6.591 -3.544 -5.444 846 HG3 ARG 109 2HG ARG 109 -6.726 -2.380 -6.760 847 HD2 ARG 109 1HD ARG 109 -8.558 -3.863 -6.973 848 HD3 ARG 109 2HD ARG 109 -7.408 -4.285 -8.240 849 HH11 ARG 109 1HH1 ARG 109 -9.813 -5.189 -7.694 850 HH12 ARG 109 2HH1 ARG 109 -10.486 -6.754 -7.393 851 HH21 ARG 109 1HH2 ARG 109 -7.608 -8.033 -5.881 852 HH22 ARG 109 2HH2 ARG 109 -9.237 -8.369 -6.364 853 H ILE 110 H ILE 110 -2.602 -5.058 -6.415 854 HA ILE 110 HA ILE 110 -0.372 -3.793 -7.839 855 HB ILE 110 HB ILE 110 -0.519 -6.507 -6.522 856 HG12 ILE 110 1HG1 ILE 110 1.371 -4.664 -5.352 857 HG13 ILE 110 2HG1 ILE 110 -0.232 -3.942 -5.370 858 HG21 ILE 110 1HG2 ILE 110 1.809 -5.038 -7.747 859 HG22 ILE 110 2HG2 ILE 110 1.078 -6.536 -8.322 860 HG23 ILE 110 3HG2 ILE 110 1.940 -6.510 -6.784 861 HD11 ILE 110 3HD1 ILE 110 0.459 -6.623 -4.185 862 HD12 ILE 110 1HD1 ILE 110 -1.125 -5.845 -4.154 863 HD13 ILE 110 2HD1 ILE 110 0.230 -5.124 -3.286 864 H VAL 111 H VAL 111 -0.407 -3.942 -9.996 865 HA VAL 111 HA VAL 111 -1.658 -6.312 -11.212 866 HB VAL 111 HB VAL 111 -1.428 -4.695 -13.336 867 HG11 VAL 111 1HG1 VAL 111 -3.544 -5.157 -11.328 868 HG12 VAL 111 2HG1 VAL 111 -3.535 -5.465 -13.065 869 HG13 VAL 111 3HG1 VAL 111 -3.807 -3.830 -12.461 870 HG21 VAL 111 3HG2 VAL 111 -1.602 -2.436 -12.909 871 HG22 VAL 111 1HG2 VAL 111 -0.469 -2.938 -11.654 872 HG23 VAL 111 2HG2 VAL 111 -2.167 -2.684 -11.256 873 H ASN 112 H ASN 112 0.595 -4.088 -12.802 874 HA ASN 112 HA ASN 112 2.058 -6.223 -13.966 875 HB2 ASN 112 1HB ASN 112 3.623 -4.428 -14.710 876 HB3 ASN 112 2HB ASN 112 1.936 -4.089 -15.091 877 HD21 ASN 112 1HD2 ASN 112 3.417 -1.981 -15.215 878 HD22 ASN 112 2HD2 ASN 112 3.269 -0.965 -13.827 879 H SER 113 H SER 113 4.516 -6.296 -13.794 880 HA SER 113 HA SER 113 6.349 -6.878 -12.585 881 HG SER 113 HG SER 113 4.457 -4.761 -10.312 882 HB2 SER 113 1HB SER 113 7.141 -5.338 -11.033 883 HB3 SER 113 2HB SER 113 6.007 -4.360 -11.962 884 H MET 114 H MET 114 7.088 -7.772 -10.423 885 HA MET 114 HA MET 114 5.434 -9.888 -9.663 886 HB2 MET 114 1HB MET 114 7.764 -8.649 -8.188 887 HB3 MET 114 2HB MET 114 7.029 -10.193 -7.776 888 HG2 MET 114 1HG MET 114 7.979 -9.805 -10.558 889 HG3 MET 114 2HG MET 114 9.184 -10.021 -9.290 890 HE1 MET 114 3HE MET 114 8.284 -13.489 -7.817 891 HE2 MET 114 1HE MET 114 8.286 -11.807 -7.286 892 HE3 MET 114 2HE MET 114 9.685 -12.465 -8.133 893 H GLU 115 H GLU 115 4.264 -10.312 -7.762 894 HA GLU 115 HA GLU 115 3.555 -7.957 -6.148 895 HB2 GLU 115 1HB GLU 115 1.211 -8.608 -6.182 896 HB3 GLU 115 2HB GLU 115 1.791 -8.353 -7.822 897 HG2 GLU 115 1HG GLU 115 1.965 -11.113 -6.810 898 HG3 GLU 115 2HG GLU 115 0.341 -10.476 -7.057 899 H GLY 116 H GLY 116 5.413 -10.029 -5.519 900 HA2 GLY 116 1HA GLY 116 3.956 -11.435 -3.366 901 HA3 GLY 116 2HA GLY 116 5.369 -12.092 -4.176 902 H LEU 117 H LEU 117 4.782 -8.836 -2.861 903 HA LEU 117 HA LEU 117 7.302 -8.419 -1.840 904 HG LEU 117 HG LEU 117 6.835 -7.269 0.737 905 HB2 LEU 117 1HB LEU 117 5.761 -6.597 -1.925 906 HB3 LEU 117 2HB LEU 117 4.634 -7.417 -0.861 907 HD11 LEU 117 1HD1 LEU 117 7.839 -5.120 0.585 908 HD12 LEU 117 2HD1 LEU 117 6.769 -4.647 -0.733 909 HD13 LEU 117 3HD1 LEU 117 7.992 -5.891 -0.992 910 HD21 LEU 117 3HD2 LEU 117 5.068 -4.901 0.769 911 HD22 LEU 117 1HD2 LEU 117 5.534 -5.995 2.071 912 HD23 LEU 117 2HD2 LEU 117 4.300 -6.483 0.914 913 H LYS 118 H LYS 118 4.627 -10.171 -0.418 914 HA LYS 118 HA LYS 118 5.258 -10.418 2.202 915 HB2 LYS 118 1HB LYS 118 4.428 -12.822 2.042 916 HB3 LYS 118 2HB LYS 118 3.342 -11.563 1.479 917 HG2 LYS 118 1HG LYS 118 3.122 -13.117 -0.183 918 HG3 LYS 118 2HG LYS 118 4.396 -12.102 -0.854 919 HD2 LYS 118 1HD LYS 118 5.324 -14.170 -1.174 920 HD3 LYS 118 2HD LYS 118 5.951 -13.807 0.434 921 HE2 LYS 118 1HE LYS 118 3.722 -14.963 1.209 922 HE3 LYS 118 2HE LYS 118 3.805 -15.704 -0.389 923 HZ1 LYS 118 3HZ LYS 118 4.930 -17.179 0.985 924 HZ2 LYS 118 1HZ LYS 118 5.705 -15.954 1.855 925 HZ3 LYS 118 2HZ LYS 118 6.184 -16.297 0.270 926 H GLY 119 H GLY 119 7.144 -11.733 -0.427 927 HA2 GLY 119 1HA GLY 119 8.677 -13.471 1.317 928 HA3 GLY 119 2HA GLY 119 8.936 -13.224 -0.401 929 H VAL 120 H VAL 120 8.737 -10.552 1.865 930 HA VAL 120 HA VAL 120 11.399 -9.715 1.105 931 HB VAL 120 HB VAL 120 10.923 -7.743 2.597 932 HG11 VAL 120 1HG1 VAL 120 9.941 -8.371 0.041 933 HG12 VAL 120 2HG1 VAL 120 10.239 -6.776 0.728 934 HG13 VAL 120 3HG1 VAL 120 8.650 -7.516 0.881 935 HG21 VAL 120 3HG2 VAL 120 8.147 -7.824 2.772 936 HG22 VAL 120 1HG2 VAL 120 9.298 -7.950 4.100 937 HG23 VAL 120 2HG2 VAL 120 8.680 -9.408 3.332 938 H ALA 121 H ALA 121 13.092 -9.204 2.635 939 HA ALA 121 HA ALA 121 13.296 -11.156 4.750 940 HB1 ALA 121 3HB ALA 121 15.270 -8.957 4.173 941 HB2 ALA 121 1HB ALA 121 15.191 -10.433 3.212 942 HB3 ALA 121 2HB ALA 121 15.563 -10.521 4.933 943 H ASP 122 H ASP 122 13.498 -10.709 6.984 944 HA ASP 122 HA ASP 122 11.820 -8.751 8.004 945 HB2 ASP 122 1HB ASP 122 12.602 -9.339 10.183 946 HB3 ASP 122 2HB ASP 122 12.553 -10.809 9.211 947 H GLY 123 H GLY 123 11.997 -6.640 8.071 948 HA2 GLY 123 1HA GLY 123 12.873 -4.537 8.309 949 HA3 GLY 123 2HA GLY 123 14.203 -5.284 9.177 950 H GLU 124 H GLU 124 13.168 -3.844 6.248 951 HA GLU 124 HA GLU 124 15.900 -3.730 5.327 952 HB2 GLU 124 1HB GLU 124 15.214 -4.515 2.990 953 HB3 GLU 124 2HB GLU 124 15.453 -5.745 4.218 954 HG2 GLU 124 1HG GLU 124 13.161 -6.145 4.426 955 HG3 GLU 124 2HG GLU 124 12.733 -4.648 3.596 956 H SER 125 H SER 125 16.293 -2.105 3.792 957 HA SER 125 HA SER 125 14.899 0.244 4.066 958 HG SER 125 HG SER 125 16.495 1.943 1.970 959 HB2 SER 125 1HB SER 125 17.087 0.316 3.139 960 HB3 SER 125 2HB SER 125 16.630 -0.726 1.791 961 H VAL 126 H VAL 126 13.785 1.521 2.402 962 HA VAL 126 HA VAL 126 12.231 0.162 0.396 963 HB VAL 126 HB VAL 126 10.770 1.415 2.730 964 HG11 VAL 126 1HG1 VAL 126 9.569 1.765 0.680 965 HG12 VAL 126 2HG1 VAL 126 8.757 0.509 1.612 966 HG13 VAL 126 3HG1 VAL 126 9.762 0.069 0.233 967 HG21 VAL 126 3HG2 VAL 126 9.902 -0.898 3.082 968 HG22 VAL 126 1HG2 VAL 126 11.605 -0.676 3.469 969 HG23 VAL 126 2HG2 VAL 126 11.140 -1.464 1.962 970 H VAL 127 H VAL 127 11.895 1.554 -1.266 971 HA VAL 127 HA VAL 127 11.964 4.435 -0.656 972 HB VAL 127 HB VAL 127 13.079 4.783 -2.870 973 HG11 VAL 127 1HG1 VAL 127 14.228 3.785 -0.424 974 HG12 VAL 127 2HG1 VAL 127 14.818 5.039 -1.513 975 HG13 VAL 127 3HG1 VAL 127 15.227 3.349 -1.811 976 HG21 VAL 127 3HG2 VAL 127 14.246 2.156 -3.057 977 HG22 VAL 127 1HG2 VAL 127 13.440 3.121 -4.295 978 HG23 VAL 127 2HG2 VAL 127 12.493 2.079 -3.233 979 H VAL 128 H VAL 128 9.970 5.158 -0.969 980 HA VAL 128 HA VAL 128 8.219 4.003 -2.966 981 HB VAL 128 HB VAL 128 7.384 6.519 -1.665 982 HG11 VAL 128 1HG1 VAL 128 6.194 3.861 -2.306 983 HG12 VAL 128 2HG1 VAL 128 5.624 5.482 -2.713 984 HG13 VAL 128 3HG1 VAL 128 5.435 4.865 -1.072 985 HG21 VAL 128 3HG2 VAL 128 8.285 5.939 0.335 986 HG22 VAL 128 1HG2 VAL 128 8.368 4.226 -0.071 987 HG23 VAL 128 2HG2 VAL 128 6.837 4.940 0.427 988 H GLU 129 H GLU 129 7.916 4.824 -5.014 989 HA GLU 129 HA GLU 129 8.393 7.624 -5.560 990 HB2 GLU 129 1HB GLU 129 9.937 6.991 -7.501 991 HB3 GLU 129 2HB GLU 129 10.619 6.953 -5.883 992 HG2 GLU 129 1HG GLU 129 9.507 4.394 -6.541 993 HG3 GLU 129 2HG GLU 129 10.627 4.916 -7.799 994 H ARG 130 H ARG 130 7.038 8.355 -7.101 995 HA ARG 130 HA ARG 130 5.160 6.566 -8.308 996 HE ARG 130 HE ARG 130 4.581 11.123 -9.559 997 HB2 ARG 130 1HB ARG 130 4.564 8.847 -7.569 998 HB3 ARG 130 2HB ARG 130 5.626 9.515 -8.799 999 HG2 ARG 130 1HG ARG 130 3.623 7.651 -9.834 1000 HG3 ARG 130 2HG ARG 130 2.956 9.096 -9.070 1001 HD2 ARG 130 1HD ARG 130 5.027 9.073 -11.263 1002 HD3 ARG 130 2HD ARG 130 3.311 9.407 -11.478 1003 HH11 ARG 130 1HH1 ARG 130 3.896 10.641 -12.946 1004 HH12 ARG 130 2HH1 ARG 130 4.035 12.322 -13.342 1005 HH21 ARG 130 1HH2 ARG 130 4.763 13.334 -10.077 1006 HH22 ARG 130 2HH2 ARG 130 4.527 13.850 -11.713 1007 H ALA 131 H ALA 131 6.251 5.197 -9.694 1008 HA ALA 131 HA ALA 131 7.483 4.511 -11.515 1009 HB1 ALA 131 3HB ALA 131 5.837 6.696 -12.770 1010 HB2 ALA 131 1HB ALA 131 5.290 5.055 -12.434 1011 HB3 ALA 131 2HB ALA 131 6.577 5.333 -13.607 Start of MODEL 5 1 H MET 1 H MET 1 -12.752 -0.186 -11.591 2 HA MET 1 HA MET 1 -12.083 0.829 -13.707 3 HB2 MET 1 1HB MET 1 -14.734 0.034 -12.753 4 HB3 MET 1 2HB MET 1 -14.794 0.999 -14.221 5 HG2 MET 1 1HG MET 1 -14.730 -1.405 -14.676 6 HG3 MET 1 2HG MET 1 -13.344 -0.553 -15.356 7 HE1 MET 1 3HE MET 1 -11.643 -3.727 -14.813 8 HE2 MET 1 1HE MET 1 -10.791 -2.192 -14.972 9 HE3 MET 1 2HE MET 1 -12.285 -2.467 -15.867 10 H GLY 2 H GLY 2 -12.160 2.562 -15.097 11 HA2 GLY 2 1HA GLY 2 -13.382 4.656 -15.695 12 HA3 GLY 2 2HA GLY 2 -13.322 5.043 -13.982 13 H GLU 3 H GLU 3 -12.382 6.893 -15.682 14 HA GLU 3 HA GLU 3 -9.547 6.919 -15.026 15 HB2 GLU 3 1HB GLU 3 -10.419 7.597 -17.832 16 HB3 GLU 3 2HB GLU 3 -8.783 7.385 -17.226 17 HG2 GLU 3 1HG GLU 3 -9.125 5.020 -16.975 18 HG3 GLU 3 2HG GLU 3 -10.826 5.184 -17.411 19 H ARG 4 H ARG 4 -8.943 9.257 -16.572 20 HA ARG 4 HA ARG 4 -9.023 11.524 -16.411 21 HE ARG 4 HE ARG 4 -10.829 13.950 -18.396 22 HB2 ARG 4 1HB ARG 4 -11.961 11.214 -15.801 23 HB3 ARG 4 2HB ARG 4 -11.155 12.596 -16.526 24 HG2 ARG 4 1HG ARG 4 -10.807 10.109 -18.028 25 HG3 ARG 4 2HG ARG 4 -12.487 10.615 -17.876 26 HD2 ARG 4 1HD ARG 4 -10.216 11.937 -19.287 27 HD3 ARG 4 2HD ARG 4 -11.883 11.702 -19.804 28 HH11 ARG 4 1HH1 ARG 4 -13.702 12.027 -18.872 29 HH12 ARG 4 2HH1 ARG 4 -14.783 13.309 -18.442 30 HH21 ARG 4 1HH2 ARG 4 -12.250 15.639 -17.830 31 HH22 ARG 4 2HH2 ARG 4 -13.959 15.359 -17.852 32 H GLY 5 H GLY 5 -8.861 9.710 -13.929 33 HA2 GLY 5 1HA GLY 5 -8.318 11.619 -12.014 34 HA3 GLY 5 2HA GLY 5 -10.020 11.236 -11.801 35 H VAL 6 H VAL 6 -9.578 8.430 -12.671 36 HA VAL 6 HA VAL 6 -8.321 7.464 -10.173 37 HB VAL 6 HB VAL 6 -9.775 5.516 -10.259 38 HG11 VAL 6 1HG1 VAL 6 -12.040 7.090 -10.416 39 HG12 VAL 6 2HG1 VAL 6 -10.765 8.234 -10.002 40 HG13 VAL 6 3HG1 VAL 6 -11.049 6.822 -8.984 41 HG21 VAL 6 3HG2 VAL 6 -10.019 5.988 -12.944 42 HG22 VAL 6 1HG2 VAL 6 -11.591 6.506 -12.331 43 HG23 VAL 6 2HG2 VAL 6 -11.013 4.871 -12.011 44 H GLU 7 H GLU 7 -6.386 7.773 -11.759 45 HA GLU 7 HA GLU 7 -5.629 5.119 -12.596 46 HB2 GLU 7 1HB GLU 7 -5.895 7.368 -14.590 47 HB3 GLU 7 2HB GLU 7 -4.906 5.944 -14.881 48 HG2 GLU 7 1HG GLU 7 -7.878 6.005 -14.428 49 HG3 GLU 7 2HG GLU 7 -7.046 5.690 -15.949 50 H MET 8 H MET 8 -4.654 6.683 -10.541 51 HA MET 8 HA MET 8 -2.071 7.661 -11.549 52 HB2 MET 8 1HB MET 8 -3.734 9.042 -10.008 53 HB3 MET 8 2HB MET 8 -2.930 8.135 -8.734 54 HG2 MET 8 1HG MET 8 -1.332 9.661 -8.751 55 HG3 MET 8 2HG MET 8 -0.872 9.085 -10.352 56 HE1 MET 8 3HE MET 8 -0.011 11.540 -9.491 57 HE2 MET 8 1HE MET 8 -1.233 12.694 -8.950 58 HE3 MET 8 2HE MET 8 -0.524 12.848 -10.558 59 H ARG 9 H ARG 9 -0.518 6.185 -11.466 60 HA ARG 9 HA ARG 9 -0.519 4.279 -9.223 61 HE ARG 9 HE ARG 9 4.321 2.877 -12.823 62 HB2 ARG 9 1HB ARG 9 0.411 2.664 -10.583 63 HB3 ARG 9 2HB ARG 9 -0.629 3.522 -11.710 64 HG2 ARG 9 1HG ARG 9 1.205 3.506 -13.003 65 HG3 ARG 9 2HG ARG 9 1.664 4.906 -12.031 66 HD2 ARG 9 1HD ARG 9 3.327 3.798 -10.998 67 HD3 ARG 9 2HD ARG 9 2.376 2.320 -10.845 68 HH11 ARG 9 1HH1 ARG 9 1.219 1.337 -12.393 69 HH12 ARG 9 2HH1 ARG 9 1.451 0.221 -13.697 70 HH21 ARG 9 1HH2 ARG 9 4.629 1.412 -14.538 71 HH22 ARG 9 2HH2 ARG 9 3.388 0.263 -14.916 72 H LEU 10 H LEU 10 1.298 3.853 -8.050 73 HA LEU 10 HA LEU 10 3.558 5.706 -8.434 74 HG LEU 10 HG LEU 10 1.028 4.571 -6.047 75 HB2 LEU 10 1HB LEU 10 3.549 4.843 -5.731 76 HB3 LEU 10 2HB LEU 10 3.351 6.466 -6.354 77 HD11 LEU 10 1HD1 LEU 10 2.231 6.481 -4.052 78 HD12 LEU 10 2HD1 LEU 10 1.875 4.767 -3.839 79 HD13 LEU 10 3HD1 LEU 10 0.558 5.936 -3.961 80 HD21 LEU 10 3HD2 LEU 10 -0.236 6.263 -6.771 81 HD22 LEU 10 1HD2 LEU 10 1.267 6.982 -7.350 82 HD23 LEU 10 2HD2 LEU 10 0.618 7.442 -5.775 83 H ARG 11 H ARG 11 5.623 4.874 -7.501 84 HA ARG 11 HA ARG 11 5.805 1.992 -8.022 85 HE ARG 11 HE ARG 11 9.459 0.385 -10.441 86 HB2 ARG 11 1HB ARG 11 7.251 4.124 -9.065 87 HB3 ARG 11 2HB ARG 11 8.349 3.403 -7.898 88 HG2 ARG 11 1HG ARG 11 6.989 1.973 -10.173 89 HG3 ARG 11 2HG ARG 11 8.682 2.461 -10.107 90 HD2 ARG 11 1HD ARG 11 8.498 1.042 -7.821 91 HD3 ARG 11 2HD ARG 11 7.301 0.202 -8.808 92 HH11 ARG 11 1HH1 ARG 11 8.987 -0.824 -7.201 93 HH12 ARG 11 2HH1 ARG 11 10.240 -2.012 -7.329 94 HH21 ARG 11 1HH2 ARG 11 11.105 -1.177 -10.610 95 HH22 ARG 11 2HH2 ARG 11 11.443 -2.213 -9.264 96 H ILE 12 H ILE 12 6.903 0.625 -6.611 97 HA ILE 12 HA ILE 12 8.021 1.733 -4.168 98 HB ILE 12 HB ILE 12 5.433 0.338 -4.282 99 HG12 ILE 12 1HG1 ILE 12 6.711 1.803 -1.981 100 HG13 ILE 12 2HG1 ILE 12 6.006 2.644 -3.359 101 HG21 ILE 12 1HG2 ILE 12 6.434 -1.575 -3.418 102 HG22 ILE 12 2HG2 ILE 12 5.879 -0.714 -1.984 103 HG23 ILE 12 3HG2 ILE 12 7.581 -0.655 -2.443 104 HD11 ILE 12 3HD1 ILE 12 3.848 1.912 -2.843 105 HD12 ILE 12 1HD1 ILE 12 4.560 2.352 -1.291 106 HD13 ILE 12 2HD1 ILE 12 4.439 0.655 -1.756 107 H ARG 13 H ARG 13 10.010 0.954 -4.496 108 HA ARG 13 HA ARG 13 10.319 -1.856 -5.273 109 HE ARG 13 HE ARG 13 13.061 2.722 -7.388 110 HB2 ARG 13 1HB ARG 13 12.712 -1.250 -5.644 111 HB3 ARG 13 2HB ARG 13 11.583 -0.356 -6.652 112 HG2 ARG 13 1HG ARG 13 11.766 1.565 -5.153 113 HG3 ARG 13 2HG ARG 13 12.888 0.661 -4.134 114 HD2 ARG 13 1HD ARG 13 14.222 2.042 -5.508 115 HD3 ARG 13 2HD ARG 13 14.351 0.419 -6.179 116 HH11 ARG 13 1HH1 ARG 13 13.579 -0.734 -7.477 117 HH12 ARG 13 2HH1 ARG 13 13.120 -0.881 -9.140 118 HH21 ARG 13 1HH2 ARG 13 12.456 2.522 -9.571 119 HH22 ARG 13 2HH2 ARG 13 12.483 0.964 -10.328 120 H PHE 14 H PHE 14 11.857 -3.195 -4.228 121 HA PHE 14 HA PHE 14 12.543 -2.476 -1.473 122 HD1 PHE 14 HD2 PHE 14 9.745 -2.199 -1.667 123 HD2 PHE 14 HD1 PHE 14 11.182 -5.256 0.925 124 HE1 PHE 14 HE2 PHE 14 8.318 -1.334 0.140 125 HE2 PHE 14 HE1 PHE 14 9.756 -4.394 2.733 126 HZ PHE 14 HZ PHE 14 8.322 -2.431 2.342 127 HB2 PHE 14 1HB PHE 14 10.789 -4.676 -2.388 128 HB3 PHE 14 2HB PHE 14 12.012 -5.135 -1.211 129 H GLU 15 H GLU 15 14.522 -3.185 -0.838 130 HA GLU 15 HA GLU 15 16.539 -3.661 -2.585 131 HB2 GLU 15 1HB GLU 15 16.186 -4.166 0.300 132 HB3 GLU 15 2HB GLU 15 17.444 -5.119 -0.465 133 HG2 GLU 15 1HG GLU 15 18.028 -2.840 0.591 134 HG3 GLU 15 2HG GLU 15 18.730 -3.290 -0.961 135 H SER 16 H SER 16 14.272 -6.043 -1.427 136 HA SER 16 HA SER 16 15.659 -8.062 -3.069 137 HG SER 16 HG SER 16 14.783 -10.661 -0.764 138 HB2 SER 16 1HB SER 16 15.904 -8.567 -0.675 139 HB3 SER 16 2HB SER 16 14.151 -8.547 -0.490 140 H ALA 17 H ALA 17 13.312 -6.173 -3.603 141 HA ALA 17 HA ALA 17 11.789 -8.012 -5.127 142 HB1 ALA 17 3HB ALA 17 10.072 -6.930 -2.937 143 HB2 ALA 17 1HB ALA 17 11.016 -8.397 -2.665 144 HB3 ALA 17 2HB ALA 17 9.831 -8.339 -3.969 145 H GLU 18 H GLU 18 10.245 -7.067 -6.473 146 HA GLU 18 HA GLU 18 10.007 -4.130 -6.331 147 HB2 GLU 18 1HB GLU 18 10.359 -5.569 -8.948 148 HB3 GLU 18 2HB GLU 18 10.504 -3.848 -8.620 149 HG2 GLU 18 1HG GLU 18 12.409 -6.028 -7.813 150 HG3 GLU 18 2HG GLU 18 12.684 -4.738 -8.983 151 H CYS 19 H CYS 19 8.026 -3.270 -6.875 152 HA CYS 19 HA CYS 19 6.079 -4.755 -8.367 153 HG CYS 19 HG CYS 19 7.048 -4.646 -4.715 154 HB2 CYS 19 1HB CYS 19 4.609 -4.376 -5.993 155 HB3 CYS 19 2HB CYS 19 5.069 -5.906 -6.730 156 H GLU 20 H GLU 20 4.221 -3.527 -8.919 157 HA GLU 20 HA GLU 20 4.394 -0.687 -8.131 158 HB2 GLU 20 1HB GLU 20 3.047 -1.493 -10.670 159 HB3 GLU 20 2HB GLU 20 3.909 -0.011 -10.284 160 HG2 GLU 20 1HG GLU 20 6.022 -1.417 -10.299 161 HG3 GLU 20 2HG GLU 20 5.042 -2.678 -11.047 162 H VAL 21 H VAL 21 2.356 0.478 -8.033 163 HA VAL 21 HA VAL 21 -0.056 -1.139 -7.873 164 HB VAL 21 HB VAL 21 -0.091 -1.323 -5.660 165 HG11 VAL 21 1HG1 VAL 21 2.354 0.427 -5.697 166 HG12 VAL 21 2HG1 VAL 21 2.265 -1.327 -5.528 167 HG13 VAL 21 3HG1 VAL 21 1.696 -0.285 -4.223 168 HG21 VAL 21 3HG2 VAL 21 -1.435 0.740 -5.769 169 HG22 VAL 21 1HG2 VAL 21 0.028 1.690 -5.505 170 HG23 VAL 21 2HG2 VAL 21 -0.551 0.595 -4.250 171 H GLU 22 H GLU 22 -1.884 -0.069 -8.355 172 HA GLU 22 HA GLU 22 -1.603 2.695 -9.247 173 HB2 GLU 22 1HB GLU 22 -3.804 0.662 -9.646 174 HB3 GLU 22 2HB GLU 22 -3.854 2.305 -10.271 175 HG2 GLU 22 1HG GLU 22 -2.667 1.733 -12.045 176 HG3 GLU 22 2HG GLU 22 -1.400 1.037 -11.037 177 H LEU 23 H LEU 23 -3.942 3.878 -8.983 178 HA LEU 23 HA LEU 23 -5.083 3.435 -6.375 179 HG LEU 23 HG LEU 23 -5.475 6.714 -6.223 180 HB2 LEU 23 1HB LEU 23 -3.358 4.696 -5.495 181 HB3 LEU 23 2HB LEU 23 -3.206 5.689 -6.927 182 HD11 LEU 23 1HD1 LEU 23 -4.803 5.019 -3.884 183 HD12 LEU 23 2HD1 LEU 23 -6.374 5.524 -4.509 184 HD13 LEU 23 3HD1 LEU 23 -5.402 6.645 -3.558 185 HD21 LEU 23 3HD2 LEU 23 -2.873 7.147 -4.781 186 HD22 LEU 23 1HD2 LEU 23 -4.273 8.197 -4.561 187 HD23 LEU 23 2HD2 LEU 23 -3.528 8.040 -6.154 188 H TYR 24 H TYR 24 -7.059 4.437 -6.079 189 HA TYR 24 HA TYR 24 -8.069 5.990 -8.369 190 HD1 TYR 24 HD2 TYR 24 -7.813 4.774 -9.984 191 HD2 TYR 24 HD1 TYR 24 -9.810 1.701 -7.824 192 HE1 TYR 24 HE2 TYR 24 -7.033 3.119 -11.628 193 HE2 TYR 24 HE1 TYR 24 -9.034 0.038 -9.460 194 HH TYR 24 HH TYR 24 -8.073 0.622 -12.362 195 HB2 TYR 24 1HB TYR 24 -9.605 3.843 -6.875 196 HB3 TYR 24 2HB TYR 24 -10.232 4.845 -8.178 197 H GLU 25 H GLU 25 -9.577 7.596 -7.935 198 HA GLU 25 HA GLU 25 -9.255 9.014 -5.562 199 HB2 GLU 25 1HB GLU 25 -11.488 9.174 -7.585 200 HB3 GLU 25 2HB GLU 25 -11.251 10.333 -6.283 201 HG2 GLU 25 1HG GLU 25 -9.439 11.291 -7.274 202 HG3 GLU 25 2HG GLU 25 -8.960 9.807 -8.098 203 H GLU 26 H GLU 26 -11.097 6.201 -5.912 204 HA GLU 26 HA GLU 26 -13.398 6.549 -4.506 205 HB2 GLU 26 1HB GLU 26 -13.331 4.246 -3.936 206 HB3 GLU 26 2HB GLU 26 -12.505 4.397 -5.480 207 HG2 GLU 26 1HG GLU 26 -10.341 4.418 -4.194 208 HG3 GLU 26 2HG GLU 26 -11.280 3.985 -2.767 209 H TRP 27 H TRP 27 -10.156 6.713 -3.243 210 HA TRP 27 HA TRP 27 -10.974 6.590 -0.482 211 HD1 TRP 27 HD1 TRP 27 -10.020 8.064 1.370 212 HE1 TRP 27 HE1 TRP 27 -8.269 8.729 3.136 213 HE3 TRP 27 HE3 TRP 27 -5.799 6.501 -1.047 214 HZ2 TRP 27 HZ2 TRP 27 -5.466 8.602 3.461 215 HZ3 TRP 27 HZ3 TRP 27 -3.622 6.807 0.059 216 HH2 TRP 27 HH2 TRP 27 -3.461 7.836 2.268 217 HB2 TRP 27 1HB TRP 27 -8.777 5.753 -0.979 218 HB3 TRP 27 2HB TRP 27 -8.344 7.227 -1.839 219 H ALA 28 H ALA 28 -9.575 9.104 -2.607 220 HA ALA 28 HA ALA 28 -11.259 11.145 -2.298 221 HB1 ALA 28 3HB ALA 28 -10.174 12.470 -0.329 222 HB2 ALA 28 1HB ALA 28 -9.710 10.868 0.244 223 HB3 ALA 28 2HB ALA 28 -11.412 11.260 0.002 224 HA PRO 29 HA PRO 29 -7.958 12.434 -5.115 225 HB2 PRO 29 1HB PRO 29 -9.598 14.916 -4.838 226 HB3 PRO 29 2HB PRO 29 -8.943 14.155 -6.291 227 HG2 PRO 29 1HG PRO 29 -11.533 13.909 -5.579 228 HG3 PRO 29 2HG PRO 29 -10.651 12.634 -6.434 229 HD2 PRO 29 1HD PRO 29 -11.609 12.698 -3.659 230 HD3 PRO 29 2HD PRO 29 -11.128 11.315 -4.657 231 H GLU 30 H GLU 30 -9.046 14.131 -2.216 232 HA GLU 30 HA GLU 30 -6.929 16.015 -2.116 233 HB2 GLU 30 1HB GLU 30 -8.905 14.996 -0.093 234 HB3 GLU 30 2HB GLU 30 -7.595 16.057 0.399 235 HG2 GLU 30 1HG GLU 30 -9.021 17.083 -1.915 236 HG3 GLU 30 2HG GLU 30 -10.075 16.824 -0.529 237 H THR 31 H THR 31 -7.363 12.813 -0.662 238 HA THR 31 HA THR 31 -4.938 12.894 0.845 239 HB THR 31 HB THR 31 -5.494 10.189 0.308 240 HG1 THR 31 HG1 THR 31 -7.446 10.738 -0.644 241 HG21 THR 31 3HG2 THR 31 -6.153 12.011 2.586 242 HG22 THR 31 1HG2 THR 31 -4.998 10.679 2.508 243 HG23 THR 31 2HG2 THR 31 -6.729 10.344 2.567 244 H VAL 32 H VAL 32 -5.783 11.523 -2.314 245 HA VAL 32 HA VAL 32 -3.464 10.231 -2.993 246 HB VAL 32 HB VAL 32 -5.060 11.968 -4.880 247 HG11 VAL 32 1HG1 VAL 32 -2.988 9.884 -5.219 248 HG12 VAL 32 2HG1 VAL 32 -3.350 11.299 -6.207 249 HG13 VAL 32 3HG1 VAL 32 -4.347 9.850 -6.340 250 HG21 VAL 32 3HG2 VAL 32 -6.057 9.511 -5.274 251 HG22 VAL 32 1HG2 VAL 32 -6.762 10.670 -4.146 252 HG23 VAL 32 2HG2 VAL 32 -5.688 9.404 -3.553 253 H ARG 33 H ARG 33 -4.085 13.682 -2.933 254 HA ARG 33 HA ARG 33 -1.904 14.593 -4.412 255 HE ARG 33 HE ARG 33 -0.769 19.267 -3.422 256 HB2 ARG 33 1HB ARG 33 -3.895 15.908 -3.436 257 HB3 ARG 33 2HB ARG 33 -2.926 16.034 -1.977 258 HG2 ARG 33 1HG ARG 33 -1.107 17.021 -3.461 259 HG3 ARG 33 2HG ARG 33 -2.360 17.169 -4.696 260 HD2 ARG 33 1HD ARG 33 -3.588 18.699 -3.440 261 HD3 ARG 33 2HD ARG 33 -2.780 18.255 -1.936 262 HH11 ARG 33 1HH1 ARG 33 -3.940 20.469 -2.596 263 HH12 ARG 33 2HH1 ARG 33 -3.460 22.132 -2.649 264 HH21 ARG 33 1HH2 ARG 33 -0.136 21.454 -3.491 265 HH22 ARG 33 2HH2 ARG 33 -1.301 22.691 -3.157 266 H ALA 34 H ALA 34 -2.117 13.620 -1.029 267 HA ALA 34 HA ALA 34 0.451 14.537 -0.254 268 HB1 ALA 34 3HB ALA 34 -0.552 14.075 1.682 269 HB2 ALA 34 1HB ALA 34 -0.072 12.402 1.402 270 HB3 ALA 34 2HB ALA 34 -1.680 12.949 0.930 271 H ILE 35 H ILE 35 -0.702 11.338 -1.290 272 HA ILE 35 HA ILE 35 1.690 9.932 -1.046 273 HB ILE 35 HB ILE 35 0.272 9.233 -3.517 274 HG12 ILE 35 1HG1 ILE 35 -1.644 10.194 -2.305 275 HG13 ILE 35 2HG1 ILE 35 -1.786 8.446 -2.454 276 HG21 ILE 35 1HG2 ILE 35 0.166 7.031 -2.335 277 HG22 ILE 35 2HG2 ILE 35 0.969 7.802 -0.967 278 HG23 ILE 35 3HG2 ILE 35 1.787 7.701 -2.526 279 HD11 ILE 35 3HD1 ILE 35 -0.626 9.684 0.008 280 HD12 ILE 35 1HD1 ILE 35 -1.360 8.094 -0.201 281 HD13 ILE 35 2HD1 ILE 35 -2.370 9.540 -0.213 282 H ALA 36 H ALA 36 0.432 11.729 -3.900 283 HA ALA 36 HA ALA 36 2.690 11.348 -5.540 284 HB1 ALA 36 3HB ALA 36 0.240 12.407 -5.931 285 HB2 ALA 36 1HB ALA 36 1.593 12.616 -7.042 286 HB3 ALA 36 2HB ALA 36 1.214 13.876 -5.868 287 H ASP 37 H ASP 37 2.004 13.591 -2.947 288 HA ASP 37 HA ASP 37 4.111 15.422 -3.566 289 HB2 ASP 37 1HB ASP 37 2.030 15.738 -2.021 290 HB3 ASP 37 2HB ASP 37 3.057 15.018 -0.783 291 H ALA 38 H ALA 38 3.948 12.369 -1.955 292 HA ALA 38 HA ALA 38 6.607 12.653 -0.800 293 HB1 ALA 38 3HB ALA 38 4.382 11.635 0.277 294 HB2 ALA 38 1HB ALA 38 6.001 11.086 0.723 295 HB3 ALA 38 2HB ALA 38 5.046 10.168 -0.442 296 H LEU 39 H LEU 39 6.857 12.615 -3.470 297 HA LEU 39 HA LEU 39 7.031 10.066 -4.679 298 HG LEU 39 HG LEU 39 6.334 13.263 -5.705 299 HB2 LEU 39 1HB LEU 39 8.549 12.585 -5.390 300 HB3 LEU 39 2HB LEU 39 8.347 11.181 -6.413 301 HD11 LEU 39 1HD1 LEU 39 7.037 13.808 -7.766 302 HD12 LEU 39 2HD1 LEU 39 5.942 12.523 -8.277 303 HD13 LEU 39 3HD1 LEU 39 7.664 12.192 -8.092 304 HD21 LEU 39 3HD2 LEU 39 4.633 11.705 -6.795 305 HD22 LEU 39 1HD2 LEU 39 5.073 11.351 -5.126 306 HD23 LEU 39 2HD2 LEU 39 5.758 10.400 -6.437 307 HA PRO 40 HA PRO 40 11.190 8.235 -4.156 308 HB2 PRO 40 1HB PRO 40 12.644 10.739 -4.936 309 HB3 PRO 40 2HB PRO 40 13.097 9.048 -5.202 310 HG2 PRO 40 1HG PRO 40 11.894 10.545 -7.111 311 HG3 PRO 40 2HG PRO 40 11.661 8.796 -6.971 312 HD2 PRO 40 1HD PRO 40 9.759 10.938 -6.513 313 HD3 PRO 40 2HD PRO 40 9.466 9.196 -6.602 314 H ILE 41 H ILE 41 11.034 8.038 -2.015 315 HA ILE 41 HA ILE 41 12.544 9.903 -0.369 316 HB ILE 41 HB ILE 41 9.625 9.270 0.087 317 HG12 ILE 41 1HG1 ILE 41 11.235 11.837 0.079 318 HG13 ILE 41 2HG1 ILE 41 10.093 11.316 -1.151 319 HG21 ILE 41 1HG2 ILE 41 11.619 10.262 2.128 320 HG22 ILE 41 2HG2 ILE 41 10.736 8.737 2.170 321 HG23 ILE 41 3HG2 ILE 41 9.868 10.259 2.344 322 HD11 ILE 41 3HD1 ILE 41 8.400 12.226 -0.047 323 HD12 ILE 41 1HD1 ILE 41 9.586 12.940 1.044 324 HD13 ILE 41 2HD1 ILE 41 8.842 11.392 1.443 325 H LYS 42 H LYS 42 13.313 8.935 1.580 326 HA LYS 42 HA LYS 42 13.550 6.062 1.348 327 HB2 LYS 42 1HB LYS 42 15.039 8.214 2.644 328 HB3 LYS 42 2HB LYS 42 14.923 6.767 3.632 329 HG2 LYS 42 1HG LYS 42 16.375 5.655 2.366 330 HG3 LYS 42 2HG LYS 42 15.598 6.176 0.870 331 HD2 LYS 42 1HD LYS 42 17.463 7.375 0.540 332 HD3 LYS 42 2HD LYS 42 16.789 8.485 1.737 333 HE2 LYS 42 1HE LYS 42 19.026 8.012 2.392 334 HE3 LYS 42 2HE LYS 42 17.961 7.148 3.502 335 HZ1 LYS 42 3HZ LYS 42 20.028 6.019 2.276 336 HZ2 LYS 42 1HZ LYS 42 18.814 5.671 1.149 337 HZ3 LYS 42 2HZ LYS 42 18.654 5.157 2.752 338 H SER 43 H SER 43 12.740 4.552 2.672 339 HA SER 43 HA SER 43 11.406 5.311 5.145 340 HG SER 43 HG SER 43 9.515 3.370 2.233 341 HB2 SER 43 1HB SER 43 9.296 4.552 4.595 342 HB3 SER 43 2HB SER 43 9.797 5.260 3.064 343 H THR 44 H THR 44 11.177 3.586 6.628 344 HA THR 44 HA THR 44 12.895 1.274 5.993 345 HB THR 44 HB THR 44 11.993 1.597 8.776 346 HG1 THR 44 HG1 THR 44 13.369 3.389 9.132 347 HG21 THR 44 3HG2 THR 44 14.326 0.665 7.357 348 HG22 THR 44 1HG2 THR 44 13.794 0.330 9.005 349 HG23 THR 44 2HG2 THR 44 14.756 1.768 8.666 350 H ALA 45 H ALA 45 12.006 -0.629 5.632 351 HA ALA 45 HA ALA 45 9.170 -0.995 5.960 352 HB1 ALA 45 3HB ALA 45 9.496 -2.175 4.111 353 HB2 ALA 45 1HB ALA 45 10.273 -3.412 5.097 354 HB3 ALA 45 2HB ALA 45 11.242 -2.150 4.343 355 H ASN 46 H ASN 46 8.103 -2.198 7.341 356 HA ASN 46 HA ASN 46 9.619 -3.660 9.399 357 HB2 ASN 46 1HB ASN 46 7.214 -1.966 9.476 358 HB3 ASN 46 2HB ASN 46 7.045 -3.482 10.357 359 HD21 ASN 46 1HD2 ASN 46 7.197 -0.708 11.306 360 HD22 ASN 46 2HD2 ASN 46 8.512 -0.671 12.428 361 H ARG 47 H ARG 47 9.432 -5.884 9.375 362 HA ARG 47 HA ARG 47 7.624 -7.028 7.425 363 HE ARG 47 HE ARG 47 7.502 -9.708 7.291 364 HB2 ARG 47 1HB ARG 47 10.113 -7.807 8.719 365 HB3 ARG 47 2HB ARG 47 8.970 -9.136 8.586 366 HG2 ARG 47 1HG ARG 47 9.102 -7.629 6.128 367 HG3 ARG 47 2HG ARG 47 10.698 -8.186 6.618 368 HD2 ARG 47 1HD ARG 47 9.133 -9.688 5.145 369 HD3 ARG 47 2HD ARG 47 10.151 -10.393 6.396 370 HH11 ARG 47 1HH1 ARG 47 9.484 -12.160 5.792 371 HH12 ARG 47 2HH1 ARG 47 8.443 -13.463 6.257 372 HH21 ARG 47 1HH2 ARG 47 6.135 -11.426 7.904 373 HH22 ARG 47 2HH2 ARG 47 6.542 -13.046 7.455 374 H TRP 48 H TRP 48 5.912 -8.318 7.786 375 HA TRP 48 HA TRP 48 5.336 -9.366 10.426 376 HD1 TRP 48 HD1 TRP 48 1.575 -9.477 9.013 377 HE1 TRP 48 HE1 TRP 48 -0.049 -10.203 10.878 378 HE3 TRP 48 HE3 TRP 48 3.946 -7.343 13.007 379 HZ2 TRP 48 HZ2 TRP 48 -0.279 -9.898 13.687 380 HZ3 TRP 48 HZ3 TRP 48 2.960 -7.606 15.246 381 HH2 TRP 48 HH2 TRP 48 0.890 -8.856 15.576 382 HB2 TRP 48 1HB TRP 48 4.270 -7.183 10.587 383 HB3 TRP 48 2HB TRP 48 3.464 -7.422 9.040 384 H GLY 49 H GLY 49 3.851 -11.106 10.365 385 HA2 GLY 49 1HA GLY 49 3.954 -12.897 8.362 386 HA3 GLY 49 2HA GLY 49 2.539 -12.757 9.393 387 H ASP 50 H ASP 50 3.915 -12.064 6.289 388 HA ASP 50 HA ASP 50 2.913 -11.788 4.256 389 HB2 ASP 50 1HB ASP 50 1.005 -13.122 5.027 390 HB3 ASP 50 2HB ASP 50 0.304 -11.696 5.777 391 H GLU 51 H GLU 51 1.709 -9.706 6.866 392 HA GLU 51 HA GLU 51 1.302 -7.493 5.061 393 HB2 GLU 51 1HB GLU 51 0.452 -8.196 7.690 394 HB3 GLU 51 2HB GLU 51 1.263 -6.640 7.777 395 HG2 GLU 51 1HG GLU 51 -0.374 -6.448 5.542 396 HG3 GLU 51 2HG GLU 51 -1.341 -7.311 6.735 397 H ILE 52 H ILE 52 2.378 -5.492 5.180 398 HA ILE 52 HA ILE 52 4.835 -5.274 6.694 399 HB ILE 52 HB ILE 52 4.808 -5.838 3.783 400 HG12 ILE 52 1HG1 ILE 52 7.372 -6.145 5.010 401 HG13 ILE 52 2HG1 ILE 52 6.162 -6.725 6.147 402 HG21 ILE 52 1HG2 ILE 52 5.455 -3.539 3.630 403 HG22 ILE 52 2HG2 ILE 52 6.888 -4.536 3.390 404 HG23 ILE 52 3HG2 ILE 52 6.626 -3.729 4.936 405 HD11 ILE 52 3HD1 ILE 52 5.334 -8.303 4.501 406 HD12 ILE 52 1HD1 ILE 52 7.069 -8.502 4.733 407 HD13 ILE 52 2HD1 ILE 52 6.466 -7.673 3.300 408 H TYR 53 H TYR 53 4.746 -3.276 7.501 409 HA TYR 53 HA TYR 53 3.635 -1.148 5.789 410 HD1 TYR 53 HD1 TYR 53 4.570 0.167 9.552 411 HD2 TYR 53 HD2 TYR 53 2.138 -3.315 9.222 412 HE1 TYR 53 HE1 TYR 53 5.189 -0.479 11.839 413 HE2 TYR 53 HE2 TYR 53 2.756 -3.966 11.508 414 HH TYR 53 HH TYR 53 4.945 -3.381 13.063 415 HB2 TYR 53 1HB TYR 53 2.704 -0.066 7.811 416 HB3 TYR 53 2HB TYR 53 2.029 -1.672 7.543 417 H PHE 54 H PHE 54 4.582 0.802 5.751 418 HA PHE 54 HA PHE 54 6.871 1.310 7.496 419 HD1 PHE 54 HD2 PHE 54 6.791 3.777 4.486 420 HD2 PHE 54 HD1 PHE 54 7.056 -0.295 3.286 421 HE1 PHE 54 HE2 PHE 54 6.014 4.390 2.238 422 HE2 PHE 54 HE1 PHE 54 6.278 0.312 1.038 423 HZ PHE 54 HZ PHE 54 5.755 2.658 0.509 424 HB2 PHE 54 1HB PHE 54 8.317 1.919 5.660 425 HB3 PHE 54 2HB PHE 54 7.747 0.277 5.406 426 H THR 55 H THR 55 7.285 3.492 7.865 427 HA THR 55 HA THR 55 5.084 5.279 7.112 428 HB THR 55 HB THR 55 7.310 6.215 8.861 429 HG1 THR 55 HG1 THR 55 7.131 4.347 9.887 430 HG21 THR 55 3HG2 THR 55 4.413 6.671 8.587 431 HG22 THR 55 1HG2 THR 55 5.712 7.793 8.987 432 HG23 THR 55 2HG2 THR 55 5.068 6.715 10.224 433 H THR 56 H THR 56 5.444 7.318 6.120 434 HA THR 56 HA THR 56 8.062 7.561 4.782 435 HB THR 56 HB THR 56 6.179 8.830 3.145 436 HG1 THR 56 HG1 THR 56 4.577 7.604 4.281 437 HG21 THR 56 3HG2 THR 56 6.618 6.277 2.080 438 HG22 THR 56 1HG2 THR 56 8.095 6.719 2.939 439 HG23 THR 56 2HG2 THR 56 7.453 7.779 1.680 440 H GLN 57 H GLN 57 6.288 8.931 7.082 441 HA GLN 57 HA GLN 57 6.593 10.932 8.163 442 HB2 GLN 57 1HB GLN 57 7.866 12.166 5.727 443 HB3 GLN 57 2HB GLN 57 8.065 12.607 7.418 444 HG2 GLN 57 1HG GLN 57 8.901 9.902 7.062 445 HG3 GLN 57 2HG GLN 57 9.683 10.920 5.854 446 HE21 GLN 57 1HE2 GLN 57 11.614 10.280 7.070 447 HE22 GLN 57 2HE2 GLN 57 12.065 11.211 8.452 448 H VAL 58 H VAL 58 4.882 10.400 5.325 449 HA VAL 58 HA VAL 58 3.676 13.035 5.213 450 HB VAL 58 HB VAL 58 3.980 11.788 3.119 451 HG11 VAL 58 1HG1 VAL 58 2.732 9.809 2.593 452 HG12 VAL 58 2HG1 VAL 58 1.912 9.854 4.154 453 HG13 VAL 58 3HG1 VAL 58 3.643 9.520 4.076 454 HG21 VAL 58 3HG2 VAL 58 1.133 12.330 3.933 455 HG22 VAL 58 1HG2 VAL 58 1.628 11.990 2.276 456 HG23 VAL 58 2HG2 VAL 58 2.249 13.415 3.105 457 H ALA 59 H ALA 59 2.147 13.622 6.604 458 HA ALA 59 HA ALA 59 0.521 11.509 7.850 459 HB1 ALA 59 3HB ALA 59 0.809 14.306 8.910 460 HB2 ALA 59 1HB ALA 59 1.953 13.020 9.300 461 HB3 ALA 59 2HB ALA 59 0.257 12.860 9.752 462 H VAL 60 H VAL 60 -1.141 11.280 6.434 463 HA VAL 60 HA VAL 60 -2.928 13.614 6.150 464 HB VAL 60 HB VAL 60 -2.008 13.146 3.965 465 HG11 VAL 60 1HG1 VAL 60 -1.359 10.773 4.528 466 HG12 VAL 60 2HG1 VAL 60 -2.000 11.028 2.907 467 HG13 VAL 60 3HG1 VAL 60 -3.022 10.317 4.153 468 HG21 VAL 60 3HG2 VAL 60 -4.323 13.770 3.918 469 HG22 VAL 60 1HG2 VAL 60 -4.826 12.111 4.249 470 HG23 VAL 60 2HG2 VAL 60 -4.065 12.513 2.709 471 H GLU 61 H GLU 61 -4.533 13.219 7.604 472 HA GLU 61 HA GLU 61 -5.787 10.555 7.501 473 HB2 GLU 61 1HB GLU 61 -4.499 11.816 9.726 474 HB3 GLU 61 2HB GLU 61 -6.213 11.646 10.083 475 HG2 GLU 61 1HG GLU 61 -6.034 9.241 9.481 476 HG3 GLU 61 2HG GLU 61 -4.293 9.462 9.316 477 H LYS 62 H LYS 62 -7.949 10.477 7.405 478 HA LYS 62 HA LYS 62 -9.597 12.723 8.153 479 HB2 LYS 62 1HB LYS 62 -8.940 13.445 5.929 480 HB3 LYS 62 2HB LYS 62 -9.364 11.878 5.255 481 HG2 LYS 62 1HG LYS 62 -11.666 12.267 5.520 482 HG3 LYS 62 2HG LYS 62 -11.392 13.639 6.596 483 HD2 LYS 62 1HD LYS 62 -11.948 14.654 4.579 484 HD3 LYS 62 2HD LYS 62 -10.184 14.694 4.574 485 HE2 LYS 62 1HE LYS 62 -10.571 12.330 3.380 486 HE3 LYS 62 2HE LYS 62 -12.061 13.138 2.896 487 HZ1 LYS 62 3HZ LYS 62 -10.764 13.886 1.237 488 HZ2 LYS 62 1HZ LYS 62 -9.322 13.664 2.093 489 HZ3 LYS 62 2HZ LYS 62 -10.270 15.035 2.374 490 H GLU 63 H GLU 63 -11.968 12.178 7.813 491 HA GLU 63 HA GLU 63 -12.345 9.335 8.361 492 HB2 GLU 63 1HB GLU 63 -14.531 11.375 8.520 493 HB3 GLU 63 2HB GLU 63 -14.334 9.893 9.440 494 HG2 GLU 63 1HG GLU 63 -13.772 11.360 11.059 495 HG3 GLU 63 2HG GLU 63 -12.183 11.186 10.315 496 H GLU 64 H GLU 64 -12.245 8.432 6.313 497 HA GLU 64 HA GLU 64 -14.670 8.407 4.851 498 HB2 GLU 64 1HB GLU 64 -14.100 10.416 3.814 499 HB3 GLU 64 2HB GLU 64 -12.385 10.035 3.791 500 HG2 GLU 64 1HG GLU 64 -12.522 8.890 1.848 501 HG3 GLU 64 2HG GLU 64 -14.147 8.298 2.179 502 H ASN 65 H ASN 65 -14.698 6.755 3.206 503 HA ASN 65 HA ASN 65 -14.084 4.808 2.208 504 HB2 ASN 65 1HB ASN 65 -12.045 6.242 1.563 505 HB3 ASN 65 2HB ASN 65 -11.199 5.410 2.866 506 HD21 ASN 65 1HD2 ASN 65 -10.148 5.143 0.468 507 HD22 ASN 65 2HD2 ASN 65 -10.462 3.585 -0.207 508 H SER 66 H SER 66 -11.418 4.924 4.518 509 HA SER 66 HA SER 66 -10.687 3.127 5.843 510 HG SER 66 HG SER 66 -11.428 5.761 7.632 511 HB2 SER 66 1HB SER 66 -13.028 4.549 7.058 512 HB3 SER 66 2HB SER 66 -12.257 3.227 7.937 513 H LYS 67 H LYS 67 -11.139 1.248 4.454 514 HA LYS 67 HA LYS 67 -13.583 -0.209 5.218 515 HB2 LYS 67 1HB LYS 67 -13.001 -1.755 3.308 516 HB3 LYS 67 2HB LYS 67 -13.463 -0.128 2.848 517 HG2 LYS 67 1HG LYS 67 -11.679 -0.561 1.474 518 HG3 LYS 67 2HG LYS 67 -10.916 0.325 2.789 519 HD2 LYS 67 1HD LYS 67 -10.372 -1.927 3.813 520 HD3 LYS 67 2HD LYS 67 -10.912 -2.646 2.299 521 HE2 LYS 67 1HE LYS 67 -9.220 -1.428 1.079 522 HE3 LYS 67 2HE LYS 67 -8.726 -0.589 2.546 523 HZ1 LYS 67 3HZ LYS 67 -8.655 -3.424 2.866 524 HZ2 LYS 67 1HZ LYS 67 -7.437 -2.285 3.128 525 HZ3 LYS 67 2HZ LYS 67 -7.675 -2.921 1.583 526 H ASP 68 H ASP 68 -13.409 -2.543 5.660 527 HA ASP 68 HA ASP 68 -10.814 -3.186 6.923 528 HB2 ASP 68 1HB ASP 68 -12.227 -4.579 8.529 529 HB3 ASP 68 2HB ASP 68 -12.314 -2.830 8.704 530 H VAL 69 H VAL 69 -12.897 -4.137 4.468 531 HA VAL 69 HA VAL 69 -11.732 -6.844 4.536 532 HB VAL 69 HB VAL 69 -14.221 -6.771 5.101 533 HG11 VAL 69 1HG1 VAL 69 -15.006 -6.791 2.306 534 HG12 VAL 69 2HG1 VAL 69 -14.387 -5.221 2.818 535 HG13 VAL 69 3HG1 VAL 69 -15.736 -5.959 3.680 536 HG21 VAL 69 3HG2 VAL 69 -14.495 -8.876 4.247 537 HG22 VAL 69 1HG2 VAL 69 -12.749 -8.695 4.081 538 HG23 VAL 69 2HG2 VAL 69 -13.798 -8.455 2.683 539 H VAL 70 H VAL 70 -11.039 -7.701 2.603 540 HA VAL 70 HA VAL 70 -11.598 -6.376 0.096 541 HB VAL 70 HB VAL 70 -9.260 -5.863 -0.457 542 HG11 VAL 70 1HG1 VAL 70 -9.137 -3.791 0.691 543 HG12 VAL 70 2HG1 VAL 70 -10.066 -4.420 2.053 544 HG13 VAL 70 3HG1 VAL 70 -10.847 -4.170 0.493 545 HG21 VAL 70 3HG2 VAL 70 -7.490 -5.897 1.108 546 HG22 VAL 70 1HG2 VAL 70 -8.281 -7.466 1.272 547 HG23 VAL 70 2HG2 VAL 70 -8.579 -6.191 2.457 548 H GLU 71 H GLU 71 -10.673 -7.459 -1.761 549 HA GLU 71 HA GLU 71 -10.419 -10.317 -1.292 550 HB2 GLU 71 1HB GLU 71 -10.334 -9.085 -4.034 551 HB3 GLU 71 2HB GLU 71 -10.940 -10.658 -3.541 552 HG2 GLU 71 1HG GLU 71 -12.915 -9.793 -2.711 553 HG3 GLU 71 2HG GLU 71 -12.279 -8.153 -2.628 554 H LEU 72 H LEU 72 -8.785 -11.603 -2.121 555 HA LEU 72 HA LEU 72 -6.194 -10.876 -1.583 556 HG LEU 72 HG LEU 72 -4.514 -12.373 -3.263 557 HB2 LEU 72 1HB LEU 72 -6.966 -13.194 -1.817 558 HB3 LEU 72 2HB LEU 72 -7.160 -12.970 -3.542 559 HD11 LEU 72 1HD1 LEU 72 -4.771 -13.040 -0.808 560 HD12 LEU 72 2HD1 LEU 72 -3.469 -13.800 -1.723 561 HD13 LEU 72 3HD1 LEU 72 -4.955 -14.690 -1.402 562 HD21 LEU 72 3HD2 LEU 72 -4.101 -14.535 -4.217 563 HD22 LEU 72 1HD2 LEU 72 -5.618 -13.912 -4.867 564 HD23 LEU 72 2HD2 LEU 72 -5.640 -15.147 -3.609 565 H GLY 73 H GLY 73 -4.671 -9.671 -2.572 566 HA2 GLY 73 1HA GLY 73 -3.393 -9.276 -4.628 567 HA3 GLY 73 2HA GLY 73 -4.920 -9.264 -5.490 568 H ASP 74 H ASP 74 -6.255 -7.572 -3.497 569 HA ASP 74 HA ASP 74 -5.576 -5.071 -4.629 570 HB2 ASP 74 1HB ASP 74 -7.411 -4.201 -3.475 571 HB3 ASP 74 2HB ASP 74 -7.844 -5.887 -3.727 572 H VAL 75 H VAL 75 -5.094 -3.101 -3.394 573 HA VAL 75 HA VAL 75 -3.202 -3.605 -1.168 574 HB VAL 75 HB VAL 75 -2.964 -1.370 -3.209 575 HG11 VAL 75 1HG1 VAL 75 -1.928 -1.072 -0.917 576 HG12 VAL 75 2HG1 VAL 75 -0.841 -0.913 -2.295 577 HG13 VAL 75 3HG1 VAL 75 -0.835 -2.395 -1.338 578 HG21 VAL 75 3HG2 VAL 75 -2.473 -4.067 -3.669 579 HG22 VAL 75 1HG2 VAL 75 -0.885 -3.373 -3.340 580 HG23 VAL 75 2HG2 VAL 75 -1.891 -2.704 -4.622 581 H ALA 76 H ALA 76 -3.118 -1.870 0.519 582 HA ALA 76 HA ALA 76 -5.126 0.210 0.286 583 HB1 ALA 76 3HB ALA 76 -5.402 -2.119 2.110 584 HB2 ALA 76 1HB ALA 76 -6.627 -1.272 1.169 585 HB3 ALA 76 2HB ALA 76 -5.984 -0.543 2.640 586 H TYR 77 H TYR 77 -4.859 1.961 1.675 587 HA TYR 77 HA TYR 77 -2.283 2.019 3.080 588 HD1 TYR 77 HD1 TYR 77 -5.486 4.741 3.497 589 HD2 TYR 77 HD2 TYR 77 -1.306 5.519 3.523 590 HE1 TYR 77 HE1 TYR 77 -5.839 6.568 5.103 591 HE2 TYR 77 HE2 TYR 77 -1.647 7.343 5.127 592 HH TYR 77 HH TYR 77 -3.546 7.856 6.951 593 HB2 TYR 77 1HB TYR 77 -2.164 3.994 1.992 594 HB3 TYR 77 2HB TYR 77 -3.879 3.979 1.611 595 H TRP 78 H TRP 78 -2.150 2.106 5.257 596 HA TRP 78 HA TRP 78 -4.501 1.667 6.808 597 HD1 TRP 78 HD1 TRP 78 -5.270 1.656 8.794 598 HE1 TRP 78 HE1 TRP 78 -5.502 0.522 11.091 599 HE3 TRP 78 HE3 TRP 78 -0.386 0.349 9.548 600 HZ2 TRP 78 HZ2 TRP 78 -3.836 -0.765 12.972 601 HZ3 TRP 78 HZ3 TRP 78 0.211 -0.833 11.621 602 HH2 TRP 78 HH2 TRP 78 -1.479 -1.378 13.297 603 HB2 TRP 78 1HB TRP 78 -2.054 0.893 7.255 604 HB3 TRP 78 2HB TRP 78 -1.874 2.468 8.017 605 H ILE 79 H ILE 79 -5.873 3.136 7.623 606 HA ILE 79 HA ILE 79 -5.434 5.919 7.300 607 HB ILE 79 HB ILE 79 -7.582 4.308 8.635 608 HG12 ILE 79 1HG1 ILE 79 -7.142 5.507 6.065 609 HG13 ILE 79 2HG1 ILE 79 -8.444 4.446 6.581 610 HG21 ILE 79 1HG2 ILE 79 -7.347 6.196 10.108 611 HG22 ILE 79 2HG2 ILE 79 -8.796 6.409 9.126 612 HG23 ILE 79 3HG2 ILE 79 -7.330 7.307 8.737 613 HD11 ILE 79 3HD1 ILE 79 -9.448 6.410 5.748 614 HD12 ILE 79 1HD1 ILE 79 -8.360 7.446 6.669 615 HD13 ILE 79 2HD1 ILE 79 -9.587 6.493 7.502 616 HA PRO 80 HA PRO 80 -4.944 6.265 12.069 617 HB2 PRO 80 1HB PRO 80 -4.897 3.988 13.554 618 HB3 PRO 80 2HB PRO 80 -6.384 4.874 13.196 619 HG2 PRO 80 1HG PRO 80 -5.261 2.441 11.860 620 HG3 PRO 80 2HG PRO 80 -6.934 2.778 12.346 621 HD2 PRO 80 1HD PRO 80 -6.104 3.058 9.797 622 HD3 PRO 80 2HD PRO 80 -7.331 4.122 10.512 623 H GLY 81 H GLY 81 -2.874 6.635 10.928 624 HA2 GLY 81 1HA GLY 81 -0.628 6.175 12.156 625 HA3 GLY 81 2HA GLY 81 -0.828 4.581 11.440 626 H LYS 82 H LYS 82 -2.182 6.334 9.126 627 HA LYS 82 HA LYS 82 -1.488 7.002 7.035 628 HB2 LYS 82 1HB LYS 82 0.989 8.232 8.131 629 HB3 LYS 82 2HB LYS 82 -0.178 8.883 6.993 630 HG2 LYS 82 1HG LYS 82 -0.943 10.146 8.647 631 HG3 LYS 82 2HG LYS 82 -1.581 8.682 9.393 632 HD2 LYS 82 1HD LYS 82 0.621 8.377 10.519 633 HD3 LYS 82 2HD LYS 82 1.112 9.947 9.880 634 HE2 LYS 82 1HE LYS 82 -1.275 10.561 11.023 635 HE3 LYS 82 2HE LYS 82 -0.702 9.285 12.096 636 HZ1 LYS 82 3HZ LYS 82 -0.034 11.837 12.372 637 HZ2 LYS 82 1HZ LYS 82 1.243 11.325 11.387 638 HZ3 LYS 82 2HZ LYS 82 0.962 10.565 12.872 639 H ALA 83 H ALA 83 -0.530 4.438 8.050 640 HA ALA 83 HA ALA 83 2.037 4.204 6.630 641 HB1 ALA 83 3HB ALA 83 2.704 3.071 8.421 642 HB2 ALA 83 1HB ALA 83 1.517 1.823 8.038 643 HB3 ALA 83 2HB ALA 83 1.086 3.149 9.116 644 H ILE 84 H ILE 84 2.230 2.918 4.870 645 HA ILE 84 HA ILE 84 -0.201 1.797 3.730 646 HB ILE 84 HB ILE 84 2.576 1.714 2.563 647 HG12 ILE 84 1HG1 ILE 84 0.444 3.819 2.165 648 HG13 ILE 84 2HG1 ILE 84 1.943 4.044 3.061 649 HG21 ILE 84 1HG2 ILE 84 -0.150 1.101 1.568 650 HG22 ILE 84 2HG2 ILE 84 1.381 0.282 1.256 651 HG23 ILE 84 3HG2 ILE 84 1.010 1.802 0.439 652 HD11 ILE 84 3HD1 ILE 84 3.029 4.559 1.201 653 HD12 ILE 84 1HD1 ILE 84 1.486 4.513 0.349 654 HD13 ILE 84 2HD1 ILE 84 2.498 3.071 0.419 655 H CYS 85 H CYS 85 -0.547 -0.405 3.287 656 HA CYS 85 HA CYS 85 1.488 -2.280 4.276 657 HG CYS 85 HG CYS 85 -0.914 -0.446 6.041 658 HB2 CYS 85 1HB CYS 85 -1.367 -2.852 4.940 659 HB3 CYS 85 2HB CYS 85 0.099 -3.374 5.765 660 H LEU 86 H LEU 86 1.834 -4.015 3.023 661 HA LEU 86 HA LEU 86 0.179 -4.379 0.651 662 HG LEU 86 HG LEU 86 1.654 -4.092 -0.928 663 HB2 LEU 86 1HB LEU 86 2.907 -4.890 1.384 664 HB3 LEU 86 2HB LEU 86 2.184 -6.386 0.828 665 HD11 LEU 86 1HD1 LEU 86 4.111 -3.926 0.064 666 HD12 LEU 86 2HD1 LEU 86 3.763 -3.601 -1.634 667 HD13 LEU 86 3HD1 LEU 86 4.409 -5.171 -1.151 668 HD21 LEU 86 3HD2 LEU 86 1.039 -6.254 -1.669 669 HD22 LEU 86 1HD2 LEU 86 2.616 -6.929 -1.251 670 HD23 LEU 86 2HD2 LEU 86 2.466 -5.800 -2.601 671 H PHE 87 H PHE 87 -0.657 -6.525 0.057 672 HA PHE 87 HA PHE 87 -1.024 -8.348 2.326 673 HD1 PHE 87 HD1 PHE 87 -2.663 -7.040 4.107 674 HD2 PHE 87 HD2 PHE 87 -3.749 -5.448 0.318 675 HE1 PHE 87 HE1 PHE 87 -3.134 -4.868 5.162 676 HE2 PHE 87 HE2 PHE 87 -4.223 -3.281 1.363 677 HZ PHE 87 HZ PHE 87 -3.916 -2.980 3.787 678 HB2 PHE 87 1HB PHE 87 -3.335 -7.706 0.516 679 HB3 PHE 87 2HB PHE 87 -3.355 -8.482 2.096 680 H PHE 88 H PHE 88 -0.747 -10.425 1.823 681 HA PHE 88 HA PHE 88 -1.318 -11.406 -0.838 682 HD1 PHE 88 HD1 PHE 88 1.176 -8.944 -1.351 683 HD2 PHE 88 HD2 PHE 88 0.696 -12.900 -2.843 684 HE1 PHE 88 HE1 PHE 88 1.379 -8.096 -3.653 685 HE2 PHE 88 HE2 PHE 88 0.898 -12.060 -5.147 686 HZ PHE 88 HZ PHE 88 1.241 -9.656 -5.554 687 HB2 PHE 88 1HB PHE 88 1.418 -10.877 0.098 688 HB3 PHE 88 2HB PHE 88 1.172 -12.508 -0.522 689 H GLY 89 H GLY 89 -2.239 -11.823 1.929 690 HA2 GLY 89 1HA GLY 89 -2.985 -14.370 2.041 691 HA3 GLY 89 2HA GLY 89 -1.317 -14.509 2.575 692 H LYS 90 H LYS 90 -1.975 -15.267 4.613 693 HA LYS 90 HA LYS 90 -3.816 -14.380 6.357 694 HB2 LYS 90 1HB LYS 90 -2.338 -15.026 8.220 695 HB3 LYS 90 2HB LYS 90 -2.365 -16.215 6.934 696 HG2 LYS 90 1HG LYS 90 -0.180 -14.151 7.156 697 HG3 LYS 90 2HG LYS 90 -0.127 -15.693 8.008 698 HD2 LYS 90 1HD LYS 90 -0.787 -16.409 5.421 699 HD3 LYS 90 2HD LYS 90 0.385 -15.105 5.211 700 HE2 LYS 90 1HE LYS 90 1.770 -16.375 6.972 701 HE3 LYS 90 2HE LYS 90 0.706 -17.733 6.611 702 HZ1 LYS 90 3HZ LYS 90 1.385 -17.078 4.163 703 HZ2 LYS 90 1HZ LYS 90 2.334 -18.120 5.102 704 HZ3 LYS 90 2HZ LYS 90 2.763 -16.491 4.952 705 H THR 91 H THR 91 -3.466 -13.097 8.486 706 HA THR 91 HA THR 91 -1.759 -10.772 8.224 707 HB THR 91 HB THR 91 -4.393 -9.832 8.912 708 HG1 THR 91 HG1 THR 91 -4.216 -11.037 6.356 709 HG21 THR 91 3HG2 THR 91 -2.181 -8.965 7.407 710 HG22 THR 91 1HG2 THR 91 -3.619 -8.051 7.866 711 HG23 THR 91 2HG2 THR 91 -3.586 -8.934 6.340 712 HA PRO 92 HA PRO 92 -1.716 -10.431 12.658 713 HB2 PRO 92 1HB PRO 92 -4.007 -8.505 12.713 714 HB3 PRO 92 2HB PRO 92 -2.460 -8.435 13.569 715 HG2 PRO 92 1HG PRO 92 -2.855 -6.943 11.411 716 HG3 PRO 92 2HG PRO 92 -1.295 -7.743 11.679 717 HD2 PRO 92 1HD PRO 92 -3.482 -8.436 9.782 718 HD3 PRO 92 2HD PRO 92 -1.728 -8.630 9.599 719 H ILE 93 H ILE 93 -4.833 -10.843 11.142 720 HA ILE 93 HA ILE 93 -5.549 -12.770 13.224 721 HB ILE 93 HB ILE 93 -7.552 -10.791 12.145 722 HG12 ILE 93 1HG1 ILE 93 -7.339 -10.177 14.779 723 HG13 ILE 93 2HG1 ILE 93 -5.670 -10.613 14.421 724 HG21 ILE 93 1HG2 ILE 93 -9.120 -11.851 13.374 725 HG22 ILE 93 2HG2 ILE 93 -7.992 -12.255 14.667 726 HG23 ILE 93 3HG2 ILE 93 -8.023 -13.219 13.190 727 HD11 ILE 93 3HD1 ILE 93 -7.302 -8.348 13.404 728 HD12 ILE 93 1HD1 ILE 93 -6.017 -9.001 12.388 729 HD13 ILE 93 2HD1 ILE 93 -5.639 -8.372 13.992 730 H SER 94 H SER 94 -4.538 -13.723 10.994 731 HA SER 94 HA SER 94 -6.022 -14.005 8.693 732 HG SER 94 HG SER 94 -2.842 -15.962 9.914 733 HB2 SER 94 1HB SER 94 -4.912 -16.572 9.309 734 HB3 SER 94 2HB SER 94 -4.316 -15.357 8.179 735 H ASP 95 H ASP 95 -5.914 -16.721 10.982 736 HA ASP 95 HA ASP 95 -7.462 -18.306 11.520 737 HB2 ASP 95 1HB ASP 95 -8.224 -15.954 12.593 738 HB3 ASP 95 2HB ASP 95 -9.650 -16.314 11.627 739 H ASP 96 H ASP 96 -7.155 -18.660 8.985 740 HA ASP 96 HA ASP 96 -8.094 -19.475 7.082 741 HB2 ASP 96 1HB ASP 96 -10.275 -19.738 9.084 742 HB3 ASP 96 2HB ASP 96 -10.719 -19.913 7.388 743 H LYS 97 H LYS 97 -8.418 -16.487 8.015 744 HA LYS 97 HA LYS 97 -9.779 -15.657 5.589 745 HB2 LYS 97 1HB LYS 97 -10.692 -14.906 8.364 746 HB3 LYS 97 2HB LYS 97 -11.039 -13.894 6.970 747 HG2 LYS 97 1HG LYS 97 -11.771 -16.780 6.882 748 HG3 LYS 97 2HG LYS 97 -12.770 -15.659 7.807 749 HD2 LYS 97 1HD LYS 97 -13.822 -15.289 5.864 750 HD3 LYS 97 2HD LYS 97 -12.413 -14.303 5.459 751 HE2 LYS 97 1HE LYS 97 -11.468 -16.679 4.717 752 HE3 LYS 97 2HE LYS 97 -13.189 -17.005 4.509 753 HZ1 LYS 97 3HZ LYS 97 -11.809 -16.017 2.568 754 HZ2 LYS 97 1HZ LYS 97 -12.041 -14.548 3.375 755 HZ3 LYS 97 2HZ LYS 97 -13.376 -15.448 2.855 756 H ILE 98 H ILE 98 -9.663 -13.069 5.586 757 HA ILE 98 HA ILE 98 -6.999 -12.352 6.617 758 HB ILE 98 HB ILE 98 -8.182 -11.486 3.983 759 HG12 ILE 98 1HG1 ILE 98 -5.847 -13.316 4.568 760 HG13 ILE 98 2HG1 ILE 98 -7.445 -13.854 4.055 761 HG21 ILE 98 1HG2 ILE 98 -5.362 -11.022 4.278 762 HG22 ILE 98 2HG2 ILE 98 -6.247 -10.235 5.584 763 HG23 ILE 98 3HG2 ILE 98 -6.651 -9.877 3.905 764 HD11 ILE 98 3HD1 ILE 98 -6.790 -13.657 1.962 765 HD12 ILE 98 1HD1 ILE 98 -5.246 -12.972 2.472 766 HD13 ILE 98 2HD1 ILE 98 -6.634 -11.915 2.200 767 H ARG 99 H ARG 99 -6.866 -10.588 7.788 768 HA ARG 99 HA ARG 99 -8.913 -8.507 7.517 769 HE ARG 99 HE ARG 99 -11.924 -10.487 11.750 770 HB2 ARG 99 1HB ARG 99 -7.933 -9.502 10.199 771 HB3 ARG 99 2HB ARG 99 -9.196 -8.316 9.900 772 HG2 ARG 99 1HG ARG 99 -10.708 -9.936 9.163 773 HG3 ARG 99 2HG ARG 99 -9.440 -11.139 8.924 774 HD2 ARG 99 1HD ARG 99 -9.444 -11.760 11.088 775 HD3 ARG 99 2HD ARG 99 -9.671 -10.110 11.665 776 HH11 ARG 99 1HH1 ARG 99 -10.440 -12.978 9.808 777 HH12 ARG 99 2HH1 ARG 99 -11.891 -13.916 9.677 778 HH21 ARG 99 1HH2 ARG 99 -13.833 -11.719 11.579 779 HH22 ARG 99 2HH2 ARG 99 -13.818 -13.201 10.682 780 HA PRO 100 HA PRO 100 -4.797 -6.567 7.305 781 HB2 PRO 100 1HB PRO 100 -5.656 -4.293 6.086 782 HB3 PRO 100 2HB PRO 100 -5.344 -5.798 5.211 783 HG2 PRO 100 1HG PRO 100 -7.955 -4.698 6.195 784 HG3 PRO 100 2HG PRO 100 -7.567 -5.408 4.613 785 HD2 PRO 100 1HD PRO 100 -8.815 -6.815 6.533 786 HD3 PRO 100 2HD PRO 100 -7.650 -7.572 5.427 787 H ALA 101 H ALA 101 -7.824 -5.192 8.486 788 HA ALA 101 HA ALA 101 -6.788 -4.319 10.935 789 HB1 ALA 101 3HB ALA 101 -6.026 -2.222 10.686 790 HB2 ALA 101 1HB ALA 101 -7.242 -1.811 9.477 791 HB3 ALA 101 2HB ALA 101 -5.786 -2.687 9.003 792 H SER 102 H SER 102 -8.310 -1.985 11.350 793 HA SER 102 HA SER 102 -11.024 -3.067 11.039 794 HG SER 102 HG SER 102 -9.020 -1.610 13.961 795 HB2 SER 102 1HB SER 102 -10.766 -0.949 13.022 796 HB3 SER 102 2HB SER 102 -11.412 -2.580 13.197 797 H ALA 103 H ALA 103 -9.027 -0.627 9.867 798 HA ALA 103 HA ALA 103 -11.199 0.638 8.526 799 HB1 ALA 103 3HB ALA 103 -10.961 2.876 9.506 800 HB2 ALA 103 1HB ALA 103 -9.847 2.218 10.706 801 HB3 ALA 103 2HB ALA 103 -11.531 1.688 10.678 802 H VAL 104 H VAL 104 -9.516 -0.229 6.954 803 HA VAL 104 HA VAL 104 -7.519 1.890 6.456 804 HB VAL 104 HB VAL 104 -6.025 0.324 5.401 805 HG11 VAL 104 1HG1 VAL 104 -6.350 -1.402 7.641 806 HG12 VAL 104 2HG1 VAL 104 -6.731 0.247 8.134 807 HG13 VAL 104 3HG1 VAL 104 -5.174 -0.115 7.393 808 HG21 VAL 104 3HG2 VAL 104 -7.746 -2.010 6.134 809 HG22 VAL 104 1HG2 VAL 104 -6.448 -1.901 4.948 810 HG23 VAL 104 2HG2 VAL 104 -8.011 -1.165 4.611 811 H ASN 105 H ASN 105 -7.299 2.733 4.442 812 HA ASN 105 HA ASN 105 -9.590 2.506 2.710 813 HB2 ASN 105 1HB ASN 105 -7.075 4.121 2.262 814 HB3 ASN 105 2HB ASN 105 -8.655 4.388 1.537 815 HD21 ASN 105 1HD2 ASN 105 -6.884 6.065 3.228 816 HD22 ASN 105 2HD2 ASN 105 -7.886 6.609 4.521 817 H VAL 106 H VAL 106 -9.573 2.011 0.487 818 HA VAL 106 HA VAL 106 -7.628 0.001 -0.290 819 HB VAL 106 HB VAL 106 -9.314 0.639 -2.498 820 HG11 VAL 106 1HG1 VAL 106 -9.712 -1.614 -2.531 821 HG12 VAL 106 2HG1 VAL 106 -9.770 -1.743 -0.773 822 HG13 VAL 106 3HG1 VAL 106 -8.219 -1.547 -1.593 823 HG21 VAL 106 3HG2 VAL 106 -11.525 -0.017 -1.391 824 HG22 VAL 106 1HG2 VAL 106 -10.981 1.651 -1.215 825 HG23 VAL 106 2HG2 VAL 106 -10.780 0.512 0.117 826 H ILE 107 H ILE 107 -5.765 1.119 -0.587 827 HA ILE 107 HA ILE 107 -5.625 3.510 -2.140 828 HB ILE 107 HB ILE 107 -4.152 2.632 -0.143 829 HG12 ILE 107 1HG1 ILE 107 -4.094 4.834 -1.498 830 HG13 ILE 107 2HG1 ILE 107 -2.682 4.387 -0.547 831 HG21 ILE 107 1HG2 ILE 107 -2.064 1.674 -0.753 832 HG22 ILE 107 2HG2 ILE 107 -2.450 1.777 -2.468 833 HG23 ILE 107 3HG2 ILE 107 -3.342 0.667 -1.428 834 HD11 ILE 107 3HD1 ILE 107 -3.050 4.318 -3.509 835 HD12 ILE 107 1HD1 ILE 107 -1.789 3.376 -2.718 836 HD13 ILE 107 2HD1 ILE 107 -1.811 5.131 -2.556 837 H GLY 108 H GLY 108 -6.493 0.833 -3.419 838 HA2 GLY 108 1HA GLY 108 -6.348 0.671 -5.845 839 HA3 GLY 108 2HA GLY 108 -4.642 1.055 -5.707 840 H ARG 109 H ARG 109 -3.958 -0.772 -6.821 841 HA ARG 109 HA ARG 109 -3.817 -3.167 -5.217 842 HE ARG 109 HE ARG 109 -8.294 -4.679 -5.357 843 HB2 ARG 109 1HB ARG 109 -4.952 -3.433 -7.997 844 HB3 ARG 109 2HB ARG 109 -4.822 -4.674 -6.761 845 HG2 ARG 109 1HG ARG 109 -6.504 -3.512 -5.418 846 HG3 ARG 109 2HG ARG 109 -6.638 -2.272 -6.664 847 HD2 ARG 109 1HD ARG 109 -8.105 -3.509 -7.772 848 HD3 ARG 109 2HD ARG 109 -6.936 -4.823 -7.892 849 HH11 ARG 109 1HH1 ARG 109 -8.398 -5.954 -8.604 850 HH12 ARG 109 2HH1 ARG 109 -9.445 -7.268 -8.189 851 HH21 ARG 109 1HH2 ARG 109 -9.672 -6.409 -4.809 852 HH22 ARG 109 2HH2 ARG 109 -10.169 -7.527 -6.035 853 H ILE 110 H ILE 110 -2.492 -4.882 -6.333 854 HA ILE 110 HA ILE 110 -0.211 -3.591 -7.622 855 HB ILE 110 HB ILE 110 -0.482 -6.388 -6.512 856 HG12 ILE 110 1HG1 ILE 110 1.394 -4.809 -5.070 857 HG13 ILE 110 2HG1 ILE 110 -0.075 -3.854 -5.226 858 HG21 ILE 110 1HG2 ILE 110 1.940 -4.896 -7.511 859 HG22 ILE 110 2HG2 ILE 110 1.199 -6.319 -8.242 860 HG23 ILE 110 3HG2 ILE 110 1.981 -6.445 -6.668 861 HD11 ILE 110 3HD1 ILE 110 -1.365 -5.645 -4.213 862 HD12 ILE 110 1HD1 ILE 110 -0.036 -5.148 -3.167 863 HD13 ILE 110 2HD1 ILE 110 0.089 -6.641 -4.098 864 H VAL 111 H VAL 111 -0.151 -3.582 -9.772 865 HA VAL 111 HA VAL 111 -1.804 -5.017 -11.481 866 HB VAL 111 HB VAL 111 0.562 -4.623 -12.964 867 HG11 VAL 111 1HG1 VAL 111 -0.902 -2.473 -13.602 868 HG12 VAL 111 2HG1 VAL 111 -2.125 -3.424 -12.758 869 HG13 VAL 111 3HG1 VAL 111 -1.283 -4.105 -14.149 870 HG21 VAL 111 3HG2 VAL 111 0.033 -2.213 -11.232 871 HG22 VAL 111 1HG2 VAL 111 1.241 -2.372 -12.508 872 HG23 VAL 111 2HG2 VAL 111 1.401 -3.308 -11.023 873 H ASN 112 H ASN 112 1.704 -5.582 -11.518 874 HA ASN 112 HA ASN 112 1.325 -8.293 -12.382 875 HB2 ASN 112 1HB ASN 112 3.807 -8.417 -12.258 876 HB3 ASN 112 2HB ASN 112 3.233 -7.048 -13.206 877 HD21 ASN 112 1HD2 ASN 112 3.442 -4.962 -12.373 878 HD22 ASN 112 2HD2 ASN 112 4.528 -4.603 -11.080 879 H SER 113 H SER 113 0.009 -8.943 -10.513 880 HA SER 113 HA SER 113 1.198 -9.149 -7.926 881 HG SER 113 HG SER 113 -1.939 -11.379 -8.974 882 HB2 SER 113 1HB SER 113 -0.777 -10.591 -7.414 883 HB3 SER 113 2HB SER 113 -1.215 -9.035 -8.121 884 H MET 114 H MET 114 3.206 -10.131 -9.038 885 HA MET 114 HA MET 114 3.113 -12.996 -8.534 886 HB2 MET 114 1HB MET 114 2.871 -12.228 -11.107 887 HB3 MET 114 2HB MET 114 4.624 -12.247 -10.971 888 HG2 MET 114 1HG MET 114 4.177 -14.607 -9.897 889 HG3 MET 114 2HG MET 114 2.682 -14.487 -10.820 890 HE1 MET 114 3HE MET 114 2.628 -16.012 -12.280 891 HE2 MET 114 1HE MET 114 4.094 -16.976 -12.457 892 HE3 MET 114 2HE MET 114 3.479 -16.049 -13.824 893 H GLU 115 H GLU 115 4.254 -10.672 -7.190 894 HA GLU 115 HA GLU 115 7.103 -11.408 -7.347 895 HB2 GLU 115 1HB GLU 115 5.934 -8.869 -7.683 896 HB3 GLU 115 2HB GLU 115 6.709 -8.838 -6.106 897 HG2 GLU 115 1HG GLU 115 8.613 -8.408 -7.145 898 HG3 GLU 115 2HG GLU 115 8.567 -10.055 -7.773 899 H GLY 116 H GLY 116 4.522 -12.013 -5.573 900 HA2 GLY 116 1HA GLY 116 4.044 -12.057 -3.256 901 HA3 GLY 116 2HA GLY 116 5.328 -13.235 -3.447 902 H LEU 117 H LEU 117 5.416 -9.670 -3.427 903 HA LEU 117 HA LEU 117 7.778 -9.287 -2.172 904 HG LEU 117 HG LEU 117 8.015 -7.150 -0.843 905 HB2 LEU 117 1HB LEU 117 6.434 -7.447 -3.013 906 HB3 LEU 117 2HB LEU 117 5.249 -7.692 -1.745 907 HD11 LEU 117 1HD1 LEU 117 7.968 -5.562 -2.612 908 HD12 LEU 117 2HD1 LEU 117 7.657 -4.699 -1.107 909 HD13 LEU 117 3HD1 LEU 117 6.325 -5.069 -2.200 910 HD21 LEU 117 3HD2 LEU 117 6.990 -6.512 1.041 911 HD22 LEU 117 1HD2 LEU 117 5.576 -7.319 0.364 912 HD23 LEU 117 2HD2 LEU 117 5.774 -5.576 0.177 913 H LYS 118 H LYS 118 4.747 -10.173 -0.619 914 HA LYS 118 HA LYS 118 5.186 -9.704 2.019 915 HB2 LYS 118 1HB LYS 118 3.994 -11.901 2.479 916 HB3 LYS 118 2HB LYS 118 3.152 -10.749 1.455 917 HG2 LYS 118 1HG LYS 118 2.800 -12.689 0.310 918 HG3 LYS 118 2HG LYS 118 4.267 -12.118 -0.481 919 HD2 LYS 118 1HD LYS 118 4.488 -14.470 0.012 920 HD3 LYS 118 2HD LYS 118 5.589 -13.560 1.047 921 HE2 LYS 118 1HE LYS 118 4.407 -14.018 2.944 922 HE3 LYS 118 2HE LYS 118 2.871 -14.140 2.087 923 HZ1 LYS 118 3HZ LYS 118 3.173 -16.318 1.674 924 HZ2 LYS 118 1HZ LYS 118 4.198 -16.241 3.019 925 HZ3 LYS 118 2HZ LYS 118 4.845 -16.177 1.457 926 H GLY 119 H GLY 119 7.011 -11.918 0.043 927 HA2 GLY 119 1HA GLY 119 8.184 -13.279 2.328 928 HA3 GLY 119 2HA GLY 119 8.554 -13.570 0.636 929 H VAL 120 H VAL 120 8.595 -10.407 2.127 930 HA VAL 120 HA VAL 120 11.278 -9.912 1.257 931 HB VAL 120 HB VAL 120 11.011 -7.742 2.515 932 HG11 VAL 120 1HG1 VAL 120 10.222 -6.915 0.614 933 HG12 VAL 120 2HG1 VAL 120 8.638 -7.633 0.886 934 HG13 VAL 120 3HG1 VAL 120 9.907 -8.569 0.094 935 HG21 VAL 120 3HG2 VAL 120 9.509 -7.917 4.201 936 HG22 VAL 120 1HG2 VAL 120 8.520 -9.098 3.348 937 HG23 VAL 120 2HG2 VAL 120 8.393 -7.390 2.941 938 H ALA 121 H ALA 121 13.082 -9.334 2.654 939 HA ALA 121 HA ALA 121 13.320 -11.099 4.895 940 HB1 ALA 121 3HB ALA 121 15.579 -10.266 5.102 941 HB2 ALA 121 1HB ALA 121 15.216 -8.913 4.032 942 HB3 ALA 121 2HB ALA 121 15.222 -10.559 3.400 943 H ASP 122 H ASP 122 13.455 -10.569 7.097 944 HA ASP 122 HA ASP 122 11.793 -8.534 8.011 945 HB2 ASP 122 1HB ASP 122 12.534 -9.084 10.235 946 HB3 ASP 122 2HB ASP 122 12.384 -10.570 9.300 947 H GLY 123 H GLY 123 12.073 -6.430 7.863 948 HA2 GLY 123 1HA GLY 123 13.009 -4.359 8.214 949 HA3 GLY 123 2HA GLY 123 14.334 -5.154 9.042 950 H GLU 124 H GLU 124 13.325 -3.574 6.202 951 HA GLU 124 HA GLU 124 16.020 -3.535 5.214 952 HB2 GLU 124 1HB GLU 124 15.162 -4.258 2.853 953 HB3 GLU 124 2HB GLU 124 15.629 -5.477 4.027 954 HG2 GLU 124 1HG GLU 124 13.289 -5.820 4.609 955 HG3 GLU 124 2HG GLU 124 12.815 -4.588 3.436 956 H SER 125 H SER 125 16.391 -1.930 3.631 957 HA SER 125 HA SER 125 15.046 0.447 3.965 958 HG SER 125 HG SER 125 17.535 1.845 2.388 959 HB2 SER 125 1HB SER 125 17.292 -0.271 2.655 960 HB3 SER 125 2HB SER 125 16.231 0.039 1.281 961 H VAL 126 H VAL 126 13.911 1.753 2.346 962 HA VAL 126 HA VAL 126 12.302 0.442 0.352 963 HB VAL 126 HB VAL 126 10.914 1.666 2.747 964 HG11 VAL 126 1HG1 VAL 126 9.793 0.388 0.262 965 HG12 VAL 126 2HG1 VAL 126 9.701 2.095 0.698 966 HG13 VAL 126 3HG1 VAL 126 8.854 0.890 1.665 967 HG21 VAL 126 3HG2 VAL 126 10.007 -0.636 3.048 968 HG22 VAL 126 1HG2 VAL 126 11.728 -0.464 3.393 969 HG23 VAL 126 2HG2 VAL 126 11.200 -1.194 1.874 970 H VAL 127 H VAL 127 11.944 1.861 -1.282 971 HA VAL 127 HA VAL 127 12.052 4.735 -0.637 972 HB VAL 127 HB VAL 127 13.160 5.124 -2.828 973 HG11 VAL 127 1HG1 VAL 127 14.289 4.360 -0.437 974 HG12 VAL 127 2HG1 VAL 127 15.140 5.087 -1.799 975 HG13 VAL 127 3HG1 VAL 127 15.108 3.334 -1.615 976 HG21 VAL 127 3HG2 VAL 127 13.297 3.515 -4.344 977 HG22 VAL 127 1HG2 VAL 127 12.537 2.387 -3.222 978 HG23 VAL 127 2HG2 VAL 127 14.292 2.553 -3.252 979 H VAL 128 H VAL 128 10.054 5.474 -0.917 980 HA VAL 128 HA VAL 128 8.275 4.351 -2.906 981 HB VAL 128 HB VAL 128 7.453 6.848 -1.568 982 HG11 VAL 128 1HG1 VAL 128 5.525 5.170 -0.958 983 HG12 VAL 128 2HG1 VAL 128 6.268 4.195 -2.222 984 HG13 VAL 128 3HG1 VAL 128 5.678 5.818 -2.590 985 HG21 VAL 128 3HG2 VAL 128 8.374 6.266 0.418 986 HG22 VAL 128 1HG2 VAL 128 8.479 4.558 -0.006 987 HG23 VAL 128 2HG2 VAL 128 6.942 5.242 0.516 988 H GLU 129 H GLU 129 7.943 5.198 -4.938 989 HA GLU 129 HA GLU 129 8.443 8.002 -5.458 990 HB2 GLU 129 1HB GLU 129 9.945 7.427 -7.411 991 HB3 GLU 129 2HB GLU 129 10.656 7.223 -5.815 992 HG2 GLU 129 1HG GLU 129 9.762 4.752 -6.142 993 HG3 GLU 129 2HG GLU 129 9.920 5.193 -7.842 994 H ARG 130 H ARG 130 7.002 8.762 -6.902 995 HA ARG 130 HA ARG 130 5.102 6.987 -8.102 996 HE ARG 130 HE ARG 130 3.589 12.005 -10.497 997 HB2 ARG 130 1HB ARG 130 4.392 9.164 -7.295 998 HB3 ARG 130 2HB ARG 130 5.522 9.969 -8.375 999 HG2 ARG 130 1HG ARG 130 3.565 8.185 -9.665 1000 HG3 ARG 130 2HG ARG 130 2.915 9.640 -8.906 1001 HD2 ARG 130 1HD ARG 130 5.229 10.415 -10.322 1002 HD3 ARG 130 2HD ARG 130 4.300 9.366 -11.393 1003 HH11 ARG 130 1HH1 ARG 130 2.377 8.976 -11.737 1004 HH12 ARG 130 2HH1 ARG 130 0.932 9.677 -12.386 1005 HH21 ARG 130 1HH2 ARG 130 1.690 12.927 -11.349 1006 HH22 ARG 130 2HH2 ARG 130 0.542 11.920 -12.165 1007 H ALA 131 H ALA 131 6.247 5.685 -9.537 1008 HA ALA 131 HA ALA 131 7.411 5.096 -11.431 1009 HB1 ALA 131 3HB ALA 131 5.534 7.207 -12.469 1010 HB2 ALA 131 1HB ALA 131 5.223 5.477 -12.322 1011 HB3 ALA 131 2HB ALA 131 6.417 6.064 -13.482 Start of MODEL 6 1 H MET 1 H MET 1 2.249 7.957 -15.325 2 HA MET 1 HA MET 1 0.905 9.350 -16.882 3 HB2 MET 1 1HB MET 1 -0.742 6.811 -16.808 4 HB3 MET 1 2HB MET 1 -1.289 8.350 -17.456 5 HG2 MET 1 1HG MET 1 0.687 8.213 -19.042 6 HG3 MET 1 2HG MET 1 0.844 6.535 -18.526 7 HE1 MET 1 3HE MET 1 0.318 6.929 -21.748 8 HE2 MET 1 1HE MET 1 -0.709 5.495 -21.742 9 HE3 MET 1 2HE MET 1 0.699 5.575 -20.683 10 H GLY 2 H GLY 2 -1.496 9.912 -16.077 11 HA2 GLY 2 1HA GLY 2 -2.435 9.207 -13.583 12 HA3 GLY 2 2HA GLY 2 -1.221 10.444 -13.287 13 H GLU 3 H GLU 3 -3.542 10.148 -15.954 14 HA GLU 3 HA GLU 3 -4.559 12.811 -15.231 15 HB2 GLU 3 1HB GLU 3 -4.953 11.452 -17.891 16 HB3 GLU 3 2HB GLU 3 -5.092 13.162 -17.510 17 HG2 GLU 3 1HG GLU 3 -2.765 13.430 -17.362 18 HG3 GLU 3 2HG GLU 3 -2.489 11.691 -17.289 19 H ARG 4 H ARG 4 -6.908 12.624 -16.884 20 HA ARG 4 HA ARG 4 -9.097 12.044 -16.750 21 HE ARG 4 HE ARG 4 -6.635 8.322 -16.929 22 HB2 ARG 4 1HB ARG 4 -7.831 9.437 -15.919 23 HB3 ARG 4 2HB ARG 4 -9.572 9.632 -16.043 24 HG2 ARG 4 1HG ARG 4 -8.978 8.716 -18.088 25 HG3 ARG 4 2HG ARG 4 -9.128 10.439 -18.434 26 HD2 ARG 4 1HD ARG 4 -7.129 9.365 -19.458 27 HD3 ARG 4 2HD ARG 4 -6.746 10.721 -18.399 28 HH11 ARG 4 1HH1 ARG 4 -4.903 10.024 -19.435 29 HH12 ARG 4 2HH1 ARG 4 -3.373 9.322 -19.027 30 HH21 ARG 4 1HH2 ARG 4 -4.623 7.398 -16.392 31 HH22 ARG 4 2HH2 ARG 4 -3.214 7.832 -17.301 32 H GLY 5 H GLY 5 -8.107 10.040 -13.998 33 HA2 GLY 5 1HA GLY 5 -8.525 11.826 -11.918 34 HA3 GLY 5 2HA GLY 5 -10.110 11.183 -12.322 35 H VAL 6 H VAL 6 -9.377 8.560 -12.995 36 HA VAL 6 HA VAL 6 -8.377 7.559 -10.394 37 HB VAL 6 HB VAL 6 -9.875 5.639 -10.587 38 HG11 VAL 6 1HG1 VAL 6 -10.846 8.400 -10.398 39 HG12 VAL 6 2HG1 VAL 6 -11.075 7.035 -9.306 40 HG13 VAL 6 3HG1 VAL 6 -12.097 7.204 -10.731 41 HG21 VAL 6 3HG2 VAL 6 -9.984 6.164 -13.261 42 HG22 VAL 6 1HG2 VAL 6 -11.552 6.762 -12.717 43 HG23 VAL 6 2HG2 VAL 6 -11.084 5.092 -12.398 44 H GLU 7 H GLU 7 -6.327 7.772 -11.799 45 HA GLU 7 HA GLU 7 -5.607 5.114 -12.618 46 HB2 GLU 7 1HB GLU 7 -5.799 7.343 -14.633 47 HB3 GLU 7 2HB GLU 7 -4.713 5.980 -14.864 48 HG2 GLU 7 1HG GLU 7 -7.710 5.929 -14.679 49 HG3 GLU 7 2HG GLU 7 -6.704 5.532 -16.070 50 H MET 8 H MET 8 -4.695 6.653 -10.528 51 HA MET 8 HA MET 8 -2.066 7.622 -11.407 52 HB2 MET 8 1HB MET 8 -3.755 8.972 -9.888 53 HB3 MET 8 2HB MET 8 -3.047 7.993 -8.610 54 HG2 MET 8 1HG MET 8 -1.394 9.450 -8.478 55 HG3 MET 8 2HG MET 8 -0.890 8.972 -10.098 56 HE1 MET 8 3HE MET 8 -0.817 12.533 -8.808 57 HE2 MET 8 1HE MET 8 -0.309 12.539 -10.497 58 HE3 MET 8 2HE MET 8 0.169 11.213 -9.436 59 H ARG 9 H ARG 9 -0.577 6.081 -11.382 60 HA ARG 9 HA ARG 9 -0.640 4.104 -9.207 61 HE ARG 9 HE ARG 9 2.826 2.398 -13.602 62 HB2 ARG 9 1HB ARG 9 0.366 2.549 -10.605 63 HB3 ARG 9 2HB ARG 9 -0.699 3.421 -11.695 64 HG2 ARG 9 1HG ARG 9 1.104 3.563 -13.010 65 HG3 ARG 9 2HG ARG 9 1.607 4.857 -11.923 66 HD2 ARG 9 1HD ARG 9 3.253 3.628 -11.011 67 HD3 ARG 9 2HD ARG 9 2.289 2.151 -11.013 68 HH11 ARG 9 1HH1 ARG 9 4.930 2.725 -10.832 69 HH12 ARG 9 2HH1 ARG 9 6.342 2.213 -11.693 70 HH21 ARG 9 1HH2 ARG 9 4.684 1.721 -14.728 71 HH22 ARG 9 2HH2 ARG 9 6.203 1.642 -13.900 72 H LEU 10 H LEU 10 1.133 3.601 -8.002 73 HA LEU 10 HA LEU 10 3.421 5.449 -8.216 74 HG LEU 10 HG LEU 10 0.827 4.174 -5.943 75 HB2 LEU 10 1HB LEU 10 3.324 4.417 -5.571 76 HB3 LEU 10 2HB LEU 10 3.161 6.078 -6.098 77 HD11 LEU 10 1HD1 LEU 10 1.889 6.105 -3.882 78 HD12 LEU 10 2HD1 LEU 10 1.680 4.362 -3.711 79 HD13 LEU 10 3HD1 LEU 10 0.267 5.411 -3.840 80 HD21 LEU 10 3HD2 LEU 10 0.378 7.030 -5.625 81 HD22 LEU 10 1HD2 LEU 10 -0.421 5.869 -6.684 82 HD23 LEU 10 2HD2 LEU 10 1.095 6.621 -7.183 83 H ARG 11 H ARG 11 5.449 4.528 -7.229 84 HA ARG 11 HA ARG 11 5.600 1.662 -7.867 85 HE ARG 11 HE ARG 11 9.653 0.369 -10.099 86 HB2 ARG 11 1HB ARG 11 6.989 3.736 -9.013 87 HB3 ARG 11 2HB ARG 11 8.134 3.135 -7.823 88 HG2 ARG 11 1HG ARG 11 6.781 1.454 -9.923 89 HG3 ARG 11 2HG ARG 11 8.416 2.107 -10.038 90 HD2 ARG 11 1HD ARG 11 8.466 0.856 -7.608 91 HD3 ARG 11 2HD ARG 11 7.405 -0.198 -8.542 92 HH11 ARG 11 1HH1 ARG 11 8.847 -1.326 -7.157 93 HH12 ARG 11 2HH1 ARG 11 10.139 -2.468 -7.312 94 HH21 ARG 11 1HH2 ARG 11 11.353 -1.132 -10.306 95 HH22 ARG 11 2HH2 ARG 11 11.563 -2.357 -9.099 96 H ILE 12 H ILE 12 6.814 0.289 -6.546 97 HA ILE 12 HA ILE 12 7.948 1.382 -4.097 98 HB ILE 12 HB ILE 12 5.442 -0.128 -4.187 99 HG12 ILE 12 1HG1 ILE 12 6.612 0.988 -1.690 100 HG13 ILE 12 2HG1 ILE 12 6.259 2.109 -3.001 101 HG21 ILE 12 1HG2 ILE 12 7.691 -1.196 -2.511 102 HG22 ILE 12 2HG2 ILE 12 6.581 -2.075 -3.561 103 HG23 ILE 12 3HG2 ILE 12 6.003 -1.390 -2.044 104 HD11 ILE 12 3HD1 ILE 12 4.216 0.179 -1.962 105 HD12 ILE 12 1HD1 ILE 12 3.967 1.626 -2.940 106 HD13 ILE 12 2HD1 ILE 12 4.462 1.775 -1.253 107 H ARG 13 H ARG 13 9.975 0.750 -4.439 108 HA ARG 13 HA ARG 13 10.465 -1.995 -5.354 109 HE ARG 13 HE ARG 13 15.278 1.917 -5.226 110 HB2 ARG 13 1HB ARG 13 12.788 -1.207 -5.786 111 HB3 ARG 13 2HB ARG 13 11.565 -0.356 -6.720 112 HG2 ARG 13 1HG ARG 13 11.659 1.486 -5.054 113 HG3 ARG 13 2HG ARG 13 12.992 0.641 -4.265 114 HD2 ARG 13 1HD ARG 13 13.309 1.020 -7.159 115 HD3 ARG 13 2HD ARG 13 13.274 2.509 -6.220 116 HH11 ARG 13 1HH1 ARG 13 14.093 -0.717 -7.193 117 HH12 ARG 13 2HH1 ARG 13 15.585 -1.589 -7.139 118 HH21 ARG 13 1HH2 ARG 13 17.238 0.766 -5.158 119 HH22 ARG 13 2HH2 ARG 13 17.370 -0.750 -5.985 120 H PHE 14 H PHE 14 12.135 -3.245 -4.388 121 HA PHE 14 HA PHE 14 12.885 -2.526 -1.654 122 HD1 PHE 14 HD1 PHE 14 11.872 -3.800 0.907 123 HD2 PHE 14 HD2 PHE 14 9.305 -3.675 -2.485 124 HE1 PHE 14 HE1 PHE 14 10.077 -2.862 2.303 125 HE2 PHE 14 HE2 PHE 14 7.507 -2.734 -1.093 126 HZ PHE 14 HZ PHE 14 7.893 -2.324 1.303 127 HB2 PHE 14 1HB PHE 14 11.344 -4.964 -2.513 128 HB3 PHE 14 2HB PHE 14 12.401 -5.029 -1.108 129 H GLU 15 H GLU 15 14.895 -3.213 -1.093 130 HA GLU 15 HA GLU 15 16.840 -3.681 -2.929 131 HB2 GLU 15 1HB GLU 15 16.628 -4.133 -0.022 132 HB3 GLU 15 2HB GLU 15 17.865 -5.082 -0.828 133 HG2 GLU 15 1HG GLU 15 18.456 -2.769 0.158 134 HG3 GLU 15 2HG GLU 15 19.098 -3.247 -1.410 135 H SER 16 H SER 16 14.659 -6.066 -1.618 136 HA SER 16 HA SER 16 15.994 -8.098 -3.286 137 HG SER 16 HG SER 16 17.199 -9.388 -1.816 138 HB2 SER 16 1HB SER 16 14.943 -8.291 -0.488 139 HB3 SER 16 2HB SER 16 14.943 -9.721 -1.519 140 H ALA 17 H ALA 17 13.608 -6.250 -3.752 141 HA ALA 17 HA ALA 17 12.033 -8.129 -5.162 142 HB1 ALA 17 3HB ALA 17 11.411 -8.250 -2.514 143 HB2 ALA 17 1HB ALA 17 10.325 -8.698 -3.829 144 HB3 ALA 17 2HB ALA 17 10.219 -7.092 -3.107 145 H GLU 18 H GLU 18 10.281 -7.224 -6.339 146 HA GLU 18 HA GLU 18 10.155 -4.279 -6.319 147 HB2 GLU 18 1HB GLU 18 9.882 -4.432 -8.825 148 HB3 GLU 18 2HB GLU 18 11.487 -4.808 -8.216 149 HG2 GLU 18 1HG GLU 18 9.760 -7.143 -8.436 150 HG3 GLU 18 2HG GLU 18 10.041 -6.325 -9.973 151 H CYS 19 H CYS 19 8.146 -3.344 -6.833 152 HA CYS 19 HA CYS 19 5.914 -4.988 -7.611 153 HG CYS 19 HG CYS 19 7.635 -4.287 -4.445 154 HB2 CYS 19 1HB CYS 19 4.902 -3.909 -5.202 155 HB3 CYS 19 2HB CYS 19 5.142 -5.605 -5.602 156 H GLU 20 H GLU 20 4.027 -3.800 -8.138 157 HA GLU 20 HA GLU 20 4.241 -0.881 -7.912 158 HB2 GLU 20 1HB GLU 20 3.134 -2.011 -10.438 159 HB3 GLU 20 2HB GLU 20 3.954 -0.481 -10.163 160 HG2 GLU 20 1HG GLU 20 6.045 -1.944 -9.767 161 HG3 GLU 20 2HG GLU 20 5.119 -3.193 -10.593 162 H VAL 21 H VAL 21 2.176 0.228 -8.138 163 HA VAL 21 HA VAL 21 -0.227 -1.378 -8.092 164 HB VAL 21 HB VAL 21 -0.485 -1.567 -5.899 165 HG11 VAL 21 1HG1 VAL 21 1.240 -0.666 -4.308 166 HG12 VAL 21 2HG1 VAL 21 2.040 0.057 -5.706 167 HG13 VAL 21 3HG1 VAL 21 1.858 -1.695 -5.602 168 HG21 VAL 21 3HG2 VAL 21 -0.277 1.441 -5.773 169 HG22 VAL 21 1HG2 VAL 21 -0.844 0.406 -4.462 170 HG23 VAL 21 2HG2 VAL 21 -1.750 0.490 -5.972 171 H GLU 22 H GLU 22 -2.141 -0.197 -8.334 172 HA GLU 22 HA GLU 22 -1.743 2.553 -9.287 173 HB2 GLU 22 1HB GLU 22 -3.740 0.406 -9.923 174 HB3 GLU 22 2HB GLU 22 -4.143 2.092 -10.217 175 HG2 GLU 22 1HG GLU 22 -2.765 2.257 -11.984 176 HG3 GLU 22 2HG GLU 22 -1.541 1.210 -11.265 177 H LEU 23 H LEU 23 -4.081 3.778 -9.045 178 HA LEU 23 HA LEU 23 -5.261 3.236 -6.467 179 HG LEU 23 HG LEU 23 -5.618 6.576 -6.335 180 HB2 LEU 23 1HB LEU 23 -3.613 4.489 -5.490 181 HB3 LEU 23 2HB LEU 23 -3.358 5.471 -6.914 182 HD11 LEU 23 1HD1 LEU 23 -5.266 4.753 -4.071 183 HD12 LEU 23 2HD1 LEU 23 -6.710 5.580 -4.651 184 HD13 LEU 23 3HD1 LEU 23 -5.571 6.425 -3.605 185 HD21 LEU 23 3HD2 LEU 23 -4.470 8.008 -4.593 186 HD22 LEU 23 1HD2 LEU 23 -3.636 7.832 -6.138 187 HD23 LEU 23 2HD2 LEU 23 -3.097 6.909 -4.734 188 H TYR 24 H TYR 24 -7.199 4.311 -6.077 189 HA TYR 24 HA TYR 24 -8.265 5.855 -8.345 190 HD1 TYR 24 HD1 TYR 24 -8.203 4.725 -10.024 191 HD2 TYR 24 HD2 TYR 24 -9.981 1.582 -7.774 192 HE1 TYR 24 HE1 TYR 24 -7.541 3.115 -11.761 193 HE2 TYR 24 HE2 TYR 24 -9.323 -0.038 -9.504 194 HH TYR 24 HH TYR 24 -8.138 0.932 -12.573 195 HB2 TYR 24 1HB TYR 24 -9.753 3.704 -6.806 196 HB3 TYR 24 2HB TYR 24 -10.452 4.746 -8.040 197 H GLU 25 H GLU 25 -9.796 7.436 -7.865 198 HA GLU 25 HA GLU 25 -9.368 8.917 -5.555 199 HB2 GLU 25 1HB GLU 25 -11.711 8.982 -7.455 200 HB3 GLU 25 2HB GLU 25 -11.427 10.182 -6.201 201 HG2 GLU 25 1HG GLU 25 -9.694 11.145 -7.316 202 HG3 GLU 25 2HG GLU 25 -9.225 9.647 -8.119 203 H GLU 26 H GLU 26 -11.170 6.061 -5.712 204 HA GLU 26 HA GLU 26 -13.396 6.430 -4.198 205 HB2 GLU 26 1HB GLU 26 -13.275 4.146 -3.550 206 HB3 GLU 26 2HB GLU 26 -12.559 4.258 -5.151 207 HG2 GLU 26 1HG GLU 26 -10.312 4.357 -3.973 208 HG3 GLU 26 2HG GLU 26 -11.177 3.870 -2.518 209 H TRP 27 H TRP 27 -10.096 6.678 -3.097 210 HA TRP 27 HA TRP 27 -10.823 6.652 -0.302 211 HD1 TRP 27 HD1 TRP 27 -6.046 7.645 -0.389 212 HE1 TRP 27 HE1 TRP 27 -5.654 8.723 1.912 213 HE3 TRP 27 HE3 TRP 27 -10.819 7.427 1.448 214 HZ2 TRP 27 HZ2 TRP 27 -7.159 9.396 4.198 215 HZ3 TRP 27 HZ3 TRP 27 -11.251 8.316 3.698 216 HH2 TRP 27 HH2 TRP 27 -9.459 9.277 5.046 217 HB2 TRP 27 1HB TRP 27 -8.658 5.778 -0.777 218 HB3 TRP 27 2HB TRP 27 -8.245 7.155 -1.789 219 H ALA 28 H ALA 28 -9.453 9.057 -2.562 220 HA ALA 28 HA ALA 28 -11.095 11.136 -2.301 221 HB1 ALA 28 3HB ALA 28 -11.191 11.351 -0.003 222 HB2 ALA 28 1HB ALA 28 -9.942 12.525 -0.414 223 HB3 ALA 28 2HB ALA 28 -9.490 10.941 0.215 224 HA PRO 29 HA PRO 29 -7.845 12.350 -5.163 225 HB2 PRO 29 1HB PRO 29 -8.981 14.980 -5.248 226 HB3 PRO 29 2HB PRO 29 -9.068 13.717 -6.475 227 HG2 PRO 29 1HG PRO 29 -11.065 14.540 -4.495 228 HG3 PRO 29 2HG PRO 29 -11.276 13.592 -5.975 229 HD2 PRO 29 1HD PRO 29 -11.469 12.555 -3.455 230 HD3 PRO 29 2HD PRO 29 -11.003 11.601 -4.875 231 H GLU 30 H GLU 30 -8.884 14.261 -2.376 232 HA GLU 30 HA GLU 30 -6.734 16.054 -2.289 233 HB2 GLU 30 1HB GLU 30 -8.576 15.001 -0.152 234 HB3 GLU 30 2HB GLU 30 -7.342 16.205 0.185 235 HG2 GLU 30 1HG GLU 30 -8.866 17.727 -0.337 236 HG3 GLU 30 2HG GLU 30 -8.647 17.229 -2.014 237 H THR 31 H THR 31 -7.195 12.963 -0.572 238 HA THR 31 HA THR 31 -4.689 13.020 0.757 239 HB THR 31 HB THR 31 -5.355 10.303 0.322 240 HG1 THR 31 HG1 THR 31 -7.380 10.480 -0.233 241 HG21 THR 31 3HG2 THR 31 -6.243 10.441 2.665 242 HG22 THR 31 1HG2 THR 31 -5.895 12.167 2.618 243 HG23 THR 31 2HG2 THR 31 -4.587 10.998 2.444 244 H VAL 32 H VAL 32 -5.693 11.543 -2.311 245 HA VAL 32 HA VAL 32 -3.418 10.176 -3.011 246 HB VAL 32 HB VAL 32 -5.035 11.852 -4.932 247 HG11 VAL 32 1HG1 VAL 32 -4.435 9.657 -6.308 248 HG12 VAL 32 2HG1 VAL 32 -3.054 9.666 -5.211 249 HG13 VAL 32 3HG1 VAL 32 -3.364 11.056 -6.251 250 HG21 VAL 32 3HG2 VAL 32 -6.760 10.652 -4.102 251 HG22 VAL 32 1HG2 VAL 32 -5.709 9.404 -3.432 252 HG23 VAL 32 2HG2 VAL 32 -6.104 9.394 -5.150 253 H ARG 33 H ARG 33 -3.966 13.628 -3.012 254 HA ARG 33 HA ARG 33 -1.800 14.424 -4.612 255 HE ARG 33 HE ARG 33 -0.789 19.190 -4.306 256 HB2 ARG 33 1HB ARG 33 -3.777 15.813 -3.691 257 HB3 ARG 33 2HB ARG 33 -2.779 16.024 -2.259 258 HG2 ARG 33 1HG ARG 33 -0.981 16.898 -3.837 259 HG3 ARG 33 2HG ARG 33 -2.257 16.978 -5.055 260 HD2 ARG 33 1HD ARG 33 -3.479 18.565 -3.825 261 HD3 ARG 33 2HD ARG 33 -2.554 18.257 -2.355 262 HH11 ARG 33 1HH1 ARG 33 -3.500 20.349 -2.439 263 HH12 ARG 33 2HH1 ARG 33 -2.963 21.995 -2.450 264 HH21 ARG 33 1HH2 ARG 33 -0.083 21.355 -4.322 265 HH22 ARG 33 2HH2 ARG 33 -1.023 22.566 -3.518 266 H ALA 34 H ALA 34 -2.014 13.683 -1.165 267 HA ALA 34 HA ALA 34 0.563 14.600 -0.450 268 HB1 ALA 34 3HB ALA 34 -0.601 14.282 1.450 269 HB2 ALA 34 1HB ALA 34 0.123 12.677 1.371 270 HB3 ALA 34 2HB ALA 34 -1.522 12.931 0.790 271 H ILE 35 H ILE 35 -0.625 11.385 -1.378 272 HA ILE 35 HA ILE 35 1.759 9.962 -1.052 273 HB ILE 35 HB ILE 35 0.307 9.168 -3.478 274 HG12 ILE 35 1HG1 ILE 35 -1.591 10.173 -2.296 275 HG13 ILE 35 2HG1 ILE 35 -1.730 8.419 -2.330 276 HG21 ILE 35 1HG2 ILE 35 1.963 7.868 -2.035 277 HG22 ILE 35 2HG2 ILE 35 0.511 7.025 -2.579 278 HG23 ILE 35 3HG2 ILE 35 0.612 7.629 -0.926 279 HD11 ILE 35 3HD1 ILE 35 -2.092 8.527 -0.148 280 HD12 ILE 35 1HD1 ILE 35 -1.596 10.218 -0.078 281 HD13 ILE 35 2HD1 ILE 35 -0.385 8.940 0.029 282 H ALA 36 H ALA 36 0.485 11.632 -3.975 283 HA ALA 36 HA ALA 36 2.726 11.169 -5.619 284 HB1 ALA 36 3HB ALA 36 0.274 12.223 -6.028 285 HB2 ALA 36 1HB ALA 36 1.614 12.369 -7.165 286 HB3 ALA 36 2HB ALA 36 1.258 13.686 -6.046 287 H ASP 37 H ASP 37 2.084 13.506 -3.105 288 HA ASP 37 HA ASP 37 4.202 15.297 -3.836 289 HB2 ASP 37 1HB ASP 37 2.112 15.711 -2.317 290 HB3 ASP 37 2HB ASP 37 3.145 15.081 -1.038 291 H ALA 38 H ALA 38 4.026 12.328 -2.086 292 HA ALA 38 HA ALA 38 6.683 12.671 -0.939 293 HB1 ALA 38 3HB ALA 38 4.868 10.336 -0.451 294 HB2 ALA 38 1HB ALA 38 4.620 11.874 0.377 295 HB3 ALA 38 2HB ALA 38 6.137 10.992 0.586 296 H LEU 39 H LEU 39 6.904 12.456 -3.595 297 HA LEU 39 HA LEU 39 7.036 9.845 -4.657 298 HG LEU 39 HG LEU 39 6.369 12.987 -5.853 299 HB2 LEU 39 1HB LEU 39 8.579 12.300 -5.523 300 HB3 LEU 39 2HB LEU 39 8.351 10.844 -6.464 301 HD11 LEU 39 1HD1 LEU 39 7.070 13.399 -7.947 302 HD12 LEU 39 2HD1 LEU 39 5.921 12.126 -8.367 303 HD13 LEU 39 3HD1 LEU 39 7.637 11.747 -8.196 304 HD21 LEU 39 3HD2 LEU 39 5.023 11.210 -5.177 305 HD22 LEU 39 1HD2 LEU 39 5.776 10.080 -6.296 306 HD23 LEU 39 2HD2 LEU 39 4.679 11.316 -6.900 307 HA PRO 40 HA PRO 40 11.182 7.978 -4.108 308 HB2 PRO 40 1HB PRO 40 12.636 10.459 -4.967 309 HB3 PRO 40 2HB PRO 40 13.096 8.762 -5.170 310 HG2 PRO 40 1HG PRO 40 11.883 10.182 -7.133 311 HG3 PRO 40 2HG PRO 40 11.662 8.437 -6.928 312 HD2 PRO 40 1HD PRO 40 9.742 10.574 -6.559 313 HD3 PRO 40 2HD PRO 40 9.465 8.826 -6.555 314 H ILE 41 H ILE 41 11.032 7.834 -1.967 315 HA ILE 41 HA ILE 41 12.548 9.730 -0.364 316 HB ILE 41 HB ILE 41 9.628 9.114 0.111 317 HG12 ILE 41 1HG1 ILE 41 11.244 11.679 0.054 318 HG13 ILE 41 2HG1 ILE 41 10.109 11.135 -1.174 319 HG21 ILE 41 1HG2 ILE 41 11.614 10.173 2.130 320 HG22 ILE 41 2HG2 ILE 41 10.767 8.629 2.202 321 HG23 ILE 41 3HG2 ILE 41 9.864 10.136 2.345 322 HD11 ILE 41 3HD1 ILE 41 8.397 12.046 -0.095 323 HD12 ILE 41 1HD1 ILE 41 9.581 12.814 0.962 324 HD13 ILE 41 2HD1 ILE 41 8.858 11.275 1.424 325 H LYS 42 H LYS 42 13.322 8.796 1.603 326 HA LYS 42 HA LYS 42 13.550 5.920 1.420 327 HB2 LYS 42 1HB LYS 42 15.027 8.089 2.731 328 HB3 LYS 42 2HB LYS 42 14.949 6.605 3.668 329 HG2 LYS 42 1HG LYS 42 16.437 5.596 2.367 330 HG3 LYS 42 2HG LYS 42 15.588 6.080 0.898 331 HD2 LYS 42 1HD LYS 42 17.210 7.538 0.469 332 HD3 LYS 42 2HD LYS 42 16.806 8.404 1.953 333 HE2 LYS 42 1HE LYS 42 19.097 7.878 2.124 334 HE3 LYS 42 2HE LYS 42 18.263 6.725 3.165 335 HZ1 LYS 42 3HZ LYS 42 18.680 5.877 0.419 336 HZ2 LYS 42 1HZ LYS 42 18.831 5.001 1.860 337 HZ3 LYS 42 2HZ LYS 42 20.080 6.024 1.357 338 H SER 43 H SER 43 12.701 4.437 2.737 339 HA SER 43 HA SER 43 11.415 5.211 5.229 340 HG SER 43 HG SER 43 8.924 3.229 2.721 341 HB2 SER 43 1HB SER 43 9.276 4.555 4.694 342 HB3 SER 43 2HB SER 43 9.786 5.198 3.141 343 H THR 44 H THR 44 11.150 3.472 6.697 344 HA THR 44 HA THR 44 12.792 1.121 6.003 345 HB THR 44 HB THR 44 11.957 1.376 8.804 346 HG1 THR 44 HG1 THR 44 12.249 3.464 8.841 347 HG21 THR 44 3HG2 THR 44 14.748 1.608 8.525 348 HG22 THR 44 1HG2 THR 44 14.206 0.426 7.332 349 HG23 THR 44 2HG2 THR 44 13.814 0.203 9.037 350 H ALA 45 H ALA 45 11.929 -0.859 5.876 351 HA ALA 45 HA ALA 45 9.049 -1.081 6.100 352 HB1 ALA 45 3HB ALA 45 10.166 -3.537 5.309 353 HB2 ALA 45 1HB ALA 45 11.075 -2.271 4.493 354 HB3 ALA 45 2HB ALA 45 9.322 -2.357 4.310 355 H ASN 46 H ASN 46 7.923 -2.255 7.486 356 HA ASN 46 HA ASN 46 9.373 -3.619 9.651 357 HB2 ASN 46 1HB ASN 46 6.449 -2.833 9.541 358 HB3 ASN 46 2HB ASN 46 7.327 -3.426 10.948 359 HD21 ASN 46 1HD2 ASN 46 7.046 -1.680 12.237 360 HD22 ASN 46 2HD2 ASN 46 7.710 -0.120 11.905 361 H ARG 47 H ARG 47 9.526 -5.829 9.439 362 HA ARG 47 HA ARG 47 7.800 -7.162 7.544 363 HE ARG 47 HE ARG 47 9.275 -5.259 6.188 364 HB2 ARG 47 1HB ARG 47 10.296 -7.821 9.015 365 HB3 ARG 47 2HB ARG 47 9.305 -9.162 8.457 366 HG2 ARG 47 1HG ARG 47 10.917 -8.750 6.776 367 HG3 ARG 47 2HG ARG 47 9.383 -8.140 6.166 368 HD2 ARG 47 1HD ARG 47 10.901 -6.118 7.628 369 HD3 ARG 47 2HD ARG 47 11.773 -6.758 6.240 370 HH11 ARG 47 1HH1 ARG 47 11.747 -6.994 4.429 371 HH12 ARG 47 2HH1 ARG 47 11.269 -6.357 2.893 372 HH21 ARG 47 1HH2 ARG 47 8.654 -4.428 4.162 373 HH22 ARG 47 2HH2 ARG 47 9.513 -4.917 2.739 374 H TRP 48 H TRP 48 6.157 -8.489 7.934 375 HA TRP 48 HA TRP 48 5.750 -9.757 10.494 376 HD1 TRP 48 HD1 TRP 48 1.980 -9.633 9.031 377 HE1 TRP 48 HE1 TRP 48 0.243 -10.547 10.696 378 HE3 TRP 48 HE3 TRP 48 4.169 -8.115 13.395 379 HZ2 TRP 48 HZ2 TRP 48 -0.145 -10.614 13.493 380 HZ3 TRP 48 HZ3 TRP 48 3.050 -8.644 15.522 381 HH2 TRP 48 HH2 TRP 48 0.936 -9.867 15.568 382 HB2 TRP 48 1HB TRP 48 4.671 -7.700 11.056 383 HB3 TRP 48 2HB TRP 48 3.893 -7.591 9.482 384 H GLY 49 H GLY 49 4.257 -11.505 10.339 385 HA2 GLY 49 1HA GLY 49 4.238 -13.150 8.271 386 HA3 GLY 49 2HA GLY 49 2.796 -12.978 9.257 387 H ASP 50 H ASP 50 4.388 -11.990 6.300 388 HA ASP 50 HA ASP 50 3.565 -11.434 4.259 389 HB2 ASP 50 1HB ASP 50 1.819 -13.097 4.549 390 HB3 ASP 50 2HB ASP 50 0.866 -11.970 5.503 391 H GLU 51 H GLU 51 1.972 -9.937 7.039 392 HA GLU 51 HA GLU 51 1.175 -7.583 5.654 393 HB2 GLU 51 1HB GLU 51 0.487 -8.658 8.026 394 HB3 GLU 51 2HB GLU 51 1.656 -7.468 8.580 395 HG2 GLU 51 1HG GLU 51 0.387 -5.701 7.468 396 HG3 GLU 51 2HG GLU 51 -0.784 -6.896 6.910 397 H ILE 52 H ILE 52 2.308 -5.807 5.176 398 HA ILE 52 HA ILE 52 4.846 -5.330 6.580 399 HB ILE 52 HB ILE 52 4.655 -6.183 3.899 400 HG12 ILE 52 1HG1 ILE 52 7.162 -5.610 3.946 401 HG13 ILE 52 2HG1 ILE 52 6.876 -5.045 5.588 402 HG21 ILE 52 1HG2 ILE 52 5.689 -4.357 2.643 403 HG22 ILE 52 2HG2 ILE 52 5.502 -3.293 4.035 404 HG23 ILE 52 3HG2 ILE 52 4.077 -3.926 3.211 405 HD11 ILE 52 3HD1 ILE 52 6.400 -7.842 4.572 406 HD12 ILE 52 1HD1 ILE 52 6.120 -7.280 6.221 407 HD13 ILE 52 2HD1 ILE 52 7.753 -7.305 5.561 408 H TYR 53 H TYR 53 4.937 -3.320 7.377 409 HA TYR 53 HA TYR 53 3.456 -1.190 6.000 410 HD1 TYR 53 HD1 TYR 53 4.231 0.162 9.891 411 HD2 TYR 53 HD2 TYR 53 2.804 -3.802 9.261 412 HE1 TYR 53 HE1 TYR 53 5.112 -0.502 12.087 413 HE2 TYR 53 HE2 TYR 53 3.682 -4.470 11.456 414 HH TYR 53 HH TYR 53 4.324 -3.499 13.558 415 HB2 TYR 53 1HB TYR 53 2.602 -0.328 8.130 416 HB3 TYR 53 2HB TYR 53 2.047 -1.976 7.853 417 H PHE 54 H PHE 54 4.503 0.690 5.825 418 HA PHE 54 HA PHE 54 6.780 1.233 7.583 419 HD1 PHE 54 HD1 PHE 54 6.808 3.667 4.508 420 HD2 PHE 54 HD2 PHE 54 6.836 -0.455 3.451 421 HE1 PHE 54 HE1 PHE 54 6.019 4.243 2.252 422 HE2 PHE 54 HE2 PHE 54 6.045 0.115 1.195 423 HZ PHE 54 HZ PHE 54 5.636 2.467 0.592 424 HB2 PHE 54 1HB PHE 54 8.225 1.819 5.734 425 HB3 PHE 54 2HB PHE 54 7.653 0.172 5.513 426 H THR 55 H THR 55 7.224 3.409 7.929 427 HA THR 55 HA THR 55 5.056 5.231 7.156 428 HB THR 55 HB THR 55 7.265 6.147 8.924 429 HG1 THR 55 HG1 THR 55 5.459 4.085 9.607 430 HG21 THR 55 3HG2 THR 55 5.562 7.696 8.838 431 HG22 THR 55 1HG2 THR 55 5.186 6.794 10.306 432 HG23 THR 55 2HG2 THR 55 4.301 6.464 8.817 433 H THR 56 H THR 56 5.450 7.243 6.140 434 HA THR 56 HA THR 56 8.095 7.459 4.851 435 HB THR 56 HB THR 56 6.233 8.755 3.198 436 HG1 THR 56 HG1 THR 56 5.334 6.161 3.901 437 HG21 THR 56 3HG2 THR 56 7.421 7.684 1.679 438 HG22 THR 56 1HG2 THR 56 6.763 6.138 2.215 439 HG23 THR 56 2HG2 THR 56 8.226 6.781 2.965 440 H GLN 57 H GLN 57 6.327 8.848 7.135 441 HA GLN 57 HA GLN 57 6.647 10.843 8.222 442 HB2 GLN 57 1HB GLN 57 7.939 12.079 5.798 443 HB3 GLN 57 2HB GLN 57 8.146 12.497 7.494 444 HG2 GLN 57 1HG GLN 57 8.954 9.796 7.143 445 HG3 GLN 57 2HG GLN 57 9.716 10.774 5.891 446 HE21 GLN 57 1HE2 GLN 57 10.031 13.159 7.235 447 HE22 GLN 57 2HE2 GLN 57 11.168 12.946 8.520 448 H VAL 58 H VAL 58 4.941 10.338 5.372 449 HA VAL 58 HA VAL 58 3.766 12.992 5.282 450 HB VAL 58 HB VAL 58 4.087 11.768 3.174 451 HG11 VAL 58 1HG1 VAL 58 2.826 9.824 2.593 452 HG12 VAL 58 2HG1 VAL 58 1.938 9.879 4.117 453 HG13 VAL 58 3HG1 VAL 58 3.661 9.495 4.115 454 HG21 VAL 58 3HG2 VAL 58 2.438 13.402 3.014 455 HG22 VAL 58 1HG2 VAL 58 1.310 12.500 4.027 456 HG23 VAL 58 2HG2 VAL 58 1.647 11.957 2.382 457 H ALA 59 H ALA 59 2.277 13.553 6.734 458 HA ALA 59 HA ALA 59 0.587 11.441 7.884 459 HB1 ALA 59 3HB ALA 59 2.014 12.873 9.407 460 HB2 ALA 59 1HB ALA 59 0.304 12.741 9.818 461 HB3 ALA 59 2HB ALA 59 0.909 14.197 9.030 462 H VAL 60 H VAL 60 -1.118 11.251 6.558 463 HA VAL 60 HA VAL 60 -2.886 13.596 6.360 464 HB VAL 60 HB VAL 60 -1.859 13.426 4.184 465 HG11 VAL 60 1HG1 VAL 60 -1.031 11.475 3.523 466 HG12 VAL 60 2HG1 VAL 60 -2.672 10.995 3.093 467 HG13 VAL 60 3HG1 VAL 60 -2.017 10.584 4.677 468 HG21 VAL 60 3HG2 VAL 60 -4.671 12.347 4.240 469 HG22 VAL 60 1HG2 VAL 60 -3.858 12.871 2.767 470 HG23 VAL 60 2HG2 VAL 60 -4.157 14.025 4.065 471 H GLU 61 H GLU 61 -4.542 13.006 7.673 472 HA GLU 61 HA GLU 61 -5.711 10.336 7.227 473 HB2 GLU 61 1HB GLU 61 -4.692 11.516 9.671 474 HB3 GLU 61 2HB GLU 61 -6.384 11.067 9.839 475 HG2 GLU 61 1HG GLU 61 -5.855 8.795 9.121 476 HG3 GLU 61 2HG GLU 61 -4.160 9.246 8.941 477 H LYS 62 H LYS 62 -7.844 10.235 6.894 478 HA LYS 62 HA LYS 62 -9.519 12.532 7.583 479 HB2 LYS 62 1HB LYS 62 -8.878 12.905 5.262 480 HB3 LYS 62 2HB LYS 62 -9.368 11.272 4.836 481 HG2 LYS 62 1HG LYS 62 -11.677 11.801 5.268 482 HG3 LYS 62 2HG LYS 62 -11.232 13.405 5.854 483 HD2 LYS 62 1HD LYS 62 -10.093 13.521 3.448 484 HD3 LYS 62 2HD LYS 62 -11.370 12.358 3.083 485 HE2 LYS 62 1HE LYS 62 -12.938 14.044 4.233 486 HE3 LYS 62 2HE LYS 62 -11.617 15.194 4.034 487 HZ1 LYS 62 3HZ LYS 62 -12.371 13.672 1.671 488 HZ2 LYS 62 1HZ LYS 62 -11.922 15.298 1.816 489 HZ3 LYS 62 2HZ LYS 62 -13.495 14.815 2.207 490 H GLU 63 H GLU 63 -11.900 11.967 7.356 491 HA GLU 63 HA GLU 63 -12.284 9.201 8.244 492 HB2 GLU 63 1HB GLU 63 -14.431 11.279 8.360 493 HB3 GLU 63 2HB GLU 63 -14.159 9.903 9.418 494 HG2 GLU 63 1HG GLU 63 -13.499 11.560 10.810 495 HG3 GLU 63 2HG GLU 63 -11.962 11.251 10.004 496 H GLU 64 H GLU 64 -12.261 8.210 6.202 497 HA GLU 64 HA GLU 64 -14.788 8.018 4.944 498 HB2 GLU 64 1HB GLU 64 -14.544 9.841 3.613 499 HB3 GLU 64 2HB GLU 64 -12.799 9.868 3.794 500 HG2 GLU 64 1HG GLU 64 -12.506 8.264 2.077 501 HG3 GLU 64 2HG GLU 64 -14.228 7.894 2.037 502 H ASN 65 H ASN 65 -14.782 6.438 3.158 503 HA ASN 65 HA ASN 65 -14.192 4.447 2.235 504 HB2 ASN 65 1HB ASN 65 -12.286 5.733 1.328 505 HB3 ASN 65 2HB ASN 65 -11.359 5.382 2.787 506 HD21 ASN 65 1HD2 ASN 65 -11.124 4.689 -0.166 507 HD22 ASN 65 2HD2 ASN 65 -10.824 2.988 -0.166 508 H SER 66 H SER 66 -11.430 4.605 4.406 509 HA SER 66 HA SER 66 -10.643 2.869 5.763 510 HG SER 66 HG SER 66 -11.979 5.536 6.385 511 HB2 SER 66 1HB SER 66 -13.109 3.714 7.282 512 HB3 SER 66 2HB SER 66 -11.556 3.196 7.938 513 H LYS 67 H LYS 67 -11.093 0.960 4.422 514 HA LYS 67 HA LYS 67 -13.507 -0.513 5.240 515 HB2 LYS 67 1HB LYS 67 -12.897 -2.108 3.378 516 HB3 LYS 67 2HB LYS 67 -13.375 -0.502 2.865 517 HG2 LYS 67 1HG LYS 67 -11.573 -0.975 1.517 518 HG3 LYS 67 2HG LYS 67 -10.837 -0.018 2.797 519 HD2 LYS 67 1HD LYS 67 -10.280 -2.221 3.926 520 HD3 LYS 67 2HD LYS 67 -10.770 -3.003 2.426 521 HE2 LYS 67 1HE LYS 67 -9.078 -1.768 1.207 522 HE3 LYS 67 2HE LYS 67 -8.620 -0.908 2.673 523 HZ1 LYS 67 3HZ LYS 67 -8.523 -3.714 3.085 524 HZ2 LYS 67 1HZ LYS 67 -7.291 -2.568 3.251 525 HZ3 LYS 67 2HZ LYS 67 -7.577 -3.287 1.748 526 H ASP 68 H ASP 68 -13.273 -2.867 5.682 527 HA ASP 68 HA ASP 68 -10.687 -3.416 7.006 528 HB2 ASP 68 1HB ASP 68 -12.063 -4.774 8.652 529 HB3 ASP 68 2HB ASP 68 -12.235 -3.025 8.751 530 H VAL 69 H VAL 69 -12.778 -4.482 4.586 531 HA VAL 69 HA VAL 69 -11.555 -7.162 4.724 532 HB VAL 69 HB VAL 69 -14.060 -7.091 5.251 533 HG11 VAL 69 1HG1 VAL 69 -15.565 -6.395 3.755 534 HG12 VAL 69 2HG1 VAL 69 -14.756 -7.224 2.426 535 HG13 VAL 69 3HG1 VAL 69 -14.212 -5.625 2.927 536 HG21 VAL 69 3HG2 VAL 69 -13.411 -9.230 4.912 537 HG22 VAL 69 1HG2 VAL 69 -12.614 -8.862 3.384 538 HG23 VAL 69 2HG2 VAL 69 -14.366 -9.047 3.440 539 H VAL 70 H VAL 70 -10.790 -8.043 2.845 540 HA VAL 70 HA VAL 70 -11.350 -6.834 0.277 541 HB VAL 70 HB VAL 70 -9.009 -6.258 -0.263 542 HG11 VAL 70 1HG1 VAL 70 -9.020 -4.126 0.734 543 HG12 VAL 70 2HG1 VAL 70 -9.888 -4.710 2.153 544 HG13 VAL 70 3HG1 VAL 70 -10.713 -4.602 0.598 545 HG21 VAL 70 3HG2 VAL 70 -7.971 -7.712 1.517 546 HG22 VAL 70 1HG2 VAL 70 -8.429 -6.474 2.689 547 HG23 VAL 70 2HG2 VAL 70 -7.304 -6.082 1.396 548 H GLU 71 H GLU 71 -10.710 -8.075 -1.484 549 HA GLU 71 HA GLU 71 -10.005 -10.825 -0.826 550 HB2 GLU 71 1HB GLU 71 -10.532 -9.887 -3.634 551 HB3 GLU 71 2HB GLU 71 -10.833 -11.458 -2.914 552 HG2 GLU 71 1HG GLU 71 -12.748 -10.753 -1.831 553 HG3 GLU 71 2HG GLU 71 -12.335 -9.048 -2.000 554 H LEU 72 H LEU 72 -8.355 -11.969 -1.859 555 HA LEU 72 HA LEU 72 -5.838 -11.016 -1.750 556 HG LEU 72 HG LEU 72 -4.350 -12.138 -3.871 557 HB2 LEU 72 1HB LEU 72 -6.305 -13.364 -2.049 558 HB3 LEU 72 2HB LEU 72 -6.934 -13.083 -3.660 559 HD11 LEU 72 1HD1 LEU 72 -2.946 -13.921 -2.936 560 HD12 LEU 72 2HD1 LEU 72 -4.355 -14.593 -2.119 561 HD13 LEU 72 3HD1 LEU 72 -3.759 -12.993 -1.676 562 HD21 LEU 72 3HD2 LEU 72 -5.031 -15.002 -4.409 563 HD22 LEU 72 1HD2 LEU 72 -4.056 -13.886 -5.365 564 HD23 LEU 72 2HD2 LEU 72 -5.810 -13.705 -5.316 565 H GLY 73 H GLY 73 -4.643 -9.530 -2.792 566 HA2 GLY 73 1HA GLY 73 -3.690 -8.833 -4.948 567 HA3 GLY 73 2HA GLY 73 -5.304 -8.955 -5.621 568 H ASP 74 H ASP 74 -6.561 -7.597 -3.354 569 HA ASP 74 HA ASP 74 -6.323 -4.934 -4.313 570 HB2 ASP 74 1HB ASP 74 -7.635 -5.456 -1.685 571 HB3 ASP 74 2HB ASP 74 -8.182 -4.442 -3.012 572 H VAL 75 H VAL 75 -4.979 -3.299 -3.652 573 HA VAL 75 HA VAL 75 -3.283 -3.764 -1.293 574 HB VAL 75 HB VAL 75 -3.089 -1.438 -3.246 575 HG11 VAL 75 1HG1 VAL 75 -0.912 -1.119 -2.466 576 HG12 VAL 75 2HG1 VAL 75 -0.857 -2.692 -1.675 577 HG13 VAL 75 3HG1 VAL 75 -1.866 -1.404 -1.012 578 HG21 VAL 75 3HG2 VAL 75 -1.100 -3.389 -3.791 579 HG22 VAL 75 1HG2 VAL 75 -2.372 -2.787 -4.851 580 HG23 VAL 75 2HG2 VAL 75 -2.671 -4.188 -3.824 581 H ALA 76 H ALA 76 -3.154 -2.101 0.443 582 HA ALA 76 HA ALA 76 -5.187 -0.015 0.328 583 HB1 ALA 76 3HB ALA 76 -5.428 -2.432 1.914 584 HB2 ALA 76 1HB ALA 76 -6.638 -1.218 1.508 585 HB3 ALA 76 2HB ALA 76 -5.561 -0.966 2.882 586 H TYR 77 H TYR 77 -4.964 1.662 1.854 587 HA TYR 77 HA TYR 77 -2.270 1.810 3.040 588 HD1 TYR 77 HD1 TYR 77 -1.568 4.990 3.994 589 HD2 TYR 77 HD2 TYR 77 -5.452 4.973 2.261 590 HE1 TYR 77 HE1 TYR 77 -2.154 6.988 5.295 591 HE2 TYR 77 HE2 TYR 77 -6.047 6.970 3.566 592 HH TYR 77 HH TYR 77 -5.310 8.076 5.679 593 HB2 TYR 77 1HB TYR 77 -2.063 3.733 1.916 594 HB3 TYR 77 2HB TYR 77 -3.715 3.607 1.333 595 H TRP 78 H TRP 78 -2.158 1.786 5.191 596 HA TRP 78 HA TRP 78 -4.438 1.607 6.823 597 HD1 TRP 78 HD1 TRP 78 -5.195 1.482 8.734 598 HE1 TRP 78 HE1 TRP 78 -5.367 0.480 11.098 599 HE3 TRP 78 HE3 TRP 78 -0.229 0.658 9.632 600 HZ2 TRP 78 HZ2 TRP 78 -3.630 -0.530 13.081 601 HZ3 TRP 78 HZ3 TRP 78 0.432 -0.329 11.787 602 HH2 TRP 78 HH2 TRP 78 -1.235 -0.909 13.473 603 HB2 TRP 78 1HB TRP 78 -1.956 0.872 7.257 604 HB3 TRP 78 2HB TRP 78 -1.803 2.478 7.954 605 H ILE 79 H ILE 79 -5.730 3.104 7.718 606 HA ILE 79 HA ILE 79 -5.281 5.879 7.176 607 HB ILE 79 HB ILE 79 -7.464 4.361 8.574 608 HG12 ILE 79 1HG1 ILE 79 -6.992 5.533 5.952 609 HG13 ILE 79 2HG1 ILE 79 -8.177 4.332 6.448 610 HG21 ILE 79 1HG2 ILE 79 -8.663 6.480 8.941 611 HG22 ILE 79 2HG2 ILE 79 -7.214 7.363 8.461 612 HG23 ILE 79 3HG2 ILE 79 -7.196 6.363 9.914 613 HD11 ILE 79 3HD1 ILE 79 -9.424 6.131 5.621 614 HD12 ILE 79 1HD1 ILE 79 -8.426 7.320 6.460 615 HD13 ILE 79 2HD1 ILE 79 -9.523 6.284 7.374 616 HA PRO 80 HA PRO 80 -4.846 6.353 11.955 617 HB2 PRO 80 1HB PRO 80 -4.702 4.093 13.463 618 HB3 PRO 80 2HB PRO 80 -6.224 4.914 13.101 619 HG2 PRO 80 1HG PRO 80 -5.009 2.516 11.786 620 HG3 PRO 80 2HG PRO 80 -6.691 2.790 12.274 621 HD2 PRO 80 1HD PRO 80 -5.882 3.078 9.719 622 HD3 PRO 80 2HD PRO 80 -7.147 4.101 10.428 623 H GLY 81 H GLY 81 -2.789 6.870 10.956 624 HA2 GLY 81 1HA GLY 81 -0.520 6.555 12.066 625 HA3 GLY 81 2HA GLY 81 -0.661 4.895 11.504 626 H LYS 82 H LYS 82 -2.130 6.525 9.123 627 HA LYS 82 HA LYS 82 -1.522 6.969 6.953 628 HB2 LYS 82 1HB LYS 82 0.934 8.398 7.429 629 HB3 LYS 82 2HB LYS 82 -0.615 9.002 6.870 630 HG2 LYS 82 1HG LYS 82 -0.652 10.189 8.752 631 HG3 LYS 82 2HG LYS 82 -1.031 8.677 9.576 632 HD2 LYS 82 1HD LYS 82 1.633 8.444 9.455 633 HD3 LYS 82 2HD LYS 82 1.501 10.204 9.476 634 HE2 LYS 82 1HE LYS 82 0.195 8.364 11.476 635 HE3 LYS 82 2HE LYS 82 1.733 9.187 11.732 636 HZ1 LYS 82 3HZ LYS 82 0.726 11.169 12.042 637 HZ2 LYS 82 1HZ LYS 82 -0.581 10.197 12.504 638 HZ3 LYS 82 2HZ LYS 82 -0.523 10.852 10.946 639 H ALA 83 H ALA 83 -0.574 4.505 7.942 640 HA ALA 83 HA ALA 83 2.031 4.227 6.601 641 HB1 ALA 83 3HB ALA 83 0.991 3.182 9.052 642 HB2 ALA 83 1HB ALA 83 2.620 3.053 8.393 643 HB3 ALA 83 2HB ALA 83 1.402 1.848 7.976 644 H ILE 84 H ILE 84 2.234 2.972 4.817 645 HA ILE 84 HA ILE 84 -0.202 1.832 3.682 646 HB ILE 84 HB ILE 84 2.468 1.795 2.323 647 HG12 ILE 84 1HG1 ILE 84 0.552 4.134 2.400 648 HG13 ILE 84 2HG1 ILE 84 2.162 4.099 3.111 649 HG21 ILE 84 1HG2 ILE 84 0.906 2.165 0.329 650 HG22 ILE 84 2HG2 ILE 84 -0.397 1.763 1.448 651 HG23 ILE 84 3HG2 ILE 84 0.877 0.587 1.118 652 HD11 ILE 84 3HD1 ILE 84 2.336 3.396 0.348 653 HD12 ILE 84 1HD1 ILE 84 3.049 4.767 1.198 654 HD13 ILE 84 2HD1 ILE 84 1.424 4.896 0.522 655 H CYS 85 H CYS 85 -0.351 -0.362 2.983 656 HA CYS 85 HA CYS 85 1.781 -2.150 3.849 657 HG CYS 85 HG CYS 85 -0.280 -4.789 4.404 658 HB2 CYS 85 1HB CYS 85 0.387 -2.085 5.791 659 HB3 CYS 85 2HB CYS 85 -1.068 -2.306 4.822 660 H LEU 86 H LEU 86 1.657 -4.296 3.046 661 HA LEU 86 HA LEU 86 0.166 -4.507 0.501 662 HG LEU 86 HG LEU 86 1.493 -4.418 -1.193 663 HB2 LEU 86 1HB LEU 86 2.914 -4.895 1.124 664 HB3 LEU 86 2HB LEU 86 2.256 -6.477 0.748 665 HD11 LEU 86 1HD1 LEU 86 3.965 -3.954 -0.334 666 HD12 LEU 86 2HD1 LEU 86 3.522 -3.824 -2.035 667 HD13 LEU 86 3HD1 LEU 86 4.318 -5.282 -1.442 668 HD21 LEU 86 3HD2 LEU 86 1.052 -6.723 -1.636 669 HD22 LEU 86 1HD2 LEU 86 2.729 -7.168 -1.310 670 HD23 LEU 86 2HD2 LEU 86 2.330 -6.205 -2.735 671 H PHE 87 H PHE 87 -0.584 -6.682 -0.099 672 HA PHE 87 HA PHE 87 -0.929 -8.515 2.161 673 HD1 PHE 87 HD2 PHE 87 -2.698 -7.413 3.977 674 HD2 PHE 87 HD1 PHE 87 -3.615 -5.590 0.247 675 HE1 PHE 87 HE2 PHE 87 -3.203 -5.305 5.137 676 HE2 PHE 87 HE1 PHE 87 -4.119 -3.485 1.399 677 HZ PHE 87 HZ PHE 87 -3.918 -3.333 3.847 678 HB2 PHE 87 1HB PHE 87 -3.235 -7.870 0.333 679 HB3 PHE 87 2HB PHE 87 -3.266 -8.732 1.869 680 H PHE 88 H PHE 88 -0.486 -10.549 1.631 681 HA PHE 88 HA PHE 88 -1.189 -11.720 -0.859 682 HD1 PHE 88 HD1 PHE 88 0.466 -13.174 -2.956 683 HD2 PHE 88 HD2 PHE 88 0.642 -8.958 -2.404 684 HE1 PHE 88 HE1 PHE 88 -0.043 -12.845 -5.341 685 HE2 PHE 88 HE2 PHE 88 0.133 -8.621 -4.789 686 HZ PHE 88 HZ PHE 88 -0.210 -10.567 -6.260 687 HB2 PHE 88 1HB PHE 88 1.379 -10.396 -0.699 688 HB3 PHE 88 2HB PHE 88 1.591 -12.118 -0.986 689 H GLY 89 H GLY 89 -1.865 -12.567 1.587 690 HA2 GLY 89 1HA GLY 89 -1.224 -15.211 1.711 691 HA3 GLY 89 2HA GLY 89 0.045 -14.448 2.652 692 H LYS 90 H LYS 90 -0.610 -13.180 4.542 693 HA LYS 90 HA LYS 90 -3.295 -13.512 5.518 694 HB2 LYS 90 1HB LYS 90 -2.495 -14.596 7.672 695 HB3 LYS 90 2HB LYS 90 -2.638 -15.631 6.271 696 HG2 LYS 90 1HG LYS 90 -0.102 -14.554 7.513 697 HG3 LYS 90 2HG LYS 90 -0.665 -16.221 7.463 698 HD2 LYS 90 1HD LYS 90 -0.595 -15.841 4.867 699 HD3 LYS 90 2HD LYS 90 0.554 -14.573 5.304 700 HE2 LYS 90 1HE LYS 90 1.511 -16.568 6.801 701 HE3 LYS 90 2HE LYS 90 0.789 -17.514 5.501 702 HZ1 LYS 90 3HZ LYS 90 2.092 -16.276 3.904 703 HZ2 LYS 90 1HZ LYS 90 3.113 -16.975 5.060 704 HZ3 LYS 90 2HZ LYS 90 2.759 -15.323 5.131 705 H THR 91 H THR 91 -3.343 -12.789 7.968 706 HA THR 91 HA THR 91 -1.424 -10.656 8.494 707 HB THR 91 HB THR 91 -4.069 -9.688 9.087 708 HG1 THR 91 HG1 THR 91 -4.932 -10.791 7.427 709 HG21 THR 91 3HG2 THR 91 -3.121 -7.777 8.518 710 HG22 THR 91 1HG2 THR 91 -2.873 -8.343 6.867 711 HG23 THR 91 2HG2 THR 91 -1.656 -8.670 8.101 712 HA PRO 92 HA PRO 92 -1.896 -11.268 12.875 713 HB2 PRO 92 1HB PRO 92 -4.133 -9.286 13.074 714 HB3 PRO 92 2HB PRO 92 -2.720 -9.490 14.116 715 HG2 PRO 92 1HG PRO 92 -2.763 -7.548 12.316 716 HG3 PRO 92 2HG PRO 92 -1.282 -8.487 12.583 717 HD2 PRO 92 1HD PRO 92 -3.218 -8.603 10.327 718 HD3 PRO 92 2HD PRO 92 -1.465 -8.873 10.321 719 H ILE 93 H ILE 93 -4.832 -11.269 10.964 720 HA ILE 93 HA ILE 93 -5.855 -13.429 12.675 721 HB ILE 93 HB ILE 93 -7.737 -11.500 11.358 722 HG12 ILE 93 1HG1 ILE 93 -7.835 -10.722 13.947 723 HG13 ILE 93 2HG1 ILE 93 -6.122 -11.107 13.812 724 HG21 ILE 93 1HG2 ILE 93 -8.127 -13.147 13.840 725 HG22 ILE 93 2HG2 ILE 93 -8.440 -13.777 12.222 726 HG23 ILE 93 3HG2 ILE 93 -9.352 -12.392 12.821 727 HD11 ILE 93 3HD1 ILE 93 -6.025 -9.596 11.830 728 HD12 ILE 93 1HD1 ILE 93 -6.396 -8.793 13.355 729 HD13 ILE 93 2HD1 ILE 93 -7.682 -9.114 12.192 730 H SER 94 H SER 94 -4.797 -14.738 10.980 731 HA SER 94 HA SER 94 -6.075 -14.769 8.367 732 HG SER 94 HG SER 94 -3.313 -14.424 9.527 733 HB2 SER 94 1HB SER 94 -4.290 -16.988 8.803 734 HB3 SER 94 2HB SER 94 -4.128 -15.632 7.690 735 H ASP 95 H ASP 95 -7.428 -15.607 10.991 736 HA ASP 95 HA ASP 95 -7.808 -18.284 11.286 737 HB2 ASP 95 1HB ASP 95 -9.385 -15.888 11.836 738 HB3 ASP 95 2HB ASP 95 -10.383 -17.315 11.570 739 H ASP 96 H ASP 96 -10.470 -16.601 9.676 740 HA ASP 96 HA ASP 96 -10.582 -18.825 7.754 741 HB2 ASP 96 1HB ASP 96 -12.651 -17.294 9.212 742 HB3 ASP 96 2HB ASP 96 -13.027 -17.681 7.535 743 H LYS 97 H LYS 97 -9.803 -15.572 7.992 744 HA LYS 97 HA LYS 97 -9.701 -15.315 5.118 745 HB2 LYS 97 1HB LYS 97 -11.255 -13.273 6.713 746 HB3 LYS 97 2HB LYS 97 -10.989 -13.276 4.976 747 HG2 LYS 97 1HG LYS 97 -12.260 -15.443 4.890 748 HG3 LYS 97 2HG LYS 97 -12.683 -15.169 6.581 749 HD2 LYS 97 1HD LYS 97 -13.156 -12.892 4.783 750 HD3 LYS 97 2HD LYS 97 -14.156 -14.312 4.476 751 HE2 LYS 97 1HE LYS 97 -13.902 -13.562 7.304 752 HE3 LYS 97 2HE LYS 97 -14.729 -12.376 6.295 753 HZ1 LYS 97 3HZ LYS 97 -15.950 -14.448 7.421 754 HZ2 LYS 97 1HZ LYS 97 -15.542 -15.141 5.931 755 HZ3 LYS 97 2HZ LYS 97 -16.479 -13.734 5.981 756 H ILE 98 H ILE 98 -9.083 -12.731 4.797 757 HA ILE 98 HA ILE 98 -6.664 -12.430 6.438 758 HB ILE 98 HB ILE 98 -7.342 -11.332 3.706 759 HG12 ILE 98 1HG1 ILE 98 -4.940 -13.006 4.260 760 HG13 ILE 98 2HG1 ILE 98 -6.507 -13.811 4.256 761 HG21 ILE 98 1HG2 ILE 98 -4.581 -11.011 4.547 762 HG22 ILE 98 2HG2 ILE 98 -5.702 -10.100 5.558 763 HG23 ILE 98 3HG2 ILE 98 -5.685 -9.847 3.815 764 HD11 ILE 98 3HD1 ILE 98 -5.785 -12.033 1.978 765 HD12 ILE 98 1HD1 ILE 98 -6.833 -13.453 2.016 766 HD13 ILE 98 2HD1 ILE 98 -5.082 -13.648 2.080 767 H ARG 99 H ARG 99 -7.057 -11.129 8.132 768 HA ARG 99 HA ARG 99 -8.727 -8.748 7.724 769 HE ARG 99 HE ARG 99 -11.076 -7.918 10.440 770 HB2 ARG 99 1HB ARG 99 -7.659 -9.887 10.313 771 HB3 ARG 99 2HB ARG 99 -8.838 -8.595 10.146 772 HG2 ARG 99 1HG ARG 99 -9.484 -11.199 8.889 773 HG3 ARG 99 2HG ARG 99 -9.537 -11.099 10.650 774 HD2 ARG 99 1HD ARG 99 -11.052 -9.384 8.689 775 HD3 ARG 99 2HD ARG 99 -11.724 -10.618 9.753 776 HH11 ARG 99 1HH1 ARG 99 -11.358 -11.161 11.698 777 HH12 ARG 99 2HH1 ARG 99 -11.650 -10.638 13.323 778 HH21 ARG 99 1HH2 ARG 99 -11.460 -7.230 12.577 779 HH22 ARG 99 2HH2 ARG 99 -11.708 -8.407 13.822 780 HA PRO 100 HA PRO 100 -4.617 -6.810 7.440 781 HB2 PRO 100 1HB PRO 100 -5.459 -4.566 6.187 782 HB3 PRO 100 2HB PRO 100 -5.222 -6.097 5.337 783 HG2 PRO 100 1HG PRO 100 -7.763 -4.904 6.390 784 HG3 PRO 100 2HG PRO 100 -7.445 -5.635 4.801 785 HD2 PRO 100 1HD PRO 100 -8.663 -6.992 6.789 786 HD3 PRO 100 2HD PRO 100 -7.580 -7.787 5.628 787 H ALA 101 H ALA 101 -7.633 -5.398 8.618 788 HA ALA 101 HA ALA 101 -6.548 -4.479 11.040 789 HB1 ALA 101 3HB ALA 101 -5.815 -2.382 10.719 790 HB2 ALA 101 1HB ALA 101 -7.068 -2.010 9.535 791 HB3 ALA 101 2HB ALA 101 -5.619 -2.883 9.039 792 H SER 102 H SER 102 -8.100 -2.120 11.388 793 HA SER 102 HA SER 102 -10.806 -3.248 11.161 794 HG SER 102 HG SER 102 -8.881 -3.435 13.353 795 HB2 SER 102 1HB SER 102 -10.529 -1.139 13.148 796 HB3 SER 102 2HB SER 102 -11.160 -2.775 13.327 797 H ALA 103 H ALA 103 -8.863 -0.831 9.907 798 HA ALA 103 HA ALA 103 -11.064 0.440 8.636 799 HB1 ALA 103 3HB ALA 103 -11.318 2.402 9.744 800 HB2 ALA 103 1HB ALA 103 -9.655 2.419 10.330 801 HB3 ALA 103 2HB ALA 103 -10.851 1.381 11.105 802 H VAL 104 H VAL 104 -9.436 -0.421 7.024 803 HA VAL 104 HA VAL 104 -7.476 1.706 6.434 804 HB VAL 104 HB VAL 104 -5.975 0.132 5.396 805 HG11 VAL 104 1HG1 VAL 104 -6.205 -1.494 7.730 806 HG12 VAL 104 2HG1 VAL 104 -6.592 0.176 8.147 807 HG13 VAL 104 3HG1 VAL 104 -5.052 -0.207 7.378 808 HG21 VAL 104 3HG2 VAL 104 -7.619 -2.203 6.286 809 HG22 VAL 104 1HG2 VAL 104 -6.357 -2.120 5.058 810 HG23 VAL 104 2HG2 VAL 104 -7.946 -1.434 4.733 811 H ASN 105 H ASN 105 -7.328 2.478 4.369 812 HA ASN 105 HA ASN 105 -9.649 2.039 2.696 813 HB2 ASN 105 1HB ASN 105 -7.341 3.841 2.004 814 HB3 ASN 105 2HB ASN 105 -9.037 4.013 1.567 815 HD21 ASN 105 1HD2 ASN 105 -7.511 6.044 2.654 816 HD22 ASN 105 2HD2 ASN 105 -8.137 6.440 4.212 817 H VAL 106 H VAL 106 -9.591 1.565 0.458 818 HA VAL 106 HA VAL 106 -7.471 -0.283 -0.307 819 HB VAL 106 HB VAL 106 -9.177 -0.067 -2.491 820 HG11 VAL 106 1HG1 VAL 106 -9.375 -2.283 -2.219 821 HG12 VAL 106 2HG1 VAL 106 -9.861 -2.145 -0.529 822 HG13 VAL 106 3HG1 VAL 106 -8.155 -2.033 -0.970 823 HG21 VAL 106 3HG2 VAL 106 -10.804 0.078 0.039 824 HG22 VAL 106 1HG2 VAL 106 -11.441 -0.426 -1.526 825 HG23 VAL 106 2HG2 VAL 106 -10.823 1.212 -1.312 826 H ILE 107 H ILE 107 -5.713 0.833 -0.950 827 HA ILE 107 HA ILE 107 -5.979 3.253 -2.502 828 HB ILE 107 HB ILE 107 -4.314 2.913 -0.637 829 HG12 ILE 107 1HG1 ILE 107 -3.791 4.042 -3.335 830 HG13 ILE 107 2HG1 ILE 107 -3.869 4.850 -1.774 831 HG21 ILE 107 1HG2 ILE 107 -3.548 0.682 -1.278 832 HG22 ILE 107 2HG2 ILE 107 -2.202 1.817 -1.194 833 HG23 ILE 107 3HG2 ILE 107 -2.856 1.341 -2.760 834 HD11 ILE 107 3HD1 ILE 107 -1.652 4.022 -1.234 835 HD12 ILE 107 1HD1 ILE 107 -1.645 4.946 -2.737 836 HD13 ILE 107 2HD1 ILE 107 -1.585 3.183 -2.785 837 H GLY 108 H GLY 108 -6.656 0.518 -3.622 838 HA2 GLY 108 1HA GLY 108 -6.626 0.348 -6.081 839 HA3 GLY 108 2HA GLY 108 -4.914 0.719 -5.999 840 H ARG 109 H ARG 109 -4.291 -1.133 -7.090 841 HA ARG 109 HA ARG 109 -4.128 -3.510 -5.448 842 HE ARG 109 HE ARG 109 -8.545 -4.849 -5.371 843 HB2 ARG 109 1HB ARG 109 -5.264 -3.828 -8.220 844 HB3 ARG 109 2HB ARG 109 -5.187 -5.019 -6.929 845 HG2 ARG 109 1HG ARG 109 -6.824 -3.632 -5.653 846 HG3 ARG 109 2HG ARG 109 -6.983 -2.607 -7.079 847 HD2 ARG 109 1HD ARG 109 -8.294 -4.083 -8.127 848 HD3 ARG 109 2HD ARG 109 -7.268 -5.444 -7.678 849 HH11 ARG 109 1HH1 ARG 109 -9.658 -5.464 -8.619 850 HH12 ARG 109 2HH1 ARG 109 -11.169 -6.135 -8.109 851 HH21 ARG 109 1HH2 ARG 109 -10.535 -5.732 -4.696 852 HH22 ARG 109 2HH2 ARG 109 -11.668 -6.287 -5.882 853 H ILE 110 H ILE 110 -2.717 -5.172 -6.444 854 HA ILE 110 HA ILE 110 -0.529 -3.877 -7.888 855 HB ILE 110 HB ILE 110 -0.649 -6.646 -6.676 856 HG12 ILE 110 1HG1 ILE 110 1.142 -5.018 -5.241 857 HG13 ILE 110 2HG1 ILE 110 -0.298 -4.034 -5.470 858 HG21 ILE 110 1HG2 ILE 110 1.749 -6.685 -6.928 859 HG22 ILE 110 2HG2 ILE 110 1.738 -5.050 -7.590 860 HG23 ILE 110 3HG2 ILE 110 0.998 -6.372 -8.493 861 HD11 ILE 110 3HD1 ILE 110 -0.421 -5.216 -3.379 862 HD12 ILE 110 1HD1 ILE 110 -0.175 -6.758 -4.195 863 HD13 ILE 110 2HD1 ILE 110 -1.652 -5.836 -4.476 864 H VAL 111 H VAL 111 -0.579 -3.970 -10.052 865 HA VAL 111 HA VAL 111 -1.838 -6.301 -11.324 866 HB VAL 111 HB VAL 111 -1.529 -4.644 -13.415 867 HG11 VAL 111 1HG1 VAL 111 -3.907 -3.753 -12.574 868 HG12 VAL 111 2HG1 VAL 111 -3.694 -5.099 -11.455 869 HG13 VAL 111 3HG1 VAL 111 -3.657 -5.385 -13.194 870 HG21 VAL 111 3HG2 VAL 111 -2.242 -2.680 -11.274 871 HG22 VAL 111 1HG2 VAL 111 -1.703 -2.388 -12.928 872 HG23 VAL 111 2HG2 VAL 111 -0.553 -2.941 -11.711 873 H ASN 112 H ASN 112 0.494 -4.111 -12.842 874 HA ASN 112 HA ASN 112 1.936 -6.326 -13.939 875 HB2 ASN 112 1HB ASN 112 3.445 -4.555 -14.850 876 HB3 ASN 112 2HB ASN 112 1.744 -4.299 -15.232 877 HD21 ASN 112 1HD2 ASN 112 4.252 -2.568 -14.778 878 HD22 ASN 112 2HD2 ASN 112 3.665 -1.288 -13.776 879 H SER 113 H SER 113 2.248 -7.128 -11.581 880 HA SER 113 HA SER 113 4.921 -7.260 -10.998 881 HG SER 113 HG SER 113 5.965 -5.044 -10.900 882 HB2 SER 113 1HB SER 113 3.860 -4.747 -10.141 883 HB3 SER 113 2HB SER 113 4.280 -5.690 -8.711 884 H MET 114 H MET 114 2.729 -8.963 -10.990 885 HA MET 114 HA MET 114 1.762 -9.497 -8.373 886 HB2 MET 114 1HB MET 114 0.954 -10.281 -10.796 887 HB3 MET 114 2HB MET 114 1.916 -11.690 -10.376 888 HG2 MET 114 1HG MET 114 0.567 -12.201 -8.530 889 HG3 MET 114 2HG MET 114 -0.189 -10.609 -8.537 890 HE1 MET 114 3HE MET 114 -1.596 -13.231 -8.177 891 HE2 MET 114 1HE MET 114 -2.834 -13.511 -9.402 892 HE3 MET 114 2HE MET 114 -2.813 -11.995 -8.501 893 H GLU 115 H GLU 115 3.973 -9.292 -7.388 894 HA GLU 115 HA GLU 115 5.531 -11.771 -7.591 895 HB2 GLU 115 1HB GLU 115 6.389 -9.197 -7.622 896 HB3 GLU 115 2HB GLU 115 6.539 -9.562 -5.908 897 HG2 GLU 115 1HG GLU 115 7.621 -11.754 -7.307 898 HG3 GLU 115 2HG GLU 115 8.253 -10.295 -8.068 899 H GLY 116 H GLY 116 6.796 -11.735 -5.135 900 HA2 GLY 116 1HA GLY 116 4.568 -12.107 -3.231 901 HA3 GLY 116 2HA GLY 116 5.845 -13.301 -3.406 902 H LEU 117 H LEU 117 6.012 -9.756 -3.259 903 HA LEU 117 HA LEU 117 8.307 -9.472 -1.843 904 HG LEU 117 HG LEU 117 7.567 -7.518 0.248 905 HB2 LEU 117 1HB LEU 117 7.198 -7.546 -2.706 906 HB3 LEU 117 2HB LEU 117 5.786 -7.829 -1.706 907 HD11 LEU 117 1HD1 LEU 117 8.679 -5.791 -1.956 908 HD12 LEU 117 2HD1 LEU 117 9.466 -7.217 -1.278 909 HD13 LEU 117 3HD1 LEU 117 9.187 -5.801 -0.267 910 HD21 LEU 117 3HD2 LEU 117 5.492 -6.240 -0.111 911 HD22 LEU 117 1HD2 LEU 117 6.358 -5.198 -1.240 912 HD23 LEU 117 2HD2 LEU 117 6.827 -5.237 0.459 913 H LYS 118 H LYS 118 5.117 -10.170 -0.508 914 HA LYS 118 HA LYS 118 5.417 -9.789 2.154 915 HB2 LYS 118 1HB LYS 118 4.028 -11.902 2.479 916 HB3 LYS 118 2HB LYS 118 3.348 -10.647 1.456 917 HG2 LYS 118 1HG LYS 118 2.900 -12.504 0.216 918 HG3 LYS 118 2HG LYS 118 4.459 -12.050 -0.464 919 HD2 LYS 118 1HD LYS 118 4.602 -14.367 -0.086 920 HD3 LYS 118 2HD LYS 118 5.481 -13.633 1.256 921 HE2 LYS 118 1HE LYS 118 2.866 -13.778 2.161 922 HE3 LYS 118 2HE LYS 118 3.099 -15.287 1.279 923 HZ1 LYS 118 3HZ LYS 118 5.361 -15.155 2.688 924 HZ2 LYS 118 1HZ LYS 118 3.971 -15.961 3.216 925 HZ3 LYS 118 2HZ LYS 118 4.297 -14.393 3.758 926 H GLY 119 H GLY 119 7.163 -12.159 0.280 927 HA2 GLY 119 1HA GLY 119 8.073 -13.575 2.660 928 HA3 GLY 119 2HA GLY 119 8.487 -13.959 0.996 929 H VAL 120 H VAL 120 8.765 -10.789 2.467 930 HA VAL 120 HA VAL 120 11.531 -10.613 1.696 931 HB VAL 120 HB VAL 120 11.356 -8.330 2.829 932 HG11 VAL 120 1HG1 VAL 120 10.511 -9.269 0.310 933 HG12 VAL 120 2HG1 VAL 120 11.065 -7.652 0.742 934 HG13 VAL 120 3HG1 VAL 120 9.349 -8.045 0.822 935 HG21 VAL 120 3HG2 VAL 120 8.429 -9.070 2.852 936 HG22 VAL 120 1HG2 VAL 120 9.088 -7.471 3.182 937 HG23 VAL 120 2HG2 VAL 120 9.445 -8.812 4.268 938 H ALA 121 H ALA 121 13.293 -10.084 3.129 939 HA ALA 121 HA ALA 121 13.266 -11.591 5.565 940 HB1 ALA 121 3HB ALA 121 15.404 -9.713 4.549 941 HB2 ALA 121 1HB ALA 121 15.258 -11.409 4.088 942 HB3 ALA 121 2HB ALA 121 15.596 -10.977 5.763 943 H ASP 122 H ASP 122 13.468 -10.801 7.703 944 HA ASP 122 HA ASP 122 11.915 -8.636 8.386 945 HB2 ASP 122 1HB ASP 122 12.679 -8.892 10.627 946 HB3 ASP 122 2HB ASP 122 12.599 -10.496 9.901 947 H GLY 123 H GLY 123 12.154 -6.538 8.750 948 HA2 GLY 123 1HA GLY 123 13.049 -4.430 8.640 949 HA3 GLY 123 2HA GLY 123 14.462 -5.142 9.396 950 H GLU 124 H GLU 124 13.108 -3.852 6.514 951 HA GLU 124 HA GLU 124 15.752 -3.888 5.279 952 HB2 GLU 124 1HB GLU 124 13.427 -4.563 3.515 953 HB3 GLU 124 2HB GLU 124 15.137 -4.889 3.273 954 HG2 GLU 124 1HG GLU 124 13.474 -6.262 5.365 955 HG3 GLU 124 2HG GLU 124 13.699 -6.884 3.730 956 H SER 125 H SER 125 16.061 -2.294 3.660 957 HA SER 125 HA SER 125 14.804 0.162 4.207 958 HG SER 125 HG SER 125 17.823 -0.406 3.796 959 HB2 SER 125 1HB SER 125 16.142 -0.026 1.594 960 HB3 SER 125 2HB SER 125 16.473 1.042 2.957 961 H VAL 126 H VAL 126 13.631 1.534 2.731 962 HA VAL 126 HA VAL 126 12.181 0.254 0.553 963 HB VAL 126 HB VAL 126 10.705 1.561 2.845 964 HG11 VAL 126 1HG1 VAL 126 9.587 1.939 0.741 965 HG12 VAL 126 2HG1 VAL 126 8.685 0.756 1.688 966 HG13 VAL 126 3HG1 VAL 126 9.694 0.223 0.344 967 HG21 VAL 126 3HG2 VAL 126 11.128 -0.446 3.798 968 HG22 VAL 126 1HG2 VAL 126 11.328 -1.267 2.249 969 HG23 VAL 126 2HG2 VAL 126 9.713 -0.893 2.846 970 H VAL 127 H VAL 127 11.928 1.656 -1.111 971 HA VAL 127 HA VAL 127 12.042 4.537 -0.499 972 HB VAL 127 HB VAL 127 13.174 4.888 -2.685 973 HG11 VAL 127 1HG1 VAL 127 15.174 3.183 -1.521 974 HG12 VAL 127 2HG1 VAL 127 14.275 4.024 -0.258 975 HG13 VAL 127 3HG1 VAL 127 15.071 4.943 -1.534 976 HG21 VAL 127 3HG2 VAL 127 13.348 3.253 -4.172 977 HG22 VAL 127 1HG2 VAL 127 12.541 2.154 -3.052 978 HG23 VAL 127 2HG2 VAL 127 14.299 2.294 -3.038 979 H VAL 128 H VAL 128 10.040 5.252 -0.792 980 HA VAL 128 HA VAL 128 8.265 4.106 -2.760 981 HB VAL 128 HB VAL 128 7.460 6.643 -1.490 982 HG11 VAL 128 1HG1 VAL 128 5.670 5.607 -2.474 983 HG12 VAL 128 2HG1 VAL 128 5.526 4.982 -0.833 984 HG13 VAL 128 3HG1 VAL 128 6.257 3.986 -2.091 985 HG21 VAL 128 3HG2 VAL 128 8.466 4.380 0.128 986 HG22 VAL 128 1HG2 VAL 128 6.940 5.100 0.632 987 HG23 VAL 128 2HG2 VAL 128 8.385 6.101 0.506 988 H GLU 129 H GLU 129 7.920 4.887 -4.810 989 HA GLU 129 HA GLU 129 8.452 7.669 -5.422 990 HB2 GLU 129 1HB GLU 129 9.882 7.028 -7.388 991 HB3 GLU 129 2HB GLU 129 10.631 6.779 -5.819 992 HG2 GLU 129 1HG GLU 129 9.371 4.370 -6.381 993 HG3 GLU 129 2HG GLU 129 10.065 4.885 -7.919 994 H ARG 130 H ARG 130 6.949 8.420 -6.803 995 HA ARG 130 HA ARG 130 4.995 6.638 -7.914 996 HE ARG 130 HE ARG 130 2.253 10.752 -10.099 997 HB2 ARG 130 1HB ARG 130 4.307 8.805 -7.073 998 HB3 ARG 130 2HB ARG 130 5.396 9.623 -8.182 999 HG2 ARG 130 1HG ARG 130 3.394 7.848 -9.418 1000 HG3 ARG 130 2HG ARG 130 2.776 9.299 -8.627 1001 HD2 ARG 130 1HD ARG 130 5.044 10.069 -10.127 1002 HD3 ARG 130 2HD ARG 130 4.054 9.046 -11.168 1003 HH11 ARG 130 1HH1 ARG 130 5.297 11.224 -11.738 1004 HH12 ARG 130 2HH1 ARG 130 4.842 12.754 -12.409 1005 HH21 ARG 130 1HH2 ARG 130 1.652 12.765 -10.980 1006 HH22 ARG 130 2HH2 ARG 130 2.772 13.629 -11.979 1007 H ALA 131 H ALA 131 6.055 5.346 -9.411 1008 HA ALA 131 HA ALA 131 7.116 4.757 -11.362 1009 HB1 ALA 131 3HB ALA 131 6.081 5.795 -13.360 1010 HB2 ALA 131 1HB ALA 131 5.269 6.942 -12.295 1011 HB3 ALA 131 2HB ALA 131 4.912 5.218 -12.173 Start of MODEL 7 1 H MET 1 H MET 1 -11.584 9.123 -22.815 2 HA MET 1 HA MET 1 -12.866 7.876 -21.387 3 HB2 MET 1 1HB MET 1 -12.072 6.129 -23.726 4 HB3 MET 1 2HB MET 1 -13.594 6.051 -22.848 5 HG2 MET 1 1HG MET 1 -14.341 7.343 -24.509 6 HG3 MET 1 2HG MET 1 -13.588 8.644 -23.590 7 HE1 MET 1 3HE MET 1 -14.001 7.561 -27.140 8 HE2 MET 1 1HE MET 1 -13.046 8.961 -27.630 9 HE3 MET 1 2HE MET 1 -14.291 9.132 -26.392 10 H GLY 2 H GLY 2 -13.104 6.293 -19.862 11 HA2 GLY 2 1HA GLY 2 -12.322 3.942 -19.281 12 HA3 GLY 2 2HA GLY 2 -10.712 4.639 -19.357 13 H GLU 3 H GLU 3 -10.105 6.212 -17.775 14 HA GLU 3 HA GLU 3 -11.627 5.915 -15.275 15 HB2 GLU 3 1HB GLU 3 -8.707 6.579 -15.690 16 HB3 GLU 3 2HB GLU 3 -9.505 6.449 -14.128 17 HG2 GLU 3 1HG GLU 3 -9.027 4.256 -16.127 18 HG3 GLU 3 2HG GLU 3 -8.309 4.431 -14.526 19 H ARG 4 H ARG 4 -9.421 8.302 -16.757 20 HA ARG 4 HA ARG 4 -9.452 10.579 -16.801 21 HE ARG 4 HE ARG 4 -12.566 7.681 -17.702 22 HB2 ARG 4 1HB ARG 4 -12.403 9.978 -16.725 23 HB3 ARG 4 2HB ARG 4 -11.790 11.622 -16.820 24 HG2 ARG 4 1HG ARG 4 -12.213 11.067 -19.032 25 HG3 ARG 4 2HG ARG 4 -10.476 10.808 -18.869 26 HD2 ARG 4 1HD ARG 4 -11.789 9.012 -20.093 27 HD3 ARG 4 2HD ARG 4 -10.727 8.467 -18.796 28 HH11 ARG 4 1HH1 ARG 4 -13.613 10.060 -20.031 29 HH12 ARG 4 2HH1 ARG 4 -15.298 9.786 -19.741 30 HH21 ARG 4 1HH2 ARG 4 -14.782 7.318 -17.319 31 HH22 ARG 4 2HH2 ARG 4 -15.962 8.230 -18.200 32 H GLY 5 H GLY 5 -9.500 9.046 -14.150 33 HA2 GLY 5 1HA GLY 5 -9.302 11.267 -12.447 34 HA3 GLY 5 2HA GLY 5 -10.892 10.554 -12.229 35 H VAL 6 H VAL 6 -9.943 7.833 -12.751 36 HA VAL 6 HA VAL 6 -8.425 7.408 -10.247 37 HB VAL 6 HB VAL 6 -9.604 5.290 -9.936 38 HG11 VAL 6 1HG1 VAL 6 -10.803 6.706 -8.674 39 HG12 VAL 6 2HG1 VAL 6 -12.044 6.471 -9.904 40 HG13 VAL 6 3HG1 VAL 6 -10.987 7.881 -9.977 41 HG21 VAL 6 3HG2 VAL 6 -10.959 4.305 -11.430 42 HG22 VAL 6 1HG2 VAL 6 -10.170 5.360 -12.599 43 HG23 VAL 6 2HG2 VAL 6 -11.719 5.824 -11.899 44 H GLU 7 H GLU 7 -6.650 7.679 -11.955 45 HA GLU 7 HA GLU 7 -5.780 5.003 -12.697 46 HB2 GLU 7 1HB GLU 7 -4.983 6.030 -14.951 47 HB3 GLU 7 2HB GLU 7 -6.648 5.495 -14.790 48 HG2 GLU 7 1HG GLU 7 -6.277 7.712 -15.933 49 HG3 GLU 7 2HG GLU 7 -7.453 7.694 -14.620 50 H MET 8 H MET 8 -4.821 6.433 -10.603 51 HA MET 8 HA MET 8 -2.258 7.519 -11.560 52 HB2 MET 8 1HB MET 8 -3.996 8.804 -9.975 53 HB3 MET 8 2HB MET 8 -3.098 7.930 -8.740 54 HG2 MET 8 1HG MET 8 -1.615 9.570 -8.792 55 HG3 MET 8 2HG MET 8 -1.140 8.997 -10.389 56 HE1 MET 8 3HE MET 8 -1.150 12.139 -12.048 57 HE2 MET 8 1HE MET 8 -1.840 10.694 -12.789 58 HE3 MET 8 2HE MET 8 -0.476 10.552 -11.681 59 H ARG 9 H ARG 9 -0.627 6.144 -11.424 60 HA ARG 9 HA ARG 9 -0.634 4.191 -9.216 61 HE ARG 9 HE ARG 9 3.090 3.035 -13.664 62 HB2 ARG 9 1HB ARG 9 0.296 2.575 -10.584 63 HB3 ARG 9 2HB ARG 9 -0.801 3.408 -11.675 64 HG2 ARG 9 1HG ARG 9 0.968 3.449 -13.048 65 HG3 ARG 9 2HG ARG 9 1.486 4.819 -12.064 66 HD2 ARG 9 1HD ARG 9 3.071 3.597 -10.945 67 HD3 ARG 9 2HD ARG 9 2.204 2.075 -11.168 68 HH11 ARG 9 1HH1 ARG 9 4.324 1.625 -10.722 69 HH12 ARG 9 2HH1 ARG 9 5.689 0.893 -11.498 70 HH21 ARG 9 1HH2 ARG 9 4.884 2.075 -14.687 71 HH22 ARG 9 2HH2 ARG 9 6.007 1.150 -13.748 72 H LEU 10 H LEU 10 1.184 3.759 -8.072 73 HA LEU 10 HA LEU 10 3.476 5.562 -8.503 74 HG LEU 10 HG LEU 10 0.876 4.674 -6.143 75 HB2 LEU 10 1HB LEU 10 3.427 4.771 -5.765 76 HB3 LEU 10 2HB LEU 10 3.335 6.383 -6.438 77 HD11 LEU 10 1HD1 LEU 10 0.494 6.022 -4.030 78 HD12 LEU 10 2HD1 LEU 10 2.206 6.435 -4.090 79 HD13 LEU 10 3HD1 LEU 10 1.712 4.750 -3.918 80 HD21 LEU 10 3HD2 LEU 10 0.760 7.579 -5.820 81 HD22 LEU 10 1HD2 LEU 10 -0.249 6.501 -6.785 82 HD23 LEU 10 2HD2 LEU 10 1.307 7.053 -7.411 83 H ARG 11 H ARG 11 5.518 4.700 -7.531 84 HA ARG 11 HA ARG 11 5.617 1.803 -7.971 85 HE ARG 11 HE ARG 11 8.571 -1.182 -9.701 86 HB2 ARG 11 1HB ARG 11 7.130 3.845 -9.071 87 HB3 ARG 11 2HB ARG 11 8.194 3.162 -7.851 88 HG2 ARG 11 1HG ARG 11 6.882 1.698 -10.129 89 HG3 ARG 11 2HG ARG 11 8.595 2.082 -9.956 90 HD2 ARG 11 1HD ARG 11 8.247 0.752 -7.674 91 HD3 ARG 11 2HD ARG 11 6.961 -0.002 -8.617 92 HH11 ARG 11 1HH1 ARG 11 10.020 1.758 -8.502 93 HH12 ARG 11 2HH1 ARG 11 11.609 1.349 -9.059 94 HH21 ARG 11 1HH2 ARG 11 10.659 -1.721 -10.435 95 HH22 ARG 11 2HH2 ARG 11 11.970 -0.624 -10.157 96 H ILE 12 H ILE 12 6.652 0.442 -6.518 97 HA ILE 12 HA ILE 12 7.797 1.563 -4.096 98 HB ILE 12 HB ILE 12 5.163 0.253 -4.185 99 HG12 ILE 12 1HG1 ILE 12 6.505 1.762 -1.947 100 HG13 ILE 12 2HG1 ILE 12 5.768 2.563 -3.333 101 HG21 ILE 12 1HG2 ILE 12 5.583 -0.737 -1.848 102 HG22 ILE 12 2HG2 ILE 12 7.282 -0.757 -2.324 103 HG23 ILE 12 3HG2 ILE 12 6.092 -1.664 -3.259 104 HD11 ILE 12 3HD1 ILE 12 3.613 1.791 -2.747 105 HD12 ILE 12 1HD1 ILE 12 4.349 2.413 -1.270 106 HD13 ILE 12 2HD1 ILE 12 4.263 0.673 -1.549 107 H ARG 13 H ARG 13 9.753 0.714 -4.444 108 HA ARG 13 HA ARG 13 9.926 -2.170 -5.003 109 HE ARG 13 HE ARG 13 14.754 0.310 -5.735 110 HB2 ARG 13 1HB ARG 13 12.226 -1.700 -5.786 111 HB3 ARG 13 2HB ARG 13 11.001 -0.834 -6.701 112 HG2 ARG 13 1HG ARG 13 11.484 1.144 -5.181 113 HG3 ARG 13 2HG ARG 13 12.909 0.246 -4.651 114 HD2 ARG 13 1HD ARG 13 12.551 0.416 -7.564 115 HD3 ARG 13 2HD ARG 13 12.855 1.955 -6.761 116 HH11 ARG 13 1HH1 ARG 13 13.795 1.160 -8.981 117 HH12 ARG 13 2HH1 ARG 13 15.382 0.949 -9.639 118 HH21 ARG 13 1HH2 ARG 13 16.843 0.035 -6.599 119 HH22 ARG 13 2HH2 ARG 13 17.114 0.311 -8.287 120 H PHE 14 H PHE 14 11.573 -3.405 -3.998 121 HA PHE 14 HA PHE 14 12.488 -2.376 -1.399 122 HD1 PHE 14 HD1 PHE 14 9.773 -2.265 -1.391 123 HD2 PHE 14 HD2 PHE 14 11.367 -5.235 1.218 124 HE1 PHE 14 HE1 PHE 14 8.322 -1.456 0.412 125 HE2 PHE 14 HE2 PHE 14 9.914 -4.420 3.025 126 HZ PHE 14 HZ PHE 14 8.386 -2.533 2.621 127 HB2 PHE 14 1HB PHE 14 10.934 -4.827 -2.039 128 HB3 PHE 14 2HB PHE 14 12.254 -5.027 -0.895 129 H GLU 15 H GLU 15 14.546 -3.010 -0.795 130 HA GLU 15 HA GLU 15 16.508 -3.278 -2.635 131 HB2 GLU 15 1HB GLU 15 16.319 -3.921 0.237 132 HB3 GLU 15 2HB GLU 15 17.616 -4.736 -0.618 133 HG2 GLU 15 1HG GLU 15 18.047 -2.450 0.509 134 HG3 GLU 15 2HG GLU 15 18.732 -2.795 -1.075 135 H SER 16 H SER 16 14.478 -5.872 -1.489 136 HA SER 16 HA SER 16 15.988 -7.735 -3.205 137 HG SER 16 HG SER 16 14.493 -10.317 -1.446 138 HB2 SER 16 1HB SER 16 16.213 -8.323 -0.839 139 HB3 SER 16 2HB SER 16 14.458 -8.373 -0.674 140 H ALA 17 H ALA 17 13.556 -5.971 -3.773 141 HA ALA 17 HA ALA 17 12.184 -7.857 -5.380 142 HB1 ALA 17 3HB ALA 17 11.375 -8.161 -2.821 143 HB2 ALA 17 1HB ALA 17 10.369 -8.514 -4.226 144 HB3 ALA 17 2HB ALA 17 10.205 -6.969 -3.390 145 H GLU 18 H GLU 18 10.494 -6.982 -6.662 146 HA GLU 18 HA GLU 18 10.225 -4.044 -6.545 147 HB2 GLU 18 1HB GLU 18 10.277 -3.983 -9.000 148 HB3 GLU 18 2HB GLU 18 11.778 -4.617 -8.338 149 HG2 GLU 18 1HG GLU 18 11.200 -6.840 -8.933 150 HG3 GLU 18 2HG GLU 18 9.552 -6.367 -9.339 151 H CYS 19 H CYS 19 8.191 -3.195 -7.040 152 HA CYS 19 HA CYS 19 6.125 -4.840 -8.177 153 HG CYS 19 HG CYS 19 6.289 -5.018 -3.872 154 HB2 CYS 19 1HB CYS 19 4.880 -4.157 -5.740 155 HB3 CYS 19 2HB CYS 19 5.272 -5.769 -6.325 156 H GLU 20 H GLU 20 4.208 -3.700 -8.695 157 HA GLU 20 HA GLU 20 4.349 -0.789 -8.231 158 HB2 GLU 20 1HB GLU 20 2.993 -1.853 -10.667 159 HB3 GLU 20 2HB GLU 20 3.822 -0.323 -10.430 160 HG2 GLU 20 1HG GLU 20 5.970 -1.675 -10.356 161 HG3 GLU 20 2HG GLU 20 5.010 -3.020 -10.968 162 H VAL 21 H VAL 21 2.248 0.315 -8.242 163 HA VAL 21 HA VAL 21 -0.126 -1.313 -7.982 164 HB VAL 21 HB VAL 21 -0.171 -1.518 -5.771 165 HG11 VAL 21 1HG1 VAL 21 1.676 -0.602 -4.342 166 HG12 VAL 21 2HG1 VAL 21 2.332 0.152 -5.797 167 HG13 VAL 21 3HG1 VAL 21 2.195 -1.605 -5.697 168 HG21 VAL 21 3HG2 VAL 21 0.012 1.493 -5.644 169 HG22 VAL 21 1HG2 VAL 21 -0.450 0.440 -4.308 170 HG23 VAL 21 2HG2 VAL 21 -1.463 0.535 -5.746 171 H GLU 22 H GLU 22 -2.011 -0.198 -8.273 172 HA GLU 22 HA GLU 22 -1.721 2.543 -9.231 173 HB2 GLU 22 1HB GLU 22 -3.700 0.355 -9.633 174 HB3 GLU 22 2HB GLU 22 -4.274 2.010 -9.781 175 HG2 GLU 22 1HG GLU 22 -3.320 2.274 -11.771 176 HG3 GLU 22 2HG GLU 22 -1.797 1.568 -11.226 177 H LEU 23 H LEU 23 -4.007 3.798 -8.809 178 HA LEU 23 HA LEU 23 -4.889 3.452 -6.076 179 HG LEU 23 HG LEU 23 -5.356 6.610 -5.850 180 HB2 LEU 23 1HB LEU 23 -3.029 4.745 -5.516 181 HB3 LEU 23 2HB LEU 23 -3.154 5.729 -6.957 182 HD11 LEU 23 1HD1 LEU 23 -4.668 6.683 -3.265 183 HD12 LEU 23 2HD1 LEU 23 -4.058 5.082 -3.678 184 HD13 LEU 23 3HD1 LEU 23 -5.760 5.471 -3.935 185 HD21 LEU 23 3HD2 LEU 23 -3.516 8.049 -6.282 186 HD22 LEU 23 1HD2 LEU 23 -2.564 7.324 -4.986 187 HD23 LEU 23 2HD2 LEU 23 -3.985 8.294 -4.600 188 H TYR 24 H TYR 24 -6.881 4.295 -5.690 189 HA TYR 24 HA TYR 24 -8.130 5.790 -7.904 190 HD1 TYR 24 HD2 TYR 24 -7.935 4.346 -9.430 191 HD2 TYR 24 HD1 TYR 24 -9.728 1.534 -6.790 192 HE1 TYR 24 HE2 TYR 24 -7.232 2.514 -10.913 193 HE2 TYR 24 HE1 TYR 24 -9.031 -0.306 -8.265 194 HH TYR 24 HH TYR 24 -6.742 -0.026 -10.598 195 HB2 TYR 24 1HB TYR 24 -9.529 3.773 -6.125 196 HB3 TYR 24 2HB TYR 24 -10.217 4.624 -7.503 197 H GLU 25 H GLU 25 -9.495 7.470 -7.407 198 HA GLU 25 HA GLU 25 -8.986 8.894 -5.054 199 HB2 GLU 25 1HB GLU 25 -11.315 9.248 -6.935 200 HB3 GLU 25 2HB GLU 25 -10.745 10.426 -5.760 201 HG2 GLU 25 1HG GLU 25 -9.546 9.594 -8.353 202 HG3 GLU 25 2HG GLU 25 -9.804 11.209 -7.694 203 H GLU 26 H GLU 26 -11.006 6.213 -5.353 204 HA GLU 26 HA GLU 26 -13.273 6.721 -3.942 205 HB2 GLU 26 1HB GLU 26 -13.336 4.428 -3.315 206 HB3 GLU 26 2HB GLU 26 -12.516 4.497 -4.868 207 HG2 GLU 26 1HG GLU 26 -10.347 4.376 -3.656 208 HG3 GLU 26 2HG GLU 26 -11.253 4.134 -2.163 209 H TRP 27 H TRP 27 -10.015 6.648 -2.684 210 HA TRP 27 HA TRP 27 -10.804 6.660 0.077 211 HD1 TRP 27 HD1 TRP 27 -6.004 7.622 -0.040 212 HE1 TRP 27 HE1 TRP 27 -5.569 8.729 2.240 213 HE3 TRP 27 HE3 TRP 27 -10.739 7.419 1.890 214 HZ2 TRP 27 HZ2 TRP 27 -7.030 9.425 4.546 215 HZ3 TRP 27 HZ3 TRP 27 -11.129 8.335 4.138 216 HH2 TRP 27 HH2 TRP 27 -9.314 9.314 5.438 217 HB2 TRP 27 1HB TRP 27 -8.658 5.746 -0.326 218 HB3 TRP 27 2HB TRP 27 -8.197 7.073 -1.384 219 H ALA 28 H ALA 28 -9.404 9.065 -2.169 220 HA ALA 28 HA ALA 28 -11.051 11.153 -1.774 221 HB1 ALA 28 3HB ALA 28 -9.445 12.432 0.011 222 HB2 ALA 28 1HB ALA 28 -9.424 10.784 0.644 223 HB3 ALA 28 2HB ALA 28 -10.958 11.626 0.423 224 HA PRO 29 HA PRO 29 -8.124 12.361 -4.957 225 HB2 PRO 29 1HB PRO 29 -9.277 14.980 -4.966 226 HB3 PRO 29 2HB PRO 29 -9.496 13.691 -6.149 227 HG2 PRO 29 1HG PRO 29 -11.262 14.557 -3.977 228 HG3 PRO 29 2HG PRO 29 -11.635 13.584 -5.406 229 HD2 PRO 29 1HD PRO 29 -11.545 12.593 -2.859 230 HD3 PRO 29 2HD PRO 29 -11.256 11.615 -4.307 231 H GLU 30 H GLU 30 -8.875 14.316 -2.100 232 HA GLU 30 HA GLU 30 -6.651 16.046 -2.310 233 HB2 GLU 30 1HB GLU 30 -8.624 16.634 -0.992 234 HB3 GLU 30 2HB GLU 30 -8.309 15.294 0.107 235 HG2 GLU 30 1HG GLU 30 -5.951 16.724 0.085 236 HG3 GLU 30 2HG GLU 30 -7.203 17.962 0.067 237 H THR 31 H THR 31 -7.164 12.956 -0.687 238 HA THR 31 HA THR 31 -4.698 12.991 0.758 239 HB THR 31 HB THR 31 -5.359 10.298 0.336 240 HG1 THR 31 HG1 THR 31 -7.308 10.616 -0.522 241 HG21 THR 31 3HG2 THR 31 -5.854 12.233 2.544 242 HG22 THR 31 1HG2 THR 31 -4.867 10.772 2.515 243 HG23 THR 31 2HG2 THR 31 -6.622 10.652 2.596 244 H VAL 32 H VAL 32 -5.686 11.603 -2.343 245 HA VAL 32 HA VAL 32 -3.427 10.203 -3.051 246 HB VAL 32 HB VAL 32 -5.120 11.920 -4.875 247 HG11 VAL 32 1HG1 VAL 32 -3.469 11.385 -6.321 248 HG12 VAL 32 2HG1 VAL 32 -4.350 9.860 -6.410 249 HG13 VAL 32 3HG1 VAL 32 -2.934 10.002 -5.368 250 HG21 VAL 32 3HG2 VAL 32 -5.643 9.429 -3.472 251 HG22 VAL 32 1HG2 VAL 32 -5.863 9.285 -5.216 252 HG23 VAL 32 2HG2 VAL 32 -6.754 10.508 -4.313 253 H ARG 33 H ARG 33 -4.022 13.673 -3.224 254 HA ARG 33 HA ARG 33 -1.791 14.458 -4.691 255 HE ARG 33 HE ARG 33 -1.090 18.833 -2.514 256 HB2 ARG 33 1HB ARG 33 -3.791 15.859 -3.877 257 HB3 ARG 33 2HB ARG 33 -2.876 16.066 -2.390 258 HG2 ARG 33 1HG ARG 33 -1.036 17.067 -3.690 259 HG3 ARG 33 2HG ARG 33 -2.015 16.913 -5.151 260 HD2 ARG 33 1HD ARG 33 -2.740 18.970 -4.668 261 HD3 ARG 33 2HD ARG 33 -3.722 18.188 -3.434 262 HH11 ARG 33 1HH1 ARG 33 -4.293 20.112 -3.043 263 HH12 ARG 33 2HH1 ARG 33 -4.131 21.354 -1.848 264 HH21 ARG 33 1HH2 ARG 33 -0.875 20.467 -0.941 265 HH22 ARG 33 2HH2 ARG 33 -2.190 21.556 -0.654 266 H ALA 34 H ALA 34 -2.087 13.657 -1.275 267 HA ALA 34 HA ALA 34 0.458 14.633 -0.479 268 HB1 ALA 34 3HB ALA 34 -0.764 14.321 1.388 269 HB2 ALA 34 1HB ALA 34 -0.015 12.725 1.347 270 HB3 ALA 34 2HB ALA 34 -1.646 12.951 0.715 271 H ILE 35 H ILE 35 -0.682 11.402 -1.410 272 HA ILE 35 HA ILE 35 1.722 10.016 -1.020 273 HB ILE 35 HB ILE 35 0.311 9.143 -3.439 274 HG12 ILE 35 1HG1 ILE 35 -1.613 10.168 -2.311 275 HG13 ILE 35 2HG1 ILE 35 -1.742 8.412 -2.316 276 HG21 ILE 35 1HG2 ILE 35 1.912 7.795 -2.166 277 HG22 ILE 35 2HG2 ILE 35 0.336 7.012 -2.293 278 HG23 ILE 35 3HG2 ILE 35 0.810 7.805 -0.789 279 HD11 ILE 35 3HD1 ILE 35 -0.439 9.006 0.059 280 HD12 ILE 35 1HD1 ILE 35 -2.128 8.542 -0.140 281 HD13 ILE 35 2HD1 ILE 35 -1.682 10.248 -0.097 282 H ALA 36 H ALA 36 0.451 11.665 -3.951 283 HA ALA 36 HA ALA 36 2.694 11.186 -5.592 284 HB1 ALA 36 3HB ALA 36 1.206 13.690 -6.037 285 HB2 ALA 36 1HB ALA 36 0.240 12.213 -6.022 286 HB3 ALA 36 2HB ALA 36 1.586 12.376 -7.152 287 H ASP 37 H ASP 37 2.001 13.572 -3.128 288 HA ASP 37 HA ASP 37 4.095 15.378 -3.846 289 HB2 ASP 37 1HB ASP 37 2.040 15.774 -2.305 290 HB3 ASP 37 2HB ASP 37 3.053 15.082 -1.041 291 H ALA 38 H ALA 38 3.956 12.417 -2.067 292 HA ALA 38 HA ALA 38 6.637 12.754 -0.983 293 HB1 ALA 38 3HB ALA 38 4.421 11.796 0.182 294 HB2 ALA 38 1HB ALA 38 6.050 11.292 0.643 295 HB3 ALA 38 2HB ALA 38 5.091 10.291 -0.451 296 H LEU 39 H LEU 39 6.871 12.577 -3.632 297 HA LEU 39 HA LEU 39 6.984 9.986 -4.743 298 HG LEU 39 HG LEU 39 6.356 13.146 -5.893 299 HB2 LEU 39 1HB LEU 39 8.561 12.442 -5.546 300 HB3 LEU 39 2HB LEU 39 8.337 11.003 -6.513 301 HD11 LEU 39 1HD1 LEU 39 5.970 12.333 -8.442 302 HD12 LEU 39 2HD1 LEU 39 7.684 11.966 -8.234 303 HD13 LEU 39 3HD1 LEU 39 7.095 13.607 -7.965 304 HD21 LEU 39 3HD2 LEU 39 5.710 10.297 -6.654 305 HD22 LEU 39 1HD2 LEU 39 4.596 11.646 -6.850 306 HD23 LEU 39 2HD2 LEU 39 5.141 11.178 -5.241 307 HA PRO 40 HA PRO 40 11.101 8.061 -4.193 308 HB2 PRO 40 1HB PRO 40 12.596 10.530 -5.013 309 HB3 PRO 40 2HB PRO 40 13.030 8.828 -5.240 310 HG2 PRO 40 1HG PRO 40 11.849 10.296 -7.186 311 HG3 PRO 40 2HG PRO 40 11.599 8.553 -7.008 312 HD2 PRO 40 1HD PRO 40 9.713 10.718 -6.613 313 HD3 PRO 40 2HD PRO 40 9.407 8.975 -6.642 314 H ILE 41 H ILE 41 10.985 7.876 -2.058 315 HA ILE 41 HA ILE 41 12.505 9.746 -0.432 316 HB ILE 41 HB ILE 41 9.579 9.146 0.033 317 HG12 ILE 41 1HG1 ILE 41 11.213 11.700 0.017 318 HG13 ILE 41 2HG1 ILE 41 10.084 11.179 -1.225 319 HG21 ILE 41 1HG2 ILE 41 10.690 8.624 2.120 320 HG22 ILE 41 2HG2 ILE 41 9.833 10.154 2.280 321 HG23 ILE 41 3HG2 ILE 41 11.583 10.140 2.065 322 HD11 ILE 41 3HD1 ILE 41 8.365 12.072 -0.140 323 HD12 ILE 41 1HD1 ILE 41 9.550 12.839 0.918 324 HD13 ILE 41 2HD1 ILE 41 8.827 11.297 1.376 325 H LYS 42 H LYS 42 13.282 8.782 1.513 326 HA LYS 42 HA LYS 42 13.477 5.904 1.307 327 HB2 LYS 42 1HB LYS 42 15.010 8.047 2.567 328 HB3 LYS 42 2HB LYS 42 14.881 6.612 3.571 329 HG2 LYS 42 1HG LYS 42 16.310 5.471 2.303 330 HG3 LYS 42 2HG LYS 42 15.520 5.979 0.810 331 HD2 LYS 42 1HD LYS 42 17.406 7.138 0.446 332 HD3 LYS 42 2HD LYS 42 16.740 8.288 1.608 333 HE2 LYS 42 1HE LYS 42 17.963 7.250 3.406 334 HE3 LYS 42 2HE LYS 42 18.530 5.973 2.332 335 HZ1 LYS 42 3HZ LYS 42 19.385 8.134 1.036 336 HZ2 LYS 42 1HZ LYS 42 20.317 7.304 2.178 337 HZ3 LYS 42 2HZ LYS 42 19.475 8.699 2.628 338 H SER 43 H SER 43 12.660 4.418 2.652 339 HA SER 43 HA SER 43 11.374 5.208 5.139 340 HG SER 43 HG SER 43 9.275 3.279 2.327 341 HB2 SER 43 1HB SER 43 9.237 4.520 4.620 342 HB3 SER 43 2HB SER 43 9.736 5.177 3.067 343 H THR 44 H THR 44 11.125 3.478 6.627 344 HA THR 44 HA THR 44 12.792 1.141 5.950 345 HB THR 44 HB THR 44 11.942 1.460 8.751 346 HG1 THR 44 HG1 THR 44 13.386 3.216 9.086 347 HG21 THR 44 3HG2 THR 44 14.183 0.425 7.303 348 HG22 THR 44 1HG2 THR 44 13.744 0.205 8.997 349 HG23 THR 44 2HG2 THR 44 14.729 1.586 8.514 350 H ALA 45 H ALA 45 11.950 -0.827 5.793 351 HA ALA 45 HA ALA 45 9.080 -1.120 6.111 352 HB1 ALA 45 3HB ALA 45 9.335 -2.266 4.233 353 HB2 ALA 45 1HB ALA 45 10.140 -3.527 5.164 354 HB3 ALA 45 2HB ALA 45 11.090 -2.253 4.404 355 H ASN 46 H ASN 46 8.060 -2.293 7.553 356 HA ASN 46 HA ASN 46 9.641 -3.798 9.529 357 HB2 ASN 46 1HB ASN 46 7.120 -2.235 9.654 358 HB3 ASN 46 2HB ASN 46 7.169 -3.702 10.628 359 HD21 ASN 46 1HD2 ASN 46 7.139 -0.832 11.356 360 HD22 ASN 46 2HD2 ASN 46 8.506 -0.613 12.390 361 H ARG 47 H ARG 47 9.465 -6.030 9.544 362 HA ARG 47 HA ARG 47 7.681 -7.200 7.587 363 HE ARG 47 HE ARG 47 7.553 -9.811 7.450 364 HB2 ARG 47 1HB ARG 47 10.153 -7.964 8.934 365 HB3 ARG 47 2HB ARG 47 9.022 -9.299 8.758 366 HG2 ARG 47 1HG ARG 47 9.234 -7.727 6.335 367 HG3 ARG 47 2HG ARG 47 10.791 -8.362 6.845 368 HD2 ARG 47 1HD ARG 47 9.160 -9.741 5.297 369 HD3 ARG 47 2HD ARG 47 10.182 -10.524 6.499 370 HH11 ARG 47 1HH1 ARG 47 9.483 -12.258 5.877 371 HH12 ARG 47 2HH1 ARG 47 8.430 -13.556 6.327 372 HH21 ARG 47 1HH2 ARG 47 6.166 -11.519 8.042 373 HH22 ARG 47 2HH2 ARG 47 6.547 -13.137 7.554 374 H TRP 48 H TRP 48 5.988 -8.515 7.927 375 HA TRP 48 HA TRP 48 5.357 -9.583 10.534 376 HD1 TRP 48 HD1 TRP 48 1.668 -9.680 9.376 377 HE1 TRP 48 HE1 TRP 48 0.079 -10.225 11.326 378 HE3 TRP 48 HE3 TRP 48 4.094 -7.185 13.123 379 HZ2 TRP 48 HZ2 TRP 48 -0.121 -9.669 14.087 380 HZ3 TRP 48 HZ3 TRP 48 3.138 -7.241 15.388 381 HH2 TRP 48 HH2 TRP 48 1.073 -8.457 15.860 382 HB2 TRP 48 1HB TRP 48 4.437 -7.315 10.728 383 HB3 TRP 48 2HB TRP 48 3.536 -7.540 9.232 384 H GLY 49 H GLY 49 3.772 -11.249 10.425 385 HA2 GLY 49 1HA GLY 49 3.769 -12.978 8.384 386 HA3 GLY 49 2HA GLY 49 2.362 -12.782 9.413 387 H ASP 50 H ASP 50 3.733 -12.236 6.304 388 HA ASP 50 HA ASP 50 2.893 -11.485 4.325 389 HB2 ASP 50 1HB ASP 50 1.158 -13.328 5.273 390 HB3 ASP 50 2HB ASP 50 0.083 -11.946 5.128 391 H GLU 51 H GLU 51 3.005 -9.605 6.647 392 HA GLU 51 HA GLU 51 1.292 -7.539 5.473 393 HB2 GLU 51 1HB GLU 51 0.721 -8.709 7.912 394 HB3 GLU 51 2HB GLU 51 1.604 -7.260 8.368 395 HG2 GLU 51 1HG GLU 51 -0.288 -6.575 6.355 396 HG3 GLU 51 2HG GLU 51 -1.103 -7.507 7.610 397 H ILE 52 H ILE 52 2.246 -5.580 5.273 398 HA ILE 52 HA ILE 52 4.780 -5.108 6.667 399 HB ILE 52 HB ILE 52 4.630 -5.803 3.933 400 HG12 ILE 52 1HG1 ILE 52 7.119 -5.157 4.044 401 HG13 ILE 52 2HG1 ILE 52 6.800 -4.705 5.713 402 HG21 ILE 52 1HG2 ILE 52 5.399 -2.908 4.255 403 HG22 ILE 52 2HG2 ILE 52 3.975 -3.515 3.411 404 HG23 ILE 52 3HG2 ILE 52 5.586 -3.875 2.792 405 HD11 ILE 52 3HD1 ILE 52 7.745 -6.936 5.549 406 HD12 ILE 52 1HD1 ILE 52 6.405 -7.449 4.528 407 HD13 ILE 52 2HD1 ILE 52 6.114 -6.992 6.207 408 H TYR 53 H TYR 53 4.911 -3.098 7.473 409 HA TYR 53 HA TYR 53 3.305 -0.971 6.250 410 HD1 TYR 53 HD2 TYR 53 4.255 0.158 10.173 411 HD2 TYR 53 HD1 TYR 53 2.681 -3.723 9.408 412 HE1 TYR 53 HE2 TYR 53 5.188 -0.635 12.303 413 HE2 TYR 53 HE1 TYR 53 3.610 -4.524 11.538 414 HH TYR 53 HH TYR 53 4.465 -2.713 13.970 415 HB2 TYR 53 1HB TYR 53 2.524 -0.207 8.459 416 HB3 TYR 53 2HB TYR 53 1.955 -1.834 8.100 417 H PHE 54 H PHE 54 4.523 0.737 5.861 418 HA PHE 54 HA PHE 54 6.755 1.332 7.677 419 HD1 PHE 54 HD2 PHE 54 6.742 3.745 4.641 420 HD2 PHE 54 HD1 PHE 54 6.892 -0.347 3.486 421 HE1 PHE 54 HE2 PHE 54 5.982 4.357 2.386 422 HE2 PHE 54 HE1 PHE 54 6.130 0.259 1.231 423 HZ PHE 54 HZ PHE 54 5.674 2.613 0.677 424 HB2 PHE 54 1HB PHE 54 8.220 1.832 5.835 425 HB3 PHE 54 2HB PHE 54 7.574 0.218 5.597 426 H THR 55 H THR 55 7.246 3.515 7.968 427 HA THR 55 HA THR 55 5.075 5.341 7.220 428 HB THR 55 HB THR 55 7.350 6.267 8.900 429 HG1 THR 55 HG1 THR 55 6.574 5.159 10.696 430 HG21 THR 55 3HG2 THR 55 5.307 6.962 10.329 431 HG22 THR 55 1HG2 THR 55 4.393 6.640 8.856 432 HG23 THR 55 2HG2 THR 55 5.681 7.845 8.849 433 H THR 56 H THR 56 5.457 7.340 6.164 434 HA THR 56 HA THR 56 8.058 7.500 4.785 435 HB THR 56 HB THR 56 6.154 8.768 3.158 436 HG1 THR 56 HG1 THR 56 5.266 6.205 3.981 437 HG21 THR 56 3HG2 THR 56 7.450 7.715 1.711 438 HG22 THR 56 1HG2 THR 56 6.569 6.232 2.084 439 HG23 THR 56 2HG2 THR 56 8.050 6.623 2.962 440 H GLN 57 H GLN 57 6.384 8.955 7.091 441 HA GLN 57 HA GLN 57 6.743 10.975 8.118 442 HB2 GLN 57 1HB GLN 57 7.946 12.193 5.649 443 HB3 GLN 57 2HB GLN 57 8.258 12.567 7.338 444 HG2 GLN 57 1HG GLN 57 9.073 9.947 7.126 445 HG3 GLN 57 2HG GLN 57 9.546 10.648 5.579 446 HE21 GLN 57 1HE2 GLN 57 10.960 9.791 8.163 447 HE22 GLN 57 2HE2 GLN 57 12.022 11.112 8.493 448 H VAL 58 H VAL 58 4.947 10.415 5.338 449 HA VAL 58 HA VAL 58 3.794 13.077 5.216 450 HB VAL 58 HB VAL 58 4.040 11.807 3.127 451 HG11 VAL 58 1HG1 VAL 58 3.639 9.557 4.124 452 HG12 VAL 58 2HG1 VAL 58 2.752 9.857 2.629 453 HG13 VAL 58 3HG1 VAL 58 1.920 9.946 4.181 454 HG21 VAL 58 3HG2 VAL 58 2.384 13.459 3.029 455 HG22 VAL 58 1HG2 VAL 58 1.269 12.526 4.028 456 HG23 VAL 58 2HG2 VAL 58 1.611 12.015 2.376 457 H ALA 59 H ALA 59 2.344 13.696 6.670 458 HA ALA 59 HA ALA 59 0.708 11.645 7.988 459 HB1 ALA 59 3HB ALA 59 0.397 13.103 9.804 460 HB2 ALA 59 1HB ALA 59 0.958 14.502 8.887 461 HB3 ALA 59 2HB ALA 59 2.100 13.243 9.367 462 H VAL 60 H VAL 60 -0.968 11.295 6.631 463 HA VAL 60 HA VAL 60 -2.836 13.546 6.289 464 HB VAL 60 HB VAL 60 -1.781 13.236 4.127 465 HG11 VAL 60 1HG1 VAL 60 -1.430 10.637 4.814 466 HG12 VAL 60 2HG1 VAL 60 -1.249 11.269 3.181 467 HG13 VAL 60 3HG1 VAL 60 -2.760 10.504 3.663 468 HG21 VAL 60 3HG2 VAL 60 -4.586 12.151 4.285 469 HG22 VAL 60 1HG2 VAL 60 -3.784 12.539 2.764 470 HG23 VAL 60 2HG2 VAL 60 -4.078 13.806 3.954 471 H GLU 61 H GLU 61 -4.465 12.991 7.647 472 HA GLU 61 HA GLU 61 -5.585 10.283 7.349 473 HB2 GLU 61 1HB GLU 61 -4.493 11.545 9.733 474 HB3 GLU 61 2HB GLU 61 -6.154 11.018 9.971 475 HG2 GLU 61 1HG GLU 61 -5.520 8.767 9.201 476 HG3 GLU 61 2HG GLU 61 -3.849 9.313 9.057 477 H LYS 62 H LYS 62 -7.732 10.165 7.101 478 HA LYS 62 HA LYS 62 -9.421 12.404 7.899 479 HB2 LYS 62 1HB LYS 62 -8.810 12.945 5.603 480 HB3 LYS 62 2HB LYS 62 -9.279 11.338 5.069 481 HG2 LYS 62 1HG LYS 62 -11.590 11.796 5.548 482 HG3 LYS 62 2HG LYS 62 -11.171 13.356 6.256 483 HD2 LYS 62 1HD LYS 62 -10.072 13.753 3.895 484 HD3 LYS 62 2HD LYS 62 -11.230 12.516 3.399 485 HE2 LYS 62 1HE LYS 62 -11.835 15.148 4.737 486 HE3 LYS 62 2HE LYS 62 -12.223 14.681 3.082 487 HZ1 LYS 62 3HZ LYS 62 -14.179 14.464 4.383 488 HZ2 LYS 62 1HZ LYS 62 -13.379 13.571 5.577 489 HZ3 LYS 62 2HZ LYS 62 -13.639 12.897 4.048 490 H GLU 63 H GLU 63 -11.796 11.819 7.632 491 HA GLU 63 HA GLU 63 -12.136 9.000 8.356 492 HB2 GLU 63 1HB GLU 63 -14.306 11.047 8.590 493 HB3 GLU 63 2HB GLU 63 -14.037 9.604 9.554 494 HG2 GLU 63 1HG GLU 63 -13.400 11.173 11.058 495 HG3 GLU 63 2HG GLU 63 -11.852 10.910 10.255 496 H GLU 64 H GLU 64 -12.152 8.061 6.313 497 HA GLU 64 HA GLU 64 -14.666 7.985 5.010 498 HB2 GLU 64 1HB GLU 64 -14.277 9.913 3.825 499 HB3 GLU 64 2HB GLU 64 -12.533 9.726 3.881 500 HG2 GLU 64 1HG GLU 64 -12.498 8.315 2.041 501 HG3 GLU 64 2HG GLU 64 -14.203 7.904 2.198 502 H ASN 65 H ASN 65 -14.705 6.419 3.229 503 HA ASN 65 HA ASN 65 -14.162 4.434 2.270 504 HB2 ASN 65 1HB ASN 65 -12.260 5.693 1.335 505 HB3 ASN 65 2HB ASN 65 -11.312 5.339 2.778 506 HD21 ASN 65 1HD2 ASN 65 -11.134 4.643 -0.182 507 HD22 ASN 65 2HD2 ASN 65 -10.836 2.941 -0.185 508 H SER 66 H SER 66 -11.363 4.528 4.402 509 HA SER 66 HA SER 66 -10.580 2.749 5.713 510 HG SER 66 HG SER 66 -11.129 4.959 8.291 511 HB2 SER 66 1HB SER 66 -12.903 4.084 7.080 512 HB3 SER 66 2HB SER 66 -11.930 2.865 7.901 513 H LYS 67 H LYS 67 -11.053 0.834 4.417 514 HA LYS 67 HA LYS 67 -13.514 -0.571 5.228 515 HB2 LYS 67 1HB LYS 67 -13.012 -2.129 3.316 516 HB3 LYS 67 2HB LYS 67 -13.416 -0.489 2.849 517 HG2 LYS 67 1HG LYS 67 -11.654 -1.020 1.465 518 HG3 LYS 67 2HG LYS 67 -10.865 -0.120 2.757 519 HD2 LYS 67 1HD LYS 67 -10.313 -2.309 3.834 520 HD3 LYS 67 2HD LYS 67 -10.971 -3.116 2.410 521 HE2 LYS 67 1HE LYS 67 -9.292 -2.216 1.015 522 HE3 LYS 67 2HE LYS 67 -8.779 -1.069 2.248 523 HZ1 LYS 67 3HZ LYS 67 -8.615 -3.810 3.100 524 HZ2 LYS 67 1HZ LYS 67 -7.462 -2.578 3.197 525 HZ3 LYS 67 2HZ LYS 67 -7.626 -3.470 1.773 526 H ASP 68 H ASP 68 -13.351 -2.943 5.574 527 HA ASP 68 HA ASP 68 -10.775 -3.626 6.855 528 HB2 ASP 68 1HB ASP 68 -12.171 -5.029 8.429 529 HB3 ASP 68 2HB ASP 68 -12.350 -3.287 8.602 530 H VAL 69 H VAL 69 -13.016 -4.539 4.458 531 HA VAL 69 HA VAL 69 -11.834 -7.240 4.390 532 HB VAL 69 HB VAL 69 -14.338 -7.107 4.901 533 HG11 VAL 69 1HG1 VAL 69 -14.400 -5.495 2.662 534 HG12 VAL 69 2HG1 VAL 69 -15.792 -6.235 3.451 535 HG13 VAL 69 3HG1 VAL 69 -15.029 -7.035 2.078 536 HG21 VAL 69 3HG2 VAL 69 -14.702 -8.926 2.964 537 HG22 VAL 69 1HG2 VAL 69 -13.773 -9.242 4.429 538 HG23 VAL 69 2HG2 VAL 69 -12.943 -8.808 2.934 539 H VAL 70 H VAL 70 -11.128 -8.050 2.439 540 HA VAL 70 HA VAL 70 -11.578 -6.599 -0.023 541 HB VAL 70 HB VAL 70 -9.218 -6.156 -0.511 542 HG11 VAL 70 1HG1 VAL 70 -10.764 -4.463 0.555 543 HG12 VAL 70 2HG1 VAL 70 -9.036 -4.148 0.699 544 HG13 VAL 70 3HG1 VAL 70 -9.931 -4.801 2.071 545 HG21 VAL 70 3HG2 VAL 70 -7.472 -6.352 1.074 546 HG22 VAL 70 1HG2 VAL 70 -8.324 -7.894 1.124 547 HG23 VAL 70 2HG2 VAL 70 -8.591 -6.692 2.387 548 H GLU 71 H GLU 71 -10.666 -7.638 -1.905 549 HA GLU 71 HA GLU 71 -10.532 -10.520 -1.558 550 HB2 GLU 71 1HB GLU 71 -10.284 -9.164 -4.233 551 HB3 GLU 71 2HB GLU 71 -10.950 -10.743 -3.843 552 HG2 GLU 71 1HG GLU 71 -12.943 -9.875 -3.077 553 HG3 GLU 71 2HG GLU 71 -12.271 -8.262 -2.847 554 H LEU 72 H LEU 72 -8.902 -11.830 -2.330 555 HA LEU 72 HA LEU 72 -6.307 -11.151 -1.683 556 HG LEU 72 HG LEU 72 -4.609 -12.702 -3.302 557 HB2 LEU 72 1HB LEU 72 -7.108 -13.457 -1.902 558 HB3 LEU 72 2HB LEU 72 -7.258 -13.261 -3.636 559 HD11 LEU 72 1HD1 LEU 72 -5.203 -14.938 -1.371 560 HD12 LEU 72 2HD1 LEU 72 -4.858 -13.285 -0.864 561 HD13 LEU 72 3HD1 LEU 72 -3.641 -14.210 -1.741 562 HD21 LEU 72 3HD2 LEU 72 -4.223 -14.748 -4.357 563 HD22 LEU 72 1HD2 LEU 72 -5.867 -14.324 -4.832 564 HD23 LEU 72 2HD2 LEU 72 -5.597 -15.522 -3.568 565 H GLY 73 H GLY 73 -4.752 -9.956 -2.635 566 HA2 GLY 73 1HA GLY 73 -3.400 -9.611 -4.660 567 HA3 GLY 73 2HA GLY 73 -4.900 -9.602 -5.568 568 H ASP 74 H ASP 74 -6.268 -7.846 -3.625 569 HA ASP 74 HA ASP 74 -5.519 -5.381 -4.799 570 HB2 ASP 74 1HB ASP 74 -7.391 -4.469 -3.739 571 HB3 ASP 74 2HB ASP 74 -7.826 -6.160 -3.936 572 H VAL 75 H VAL 75 -5.103 -3.375 -3.507 573 HA VAL 75 HA VAL 75 -3.167 -3.915 -1.327 574 HB VAL 75 HB VAL 75 -3.043 -1.601 -3.293 575 HG11 VAL 75 1HG1 VAL 75 -0.927 -1.089 -2.397 576 HG12 VAL 75 2HG1 VAL 75 -0.858 -2.591 -1.477 577 HG13 VAL 75 3HG1 VAL 75 -1.991 -1.321 -1.011 578 HG21 VAL 75 3HG2 VAL 75 -1.896 -2.839 -4.750 579 HG22 VAL 75 1HG2 VAL 75 -2.493 -4.245 -3.868 580 HG23 VAL 75 2HG2 VAL 75 -0.912 -3.568 -3.482 581 H ALA 76 H ALA 76 -3.084 -2.259 0.429 582 HA ALA 76 HA ALA 76 -5.162 -0.231 0.347 583 HB1 ALA 76 3HB ALA 76 -6.064 -0.982 2.571 584 HB2 ALA 76 1HB ALA 76 -5.180 -2.485 2.327 585 HB3 ALA 76 2HB ALA 76 -6.451 -2.018 1.199 586 H TYR 77 H TYR 77 -4.922 1.452 1.850 587 HA TYR 77 HA TYR 77 -2.280 1.522 3.138 588 HD1 TYR 77 HD2 TYR 77 -1.890 4.130 4.722 589 HD2 TYR 77 HD1 TYR 77 -5.132 5.182 2.179 590 HE1 TYR 77 HE2 TYR 77 -2.457 5.990 6.220 591 HE2 TYR 77 HE1 TYR 77 -5.703 7.050 3.672 592 HH TYR 77 HH TYR 77 -5.383 7.753 5.949 593 HB2 TYR 77 1HB TYR 77 -2.092 3.511 2.121 594 HB3 TYR 77 2HB TYR 77 -3.756 3.432 1.559 595 H TRP 78 H TRP 78 -2.082 1.804 5.301 596 HA TRP 78 HA TRP 78 -4.411 1.387 6.922 597 HD1 TRP 78 HD1 TRP 78 -4.788 1.953 9.381 598 HE1 TRP 78 HE1 TRP 78 -5.162 0.362 11.366 599 HE3 TRP 78 HE3 TRP 78 -0.749 -1.108 8.727 600 HZ2 TRP 78 HZ2 TRP 78 -3.905 -1.898 12.505 601 HZ3 TRP 78 HZ3 TRP 78 -0.407 -2.961 10.307 602 HH2 TRP 78 HH2 TRP 78 -1.952 -3.347 12.158 603 HB2 TRP 78 1HB TRP 78 -1.904 0.610 7.256 604 HB3 TRP 78 2HB TRP 78 -1.780 2.138 8.121 605 H ILE 79 H ILE 79 -5.792 3.028 7.298 606 HA ILE 79 HA ILE 79 -5.207 5.744 7.117 607 HB ILE 79 HB ILE 79 -7.443 4.236 8.433 608 HG12 ILE 79 1HG1 ILE 79 -6.905 5.326 5.849 609 HG13 ILE 79 2HG1 ILE 79 -8.297 4.395 6.385 610 HG21 ILE 79 1HG2 ILE 79 -8.584 6.397 8.854 611 HG22 ILE 79 2HG2 ILE 79 -7.067 7.224 8.499 612 HG23 ILE 79 3HG2 ILE 79 -7.174 6.134 9.881 613 HD11 ILE 79 3HD1 ILE 79 -9.316 6.529 7.183 614 HD12 ILE 79 1HD1 ILE 79 -9.085 6.429 5.438 615 HD13 ILE 79 2HD1 ILE 79 -7.975 7.385 6.422 616 HA PRO 80 HA PRO 80 -4.942 6.148 11.944 617 HB2 PRO 80 1HB PRO 80 -4.717 3.752 13.303 618 HB3 PRO 80 2HB PRO 80 -6.213 4.675 13.131 619 HG2 PRO 80 1HG PRO 80 -5.248 2.320 11.562 620 HG3 PRO 80 2HG PRO 80 -6.880 2.678 12.157 621 HD2 PRO 80 1HD PRO 80 -6.227 3.077 9.595 622 HD3 PRO 80 2HD PRO 80 -7.300 4.201 10.453 623 H GLY 81 H GLY 81 -2.890 6.783 11.059 624 HA2 GLY 81 1HA GLY 81 -0.630 6.446 12.166 625 HA3 GLY 81 2HA GLY 81 -0.724 4.822 11.502 626 H LYS 82 H LYS 82 -2.180 6.590 9.197 627 HA LYS 82 HA LYS 82 -1.528 7.213 7.078 628 HB2 LYS 82 1HB LYS 82 0.974 8.504 7.823 629 HB3 LYS 82 2HB LYS 82 -0.468 9.184 7.091 630 HG2 LYS 82 1HG LYS 82 -0.713 10.315 8.989 631 HG3 LYS 82 2HG LYS 82 -1.232 8.795 9.712 632 HD2 LYS 82 1HD LYS 82 1.472 8.552 9.845 633 HD3 LYS 82 2HD LYS 82 1.269 10.292 10.051 634 HE2 LYS 82 1HE LYS 82 -0.647 9.410 11.713 635 HE3 LYS 82 2HE LYS 82 0.481 8.060 11.820 636 HZ1 LYS 82 3HZ LYS 82 0.874 10.871 12.599 637 HZ2 LYS 82 1HZ LYS 82 2.213 9.923 12.183 638 HZ3 LYS 82 2HZ LYS 82 1.218 9.463 13.471 639 H ALA 83 H ALA 83 -0.573 4.657 8.043 640 HA ALA 83 HA ALA 83 1.999 4.437 6.629 641 HB1 ALA 83 3HB ALA 83 1.616 2.039 7.937 642 HB2 ALA 83 1HB ALA 83 0.943 3.228 9.051 643 HB3 ALA 83 2HB ALA 83 2.610 3.385 8.498 644 H ILE 84 H ILE 84 2.156 3.282 4.811 645 HA ILE 84 HA ILE 84 -0.248 2.065 3.708 646 HB ILE 84 HB ILE 84 2.453 2.187 2.378 647 HG12 ILE 84 1HG1 ILE 84 0.281 4.297 2.389 648 HG13 ILE 84 2HG1 ILE 84 1.889 4.456 3.091 649 HG21 ILE 84 1HG2 ILE 84 0.805 0.731 1.342 650 HG22 ILE 84 2HG2 ILE 84 1.119 2.137 0.324 651 HG23 ILE 84 3HG2 ILE 84 -0.356 2.058 1.289 652 HD11 ILE 84 3HD1 ILE 84 1.146 5.285 0.601 653 HD12 ILE 84 1HD1 ILE 84 1.922 3.738 0.267 654 HD13 ILE 84 2HD1 ILE 84 2.804 4.998 1.134 655 H CYS 85 H CYS 85 -0.337 -0.141 2.981 656 HA CYS 85 HA CYS 85 1.824 -1.868 3.910 657 HG CYS 85 HG CYS 85 0.036 -4.261 6.140 658 HB2 CYS 85 1HB CYS 85 0.407 -1.837 5.817 659 HB3 CYS 85 2HB CYS 85 -1.038 -2.032 4.832 660 H LEU 86 H LEU 86 1.781 -4.017 3.140 661 HA LEU 86 HA LEU 86 0.173 -4.426 0.697 662 HG LEU 86 HG LEU 86 1.313 -4.065 -1.150 663 HB2 LEU 86 1HB LEU 86 2.991 -4.299 0.937 664 HB3 LEU 86 2HB LEU 86 2.599 -5.997 0.703 665 HD11 LEU 86 1HD1 LEU 86 3.155 -3.481 -2.343 666 HD12 LEU 86 2HD1 LEU 86 4.060 -4.918 -1.867 667 HD13 LEU 86 3HD1 LEU 86 3.897 -3.564 -0.746 668 HD21 LEU 86 3HD2 LEU 86 2.333 -6.871 -1.185 669 HD22 LEU 86 1HD2 LEU 86 2.159 -5.989 -2.703 670 HD23 LEU 86 2HD2 LEU 86 0.757 -6.236 -1.663 671 H PHE 87 H PHE 87 -0.850 -6.475 0.544 672 HA PHE 87 HA PHE 87 -0.111 -8.462 2.567 673 HD1 PHE 87 HD2 PHE 87 -3.718 -8.835 0.657 674 HD2 PHE 87 HD1 PHE 87 -2.990 -5.369 3.018 675 HE1 PHE 87 HE2 PHE 87 -5.450 -7.623 -0.594 676 HE2 PHE 87 HE1 PHE 87 -4.720 -4.154 1.768 677 HZ PHE 87 HZ PHE 87 -5.952 -5.276 -0.037 678 HB2 PHE 87 1HB PHE 87 -2.571 -8.881 2.955 679 HB3 PHE 87 2HB PHE 87 -1.962 -7.357 3.579 680 H PHE 88 H PHE 88 -0.265 -10.559 1.951 681 HA PHE 88 HA PHE 88 -1.644 -11.282 -0.510 682 HD1 PHE 88 HD1 PHE 88 -0.252 -13.405 -2.599 683 HD2 PHE 88 HD2 PHE 88 0.485 -9.231 -2.215 684 HE1 PHE 88 HE1 PHE 88 -0.776 -13.097 -4.984 685 HE2 PHE 88 HE2 PHE 88 -0.036 -8.916 -4.599 686 HZ PHE 88 HZ PHE 88 -0.668 -10.850 -5.986 687 HB2 PHE 88 1HB PHE 88 1.152 -10.749 -0.495 688 HB3 PHE 88 2HB PHE 88 0.949 -12.490 -0.675 689 H GLY 89 H GLY 89 -2.514 -12.034 1.859 690 HA2 GLY 89 1HA GLY 89 -2.976 -14.618 1.994 691 HA3 GLY 89 2HA GLY 89 -1.334 -14.586 2.625 692 H LYS 90 H LYS 90 -1.593 -14.973 4.810 693 HA LYS 90 HA LYS 90 -3.796 -14.205 6.332 694 HB2 LYS 90 1HB LYS 90 -2.602 -14.838 8.243 695 HB3 LYS 90 2HB LYS 90 -1.947 -15.855 6.980 696 HG2 LYS 90 1HG LYS 90 0.038 -15.210 7.755 697 HG3 LYS 90 2HG LYS 90 -0.272 -13.686 6.926 698 HD2 LYS 90 1HD LYS 90 -0.150 -12.664 8.901 699 HD3 LYS 90 2HD LYS 90 -1.611 -13.521 9.388 700 HE2 LYS 90 1HE LYS 90 0.418 -13.747 10.903 701 HE3 LYS 90 2HE LYS 90 -0.396 -15.236 10.426 702 HZ1 LYS 90 3HZ LYS 90 1.418 -15.957 9.384 703 HZ2 LYS 90 1HZ LYS 90 2.263 -14.731 10.187 704 HZ3 LYS 90 2HZ LYS 90 1.695 -14.478 8.614 705 H THR 91 H THR 91 -3.101 -12.874 8.495 706 HA THR 91 HA THR 91 -1.695 -10.447 8.066 707 HB THR 91 HB THR 91 -4.362 -9.526 8.563 708 HG1 THR 91 HG1 THR 91 -4.200 -10.780 6.049 709 HG21 THR 91 3HG2 THR 91 -3.767 -8.677 6.037 710 HG22 THR 91 1HG2 THR 91 -2.172 -8.943 6.735 711 HG23 THR 91 2HG2 THR 91 -3.310 -7.857 7.529 712 HA PRO 92 HA PRO 92 -1.894 -9.824 12.468 713 HB2 PRO 92 1HB PRO 92 -4.284 -8.028 12.287 714 HB3 PRO 92 2HB PRO 92 -2.797 -7.826 13.223 715 HG2 PRO 92 1HG PRO 92 -3.132 -6.482 10.964 716 HG3 PRO 92 2HG PRO 92 -1.554 -7.192 11.358 717 HD2 PRO 92 1HD PRO 92 -3.603 -8.094 9.397 718 HD3 PRO 92 2HD PRO 92 -1.834 -8.211 9.312 719 H ILE 93 H ILE 93 -4.877 -10.596 10.820 720 HA ILE 93 HA ILE 93 -5.582 -12.379 13.024 721 HB ILE 93 HB ILE 93 -7.727 -10.703 11.751 722 HG12 ILE 93 1HG1 ILE 93 -6.416 -10.107 14.410 723 HG13 ILE 93 2HG1 ILE 93 -5.999 -9.266 12.921 724 HG21 ILE 93 1HG2 ILE 93 -8.293 -12.835 12.909 725 HG22 ILE 93 2HG2 ILE 93 -9.058 -11.408 13.606 726 HG23 ILE 93 3HG2 ILE 93 -7.660 -12.136 14.398 727 HD11 ILE 93 3HD1 ILE 93 -8.850 -9.268 13.369 728 HD12 ILE 93 1HD1 ILE 93 -7.745 -7.917 13.103 729 HD13 ILE 93 2HD1 ILE 93 -7.970 -8.568 14.727 730 H SER 94 H SER 94 -4.514 -13.580 10.979 731 HA SER 94 HA SER 94 -5.882 -14.081 8.638 732 HG SER 94 HG SER 94 -2.696 -15.762 10.016 733 HB2 SER 94 1HB SER 94 -4.846 -16.568 9.656 734 HB3 SER 94 2HB SER 94 -4.232 -15.549 8.357 735 H ASP 95 H ASP 95 -5.947 -16.460 11.280 736 HA ASP 95 HA ASP 95 -7.557 -17.841 12.074 737 HB2 ASP 95 1HB ASP 95 -9.165 -15.419 11.326 738 HB3 ASP 95 2HB ASP 95 -9.973 -16.870 11.914 739 H ASP 96 H ASP 96 -10.070 -16.836 9.929 740 HA ASP 96 HA ASP 96 -9.592 -19.232 8.284 741 HB2 ASP 96 1HB ASP 96 -12.036 -18.192 9.601 742 HB3 ASP 96 2HB ASP 96 -12.246 -18.838 7.977 743 H LYS 97 H LYS 97 -9.708 -15.892 8.259 744 HA LYS 97 HA LYS 97 -9.876 -15.866 5.342 745 HB2 LYS 97 1HB LYS 97 -11.251 -13.726 6.951 746 HB3 LYS 97 2HB LYS 97 -11.425 -14.090 5.241 747 HG2 LYS 97 1HG LYS 97 -13.391 -14.905 6.119 748 HG3 LYS 97 2HG LYS 97 -12.380 -16.350 6.070 749 HD2 LYS 97 1HD LYS 97 -12.281 -16.510 8.320 750 HD3 LYS 97 2HD LYS 97 -12.195 -14.763 8.543 751 HE2 LYS 97 1HE LYS 97 -14.380 -14.628 8.949 752 HE3 LYS 97 2HE LYS 97 -14.772 -15.564 7.508 753 HZ1 LYS 97 3HZ LYS 97 -13.701 -17.073 9.746 754 HZ2 LYS 97 1HZ LYS 97 -14.962 -17.456 8.686 755 HZ3 LYS 97 2HZ LYS 97 -15.238 -16.409 9.984 756 H ILE 98 H ILE 98 -9.713 -12.988 5.189 757 HA ILE 98 HA ILE 98 -7.071 -12.546 6.414 758 HB ILE 98 HB ILE 98 -7.997 -11.729 3.660 759 HG12 ILE 98 1HG1 ILE 98 -5.669 -13.471 4.493 760 HG13 ILE 98 2HG1 ILE 98 -7.241 -14.097 3.999 761 HG21 ILE 98 1HG2 ILE 98 -5.231 -11.211 4.053 762 HG22 ILE 98 2HG2 ILE 98 -6.127 -10.430 5.355 763 HG23 ILE 98 3HG2 ILE 98 -6.523 -10.073 3.676 764 HD11 ILE 98 3HD1 ILE 98 -5.049 -13.410 2.377 765 HD12 ILE 98 1HD1 ILE 98 -6.339 -12.255 2.030 766 HD13 ILE 98 2HD1 ILE 98 -6.639 -13.989 1.881 767 H ARG 99 H ARG 99 -7.106 -10.959 7.825 768 HA ARG 99 HA ARG 99 -8.959 -8.708 7.368 769 HE ARG 99 HE ARG 99 -12.164 -7.896 10.591 770 HB2 ARG 99 1HB ARG 99 -9.510 -10.065 9.370 771 HB3 ARG 99 2HB ARG 99 -7.908 -9.732 10.014 772 HG2 ARG 99 1HG ARG 99 -9.452 -8.272 11.083 773 HG3 ARG 99 2HG ARG 99 -8.470 -7.308 9.980 774 HD2 ARG 99 1HD ARG 99 -10.606 -6.519 9.569 775 HD3 ARG 99 2HD ARG 99 -10.391 -7.717 8.295 776 HH11 ARG 99 1HH1 ARG 99 -10.710 -9.530 7.865 777 HH12 ARG 99 2HH1 ARG 99 -11.901 -10.785 7.829 778 HH21 ARG 99 1HH2 ARG 99 -13.724 -9.549 10.540 779 HH22 ARG 99 2HH2 ARG 99 -13.609 -10.798 9.345 780 HA PRO 100 HA PRO 100 -4.842 -6.820 6.824 781 HB2 PRO 100 1HB PRO 100 -5.833 -4.474 5.809 782 HB3 PRO 100 2HB PRO 100 -5.527 -5.918 4.839 783 HG2 PRO 100 1HG PRO 100 -8.105 -4.957 6.028 784 HG3 PRO 100 2HG PRO 100 -7.792 -5.596 4.402 785 HD2 PRO 100 1HD PRO 100 -8.885 -7.121 6.308 786 HD3 PRO 100 2HD PRO 100 -7.719 -7.794 5.150 787 H ALA 101 H ALA 101 -7.699 -5.502 8.403 788 HA ALA 101 HA ALA 101 -6.416 -4.728 10.753 789 HB1 ALA 101 3HB ALA 101 -5.719 -2.977 8.672 790 HB2 ALA 101 1HB ALA 101 -5.421 -2.775 10.398 791 HB3 ALA 101 2HB ALA 101 -6.879 -2.104 9.671 792 H SER 102 H SER 102 -7.795 -2.367 11.404 793 HA SER 102 HA SER 102 -10.550 -3.367 11.386 794 HG SER 102 HG SER 102 -8.562 -0.912 13.676 795 HB2 SER 102 1HB SER 102 -10.560 -1.417 13.277 796 HB3 SER 102 2HB SER 102 -10.187 -3.107 13.611 797 H ALA 103 H ALA 103 -8.681 -1.056 9.843 798 HA ALA 103 HA ALA 103 -10.900 0.172 8.621 799 HB1 ALA 103 3HB ALA 103 -10.671 2.455 9.553 800 HB2 ALA 103 1HB ALA 103 -9.571 1.809 10.773 801 HB3 ALA 103 2HB ALA 103 -11.253 1.273 10.726 802 H VAL 104 H VAL 104 -9.376 -0.547 6.927 803 HA VAL 104 HA VAL 104 -7.411 1.585 6.374 804 HB VAL 104 HB VAL 104 -5.920 0.016 5.269 805 HG11 VAL 104 1HG1 VAL 104 -5.911 0.457 7.803 806 HG12 VAL 104 2HG1 VAL 104 -4.957 -0.891 7.181 807 HG13 VAL 104 3HG1 VAL 104 -6.519 -1.192 7.942 808 HG21 VAL 104 3HG2 VAL 104 -7.953 -1.603 4.808 809 HG22 VAL 104 1HG2 VAL 104 -7.409 -2.341 6.315 810 HG23 VAL 104 2HG2 VAL 104 -6.307 -2.216 4.946 811 H ASN 105 H ASN 105 -7.287 2.396 4.336 812 HA ASN 105 HA ASN 105 -9.598 2.000 2.658 813 HB2 ASN 105 1HB ASN 105 -7.253 3.700 1.869 814 HB3 ASN 105 2HB ASN 105 -8.965 3.958 1.550 815 HD21 ASN 105 1HD2 ASN 105 -6.968 5.743 2.674 816 HD22 ASN 105 2HD2 ASN 105 -7.575 6.234 4.212 817 H VAL 106 H VAL 106 -9.554 1.528 0.415 818 HA VAL 106 HA VAL 106 -7.576 -0.468 -0.318 819 HB VAL 106 HB VAL 106 -9.269 0.085 -2.537 820 HG11 VAL 106 1HG1 VAL 106 -9.472 -2.150 -2.569 821 HG12 VAL 106 2HG1 VAL 106 -9.887 -2.246 -0.858 822 HG13 VAL 106 3HG1 VAL 106 -8.200 -2.077 -1.349 823 HG21 VAL 106 3HG2 VAL 106 -10.921 1.149 -1.253 824 HG22 VAL 106 1HG2 VAL 106 -10.742 0.005 0.078 825 HG23 VAL 106 2HG2 VAL 106 -11.481 -0.514 -1.435 826 H ILE 107 H ILE 107 -5.804 0.959 -0.400 827 HA ILE 107 HA ILE 107 -5.643 3.253 -1.985 828 HB ILE 107 HB ILE 107 -4.132 2.323 -0.068 829 HG12 ILE 107 1HG1 ILE 107 -3.987 4.435 -1.844 830 HG13 ILE 107 2HG1 ILE 107 -3.040 4.251 -0.375 831 HG21 ILE 107 1HG2 ILE 107 -2.557 1.406 -2.470 832 HG22 ILE 107 2HG2 ILE 107 -3.371 0.346 -1.320 833 HG23 ILE 107 3HG2 ILE 107 -2.038 1.365 -0.787 834 HD11 ILE 107 3HD1 ILE 107 -2.213 3.445 -3.148 835 HD12 ILE 107 1HD1 ILE 107 -1.269 3.170 -1.685 836 HD13 ILE 107 2HD1 ILE 107 -1.610 4.816 -2.218 837 H GLY 108 H GLY 108 -6.523 0.640 -3.418 838 HA2 GLY 108 1HA GLY 108 -6.362 0.714 -5.870 839 HA3 GLY 108 2HA GLY 108 -4.633 0.945 -5.663 840 H ARG 109 H ARG 109 -3.806 -0.824 -6.639 841 HA ARG 109 HA ARG 109 -3.897 -3.294 -5.280 842 HE ARG 109 HE ARG 109 -7.573 -2.056 -9.804 843 HB2 ARG 109 1HB ARG 109 -4.796 -4.446 -7.534 844 HB3 ARG 109 2HB ARG 109 -5.828 -4.073 -6.166 845 HG2 ARG 109 1HG ARG 109 -6.538 -2.006 -7.265 846 HG3 ARG 109 2HG ARG 109 -5.490 -2.380 -8.639 847 HD2 ARG 109 1HD ARG 109 -6.765 -4.490 -8.952 848 HD3 ARG 109 2HD ARG 109 -7.864 -3.967 -7.677 849 HH11 ARG 109 1HH1 ARG 109 -9.294 -4.893 -8.725 850 HH12 ARG 109 2HH1 ARG 109 -10.675 -4.588 -9.722 851 HH21 ARG 109 1HH2 ARG 109 -9.390 -1.654 -11.117 852 HH22 ARG 109 2HH2 ARG 109 -10.730 -2.750 -11.081 853 H ILE 110 H ILE 110 -2.626 -4.985 -6.374 854 HA ILE 110 HA ILE 110 -0.380 -3.777 -7.779 855 HB ILE 110 HB ILE 110 -0.755 -6.591 -6.736 856 HG12 ILE 110 1HG1 ILE 110 1.290 -5.201 -5.353 857 HG13 ILE 110 2HG1 ILE 110 -0.087 -4.107 -5.431 858 HG21 ILE 110 1HG2 ILE 110 1.664 -6.827 -7.053 859 HG22 ILE 110 2HG2 ILE 110 1.720 -5.228 -7.793 860 HG23 ILE 110 3HG2 ILE 110 0.831 -6.535 -8.578 861 HD11 ILE 110 3HD1 ILE 110 -0.082 -6.900 -4.305 862 HD12 ILE 110 1HD1 ILE 110 -1.499 -5.855 -4.431 863 HD13 ILE 110 2HD1 ILE 110 -0.149 -5.391 -3.396 864 H VAL 111 H VAL 111 -0.388 -3.706 -9.931 865 HA VAL 111 HA VAL 111 -2.157 -5.359 -11.486 866 HB VAL 111 HB VAL 111 -0.534 -4.228 -13.375 867 HG11 VAL 111 1HG1 VAL 111 -2.447 -2.275 -12.895 868 HG12 VAL 111 2HG1 VAL 111 -3.160 -3.758 -12.259 869 HG13 VAL 111 3HG1 VAL 111 -2.613 -3.691 -13.934 870 HG21 VAL 111 3HG2 VAL 111 0.687 -3.061 -11.480 871 HG22 VAL 111 1HG2 VAL 111 -0.779 -2.109 -11.256 872 HG23 VAL 111 2HG2 VAL 111 0.094 -2.036 -12.786 873 H ASN 112 H ASN 112 1.238 -4.810 -12.343 874 HA ASN 112 HA ASN 112 1.858 -7.627 -12.084 875 HB2 ASN 112 1HB ASN 112 2.584 -7.745 -14.517 876 HB3 ASN 112 2HB ASN 112 0.846 -7.755 -14.228 877 HD21 ASN 112 1HD2 ASN 112 0.454 -7.021 -16.322 878 HD22 ASN 112 2HD2 ASN 112 0.731 -5.378 -16.779 879 H SER 113 H SER 113 3.976 -7.977 -11.749 880 HA SER 113 HA SER 113 6.143 -6.599 -12.759 881 HG SER 113 HG SER 113 6.865 -3.770 -11.128 882 HB2 SER 113 1HB SER 113 4.784 -4.990 -10.881 883 HB3 SER 113 2HB SER 113 6.232 -5.573 -10.059 884 H MET 114 H MET 114 5.110 -7.645 -9.514 885 HA MET 114 HA MET 114 6.415 -10.100 -9.524 886 HB2 MET 114 1HB MET 114 8.295 -8.091 -9.406 887 HB3 MET 114 2HB MET 114 8.067 -8.493 -7.711 888 HG2 MET 114 1HG MET 114 9.886 -9.773 -8.638 889 HG3 MET 114 2HG MET 114 8.547 -10.839 -8.206 890 HE1 MET 114 3HE MET 114 7.111 -12.340 -10.581 891 HE2 MET 114 1HE MET 114 8.222 -12.594 -9.235 892 HE3 MET 114 2HE MET 114 8.688 -13.078 -10.866 893 H GLU 115 H GLU 115 4.259 -10.289 -8.593 894 HA GLU 115 HA GLU 115 3.632 -9.145 -6.068 895 HB2 GLU 115 1HB GLU 115 1.735 -10.702 -6.068 896 HB3 GLU 115 2HB GLU 115 1.886 -9.870 -7.610 897 HG2 GLU 115 1HG GLU 115 3.235 -11.984 -8.304 898 HG3 GLU 115 2HG GLU 115 2.404 -12.729 -6.940 899 H GLY 116 H GLY 116 5.930 -9.862 -5.309 900 HA2 GLY 116 1HA GLY 116 5.516 -12.280 -3.694 901 HA3 GLY 116 2HA GLY 116 6.988 -12.133 -4.639 902 H LEU 117 H LEU 117 5.851 -9.150 -3.432 903 HA LEU 117 HA LEU 117 8.143 -8.646 -1.941 904 HG LEU 117 HG LEU 117 7.398 -7.003 0.129 905 HB2 LEU 117 1HB LEU 117 6.699 -6.859 -2.741 906 HB3 LEU 117 2HB LEU 117 5.418 -7.385 -1.664 907 HD11 LEU 117 1HD1 LEU 117 8.520 -4.890 -0.382 908 HD12 LEU 117 2HD1 LEU 117 7.864 -4.941 -2.016 909 HD13 LEU 117 3HD1 LEU 117 9.000 -6.181 -1.480 910 HD21 LEU 117 3HD2 LEU 117 6.251 -5.071 0.822 911 HD22 LEU 117 1HD2 LEU 117 5.038 -6.100 0.063 912 HD23 LEU 117 2HD2 LEU 117 5.698 -4.718 -0.813 913 H LYS 118 H LYS 118 4.963 -9.789 -0.876 914 HA LYS 118 HA LYS 118 5.125 -9.681 1.822 915 HB2 LYS 118 1HB LYS 118 3.890 -11.913 1.852 916 HB3 LYS 118 2HB LYS 118 3.159 -10.606 0.935 917 HG2 LYS 118 1HG LYS 118 2.910 -12.340 -0.526 918 HG3 LYS 118 2HG LYS 118 4.462 -11.702 -1.065 919 HD2 LYS 118 1HD LYS 118 5.033 -13.898 -0.900 920 HD3 LYS 118 2HD LYS 118 5.348 -13.421 0.769 921 HE2 LYS 118 1HE LYS 118 2.904 -14.078 1.205 922 HE3 LYS 118 2HE LYS 118 2.990 -14.900 -0.353 923 HZ1 LYS 118 3HZ LYS 118 4.828 -15.405 1.923 924 HZ2 LYS 118 1HZ LYS 118 4.785 -16.249 0.458 925 HZ3 LYS 118 2HZ LYS 118 3.489 -16.363 1.539 926 H GLY 119 H GLY 119 7.136 -11.676 -0.207 927 HA2 GLY 119 1HA GLY 119 8.070 -13.271 2.048 928 HA3 GLY 119 2HA GLY 119 8.570 -13.445 0.373 929 H VAL 120 H VAL 120 8.542 -10.366 2.023 930 HA VAL 120 HA VAL 120 11.277 -9.856 1.400 931 HB VAL 120 HB VAL 120 10.917 -7.840 2.955 932 HG11 VAL 120 1HG1 VAL 120 10.782 -7.076 0.860 933 HG12 VAL 120 2HG1 VAL 120 9.044 -7.048 1.145 934 HG13 VAL 120 3HG1 VAL 120 9.783 -8.424 0.326 935 HG21 VAL 120 3HG2 VAL 120 8.081 -7.811 2.725 936 HG22 VAL 120 1HG2 VAL 120 9.069 -7.731 4.184 937 HG23 VAL 120 2HG2 VAL 120 8.555 -9.293 3.552 938 H ALA 121 H ALA 121 13.012 -9.416 2.909 939 HA ALA 121 HA ALA 121 13.086 -11.312 5.085 940 HB1 ALA 121 3HB ALA 121 15.231 -9.279 4.577 941 HB2 ALA 121 1HB ALA 121 15.022 -10.648 3.484 942 HB3 ALA 121 2HB ALA 121 15.377 -10.928 5.186 943 H ASP 122 H ASP 122 13.353 -10.790 7.308 944 HA ASP 122 HA ASP 122 11.769 -8.718 8.255 945 HB2 ASP 122 1HB ASP 122 12.561 -9.248 10.458 946 HB3 ASP 122 2HB ASP 122 12.362 -10.742 9.549 947 H GLY 123 H GLY 123 12.083 -6.634 7.973 948 HA2 GLY 123 1HA GLY 123 13.033 -4.565 8.344 949 HA3 GLY 123 2HA GLY 123 14.400 -5.369 9.095 950 H GLU 124 H GLU 124 13.204 -3.823 6.290 951 HA GLU 124 HA GLU 124 15.861 -3.783 5.166 952 HB2 GLU 124 1HB GLU 124 14.431 -4.366 2.860 953 HB3 GLU 124 2HB GLU 124 15.562 -5.430 3.678 954 HG2 GLU 124 1HG GLU 124 13.665 -6.349 4.985 955 HG3 GLU 124 2HG GLU 124 12.576 -5.361 4.011 956 H SER 125 H SER 125 16.138 -2.196 3.514 957 HA SER 125 HA SER 125 14.839 0.207 4.022 958 HG SER 125 HG SER 125 16.014 2.010 2.312 959 HB2 SER 125 1HB SER 125 17.027 -0.602 2.523 960 HB3 SER 125 2HB SER 125 15.931 0.078 1.320 961 H VAL 126 H VAL 126 13.745 1.573 2.370 962 HA VAL 126 HA VAL 126 12.086 0.282 0.404 963 HB VAL 126 HB VAL 126 10.755 1.566 2.798 964 HG11 VAL 126 1HG1 VAL 126 9.506 2.017 0.793 965 HG12 VAL 126 2HG1 VAL 126 8.666 0.788 1.736 966 HG13 VAL 126 3HG1 VAL 126 9.596 0.321 0.315 967 HG21 VAL 126 3HG2 VAL 126 9.792 -0.709 3.133 968 HG22 VAL 126 1HG2 VAL 126 11.518 -0.578 3.457 969 HG23 VAL 126 2HG2 VAL 126 10.958 -1.309 1.953 970 H VAL 127 H VAL 127 11.737 1.688 -1.244 971 HA VAL 127 HA VAL 127 11.912 4.565 -0.635 972 HB VAL 127 HB VAL 127 13.049 4.921 -2.806 973 HG11 VAL 127 1HG1 VAL 127 14.146 4.100 -0.414 974 HG12 VAL 127 2HG1 VAL 127 15.016 4.831 -1.762 975 HG13 VAL 127 3HG1 VAL 127 14.948 3.076 -1.604 976 HG21 VAL 127 3HG2 VAL 127 12.909 3.281 -4.307 977 HG22 VAL 127 1HG2 VAL 127 12.502 2.081 -3.078 978 HG23 VAL 127 2HG2 VAL 127 14.190 2.479 -3.400 979 H VAL 128 H VAL 128 9.926 5.324 -0.929 980 HA VAL 128 HA VAL 128 8.135 4.205 -2.906 981 HB VAL 128 HB VAL 128 7.365 6.746 -1.614 982 HG11 VAL 128 1HG1 VAL 128 5.386 5.158 -0.989 983 HG12 VAL 128 2HG1 VAL 128 6.114 4.096 -2.191 984 HG13 VAL 128 3HG1 VAL 128 5.583 5.717 -2.648 985 HG21 VAL 128 3HG2 VAL 128 8.274 6.172 0.382 986 HG22 VAL 128 1HG2 VAL 128 8.329 4.453 -0.011 987 HG23 VAL 128 2HG2 VAL 128 6.813 5.192 0.496 988 H GLU 129 H GLU 129 7.825 5.018 -4.954 989 HA GLU 129 HA GLU 129 8.361 7.802 -5.530 990 HB2 GLU 129 1HB GLU 129 9.865 7.150 -7.473 991 HB3 GLU 129 2HB GLU 129 10.568 7.026 -5.866 992 HG2 GLU 129 1HG GLU 129 9.799 4.553 -6.001 993 HG3 GLU 129 2HG GLU 129 9.731 4.857 -7.737 994 H ARG 130 H ARG 130 6.993 8.554 -7.047 995 HA ARG 130 HA ARG 130 5.054 6.783 -8.207 996 HE ARG 130 HE ARG 130 5.171 8.525 -12.201 997 HB2 ARG 130 1HB ARG 130 4.409 9.009 -7.455 998 HB3 ARG 130 2HB ARG 130 5.538 9.745 -8.583 999 HG2 ARG 130 1HG ARG 130 3.516 7.947 -9.758 1000 HG3 ARG 130 2HG ARG 130 2.925 9.461 -9.070 1001 HD2 ARG 130 1HD ARG 130 3.554 10.511 -10.920 1002 HD3 ARG 130 2HD ARG 130 5.228 10.106 -10.549 1003 HH11 ARG 130 1HH1 ARG 130 1.897 9.432 -11.404 1004 HH12 ARG 130 2HH1 ARG 130 1.199 8.541 -12.713 1005 HH21 ARG 130 1HH2 ARG 130 4.254 7.354 -13.927 1006 HH22 ARG 130 2HH2 ARG 130 2.537 7.360 -14.145 1007 H ALA 131 H ALA 131 6.192 5.424 -9.592 1008 HA ALA 131 HA ALA 131 7.375 4.762 -11.453 1009 HB1 ALA 131 3HB ALA 131 5.936 6.863 -12.988 1010 HB2 ALA 131 1HB ALA 131 5.002 5.629 -12.141 1011 HB3 ALA 131 2HB ALA 131 6.184 5.157 -13.360 Start of MODEL 8 1 H MET 1 H MET 1 -12.815 11.733 -21.050 2 HA MET 1 HA MET 1 -9.893 11.864 -21.188 3 HB2 MET 1 1HB MET 1 -11.813 13.726 -21.597 4 HB3 MET 1 2HB MET 1 -11.600 13.888 -19.859 5 HG2 MET 1 1HG MET 1 -9.043 13.932 -20.573 6 HG3 MET 1 2HG MET 1 -9.747 14.537 -22.072 7 HE1 MET 1 3HE MET 1 -8.266 17.040 -21.514 8 HE2 MET 1 1HE MET 1 -9.668 18.106 -21.440 9 HE3 MET 1 2HE MET 1 -9.672 16.719 -22.530 10 H GLY 2 H GLY 2 -12.638 11.238 -19.116 11 HA2 GLY 2 1HA GLY 2 -11.654 9.770 -17.177 12 HA3 GLY 2 2HA GLY 2 -10.946 11.314 -16.727 13 H GLU 3 H GLU 3 -13.621 9.296 -16.429 14 HA GLU 3 HA GLU 3 -15.733 11.097 -16.082 15 HB2 GLU 3 1HB GLU 3 -16.656 9.260 -14.549 16 HB3 GLU 3 2HB GLU 3 -16.328 8.831 -16.223 17 HG2 GLU 3 1HG GLU 3 -14.397 7.630 -15.650 18 HG3 GLU 3 2HG GLU 3 -14.333 8.342 -14.038 19 H ARG 4 H ARG 4 -13.241 9.995 -13.849 20 HA ARG 4 HA ARG 4 -13.831 12.260 -12.124 21 HE ARG 4 HE ARG 4 -16.629 12.051 -10.247 22 HB2 ARG 4 1HB ARG 4 -13.380 9.846 -10.517 23 HB3 ARG 4 2HB ARG 4 -14.506 11.168 -10.273 24 HG2 ARG 4 1HG ARG 4 -15.124 9.264 -12.456 25 HG3 ARG 4 2HG ARG 4 -15.283 8.676 -10.804 26 HD2 ARG 4 1HD ARG 4 -16.791 10.856 -12.197 27 HD3 ARG 4 2HD ARG 4 -17.405 9.483 -11.280 28 HH11 ARG 4 1HH1 ARG 4 -17.072 8.675 -9.482 29 HH12 ARG 4 2HH1 ARG 4 -17.310 8.960 -7.792 30 HH21 ARG 4 1HH2 ARG 4 -16.943 12.428 -8.022 31 HH22 ARG 4 2HH2 ARG 4 -17.239 11.091 -6.962 32 H GLY 5 H GLY 5 -11.923 9.275 -11.749 33 HA2 GLY 5 1HA GLY 5 -9.436 10.277 -12.477 34 HA3 GLY 5 2HA GLY 5 -9.646 10.675 -10.779 35 H VAL 6 H VAL 6 -9.254 8.093 -13.099 36 HA VAL 6 HA VAL 6 -8.390 6.339 -10.901 37 HB VAL 6 HB VAL 6 -9.535 4.395 -11.925 38 HG11 VAL 6 1HG1 VAL 6 -10.702 5.158 -10.085 39 HG12 VAL 6 2HG1 VAL 6 -11.933 5.232 -11.345 40 HG13 VAL 6 3HG1 VAL 6 -11.101 6.701 -10.844 41 HG21 VAL 6 3HG2 VAL 6 -10.717 4.466 -13.828 42 HG22 VAL 6 1HG2 VAL 6 -9.855 5.974 -14.131 43 HG23 VAL 6 2HG2 VAL 6 -11.467 6.009 -13.422 44 H GLU 7 H GLU 7 -6.310 7.022 -11.767 45 HA GLU 7 HA GLU 7 -5.177 5.064 -13.430 46 HB2 GLU 7 1HB GLU 7 -4.445 7.109 -15.106 47 HB3 GLU 7 2HB GLU 7 -5.656 5.890 -15.461 48 HG2 GLU 7 1HG GLU 7 -7.425 7.340 -14.940 49 HG3 GLU 7 2HG GLU 7 -6.357 8.480 -14.119 50 H MET 8 H MET 8 -4.731 6.363 -10.902 51 HA MET 8 HA MET 8 -2.105 7.604 -11.366 52 HB2 MET 8 1HB MET 8 -4.118 8.719 -10.004 53 HB3 MET 8 2HB MET 8 -3.401 7.783 -8.699 54 HG2 MET 8 1HG MET 8 -2.014 9.480 -8.391 55 HG3 MET 8 2HG MET 8 -1.234 9.007 -9.899 56 HE1 MET 8 3HE MET 8 -2.616 10.240 -12.471 57 HE2 MET 8 1HE MET 8 -1.004 10.182 -11.759 58 HE3 MET 8 2HE MET 8 -1.708 11.731 -12.221 59 H ARG 9 H ARG 9 -0.594 6.067 -11.266 60 HA ARG 9 HA ARG 9 -0.728 4.167 -9.014 61 HE ARG 9 HE ARG 9 3.896 2.424 -12.718 62 HB2 ARG 9 1HB ARG 9 0.110 2.461 -10.323 63 HB3 ARG 9 2HB ARG 9 -0.890 3.330 -11.476 64 HG2 ARG 9 1HG ARG 9 0.939 3.166 -12.769 65 HG3 ARG 9 2HG ARG 9 1.457 4.588 -11.862 66 HD2 ARG 9 1HD ARG 9 3.106 3.467 -10.836 67 HD3 ARG 9 2HD ARG 9 2.077 2.070 -10.519 68 HH11 ARG 9 1HH1 ARG 9 1.044 0.751 -11.602 69 HH12 ARG 9 2HH1 ARG 9 1.240 -0.575 -12.697 70 HH21 ARG 9 1HH2 ARG 9 4.156 0.681 -14.159 71 HH22 ARG 9 2HH2 ARG 9 3.007 -0.615 -14.150 72 H LEU 10 H LEU 10 1.083 3.699 -7.844 73 HA LEU 10 HA LEU 10 3.393 5.480 -8.279 74 HG LEU 10 HG LEU 10 0.913 4.342 -5.819 75 HB2 LEU 10 1HB LEU 10 3.437 4.566 -5.591 76 HB3 LEU 10 2HB LEU 10 3.256 6.203 -6.180 77 HD11 LEU 10 1HD1 LEU 10 0.500 5.663 -3.725 78 HD12 LEU 10 2HD1 LEU 10 2.137 6.301 -3.878 79 HD13 LEU 10 3HD1 LEU 10 1.885 4.571 -3.644 80 HD21 LEU 10 3HD2 LEU 10 -0.334 6.027 -6.572 81 HD22 LEU 10 1HD2 LEU 10 1.167 6.773 -7.122 82 HD23 LEU 10 2HD2 LEU 10 0.497 7.198 -5.547 83 H ARG 11 H ARG 11 5.462 4.588 -7.402 84 HA ARG 11 HA ARG 11 5.568 1.707 -7.961 85 HE ARG 11 HE ARG 11 9.061 -0.870 -9.951 86 HB2 ARG 11 1HB ARG 11 6.968 3.769 -9.126 87 HB3 ARG 11 2HB ARG 11 8.120 3.146 -7.954 88 HG2 ARG 11 1HG ARG 11 6.713 1.503 -10.050 89 HG3 ARG 11 2HG ARG 11 8.365 2.113 -10.166 90 HD2 ARG 11 1HD ARG 11 8.394 0.849 -7.747 91 HD3 ARG 11 2HD ARG 11 7.292 -0.169 -8.673 92 HH11 ARG 11 1HH1 ARG 11 10.024 1.942 -8.121 93 HH12 ARG 11 2HH1 ARG 11 11.695 1.802 -8.548 94 HH21 ARG 11 1HH2 ARG 11 11.260 -1.057 -10.513 95 HH22 ARG 11 2HH2 ARG 11 12.398 0.100 -9.905 96 H ILE 12 H ILE 12 6.776 0.329 -6.641 97 HA ILE 12 HA ILE 12 7.953 1.421 -4.211 98 HB ILE 12 HB ILE 12 5.416 -0.054 -4.271 99 HG12 ILE 12 1HG1 ILE 12 6.656 1.195 -1.854 100 HG13 ILE 12 2HG1 ILE 12 6.154 2.221 -3.193 101 HG21 ILE 12 1HG2 ILE 12 5.969 -1.240 -2.079 102 HG22 ILE 12 2HG2 ILE 12 7.658 -1.085 -2.565 103 HG23 ILE 12 3HG2 ILE 12 6.528 -1.986 -3.575 104 HD11 ILE 12 3HD1 ILE 12 4.308 0.249 -1.886 105 HD12 ILE 12 1HD1 ILE 12 3.899 1.586 -2.961 106 HD13 ILE 12 2HD1 ILE 12 4.489 1.915 -1.331 107 H ARG 13 H ARG 13 9.962 0.732 -4.576 108 HA ARG 13 HA ARG 13 10.371 -2.029 -5.476 109 HE ARG 13 HE ARG 13 15.022 0.565 -4.955 110 HB2 ARG 13 1HB ARG 13 12.725 -1.315 -5.882 111 HB3 ARG 13 2HB ARG 13 11.539 -0.424 -6.825 112 HG2 ARG 13 1HG ARG 13 11.680 1.422 -5.188 113 HG3 ARG 13 2HG ARG 13 12.942 0.529 -4.338 114 HD2 ARG 13 1HD ARG 13 13.325 0.936 -7.242 115 HD3 ARG 13 2HD ARG 13 13.456 2.366 -6.220 116 HH11 ARG 13 1HH1 ARG 13 14.878 1.689 -8.255 117 HH12 ARG 13 2HH1 ARG 13 16.568 1.449 -8.543 118 HH21 ARG 13 1HH2 ARG 13 17.247 0.251 -5.331 119 HH22 ARG 13 2HH2 ARG 13 17.913 0.631 -6.884 120 H PHE 14 H PHE 14 11.998 -3.336 -4.505 121 HA PHE 14 HA PHE 14 12.760 -2.655 -1.768 122 HD1 PHE 14 HD2 PHE 14 9.623 -2.630 -2.159 123 HD2 PHE 14 HD1 PHE 14 11.562 -4.974 0.815 124 HE1 PHE 14 HE2 PHE 14 8.147 -1.667 -0.445 125 HE2 PHE 14 HE1 PHE 14 10.087 -4.017 2.535 126 HZ PHE 14 HZ PHE 14 8.377 -2.361 1.906 127 HB2 PHE 14 1HB PHE 14 10.976 -4.887 -2.607 128 HB3 PHE 14 2HB PHE 14 12.178 -5.243 -1.374 129 H GLU 15 H GLU 15 14.767 -3.322 -1.269 130 HA GLU 15 HA GLU 15 16.673 -3.903 -3.097 131 HB2 GLU 15 1HB GLU 15 16.477 -4.286 -0.179 132 HB3 GLU 15 2HB GLU 15 17.687 -5.278 -0.975 133 HG2 GLU 15 1HG GLU 15 18.335 -2.958 -0.047 134 HG3 GLU 15 2HG GLU 15 18.952 -3.480 -1.609 135 H SER 16 H SER 16 14.454 -6.209 -1.710 136 HA SER 16 HA SER 16 15.724 -8.310 -3.344 137 HG SER 16 HG SER 16 15.642 -10.800 -1.467 138 HB2 SER 16 1HB SER 16 16.134 -8.821 -1.021 139 HB3 SER 16 2HB SER 16 14.433 -8.580 -0.620 140 H ALA 17 H ALA 17 13.380 -6.404 -3.826 141 HA ALA 17 HA ALA 17 11.755 -8.254 -5.214 142 HB1 ALA 17 3HB ALA 17 10.055 -7.135 -3.067 143 HB2 ALA 17 1HB ALA 17 11.141 -8.453 -2.617 144 HB3 ALA 17 2HB ALA 17 9.961 -8.684 -3.906 145 H GLU 18 H GLU 18 10.064 -7.314 -6.426 146 HA GLU 18 HA GLU 18 9.962 -4.366 -6.380 147 HB2 GLU 18 1HB GLU 18 9.872 -4.392 -8.855 148 HB3 GLU 18 2HB GLU 18 11.397 -4.994 -8.222 149 HG2 GLU 18 1HG GLU 18 10.151 -7.315 -8.439 150 HG3 GLU 18 2HG GLU 18 9.235 -6.427 -9.656 151 H CYS 19 H CYS 19 7.971 -3.416 -6.816 152 HA CYS 19 HA CYS 19 5.766 -4.964 -7.823 153 HG CYS 19 HG CYS 19 7.235 -4.396 -4.383 154 HB2 CYS 19 1HB CYS 19 4.669 -4.131 -5.358 155 HB3 CYS 19 2HB CYS 19 4.925 -5.779 -5.912 156 H GLU 20 H GLU 20 3.908 -3.717 -8.305 157 HA GLU 20 HA GLU 20 4.175 -0.825 -7.824 158 HB2 GLU 20 1HB GLU 20 2.939 -1.742 -10.375 159 HB3 GLU 20 2HB GLU 20 3.832 -0.269 -10.032 160 HG2 GLU 20 1HG GLU 20 5.840 -1.950 -9.775 161 HG3 GLU 20 2HG GLU 20 4.822 -2.953 -10.806 162 H VAL 21 H VAL 21 2.107 0.348 -7.960 163 HA VAL 21 HA VAL 21 -0.306 -1.252 -7.835 164 HB VAL 21 HB VAL 21 -0.451 -1.418 -5.629 165 HG11 VAL 21 1HG1 VAL 21 1.901 -1.466 -5.402 166 HG12 VAL 21 2HG1 VAL 21 1.291 -0.421 -4.116 167 HG13 VAL 21 3HG1 VAL 21 2.024 0.288 -5.557 168 HG21 VAL 21 3HG2 VAL 21 -0.327 1.597 -5.557 169 HG22 VAL 21 1HG2 VAL 21 -0.854 0.562 -4.230 170 HG23 VAL 21 2HG2 VAL 21 -1.779 0.611 -5.730 171 H GLU 22 H GLU 22 -2.174 -0.128 -8.210 172 HA GLU 22 HA GLU 22 -1.827 2.618 -9.166 173 HB2 GLU 22 1HB GLU 22 -4.058 0.619 -9.591 174 HB3 GLU 22 2HB GLU 22 -4.053 2.256 -10.236 175 HG2 GLU 22 1HG GLU 22 -2.715 1.703 -11.929 176 HG3 GLU 22 2HG GLU 22 -1.645 0.760 -10.894 177 H LEU 23 H LEU 23 -4.166 3.830 -8.907 178 HA LEU 23 HA LEU 23 -5.291 3.352 -6.297 179 HG LEU 23 HG LEU 23 -5.683 6.669 -6.180 180 HB2 LEU 23 1HB LEU 23 -3.595 4.632 -5.411 181 HB3 LEU 23 2HB LEU 23 -3.433 5.611 -6.854 182 HD11 LEU 23 1HD1 LEU 23 -5.181 4.878 -3.904 183 HD12 LEU 23 2HD1 LEU 23 -6.683 5.610 -4.466 184 HD13 LEU 23 3HD1 LEU 23 -5.570 6.540 -3.467 185 HD21 LEU 23 3HD2 LEU 23 -3.724 7.967 -6.053 186 HD22 LEU 23 1HD2 LEU 23 -3.109 7.052 -4.676 187 HD23 LEU 23 2HD2 LEU 23 -4.497 8.121 -4.476 188 H TYR 24 H TYR 24 -7.239 4.390 -5.916 189 HA TYR 24 HA TYR 24 -8.353 5.873 -8.205 190 HD1 TYR 24 HD2 TYR 24 -8.386 4.639 -9.881 191 HD2 TYR 24 HD1 TYR 24 -9.920 1.602 -7.328 192 HE1 TYR 24 HE2 TYR 24 -7.717 2.931 -11.519 193 HE2 TYR 24 HE1 TYR 24 -9.253 -0.114 -8.957 194 HH TYR 24 HH TYR 24 -7.313 -0.139 -10.914 195 HB2 TYR 24 1HB TYR 24 -9.817 3.791 -6.549 196 HB3 TYR 24 2HB TYR 24 -10.517 4.758 -7.843 197 H GLU 25 H GLU 25 -9.862 7.482 -7.745 198 HA GLU 25 HA GLU 25 -9.390 9.008 -5.461 199 HB2 GLU 25 1HB GLU 25 -11.714 9.081 -7.384 200 HB3 GLU 25 2HB GLU 25 -11.458 10.280 -6.125 201 HG2 GLU 25 1HG GLU 25 -9.417 11.010 -7.139 202 HG3 GLU 25 2HG GLU 25 -9.457 9.680 -8.297 203 H GLU 26 H GLU 26 -11.237 6.185 -5.578 204 HA GLU 26 HA GLU 26 -13.463 6.597 -4.080 205 HB2 GLU 26 1HB GLU 26 -13.364 4.322 -3.408 206 HB3 GLU 26 2HB GLU 26 -12.615 4.404 -4.995 207 HG2 GLU 26 1HG GLU 26 -10.391 4.471 -3.832 208 HG3 GLU 26 2HG GLU 26 -11.248 4.130 -2.331 209 H TRP 27 H TRP 27 -10.163 6.805 -2.969 210 HA TRP 27 HA TRP 27 -10.900 6.833 -0.177 211 HD1 TRP 27 HD1 TRP 27 -6.106 7.699 -0.199 212 HE1 TRP 27 HE1 TRP 27 -5.725 8.750 2.115 213 HE3 TRP 27 HE3 TRP 27 -10.920 7.628 1.540 214 HZ2 TRP 27 HZ2 TRP 27 -7.253 9.461 4.374 215 HZ3 TRP 27 HZ3 TRP 27 -11.368 8.518 3.787 216 HH2 TRP 27 HH2 TRP 27 -9.574 9.411 5.176 217 HB2 TRP 27 1HB TRP 27 -8.743 5.919 -0.657 218 HB3 TRP 27 2HB TRP 27 -8.301 7.306 -1.647 219 H ALA 28 H ALA 28 -9.487 9.196 -2.462 220 HA ALA 28 HA ALA 28 -11.104 11.294 -2.242 221 HB1 ALA 28 3HB ALA 28 -9.958 12.687 -0.348 222 HB2 ALA 28 1HB ALA 28 -9.554 11.100 0.307 223 HB3 ALA 28 2HB ALA 28 -11.242 11.543 0.045 224 HA PRO 29 HA PRO 29 -7.810 12.487 -5.059 225 HB2 PRO 29 1HB PRO 29 -8.905 15.137 -5.128 226 HB3 PRO 29 2HB PRO 29 -8.996 13.889 -6.369 227 HG2 PRO 29 1HG PRO 29 -11.004 14.721 -4.407 228 HG3 PRO 29 2HG PRO 29 -11.210 13.786 -5.894 229 HD2 PRO 29 1HD PRO 29 -11.446 12.737 -3.383 230 HD3 PRO 29 2HD PRO 29 -10.982 11.784 -4.805 231 H GLU 30 H GLU 30 -8.848 14.400 -2.271 232 HA GLU 30 HA GLU 30 -6.676 16.158 -2.140 233 HB2 GLU 30 1HB GLU 30 -8.584 15.104 -0.068 234 HB3 GLU 30 2HB GLU 30 -7.293 16.218 0.362 235 HG2 GLU 30 1HG GLU 30 -9.146 17.581 0.036 236 HG3 GLU 30 2HG GLU 30 -8.227 17.733 -1.462 237 H THR 31 H THR 31 -7.189 13.076 -0.413 238 HA THR 31 HA THR 31 -4.686 13.068 0.905 239 HB THR 31 HB THR 31 -5.384 10.366 0.406 240 HG1 THR 31 HG1 THR 31 -7.540 10.296 0.660 241 HG21 THR 31 3HG2 THR 31 -6.351 10.524 2.759 242 HG22 THR 31 1HG2 THR 31 -5.813 12.202 2.737 243 HG23 THR 31 2HG2 THR 31 -4.641 10.896 2.550 244 H VAL 32 H VAL 32 -5.692 11.645 -2.190 245 HA VAL 32 HA VAL 32 -3.411 10.290 -2.906 246 HB VAL 32 HB VAL 32 -5.035 11.979 -4.808 247 HG11 VAL 32 1HG1 VAL 32 -3.337 11.191 -6.111 248 HG12 VAL 32 2HG1 VAL 32 -4.445 9.823 -6.222 249 HG13 VAL 32 3HG1 VAL 32 -3.080 9.763 -5.109 250 HG21 VAL 32 3HG2 VAL 32 -5.678 9.460 -3.378 251 HG22 VAL 32 1HG2 VAL 32 -6.160 9.586 -5.070 252 HG23 VAL 32 2HG2 VAL 32 -6.737 10.770 -3.897 253 H ARG 33 H ARG 33 -3.961 13.739 -2.843 254 HA ARG 33 HA ARG 33 -1.803 14.546 -4.457 255 HE ARG 33 HE ARG 33 -1.944 19.690 -3.970 256 HB2 ARG 33 1HB ARG 33 -3.741 15.970 -3.671 257 HB3 ARG 33 2HB ARG 33 -2.931 16.087 -2.117 258 HG2 ARG 33 1HG ARG 33 -1.783 17.822 -2.866 259 HG3 ARG 33 2HG ARG 33 -1.032 16.793 -4.086 260 HD2 ARG 33 1HD ARG 33 -2.284 17.648 -5.737 261 HD3 ARG 33 2HD ARG 33 -3.753 17.619 -4.760 262 HH11 ARG 33 1HH1 ARG 33 -4.433 18.840 -6.267 263 HH12 ARG 33 2HH1 ARG 33 -4.888 20.482 -6.571 264 HH21 ARG 33 1HH2 ARG 33 -2.543 21.851 -4.370 265 HH22 ARG 33 2HH2 ARG 33 -3.816 22.191 -5.495 266 H ALA 34 H ALA 34 -1.962 13.515 -1.127 267 HA ALA 34 HA ALA 34 0.604 14.559 -0.381 268 HB1 ALA 34 3HB ALA 34 0.209 12.709 1.482 269 HB2 ALA 34 1HB ALA 34 -1.445 12.835 0.880 270 HB3 ALA 34 2HB ALA 34 -0.621 14.265 1.505 271 H ILE 35 H ILE 35 -0.612 11.363 -1.319 272 HA ILE 35 HA ILE 35 1.753 9.908 -0.989 273 HB ILE 35 HB ILE 35 0.288 9.150 -3.422 274 HG12 ILE 35 1HG1 ILE 35 -1.592 10.165 -2.226 275 HG13 ILE 35 2HG1 ILE 35 -1.751 8.411 -2.264 276 HG21 ILE 35 1HG2 ILE 35 1.841 7.664 -2.344 277 HG22 ILE 35 2HG2 ILE 35 0.220 6.979 -2.249 278 HG23 ILE 35 3HG2 ILE 35 0.935 7.754 -0.834 279 HD11 ILE 35 3HD1 ILE 35 -0.378 9.480 0.097 280 HD12 ILE 35 1HD1 ILE 35 -1.613 8.227 -0.037 281 HD13 ILE 35 2HD1 ILE 35 -2.078 9.929 -0.059 282 H ALA 36 H ALA 36 0.509 11.602 -3.912 283 HA ALA 36 HA ALA 36 2.752 11.117 -5.544 284 HB1 ALA 36 3HB ALA 36 1.311 13.651 -5.972 285 HB2 ALA 36 1HB ALA 36 0.315 12.196 -5.968 286 HB3 ALA 36 2HB ALA 36 1.665 12.337 -7.096 287 H ASP 37 H ASP 37 2.115 13.470 -3.039 288 HA ASP 37 HA ASP 37 4.250 15.239 -3.750 289 HB2 ASP 37 1HB ASP 37 2.189 15.690 -2.233 290 HB3 ASP 37 2HB ASP 37 3.172 14.978 -0.957 291 H ALA 38 H ALA 38 4.041 12.267 -2.003 292 HA ALA 38 HA ALA 38 6.705 12.559 -0.864 293 HB1 ALA 38 3HB ALA 38 6.112 10.973 0.682 294 HB2 ALA 38 1HB ALA 38 5.004 10.155 -0.421 295 HB3 ALA 38 2HB ALA 38 4.534 11.681 0.333 296 H LEU 39 H LEU 39 6.942 12.404 -3.528 297 HA LEU 39 HA LEU 39 7.067 9.815 -4.641 298 HG LEU 39 HG LEU 39 6.426 12.974 -5.788 299 HB2 LEU 39 1HB LEU 39 8.630 12.280 -5.441 300 HB3 LEU 39 2HB LEU 39 8.415 10.842 -6.410 301 HD11 LEU 39 1HD1 LEU 39 7.076 13.436 -7.877 302 HD12 LEU 39 2HD1 LEU 39 6.041 12.083 -8.337 303 HD13 LEU 39 3HD1 LEU 39 7.774 11.833 -8.118 304 HD21 LEU 39 3HD2 LEU 39 5.817 10.090 -6.397 305 HD22 LEU 39 1HD2 LEU 39 4.709 11.389 -6.819 306 HD23 LEU 39 2HD2 LEU 39 5.137 11.108 -5.135 307 HA PRO 40 HA PRO 40 11.193 7.901 -4.090 308 HB2 PRO 40 1HB PRO 40 12.674 10.386 -4.888 309 HB3 PRO 40 2HB PRO 40 13.122 8.689 -5.121 310 HG2 PRO 40 1HG PRO 40 11.936 10.158 -7.065 311 HG3 PRO 40 2HG PRO 40 11.702 8.412 -6.898 312 HD2 PRO 40 1HD PRO 40 9.793 10.553 -6.503 313 HD3 PRO 40 2HD PRO 40 9.506 8.809 -6.533 314 H ILE 41 H ILE 41 11.101 7.685 -1.964 315 HA ILE 41 HA ILE 41 12.597 9.546 -0.311 316 HB ILE 41 HB ILE 41 9.669 8.949 0.135 317 HG12 ILE 41 1HG1 ILE 41 11.306 11.500 0.160 318 HG13 ILE 41 2HG1 ILE 41 10.197 10.991 -1.107 319 HG21 ILE 41 1HG2 ILE 41 11.654 9.936 2.187 320 HG22 ILE 41 2HG2 ILE 41 10.784 8.403 2.220 321 HG23 ILE 41 3HG2 ILE 41 9.903 9.918 2.392 322 HD11 ILE 41 3HD1 ILE 41 9.629 12.623 1.054 323 HD12 ILE 41 1HD1 ILE 41 8.890 11.077 1.468 324 HD13 ILE 41 2HD1 ILE 41 8.466 11.881 -0.043 325 H LYS 42 H LYS 42 13.346 8.569 1.645 326 HA LYS 42 HA LYS 42 13.561 5.694 1.410 327 HB2 LYS 42 1HB LYS 42 15.028 7.835 2.791 328 HB3 LYS 42 2HB LYS 42 14.951 6.317 3.672 329 HG2 LYS 42 1HG LYS 42 16.456 5.370 2.345 330 HG3 LYS 42 2HG LYS 42 15.605 5.891 0.890 331 HD2 LYS 42 1HD LYS 42 17.776 6.874 0.836 332 HD3 LYS 42 2HD LYS 42 16.628 8.159 1.216 333 HE2 LYS 42 1HE LYS 42 17.775 6.743 3.531 334 HE3 LYS 42 2HE LYS 42 18.911 7.707 2.590 335 HZ1 LYS 42 3HZ LYS 42 16.698 8.562 4.264 336 HZ2 LYS 42 1HZ LYS 42 16.890 9.417 2.817 337 HZ3 LYS 42 2HZ LYS 42 18.164 9.336 3.927 338 H SER 43 H SER 43 12.718 4.186 2.716 339 HA SER 43 HA SER 43 11.403 4.937 5.201 340 HG SER 43 HG SER 43 9.232 2.339 3.769 341 HB2 SER 43 1HB SER 43 9.274 4.246 4.647 342 HB3 SER 43 2HB SER 43 9.787 4.944 3.116 343 H THR 44 H THR 44 11.140 3.191 6.658 344 HA THR 44 HA THR 44 12.800 0.851 5.976 345 HB THR 44 HB THR 44 11.897 1.207 8.768 346 HG1 THR 44 HG1 THR 44 13.788 2.992 7.641 347 HG21 THR 44 3HG2 THR 44 13.601 -0.176 9.035 348 HG22 THR 44 1HG2 THR 44 14.676 1.159 8.627 349 HG23 THR 44 2HG2 THR 44 14.125 0.055 7.367 350 H ALA 45 H ALA 45 11.934 -1.101 5.762 351 HA ALA 45 HA ALA 45 9.063 -1.378 6.109 352 HB1 ALA 45 3HB ALA 45 11.037 -2.499 4.338 353 HB2 ALA 45 1HB ALA 45 9.283 -2.441 4.170 354 HB3 ALA 45 2HB ALA 45 10.042 -3.762 5.057 355 H ASN 46 H ASN 46 8.071 -2.522 7.567 356 HA ASN 46 HA ASN 46 9.647 -4.096 9.485 357 HB2 ASN 46 1HB ASN 46 7.057 -2.631 9.597 358 HB3 ASN 46 2HB ASN 46 7.169 -4.106 10.553 359 HD21 ASN 46 1HD2 ASN 46 7.119 -1.109 11.124 360 HD22 ASN 46 2HD2 ASN 46 8.411 -0.889 12.249 361 H ARG 47 H ARG 47 9.431 -6.349 9.554 362 HA ARG 47 HA ARG 47 7.674 -7.454 7.500 363 HE ARG 47 HE ARG 47 7.519 -9.260 6.105 364 HB2 ARG 47 1HB ARG 47 10.227 -8.261 8.727 365 HB3 ARG 47 2HB ARG 47 9.145 -9.570 8.270 366 HG2 ARG 47 1HG ARG 47 9.330 -7.578 6.188 367 HG3 ARG 47 2HG ARG 47 10.916 -8.210 6.620 368 HD2 ARG 47 1HD ARG 47 9.960 -9.542 4.857 369 HD3 ARG 47 2HD ARG 47 10.054 -10.498 6.333 370 HH11 ARG 47 1HH1 ARG 47 9.413 -11.882 4.800 371 HH12 ARG 47 2HH1 ARG 47 8.032 -12.841 4.389 372 HH21 ARG 47 1HH2 ARG 47 5.701 -10.520 5.567 373 HH22 ARG 47 2HH2 ARG 47 5.925 -12.068 4.824 374 H TRP 48 H TRP 48 6.008 -8.752 7.847 375 HA TRP 48 HA TRP 48 5.661 -10.283 10.251 376 HD1 TRP 48 HD1 TRP 48 4.864 -8.457 13.098 377 HE1 TRP 48 HE1 TRP 48 3.407 -9.875 14.675 378 HE3 TRP 48 HE3 TRP 48 1.799 -10.659 9.631 379 HZ2 TRP 48 HZ2 TRP 48 1.253 -11.685 14.480 380 HZ3 TRP 48 HZ3 TRP 48 0.072 -12.220 10.418 381 HH2 TRP 48 HH2 TRP 48 -0.195 -12.721 12.791 382 HB2 TRP 48 1HB TRP 48 4.728 -7.814 10.586 383 HB3 TRP 48 2HB TRP 48 3.374 -8.446 9.654 384 H GLY 49 H GLY 49 4.072 -11.946 9.923 385 HA2 GLY 49 1HA GLY 49 3.841 -13.291 7.698 386 HA3 GLY 49 2HA GLY 49 2.415 -13.091 8.704 387 H ASP 50 H ASP 50 4.103 -11.972 5.851 388 HA ASP 50 HA ASP 50 3.370 -11.045 3.914 389 HB2 ASP 50 1HB ASP 50 1.538 -12.573 3.857 390 HB3 ASP 50 2HB ASP 50 0.665 -11.679 5.096 391 H GLU 51 H GLU 51 1.721 -9.838 6.816 392 HA GLU 51 HA GLU 51 1.021 -7.319 5.811 393 HB2 GLU 51 1HB GLU 51 0.241 -8.455 7.967 394 HB3 GLU 51 2HB GLU 51 1.734 -7.869 8.686 395 HG2 GLU 51 1HG GLU 51 0.961 -5.558 7.824 396 HG3 GLU 51 2HG GLU 51 -0.625 -6.320 7.711 397 H ILE 52 H ILE 52 2.273 -5.725 5.159 398 HA ILE 52 HA ILE 52 4.839 -5.295 6.534 399 HB ILE 52 HB ILE 52 4.592 -6.127 3.868 400 HG12 ILE 52 1HG1 ILE 52 7.103 -5.524 3.857 401 HG13 ILE 52 2HG1 ILE 52 6.837 -4.991 5.513 402 HG21 ILE 52 1HG2 ILE 52 5.376 -3.223 3.969 403 HG22 ILE 52 2HG2 ILE 52 3.997 -3.920 3.119 404 HG23 ILE 52 3HG2 ILE 52 5.638 -4.292 2.594 405 HD11 ILE 52 3HD1 ILE 52 6.366 -7.775 4.455 406 HD12 ILE 52 1HD1 ILE 52 6.101 -7.243 6.117 407 HD13 ILE 52 2HD1 ILE 52 7.725 -7.244 5.438 408 H TYR 53 H TYR 53 4.733 -3.427 7.538 409 HA TYR 53 HA TYR 53 3.347 -1.190 6.204 410 HD1 TYR 53 HD2 TYR 53 4.311 0.013 10.067 411 HD2 TYR 53 HD1 TYR 53 2.685 -3.875 9.449 412 HE1 TYR 53 HE2 TYR 53 5.249 -0.718 12.217 413 HE2 TYR 53 HE1 TYR 53 3.621 -4.611 11.598 414 HH TYR 53 HH TYR 53 5.904 -2.768 13.340 415 HB2 TYR 53 1HB TYR 53 2.549 -0.393 8.380 416 HB3 TYR 53 2HB TYR 53 1.981 -2.033 8.071 417 H PHE 54 H PHE 54 4.509 0.574 5.919 418 HA PHE 54 HA PHE 54 6.777 1.102 7.698 419 HD1 PHE 54 HD2 PHE 54 6.761 3.539 4.691 420 HD2 PHE 54 HD1 PHE 54 6.959 -0.534 3.476 421 HE1 PHE 54 HE2 PHE 54 6.035 4.179 2.436 422 HE2 PHE 54 HE1 PHE 54 6.235 0.102 1.217 423 HZ PHE 54 HZ PHE 54 5.773 2.462 0.693 424 HB2 PHE 54 1HB PHE 54 8.249 1.608 5.868 425 HB3 PHE 54 2HB PHE 54 7.597 -0.001 5.611 426 H THR 55 H THR 55 7.276 3.273 8.014 427 HA THR 55 HA THR 55 5.120 5.119 7.268 428 HB THR 55 HB THR 55 7.401 6.004 8.972 429 HG1 THR 55 HG1 THR 55 6.588 4.902 10.751 430 HG21 THR 55 3HG2 THR 55 5.279 6.668 10.375 431 HG22 THR 55 1HG2 THR 55 4.482 6.497 8.810 432 HG23 THR 55 2HG2 THR 55 5.818 7.632 9.000 433 H THR 56 H THR 56 5.530 7.137 6.248 434 HA THR 56 HA THR 56 8.132 7.275 4.868 435 HB THR 56 HB THR 56 6.256 8.595 3.253 436 HG1 THR 56 HG1 THR 56 5.307 6.026 3.965 437 HG21 THR 56 3HG2 THR 56 6.607 6.060 2.159 438 HG22 THR 56 1HG2 THR 56 8.098 6.404 3.038 439 HG23 THR 56 2HG2 THR 56 7.525 7.521 1.798 440 H GLN 57 H GLN 57 6.424 8.733 7.175 441 HA GLN 57 HA GLN 57 6.811 10.729 8.237 442 HB2 GLN 57 1HB GLN 57 8.126 11.890 5.787 443 HB3 GLN 57 2HB GLN 57 8.348 12.335 7.475 444 HG2 GLN 57 1HG GLN 57 9.070 9.591 7.118 445 HG3 GLN 57 2HG GLN 57 9.899 10.583 5.919 446 HE21 GLN 57 1HE2 GLN 57 10.001 9.414 9.019 447 HE22 GLN 57 2HE2 GLN 57 11.176 10.493 9.683 448 H VAL 58 H VAL 58 5.069 10.244 5.406 449 HA VAL 58 HA VAL 58 3.965 12.932 5.312 450 HB VAL 58 HB VAL 58 4.263 11.712 3.198 451 HG11 VAL 58 1HG1 VAL 58 3.796 9.442 4.123 452 HG12 VAL 58 2HG1 VAL 58 2.961 9.796 2.607 453 HG13 VAL 58 3HG1 VAL 58 2.081 9.858 4.134 454 HG21 VAL 58 3HG2 VAL 58 1.860 11.976 2.375 455 HG22 VAL 58 1HG2 VAL 58 2.634 13.391 3.089 456 HG23 VAL 58 2HG2 VAL 58 1.476 12.452 4.030 457 H ALA 59 H ALA 59 2.472 13.528 6.738 458 HA ALA 59 HA ALA 59 0.752 11.450 7.907 459 HB1 ALA 59 3HB ALA 59 2.168 12.916 9.409 460 HB2 ALA 59 1HB ALA 59 0.453 12.802 9.806 461 HB3 ALA 59 2HB ALA 59 1.073 14.235 8.989 462 H VAL 60 H VAL 60 -0.873 11.256 6.455 463 HA VAL 60 HA VAL 60 -2.630 13.608 6.167 464 HB VAL 60 HB VAL 60 -1.570 13.214 4.015 465 HG11 VAL 60 1HG1 VAL 60 -0.938 11.187 3.375 466 HG12 VAL 60 2HG1 VAL 60 -2.625 10.710 3.208 467 HG13 VAL 60 3HG1 VAL 60 -1.787 10.468 4.740 468 HG21 VAL 60 3HG2 VAL 60 -4.457 12.392 4.187 469 HG22 VAL 60 1HG2 VAL 60 -3.629 12.628 2.648 470 HG23 VAL 60 2HG2 VAL 60 -3.786 13.971 3.779 471 H GLU 61 H GLU 61 -4.302 13.148 7.527 472 HA GLU 61 HA GLU 61 -5.525 10.479 7.261 473 HB2 GLU 61 1HB GLU 61 -4.438 11.770 9.615 474 HB3 GLU 61 2HB GLU 61 -6.135 11.366 9.839 475 HG2 GLU 61 1HG GLU 61 -5.719 9.064 9.385 476 HG3 GLU 61 2HG GLU 61 -4.063 9.405 8.886 477 H LYS 62 H LYS 62 -7.664 10.396 6.980 478 HA LYS 62 HA LYS 62 -9.303 12.735 7.592 479 HB2 LYS 62 1HB LYS 62 -8.681 13.047 5.258 480 HB3 LYS 62 2HB LYS 62 -9.179 11.407 4.875 481 HG2 LYS 62 1HG LYS 62 -11.479 11.944 5.270 482 HG3 LYS 62 2HG LYS 62 -11.046 13.544 5.875 483 HD2 LYS 62 1HD LYS 62 -10.521 14.343 3.770 484 HD3 LYS 62 2HD LYS 62 -10.227 12.729 3.120 485 HE2 LYS 62 1HE LYS 62 -12.270 12.832 2.242 486 HE3 LYS 62 2HE LYS 62 -12.889 12.674 3.885 487 HZ1 LYS 62 3HZ LYS 62 -13.557 14.677 2.340 488 HZ2 LYS 62 1HZ LYS 62 -12.135 15.347 2.972 489 HZ3 LYS 62 2HZ LYS 62 -13.384 14.871 4.011 490 H GLU 63 H GLU 63 -11.696 12.176 7.364 491 HA GLU 63 HA GLU 63 -12.080 9.415 8.284 492 HB2 GLU 63 1HB GLU 63 -14.219 10.239 9.248 493 HB3 GLU 63 2HB GLU 63 -12.797 11.026 9.912 494 HG2 GLU 63 1HG GLU 63 -14.285 12.298 7.656 495 HG3 GLU 63 2HG GLU 63 -14.892 12.421 9.305 496 H GLU 64 H GLU 64 -12.215 8.403 6.277 497 HA GLU 64 HA GLU 64 -14.808 8.307 5.141 498 HB2 GLU 64 1HB GLU 64 -14.575 10.090 3.764 499 HB3 GLU 64 2HB GLU 64 -12.824 10.090 3.898 500 HG2 GLU 64 1HG GLU 64 -12.613 8.438 2.200 501 HG3 GLU 64 2HG GLU 64 -14.351 8.143 2.189 502 H ASN 65 H ASN 65 -14.942 6.732 3.349 503 HA ASN 65 HA ASN 65 -14.479 4.720 2.403 504 HB2 ASN 65 1HB ASN 65 -12.565 5.882 1.404 505 HB3 ASN 65 2HB ASN 65 -11.601 5.574 2.849 506 HD21 ASN 65 1HD2 ASN 65 -11.721 4.710 -0.158 507 HD22 ASN 65 2HD2 ASN 65 -11.346 3.025 -0.071 508 H SER 66 H SER 66 -11.636 4.722 4.459 509 HA SER 66 HA SER 66 -10.874 3.002 5.827 510 HG SER 66 HG SER 66 -11.572 5.250 8.356 511 HB2 SER 66 1HB SER 66 -13.237 4.318 7.133 512 HB3 SER 66 2HB SER 66 -12.314 3.077 7.979 513 H LYS 67 H LYS 67 -11.307 1.103 4.467 514 HA LYS 67 HA LYS 67 -13.738 -0.371 5.233 515 HB2 LYS 67 1HB LYS 67 -13.108 -1.969 3.391 516 HB3 LYS 67 2HB LYS 67 -13.542 -0.357 2.856 517 HG2 LYS 67 1HG LYS 67 -11.717 -0.867 1.556 518 HG3 LYS 67 2HG LYS 67 -10.992 0.077 2.853 519 HD2 LYS 67 1HD LYS 67 -10.510 -2.140 3.997 520 HD3 LYS 67 2HD LYS 67 -10.982 -2.912 2.487 521 HE2 LYS 67 1HE LYS 67 -9.224 -1.778 1.304 522 HE3 LYS 67 2HE LYS 67 -8.811 -0.840 2.737 523 HZ1 LYS 67 3HZ LYS 67 -8.733 -3.605 3.328 524 HZ2 LYS 67 1HZ LYS 67 -7.491 -2.464 3.424 525 HZ3 LYS 67 2HZ LYS 67 -7.767 -3.287 1.977 526 H ASP 68 H ASP 68 -13.557 -2.668 5.791 527 HA ASP 68 HA ASP 68 -10.994 -3.220 7.158 528 HB2 ASP 68 1HB ASP 68 -12.427 -4.593 8.750 529 HB3 ASP 68 2HB ASP 68 -12.599 -2.842 8.849 530 H VAL 69 H VAL 69 -12.978 -4.316 4.665 531 HA VAL 69 HA VAL 69 -11.712 -6.971 4.845 532 HB VAL 69 HB VAL 69 -14.199 -6.996 5.371 533 HG11 VAL 69 1HG1 VAL 69 -15.718 -6.224 3.938 534 HG12 VAL 69 2HG1 VAL 69 -14.991 -7.096 2.590 535 HG13 VAL 69 3HG1 VAL 69 -14.387 -5.501 3.036 536 HG21 VAL 69 3HG2 VAL 69 -13.288 -9.074 4.928 537 HG22 VAL 69 1HG2 VAL 69 -12.881 -8.656 3.263 538 HG23 VAL 69 2HG2 VAL 69 -14.559 -8.960 3.711 539 H VAL 70 H VAL 70 -10.991 -7.893 2.952 540 HA VAL 70 HA VAL 70 -11.529 -6.669 0.394 541 HB VAL 70 HB VAL 70 -9.206 -6.142 -0.158 542 HG11 VAL 70 1HG1 VAL 70 -9.102 -4.047 0.909 543 HG12 VAL 70 2HG1 VAL 70 -9.971 -4.645 2.323 544 HG13 VAL 70 3HG1 VAL 70 -10.811 -4.456 0.785 545 HG21 VAL 70 3HG2 VAL 70 -7.427 -6.118 1.402 546 HG22 VAL 70 1HG2 VAL 70 -8.187 -7.702 1.572 547 HG23 VAL 70 2HG2 VAL 70 -8.508 -6.433 2.756 548 H GLU 71 H GLU 71 -10.605 -7.846 -1.408 549 HA GLU 71 HA GLU 71 -10.154 -10.658 -0.696 550 HB2 GLU 71 1HB GLU 71 -10.660 -9.724 -3.509 551 HB3 GLU 71 2HB GLU 71 -10.981 -11.291 -2.783 552 HG2 GLU 71 1HG GLU 71 -12.886 -10.560 -1.704 553 HG3 GLU 71 2HG GLU 71 -12.432 -8.863 -1.840 554 H LEU 72 H LEU 72 -8.540 -11.882 -1.591 555 HA LEU 72 HA LEU 72 -5.988 -11.004 -1.563 556 HG LEU 72 HG LEU 72 -4.553 -12.319 -3.606 557 HB2 LEU 72 1HB LEU 72 -6.497 -13.352 -1.676 558 HB3 LEU 72 2HB LEU 72 -7.172 -13.187 -3.283 559 HD11 LEU 72 1HD1 LEU 72 -4.514 -14.812 -1.920 560 HD12 LEU 72 2HD1 LEU 72 -4.118 -13.208 -1.302 561 HD13 LEU 72 3HD1 LEU 72 -3.136 -13.929 -2.579 562 HD21 LEU 72 3HD2 LEU 72 -5.987 -14.896 -4.145 563 HD22 LEU 72 1HD2 LEU 72 -4.303 -14.665 -4.612 564 HD23 LEU 72 2HD2 LEU 72 -5.552 -13.610 -5.269 565 H GLY 73 H GLY 73 -4.698 -9.717 -2.757 566 HA2 GLY 73 1HA GLY 73 -3.790 -9.238 -4.991 567 HA3 GLY 73 2HA GLY 73 -5.440 -9.277 -5.587 568 H ASP 74 H ASP 74 -6.487 -7.655 -3.352 569 HA ASP 74 HA ASP 74 -5.899 -5.099 -4.525 570 HB2 ASP 74 1HB ASP 74 -7.522 -4.300 -2.665 571 HB3 ASP 74 2HB ASP 74 -8.148 -5.290 -3.980 572 H VAL 75 H VAL 75 -5.301 -3.195 -3.348 573 HA VAL 75 HA VAL 75 -3.417 -3.746 -1.128 574 HB VAL 75 HB VAL 75 -3.231 -1.453 -3.112 575 HG11 VAL 75 1HG1 VAL 75 -1.059 -2.519 -1.324 576 HG12 VAL 75 2HG1 VAL 75 -2.143 -1.212 -0.841 577 HG13 VAL 75 3HG1 VAL 75 -1.091 -1.015 -2.241 578 HG21 VAL 75 3HG2 VAL 75 -2.730 -4.154 -3.623 579 HG22 VAL 75 1HG2 VAL 75 -1.145 -3.424 -3.371 580 HG23 VAL 75 2HG2 VAL 75 -2.232 -2.771 -4.596 581 H ALA 76 H ALA 76 -3.286 -2.065 0.602 582 HA ALA 76 HA ALA 76 -5.342 -0.005 0.522 583 HB1 ALA 76 3HB ALA 76 -6.654 -1.733 1.419 584 HB2 ALA 76 1HB ALA 76 -6.173 -0.755 2.803 585 HB3 ALA 76 2HB ALA 76 -5.356 -2.279 2.478 586 H TYR 77 H TYR 77 -5.110 1.673 2.046 587 HA TYR 77 HA TYR 77 -2.454 1.752 3.321 588 HD1 TYR 77 HD1 TYR 77 -1.749 4.945 4.319 589 HD2 TYR 77 HD2 TYR 77 -5.550 4.963 2.407 590 HE1 TYR 77 HE1 TYR 77 -2.374 6.953 5.591 591 HE2 TYR 77 HE2 TYR 77 -6.186 6.967 3.680 592 HH TYR 77 HH TYR 77 -5.099 8.833 4.839 593 HB2 TYR 77 1HB TYR 77 -2.162 3.680 2.227 594 HB3 TYR 77 2HB TYR 77 -3.784 3.577 1.562 595 H TRP 78 H TRP 78 -2.296 2.060 5.463 596 HA TRP 78 HA TRP 78 -4.653 1.872 7.076 597 HD1 TRP 78 HD1 TRP 78 -5.448 1.474 8.834 598 HE1 TRP 78 HE1 TRP 78 -5.705 0.468 11.185 599 HE3 TRP 78 HE3 TRP 78 -0.507 0.910 10.014 600 HZ2 TRP 78 HZ2 TRP 78 -4.032 -0.461 13.263 601 HZ3 TRP 78 HZ3 TRP 78 0.080 -0.049 12.203 602 HH2 TRP 78 HH2 TRP 78 -1.647 -0.719 13.792 603 HB2 TRP 78 1HB TRP 78 -2.181 1.020 7.494 604 HB3 TRP 78 2HB TRP 78 -2.005 2.595 8.258 605 H ILE 79 H ILE 79 -5.579 3.392 8.454 606 HA ILE 79 HA ILE 79 -4.990 6.168 7.759 607 HB ILE 79 HB ILE 79 -7.276 5.282 9.503 608 HG12 ILE 79 1HG1 ILE 79 -6.881 4.530 6.798 609 HG13 ILE 79 2HG1 ILE 79 -8.328 4.323 7.776 610 HG21 ILE 79 1HG2 ILE 79 -6.690 7.723 7.859 611 HG22 ILE 79 2HG2 ILE 79 -6.958 7.607 9.599 612 HG23 ILE 79 3HG2 ILE 79 -8.298 7.355 8.480 613 HD11 ILE 79 3HD1 ILE 79 -8.966 5.429 5.796 614 HD12 ILE 79 1HD1 ILE 79 -7.662 6.604 5.942 615 HD13 ILE 79 2HD1 ILE 79 -9.009 6.630 7.080 616 HA PRO 80 HA PRO 80 -4.629 6.376 12.553 617 HB2 PRO 80 1HB PRO 80 -4.523 3.620 13.522 618 HB3 PRO 80 2HB PRO 80 -5.594 4.932 14.015 619 HG2 PRO 80 1HG PRO 80 -6.480 2.788 12.633 620 HG3 PRO 80 2HG PRO 80 -7.187 4.405 12.440 621 HD2 PRO 80 1HD PRO 80 -5.182 2.998 10.714 622 HD3 PRO 80 2HD PRO 80 -6.615 3.922 10.231 623 H GLY 81 H GLY 81 -2.593 6.725 11.204 624 HA2 GLY 81 1HA GLY 81 -0.301 6.425 12.407 625 HA3 GLY 81 2HA GLY 81 -0.479 4.778 11.815 626 H LYS 82 H LYS 82 -1.954 6.453 9.471 627 HA LYS 82 HA LYS 82 -1.362 6.978 7.309 628 HB2 LYS 82 1HB LYS 82 1.185 8.229 8.191 629 HB3 LYS 82 2HB LYS 82 -0.049 8.836 7.098 630 HG2 LYS 82 1HG LYS 82 -0.622 10.215 8.746 631 HG3 LYS 82 2HG LYS 82 -1.334 8.812 9.541 632 HD2 LYS 82 1HD LYS 82 1.062 8.423 10.448 633 HD3 LYS 82 2HD LYS 82 1.316 10.116 10.020 634 HE2 LYS 82 1HE LYS 82 -1.018 9.241 11.693 635 HE3 LYS 82 2HE LYS 82 0.556 9.581 12.409 636 HZ1 LYS 82 3HZ LYS 82 0.451 11.811 11.706 637 HZ2 LYS 82 1HZ LYS 82 -1.069 11.475 12.371 638 HZ3 LYS 82 2HZ LYS 82 -0.874 11.527 10.692 639 H ALA 83 H ALA 83 -0.469 4.438 8.293 640 HA ALA 83 HA ALA 83 2.073 4.099 6.850 641 HB1 ALA 83 3HB ALA 83 1.661 1.730 8.153 642 HB2 ALA 83 1HB ALA 83 0.955 2.899 9.270 643 HB3 ALA 83 2HB ALA 83 2.635 3.071 8.758 644 H ILE 84 H ILE 84 2.146 2.938 5.027 645 HA ILE 84 HA ILE 84 -0.341 1.815 3.994 646 HB ILE 84 HB ILE 84 2.264 1.756 2.514 647 HG12 ILE 84 1HG1 ILE 84 0.410 4.136 2.736 648 HG13 ILE 84 2HG1 ILE 84 2.060 4.051 3.340 649 HG21 ILE 84 1HG2 ILE 84 0.889 1.818 0.566 650 HG22 ILE 84 2HG2 ILE 84 -0.546 2.176 1.526 651 HG23 ILE 84 3HG2 ILE 84 0.230 0.599 1.656 652 HD11 ILE 84 3HD1 ILE 84 2.855 4.702 1.379 653 HD12 ILE 84 1HD1 ILE 84 1.193 4.939 0.836 654 HD13 ILE 84 2HD1 ILE 84 2.003 3.398 0.550 655 H CYS 85 H CYS 85 -0.521 -0.369 3.242 656 HA CYS 85 HA CYS 85 1.615 -2.179 4.064 657 HG CYS 85 HG CYS 85 -0.866 -4.725 5.729 658 HB2 CYS 85 1HB CYS 85 0.181 -2.139 5.992 659 HB3 CYS 85 2HB CYS 85 -1.247 -2.390 4.993 660 H LEU 86 H LEU 86 1.508 -4.295 3.184 661 HA LEU 86 HA LEU 86 0.027 -4.416 0.633 662 HG LEU 86 HG LEU 86 1.430 -4.161 -0.996 663 HB2 LEU 86 1HB LEU 86 2.766 -4.872 1.283 664 HB3 LEU 86 2HB LEU 86 2.080 -6.408 0.790 665 HD11 LEU 86 1HD1 LEU 86 3.875 -3.853 -0.146 666 HD12 LEU 86 2HD1 LEU 86 3.525 -3.761 -1.872 667 HD13 LEU 86 3HD1 LEU 86 4.210 -5.236 -1.188 668 HD21 LEU 86 3HD2 LEU 86 0.794 -6.327 -1.679 669 HD22 LEU 86 1HD2 LEU 86 2.375 -7.003 -1.280 670 HD23 LEU 86 2HD2 LEU 86 2.202 -5.913 -2.657 671 H PHE 87 H PHE 87 -0.644 -6.604 -0.070 672 HA PHE 87 HA PHE 87 -1.114 -8.470 2.142 673 HD1 PHE 87 HD2 PHE 87 -2.921 -7.547 3.874 674 HD2 PHE 87 HD1 PHE 87 -3.745 -5.472 0.260 675 HE1 PHE 87 HE2 PHE 87 -3.494 -5.537 5.167 676 HE2 PHE 87 HE1 PHE 87 -4.325 -3.462 1.542 677 HZ PHE 87 HZ PHE 87 -4.201 -3.486 4.001 678 HB2 PHE 87 1HB PHE 87 -3.287 -7.733 0.181 679 HB3 PHE 87 2HB PHE 87 -3.435 -8.713 1.636 680 H PHE 88 H PHE 88 -1.100 -10.606 1.584 681 HA PHE 88 HA PHE 88 -1.489 -11.748 -0.904 682 HD1 PHE 88 HD1 PHE 88 -0.545 -9.786 -2.939 683 HD2 PHE 88 HD2 PHE 88 1.436 -13.504 -2.372 684 HE1 PHE 88 HE1 PHE 88 -0.789 -10.275 -5.340 685 HE2 PHE 88 HE2 PHE 88 1.199 -14.005 -4.771 686 HZ PHE 88 HZ PHE 88 0.085 -12.387 -6.260 687 HB2 PHE 88 1HB PHE 88 0.859 -10.263 -0.940 688 HB3 PHE 88 2HB PHE 88 1.421 -11.905 -0.652 689 H GLY 89 H GLY 89 -2.073 -12.440 1.727 690 HA2 GLY 89 1HA GLY 89 -1.583 -15.124 1.848 691 HA3 GLY 89 2HA GLY 89 -0.203 -14.420 2.674 692 H LYS 90 H LYS 90 -0.603 -13.145 4.591 693 HA LYS 90 HA LYS 90 -3.236 -13.423 5.795 694 HB2 LYS 90 1HB LYS 90 -1.847 -14.139 7.963 695 HB3 LYS 90 2HB LYS 90 -2.532 -15.302 6.847 696 HG2 LYS 90 1HG LYS 90 -0.159 -15.675 7.644 697 HG3 LYS 90 2HG LYS 90 -0.458 -15.802 5.909 698 HD2 LYS 90 1HD LYS 90 0.198 -13.145 6.263 699 HD3 LYS 90 2HD LYS 90 1.247 -13.978 7.405 700 HE2 LYS 90 1HE LYS 90 0.997 -14.557 4.456 701 HE3 LYS 90 2HE LYS 90 2.347 -13.747 5.252 702 HZ1 LYS 90 3HZ LYS 90 2.346 -15.963 6.639 703 HZ2 LYS 90 1HZ LYS 90 3.151 -15.854 5.155 704 HZ3 LYS 90 2HZ LYS 90 1.626 -16.581 5.240 705 H THR 91 H THR 91 -2.694 -12.611 8.345 706 HA THR 91 HA THR 91 -1.028 -10.285 8.422 707 HB THR 91 HB THR 91 -3.604 -9.238 9.045 708 HG1 THR 91 HG1 THR 91 -3.517 -10.190 6.388 709 HG21 THR 91 3HG2 THR 91 -3.148 -7.608 7.354 710 HG22 THR 91 1HG2 THR 91 -1.911 -8.639 6.634 711 HG23 THR 91 2HG2 THR 91 -1.658 -7.945 8.235 712 HA PRO 92 HA PRO 92 -1.227 -10.385 12.868 713 HB2 PRO 92 1HB PRO 92 -3.462 -8.389 12.906 714 HB3 PRO 92 2HB PRO 92 -2.013 -8.467 13.915 715 HG2 PRO 92 1HG PRO 92 -2.133 -6.770 11.875 716 HG3 PRO 92 2HG PRO 92 -0.635 -7.650 12.233 717 HD2 PRO 92 1HD PRO 92 -2.583 -8.048 10.032 718 HD3 PRO 92 2HD PRO 92 -0.840 -8.372 10.066 719 H ILE 93 H ILE 93 -4.311 -10.475 11.184 720 HA ILE 93 HA ILE 93 -5.222 -12.513 13.099 721 HB ILE 93 HB ILE 93 -7.087 -10.519 11.822 722 HG12 ILE 93 1HG1 ILE 93 -7.123 -9.873 14.456 723 HG13 ILE 93 2HG1 ILE 93 -5.430 -10.317 14.263 724 HG21 ILE 93 1HG2 ILE 93 -8.725 -11.370 13.324 725 HG22 ILE 93 2HG2 ILE 93 -7.520 -12.315 14.197 726 HG23 ILE 93 3HG2 ILE 93 -7.959 -12.754 12.547 727 HD11 ILE 93 3HD1 ILE 93 -5.578 -7.989 13.918 728 HD12 ILE 93 1HD1 ILE 93 -6.948 -8.167 12.822 729 HD13 ILE 93 2HD1 ILE 93 -5.347 -8.718 12.328 730 H SER 94 H SER 94 -4.282 -13.905 11.406 731 HA SER 94 HA SER 94 -5.861 -14.107 8.946 732 HG SER 94 HG SER 94 -2.851 -15.220 10.668 733 HB2 SER 94 1HB SER 94 -3.918 -16.099 8.890 734 HB3 SER 94 2HB SER 94 -3.837 -14.525 8.103 735 H ASP 95 H ASP 95 -6.866 -14.893 11.643 736 HA ASP 95 HA ASP 95 -6.877 -17.656 12.004 737 HB2 ASP 95 1HB ASP 95 -8.910 -15.546 12.729 738 HB3 ASP 95 2HB ASP 95 -9.075 -17.233 13.210 739 H ASP 96 H ASP 96 -9.880 -16.038 11.051 740 HA ASP 96 HA ASP 96 -10.562 -18.341 9.413 741 HB2 ASP 96 1HB ASP 96 -12.789 -17.236 9.240 742 HB3 ASP 96 2HB ASP 96 -12.281 -17.518 10.903 743 H LYS 97 H LYS 97 -10.167 -14.839 9.035 744 HA LYS 97 HA LYS 97 -9.581 -15.267 6.204 745 HB2 LYS 97 1HB LYS 97 -11.629 -13.314 7.261 746 HB3 LYS 97 2HB LYS 97 -10.972 -13.251 5.631 747 HG2 LYS 97 1HG LYS 97 -12.146 -15.817 6.540 748 HG3 LYS 97 2HG LYS 97 -13.245 -14.481 6.193 749 HD2 LYS 97 1HD LYS 97 -13.088 -15.566 4.146 750 HD3 LYS 97 2HD LYS 97 -11.911 -14.262 3.990 751 HE2 LYS 97 1HE LYS 97 -10.100 -15.698 4.234 752 HE3 LYS 97 2HE LYS 97 -11.075 -16.954 4.997 753 HZ1 LYS 97 3HZ LYS 97 -10.317 -17.035 2.457 754 HZ2 LYS 97 1HZ LYS 97 -11.806 -16.253 2.275 755 HZ3 LYS 97 2HZ LYS 97 -11.734 -17.767 3.021 756 H ILE 98 H ILE 98 -8.754 -13.152 5.208 757 HA ILE 98 HA ILE 98 -6.597 -12.217 6.860 758 HB ILE 98 HB ILE 98 -7.454 -11.379 4.086 759 HG12 ILE 98 1HG1 ILE 98 -4.952 -12.893 4.772 760 HG13 ILE 98 2HG1 ILE 98 -6.488 -13.751 4.629 761 HG21 ILE 98 1HG2 ILE 98 -4.742 -10.743 4.542 762 HG22 ILE 98 2HG2 ILE 98 -5.665 -10.083 5.890 763 HG23 ILE 98 3HG2 ILE 98 -6.085 -9.643 4.236 764 HD11 ILE 98 3HD1 ILE 98 -6.530 -13.557 2.393 765 HD12 ILE 98 1HD1 ILE 98 -4.791 -13.334 2.588 766 HD13 ILE 98 2HD1 ILE 98 -5.848 -11.929 2.411 767 H ARG 99 H ARG 99 -7.273 -10.944 8.525 768 HA ARG 99 HA ARG 99 -8.965 -8.631 7.886 769 HE ARG 99 HE ARG 99 -12.280 -9.030 9.613 770 HB2 ARG 99 1HB ARG 99 -8.080 -9.359 10.663 771 HB3 ARG 99 2HB ARG 99 -9.514 -8.480 10.159 772 HG2 ARG 99 1HG ARG 99 -9.053 -11.416 9.680 773 HG3 ARG 99 2HG ARG 99 -9.996 -10.745 11.012 774 HD2 ARG 99 1HD ARG 99 -10.669 -9.905 8.239 775 HD3 ARG 99 2HD ARG 99 -11.135 -11.525 8.757 776 HH11 ARG 99 1HH1 ARG 99 -11.772 -12.381 10.443 777 HH12 ARG 99 2HH1 ARG 99 -13.129 -12.452 11.516 778 HH21 ARG 99 1HH2 ARG 99 -14.066 -9.120 11.025 779 HH22 ARG 99 2HH2 ARG 99 -14.431 -10.600 11.846 780 HA PRO 100 HA PRO 100 -4.867 -6.659 7.812 781 HB2 PRO 100 1HB PRO 100 -5.668 -4.444 6.461 782 HB3 PRO 100 2HB PRO 100 -5.320 -5.984 5.668 783 HG2 PRO 100 1HG PRO 100 -7.967 -4.839 6.472 784 HG3 PRO 100 2HG PRO 100 -7.504 -5.623 4.947 785 HD2 PRO 100 1HD PRO 100 -8.848 -6.929 6.885 786 HD3 PRO 100 2HD PRO 100 -7.658 -7.740 5.847 787 H ALA 101 H ALA 101 -7.949 -5.250 8.799 788 HA ALA 101 HA ALA 101 -6.991 -4.267 11.246 789 HB1 ALA 101 3HB ALA 101 -5.969 -2.708 9.265 790 HB2 ALA 101 1HB ALA 101 -6.258 -2.170 10.920 791 HB3 ALA 101 2HB ALA 101 -7.448 -1.835 9.662 792 H SER 102 H SER 102 -8.546 -1.965 11.555 793 HA SER 102 HA SER 102 -11.244 -3.075 11.210 794 HG SER 102 HG SER 102 -9.454 -3.246 13.466 795 HB2 SER 102 1HB SER 102 -11.000 -0.895 13.145 796 HB3 SER 102 2HB SER 102 -11.712 -2.497 13.335 797 H ALA 103 H ALA 103 -9.221 -0.619 10.074 798 HA ALA 103 HA ALA 103 -11.382 0.599 8.649 799 HB1 ALA 103 3HB ALA 103 -11.712 1.716 10.766 800 HB2 ALA 103 1HB ALA 103 -11.122 2.863 9.563 801 HB3 ALA 103 2HB ALA 103 -10.024 2.226 10.788 802 H VAL 104 H VAL 104 -9.740 -0.303 7.083 803 HA VAL 104 HA VAL 104 -7.723 1.781 6.520 804 HB VAL 104 HB VAL 104 -6.242 0.160 5.504 805 HG11 VAL 104 1HG1 VAL 104 -6.462 -1.417 7.849 806 HG12 VAL 104 2HG1 VAL 104 -6.900 0.241 8.261 807 HG13 VAL 104 3HG1 VAL 104 -5.343 -0.100 7.506 808 HG21 VAL 104 3HG2 VAL 104 -6.668 -2.080 5.195 809 HG22 VAL 104 1HG2 VAL 104 -8.257 -1.385 4.886 810 HG23 VAL 104 2HG2 VAL 104 -7.908 -2.132 6.444 811 H ASN 105 H ASN 105 -7.518 2.545 4.468 812 HA ASN 105 HA ASN 105 -9.793 2.133 2.726 813 HB2 ASN 105 1HB ASN 105 -7.403 3.949 2.324 814 HB3 ASN 105 2HB ASN 105 -8.938 4.034 1.472 815 HD21 ASN 105 1HD2 ASN 105 -7.770 6.144 2.867 816 HD22 ASN 105 2HD2 ASN 105 -8.812 6.563 4.177 817 H VAL 106 H VAL 106 -9.706 1.602 0.512 818 HA VAL 106 HA VAL 106 -7.587 -0.262 -0.203 819 HB VAL 106 HB VAL 106 -9.256 -0.067 -2.413 820 HG11 VAL 106 1HG1 VAL 106 -10.023 -2.105 -0.451 821 HG12 VAL 106 2HG1 VAL 106 -8.296 -2.016 -0.807 822 HG13 VAL 106 3HG1 VAL 106 -9.456 -2.274 -2.111 823 HG21 VAL 106 3HG2 VAL 106 -10.906 1.253 -1.290 824 HG22 VAL 106 1HG2 VAL 106 -10.921 0.147 0.086 825 HG23 VAL 106 2HG2 VAL 106 -11.539 -0.384 -1.479 826 H ILE 107 H ILE 107 -5.819 0.929 -0.740 827 HA ILE 107 HA ILE 107 -6.029 3.300 -2.358 828 HB ILE 107 HB ILE 107 -4.416 2.961 -0.444 829 HG12 ILE 107 1HG1 ILE 107 -3.812 4.070 -3.132 830 HG13 ILE 107 2HG1 ILE 107 -3.909 4.885 -1.577 831 HG21 ILE 107 1HG2 ILE 107 -3.663 0.713 -1.074 832 HG22 ILE 107 2HG2 ILE 107 -2.311 1.833 -0.922 833 HG23 ILE 107 3HG2 ILE 107 -2.902 1.379 -2.519 834 HD11 ILE 107 3HD1 ILE 107 -1.661 4.937 -2.500 835 HD12 ILE 107 1HD1 ILE 107 -1.632 3.174 -2.530 836 HD13 ILE 107 2HD1 ILE 107 -1.716 4.027 -0.989 837 H GLY 108 H GLY 108 -6.702 0.587 -3.510 838 HA2 GLY 108 1HA GLY 108 -6.613 0.286 -5.917 839 HA3 GLY 108 2HA GLY 108 -4.942 0.820 -5.863 840 H ARG 109 H ARG 109 -4.479 -1.140 -7.082 841 HA ARG 109 HA ARG 109 -4.000 -3.382 -5.275 842 HE ARG 109 HE ARG 109 -8.512 -2.513 -9.091 843 HB2 ARG 109 1HB ARG 109 -4.882 -4.216 -7.956 844 HB3 ARG 109 2HB ARG 109 -5.235 -4.918 -6.385 845 HG2 ARG 109 1HG ARG 109 -7.292 -4.179 -7.229 846 HG3 ARG 109 2HG ARG 109 -6.826 -2.981 -6.026 847 HD2 ARG 109 1HD ARG 109 -7.122 -1.425 -7.584 848 HD3 ARG 109 2HD ARG 109 -5.713 -2.078 -8.416 849 HH11 ARG 109 1HH1 ARG 109 -5.169 -3.346 -9.686 850 HH12 ARG 109 2HH1 ARG 109 -5.493 -4.039 -11.238 851 HH21 ARG 109 1HH2 ARG 109 -8.930 -3.425 -11.130 852 HH22 ARG 109 2HH2 ARG 109 -7.623 -4.085 -12.059 853 H ILE 110 H ILE 110 -2.601 -5.072 -6.331 854 HA ILE 110 HA ILE 110 -0.389 -3.729 -7.681 855 HB ILE 110 HB ILE 110 -0.545 -6.535 -6.563 856 HG12 ILE 110 1HG1 ILE 110 1.220 -4.958 -5.040 857 HG13 ILE 110 2HG1 ILE 110 -0.211 -3.963 -5.269 858 HG21 ILE 110 1HG2 ILE 110 1.150 -6.282 -8.304 859 HG22 ILE 110 2HG2 ILE 110 1.885 -6.531 -6.721 860 HG23 ILE 110 3HG2 ILE 110 1.847 -4.917 -7.431 861 HD11 ILE 110 3HD1 ILE 110 -0.350 -5.231 -3.213 862 HD12 ILE 110 1HD1 ILE 110 -0.150 -6.740 -4.102 863 HD13 ILE 110 2HD1 ILE 110 -1.596 -5.756 -4.342 864 H VAL 111 H VAL 111 -0.332 -3.762 -9.848 865 HA VAL 111 HA VAL 111 -1.715 -5.906 -11.274 866 HB VAL 111 HB VAL 111 -0.845 -4.358 -13.296 867 HG11 VAL 111 1HG1 VAL 111 -3.292 -4.597 -11.744 868 HG12 VAL 111 2HG1 VAL 111 -3.057 -4.542 -13.489 869 HG13 VAL 111 3HG1 VAL 111 -3.150 -3.043 -12.564 870 HG21 VAL 111 3HG2 VAL 111 -1.473 -2.277 -11.240 871 HG22 VAL 111 1HG2 VAL 111 -0.696 -2.097 -12.812 872 HG23 VAL 111 2HG2 VAL 111 0.185 -2.828 -11.471 873 H ASN 112 H ASN 112 1.155 -4.191 -12.440 874 HA ASN 112 HA ASN 112 2.314 -6.725 -13.228 875 HB2 ASN 112 1HB ASN 112 3.991 -5.372 -14.381 876 HB3 ASN 112 2HB ASN 112 2.371 -4.806 -14.769 877 HD21 ASN 112 1HD2 ASN 112 4.884 -3.390 -14.949 878 HD22 ASN 112 2HD2 ASN 112 4.735 -1.996 -13.939 879 H SER 113 H SER 113 4.963 -6.450 -13.039 880 HA SER 113 HA SER 113 6.746 -6.738 -11.660 881 HG SER 113 HG SER 113 7.417 -3.714 -10.902 882 HB2 SER 113 1HB SER 113 5.226 -4.737 -9.975 883 HB3 SER 113 2HB SER 113 6.864 -5.282 -9.619 884 H MET 114 H MET 114 7.436 -7.735 -9.624 885 HA MET 114 HA MET 114 5.925 -9.963 -8.945 886 HB2 MET 114 1HB MET 114 8.431 -9.439 -8.535 887 HB3 MET 114 2HB MET 114 7.880 -8.741 -7.019 888 HG2 MET 114 1HG MET 114 6.636 -11.126 -6.926 889 HG3 MET 114 2HG MET 114 8.074 -11.552 -7.852 890 HE1 MET 114 3HE MET 114 9.726 -12.945 -5.093 891 HE2 MET 114 1HE MET 114 8.423 -13.194 -6.257 892 HE3 MET 114 2HE MET 114 8.048 -12.953 -4.551 893 H GLU 115 H GLU 115 3.949 -9.906 -8.086 894 HA GLU 115 HA GLU 115 3.251 -7.858 -6.137 895 HB2 GLU 115 1HB GLU 115 0.959 -8.796 -6.345 896 HB3 GLU 115 2HB GLU 115 1.637 -8.264 -7.878 897 HG2 GLU 115 1HG GLU 115 2.142 -11.076 -7.276 898 HG3 GLU 115 2HG GLU 115 0.432 -10.668 -7.422 899 H GLY 116 H GLY 116 5.029 -10.341 -5.649 900 HA2 GLY 116 1HA GLY 116 3.503 -11.420 -3.367 901 HA3 GLY 116 2HA GLY 116 4.788 -12.283 -4.200 902 H LEU 117 H LEU 117 4.710 -8.929 -3.048 903 HA LEU 117 HA LEU 117 7.291 -8.816 -2.116 904 HG LEU 117 HG LEU 117 7.157 -7.428 0.325 905 HB2 LEU 117 1HB LEU 117 6.012 -6.808 -2.295 906 HB3 LEU 117 2HB LEU 117 4.821 -7.386 -1.146 907 HD11 LEU 117 1HD1 LEU 117 8.237 -5.304 0.044 908 HD12 LEU 117 2HD1 LEU 117 7.149 -4.879 -1.275 909 HD13 LEU 117 3HD1 LEU 117 8.309 -6.193 -1.477 910 HD21 LEU 117 3HD2 LEU 117 5.520 -4.961 0.385 911 HD22 LEU 117 1HD2 LEU 117 6.052 -6.004 1.702 912 HD23 LEU 117 2HD2 LEU 117 4.703 -6.497 0.680 913 H LYS 118 H LYS 118 4.492 -10.208 -0.577 914 HA LYS 118 HA LYS 118 5.081 -10.338 2.061 915 HB2 LYS 118 1HB LYS 118 4.093 -12.683 2.040 916 HB3 LYS 118 2HB LYS 118 3.099 -11.403 1.361 917 HG2 LYS 118 1HG LYS 118 2.851 -13.142 -0.147 918 HG3 LYS 118 2HG LYS 118 4.083 -12.134 -0.905 919 HD2 LYS 118 1HD LYS 118 5.457 -13.881 -0.960 920 HD3 LYS 118 2HD LYS 118 5.416 -13.959 0.803 921 HE2 LYS 118 1HE LYS 118 4.777 -16.090 -0.246 922 HE3 LYS 118 2HE LYS 118 3.479 -15.403 0.731 923 HZ1 LYS 118 3HZ LYS 118 3.530 -14.749 -2.119 924 HZ2 LYS 118 1HZ LYS 118 2.209 -14.979 -1.087 925 HZ3 LYS 118 2HZ LYS 118 3.057 -16.314 -1.687 926 H GLY 119 H GLY 119 6.872 -11.950 -0.469 927 HA2 GLY 119 1HA GLY 119 8.291 -13.671 1.379 928 HA3 GLY 119 2HA GLY 119 8.571 -13.539 -0.348 929 H VAL 120 H VAL 120 8.542 -10.738 1.771 930 HA VAL 120 HA VAL 120 11.234 -10.082 0.965 931 HB VAL 120 HB VAL 120 10.878 -8.078 2.501 932 HG11 VAL 120 1HG1 VAL 120 9.418 -8.683 -0.004 933 HG12 VAL 120 2HG1 VAL 120 10.648 -7.468 0.330 934 HG13 VAL 120 3HG1 VAL 120 8.989 -7.206 0.860 935 HG21 VAL 120 3HG2 VAL 120 8.668 -9.582 3.333 936 HG22 VAL 120 1HG2 VAL 120 8.011 -8.214 2.433 937 HG23 VAL 120 2HG2 VAL 120 9.088 -7.935 3.799 938 H ALA 121 H ALA 121 12.986 -9.627 2.458 939 HA ALA 121 HA ALA 121 13.148 -11.560 4.589 940 HB1 ALA 121 3HB ALA 121 15.051 -10.921 3.035 941 HB2 ALA 121 1HB ALA 121 15.439 -10.976 4.753 942 HB3 ALA 121 2HB ALA 121 15.178 -9.424 3.959 943 H ASP 122 H ASP 122 13.387 -11.103 6.823 944 HA ASP 122 HA ASP 122 11.768 -9.108 7.847 945 HB2 ASP 122 1HB ASP 122 12.536 -9.689 10.014 946 HB3 ASP 122 2HB ASP 122 12.507 -11.169 9.057 947 H GLY 123 H GLY 123 11.966 -7.003 7.853 948 HA2 GLY 123 1HA GLY 123 12.851 -4.907 8.104 949 HA3 GLY 123 2HA GLY 123 14.196 -5.661 8.940 950 H GLU 124 H GLU 124 13.149 -4.118 6.091 951 HA GLU 124 HA GLU 124 15.855 -4.041 5.112 952 HB2 GLU 124 1HB GLU 124 15.068 -4.709 2.752 953 HB3 GLU 124 2HB GLU 124 15.382 -5.983 3.917 954 HG2 GLU 124 1HG GLU 124 13.050 -6.304 4.298 955 HG3 GLU 124 2HG GLU 124 12.644 -4.886 3.326 956 H SER 125 H SER 125 16.252 -2.370 3.629 957 HA SER 125 HA SER 125 14.900 -0.007 4.024 958 HG SER 125 HG SER 125 16.561 1.421 3.547 959 HB2 SER 125 1HB SER 125 17.172 -0.667 2.740 960 HB3 SER 125 2HB SER 125 16.141 -0.329 1.350 961 H VAL 126 H VAL 126 13.815 1.364 2.397 962 HA VAL 126 HA VAL 126 12.228 0.099 0.355 963 HB VAL 126 HB VAL 126 10.785 1.327 2.710 964 HG11 VAL 126 1HG1 VAL 126 8.765 0.454 1.570 965 HG12 VAL 126 2HG1 VAL 126 9.773 0.032 0.188 966 HG13 VAL 126 3HG1 VAL 126 9.595 1.720 0.664 967 HG21 VAL 126 3HG2 VAL 126 11.129 -1.546 1.911 968 HG22 VAL 126 1HG2 VAL 126 9.880 -0.983 3.020 969 HG23 VAL 126 2HG2 VAL 126 11.581 -0.781 3.434 970 H VAL 127 H VAL 127 11.937 1.538 -1.267 971 HA VAL 127 HA VAL 127 12.035 4.402 -0.581 972 HB VAL 127 HB VAL 127 13.116 4.790 -2.808 973 HG11 VAL 127 1HG1 VAL 127 14.855 5.020 -1.440 974 HG12 VAL 127 2HG1 VAL 127 15.285 3.355 -1.833 975 HG13 VAL 127 3HG1 VAL 127 14.307 3.700 -0.408 976 HG21 VAL 127 3HG2 VAL 127 14.263 2.158 -3.061 977 HG22 VAL 127 1HG2 VAL 127 13.449 3.152 -4.269 978 HG23 VAL 127 2HG2 VAL 127 12.508 2.097 -3.214 979 H VAL 128 H VAL 128 10.035 5.141 -0.845 980 HA VAL 128 HA VAL 128 8.238 4.040 -2.820 981 HB VAL 128 HB VAL 128 7.451 6.562 -1.514 982 HG11 VAL 128 1HG1 VAL 128 6.244 3.916 -2.138 983 HG12 VAL 128 2HG1 VAL 128 5.650 5.541 -2.485 984 HG13 VAL 128 3HG1 VAL 128 5.525 4.886 -0.856 985 HG21 VAL 128 3HG2 VAL 128 6.946 5.001 0.601 986 HG22 VAL 128 1HG2 VAL 128 8.390 6.005 0.473 987 HG23 VAL 128 2HG2 VAL 128 8.469 4.286 0.079 988 H GLU 129 H GLU 129 7.901 4.855 -4.858 989 HA GLU 129 HA GLU 129 8.437 7.642 -5.429 990 HB2 GLU 129 1HB GLU 129 9.887 7.007 -7.402 991 HB3 GLU 129 2HB GLU 129 10.626 6.806 -5.820 992 HG2 GLU 129 1HG GLU 129 9.631 4.352 -6.124 993 HG3 GLU 129 2HG GLU 129 9.841 4.781 -7.821 994 H ARG 130 H ARG 130 7.005 8.413 -6.879 995 HA ARG 130 HA ARG 130 5.051 6.642 -8.019 996 HE ARG 130 HE ARG 130 3.813 7.387 -11.228 997 HB2 ARG 130 1HB ARG 130 4.487 8.893 -7.141 998 HB3 ARG 130 2HB ARG 130 5.436 9.614 -8.433 999 HG2 ARG 130 1HG ARG 130 3.258 7.737 -9.176 1000 HG3 ARG 130 2HG ARG 130 2.823 9.348 -8.598 1001 HD2 ARG 130 1HD ARG 130 3.214 10.138 -10.631 1002 HD3 ARG 130 2HD ARG 130 4.913 9.714 -10.437 1003 HH11 ARG 130 1HH1 ARG 130 3.633 10.631 -12.503 1004 HH12 ARG 130 2HH1 ARG 130 3.410 10.110 -14.138 1005 HH21 ARG 130 1HH2 ARG 130 3.519 6.700 -13.380 1006 HH22 ARG 130 2HH2 ARG 130 3.346 7.879 -14.637 1007 H ALA 131 H ALA 131 5.997 5.360 -9.555 1008 HA ALA 131 HA ALA 131 7.109 4.758 -11.479 1009 HB1 ALA 131 3HB ALA 131 6.072 5.632 -13.448 1010 HB2 ALA 131 1HB ALA 131 5.515 7.060 -12.577 1011 HB3 ALA 131 2HB ALA 131 4.848 5.473 -12.188 Start of MODEL 9 1 H MET 1 H MET 1 -14.267 10.131 -16.908 2 HA MET 1 HA MET 1 -17.025 9.156 -17.001 3 HB2 MET 1 1HB MET 1 -15.053 10.480 -18.784 4 HB3 MET 1 2HB MET 1 -16.114 9.292 -19.529 5 HG2 MET 1 1HG MET 1 -17.712 10.807 -19.658 6 HG3 MET 1 2HG MET 1 -17.726 10.940 -17.900 7 HE1 MET 1 3HE MET 1 -14.927 12.510 -17.115 8 HE2 MET 1 1HE MET 1 -16.592 12.525 -16.539 9 HE3 MET 1 2HE MET 1 -15.823 14.028 -17.048 10 H GLY 2 H GLY 2 -13.671 8.226 -17.231 11 HA2 GLY 2 1HA GLY 2 -13.898 5.888 -18.749 12 HA3 GLY 2 2HA GLY 2 -12.663 6.186 -17.535 13 H GLU 3 H GLU 3 -12.694 5.005 -15.723 14 HA GLU 3 HA GLU 3 -14.949 3.172 -15.351 15 HB2 GLU 3 1HB GLU 3 -12.261 3.060 -13.987 16 HB3 GLU 3 2HB GLU 3 -13.466 1.783 -14.088 17 HG2 GLU 3 1HG GLU 3 -12.716 1.085 -16.061 18 HG3 GLU 3 2HG GLU 3 -12.607 2.724 -16.700 19 H ARG 4 H ARG 4 -14.723 6.089 -14.469 20 HA ARG 4 HA ARG 4 -15.373 7.371 -12.706 21 HE ARG 4 HE ARG 4 -17.736 3.548 -12.842 22 HB2 ARG 4 1HB ARG 4 -16.544 4.728 -11.836 23 HB3 ARG 4 2HB ARG 4 -16.845 6.246 -11.004 24 HG2 ARG 4 1HG ARG 4 -18.696 5.949 -12.397 25 HG3 ARG 4 2HG ARG 4 -17.686 7.129 -13.233 26 HD2 ARG 4 1HD ARG 4 -18.638 5.348 -14.704 27 HD3 ARG 4 2HD ARG 4 -16.880 5.473 -14.754 28 HH11 ARG 4 1HH1 ARG 4 -17.276 4.049 -16.264 29 HH12 ARG 4 2HH1 ARG 4 -17.027 2.369 -16.604 30 HH21 ARG 4 1HH2 ARG 4 -17.409 1.339 -13.286 31 HH22 ARG 4 2HH2 ARG 4 -17.102 0.831 -14.913 32 H GLY 5 H GLY 5 -12.786 5.716 -12.602 33 HA2 GLY 5 1HA GLY 5 -11.837 6.695 -10.152 34 HA3 GLY 5 2HA GLY 5 -12.262 5.005 -9.933 35 H VAL 6 H VAL 6 -10.158 7.247 -11.615 36 HA VAL 6 HA VAL 6 -8.113 5.176 -11.790 37 HB VAL 6 HB VAL 6 -9.260 4.846 -13.900 38 HG11 VAL 6 1HG1 VAL 6 -9.521 7.695 -13.845 39 HG12 VAL 6 2HG1 VAL 6 -10.313 6.523 -14.896 40 HG13 VAL 6 3HG1 VAL 6 -8.750 7.200 -15.351 41 HG21 VAL 6 3HG2 VAL 6 -7.381 5.423 -15.482 42 HG22 VAL 6 1HG2 VAL 6 -6.915 4.512 -14.048 43 HG23 VAL 6 2HG2 VAL 6 -6.604 6.247 -14.132 44 H GLU 7 H GLU 7 -6.900 6.436 -10.389 45 HA GLU 7 HA GLU 7 -6.263 9.164 -11.151 46 HB2 GLU 7 1HB GLU 7 -6.851 8.410 -8.774 47 HB3 GLU 7 2HB GLU 7 -5.248 7.686 -8.731 48 HG2 GLU 7 1HG GLU 7 -5.555 9.949 -7.718 49 HG3 GLU 7 2HG GLU 7 -4.202 9.772 -8.824 50 H MET 8 H MET 8 -3.612 8.205 -9.509 51 HA MET 8 HA MET 8 -2.184 7.389 -11.940 52 HB2 MET 8 1HB MET 8 -1.814 9.793 -11.296 53 HB3 MET 8 2HB MET 8 -1.077 9.218 -9.807 54 HG2 MET 8 1HG MET 8 0.732 9.633 -11.190 55 HG3 MET 8 2HG MET 8 0.499 7.891 -11.323 56 HE1 MET 8 3HE MET 8 -0.399 11.245 -12.579 57 HE2 MET 8 1HE MET 8 -0.857 11.061 -14.272 58 HE3 MET 8 2HE MET 8 0.846 11.157 -13.824 59 H ARG 9 H ARG 9 -0.566 5.900 -11.733 60 HA ARG 9 HA ARG 9 -0.634 4.315 -9.308 61 HE ARG 9 HE ARG 9 4.450 2.837 -12.480 62 HB2 ARG 9 1HB ARG 9 0.321 2.581 -10.527 63 HB3 ARG 9 2HB ARG 9 -0.657 3.413 -11.727 64 HG2 ARG 9 1HG ARG 9 1.212 3.267 -12.964 65 HG3 ARG 9 2HG ARG 9 1.697 4.697 -12.050 66 HD2 ARG 9 1HD ARG 9 3.169 3.531 -10.738 67 HD3 ARG 9 2HD ARG 9 2.273 2.019 -10.890 68 HH11 ARG 9 1HH1 ARG 9 1.337 1.282 -12.755 69 HH12 ARG 9 2HH1 ARG 9 1.775 0.372 -14.162 70 HH21 ARG 9 1HH2 ARG 9 5.027 1.642 -14.331 71 HH22 ARG 9 2HH2 ARG 9 3.872 0.576 -15.055 72 H LEU 10 H LEU 10 1.078 3.821 -7.999 73 HA LEU 10 HA LEU 10 3.436 5.564 -8.277 74 HG LEU 10 HG LEU 10 0.822 4.368 -5.896 75 HB2 LEU 10 1HB LEU 10 3.276 4.692 -5.590 76 HB3 LEU 10 2HB LEU 10 3.104 6.320 -6.214 77 HD11 LEU 10 1HD1 LEU 10 1.749 5.003 -3.726 78 HD12 LEU 10 2HD1 LEU 10 0.169 5.747 -3.980 79 HD13 LEU 10 3HD1 LEU 10 1.636 6.707 -4.168 80 HD21 LEU 10 3HD2 LEU 10 0.980 6.569 -7.521 81 HD22 LEU 10 1HD2 LEU 10 0.270 7.230 -6.049 82 HD23 LEU 10 2HD2 LEU 10 -0.508 5.880 -6.872 83 H ARG 11 H ARG 11 5.452 4.696 -7.478 84 HA ARG 11 HA ARG 11 5.573 1.797 -7.885 85 HE ARG 11 HE ARG 11 10.015 0.867 -8.236 86 HB2 ARG 11 1HB ARG 11 7.084 3.939 -8.928 87 HB3 ARG 11 2HB ARG 11 8.164 3.050 -7.868 88 HG2 ARG 11 1HG ARG 11 6.512 1.720 -9.995 89 HG3 ARG 11 2HG ARG 11 8.135 2.350 -10.289 90 HD2 ARG 11 1HD ARG 11 7.763 0.560 -7.954 91 HD3 ARG 11 2HD ARG 11 7.681 -0.172 -9.555 92 HH11 ARG 11 1HH1 ARG 11 8.577 0.096 -11.321 93 HH12 ARG 11 2HH1 ARG 11 10.098 -0.085 -12.126 94 HH21 ARG 11 1HH2 ARG 11 12.018 0.630 -9.293 95 HH22 ARG 11 2HH2 ARG 11 12.053 0.217 -10.975 96 H ILE 12 H ILE 12 6.575 0.444 -6.415 97 HA ILE 12 HA ILE 12 7.813 1.614 -4.051 98 HB ILE 12 HB ILE 12 5.205 0.248 -4.043 99 HG12 ILE 12 1HG1 ILE 12 6.541 1.687 -1.770 100 HG13 ILE 12 2HG1 ILE 12 5.926 2.567 -3.166 101 HG21 ILE 12 1HG2 ILE 12 5.719 -0.771 -1.745 102 HG22 ILE 12 2HG2 ILE 12 7.404 -0.742 -2.263 103 HG23 ILE 12 3HG2 ILE 12 6.215 -1.664 -3.183 104 HD11 ILE 12 3HD1 ILE 12 3.839 0.897 -2.416 105 HD12 ILE 12 1HD1 ILE 12 3.970 2.634 -2.133 106 HD13 ILE 12 2HD1 ILE 12 4.511 1.495 -0.899 107 H ARG 13 H ARG 13 9.782 0.813 -4.416 108 HA ARG 13 HA ARG 13 10.038 -2.027 -5.115 109 HE ARG 13 HE ARG 13 14.293 2.751 -6.265 110 HB2 ARG 13 1HB ARG 13 12.385 -1.476 -5.687 111 HB3 ARG 13 2HB ARG 13 11.213 -0.559 -6.622 112 HG2 ARG 13 1HG ARG 13 11.657 1.127 -4.539 113 HG3 ARG 13 2HG ARG 13 13.232 0.349 -4.699 114 HD2 ARG 13 1HD ARG 13 12.351 0.957 -7.309 115 HD3 ARG 13 2HD ARG 13 12.046 2.388 -6.323 116 HH11 ARG 13 1HH1 ARG 13 13.753 -0.609 -7.040 117 HH12 ARG 13 2HH1 ARG 13 15.431 -0.948 -7.300 118 HH21 ARG 13 1HH2 ARG 13 16.501 2.306 -6.607 119 HH22 ARG 13 2HH2 ARG 13 16.992 0.706 -7.054 120 H PHE 14 H PHE 14 11.629 -3.330 -4.117 121 HA PHE 14 HA PHE 14 12.467 -2.514 -1.429 122 HD1 PHE 14 HD1 PHE 14 9.669 -2.275 -1.510 123 HD2 PHE 14 HD2 PHE 14 11.236 -5.249 1.102 124 HE1 PHE 14 HE1 PHE 14 8.300 -1.379 0.324 125 HE2 PHE 14 HE2 PHE 14 9.870 -4.357 2.941 126 HZ PHE 14 HZ PHE 14 8.398 -2.419 2.554 127 HB2 PHE 14 1HB PHE 14 10.712 -4.776 -2.198 128 HB3 PHE 14 2HB PHE 14 11.995 -5.165 -1.058 129 H GLU 15 H GLU 15 14.488 -3.194 -0.874 130 HA GLU 15 HA GLU 15 16.421 -3.670 -2.708 131 HB2 GLU 15 1HB GLU 15 16.215 -4.148 0.196 132 HB3 GLU 15 2HB GLU 15 17.452 -5.087 -0.622 133 HG2 GLU 15 1HG GLU 15 18.041 -2.781 0.382 134 HG3 GLU 15 2HG GLU 15 18.682 -3.245 -1.191 135 H SER 16 H SER 16 14.243 -6.064 -1.416 136 HA SER 16 HA SER 16 15.593 -8.098 -3.070 137 HG SER 16 HG SER 16 13.669 -8.622 0.345 138 HB2 SER 16 1HB SER 16 14.374 -9.677 -1.314 139 HB3 SER 16 2HB SER 16 15.966 -8.989 -0.991 140 H ALA 17 H ALA 17 13.247 -6.221 -3.620 141 HA ALA 17 HA ALA 17 11.702 -8.082 -5.090 142 HB1 ALA 17 3HB ALA 17 10.964 -8.409 -2.598 143 HB2 ALA 17 1HB ALA 17 9.773 -8.415 -3.898 144 HB3 ALA 17 2HB ALA 17 9.995 -6.969 -2.914 145 H GLU 18 H GLU 18 10.132 -7.156 -6.424 146 HA GLU 18 HA GLU 18 9.873 -4.222 -6.312 147 HB2 GLU 18 1HB GLU 18 10.025 -4.285 -8.866 148 HB3 GLU 18 2HB GLU 18 11.523 -4.455 -7.962 149 HG2 GLU 18 1HG GLU 18 10.182 -6.984 -8.583 150 HG3 GLU 18 2HG GLU 18 10.737 -6.075 -9.988 151 H CYS 19 H CYS 19 7.894 -3.382 -6.918 152 HA CYS 19 HA CYS 19 5.967 -4.931 -8.376 153 HG CYS 19 HG CYS 19 6.444 -6.369 -4.802 154 HB2 CYS 19 1HB CYS 19 4.478 -4.474 -6.026 155 HB3 CYS 19 2HB CYS 19 4.948 -6.026 -6.707 156 H GLU 20 H GLU 20 4.102 -3.732 -8.980 157 HA GLU 20 HA GLU 20 4.261 -0.865 -8.297 158 HB2 GLU 20 1HB GLU 20 2.933 -1.771 -10.812 159 HB3 GLU 20 2HB GLU 20 3.787 -0.272 -10.478 160 HG2 GLU 20 1HG GLU 20 5.901 -1.692 -10.409 161 HG3 GLU 20 2HG GLU 20 4.923 -2.958 -11.148 162 H VAL 21 H VAL 21 2.215 0.300 -8.268 163 HA VAL 21 HA VAL 21 -0.208 -1.288 -8.097 164 HB VAL 21 HB VAL 21 -0.317 -1.459 -5.888 165 HG11 VAL 21 1HG1 VAL 21 2.242 0.127 -5.859 166 HG12 VAL 21 2HG1 VAL 21 2.052 -1.628 -5.796 167 HG13 VAL 21 3HG1 VAL 21 1.536 -0.636 -4.432 168 HG21 VAL 21 3HG2 VAL 21 -1.500 0.697 -5.961 169 HG22 VAL 21 1HG2 VAL 21 0.029 1.532 -5.693 170 HG23 VAL 21 2HG2 VAL 21 -0.625 0.468 -4.448 171 H GLU 22 H GLU 22 -2.051 -0.148 -8.487 172 HA GLU 22 HA GLU 22 -1.692 2.638 -9.323 173 HB2 GLU 22 1HB GLU 22 -3.655 0.482 -10.024 174 HB3 GLU 22 2HB GLU 22 -4.087 2.168 -10.274 175 HG2 GLU 22 1HG GLU 22 -2.560 2.459 -11.950 176 HG3 GLU 22 2HG GLU 22 -1.494 1.191 -11.346 177 H LEU 23 H LEU 23 -4.044 3.827 -9.087 178 HA LEU 23 HA LEU 23 -5.222 3.251 -6.505 179 HG LEU 23 HG LEU 23 -5.768 6.471 -6.240 180 HB2 LEU 23 1HB LEU 23 -3.534 4.554 -5.604 181 HB3 LEU 23 2HB LEU 23 -3.443 5.596 -7.007 182 HD11 LEU 23 1HD1 LEU 23 -6.567 5.253 -4.513 183 HD12 LEU 23 2HD1 LEU 23 -5.567 6.352 -3.564 184 HD13 LEU 23 3HD1 LEU 23 -4.961 4.750 -3.980 185 HD21 LEU 23 3HD2 LEU 23 -4.646 8.044 -4.670 186 HD22 LEU 23 1HD2 LEU 23 -3.817 7.852 -6.215 187 HD23 LEU 23 2HD2 LEU 23 -3.198 7.043 -4.775 188 H TYR 24 H TYR 24 -7.238 4.120 -6.215 189 HA TYR 24 HA TYR 24 -8.324 5.640 -8.498 190 HD1 TYR 24 HD1 TYR 24 -7.917 4.262 -9.965 191 HD2 TYR 24 HD2 TYR 24 -10.091 1.368 -7.729 192 HE1 TYR 24 HE1 TYR 24 -7.114 2.499 -11.478 193 HE2 TYR 24 HE2 TYR 24 -9.295 -0.403 -9.238 194 HH TYR 24 HH TYR 24 -6.751 -0.012 -11.352 195 HB2 TYR 24 1HB TYR 24 -9.816 3.557 -6.870 196 HB3 TYR 24 2HB TYR 24 -10.442 4.460 -8.246 197 H GLU 25 H GLU 25 -9.835 7.254 -8.071 198 HA GLU 25 HA GLU 25 -9.437 8.757 -5.764 199 HB2 GLU 25 1HB GLU 25 -11.762 8.831 -7.685 200 HB3 GLU 25 2HB GLU 25 -11.456 10.047 -6.450 201 HG2 GLU 25 1HG GLU 25 -9.755 10.991 -7.602 202 HG3 GLU 25 2HG GLU 25 -9.224 9.461 -8.298 203 H GLU 26 H GLU 26 -11.276 5.924 -5.938 204 HA GLU 26 HA GLU 26 -13.511 6.314 -4.437 205 HB2 GLU 26 1HB GLU 26 -13.414 4.027 -3.805 206 HB3 GLU 26 2HB GLU 26 -12.662 4.135 -5.388 207 HG2 GLU 26 1HG GLU 26 -10.440 4.195 -4.204 208 HG3 GLU 26 2HG GLU 26 -11.312 3.798 -2.725 209 H TRP 27 H TRP 27 -10.212 6.513 -3.334 210 HA TRP 27 HA TRP 27 -10.888 6.461 -0.537 211 HD1 TRP 27 HD1 TRP 27 -9.832 7.964 1.242 212 HE1 TRP 27 HE1 TRP 27 -7.981 8.733 2.856 213 HE3 TRP 27 HE3 TRP 27 -5.754 6.458 -1.435 214 HZ2 TRP 27 HZ2 TRP 27 -5.155 8.702 2.975 215 HZ3 TRP 27 HZ3 TRP 27 -3.510 6.860 -0.505 216 HH2 TRP 27 HH2 TRP 27 -3.220 7.961 1.655 217 HB2 TRP 27 1HB TRP 27 -8.720 5.618 -1.107 218 HB3 TRP 27 2HB TRP 27 -8.341 7.053 -2.056 219 H ALA 28 H ALA 28 -9.602 8.930 -2.782 220 HA ALA 28 HA ALA 28 -11.233 10.982 -2.525 221 HB1 ALA 28 3HB ALA 28 -11.480 11.134 -0.238 222 HB2 ALA 28 1HB ALA 28 -10.219 12.333 -0.532 223 HB3 ALA 28 2HB ALA 28 -9.792 10.734 0.080 224 HA PRO 29 HA PRO 29 -7.833 12.341 -5.140 225 HB2 PRO 29 1HB PRO 29 -9.024 14.952 -5.205 226 HB3 PRO 29 2HB PRO 29 -8.986 13.737 -6.481 227 HG2 PRO 29 1HG PRO 29 -11.147 14.438 -4.639 228 HG3 PRO 29 2HG PRO 29 -11.217 13.522 -6.150 229 HD2 PRO 29 1HD PRO 29 -11.561 12.421 -3.669 230 HD3 PRO 29 2HD PRO 29 -10.983 11.515 -5.079 231 H GLU 30 H GLU 30 -9.102 14.188 -2.398 232 HA GLU 30 HA GLU 30 -6.972 15.988 -2.104 233 HB2 GLU 30 1HB GLU 30 -9.097 14.960 -0.267 234 HB3 GLU 30 2HB GLU 30 -7.742 15.834 0.428 235 HG2 GLU 30 1HG GLU 30 -9.050 17.115 -1.887 236 HG3 GLU 30 2HG GLU 30 -10.000 17.006 -0.406 237 H THR 31 H THR 31 -7.538 12.890 -0.426 238 HA THR 31 HA THR 31 -5.110 12.899 1.023 239 HB THR 31 HB THR 31 -5.743 10.193 0.457 240 HG1 THR 31 HG1 THR 31 -7.806 10.134 0.154 241 HG21 THR 31 3HG2 THR 31 -6.262 12.006 2.781 242 HG22 THR 31 1HG2 THR 31 -5.164 10.631 2.647 243 HG23 THR 31 2HG2 THR 31 -6.903 10.363 2.753 244 H VAL 32 H VAL 32 -5.926 11.482 -2.130 245 HA VAL 32 HA VAL 32 -3.604 10.160 -2.747 246 HB VAL 32 HB VAL 32 -5.136 11.874 -4.704 247 HG11 VAL 32 1HG1 VAL 32 -3.138 9.697 -4.938 248 HG12 VAL 32 2HG1 VAL 32 -3.397 11.115 -5.955 249 HG13 VAL 32 3HG1 VAL 32 -4.462 9.718 -6.100 250 HG21 VAL 32 3HG2 VAL 32 -5.879 9.401 -3.285 251 HG22 VAL 32 1HG2 VAL 32 -6.176 9.408 -5.023 252 HG23 VAL 32 2HG2 VAL 32 -6.897 10.651 -4.000 253 H ARG 33 H ARG 33 -4.163 13.600 -2.632 254 HA ARG 33 HA ARG 33 -1.998 14.504 -4.151 255 HE ARG 33 HE ARG 33 -2.636 19.994 -3.976 256 HB2 ARG 33 1HB ARG 33 -3.964 15.826 -3.119 257 HB3 ARG 33 2HB ARG 33 -2.954 15.935 -1.686 258 HG2 ARG 33 1HG ARG 33 -1.169 16.920 -3.208 259 HG3 ARG 33 2HG ARG 33 -2.449 17.079 -4.413 260 HD2 ARG 33 1HD ARG 33 -3.763 18.395 -2.780 261 HD3 ARG 33 2HD ARG 33 -2.407 18.304 -1.657 262 HH11 ARG 33 1HH1 ARG 33 -0.431 18.469 -1.742 263 HH12 ARG 33 2HH1 ARG 33 0.842 19.609 -2.027 264 HH21 ARG 33 1HH2 ARG 33 -0.963 21.493 -4.351 265 HH22 ARG 33 2HH2 ARG 33 0.541 21.326 -3.508 266 H ALA 34 H ALA 34 -2.165 13.530 -0.755 267 HA ALA 34 HA ALA 34 0.431 14.404 -0.037 268 HB1 ALA 34 3HB ALA 34 -0.669 13.995 1.878 269 HB2 ALA 34 1HB ALA 34 -0.008 12.371 1.684 270 HB3 ALA 34 2HB ALA 34 -1.657 12.720 1.165 271 H ILE 35 H ILE 35 -0.789 11.230 -1.072 272 HA ILE 35 HA ILE 35 1.581 9.781 -0.857 273 HB ILE 35 HB ILE 35 0.115 9.119 -3.310 274 HG12 ILE 35 1HG1 ILE 35 -1.765 10.094 -2.062 275 HG13 ILE 35 2HG1 ILE 35 -1.931 8.347 -2.207 276 HG21 ILE 35 1HG2 ILE 35 0.117 6.909 -2.327 277 HG22 ILE 35 2HG2 ILE 35 0.640 7.574 -0.780 278 HG23 ILE 35 3HG2 ILE 35 1.712 7.646 -2.179 279 HD11 ILE 35 3HD1 ILE 35 -0.541 9.134 0.215 280 HD12 ILE 35 1HD1 ILE 35 -1.930 8.071 -0.003 281 HD13 ILE 35 2HD1 ILE 35 -2.163 9.817 0.100 282 H ALA 36 H ALA 36 0.324 11.596 -3.700 283 HA ALA 36 HA ALA 36 2.565 11.175 -5.356 284 HB1 ALA 36 3HB ALA 36 1.478 12.449 -6.858 285 HB2 ALA 36 1HB ALA 36 1.117 13.719 -5.688 286 HB3 ALA 36 2HB ALA 36 0.126 12.260 -5.740 287 H ASP 37 H ASP 37 1.928 13.432 -2.764 288 HA ASP 37 HA ASP 37 4.045 15.241 -3.413 289 HB2 ASP 37 1HB ASP 37 1.991 15.589 -1.847 290 HB3 ASP 37 2HB ASP 37 3.015 14.850 -0.618 291 H ALA 38 H ALA 38 3.870 12.196 -1.784 292 HA ALA 38 HA ALA 38 6.539 12.456 -0.656 293 HB1 ALA 38 3HB ALA 38 4.912 9.995 -0.323 294 HB2 ALA 38 1HB ALA 38 4.352 11.471 0.465 295 HB3 ALA 38 2HB ALA 38 5.956 10.827 0.831 296 H LEU 39 H LEU 39 6.763 12.432 -3.337 297 HA LEU 39 HA LEU 39 6.934 9.887 -4.553 298 HG LEU 39 HG LEU 39 6.221 13.088 -5.561 299 HB2 LEU 39 1HB LEU 39 8.441 12.411 -5.275 300 HB3 LEU 39 2HB LEU 39 8.229 11.009 -6.297 301 HD11 LEU 39 1HD1 LEU 39 7.564 12.078 -7.955 302 HD12 LEU 39 2HD1 LEU 39 6.859 13.662 -7.627 303 HD13 LEU 39 3HD1 LEU 39 5.828 12.328 -8.147 304 HD21 LEU 39 3HD2 LEU 39 4.983 11.150 -4.986 305 HD22 LEU 39 1HD2 LEU 39 5.639 10.235 -6.339 306 HD23 LEU 39 2HD2 LEU 39 4.505 11.549 -6.633 307 HA PRO 40 HA PRO 40 11.105 8.072 -4.067 308 HB2 PRO 40 1HB PRO 40 12.542 10.581 -4.864 309 HB3 PRO 40 2HB PRO 40 12.996 8.892 -5.136 310 HG2 PRO 40 1HG PRO 40 11.766 10.386 -7.031 311 HG3 PRO 40 2HG PRO 40 11.544 8.635 -6.889 312 HD2 PRO 40 1HD PRO 40 9.635 10.766 -6.412 313 HD3 PRO 40 2HD PRO 40 9.352 9.021 -6.494 314 H ILE 41 H ILE 41 11.030 7.855 -1.932 315 HA ILE 41 HA ILE 41 12.546 9.722 -0.305 316 HB ILE 41 HB ILE 41 9.628 9.116 0.203 317 HG12 ILE 41 1HG1 ILE 41 11.244 11.678 0.122 318 HG13 ILE 41 2HG1 ILE 41 10.095 11.135 -1.092 319 HG21 ILE 41 1HG2 ILE 41 11.658 10.161 2.183 320 HG22 ILE 41 2HG2 ILE 41 10.797 8.625 2.272 321 HG23 ILE 41 3HG2 ILE 41 9.912 10.142 2.433 322 HD11 ILE 41 3HD1 ILE 41 9.591 12.815 1.048 323 HD12 ILE 41 1HD1 ILE 41 8.879 11.273 1.525 324 HD13 ILE 41 2HD1 ILE 41 8.395 12.039 0.010 325 H LYS 42 H LYS 42 13.352 8.748 1.617 326 HA LYS 42 HA LYS 42 13.527 5.869 1.405 327 HB2 LYS 42 1HB LYS 42 15.071 8.008 2.692 328 HB3 LYS 42 2HB LYS 42 14.985 6.523 3.629 329 HG2 LYS 42 1HG LYS 42 16.416 5.481 2.289 330 HG3 LYS 42 2HG LYS 42 15.560 6.005 0.839 331 HD2 LYS 42 1HD LYS 42 17.490 7.140 0.485 332 HD3 LYS 42 2HD LYS 42 16.704 8.327 1.528 333 HE2 LYS 42 1HE LYS 42 18.792 8.132 2.499 334 HE3 LYS 42 2HE LYS 42 17.832 7.002 3.452 335 HZ1 LYS 42 3HZ LYS 42 18.674 5.351 1.602 336 HZ2 LYS 42 1HZ LYS 42 19.606 5.694 2.973 337 HZ3 LYS 42 2HZ LYS 42 19.945 6.464 1.506 338 H SER 43 H SER 43 12.721 4.383 2.763 339 HA SER 43 HA SER 43 11.479 5.179 5.270 340 HG SER 43 HG SER 43 9.391 2.520 3.932 341 HB2 SER 43 1HB SER 43 9.332 4.461 4.790 342 HB3 SER 43 2HB SER 43 9.798 5.176 3.252 343 H THR 44 H THR 44 11.245 3.459 6.763 344 HA THR 44 HA THR 44 12.896 1.113 6.080 345 HB THR 44 HB THR 44 12.070 1.470 8.888 346 HG1 THR 44 HG1 THR 44 13.671 3.400 7.574 347 HG21 THR 44 3HG2 THR 44 13.828 0.140 9.082 348 HG22 THR 44 1HG2 THR 44 14.835 1.537 8.703 349 HG23 THR 44 2HG2 THR 44 14.327 0.441 7.417 350 H ALA 45 H ALA 45 11.951 -0.747 5.705 351 HA ALA 45 HA ALA 45 9.128 -1.079 6.092 352 HB1 ALA 45 3HB ALA 45 9.414 -2.296 4.260 353 HB2 ALA 45 1HB ALA 45 10.212 -3.519 5.248 354 HB3 ALA 45 2HB ALA 45 11.164 -2.264 4.462 355 H ASN 46 H ASN 46 8.066 -2.182 7.554 356 HA ASN 46 HA ASN 46 9.581 -3.660 9.600 357 HB2 ASN 46 1HB ASN 46 7.118 -2.011 9.653 358 HB3 ASN 46 2HB ASN 46 7.083 -3.465 10.644 359 HD21 ASN 46 1HD2 ASN 46 7.182 -0.559 11.296 360 HD22 ASN 46 2HD2 ASN 46 8.521 -0.392 12.374 361 H ARG 47 H ARG 47 9.423 -5.881 9.528 362 HA ARG 47 HA ARG 47 7.576 -7.027 7.630 363 HE ARG 47 HE ARG 47 7.514 -9.685 7.432 364 HB2 ARG 47 1HB ARG 47 10.053 -7.832 8.955 365 HB3 ARG 47 2HB ARG 47 8.903 -9.148 8.749 366 HG2 ARG 47 1HG ARG 47 9.065 -7.594 6.341 367 HG3 ARG 47 2HG ARG 47 10.673 -8.103 6.846 368 HD2 ARG 47 1HD ARG 47 9.406 -9.670 5.317 369 HD3 ARG 47 2HD ARG 47 10.093 -10.378 6.777 370 HH11 ARG 47 1HH1 ARG 47 9.040 -11.739 5.060 371 HH12 ARG 47 2HH1 ARG 47 7.715 -12.849 4.985 372 HH21 ARG 47 1HH2 ARG 47 5.768 -11.147 7.332 373 HH22 ARG 47 2HH2 ARG 47 5.857 -12.513 6.273 374 H TRP 48 H TRP 48 5.865 -8.304 7.990 375 HA TRP 48 HA TRP 48 5.278 -9.351 10.628 376 HD1 TRP 48 HD1 TRP 48 1.601 -9.512 9.140 377 HE1 TRP 48 HE1 TRP 48 -0.114 -10.205 10.933 378 HE3 TRP 48 HE3 TRP 48 3.719 -7.229 13.195 379 HZ2 TRP 48 HZ2 TRP 48 -0.505 -9.823 13.712 380 HZ3 TRP 48 HZ3 TRP 48 2.612 -7.441 15.381 381 HH2 TRP 48 HH2 TRP 48 0.543 -8.712 15.631 382 HB2 TRP 48 1HB TRP 48 4.215 -7.182 10.819 383 HB3 TRP 48 2HB TRP 48 3.446 -7.369 9.245 384 H GLY 49 H GLY 49 3.783 -11.087 10.556 385 HA2 GLY 49 1HA GLY 49 3.884 -12.894 8.585 386 HA3 GLY 49 2HA GLY 49 2.441 -12.711 9.567 387 H ASP 50 H ASP 50 3.937 -12.057 6.503 388 HA ASP 50 HA ASP 50 3.009 -11.788 4.432 389 HB2 ASP 50 1HB ASP 50 1.046 -13.095 5.282 390 HB3 ASP 50 2HB ASP 50 0.310 -11.573 5.771 391 H GLU 51 H GLU 51 1.692 -9.706 6.988 392 HA GLU 51 HA GLU 51 1.312 -7.497 5.193 393 HB2 GLU 51 1HB GLU 51 0.790 -8.073 8.036 394 HB3 GLU 51 2HB GLU 51 1.155 -6.392 7.672 395 HG2 GLU 51 1HG GLU 51 -0.624 -6.821 5.755 396 HG3 GLU 51 2HG GLU 51 -1.172 -8.043 6.897 397 H ILE 52 H ILE 52 2.392 -5.522 5.239 398 HA ILE 52 HA ILE 52 4.874 -5.281 6.728 399 HB ILE 52 HB ILE 52 4.834 -6.040 3.930 400 HG12 ILE 52 1HG1 ILE 52 7.468 -5.858 4.687 401 HG13 ILE 52 2HG1 ILE 52 6.661 -6.010 6.240 402 HG21 ILE 52 1HG2 ILE 52 6.201 -3.449 4.606 403 HG22 ILE 52 2HG2 ILE 52 5.021 -3.757 3.332 404 HG23 ILE 52 3HG2 ILE 52 6.639 -4.443 3.217 405 HD11 ILE 52 3HD1 ILE 52 7.374 -8.167 5.439 406 HD12 ILE 52 1HD1 ILE 52 6.476 -7.947 3.938 407 HD13 ILE 52 2HD1 ILE 52 5.615 -8.098 5.473 408 H TYR 53 H TYR 53 4.741 -3.322 7.584 409 HA TYR 53 HA TYR 53 3.583 -1.161 5.940 410 HD1 TYR 53 HD1 TYR 53 4.450 0.199 9.734 411 HD2 TYR 53 HD2 TYR 53 2.347 -3.483 9.337 412 HE1 TYR 53 HE1 TYR 53 5.151 -0.441 12.000 413 HE2 TYR 53 HE2 TYR 53 3.044 -4.130 11.603 414 HH TYR 53 HH TYR 53 3.807 -3.131 13.652 415 HB2 TYR 53 1HB TYR 53 2.662 -0.146 7.987 416 HB3 TYR 53 2HB TYR 53 2.029 -1.771 7.728 417 H PHE 54 H PHE 54 4.620 0.716 5.804 418 HA PHE 54 HA PHE 54 6.894 1.223 7.580 419 HD1 PHE 54 HD1 PHE 54 6.816 3.694 4.543 420 HD2 PHE 54 HD2 PHE 54 6.992 -0.402 3.411 421 HE1 PHE 54 HE1 PHE 54 5.996 4.282 2.303 422 HE2 PHE 54 HE2 PHE 54 6.169 0.177 1.170 423 HZ PHE 54 HZ PHE 54 5.671 2.523 0.612 424 HB2 PHE 54 1HB PHE 54 8.319 1.859 5.723 425 HB3 PHE 54 2HB PHE 54 7.765 0.207 5.492 426 H THR 55 H THR 55 7.330 3.397 7.968 427 HA THR 55 HA THR 55 5.148 5.212 7.219 428 HB THR 55 HB THR 55 7.306 6.168 9.012 429 HG1 THR 55 HG1 THR 55 7.230 4.171 9.876 430 HG21 THR 55 3HG2 THR 55 4.403 6.474 8.726 431 HG22 THR 55 1HG2 THR 55 5.626 7.632 9.248 432 HG23 THR 55 2HG2 THR 55 5.004 6.436 10.384 433 H THR 56 H THR 56 5.517 7.217 6.198 434 HA THR 56 HA THR 56 8.179 7.489 4.960 435 HB THR 56 HB THR 56 6.295 8.775 3.308 436 HG1 THR 56 HG1 THR 56 4.718 7.451 4.355 437 HG21 THR 56 3HG2 THR 56 6.992 6.146 2.361 438 HG22 THR 56 1HG2 THR 56 8.397 6.989 3.014 439 HG23 THR 56 2HG2 THR 56 7.440 7.729 1.728 440 H GLN 57 H GLN 57 6.396 8.822 7.248 441 HA GLN 57 HA GLN 57 6.658 10.816 8.353 442 HB2 GLN 57 1HB GLN 57 7.951 12.112 5.966 443 HB3 GLN 57 2HB GLN 57 8.157 12.480 7.672 444 HG2 GLN 57 1HG GLN 57 9.001 9.818 7.317 445 HG3 GLN 57 2HG GLN 57 9.695 10.756 5.996 446 HE21 GLN 57 1HE2 GLN 57 11.608 11.566 6.417 447 HE22 GLN 57 2HE2 GLN 57 12.206 12.031 7.970 448 H VAL 58 H VAL 58 4.991 10.297 5.492 449 HA VAL 58 HA VAL 58 3.786 12.933 5.376 450 HB VAL 58 HB VAL 58 4.155 11.707 3.277 451 HG11 VAL 58 1HG1 VAL 58 2.931 9.739 2.689 452 HG12 VAL 58 2HG1 VAL 58 2.030 9.783 4.205 453 HG13 VAL 58 3HG1 VAL 58 3.759 9.431 4.217 454 HG21 VAL 58 3HG2 VAL 58 1.313 12.315 4.047 455 HG22 VAL 58 1HG2 VAL 58 1.785 11.902 2.398 456 HG23 VAL 58 2HG2 VAL 58 2.457 13.337 3.174 457 H ALA 59 H ALA 59 2.246 13.491 6.760 458 HA ALA 59 HA ALA 59 0.589 11.372 7.945 459 HB1 ALA 59 3HB ALA 59 0.203 12.755 9.808 460 HB2 ALA 59 1HB ALA 59 0.778 14.194 8.965 461 HB3 ALA 59 2HB ALA 59 1.918 12.930 9.437 462 H VAL 60 H VAL 60 -1.024 11.074 6.500 463 HA VAL 60 HA VAL 60 -2.805 13.386 6.032 464 HB VAL 60 HB VAL 60 -1.755 12.775 3.923 465 HG11 VAL 60 1HG1 VAL 60 -2.930 10.015 4.126 466 HG12 VAL 60 2HG1 VAL 60 -1.295 10.378 4.674 467 HG13 VAL 60 3HG1 VAL 60 -1.732 10.624 2.986 468 HG21 VAL 60 3HG2 VAL 60 -4.643 11.967 4.177 469 HG22 VAL 60 1HG2 VAL 60 -3.815 12.083 2.623 470 HG23 VAL 60 2HG2 VAL 60 -3.981 13.514 3.641 471 H GLU 61 H GLU 61 -4.472 13.068 7.430 472 HA GLU 61 HA GLU 61 -5.699 10.387 7.443 473 HB2 GLU 61 1HB GLU 61 -4.674 11.957 9.650 474 HB3 GLU 61 2HB GLU 61 -6.380 11.595 9.872 475 HG2 GLU 61 1HG GLU 61 -6.013 9.287 9.856 476 HG3 GLU 61 2HG GLU 61 -4.408 9.460 9.148 477 H LYS 62 H LYS 62 -7.820 10.272 7.089 478 HA LYS 62 HA LYS 62 -9.511 12.609 7.449 479 HB2 LYS 62 1HB LYS 62 -8.715 12.851 5.150 480 HB3 LYS 62 2HB LYS 62 -9.212 11.205 4.785 481 HG2 LYS 62 1HG LYS 62 -11.535 11.799 5.081 482 HG3 LYS 62 2HG LYS 62 -11.081 13.432 5.570 483 HD2 LYS 62 1HD LYS 62 -9.816 13.290 3.201 484 HD3 LYS 62 2HD LYS 62 -11.176 12.210 2.885 485 HE2 LYS 62 1HE LYS 62 -12.672 14.045 3.765 486 HE3 LYS 62 2HE LYS 62 -11.259 15.099 3.726 487 HZ1 LYS 62 3HZ LYS 62 -12.864 14.065 1.537 488 HZ2 LYS 62 1HZ LYS 62 -11.193 14.096 1.266 489 HZ3 LYS 62 2HZ LYS 62 -12.013 15.521 1.662 490 H GLU 63 H GLU 63 -11.867 12.019 7.119 491 HA GLU 63 HA GLU 63 -12.288 9.283 8.093 492 HB2 GLU 63 1HB GLU 63 -14.447 11.346 8.051 493 HB3 GLU 63 2HB GLU 63 -14.199 10.020 9.176 494 HG2 GLU 63 1HG GLU 63 -13.626 11.766 10.509 495 HG3 GLU 63 2HG GLU 63 -12.050 11.404 9.807 496 H GLU 64 H GLU 64 -12.109 8.308 6.019 497 HA GLU 64 HA GLU 64 -14.592 8.003 4.695 498 HB2 GLU 64 1HB GLU 64 -14.308 9.943 3.481 499 HB3 GLU 64 2HB GLU 64 -12.557 9.826 3.498 500 HG2 GLU 64 1HG GLU 64 -12.486 8.482 1.656 501 HG3 GLU 64 2HG GLU 64 -14.086 7.808 1.947 502 H ASN 65 H ASN 65 -14.540 6.323 3.062 503 HA ASN 65 HA ASN 65 -13.801 4.418 2.073 504 HB2 ASN 65 1HB ASN 65 -11.784 5.963 1.521 505 HB3 ASN 65 2HB ASN 65 -10.952 5.071 2.797 506 HD21 ASN 65 1HD2 ASN 65 -9.967 4.997 0.287 507 HD22 ASN 65 2HD2 ASN 65 -10.222 3.442 -0.420 508 H SER 66 H SER 66 -11.229 4.687 4.487 509 HA SER 66 HA SER 66 -10.474 2.866 5.796 510 HG SER 66 HG SER 66 -12.767 2.338 8.124 511 HB2 SER 66 1HB SER 66 -11.105 4.494 7.354 512 HB3 SER 66 2HB SER 66 -12.825 4.274 7.031 513 H LYS 67 H LYS 67 -10.950 0.961 4.466 514 HA LYS 67 HA LYS 67 -13.429 -0.430 5.229 515 HB2 LYS 67 1HB LYS 67 -12.805 -2.039 3.362 516 HB3 LYS 67 2HB LYS 67 -13.294 -0.427 2.877 517 HG2 LYS 67 1HG LYS 67 -11.492 -0.843 1.518 518 HG3 LYS 67 2HG LYS 67 -10.753 0.069 2.830 519 HD2 LYS 67 1HD LYS 67 -10.169 -2.143 3.885 520 HD3 LYS 67 2HD LYS 67 -10.710 -2.909 2.395 521 HE2 LYS 67 1HE LYS 67 -9.059 -1.610 1.139 522 HE3 LYS 67 2HE LYS 67 -8.508 -0.868 2.639 523 HZ1 LYS 67 3HZ LYS 67 -8.509 -3.723 2.785 524 HZ2 LYS 67 1HZ LYS 67 -7.256 -2.631 3.102 525 HZ3 LYS 67 2HZ LYS 67 -7.535 -3.162 1.523 526 H ASP 68 H ASP 68 -13.261 -2.833 5.561 527 HA ASP 68 HA ASP 68 -10.741 -3.489 6.963 528 HB2 ASP 68 1HB ASP 68 -12.210 -4.812 8.560 529 HB3 ASP 68 2HB ASP 68 -12.304 -3.058 8.683 530 H VAL 69 H VAL 69 -12.771 -4.412 4.465 531 HA VAL 69 HA VAL 69 -11.644 -7.132 4.543 532 HB VAL 69 HB VAL 69 -14.454 -6.536 3.590 533 HG11 VAL 69 1HG1 VAL 69 -13.325 -8.386 2.428 534 HG12 VAL 69 2HG1 VAL 69 -14.679 -8.941 3.414 535 HG13 VAL 69 3HG1 VAL 69 -13.024 -9.162 3.985 536 HG21 VAL 69 3HG2 VAL 69 -13.423 -7.079 6.242 537 HG22 VAL 69 1HG2 VAL 69 -14.571 -8.313 5.727 538 HG23 VAL 69 2HG2 VAL 69 -15.048 -6.615 5.739 539 H VAL 70 H VAL 70 -10.956 -7.981 2.615 540 HA VAL 70 HA VAL 70 -11.561 -6.673 0.107 541 HB VAL 70 HB VAL 70 -9.240 -6.134 -0.475 542 HG11 VAL 70 1HG1 VAL 70 -9.092 -4.073 0.712 543 HG12 VAL 70 2HG1 VAL 70 -10.037 -4.718 2.054 544 HG13 VAL 70 3HG1 VAL 70 -10.802 -4.443 0.490 545 HG21 VAL 70 3HG2 VAL 70 -7.447 -6.143 1.077 546 HG22 VAL 70 1HG2 VAL 70 -8.199 -7.735 1.205 547 HG23 VAL 70 2HG2 VAL 70 -8.515 -6.501 2.427 548 H GLU 71 H GLU 71 -10.647 -7.752 -1.758 549 HA GLU 71 HA GLU 71 -10.336 -10.608 -1.274 550 HB2 GLU 71 1HB GLU 71 -10.361 -9.400 -4.026 551 HB3 GLU 71 2HB GLU 71 -10.924 -10.977 -3.500 552 HG2 GLU 71 1HG GLU 71 -12.886 -10.139 -2.614 553 HG3 GLU 71 2HG GLU 71 -12.278 -8.488 -2.572 554 H LEU 72 H LEU 72 -8.701 -11.867 -2.164 555 HA LEU 72 HA LEU 72 -6.109 -11.085 -1.704 556 HG LEU 72 HG LEU 72 -4.453 -12.532 -3.459 557 HB2 LEU 72 1HB LEU 72 -6.829 -13.420 -1.925 558 HB3 LEU 72 2HB LEU 72 -7.083 -13.194 -3.641 559 HD11 LEU 72 1HD1 LEU 72 -3.318 -13.626 -1.827 560 HD12 LEU 72 2HD1 LEU 72 -4.509 -14.919 -1.709 561 HD13 LEU 72 3HD1 LEU 72 -4.822 -13.360 -0.946 562 HD21 LEU 72 3HD2 LEU 72 -4.008 -14.666 -4.428 563 HD22 LEU 72 1HD2 LEU 72 -5.597 -14.143 -4.988 564 HD23 LEU 72 2HD2 LEU 72 -5.466 -15.357 -3.715 565 H GLY 73 H GLY 73 -4.629 -9.865 -2.744 566 HA2 GLY 73 1HA GLY 73 -3.437 -9.438 -4.849 567 HA3 GLY 73 2HA GLY 73 -4.999 -9.434 -5.648 568 H ASP 74 H ASP 74 -6.269 -7.778 -3.582 569 HA ASP 74 HA ASP 74 -5.648 -5.258 -4.710 570 HB2 ASP 74 1HB ASP 74 -7.455 -4.415 -3.485 571 HB3 ASP 74 2HB ASP 74 -7.886 -6.098 -3.757 572 H VAL 75 H VAL 75 -5.134 -3.306 -3.476 573 HA VAL 75 HA VAL 75 -3.191 -3.822 -1.294 574 HB VAL 75 HB VAL 75 -2.984 -1.610 -3.365 575 HG11 VAL 75 1HG1 VAL 75 -0.840 -2.596 -1.490 576 HG12 VAL 75 2HG1 VAL 75 -1.920 -1.252 -1.102 577 HG13 VAL 75 3HG1 VAL 75 -0.841 -1.142 -2.492 578 HG21 VAL 75 3HG2 VAL 75 -0.947 -3.704 -3.419 579 HG22 VAL 75 1HG2 VAL 75 -1.818 -2.931 -4.743 580 HG23 VAL 75 2HG2 VAL 75 -2.559 -4.269 -3.863 581 H ALA 76 H ALA 76 -3.067 -2.081 0.384 582 HA ALA 76 HA ALA 76 -5.085 -0.003 0.185 583 HB1 ALA 76 3HB ALA 76 -5.310 -2.327 2.016 584 HB2 ALA 76 1HB ALA 76 -6.560 -1.475 1.111 585 HB3 ALA 76 2HB ALA 76 -5.872 -0.752 2.567 586 H TYR 77 H TYR 77 -4.813 1.748 1.581 587 HA TYR 77 HA TYR 77 -2.201 1.840 2.917 588 HD1 TYR 77 HD1 TYR 77 -5.500 4.823 2.839 589 HD2 TYR 77 HD2 TYR 77 -1.371 5.057 3.817 590 HE1 TYR 77 HE1 TYR 77 -5.978 6.657 4.404 591 HE2 TYR 77 HE2 TYR 77 -1.836 6.892 5.377 592 HH TYR 77 HH TYR 77 -3.978 7.632 6.756 593 HB2 TYR 77 1HB TYR 77 -2.099 3.834 1.882 594 HB3 TYR 77 2HB TYR 77 -3.796 3.754 1.426 595 H TRP 78 H TRP 78 -2.096 1.624 5.057 596 HA TRP 78 HA TRP 78 -4.388 1.310 6.670 597 HD1 TRP 78 HD1 TRP 78 -4.256 2.484 9.438 598 HE1 TRP 78 HE1 TRP 78 -4.765 1.045 11.510 599 HE3 TRP 78 HE3 TRP 78 -1.350 -1.572 8.333 600 HZ2 TRP 78 HZ2 TRP 78 -4.018 -1.474 12.544 601 HZ3 TRP 78 HZ3 TRP 78 -1.299 -3.453 9.918 602 HH2 TRP 78 HH2 TRP 78 -2.605 -3.403 11.981 603 HB2 TRP 78 1HB TRP 78 -1.998 0.424 7.065 604 HB3 TRP 78 2HB TRP 78 -1.670 2.006 7.762 605 H ILE 79 H ILE 79 -5.748 2.849 7.397 606 HA ILE 79 HA ILE 79 -5.082 5.613 7.249 607 HB ILE 79 HB ILE 79 -7.470 4.096 8.208 608 HG12 ILE 79 1HG1 ILE 79 -6.773 6.062 6.085 609 HG13 ILE 79 2HG1 ILE 79 -7.722 4.585 5.978 610 HG21 ILE 79 1HG2 ILE 79 -7.022 7.022 8.797 611 HG22 ILE 79 2HG2 ILE 79 -7.166 5.732 9.990 612 HG23 ILE 79 3HG2 ILE 79 -8.549 6.162 8.987 613 HD11 ILE 79 3HD1 ILE 79 -9.405 6.012 7.448 614 HD12 ILE 79 1HD1 ILE 79 -9.374 6.116 5.689 615 HD13 ILE 79 2HD1 ILE 79 -8.560 7.343 6.659 616 HA PRO 80 HA PRO 80 -5.044 5.596 12.131 617 HB2 PRO 80 1HB PRO 80 -4.790 2.681 12.642 618 HB3 PRO 80 2HB PRO 80 -5.684 3.909 13.542 619 HG2 PRO 80 1HG PRO 80 -6.938 2.137 11.983 620 HG3 PRO 80 2HG PRO 80 -7.506 3.808 12.133 621 HD2 PRO 80 1HD PRO 80 -6.049 2.498 9.894 622 HD3 PRO 80 2HD PRO 80 -7.277 3.770 9.861 623 H GLY 81 H GLY 81 -2.998 6.363 11.227 624 HA2 GLY 81 1HA GLY 81 -0.719 6.054 12.271 625 HA3 GLY 81 2HA GLY 81 -0.780 4.436 11.584 626 H LYS 82 H LYS 82 -2.304 6.178 9.315 627 HA LYS 82 HA LYS 82 -1.691 6.823 7.189 628 HB2 LYS 82 1HB LYS 82 0.711 8.249 8.203 629 HB3 LYS 82 2HB LYS 82 -0.541 8.800 7.103 630 HG2 LYS 82 1HG LYS 82 -1.240 10.059 8.799 631 HG3 LYS 82 2HG LYS 82 -1.899 8.574 9.480 632 HD2 LYS 82 1HD LYS 82 0.326 8.228 10.603 633 HD3 LYS 82 2HD LYS 82 0.760 9.854 10.077 634 HE2 LYS 82 1HE LYS 82 -1.835 9.656 11.434 635 HE3 LYS 82 2HE LYS 82 -0.446 9.250 12.442 636 HZ1 LYS 82 3HZ LYS 82 -0.459 11.474 12.750 637 HZ2 LYS 82 1HZ LYS 82 -1.203 11.806 11.266 638 HZ3 LYS 82 2HZ LYS 82 0.452 11.462 11.325 639 H ALA 83 H ALA 83 -0.650 4.313 7.984 640 HA ALA 83 HA ALA 83 1.973 4.280 6.639 641 HB1 ALA 83 3HB ALA 83 2.694 3.023 8.323 642 HB2 ALA 83 1HB ALA 83 1.454 1.817 7.973 643 HB3 ALA 83 2HB ALA 83 1.108 3.141 9.083 644 H ILE 84 H ILE 84 2.282 3.030 4.839 645 HA ILE 84 HA ILE 84 -0.089 1.875 3.607 646 HB ILE 84 HB ILE 84 2.656 1.748 2.410 647 HG12 ILE 84 1HG1 ILE 84 0.803 4.138 2.372 648 HG13 ILE 84 2HG1 ILE 84 2.396 4.069 3.114 649 HG21 ILE 84 1HG2 ILE 84 1.339 1.989 0.308 650 HG22 ILE 84 2HG2 ILE 84 -0.128 1.914 1.283 651 HG23 ILE 84 3HG2 ILE 84 0.970 0.534 1.235 652 HD11 ILE 84 3HD1 ILE 84 1.710 4.804 0.478 653 HD12 ILE 84 1HD1 ILE 84 2.650 3.314 0.389 654 HD13 ILE 84 2HD1 ILE 84 3.311 4.728 1.213 655 H CYS 85 H CYS 85 -0.281 -0.327 2.971 656 HA CYS 85 HA CYS 85 1.770 -2.159 3.948 657 HG CYS 85 HG CYS 85 -0.858 -4.641 5.261 658 HB2 CYS 85 1HB CYS 85 0.286 -1.990 5.832 659 HB3 CYS 85 2HB CYS 85 -1.119 -2.260 4.809 660 H LEU 86 H LEU 86 1.644 -4.298 3.155 661 HA LEU 86 HA LEU 86 0.175 -4.535 0.602 662 HG LEU 86 HG LEU 86 1.598 -4.277 -1.024 663 HB2 LEU 86 1HB LEU 86 2.927 -4.929 1.281 664 HB3 LEU 86 2HB LEU 86 2.257 -6.478 0.808 665 HD11 LEU 86 1HD1 LEU 86 4.041 -3.938 -0.124 666 HD12 LEU 86 2HD1 LEU 86 3.687 -3.803 -1.845 667 HD13 LEU 86 3HD1 LEU 86 4.395 -5.287 -1.205 668 HD21 LEU 86 3HD2 LEU 86 2.372 -6.009 -2.661 669 HD22 LEU 86 1HD2 LEU 86 1.040 -6.518 -1.621 670 HD23 LEU 86 2HD2 LEU 86 2.682 -7.078 -1.290 671 H PHE 87 H PHE 87 -0.634 -6.698 0.055 672 HA PHE 87 HA PHE 87 -0.894 -8.512 2.347 673 HD1 PHE 87 HD1 PHE 87 -2.550 -7.081 4.137 674 HD2 PHE 87 HD2 PHE 87 -3.725 -5.758 0.269 675 HE1 PHE 87 HE1 PHE 87 -3.046 -4.852 5.055 676 HE2 PHE 87 HE2 PHE 87 -4.223 -3.536 1.176 677 HZ PHE 87 HZ PHE 87 -3.884 -3.073 3.573 678 HB2 PHE 87 1HB PHE 87 -3.291 -8.002 0.621 679 HB3 PHE 87 2HB PHE 87 -3.215 -8.662 2.249 680 H PHE 88 H PHE 88 -0.508 -10.561 1.839 681 HA PHE 88 HA PHE 88 -1.170 -11.565 -0.806 682 HD1 PHE 88 HD2 PHE 88 1.017 -9.141 -1.493 683 HD2 PHE 88 HD1 PHE 88 1.106 -13.210 -2.735 684 HE1 PHE 88 HE2 PHE 88 1.183 -8.416 -3.840 685 HE2 PHE 88 HE1 PHE 88 1.273 -12.493 -5.083 686 HZ PHE 88 HZ PHE 88 1.311 -10.095 -5.638 687 HB2 PHE 88 1HB PHE 88 1.564 -11.007 0.071 688 HB3 PHE 88 2HB PHE 88 1.334 -12.669 -0.458 689 H GLY 89 H GLY 89 -2.106 -11.969 1.940 690 HA2 GLY 89 1HA GLY 89 -2.848 -14.512 2.072 691 HA3 GLY 89 2HA GLY 89 -1.182 -14.649 2.613 692 H LYS 90 H LYS 90 -1.803 -15.374 4.660 693 HA LYS 90 HA LYS 90 -3.652 -14.559 6.409 694 HB2 LYS 90 1HB LYS 90 -2.107 -15.067 8.271 695 HB3 LYS 90 2HB LYS 90 -2.093 -16.288 7.014 696 HG2 LYS 90 1HG LYS 90 -0.022 -14.104 7.146 697 HG3 LYS 90 2HG LYS 90 0.133 -15.619 8.033 698 HD2 LYS 90 1HD LYS 90 -0.539 -16.412 5.461 699 HD3 LYS 90 2HD LYS 90 0.583 -15.071 5.222 700 HE2 LYS 90 1HE LYS 90 1.190 -17.251 7.179 701 HE3 LYS 90 2HE LYS 90 1.508 -17.475 5.459 702 HZ1 LYS 90 3HZ LYS 90 2.632 -15.096 5.876 703 HZ2 LYS 90 1HZ LYS 90 3.473 -16.560 6.003 704 HZ3 LYS 90 2HZ LYS 90 2.877 -15.802 7.394 705 H THR 91 H THR 91 -3.365 -13.243 8.516 706 HA THR 91 HA THR 91 -1.786 -10.838 8.296 707 HB THR 91 HB THR 91 -4.419 -9.905 8.829 708 HG1 THR 91 HG1 THR 91 -4.281 -11.339 6.393 709 HG21 THR 91 3HG2 THR 91 -2.891 -8.419 7.848 710 HG22 THR 91 1HG2 THR 91 -4.120 -8.719 6.620 711 HG23 THR 91 2HG2 THR 91 -2.555 -9.522 6.515 712 HA PRO 92 HA PRO 92 -1.990 -10.449 12.729 713 HB2 PRO 92 1HB PRO 92 -4.367 -8.628 12.586 714 HB3 PRO 92 2HB PRO 92 -2.902 -8.486 13.569 715 HG2 PRO 92 1HG PRO 92 -3.175 -7.033 11.363 716 HG3 PRO 92 2HG PRO 92 -1.611 -7.761 11.774 717 HD2 PRO 92 1HD PRO 92 -3.576 -8.547 9.689 718 HD3 PRO 92 2HD PRO 92 -1.809 -8.706 9.692 719 H ILE 93 H ILE 93 -5.013 -10.979 11.048 720 HA ILE 93 HA ILE 93 -5.766 -12.932 13.096 721 HB ILE 93 HB ILE 93 -7.816 -11.105 11.857 722 HG12 ILE 93 1HG1 ILE 93 -7.745 -10.313 14.444 723 HG13 ILE 93 2HG1 ILE 93 -6.041 -10.677 14.189 724 HG21 ILE 93 1HG2 ILE 93 -7.914 -12.932 14.254 725 HG22 ILE 93 2HG2 ILE 93 -8.623 -13.259 12.672 726 HG23 ILE 93 3HG2 ILE 93 -9.240 -11.933 13.658 727 HD11 ILE 93 3HD1 ILE 93 -6.121 -8.464 13.622 728 HD12 ILE 93 1HD1 ILE 93 -7.742 -8.583 12.939 729 HD13 ILE 93 2HD1 ILE 93 -6.360 -9.218 12.046 730 H SER 94 H SER 94 -4.567 -13.838 10.939 731 HA SER 94 HA SER 94 -5.891 -14.203 8.555 732 HG SER 94 HG SER 94 -3.437 -15.796 10.837 733 HB2 SER 94 1HB SER 94 -4.636 -16.685 9.280 734 HB3 SER 94 2HB SER 94 -4.094 -15.459 8.133 735 H ASP 95 H ASP 95 -6.301 -16.009 11.573 736 HA ASP 95 HA ASP 95 -7.859 -18.116 10.790 737 HB2 ASP 95 1HB ASP 95 -7.062 -17.463 13.146 738 HB3 ASP 95 2HB ASP 95 -8.542 -16.513 13.247 739 H ASP 96 H ASP 96 -9.205 -15.019 11.943 740 HA ASP 96 HA ASP 96 -11.803 -15.633 10.860 741 HB2 ASP 96 1HB ASP 96 -10.598 -13.425 12.453 742 HB3 ASP 96 2HB ASP 96 -12.042 -13.050 11.517 743 H LYS 97 H LYS 97 -10.344 -15.871 8.686 744 HA LYS 97 HA LYS 97 -10.109 -15.183 6.537 745 HB2 LYS 97 1HB LYS 97 -12.070 -13.103 7.495 746 HB3 LYS 97 2HB LYS 97 -11.453 -13.111 5.849 747 HG2 LYS 97 1HG LYS 97 -12.636 -15.612 6.942 748 HG3 LYS 97 2HG LYS 97 -13.709 -14.295 6.465 749 HD2 LYS 97 1HD LYS 97 -13.578 -15.176 4.408 750 HD3 LYS 97 2HD LYS 97 -11.980 -14.432 4.346 751 HE2 LYS 97 1HE LYS 97 -12.193 -17.102 5.617 752 HE3 LYS 97 2HE LYS 97 -12.385 -17.024 3.865 753 HZ1 LYS 97 3HZ LYS 97 -10.185 -17.003 3.743 754 HZ2 LYS 97 1HZ LYS 97 -10.015 -16.834 5.417 755 HZ3 LYS 97 2HZ LYS 97 -10.190 -15.464 4.442 756 H ILE 98 H ILE 98 -9.173 -13.411 5.178 757 HA ILE 98 HA ILE 98 -6.852 -12.372 6.429 758 HB ILE 98 HB ILE 98 -8.099 -11.690 3.758 759 HG12 ILE 98 1HG1 ILE 98 -5.693 -13.390 4.469 760 HG13 ILE 98 2HG1 ILE 98 -7.275 -14.007 3.992 761 HG21 ILE 98 1HG2 ILE 98 -5.902 -10.700 3.190 762 HG22 ILE 98 2HG2 ILE 98 -5.430 -10.862 4.881 763 HG23 ILE 98 3HG2 ILE 98 -6.770 -9.805 4.437 764 HD11 ILE 98 3HD1 ILE 98 -6.461 -12.175 2.008 765 HD12 ILE 98 1HD1 ILE 98 -6.643 -13.926 1.882 766 HD13 ILE 98 2HD1 ILE 98 -5.090 -13.234 2.354 767 H ARG 99 H ARG 99 -7.069 -10.932 8.026 768 HA ARG 99 HA ARG 99 -8.762 -8.571 7.543 769 HE ARG 99 HE ARG 99 -12.270 -8.932 10.772 770 HB2 ARG 99 1HB ARG 99 -8.122 -10.158 9.934 771 HB3 ARG 99 2HB ARG 99 -8.025 -8.420 10.183 772 HG2 ARG 99 1HG ARG 99 -10.262 -8.108 9.884 773 HG3 ARG 99 2HG ARG 99 -10.423 -9.494 8.804 774 HD2 ARG 99 1HD ARG 99 -10.423 -11.021 10.587 775 HD3 ARG 99 2HD ARG 99 -9.793 -9.827 11.720 776 HH11 ARG 99 1HH1 ARG 99 -10.956 -11.484 12.757 777 HH12 ARG 99 2HH1 ARG 99 -12.385 -11.641 13.721 778 HH21 ARG 99 1HH2 ARG 99 -14.152 -9.138 12.040 779 HH22 ARG 99 2HH2 ARG 99 -14.200 -10.312 13.314 780 HA PRO 100 HA PRO 100 -4.610 -6.818 6.856 781 HB2 PRO 100 1HB PRO 100 -5.540 -4.489 5.770 782 HB3 PRO 100 2HB PRO 100 -5.329 -5.984 4.850 783 HG2 PRO 100 1HG PRO 100 -7.821 -4.864 6.083 784 HG3 PRO 100 2HG PRO 100 -7.591 -5.571 4.471 785 HD2 PRO 100 1HD PRO 100 -8.682 -6.976 6.473 786 HD3 PRO 100 2HD PRO 100 -7.601 -7.742 5.288 787 H ALA 101 H ALA 101 -7.399 -5.364 8.442 788 HA ALA 101 HA ALA 101 -5.972 -4.509 10.701 789 HB1 ALA 101 3HB ALA 101 -5.630 -2.773 8.454 790 HB2 ALA 101 1HB ALA 101 -4.965 -2.634 10.079 791 HB3 ALA 101 2HB ALA 101 -6.535 -1.925 9.708 792 H SER 102 H SER 102 -7.358 -2.202 11.425 793 HA SER 102 HA SER 102 -10.086 -3.256 11.610 794 HG SER 102 HG SER 102 -7.458 -2.615 13.434 795 HB2 SER 102 1HB SER 102 -9.911 -1.186 13.435 796 HB3 SER 102 2HB SER 102 -9.700 -2.899 13.798 797 H ALA 103 H ALA 103 -8.381 -0.941 9.908 798 HA ALA 103 HA ALA 103 -10.674 0.218 8.777 799 HB1 ALA 103 3HB ALA 103 -9.369 1.807 10.965 800 HB2 ALA 103 1HB ALA 103 -11.075 1.404 10.768 801 HB3 ALA 103 2HB ALA 103 -10.313 2.565 9.682 802 H VAL 104 H VAL 104 -9.251 -0.433 7.002 803 HA VAL 104 HA VAL 104 -7.288 1.685 6.415 804 HB VAL 104 HB VAL 104 -5.790 0.152 5.352 805 HG11 VAL 104 1HG1 VAL 104 -5.110 -1.221 7.236 806 HG12 VAL 104 2HG1 VAL 104 -6.700 -1.027 7.972 807 HG13 VAL 104 3HG1 VAL 104 -5.639 0.367 7.795 808 HG21 VAL 104 3HG2 VAL 104 -7.702 -1.357 4.519 809 HG22 VAL 104 1HG2 VAL 104 -7.541 -2.179 6.069 810 HG23 VAL 104 2HG2 VAL 104 -6.176 -2.120 4.957 811 H ASN 105 H ASN 105 -7.176 2.503 4.395 812 HA ASN 105 HA ASN 105 -9.525 2.206 2.744 813 HB2 ASN 105 1HB ASN 105 -7.076 3.901 2.231 814 HB3 ASN 105 2HB ASN 105 -8.673 4.112 1.533 815 HD21 ASN 105 1HD2 ASN 105 -7.352 6.142 2.809 816 HD22 ASN 105 2HD2 ASN 105 -8.190 6.550 4.258 817 H VAL 106 H VAL 106 -9.547 1.721 0.508 818 HA VAL 106 HA VAL 106 -7.577 -0.249 -0.305 819 HB VAL 106 HB VAL 106 -9.281 0.336 -2.496 820 HG11 VAL 106 1HG1 VAL 106 -9.744 -1.924 -2.437 821 HG12 VAL 106 2HG1 VAL 106 -9.677 -1.998 -0.676 822 HG13 VAL 106 3HG1 VAL 106 -8.189 -1.825 -1.610 823 HG21 VAL 106 3HG2 VAL 106 -10.929 1.393 -1.210 824 HG22 VAL 106 1HG2 VAL 106 -10.751 0.247 0.119 825 HG23 VAL 106 2HG2 VAL 106 -11.495 -0.267 -1.395 826 H ILE 107 H ILE 107 -5.755 1.027 -0.527 827 HA ILE 107 HA ILE 107 -5.658 3.368 -2.121 828 HB ILE 107 HB ILE 107 -4.117 2.494 -0.177 829 HG12 ILE 107 1HG1 ILE 107 -4.101 4.700 -1.501 830 HG13 ILE 107 2HG1 ILE 107 -2.638 4.237 -0.641 831 HG21 ILE 107 1HG2 ILE 107 -2.604 1.536 -2.597 832 HG22 ILE 107 2HG2 ILE 107 -3.284 0.528 -1.320 833 HG23 ILE 107 3HG2 ILE 107 -1.970 1.642 -0.959 834 HD11 ILE 107 3HD1 ILE 107 -1.640 4.750 -2.566 835 HD12 ILE 107 1HD1 ILE 107 -3.122 4.571 -3.503 836 HD13 ILE 107 2HD1 ILE 107 -2.174 3.151 -3.074 837 H GLY 108 H GLY 108 -6.482 0.603 -3.358 838 HA2 GLY 108 1HA GLY 108 -6.422 0.504 -5.809 839 HA3 GLY 108 2HA GLY 108 -4.712 0.881 -5.704 840 H ARG 109 H ARG 109 -4.093 -0.956 -6.857 841 HA ARG 109 HA ARG 109 -3.876 -3.337 -5.245 842 HE ARG 109 HE ARG 109 -8.496 -5.630 -5.591 843 HB2 ARG 109 1HB ARG 109 -5.161 -3.643 -7.952 844 HB3 ARG 109 2HB ARG 109 -4.976 -4.859 -6.697 845 HG2 ARG 109 1HG ARG 109 -6.574 -3.639 -5.294 846 HG3 ARG 109 2HG ARG 109 -6.773 -2.444 -6.575 847 HD2 ARG 109 1HD ARG 109 -8.555 -3.805 -7.013 848 HD3 ARG 109 2HD ARG 109 -7.325 -4.562 -8.025 849 HH11 ARG 109 1HH1 ARG 109 -5.995 -5.912 -8.016 850 HH12 ARG 109 2HH1 ARG 109 -5.676 -7.576 -7.666 851 HH21 ARG 109 1HH2 ARG 109 -8.073 -7.819 -5.137 852 HH22 ARG 109 2HH2 ARG 109 -6.853 -8.658 -6.035 853 H ILE 110 H ILE 110 -2.613 -5.065 -6.428 854 HA ILE 110 HA ILE 110 -0.473 -3.767 -7.965 855 HB ILE 110 HB ILE 110 -0.521 -6.411 -6.505 856 HG12 ILE 110 1HG1 ILE 110 1.446 -4.349 -5.770 857 HG13 ILE 110 2HG1 ILE 110 -0.225 -3.890 -5.465 858 HG21 ILE 110 1HG2 ILE 110 0.896 -6.588 -8.463 859 HG22 ILE 110 2HG2 ILE 110 1.883 -6.539 -7.004 860 HG23 ILE 110 3HG2 ILE 110 1.737 -5.103 -8.016 861 HD11 ILE 110 3HD1 ILE 110 0.925 -4.940 -3.537 862 HD12 ILE 110 1HD1 ILE 110 1.034 -6.434 -4.467 863 HD13 ILE 110 2HD1 ILE 110 -0.546 -5.775 -4.032 864 H VAL 111 H VAL 111 -0.609 -3.979 -10.104 865 HA VAL 111 HA VAL 111 -1.805 -6.437 -11.201 866 HB VAL 111 HB VAL 111 -1.854 -4.828 -13.350 867 HG11 VAL 111 1HG1 VAL 111 -3.690 -6.100 -12.021 868 HG12 VAL 111 2HG1 VAL 111 -4.146 -4.769 -13.085 869 HG13 VAL 111 3HG1 VAL 111 -4.045 -4.512 -11.342 870 HG21 VAL 111 3HG2 VAL 111 -2.203 -2.588 -12.908 871 HG22 VAL 111 1HG2 VAL 111 -0.927 -2.984 -11.756 872 HG23 VAL 111 2HG2 VAL 111 -2.601 -2.875 -11.215 873 H ASN 112 H ASN 112 0.133 -4.070 -12.984 874 HA ASN 112 HA ASN 112 1.711 -6.137 -14.158 875 HB2 ASN 112 1HB ASN 112 3.028 -4.189 -15.101 876 HB3 ASN 112 2HB ASN 112 1.305 -4.192 -15.476 877 HD21 ASN 112 1HD2 ASN 112 0.002 -2.606 -14.671 878 HD22 ASN 112 2HD2 ASN 112 0.603 -1.214 -13.840 879 H SER 113 H SER 113 3.836 -6.688 -13.838 880 HA SER 113 HA SER 113 5.774 -7.052 -12.712 881 HG SER 113 HG SER 113 7.669 -5.870 -12.303 882 HB2 SER 113 1HB SER 113 5.379 -4.229 -12.646 883 HB3 SER 113 2HB SER 113 6.027 -4.724 -11.081 884 H MET 114 H MET 114 3.161 -7.735 -11.523 885 HA MET 114 HA MET 114 3.236 -7.304 -8.726 886 HB2 MET 114 1HB MET 114 1.184 -7.948 -9.912 887 HB3 MET 114 2HB MET 114 1.890 -9.511 -10.297 888 HG2 MET 114 1HG MET 114 1.998 -10.045 -7.914 889 HG3 MET 114 2HG MET 114 1.275 -8.482 -7.536 890 HE1 MET 114 3HE MET 114 -2.179 -9.622 -7.009 891 HE2 MET 114 1HE MET 114 -1.005 -8.308 -6.919 892 HE3 MET 114 2HE MET 114 -0.683 -9.838 -6.101 893 H GLU 115 H GLU 115 3.763 -8.810 -7.048 894 HA GLU 115 HA GLU 115 5.186 -11.224 -7.678 895 HB2 GLU 115 1HB GLU 115 6.782 -9.136 -7.923 896 HB3 GLU 115 2HB GLU 115 6.840 -9.246 -6.169 897 HG2 GLU 115 1HG GLU 115 7.938 -11.260 -6.194 898 HG3 GLU 115 2HG GLU 115 7.335 -11.693 -7.792 899 H GLY 116 H GLY 116 6.237 -12.120 -5.597 900 HA2 GLY 116 1HA GLY 116 4.202 -11.962 -3.512 901 HA3 GLY 116 2HA GLY 116 5.448 -13.194 -3.663 902 H LEU 117 H LEU 117 5.690 -9.650 -3.560 903 HA LEU 117 HA LEU 117 7.999 -9.382 -2.189 904 HG LEU 117 HG LEU 117 8.241 -7.266 -0.813 905 HB2 LEU 117 1HB LEU 117 6.766 -7.486 -3.071 906 HB3 LEU 117 2HB LEU 117 5.512 -7.699 -1.864 907 HD11 LEU 117 1HD1 LEU 117 8.024 -4.809 -1.092 908 HD12 LEU 117 2HD1 LEU 117 6.714 -5.102 -2.235 909 HD13 LEU 117 3HD1 LEU 117 8.342 -5.678 -2.593 910 HD21 LEU 117 3HD2 LEU 117 5.836 -7.414 0.334 911 HD22 LEU 117 1HD2 LEU 117 5.890 -5.679 0.016 912 HD23 LEU 117 2HD2 LEU 117 7.150 -6.437 0.989 913 H LYS 118 H LYS 118 4.902 -10.272 -0.811 914 HA LYS 118 HA LYS 118 5.162 -9.826 1.855 915 HB2 LYS 118 1HB LYS 118 3.997 -12.055 2.210 916 HB3 LYS 118 2HB LYS 118 3.195 -10.921 1.133 917 HG2 LYS 118 1HG LYS 118 3.011 -12.972 0.056 918 HG3 LYS 118 2HG LYS 118 4.361 -12.192 -0.762 919 HD2 LYS 118 1HD LYS 118 5.662 -13.923 -0.254 920 HD3 LYS 118 2HD LYS 118 5.396 -13.625 1.464 921 HE2 LYS 118 1HE LYS 118 4.743 -15.869 1.028 922 HE3 LYS 118 2HE LYS 118 3.271 -14.929 1.271 923 HZ1 LYS 118 3HZ LYS 118 3.474 -16.573 -0.718 924 HZ2 LYS 118 1HZ LYS 118 4.292 -15.289 -1.459 925 HZ3 LYS 118 2HZ LYS 118 2.699 -15.083 -0.925 926 H GLY 119 H GLY 119 7.086 -12.051 -0.031 927 HA2 GLY 119 1HA GLY 119 8.160 -13.406 2.298 928 HA3 GLY 119 2HA GLY 119 8.629 -13.671 0.626 929 H VAL 120 H VAL 120 8.566 -10.524 2.151 930 HA VAL 120 HA VAL 120 11.276 -9.985 1.429 931 HB VAL 120 HB VAL 120 10.905 -7.871 2.797 932 HG11 VAL 120 1HG1 VAL 120 10.293 -6.980 0.860 933 HG12 VAL 120 2HG1 VAL 120 8.692 -7.707 0.970 934 HG13 VAL 120 3HG1 VAL 120 10.023 -8.614 0.252 935 HG21 VAL 120 3HG2 VAL 120 8.590 -9.359 3.613 936 HG22 VAL 120 1HG2 VAL 120 8.095 -7.860 2.829 937 HG23 VAL 120 2HG2 VAL 120 9.189 -7.814 4.210 938 H ALA 121 H ALA 121 13.021 -9.435 2.899 939 HA ALA 121 HA ALA 121 13.180 -11.241 5.130 940 HB1 ALA 121 3HB ALA 121 15.092 -10.524 3.550 941 HB2 ALA 121 1HB ALA 121 15.444 -10.687 5.269 942 HB3 ALA 121 2HB ALA 121 15.195 -9.088 4.568 943 H ASP 122 H ASP 122 13.366 -10.686 7.345 944 HA ASP 122 HA ASP 122 11.684 -8.649 8.231 945 HB2 ASP 122 1HB ASP 122 12.459 -9.138 10.466 946 HB3 ASP 122 2HB ASP 122 12.260 -10.639 9.569 947 H GLY 123 H GLY 123 11.983 -6.563 7.904 948 HA2 GLY 123 1HA GLY 123 12.894 -4.472 8.259 949 HA3 GLY 123 2HA GLY 123 14.230 -5.240 9.099 950 H GLU 124 H GLU 124 13.189 -3.739 6.226 951 HA GLU 124 HA GLU 124 15.885 -3.767 5.204 952 HB2 GLU 124 1HB GLU 124 14.594 -4.366 2.848 953 HB3 GLU 124 2HB GLU 124 15.597 -5.471 3.774 954 HG2 GLU 124 1HG GLU 124 13.580 -6.280 4.932 955 HG3 GLU 124 2HG GLU 124 12.604 -5.218 3.916 956 H SER 125 H SER 125 16.250 -2.202 3.535 957 HA SER 125 HA SER 125 15.010 0.236 3.953 958 HG SER 125 HG SER 125 16.323 1.407 0.921 959 HB2 SER 125 1HB SER 125 17.226 -0.086 2.868 960 HB3 SER 125 2HB SER 125 16.401 -0.628 1.407 961 H VAL 126 H VAL 126 13.862 1.581 2.362 962 HA VAL 126 HA VAL 126 12.181 0.302 0.406 963 HB VAL 126 HB VAL 126 10.855 1.566 2.813 964 HG11 VAL 126 1HG1 VAL 126 8.778 0.727 1.766 965 HG12 VAL 126 2HG1 VAL 126 9.713 0.282 0.343 966 HG13 VAL 126 3HG1 VAL 126 9.583 1.975 0.820 967 HG21 VAL 126 3HG2 VAL 126 11.670 -0.564 3.484 968 HG22 VAL 126 1HG2 VAL 126 11.095 -1.317 1.997 969 HG23 VAL 126 2HG2 VAL 126 9.940 -0.721 3.189 970 H VAL 127 H VAL 127 11.815 1.720 -1.221 971 HA VAL 127 HA VAL 127 11.971 4.594 -0.586 972 HB VAL 127 HB VAL 127 13.045 4.968 -2.793 973 HG11 VAL 127 1HG1 VAL 127 14.210 4.185 -0.425 974 HG12 VAL 127 2HG1 VAL 127 15.045 4.899 -1.805 975 HG13 VAL 127 3HG1 VAL 127 14.989 3.146 -1.619 976 HG21 VAL 127 3HG2 VAL 127 12.541 2.116 -3.040 977 HG22 VAL 127 1HG2 VAL 127 14.209 2.549 -3.415 978 HG23 VAL 127 2HG2 VAL 127 12.881 3.321 -4.283 979 H VAL 128 H VAL 128 9.971 5.346 -0.828 980 HA VAL 128 HA VAL 128 8.140 4.234 -2.772 981 HB VAL 128 HB VAL 128 7.387 6.767 -1.463 982 HG11 VAL 128 1HG1 VAL 128 5.581 5.739 -2.440 983 HG12 VAL 128 2HG1 VAL 128 5.438 5.152 -0.786 984 HG13 VAL 128 3HG1 VAL 128 6.141 4.119 -2.026 985 HG21 VAL 128 3HG2 VAL 128 6.891 5.242 0.667 986 HG22 VAL 128 1HG2 VAL 128 8.366 6.191 0.505 987 HG23 VAL 128 2HG2 VAL 128 8.377 4.469 0.123 988 H GLU 129 H GLU 129 7.786 5.053 -4.812 989 HA GLU 129 HA GLU 129 8.310 7.838 -5.385 990 HB2 GLU 129 1HB GLU 129 9.783 7.222 -7.347 991 HB3 GLU 129 2HB GLU 129 10.511 7.032 -5.757 992 HG2 GLU 129 1HG GLU 129 9.465 4.563 -6.150 993 HG3 GLU 129 2HG GLU 129 9.881 5.029 -7.799 994 H ARG 130 H ARG 130 6.891 8.601 -6.850 995 HA ARG 130 HA ARG 130 4.946 6.831 -7.995 996 HE ARG 130 HE ARG 130 2.570 10.662 -11.661 997 HB2 ARG 130 1HB ARG 130 4.293 9.037 -7.196 998 HB3 ARG 130 2HB ARG 130 5.393 9.803 -8.333 999 HG2 ARG 130 1HG ARG 130 3.375 8.007 -9.509 1000 HG3 ARG 130 2HG ARG 130 2.767 9.490 -8.769 1001 HD2 ARG 130 1HD ARG 130 4.984 10.303 -10.234 1002 HD3 ARG 130 2HD ARG 130 4.187 9.115 -11.265 1003 HH11 ARG 130 1HH1 ARG 130 4.096 11.452 -8.623 1004 HH12 ARG 130 2HH1 ARG 130 3.179 12.904 -8.398 1005 HH21 ARG 130 1HH2 ARG 130 1.363 12.571 -11.367 1006 HH22 ARG 130 2HH2 ARG 130 1.629 13.539 -9.954 1007 H ALA 131 H ALA 131 6.121 5.503 -9.408 1008 HA ALA 131 HA ALA 131 7.248 4.887 -11.312 1009 HB1 ALA 131 3HB ALA 131 5.354 6.980 -12.356 1010 HB2 ALA 131 1HB ALA 131 5.053 5.249 -12.191 1011 HB3 ALA 131 2HB ALA 131 6.232 5.832 -13.367 Start of MODEL 10 1 H MET 1 H MET 1 -6.557 6.573 -22.398 2 HA MET 1 HA MET 1 -4.900 8.159 -23.371 3 HB2 MET 1 1HB MET 1 -6.327 7.836 -25.614 4 HB3 MET 1 2HB MET 1 -7.188 9.219 -24.952 5 HG2 MET 1 1HG MET 1 -5.151 10.507 -24.886 6 HG3 MET 1 2HG MET 1 -4.219 9.112 -25.429 7 HE1 MET 1 3HE MET 1 -4.048 11.586 -28.398 8 HE2 MET 1 1HE MET 1 -3.481 11.320 -26.749 9 HE3 MET 1 2HE MET 1 -4.857 12.382 -27.047 10 H GLY 2 H GLY 2 -4.807 9.608 -21.788 11 HA2 GLY 2 1HA GLY 2 -5.694 11.572 -20.711 12 HA3 GLY 2 2HA GLY 2 -7.305 10.899 -20.908 13 H GLU 3 H GLU 3 -6.157 11.903 -18.482 14 HA GLU 3 HA GLU 3 -5.385 9.671 -16.850 15 HB2 GLU 3 1HB GLU 3 -6.319 12.380 -15.904 16 HB3 GLU 3 2HB GLU 3 -5.313 11.230 -15.034 17 HG2 GLU 3 1HG GLU 3 -3.441 11.940 -16.014 18 HG3 GLU 3 2HG GLU 3 -4.199 12.057 -17.601 19 H ARG 4 H ARG 4 -8.347 11.386 -17.567 20 HA ARG 4 HA ARG 4 -10.530 10.890 -17.153 21 HE ARG 4 HE ARG 4 -12.796 8.209 -18.304 22 HB2 ARG 4 1HB ARG 4 -9.577 8.287 -15.958 23 HB3 ARG 4 2HB ARG 4 -11.168 8.644 -16.607 24 HG2 ARG 4 1HG ARG 4 -9.013 9.043 -18.538 25 HG3 ARG 4 2HG ARG 4 -9.116 7.391 -17.938 26 HD2 ARG 4 1HD ARG 4 -11.057 8.951 -19.576 27 HD3 ARG 4 2HD ARG 4 -10.532 7.277 -19.736 28 HH11 ARG 4 1HH1 ARG 4 -10.279 5.793 -18.214 29 HH12 ARG 4 2HH1 ARG 4 -11.224 4.663 -17.303 30 HH21 ARG 4 1HH2 ARG 4 -14.038 6.726 -17.102 31 HH22 ARG 4 2HH2 ARG 4 -13.357 5.193 -16.672 32 H GLY 5 H GLY 5 -8.901 9.261 -14.427 33 HA2 GLY 5 1HA GLY 5 -9.131 11.172 -12.471 34 HA3 GLY 5 2HA GLY 5 -10.729 10.442 -12.544 35 H VAL 6 H VAL 6 -9.604 7.812 -13.293 36 HA VAL 6 HA VAL 6 -8.413 7.075 -10.686 37 HB VAL 6 HB VAL 6 -9.653 4.964 -10.738 38 HG11 VAL 6 1HG1 VAL 6 -10.940 6.253 -9.427 39 HG12 VAL 6 2HG1 VAL 6 -12.062 6.214 -10.786 40 HG13 VAL 6 3HG1 VAL 6 -10.969 7.583 -10.584 41 HG21 VAL 6 3HG2 VAL 6 -9.972 5.374 -13.413 42 HG22 VAL 6 1HG2 VAL 6 -11.570 5.791 -12.798 43 HG23 VAL 6 2HG2 VAL 6 -10.879 4.205 -12.458 44 H GLU 7 H GLU 7 -6.450 7.448 -12.126 45 HA GLU 7 HA GLU 7 -5.530 4.854 -13.019 46 HB2 GLU 7 1HB GLU 7 -5.691 7.212 -14.900 47 HB3 GLU 7 2HB GLU 7 -4.691 5.796 -15.199 48 HG2 GLU 7 1HG GLU 7 -7.688 5.847 -14.930 49 HG3 GLU 7 2HG GLU 7 -6.765 5.632 -16.417 50 H MET 8 H MET 8 -4.790 6.418 -10.822 51 HA MET 8 HA MET 8 -2.161 7.486 -11.585 52 HB2 MET 8 1HB MET 8 -3.959 8.768 -10.133 53 HB3 MET 8 2HB MET 8 -3.276 7.803 -8.832 54 HG2 MET 8 1HG MET 8 -1.687 9.320 -8.615 55 HG3 MET 8 2HG MET 8 -1.085 8.856 -10.206 56 HE1 MET 8 3HE MET 8 -2.501 11.110 -7.930 57 HE2 MET 8 1HE MET 8 -3.857 11.887 -8.750 58 HE3 MET 8 2HE MET 8 -2.273 12.663 -8.736 59 H ARG 9 H ARG 9 -0.585 6.038 -11.460 60 HA ARG 9 HA ARG 9 -0.673 4.072 -9.266 61 HE ARG 9 HE ARG 9 4.413 3.009 -12.531 62 HB2 ARG 9 1HB ARG 9 0.291 2.473 -10.620 63 HB3 ARG 9 2HB ARG 9 -0.711 3.349 -11.767 64 HG2 ARG 9 1HG ARG 9 1.172 3.322 -12.998 65 HG3 ARG 9 2HG ARG 9 1.583 4.730 -12.018 66 HD2 ARG 9 1HD ARG 9 3.114 3.582 -10.760 67 HD3 ARG 9 2HD ARG 9 2.281 2.039 -10.963 68 HH11 ARG 9 1HH1 ARG 9 1.381 1.307 -12.834 69 HH12 ARG 9 2HH1 ARG 9 1.859 0.455 -14.264 70 HH21 ARG 9 1HH2 ARG 9 5.043 1.892 -14.412 71 HH22 ARG 9 2HH2 ARG 9 3.938 0.785 -15.160 72 H LEU 10 H LEU 10 1.110 3.623 -8.055 73 HA LEU 10 HA LEU 10 3.365 5.506 -8.321 74 HG LEU 10 HG LEU 10 0.818 4.213 -6.017 75 HB2 LEU 10 1HB LEU 10 3.319 4.487 -5.665 76 HB3 LEU 10 2HB LEU 10 3.127 6.142 -6.202 77 HD11 LEU 10 1HD1 LEU 10 1.696 4.406 -3.792 78 HD12 LEU 10 2HD1 LEU 10 0.269 5.436 -3.905 79 HD13 LEU 10 3HD1 LEU 10 1.878 6.153 -3.963 80 HD21 LEU 10 3HD2 LEU 10 1.063 6.680 -7.241 81 HD22 LEU 10 1HD2 LEU 10 0.321 7.053 -5.686 82 HD23 LEU 10 2HD2 LEU 10 -0.442 5.890 -6.770 83 H ARG 11 H ARG 11 5.427 4.642 -7.375 84 HA ARG 11 HA ARG 11 5.635 1.781 -8.014 85 HE ARG 11 HE ARG 11 9.126 -0.753 -9.964 86 HB2 ARG 11 1HB ARG 11 6.998 3.911 -9.110 87 HB3 ARG 11 2HB ARG 11 8.147 3.279 -7.938 88 HG2 ARG 11 1HG ARG 11 6.810 1.687 -10.118 89 HG3 ARG 11 2HG ARG 11 8.464 2.303 -10.153 90 HD2 ARG 11 1HD ARG 11 8.439 0.963 -7.787 91 HD3 ARG 11 2HD ARG 11 7.337 -0.020 -8.754 92 HH11 ARG 11 1HH1 ARG 11 10.050 2.162 -8.285 93 HH12 ARG 11 2HH1 ARG 11 11.714 2.054 -8.750 94 HH21 ARG 11 1HH2 ARG 11 11.314 -0.900 -10.577 95 HH22 ARG 11 2HH2 ARG 11 12.432 0.314 -10.050 96 H ILE 12 H ILE 12 6.843 0.411 -6.693 97 HA ILE 12 HA ILE 12 7.973 1.486 -4.236 98 HB ILE 12 HB ILE 12 5.449 0.006 -4.339 99 HG12 ILE 12 1HG1 ILE 12 6.652 1.125 -1.849 100 HG13 ILE 12 2HG1 ILE 12 6.250 2.233 -3.157 101 HG21 ILE 12 1HG2 ILE 12 7.679 -1.094 -2.658 102 HG22 ILE 12 2HG2 ILE 12 6.560 -1.958 -3.716 103 HG23 ILE 12 3HG2 ILE 12 5.985 -1.269 -2.197 104 HD11 ILE 12 3HD1 ILE 12 3.950 1.570 -3.086 105 HD12 ILE 12 1HD1 ILE 12 4.472 2.000 -1.457 106 HD13 ILE 12 2HD1 ILE 12 4.308 0.303 -1.914 107 H ARG 13 H ARG 13 9.996 0.827 -4.569 108 HA ARG 13 HA ARG 13 10.446 -1.921 -5.501 109 HE ARG 13 HE ARG 13 13.156 2.916 -6.592 110 HB2 ARG 13 1HB ARG 13 12.764 -1.194 -5.952 111 HB3 ARG 13 2HB ARG 13 11.573 -0.247 -6.834 112 HG2 ARG 13 1HG ARG 13 11.906 1.633 -5.500 113 HG3 ARG 13 2HG ARG 13 12.665 0.695 -4.211 114 HD2 ARG 13 1HD ARG 13 14.650 1.201 -5.069 115 HD3 ARG 13 2HD ARG 13 14.226 0.278 -6.509 116 HH11 ARG 13 1HH1 ARG 13 16.081 1.074 -7.073 117 HH12 ARG 13 2HH1 ARG 13 16.763 2.212 -8.184 118 HH21 ARG 13 1HH2 ARG 13 14.052 4.413 -8.056 119 HH22 ARG 13 2HH2 ARG 13 15.612 4.108 -8.742 120 H PHE 14 H PHE 14 12.093 -3.207 -4.540 121 HA PHE 14 HA PHE 14 12.824 -2.530 -1.789 122 HD1 PHE 14 HD2 PHE 14 9.441 -3.024 -2.369 123 HD2 PHE 14 HD1 PHE 14 11.876 -4.514 0.785 124 HE1 PHE 14 HE2 PHE 14 7.847 -2.128 -0.723 125 HE2 PHE 14 HE1 PHE 14 10.288 -3.622 2.437 126 HZ PHE 14 HZ PHE 14 8.270 -2.427 1.685 127 HB2 PHE 14 1HB PHE 14 11.166 -4.840 -2.698 128 HB3 PHE 14 2HB PHE 14 12.339 -5.126 -1.417 129 H GLU 15 H GLU 15 14.831 -3.210 -1.230 130 HA GLU 15 HA GLU 15 16.789 -3.667 -3.053 131 HB2 GLU 15 1HB GLU 15 16.554 -4.141 -0.151 132 HB3 GLU 15 2HB GLU 15 17.796 -5.086 -0.954 133 HG2 GLU 15 1HG GLU 15 18.384 -2.782 0.052 134 HG3 GLU 15 2HG GLU 15 19.037 -3.247 -1.514 135 H SER 16 H SER 16 14.598 -6.062 -1.776 136 HA SER 16 HA SER 16 15.941 -8.080 -3.455 137 HG SER 16 HG SER 16 13.589 -9.443 -0.989 138 HB2 SER 16 1HB SER 16 15.537 -9.772 -1.843 139 HB3 SER 16 2HB SER 16 16.186 -8.402 -0.940 140 H ALA 17 H ALA 17 13.551 -6.230 -3.903 141 HA ALA 17 HA ALA 17 11.982 -8.093 -5.341 142 HB1 ALA 17 3HB ALA 17 10.234 -8.641 -4.036 143 HB2 ALA 17 1HB ALA 17 10.204 -7.074 -3.228 144 HB3 ALA 17 2HB ALA 17 11.360 -8.306 -2.723 145 H GLU 18 H GLU 18 10.238 -7.173 -6.517 146 HA GLU 18 HA GLU 18 10.052 -4.232 -6.411 147 HB2 GLU 18 1HB GLU 18 9.990 -4.212 -8.901 148 HB3 GLU 18 2HB GLU 18 11.539 -4.722 -8.242 149 HG2 GLU 18 1HG GLU 18 11.004 -7.037 -8.688 150 HG3 GLU 18 2HG GLU 18 9.403 -6.579 -9.264 151 H CYS 19 H CYS 19 8.039 -3.338 -6.914 152 HA CYS 19 HA CYS 19 5.916 -4.955 -7.982 153 HG CYS 19 HG CYS 19 7.496 -4.693 -4.738 154 HB2 CYS 19 1HB CYS 19 4.725 -4.195 -5.542 155 HB3 CYS 19 2HB CYS 19 5.073 -5.828 -6.099 156 H GLU 20 H GLU 20 4.027 -3.773 -8.502 157 HA GLU 20 HA GLU 20 4.202 -0.869 -8.018 158 HB2 GLU 20 1HB GLU 20 2.986 -1.877 -10.552 159 HB3 GLU 20 2HB GLU 20 3.789 -0.348 -10.231 160 HG2 GLU 20 1HG GLU 20 5.938 -1.689 -10.062 161 HG3 GLU 20 2HG GLU 20 5.026 -3.024 -10.764 162 H VAL 21 H VAL 21 2.127 0.250 -8.089 163 HA VAL 21 HA VAL 21 -0.267 -1.378 -7.985 164 HB VAL 21 HB VAL 21 -0.350 -1.616 -5.778 165 HG11 VAL 21 1HG1 VAL 21 2.020 0.229 -5.716 166 HG12 VAL 21 2HG1 VAL 21 1.978 -1.523 -5.504 167 HG13 VAL 21 3HG1 VAL 21 1.317 -0.468 -4.255 168 HG21 VAL 21 3HG2 VAL 21 -0.406 1.398 -5.619 169 HG22 VAL 21 1HG2 VAL 21 -0.942 0.279 -4.365 170 HG23 VAL 21 2HG2 VAL 21 -1.800 0.355 -5.903 171 H GLU 22 H GLU 22 -2.080 -0.298 -8.521 172 HA GLU 22 HA GLU 22 -1.763 2.480 -9.357 173 HB2 GLU 22 1HB GLU 22 -4.073 0.584 -9.819 174 HB3 GLU 22 2HB GLU 22 -3.851 2.157 -10.574 175 HG2 GLU 22 1HG GLU 22 -2.856 1.106 -12.247 176 HG3 GLU 22 2HG GLU 22 -1.513 0.785 -11.151 177 H LEU 23 H LEU 23 -4.104 3.676 -9.136 178 HA LEU 23 HA LEU 23 -5.280 3.179 -6.550 179 HG LEU 23 HG LEU 23 -5.740 6.462 -6.395 180 HB2 LEU 23 1HB LEU 23 -3.596 4.478 -5.650 181 HB3 LEU 23 2HB LEU 23 -3.458 5.478 -7.078 182 HD11 LEU 23 1HD1 LEU 23 -5.681 6.338 -3.707 183 HD12 LEU 23 2HD1 LEU 23 -5.137 4.707 -4.095 184 HD13 LEU 23 3HD1 LEU 23 -6.685 5.290 -4.707 185 HD21 LEU 23 3HD2 LEU 23 -3.788 7.793 -6.262 186 HD22 LEU 23 1HD2 LEU 23 -3.197 6.913 -4.852 187 HD23 LEU 23 2HD2 LEU 23 -4.614 7.956 -4.713 188 H TYR 24 H TYR 24 -7.266 4.151 -6.235 189 HA TYR 24 HA TYR 24 -8.346 5.614 -8.554 190 HD1 TYR 24 HD1 TYR 24 -7.921 4.179 -9.971 191 HD2 TYR 24 HD2 TYR 24 -10.188 1.384 -7.704 192 HE1 TYR 24 HE1 TYR 24 -7.137 2.366 -11.435 193 HE2 TYR 24 HE2 TYR 24 -9.411 -0.437 -9.161 194 HH TYR 24 HH TYR 24 -6.839 -0.254 -11.120 195 HB2 TYR 24 1HB TYR 24 -9.858 3.585 -6.882 196 HB3 TYR 24 2HB TYR 24 -10.473 4.458 -8.281 197 H GLU 25 H GLU 25 -9.835 7.252 -8.152 198 HA GLU 25 HA GLU 25 -9.431 8.787 -5.865 199 HB2 GLU 25 1HB GLU 25 -11.706 8.863 -7.843 200 HB3 GLU 25 2HB GLU 25 -11.456 10.075 -6.592 201 HG2 GLU 25 1HG GLU 25 -9.566 10.927 -7.608 202 HG3 GLU 25 2HG GLU 25 -9.258 9.449 -8.518 203 H GLU 26 H GLU 26 -11.307 5.981 -6.011 204 HA GLU 26 HA GLU 26 -13.562 6.429 -4.563 205 HB2 GLU 26 1HB GLU 26 -13.505 4.155 -3.873 206 HB3 GLU 26 2HB GLU 26 -12.744 4.223 -5.455 207 HG2 GLU 26 1HG GLU 26 -10.528 4.324 -4.189 208 HG3 GLU 26 2HG GLU 26 -11.461 3.829 -2.777 209 H TRP 27 H TRP 27 -10.293 6.673 -3.398 210 HA TRP 27 HA TRP 27 -11.040 6.655 -0.611 211 HD1 TRP 27 HD1 TRP 27 -10.089 8.201 1.153 212 HE1 TRP 27 HE1 TRP 27 -8.331 8.909 2.894 213 HE3 TRP 27 HE3 TRP 27 -5.885 6.546 -1.226 214 HZ2 TRP 27 HZ2 TRP 27 -5.526 8.781 3.216 215 HZ3 TRP 27 HZ3 TRP 27 -3.701 6.874 -0.138 216 HH2 TRP 27 HH2 TRP 27 -3.528 7.969 2.038 217 HB2 TRP 27 1HB TRP 27 -8.837 5.820 -1.148 218 HB3 TRP 27 2HB TRP 27 -8.444 7.289 -2.036 219 H ALA 28 H ALA 28 -9.709 9.079 -2.870 220 HA ALA 28 HA ALA 28 -11.354 11.131 -2.694 221 HB1 ALA 28 3HB ALA 28 -10.374 12.536 -0.724 222 HB2 ALA 28 1HB ALA 28 -9.938 10.960 -0.065 223 HB3 ALA 28 2HB ALA 28 -11.627 11.335 -0.411 224 HA PRO 29 HA PRO 29 -7.916 12.421 -5.292 225 HB2 PRO 29 1HB PRO 29 -9.102 15.018 -5.495 226 HB3 PRO 29 2HB PRO 29 -9.073 13.739 -6.708 227 HG2 PRO 29 1HG PRO 29 -11.223 14.540 -4.883 228 HG3 PRO 29 2HG PRO 29 -11.311 13.585 -6.370 229 HD2 PRO 29 1HD PRO 29 -11.669 12.549 -3.869 230 HD3 PRO 29 2HD PRO 29 -11.082 11.600 -5.248 231 H GLU 30 H GLU 30 -9.157 14.136 -2.491 232 HA GLU 30 HA GLU 30 -7.069 16.046 -2.293 233 HB2 GLU 30 1HB GLU 30 -9.134 15.012 -0.372 234 HB3 GLU 30 2HB GLU 30 -7.852 16.068 0.194 235 HG2 GLU 30 1HG GLU 30 -9.187 17.089 -2.188 236 HG3 GLU 30 2HG GLU 30 -10.274 16.862 -0.819 237 H THR 31 H THR 31 -7.550 12.859 -0.815 238 HA THR 31 HA THR 31 -5.164 12.976 0.759 239 HB THR 31 HB THR 31 -5.739 10.260 0.307 240 HG1 THR 31 HG1 THR 31 -8.162 11.681 0.659 241 HG21 THR 31 3HG2 THR 31 -7.060 10.555 2.529 242 HG22 THR 31 1HG2 THR 31 -6.372 12.178 2.502 243 HG23 THR 31 2HG2 THR 31 -5.311 10.768 2.498 244 H VAL 32 H VAL 32 -5.947 11.461 -2.358 245 HA VAL 32 HA VAL 32 -3.629 10.129 -2.924 246 HB VAL 32 HB VAL 32 -5.121 11.819 -4.934 247 HG11 VAL 32 1HG1 VAL 32 -3.163 9.587 -5.111 248 HG12 VAL 32 2HG1 VAL 32 -3.326 11.030 -6.111 249 HG13 VAL 32 3HG1 VAL 32 -4.445 9.683 -6.318 250 HG21 VAL 32 3HG2 VAL 32 -5.797 9.192 -3.668 251 HG22 VAL 32 1HG2 VAL 32 -6.322 9.555 -5.311 252 HG23 VAL 32 2HG2 VAL 32 -6.834 10.586 -3.976 253 H ARG 33 H ARG 33 -4.157 13.573 -2.863 254 HA ARG 33 HA ARG 33 -1.947 14.429 -4.353 255 HE ARG 33 HE ARG 33 -1.786 19.992 -3.877 256 HB2 ARG 33 1HB ARG 33 -3.931 15.788 -3.401 257 HB3 ARG 33 2HB ARG 33 -2.957 15.918 -1.943 258 HG2 ARG 33 1HG ARG 33 -1.127 16.869 -3.417 259 HG3 ARG 33 2HG ARG 33 -2.351 16.987 -4.683 260 HD2 ARG 33 1HD ARG 33 -3.568 18.590 -3.541 261 HD3 ARG 33 2HD ARG 33 -2.889 18.135 -1.978 262 HH11 ARG 33 1HH1 ARG 33 -1.076 17.870 -1.198 263 HH12 ARG 33 2HH1 ARG 33 0.355 18.728 -0.736 264 HH21 ARG 33 1HH2 ARG 33 0.098 21.122 -3.272 265 HH22 ARG 33 2HH2 ARG 33 1.022 20.574 -1.913 266 H ALA 34 H ALA 34 -2.225 13.524 -0.944 267 HA ALA 34 HA ALA 34 0.357 14.384 -0.163 268 HB1 ALA 34 3HB ALA 34 -1.765 12.695 0.995 269 HB2 ALA 34 1HB ALA 34 -0.842 14.015 1.711 270 HB3 ALA 34 2HB ALA 34 -0.129 12.408 1.588 271 H ILE 35 H ILE 35 -0.862 11.210 -1.201 272 HA ILE 35 HA ILE 35 1.512 9.763 -0.909 273 HB ILE 35 HB ILE 35 0.067 9.032 -3.355 274 HG12 ILE 35 1HG1 ILE 35 -1.829 10.037 -2.160 275 HG13 ILE 35 2HG1 ILE 35 -1.989 8.286 -2.244 276 HG21 ILE 35 1HG2 ILE 35 0.293 7.417 -0.851 277 HG22 ILE 35 2HG2 ILE 35 1.700 7.707 -1.874 278 HG23 ILE 35 3HG2 ILE 35 0.288 6.880 -2.530 279 HD11 ILE 35 3HD1 ILE 35 -1.969 8.071 -0.030 280 HD12 ILE 35 1HD1 ILE 35 -2.277 9.806 0.004 281 HD13 ILE 35 2HD1 ILE 35 -0.629 9.200 0.162 282 H ALA 36 H ALA 36 0.272 11.552 -3.773 283 HA ALA 36 HA ALA 36 2.517 11.094 -5.422 284 HB1 ALA 36 3HB ALA 36 1.062 13.629 -5.795 285 HB2 ALA 36 1HB ALA 36 0.078 12.165 -5.833 286 HB3 ALA 36 2HB ALA 36 1.433 12.346 -6.948 287 H ASP 37 H ASP 37 1.884 13.357 -2.845 288 HA ASP 37 HA ASP 37 4.004 15.165 -3.521 289 HB2 ASP 37 1HB ASP 37 1.930 15.538 -1.979 290 HB3 ASP 37 2HB ASP 37 2.955 14.842 -0.728 291 H ALA 38 H ALA 38 3.821 12.140 -1.863 292 HA ALA 38 HA ALA 38 6.459 12.427 -0.678 293 HB1 ALA 38 3HB ALA 38 5.806 10.910 0.852 294 HB2 ALA 38 1HB ALA 38 4.982 9.906 -0.344 295 HB3 ALA 38 2HB ALA 38 4.185 11.344 0.299 296 H LEU 39 H LEU 39 6.694 12.393 -3.374 297 HA LEU 39 HA LEU 39 6.946 9.849 -4.570 298 HG LEU 39 HG LEU 39 6.166 13.023 -5.604 299 HB2 LEU 39 1HB LEU 39 8.398 12.407 -5.283 300 HB3 LEU 39 2HB LEU 39 8.239 10.996 -6.304 301 HD11 LEU 39 1HD1 LEU 39 6.866 13.583 -7.662 302 HD12 LEU 39 2HD1 LEU 39 5.790 12.280 -8.172 303 HD13 LEU 39 3HD1 LEU 39 7.519 11.979 -7.993 304 HD21 LEU 39 3HD2 LEU 39 5.693 10.127 -6.228 305 HD22 LEU 39 1HD2 LEU 39 4.553 11.358 -6.763 306 HD23 LEU 39 2HD2 LEU 39 4.891 11.151 -5.045 307 HA PRO 40 HA PRO 40 11.155 8.125 -4.037 308 HB2 PRO 40 1HB PRO 40 12.532 10.682 -4.789 309 HB3 PRO 40 2HB PRO 40 13.045 9.009 -5.057 310 HG2 PRO 40 1HG PRO 40 11.805 10.476 -6.969 311 HG3 PRO 40 2HG PRO 40 11.638 8.719 -6.843 312 HD2 PRO 40 1HD PRO 40 9.647 10.777 -6.399 313 HD3 PRO 40 2HD PRO 40 9.428 9.023 -6.479 314 H ILE 41 H ILE 41 11.031 7.888 -1.905 315 HA ILE 41 HA ILE 41 12.466 9.777 -0.228 316 HB ILE 41 HB ILE 41 9.559 9.073 0.218 317 HG12 ILE 41 1HG1 ILE 41 11.096 11.686 0.196 318 HG13 ILE 41 2HG1 ILE 41 9.983 11.122 -1.042 319 HG21 ILE 41 1HG2 ILE 41 11.499 10.188 2.251 320 HG22 ILE 41 2HG2 ILE 41 10.738 8.599 2.301 321 HG23 ILE 41 3HG2 ILE 41 9.754 10.052 2.464 322 HD11 ILE 41 3HD1 ILE 41 8.253 11.989 0.036 323 HD12 ILE 41 1HD1 ILE 41 9.405 12.745 1.135 324 HD13 ILE 41 2HD1 ILE 41 8.703 11.178 1.536 325 H LYS 42 H LYS 42 13.267 8.797 1.698 326 HA LYS 42 HA LYS 42 13.531 5.929 1.438 327 HB2 LYS 42 1HB LYS 42 14.913 8.046 3.021 328 HB3 LYS 42 2HB LYS 42 15.032 6.377 3.563 329 HG2 LYS 42 1HG LYS 42 15.672 5.967 1.037 330 HG3 LYS 42 2HG LYS 42 16.135 7.667 1.128 331 HD2 LYS 42 1HD LYS 42 17.051 5.810 3.273 332 HD3 LYS 42 2HD LYS 42 17.854 5.762 1.702 333 HE2 LYS 42 1HE LYS 42 19.117 7.291 2.926 334 HE3 LYS 42 2HE LYS 42 18.055 8.307 1.952 335 HZ1 LYS 42 3HZ LYS 42 18.368 8.616 4.564 336 HZ2 LYS 42 1HZ LYS 42 17.053 7.551 4.574 337 HZ3 LYS 42 2HZ LYS 42 16.940 9.027 3.755 338 H SER 43 H SER 43 12.673 4.398 2.701 339 HA SER 43 HA SER 43 11.415 5.090 5.233 340 HG SER 43 HG SER 43 9.175 3.256 2.436 341 HB2 SER 43 1HB SER 43 9.275 4.447 4.696 342 HB3 SER 43 2HB SER 43 9.771 5.139 3.158 343 H THR 44 H THR 44 11.150 3.304 6.648 344 HA THR 44 HA THR 44 12.814 0.987 5.892 345 HB THR 44 HB THR 44 11.958 1.169 8.696 346 HG1 THR 44 HG1 THR 44 12.186 3.300 8.633 347 HG21 THR 44 3HG2 THR 44 14.744 1.397 8.464 348 HG22 THR 44 1HG2 THR 44 14.228 0.268 7.211 349 HG23 THR 44 2HG2 THR 44 13.804 -0.029 8.896 350 H ALA 45 H ALA 45 11.990 -1.002 5.724 351 HA ALA 45 HA ALA 45 9.112 -1.296 5.920 352 HB1 ALA 45 3HB ALA 45 9.368 -2.617 4.156 353 HB2 ALA 45 1HB ALA 45 10.423 -3.689 5.076 354 HB3 ALA 45 2HB ALA 45 11.105 -2.311 4.223 355 H ASN 46 H ASN 46 8.001 -2.573 7.238 356 HA ASN 46 HA ASN 46 9.492 -4.028 9.325 357 HB2 ASN 46 1HB ASN 46 6.860 -2.605 9.299 358 HB3 ASN 46 2HB ASN 46 7.062 -3.975 10.387 359 HD21 ASN 46 1HD2 ASN 46 6.879 -0.924 10.645 360 HD22 ASN 46 2HD2 ASN 46 8.162 -0.542 11.737 361 H ARG 47 H ARG 47 9.503 -6.241 9.092 362 HA ARG 47 HA ARG 47 7.723 -7.457 7.176 363 HE ARG 47 HE ARG 47 8.869 -6.178 6.213 364 HB2 ARG 47 1HB ARG 47 10.222 -8.152 8.521 365 HB3 ARG 47 2HB ARG 47 9.132 -9.517 8.330 366 HG2 ARG 47 1HG ARG 47 10.556 -9.516 6.449 367 HG3 ARG 47 2HG ARG 47 8.999 -8.925 5.880 368 HD2 ARG 47 1HD ARG 47 11.168 -7.043 6.738 369 HD3 ARG 47 2HD ARG 47 11.124 -7.715 5.115 370 HH11 ARG 47 1HH1 ARG 47 11.225 -6.762 3.692 371 HH12 ARG 47 2HH1 ARG 47 10.535 -5.600 2.614 372 HH21 ARG 47 1HH2 ARG 47 7.990 -4.630 4.797 373 HH22 ARG 47 2HH2 ARG 47 8.700 -4.396 3.236 374 H TRP 48 H TRP 48 5.871 -8.517 7.600 375 HA TRP 48 HA TRP 48 5.453 -9.798 10.178 376 HD1 TRP 48 HD1 TRP 48 1.698 -9.872 9.235 377 HE1 TRP 48 HE1 TRP 48 0.236 -10.542 11.244 378 HE3 TRP 48 HE3 TRP 48 4.334 -7.565 12.958 379 HZ2 TRP 48 HZ2 TRP 48 0.205 -10.144 14.039 380 HZ3 TRP 48 HZ3 TRP 48 3.520 -7.758 15.272 381 HH2 TRP 48 HH2 TRP 48 1.498 -9.022 15.800 382 HB2 TRP 48 1HB TRP 48 4.523 -7.553 10.542 383 HB3 TRP 48 2HB TRP 48 3.534 -7.710 9.093 384 H GLY 49 H GLY 49 3.886 -11.482 10.086 385 HA2 GLY 49 1HA GLY 49 3.773 -13.139 8.006 386 HA3 GLY 49 2HA GLY 49 2.394 -12.953 9.076 387 H ASP 50 H ASP 50 3.748 -12.207 5.975 388 HA ASP 50 HA ASP 50 2.778 -11.652 3.997 389 HB2 ASP 50 1HB ASP 50 0.910 -13.113 4.585 390 HB3 ASP 50 2HB ASP 50 0.169 -11.818 5.520 391 H GLU 51 H GLU 51 1.612 -9.882 6.829 392 HA GLU 51 HA GLU 51 1.003 -7.522 5.320 393 HB2 GLU 51 1HB GLU 51 0.339 -8.486 7.847 394 HB3 GLU 51 2HB GLU 51 1.373 -7.102 8.174 395 HG2 GLU 51 1HG GLU 51 -0.784 -6.763 6.171 396 HG3 GLU 51 2HG GLU 51 -1.244 -6.879 7.870 397 H ILE 52 H ILE 52 2.186 -5.701 5.091 398 HA ILE 52 HA ILE 52 4.750 -5.466 6.462 399 HB ILE 52 HB ILE 52 4.428 -6.006 3.570 400 HG12 ILE 52 1HG1 ILE 52 7.116 -6.281 4.560 401 HG13 ILE 52 2HG1 ILE 52 6.002 -6.932 5.757 402 HG21 ILE 52 1HG2 ILE 52 5.051 -3.779 3.216 403 HG22 ILE 52 2HG2 ILE 52 6.550 -4.694 3.063 404 HG23 ILE 52 3HG2 ILE 52 6.212 -3.799 4.543 405 HD11 ILE 52 3HD1 ILE 52 5.093 -8.462 4.105 406 HD12 ILE 52 1HD1 ILE 52 6.843 -8.632 4.216 407 HD13 ILE 52 2HD1 ILE 52 6.133 -7.761 2.859 408 H TYR 53 H TYR 53 4.618 -3.531 7.370 409 HA TYR 53 HA TYR 53 3.482 -1.322 5.780 410 HD1 TYR 53 HD1 TYR 53 4.373 0.008 9.581 411 HD2 TYR 53 HD2 TYR 53 2.294 -3.687 9.166 412 HE1 TYR 53 HE1 TYR 53 5.103 -0.651 11.831 413 HE2 TYR 53 HE2 TYR 53 3.021 -4.351 11.417 414 HH TYR 53 HH TYR 53 4.016 -2.416 13.677 415 HB2 TYR 53 1HB TYR 53 2.588 -0.329 7.843 416 HB3 TYR 53 2HB TYR 53 1.939 -1.948 7.583 417 H PHE 54 H PHE 54 4.495 0.587 5.751 418 HA PHE 54 HA PHE 54 6.797 1.020 7.496 419 HD1 PHE 54 HD1 PHE 54 6.855 3.493 4.462 420 HD2 PHE 54 HD2 PHE 54 6.860 -0.606 3.326 421 HE1 PHE 54 HE1 PHE 54 6.087 4.120 2.214 422 HE2 PHE 54 HE2 PHE 54 6.089 0.013 1.077 423 HZ PHE 54 HZ PHE 54 5.701 2.378 0.516 424 HB2 PHE 54 1HB PHE 54 8.261 1.595 5.658 425 HB3 PHE 54 2HB PHE 54 7.648 -0.033 5.411 426 H THR 55 H THR 55 7.215 3.171 7.942 427 HA THR 55 HA THR 55 5.076 5.021 7.173 428 HB THR 55 HB THR 55 7.242 5.974 8.951 429 HG1 THR 55 HG1 THR 55 5.461 3.958 9.842 430 HG21 THR 55 3HG2 THR 55 4.242 5.930 9.165 431 HG22 THR 55 1HG2 THR 55 5.263 7.304 8.739 432 HG23 THR 55 2HG2 THR 55 5.326 6.629 10.367 433 H THR 56 H THR 56 5.445 7.013 6.138 434 HA THR 56 HA THR 56 8.103 7.263 4.882 435 HB THR 56 HB THR 56 6.235 8.606 3.264 436 HG1 THR 56 HG1 THR 56 5.351 5.991 3.902 437 HG21 THR 56 3HG2 THR 56 6.810 5.986 2.254 438 HG22 THR 56 1HG2 THR 56 8.260 6.710 2.951 439 HG23 THR 56 2HG2 THR 56 7.371 7.559 1.683 440 H GLN 57 H GLN 57 6.321 8.616 7.190 441 HA GLN 57 HA GLN 57 6.640 10.584 8.324 442 HB2 GLN 57 1HB GLN 57 8.005 11.850 5.958 443 HB3 GLN 57 2HB GLN 57 8.185 12.223 7.666 444 HG2 GLN 57 1HG GLN 57 8.951 9.518 7.277 445 HG3 GLN 57 2HG GLN 57 9.751 10.502 6.053 446 HE21 GLN 57 1HE2 GLN 57 10.351 9.152 8.838 447 HE22 GLN 57 2HE2 GLN 57 11.362 10.331 9.595 448 H VAL 58 H VAL 58 4.979 10.163 5.442 449 HA VAL 58 HA VAL 58 3.868 12.841 5.353 450 HB VAL 58 HB VAL 58 4.188 11.627 3.241 451 HG11 VAL 58 1HG1 VAL 58 2.020 9.754 4.175 452 HG12 VAL 58 2HG1 VAL 58 3.737 9.354 4.134 453 HG13 VAL 58 3HG1 VAL 58 2.877 9.711 2.634 454 HG21 VAL 58 3HG2 VAL 58 1.835 11.914 2.360 455 HG22 VAL 58 1HG2 VAL 58 2.536 13.314 3.171 456 HG23 VAL 58 2HG2 VAL 58 1.362 12.302 4.014 457 H ALA 59 H ALA 59 2.342 13.449 6.729 458 HA ALA 59 HA ALA 59 0.649 11.386 7.950 459 HB1 ALA 59 3HB ALA 59 0.838 14.248 8.858 460 HB2 ALA 59 1HB ALA 59 1.956 12.993 9.400 461 HB3 ALA 59 2HB ALA 59 0.234 12.850 9.747 462 H VAL 60 H VAL 60 -0.931 11.029 6.472 463 HA VAL 60 HA VAL 60 -2.743 13.301 5.953 464 HB VAL 60 HB VAL 60 -1.657 12.714 3.863 465 HG11 VAL 60 1HG1 VAL 60 -2.745 9.919 4.076 466 HG12 VAL 60 2HG1 VAL 60 -1.120 10.344 4.619 467 HG13 VAL 60 3HG1 VAL 60 -1.571 10.559 2.928 468 HG21 VAL 60 3HG2 VAL 60 -3.690 11.922 2.549 469 HG22 VAL 60 1HG2 VAL 60 -3.882 13.385 3.514 470 HG23 VAL 60 2HG2 VAL 60 -4.528 11.851 4.099 471 H GLU 61 H GLU 61 -4.425 12.962 7.321 472 HA GLU 61 HA GLU 61 -5.697 10.313 7.228 473 HB2 GLU 61 1HB GLU 61 -4.528 11.652 9.534 474 HB3 GLU 61 2HB GLU 61 -6.218 11.242 9.793 475 HG2 GLU 61 1HG GLU 61 -5.797 8.933 9.359 476 HG3 GLU 61 2HG GLU 61 -4.145 9.280 8.849 477 H LYS 62 H LYS 62 -7.832 10.331 6.946 478 HA LYS 62 HA LYS 62 -9.416 12.644 7.684 479 HB2 LYS 62 1HB LYS 62 -8.438 12.770 5.216 480 HB3 LYS 62 2HB LYS 62 -9.771 11.678 4.875 481 HG2 LYS 62 1HG LYS 62 -10.753 13.686 4.434 482 HG3 LYS 62 2HG LYS 62 -11.177 13.509 6.135 483 HD2 LYS 62 1HD LYS 62 -8.650 14.909 5.336 484 HD3 LYS 62 2HD LYS 62 -10.196 15.760 5.287 485 HE2 LYS 62 1HE LYS 62 -8.827 14.527 7.663 486 HE3 LYS 62 2HE LYS 62 -9.241 16.219 7.405 487 HZ1 LYS 62 3HZ LYS 62 -11.641 15.332 7.327 488 HZ2 LYS 62 1HZ LYS 62 -10.882 15.491 8.832 489 HZ3 LYS 62 2HZ LYS 62 -11.010 13.970 8.104 490 H GLU 63 H GLU 63 -11.802 12.183 7.359 491 HA GLU 63 HA GLU 63 -12.300 9.379 7.997 492 HB2 GLU 63 1HB GLU 63 -14.406 11.506 8.026 493 HB3 GLU 63 2HB GLU 63 -14.287 10.055 9.010 494 HG2 GLU 63 1HG GLU 63 -13.676 11.530 10.591 495 HG3 GLU 63 2HG GLU 63 -12.090 11.329 9.848 496 H GLU 64 H GLU 64 -12.127 8.456 5.943 497 HA GLU 64 HA GLU 64 -14.538 8.393 4.452 498 HB2 GLU 64 1HB GLU 64 -13.683 9.278 2.317 499 HB3 GLU 64 2HB GLU 64 -13.701 10.508 3.572 500 HG2 GLU 64 1HG GLU 64 -11.200 9.624 3.881 501 HG3 GLU 64 2HG GLU 64 -11.426 9.257 2.172 502 H ASN 65 H ASN 65 -14.579 6.630 2.945 503 HA ASN 65 HA ASN 65 -13.928 4.690 1.970 504 HB2 ASN 65 1HB ASN 65 -11.897 6.129 1.303 505 HB3 ASN 65 2HB ASN 65 -11.048 5.315 2.618 506 HD21 ASN 65 1HD2 ASN 65 -10.140 5.089 0.071 507 HD22 ASN 65 2HD2 ASN 65 -10.403 3.488 -0.520 508 H SER 66 H SER 66 -11.228 4.819 4.239 509 HA SER 66 HA SER 66 -10.535 3.032 5.595 510 HG SER 66 HG SER 66 -12.010 5.826 6.245 511 HB2 SER 66 1HB SER 66 -12.938 3.977 7.139 512 HB3 SER 66 2HB SER 66 -11.349 3.512 7.748 513 H LYS 67 H LYS 67 -11.090 1.114 4.314 514 HA LYS 67 HA LYS 67 -13.607 -0.175 5.133 515 HB2 LYS 67 1HB LYS 67 -13.065 -1.875 3.345 516 HB3 LYS 67 2HB LYS 67 -13.429 -0.263 2.763 517 HG2 LYS 67 1HG LYS 67 -11.636 -0.864 1.470 518 HG3 LYS 67 2HG LYS 67 -10.850 0.039 2.759 519 HD2 LYS 67 1HD LYS 67 -10.458 -2.161 3.917 520 HD3 LYS 67 2HD LYS 67 -11.052 -2.953 2.461 521 HE2 LYS 67 1HE LYS 67 -9.263 -2.080 1.164 522 HE3 LYS 67 2HE LYS 67 -8.762 -1.005 2.467 523 HZ1 LYS 67 3HZ LYS 67 -8.769 -3.673 3.388 524 HZ2 LYS 67 1HZ LYS 67 -7.472 -2.596 3.275 525 HZ3 LYS 67 2HZ LYS 67 -7.864 -3.583 1.963 526 H ASP 68 H ASP 68 -13.519 -2.548 5.620 527 HA ASP 68 HA ASP 68 -11.025 -3.178 7.083 528 HB2 ASP 68 1HB ASP 68 -12.529 -4.418 8.700 529 HB3 ASP 68 2HB ASP 68 -12.649 -2.662 8.730 530 H VAL 69 H VAL 69 -12.813 -4.153 4.492 531 HA VAL 69 HA VAL 69 -11.739 -6.877 4.728 532 HB VAL 69 HB VAL 69 -14.548 -6.316 3.743 533 HG11 VAL 69 1HG1 VAL 69 -12.773 -8.680 3.677 534 HG12 VAL 69 2HG1 VAL 69 -14.052 -8.186 2.568 535 HG13 VAL 69 3HG1 VAL 69 -14.463 -8.964 4.097 536 HG21 VAL 69 3HG2 VAL 69 -15.138 -6.375 5.893 537 HG22 VAL 69 1HG2 VAL 69 -13.511 -6.833 6.398 538 HG23 VAL 69 2HG2 VAL 69 -14.661 -8.071 5.894 539 H VAL 70 H VAL 70 -11.110 -7.828 2.798 540 HA VAL 70 HA VAL 70 -11.653 -6.558 0.261 541 HB VAL 70 HB VAL 70 -9.302 -6.124 -0.319 542 HG11 VAL 70 1HG1 VAL 70 -10.886 -4.390 0.669 543 HG12 VAL 70 2HG1 VAL 70 -9.166 -4.011 0.659 544 HG13 VAL 70 3HG1 VAL 70 -9.941 -4.554 2.147 545 HG21 VAL 70 3HG2 VAL 70 -8.341 -7.698 1.432 546 HG22 VAL 70 1HG2 VAL 70 -8.621 -6.402 2.599 547 HG23 VAL 70 2HG2 VAL 70 -7.529 -6.142 1.245 548 H GLU 71 H GLU 71 -10.744 -7.726 -1.573 549 HA GLU 71 HA GLU 71 -10.484 -10.571 -0.953 550 HB2 GLU 71 1HB GLU 71 -10.646 -9.502 -3.758 551 HB3 GLU 71 2HB GLU 71 -11.177 -11.053 -3.126 552 HG2 GLU 71 1HG GLU 71 -13.097 -10.172 -2.188 553 HG3 GLU 71 2HG GLU 71 -12.486 -8.522 -2.246 554 H LEU 72 H LEU 72 -8.891 -11.877 -1.816 555 HA LEU 72 HA LEU 72 -6.287 -11.114 -1.529 556 HG LEU 72 HG LEU 72 -4.740 -12.592 -3.358 557 HB2 LEU 72 1HB LEU 72 -7.005 -13.441 -1.660 558 HB3 LEU 72 2HB LEU 72 -7.396 -13.255 -3.356 559 HD11 LEU 72 1HD1 LEU 72 -5.078 -14.835 -1.371 560 HD12 LEU 72 2HD1 LEU 72 -4.575 -13.196 -0.960 561 HD13 LEU 72 3HD1 LEU 72 -3.561 -14.196 -2.002 562 HD21 LEU 72 3HD2 LEU 72 -6.318 -15.040 -3.927 563 HD22 LEU 72 1HD2 LEU 72 -4.560 -15.179 -3.918 564 HD23 LEU 72 2HD2 LEU 72 -5.347 -14.036 -5.006 565 H GLY 73 H GLY 73 -4.884 -9.860 -2.647 566 HA2 GLY 73 1HA GLY 73 -3.776 -9.486 -4.810 567 HA3 GLY 73 2HA GLY 73 -5.364 -9.532 -5.548 568 H ASP 74 H ASP 74 -6.529 -7.769 -3.427 569 HA ASP 74 HA ASP 74 -5.841 -5.300 -4.717 570 HB2 ASP 74 1HB ASP 74 -7.535 -4.355 -3.018 571 HB3 ASP 74 2HB ASP 74 -8.122 -5.463 -4.252 572 H VAL 75 H VAL 75 -5.252 -3.343 -3.631 573 HA VAL 75 HA VAL 75 -3.422 -3.832 -1.356 574 HB VAL 75 HB VAL 75 -3.282 -1.518 -3.324 575 HG11 VAL 75 1HG1 VAL 75 -2.228 -1.259 -1.039 576 HG12 VAL 75 2HG1 VAL 75 -1.164 -1.029 -2.424 577 HG13 VAL 75 3HG1 VAL 75 -1.105 -2.537 -1.510 578 HG21 VAL 75 3HG2 VAL 75 -2.773 -4.143 -3.946 579 HG22 VAL 75 1HG2 VAL 75 -1.181 -3.533 -3.493 580 HG23 VAL 75 2HG2 VAL 75 -2.099 -2.738 -4.771 581 H ALA 76 H ALA 76 -3.338 -2.174 0.372 582 HA ALA 76 HA ALA 76 -5.395 -0.130 0.307 583 HB1 ALA 76 3HB ALA 76 -6.406 -2.290 1.209 584 HB2 ALA 76 1HB ALA 76 -6.609 -0.840 2.190 585 HB3 ALA 76 2HB ALA 76 -5.388 -2.032 2.627 586 H TYR 77 H TYR 77 -5.134 1.521 1.841 587 HA TYR 77 HA TYR 77 -2.453 1.601 3.029 588 HD1 TYR 77 HD1 TYR 77 -1.410 4.244 4.070 589 HD2 TYR 77 HD2 TYR 77 -5.360 5.189 2.814 590 HE1 TYR 77 HE1 TYR 77 -1.460 6.106 5.655 591 HE2 TYR 77 HE2 TYR 77 -5.425 7.059 4.409 592 HH TYR 77 HH TYR 77 -3.870 8.509 5.608 593 HB2 TYR 77 1HB TYR 77 -2.407 3.505 1.804 594 HB3 TYR 77 2HB TYR 77 -4.158 3.562 1.653 595 H TRP 78 H TRP 78 -2.202 1.751 5.183 596 HA TRP 78 HA TRP 78 -4.465 1.391 6.885 597 HD1 TRP 78 HD1 TRP 78 -5.064 1.540 8.974 598 HE1 TRP 78 HE1 TRP 78 -5.198 0.341 11.246 599 HE3 TRP 78 HE3 TRP 78 -0.264 -0.185 9.255 600 HZ2 TRP 78 HZ2 TRP 78 -3.490 -1.148 12.932 601 HZ3 TRP 78 HZ3 TRP 78 0.407 -1.491 11.229 602 HH2 TRP 78 HH2 TRP 78 -1.174 -1.962 13.029 603 HB2 TRP 78 1HB TRP 78 -1.983 0.601 7.180 604 HB3 TRP 78 2HB TRP 78 -1.767 2.177 7.930 605 H ILE 79 H ILE 79 -5.833 2.999 7.422 606 HA ILE 79 HA ILE 79 -5.129 5.739 7.196 607 HB ILE 79 HB ILE 79 -7.551 4.262 8.089 608 HG12 ILE 79 1HG1 ILE 79 -6.750 6.226 6.004 609 HG13 ILE 79 2HG1 ILE 79 -7.709 4.759 5.858 610 HG21 ILE 79 1HG2 ILE 79 -8.656 6.337 8.820 611 HG22 ILE 79 2HG2 ILE 79 -7.107 7.175 8.733 612 HG23 ILE 79 3HG2 ILE 79 -7.339 5.869 9.894 613 HD11 ILE 79 3HD1 ILE 79 -9.335 6.295 5.499 614 HD12 ILE 79 1HD1 ILE 79 -8.546 7.527 6.486 615 HD13 ILE 79 2HD1 ILE 79 -9.436 6.213 7.256 616 HA PRO 80 HA PRO 80 -5.121 5.936 12.033 617 HB2 PRO 80 1HB PRO 80 -5.099 3.097 12.848 618 HB3 PRO 80 2HB PRO 80 -6.031 4.447 13.502 619 HG2 PRO 80 1HG PRO 80 -7.186 2.527 12.034 620 HG3 PRO 80 2HG PRO 80 -7.712 4.217 11.940 621 HD2 PRO 80 1HD PRO 80 -6.001 2.658 10.051 622 HD3 PRO 80 2HD PRO 80 -7.270 3.845 9.709 623 H GLY 81 H GLY 81 -3.006 6.408 11.007 624 HA2 GLY 81 1HA GLY 81 -0.795 5.951 12.270 625 HA3 GLY 81 2HA GLY 81 -0.949 4.364 11.529 626 H LYS 82 H LYS 82 -2.259 6.237 9.247 627 HA LYS 82 HA LYS 82 -1.529 6.915 7.173 628 HB2 LYS 82 1HB LYS 82 0.922 8.139 8.324 629 HB3 LYS 82 2HB LYS 82 -0.239 8.803 7.187 630 HG2 LYS 82 1HG LYS 82 -0.945 10.059 8.882 631 HG3 LYS 82 2HG LYS 82 -1.710 8.596 9.506 632 HD2 LYS 82 1HD LYS 82 0.534 8.114 10.628 633 HD3 LYS 82 2HD LYS 82 0.936 9.793 10.266 634 HE2 LYS 82 1HE LYS 82 -1.657 9.743 11.419 635 HE3 LYS 82 2HE LYS 82 -0.599 8.753 12.424 636 HZ1 LYS 82 3HZ LYS 82 0.481 11.311 11.566 637 HZ2 LYS 82 1HZ LYS 82 0.606 10.527 13.060 638 HZ3 LYS 82 2HZ LYS 82 -0.799 11.385 12.670 639 H ALA 83 H ALA 83 -0.681 4.315 7.933 640 HA ALA 83 HA ALA 83 1.948 4.141 6.604 641 HB1 ALA 83 3HB ALA 83 1.057 3.077 9.074 642 HB2 ALA 83 1HB ALA 83 2.629 2.879 8.302 643 HB3 ALA 83 2HB ALA 83 1.335 1.723 7.981 644 H ILE 84 H ILE 84 2.187 2.836 4.829 645 HA ILE 84 HA ILE 84 -0.248 1.767 3.631 646 HB ILE 84 HB ILE 84 2.466 1.499 2.393 647 HG12 ILE 84 1HG1 ILE 84 0.768 4.003 2.358 648 HG13 ILE 84 2HG1 ILE 84 2.350 3.839 3.108 649 HG21 ILE 84 1HG2 ILE 84 1.154 0.577 0.848 650 HG22 ILE 84 2HG2 ILE 84 0.660 2.225 0.459 651 HG23 ILE 84 3HG2 ILE 84 -0.311 1.249 1.562 652 HD11 ILE 84 3HD1 ILE 84 3.009 4.786 1.170 653 HD12 ILE 84 1HD1 ILE 84 1.615 4.181 0.274 654 HD13 ILE 84 2HD1 ILE 84 2.976 3.111 0.612 655 H CYS 85 H CYS 85 -0.541 -0.434 3.038 656 HA CYS 85 HA CYS 85 1.469 -2.336 4.010 657 HG CYS 85 HG CYS 85 -0.708 -0.550 6.008 658 HB2 CYS 85 1HB CYS 85 -1.405 -2.791 4.754 659 HB3 CYS 85 2HB CYS 85 0.042 -3.517 5.448 660 H LEU 86 H LEU 86 1.765 -4.074 2.728 661 HA LEU 86 HA LEU 86 0.069 -4.369 0.372 662 HG LEU 86 HG LEU 86 1.419 -4.238 -1.292 663 HB2 LEU 86 1HB LEU 86 2.798 -4.896 1.009 664 HB3 LEU 86 2HB LEU 86 2.063 -6.420 0.547 665 HD11 LEU 86 1HD1 LEU 86 4.185 -5.193 -1.649 666 HD12 LEU 86 2HD1 LEU 86 3.938 -3.993 -0.379 667 HD13 LEU 86 3HD1 LEU 86 3.462 -3.631 -2.038 668 HD21 LEU 86 3HD2 LEU 86 0.863 -6.415 -1.957 669 HD22 LEU 86 1HD2 LEU 86 2.432 -7.062 -1.466 670 HD23 LEU 86 2HD2 LEU 86 2.309 -6.022 -2.888 671 H PHE 87 H PHE 87 -0.725 -6.528 -0.283 672 HA PHE 87 HA PHE 87 -1.183 -8.349 1.971 673 HD1 PHE 87 HD2 PHE 87 -2.748 -7.385 3.749 674 HD2 PHE 87 HD1 PHE 87 -3.937 -5.329 0.222 675 HE1 PHE 87 HE2 PHE 87 -3.235 -5.382 5.092 676 HE2 PHE 87 HE1 PHE 87 -4.423 -3.329 1.557 677 HZ PHE 87 HZ PHE 87 -4.076 -3.345 3.993 678 HB2 PHE 87 1HB PHE 87 -3.390 -7.538 0.083 679 HB3 PHE 87 2HB PHE 87 -3.525 -8.541 1.524 680 H PHE 88 H PHE 88 -0.991 -10.424 1.501 681 HA PHE 88 HA PHE 88 -1.588 -11.544 -1.045 682 HD1 PHE 88 HD2 PHE 88 -0.006 -13.046 -3.097 683 HD2 PHE 88 HD1 PHE 88 0.904 -9.002 -2.132 684 HE1 PHE 88 HE2 PHE 88 -0.166 -12.446 -5.477 685 HE2 PHE 88 HE1 PHE 88 0.746 -8.396 -4.512 686 HZ PHE 88 HZ PHE 88 0.210 -10.118 -6.187 687 HB2 PHE 88 1HB PHE 88 1.158 -10.684 -0.508 688 HB3 PHE 88 2HB PHE 88 1.047 -12.388 -0.929 689 H GLY 89 H GLY 89 -2.280 -11.915 1.716 690 HA2 GLY 89 1HA GLY 89 -2.567 -14.589 1.979 691 HA3 GLY 89 2HA GLY 89 -0.957 -14.316 2.631 692 H LYS 90 H LYS 90 -1.584 -14.964 4.713 693 HA LYS 90 HA LYS 90 -3.774 -14.136 6.165 694 HB2 LYS 90 1HB LYS 90 -2.659 -14.887 8.096 695 HB3 LYS 90 2HB LYS 90 -2.051 -15.887 6.789 696 HG2 LYS 90 1HG LYS 90 -0.069 -15.408 7.719 697 HG3 LYS 90 2HG LYS 90 -0.209 -13.923 6.784 698 HD2 LYS 90 1HD LYS 90 -0.251 -12.708 8.650 699 HD3 LYS 90 2HD LYS 90 -1.595 -13.654 9.283 700 HE2 LYS 90 1HE LYS 90 -0.231 -15.075 10.450 701 HE3 LYS 90 2HE LYS 90 1.137 -14.822 9.369 702 HZ1 LYS 90 3HZ LYS 90 0.306 -13.293 11.699 703 HZ2 LYS 90 1HZ LYS 90 0.896 -12.392 10.393 704 HZ3 LYS 90 2HZ LYS 90 1.859 -13.591 11.097 705 H THR 91 H THR 91 -3.144 -12.955 8.435 706 HA THR 91 HA THR 91 -1.701 -10.495 8.108 707 HB THR 91 HB THR 91 -4.287 -9.610 8.889 708 HG1 THR 91 HG1 THR 91 -5.548 -10.218 7.183 709 HG21 THR 91 3HG2 THR 91 -2.497 -9.131 6.559 710 HG22 THR 91 1HG2 THR 91 -3.023 -8.018 7.822 711 HG23 THR 91 2HG2 THR 91 -4.141 -8.496 6.548 712 HA PRO 92 HA PRO 92 -1.471 -10.108 12.538 713 HB2 PRO 92 1HB PRO 92 -3.963 -8.438 12.627 714 HB3 PRO 92 2HB PRO 92 -2.438 -8.224 13.500 715 HG2 PRO 92 1HG PRO 92 -2.943 -6.766 11.346 716 HG3 PRO 92 2HG PRO 92 -1.320 -7.429 11.619 717 HD2 PRO 92 1HD PRO 92 -3.411 -8.269 9.684 718 HD3 PRO 92 2HD PRO 92 -1.645 -8.365 9.546 719 H ILE 93 H ILE 93 -4.630 -10.879 11.200 720 HA ILE 93 HA ILE 93 -4.935 -12.933 13.241 721 HB ILE 93 HB ILE 93 -7.338 -12.345 13.584 722 HG12 ILE 93 1HG1 ILE 93 -7.476 -10.861 11.550 723 HG13 ILE 93 2HG1 ILE 93 -8.170 -10.177 13.015 724 HG21 ILE 93 1HG2 ILE 93 -6.832 -10.429 15.143 725 HG22 ILE 93 2HG2 ILE 93 -5.187 -10.462 14.508 726 HG23 ILE 93 3HG2 ILE 93 -5.837 -11.872 15.344 727 HD11 ILE 93 3HD1 ILE 93 -5.836 -9.317 11.439 728 HD12 ILE 93 1HD1 ILE 93 -5.699 -9.168 13.190 729 HD13 ILE 93 2HD1 ILE 93 -7.018 -8.368 12.339 730 H SER 94 H SER 94 -4.293 -13.971 11.091 731 HA SER 94 HA SER 94 -5.912 -14.151 8.854 732 HG SER 94 HG SER 94 -3.056 -14.715 9.931 733 HB2 SER 94 1HB SER 94 -4.938 -16.778 9.432 734 HB3 SER 94 2HB SER 94 -4.336 -15.611 8.257 735 H ASP 95 H ASP 95 -5.817 -16.794 11.226 736 HA ASP 95 HA ASP 95 -7.406 -18.152 12.094 737 HB2 ASP 95 1HB ASP 95 -8.362 -16.136 13.043 738 HB3 ASP 95 2HB ASP 95 -9.205 -15.784 11.539 739 H ASP 96 H ASP 96 -9.957 -16.815 10.127 740 HA ASP 96 HA ASP 96 -9.823 -19.216 8.427 741 HB2 ASP 96 1HB ASP 96 -12.309 -18.944 8.196 742 HB3 ASP 96 2HB ASP 96 -11.769 -19.349 9.821 743 H LYS 97 H LYS 97 -10.142 -15.763 8.533 744 HA LYS 97 HA LYS 97 -10.071 -15.704 5.594 745 HB2 LYS 97 1HB LYS 97 -11.493 -13.671 7.319 746 HB3 LYS 97 2HB LYS 97 -11.493 -13.759 5.563 747 HG2 LYS 97 1HG LYS 97 -12.625 -16.000 5.793 748 HG3 LYS 97 2HG LYS 97 -12.825 -15.624 7.504 749 HD2 LYS 97 1HD LYS 97 -13.712 -13.347 6.165 750 HD3 LYS 97 2HD LYS 97 -14.338 -14.699 5.219 751 HE2 LYS 97 1HE LYS 97 -16.021 -14.579 6.729 752 HE3 LYS 97 2HE LYS 97 -14.923 -15.584 7.675 753 HZ1 LYS 97 3HZ LYS 97 -14.152 -13.650 8.841 754 HZ2 LYS 97 1HZ LYS 97 -15.841 -13.693 8.930 755 HZ3 LYS 97 2HZ LYS 97 -15.078 -12.624 7.865 756 H ILE 98 H ILE 98 -9.770 -12.918 5.348 757 HA ILE 98 HA ILE 98 -7.148 -12.518 6.636 758 HB ILE 98 HB ILE 98 -8.105 -11.729 3.887 759 HG12 ILE 98 1HG1 ILE 98 -5.622 -13.235 4.739 760 HG13 ILE 98 2HG1 ILE 98 -7.131 -14.013 4.257 761 HG21 ILE 98 1HG2 ILE 98 -5.593 -10.810 5.272 762 HG22 ILE 98 2HG2 ILE 98 -6.967 -9.800 4.829 763 HG23 ILE 98 3HG2 ILE 98 -5.983 -10.550 3.574 764 HD11 ILE 98 3HD1 ILE 98 -6.594 -13.831 2.125 765 HD12 ILE 98 1HD1 ILE 98 -5.024 -13.194 2.617 766 HD13 ILE 98 2HD1 ILE 98 -6.362 -12.086 2.285 767 H ARG 99 H ARG 99 -7.173 -10.974 8.111 768 HA ARG 99 HA ARG 99 -8.963 -8.662 7.685 769 HE ARG 99 HE ARG 99 -12.184 -10.654 11.473 770 HB2 ARG 99 1HB ARG 99 -7.972 -9.394 10.412 771 HB3 ARG 99 2HB ARG 99 -9.432 -8.532 9.953 772 HG2 ARG 99 1HG ARG 99 -10.433 -10.603 9.167 773 HG3 ARG 99 2HG ARG 99 -8.960 -11.481 9.575 774 HD2 ARG 99 1HD ARG 99 -9.472 -11.561 11.758 775 HD3 ARG 99 2HD ARG 99 -10.045 -9.892 11.779 776 HH11 ARG 99 1HH1 ARG 99 -9.946 -13.241 10.775 777 HH12 ARG 99 2HH1 ARG 99 -11.185 -14.445 10.646 778 HH21 ARG 99 1HH2 ARG 99 -13.813 -12.236 11.305 779 HH22 ARG 99 2HH2 ARG 99 -13.381 -13.875 10.947 780 HA PRO 100 HA PRO 100 -4.786 -6.867 7.425 781 HB2 PRO 100 1HB PRO 100 -5.555 -4.606 6.147 782 HB3 PRO 100 2HB PRO 100 -5.329 -6.146 5.310 783 HG2 PRO 100 1HG PRO 100 -7.865 -4.895 6.302 784 HG3 PRO 100 2HG PRO 100 -7.536 -5.651 4.729 785 HD2 PRO 100 1HD PRO 100 -8.821 -6.959 6.699 786 HD3 PRO 100 2HD PRO 100 -7.719 -7.793 5.583 787 H ALA 101 H ALA 101 -7.760 -5.365 8.581 788 HA ALA 101 HA ALA 101 -6.654 -4.446 10.990 789 HB1 ALA 101 3HB ALA 101 -5.804 -2.858 8.864 790 HB2 ALA 101 1HB ALA 101 -5.715 -2.471 10.582 791 HB3 ALA 101 2HB ALA 101 -7.097 -1.931 9.630 792 H SER 102 H SER 102 -8.125 -2.056 11.339 793 HA SER 102 HA SER 102 -10.871 -3.086 11.100 794 HG SER 102 HG SER 102 -8.639 -1.706 13.754 795 HB2 SER 102 1HB SER 102 -10.525 -0.991 13.091 796 HB3 SER 102 2HB SER 102 -11.214 -2.605 13.265 797 H ALA 103 H ALA 103 -8.838 -0.742 9.857 798 HA ALA 103 HA ALA 103 -10.998 0.626 8.605 799 HB1 ALA 103 3HB ALA 103 -10.575 2.860 9.557 800 HB2 ALA 103 1HB ALA 103 -9.481 2.126 10.731 801 HB3 ALA 103 2HB ALA 103 -11.197 1.713 10.745 802 H VAL 104 H VAL 104 -9.501 -0.283 6.928 803 HA VAL 104 HA VAL 104 -7.430 1.720 6.302 804 HB VAL 104 HB VAL 104 -6.039 0.052 5.228 805 HG11 VAL 104 1HG1 VAL 104 -6.580 -1.251 7.831 806 HG12 VAL 104 2HG1 VAL 104 -6.193 0.468 7.847 807 HG13 VAL 104 3HG1 VAL 104 -5.062 -0.685 7.138 808 HG21 VAL 104 3HG2 VAL 104 -6.537 -2.183 4.988 809 HG22 VAL 104 1HG2 VAL 104 -8.119 -1.451 4.736 810 HG23 VAL 104 2HG2 VAL 104 -7.718 -2.175 6.294 811 H ASN 105 H ASN 105 -7.300 2.501 4.272 812 HA ASN 105 HA ASN 105 -9.643 2.179 2.617 813 HB2 ASN 105 1HB ASN 105 -7.224 3.855 1.973 814 HB3 ASN 105 2HB ASN 105 -8.883 4.095 1.445 815 HD21 ASN 105 1HD2 ASN 105 -7.161 5.974 2.700 816 HD22 ASN 105 2HD2 ASN 105 -7.914 6.456 4.174 817 H VAL 106 H VAL 106 -9.674 1.636 0.407 818 HA VAL 106 HA VAL 106 -7.650 -0.287 -0.403 819 HB VAL 106 HB VAL 106 -9.362 0.070 -2.577 820 HG11 VAL 106 1HG1 VAL 106 -8.382 -1.984 -1.192 821 HG12 VAL 106 2HG1 VAL 106 -9.706 -2.147 -2.347 822 HG13 VAL 106 3HG1 VAL 106 -10.051 -2.031 -0.622 823 HG21 VAL 106 3HG2 VAL 106 -11.621 -0.235 -1.578 824 HG22 VAL 106 1HG2 VAL 106 -10.939 1.374 -1.334 825 HG23 VAL 106 2HG2 VAL 106 -10.935 0.203 -0.013 826 H ILE 107 H ILE 107 -5.832 0.768 -0.996 827 HA ILE 107 HA ILE 107 -5.942 3.215 -2.507 828 HB ILE 107 HB ILE 107 -4.292 2.694 -0.665 829 HG12 ILE 107 1HG1 ILE 107 -3.727 3.903 -3.314 830 HG13 ILE 107 2HG1 ILE 107 -3.710 4.638 -1.716 831 HG21 ILE 107 1HG2 ILE 107 -2.939 1.131 -2.858 832 HG22 ILE 107 2HG2 ILE 107 -3.682 0.444 -1.413 833 HG23 ILE 107 3HG2 ILE 107 -2.268 1.485 -1.268 834 HD11 ILE 107 3HD1 ILE 107 -1.552 3.597 -1.271 835 HD12 ILE 107 1HD1 ILE 107 -1.503 4.622 -2.706 836 HD13 ILE 107 2HD1 ILE 107 -1.581 2.868 -2.877 837 H GLY 108 H GLY 108 -6.794 0.542 -3.710 838 HA2 GLY 108 1HA GLY 108 -6.802 0.421 -6.162 839 HA3 GLY 108 2HA GLY 108 -5.082 0.763 -6.110 840 H ARG 109 H ARG 109 -4.027 -0.975 -6.816 841 HA ARG 109 HA ARG 109 -4.080 -3.396 -5.374 842 HE ARG 109 HE ARG 109 -7.827 -2.390 -9.864 843 HB2 ARG 109 1HB ARG 109 -4.750 -4.679 -7.632 844 HB3 ARG 109 2HB ARG 109 -5.899 -4.311 -6.361 845 HG2 ARG 109 1HG ARG 109 -6.635 -2.335 -7.596 846 HG3 ARG 109 2HG ARG 109 -5.463 -2.694 -8.869 847 HD2 ARG 109 1HD ARG 109 -6.587 -4.895 -9.179 848 HD3 ARG 109 2HD ARG 109 -7.824 -4.369 -8.037 849 HH11 ARG 109 1HH1 ARG 109 -8.022 -5.862 -10.151 850 HH12 ARG 109 2HH1 ARG 109 -8.973 -5.814 -11.599 851 HH21 ARG 109 1HH2 ARG 109 -9.078 -2.325 -11.767 852 HH22 ARG 109 2HH2 ARG 109 -9.571 -3.807 -12.516 853 H ILE 110 H ILE 110 -2.738 -5.113 -6.440 854 HA ILE 110 HA ILE 110 -0.410 -3.843 -7.666 855 HB ILE 110 HB ILE 110 -0.750 -6.659 -6.607 856 HG12 ILE 110 1HG1 ILE 110 1.035 -5.197 -4.994 857 HG13 ILE 110 2HG1 ILE 110 -0.331 -4.122 -5.267 858 HG21 ILE 110 1HG2 ILE 110 1.743 -5.151 -7.391 859 HG22 ILE 110 2HG2 ILE 110 1.022 -6.501 -8.267 860 HG23 ILE 110 3HG2 ILE 110 1.696 -6.753 -6.658 861 HD11 ILE 110 3HD1 ILE 110 -0.614 -5.406 -3.233 862 HD12 ILE 110 1HD1 ILE 110 -0.472 -6.913 -4.138 863 HD13 ILE 110 2HD1 ILE 110 -1.847 -5.841 -4.415 864 H VAL 111 H VAL 111 -0.247 -3.851 -9.826 865 HA VAL 111 HA VAL 111 -1.862 -5.534 -11.473 866 HB VAL 111 HB VAL 111 0.062 -4.590 -13.202 867 HG11 VAL 111 1HG1 VAL 111 -1.926 -4.101 -14.069 868 HG12 VAL 111 2HG1 VAL 111 -1.823 -2.582 -13.179 869 HG13 VAL 111 3HG1 VAL 111 -2.681 -3.956 -12.482 870 HG21 VAL 111 3HG2 VAL 111 1.044 -3.322 -11.248 871 HG22 VAL 111 1HG2 VAL 111 -0.428 -2.349 -11.255 872 HG23 VAL 111 2HG2 VAL 111 0.630 -2.358 -12.666 873 H ASN 112 H ASN 112 1.641 -5.209 -11.927 874 HA ASN 112 HA ASN 112 2.093 -8.018 -11.438 875 HB2 ASN 112 1HB ASN 112 2.869 -8.538 -13.711 876 HB3 ASN 112 2HB ASN 112 1.165 -8.092 -13.705 877 HD21 ASN 112 1HD2 ASN 112 2.998 -8.031 -15.912 878 HD22 ASN 112 2HD2 ASN 112 3.073 -6.393 -16.459 879 H SER 113 H SER 113 4.210 -8.489 -11.052 880 HA SER 113 HA SER 113 6.468 -7.180 -11.947 881 HG SER 113 HG SER 113 7.190 -4.738 -11.249 882 HB2 SER 113 1HB SER 113 5.135 -5.803 -9.684 883 HB3 SER 113 2HB SER 113 6.880 -6.014 -9.547 884 H MET 114 H MET 114 4.905 -8.698 -9.194 885 HA MET 114 HA MET 114 6.798 -10.812 -9.109 886 HB2 MET 114 1HB MET 114 7.691 -8.592 -7.781 887 HB3 MET 114 2HB MET 114 6.880 -9.471 -6.493 888 HG2 MET 114 1HG MET 114 8.914 -10.744 -8.293 889 HG3 MET 114 2HG MET 114 9.343 -9.918 -6.796 890 HE1 MET 114 3HE MET 114 8.475 -10.493 -4.530 891 HE2 MET 114 1HE MET 114 9.867 -11.558 -4.725 892 HE3 MET 114 2HE MET 114 8.377 -12.178 -4.015 893 H GLU 115 H GLU 115 4.413 -8.980 -7.233 894 HA GLU 115 HA GLU 115 2.589 -9.616 -6.034 895 HB2 GLU 115 1HB GLU 115 2.809 -11.947 -7.937 896 HB3 GLU 115 2HB GLU 115 1.478 -11.766 -6.804 897 HG2 GLU 115 1HG GLU 115 1.085 -9.492 -7.859 898 HG3 GLU 115 2HG GLU 115 2.194 -10.011 -9.128 899 H GLY 116 H GLY 116 5.394 -10.566 -5.258 900 HA2 GLY 116 1HA GLY 116 4.446 -12.440 -3.202 901 HA3 GLY 116 2HA GLY 116 5.856 -12.868 -4.153 902 H LEU 117 H LEU 117 5.161 -9.582 -3.100 903 HA LEU 117 HA LEU 117 7.718 -9.181 -2.057 904 HG LEU 117 HG LEU 117 7.338 -7.408 0.099 905 HB2 LEU 117 1HB LEU 117 6.318 -7.308 -2.686 906 HB3 LEU 117 2HB LEU 117 5.155 -7.714 -1.437 907 HD11 LEU 117 1HD1 LEU 117 7.729 -5.353 -2.065 908 HD12 LEU 117 2HD1 LEU 117 8.718 -6.803 -1.888 909 HD13 LEU 117 3HD1 LEU 117 8.697 -5.588 -0.612 910 HD21 LEU 117 3HD2 LEU 117 6.354 -5.491 0.891 911 HD22 LEU 117 1HD2 LEU 117 5.006 -6.243 0.040 912 HD23 LEU 117 2HD2 LEU 117 5.902 -4.927 -0.716 913 H LYS 118 H LYS 118 4.703 -10.082 -0.410 914 HA LYS 118 HA LYS 118 5.343 -9.866 2.207 915 HB2 LYS 118 1HB LYS 118 4.041 -12.075 2.529 916 HB3 LYS 118 2HB LYS 118 3.219 -10.684 1.843 917 HG2 LYS 118 1HG LYS 118 2.564 -12.013 0.205 918 HG3 LYS 118 2HG LYS 118 4.227 -12.033 -0.364 919 HD2 LYS 118 1HD LYS 118 3.607 -13.894 1.834 920 HD3 LYS 118 2HD LYS 118 2.819 -14.245 0.295 921 HE2 LYS 118 1HE LYS 118 5.765 -14.024 0.865 922 HE3 LYS 118 2HE LYS 118 4.871 -15.437 0.308 923 HZ1 LYS 118 3HZ LYS 118 5.613 -14.784 -1.689 924 HZ2 LYS 118 1HZ LYS 118 5.903 -13.191 -1.197 925 HZ3 LYS 118 2HZ LYS 118 4.340 -13.673 -1.631 926 H GLY 119 H GLY 119 6.967 -11.998 -0.003 927 HA2 GLY 119 1HA GLY 119 8.071 -13.633 2.141 928 HA3 GLY 119 2HA GLY 119 8.369 -13.832 0.421 929 H VAL 120 H VAL 120 8.690 -10.766 2.061 930 HA VAL 120 HA VAL 120 11.431 -10.529 1.209 931 HB VAL 120 HB VAL 120 11.277 -8.293 2.438 932 HG11 VAL 120 1HG1 VAL 120 10.793 -7.446 0.444 933 HG12 VAL 120 2HG1 VAL 120 9.144 -8.063 0.503 934 HG13 VAL 120 3HG1 VAL 120 10.449 -9.092 -0.086 935 HG21 VAL 120 3HG2 VAL 120 8.889 -7.520 2.771 936 HG22 VAL 120 1HG2 VAL 120 9.505 -8.658 3.968 937 HG23 VAL 120 2HG2 VAL 120 8.422 -9.215 2.697 938 H ALA 121 H ALA 121 13.233 -10.069 2.630 939 HA ALA 121 HA ALA 121 13.241 -11.697 4.983 940 HB1 ALA 121 3HB ALA 121 15.221 -11.444 3.513 941 HB2 ALA 121 1HB ALA 121 15.565 -11.077 5.203 942 HB3 ALA 121 2HB ALA 121 15.363 -9.767 4.041 943 H ASP 122 H ASP 122 13.344 -11.048 7.145 944 HA ASP 122 HA ASP 122 11.842 -8.903 7.948 945 HB2 ASP 122 1HB ASP 122 12.672 -9.278 10.185 946 HB3 ASP 122 2HB ASP 122 12.441 -10.826 9.378 947 H GLY 123 H GLY 123 12.098 -6.809 8.298 948 HA2 GLY 123 1HA GLY 123 13.042 -4.724 8.361 949 HA3 GLY 123 2HA GLY 123 14.434 -5.506 9.085 950 H GLU 124 H GLU 124 13.143 -4.012 6.289 951 HA GLU 124 HA GLU 124 15.784 -3.992 5.068 952 HB2 GLU 124 1HB GLU 124 13.510 -4.603 3.222 953 HB3 GLU 124 2HB GLU 124 15.223 -4.938 3.028 954 HG2 GLU 124 1HG GLU 124 13.517 -6.375 5.036 955 HG3 GLU 124 2HG GLU 124 13.696 -6.916 3.367 956 H SER 125 H SER 125 16.056 -2.316 3.495 957 HA SER 125 HA SER 125 14.758 0.084 4.163 958 HG SER 125 HG SER 125 15.820 1.003 0.917 959 HB2 SER 125 1HB SER 125 16.952 0.284 3.318 960 HB3 SER 125 2HB SER 125 16.587 -0.699 1.901 961 H VAL 126 H VAL 126 13.755 1.545 2.485 962 HA VAL 126 HA VAL 126 12.209 0.297 0.390 963 HB VAL 126 HB VAL 126 10.741 1.535 2.729 964 HG11 VAL 126 1HG1 VAL 126 8.719 0.773 1.561 965 HG12 VAL 126 2HG1 VAL 126 9.715 0.265 0.198 966 HG13 VAL 126 3HG1 VAL 126 9.618 1.972 0.633 967 HG21 VAL 126 3HG2 VAL 126 11.464 -0.586 3.447 968 HG22 VAL 126 1HG2 VAL 126 11.070 -1.326 1.895 969 HG23 VAL 126 2HG2 VAL 126 9.779 -0.773 2.962 970 H VAL 127 H VAL 127 11.947 1.742 -1.234 971 HA VAL 127 HA VAL 127 12.031 4.606 -0.544 972 HB VAL 127 HB VAL 127 13.197 5.042 -2.685 973 HG11 VAL 127 1HG1 VAL 127 15.179 4.941 -1.650 974 HG12 VAL 127 2HG1 VAL 127 15.090 3.194 -1.438 975 HG13 VAL 127 3HG1 VAL 127 14.274 4.264 -0.298 976 HG21 VAL 127 3HG2 VAL 127 12.596 2.304 -3.152 977 HG22 VAL 127 1HG2 VAL 127 14.348 2.499 -3.174 978 HG23 VAL 127 2HG2 VAL 127 13.337 3.473 -4.243 979 H VAL 128 H VAL 128 10.019 5.289 -0.833 980 HA VAL 128 HA VAL 128 8.281 4.171 -2.850 981 HB VAL 128 HB VAL 128 7.425 6.665 -1.525 982 HG11 VAL 128 1HG1 VAL 128 5.661 5.617 -2.547 983 HG12 VAL 128 2HG1 VAL 128 5.515 4.959 -0.920 984 HG13 VAL 128 3HG1 VAL 128 6.270 3.999 -2.188 985 HG21 VAL 128 3HG2 VAL 128 8.366 6.085 0.458 986 HG22 VAL 128 1HG2 VAL 128 8.441 4.371 0.051 987 HG23 VAL 128 2HG2 VAL 128 6.915 5.087 0.564 988 H GLU 129 H GLU 129 7.936 5.000 -4.883 989 HA GLU 129 HA GLU 129 8.416 7.805 -5.415 990 HB2 GLU 129 1HB GLU 129 9.885 7.253 -7.380 991 HB3 GLU 129 2HB GLU 129 10.620 6.979 -5.806 992 HG2 GLU 129 1HG GLU 129 9.640 4.541 -6.224 993 HG3 GLU 129 2HG GLU 129 9.833 5.049 -7.901 994 H ARG 130 H ARG 130 6.884 8.553 -6.763 995 HA ARG 130 HA ARG 130 4.988 6.766 -7.952 996 HE ARG 130 HE ARG 130 2.527 11.213 -9.701 997 HB2 ARG 130 1HB ARG 130 4.246 8.897 -7.080 998 HB3 ARG 130 2HB ARG 130 5.347 9.762 -8.142 999 HG2 ARG 130 1HG ARG 130 3.412 7.992 -9.480 1000 HG3 ARG 130 2HG ARG 130 2.736 9.396 -8.651 1001 HD2 ARG 130 1HD ARG 130 5.037 10.243 -10.083 1002 HD3 ARG 130 2HD ARG 130 4.038 9.282 -11.174 1003 HH11 ARG 130 1HH1 ARG 130 4.554 10.751 -12.503 1004 HH12 ARG 130 2HH1 ARG 130 3.878 12.090 -13.368 1005 HH21 ARG 130 1HH2 ARG 130 1.637 12.976 -10.836 1006 HH22 ARG 130 2HH2 ARG 130 2.223 13.354 -12.422 1007 H ALA 131 H ALA 131 6.047 5.525 -9.481 1008 HA ALA 131 HA ALA 131 7.139 4.990 -11.431 1009 HB1 ALA 131 3HB ALA 131 5.292 7.190 -12.329 1010 HB2 ALA 131 1HB ALA 131 4.942 5.464 -12.253 1011 HB3 ALA 131 2HB ALA 131 6.121 6.074 -13.414 Start of MODEL 11 1 H MET 1 H MET 1 -13.965 8.471 -18.125 2 HA MET 1 HA MET 1 -15.839 9.823 -17.764 3 HB2 MET 1 1HB MET 1 -17.057 7.169 -17.153 4 HB3 MET 1 2HB MET 1 -17.670 8.575 -16.294 5 HG2 MET 1 1HG MET 1 -17.916 9.640 -18.609 6 HG3 MET 1 2HG MET 1 -17.723 8.003 -19.231 7 HE1 MET 1 3HE MET 1 -19.785 10.296 -19.335 8 HE2 MET 1 1HE MET 1 -20.901 10.374 -17.970 9 HE3 MET 1 2HE MET 1 -21.344 9.477 -19.422 10 H GLY 2 H GLY 2 -14.179 10.688 -16.469 11 HA2 GLY 2 1HA GLY 2 -13.973 11.534 -14.212 12 HA3 GLY 2 2HA GLY 2 -14.407 9.935 -13.627 13 H GLU 3 H GLU 3 -12.165 10.330 -16.257 14 HA GLU 3 HA GLU 3 -10.115 8.981 -14.745 15 HB2 GLU 3 1HB GLU 3 -9.831 10.132 -17.518 16 HB3 GLU 3 2HB GLU 3 -8.931 8.803 -16.800 17 HG2 GLU 3 1HG GLU 3 -11.642 8.070 -16.708 18 HG3 GLU 3 2HG GLU 3 -11.355 8.744 -18.311 19 H ARG 4 H ARG 4 -7.820 10.209 -15.968 20 HA ARG 4 HA ARG 4 -6.300 11.861 -15.601 21 HE ARG 4 HE ARG 4 -5.626 14.447 -17.758 22 HB2 ARG 4 1HB ARG 4 -8.530 13.782 -15.005 23 HB3 ARG 4 2HB ARG 4 -6.981 14.099 -15.769 24 HG2 ARG 4 1HG ARG 4 -8.777 12.252 -17.212 25 HG3 ARG 4 2HG ARG 4 -9.318 13.923 -17.096 26 HD2 ARG 4 1HD ARG 4 -6.968 12.774 -18.520 27 HD3 ARG 4 2HD ARG 4 -8.116 14.000 -19.045 28 HH11 ARG 4 1HH1 ARG 4 -8.887 15.677 -17.962 29 HH12 ARG 4 2HH1 ARG 4 -8.435 17.295 -17.546 30 HH21 ARG 4 1HH2 ARG 4 -5.032 16.577 -17.212 31 HH22 ARG 4 2HH2 ARG 4 -6.247 17.808 -17.122 32 H GLY 5 H GLY 5 -7.691 10.314 -13.338 33 HA2 GLY 5 1HA GLY 5 -6.235 11.575 -11.217 34 HA3 GLY 5 2HA GLY 5 -7.971 11.761 -11.028 35 H VAL 6 H VAL 6 -8.783 9.269 -12.067 36 HA VAL 6 HA VAL 6 -8.064 7.580 -9.785 37 HB VAL 6 HB VAL 6 -10.434 7.883 -10.376 38 HG11 VAL 6 1HG1 VAL 6 -9.498 6.993 -13.000 39 HG12 VAL 6 2HG1 VAL 6 -10.918 7.943 -12.563 40 HG13 VAL 6 3HG1 VAL 6 -10.965 6.187 -12.449 41 HG21 VAL 6 3HG2 VAL 6 -9.165 5.199 -10.288 42 HG22 VAL 6 1HG2 VAL 6 -10.895 5.291 -10.618 43 HG23 VAL 6 2HG2 VAL 6 -10.244 5.978 -9.131 44 H GLU 7 H GLU 7 -5.907 7.702 -11.215 45 HA GLU 7 HA GLU 7 -5.392 5.033 -11.986 46 HB2 GLU 7 1HB GLU 7 -4.623 5.919 -14.384 47 HB3 GLU 7 2HB GLU 7 -6.213 5.234 -14.099 48 HG2 GLU 7 1HG GLU 7 -6.286 7.290 -15.432 49 HG3 GLU 7 2HG GLU 7 -7.173 7.437 -13.915 50 H MET 8 H MET 8 -4.296 6.972 -10.201 51 HA MET 8 HA MET 8 -1.710 7.623 -11.410 52 HB2 MET 8 1HB MET 8 -3.158 9.275 -10.000 53 HB3 MET 8 2HB MET 8 -2.490 8.408 -8.624 54 HG2 MET 8 1HG MET 8 -0.678 9.662 -8.727 55 HG3 MET 8 2HG MET 8 -0.337 9.028 -10.336 56 HE1 MET 8 3HE MET 8 0.594 10.521 -11.604 57 HE2 MET 8 1HE MET 8 0.863 11.961 -10.622 58 HE3 MET 8 2HE MET 8 -0.007 12.086 -12.151 59 H ARG 9 H ARG 9 -0.747 5.610 -11.458 60 HA ARG 9 HA ARG 9 -0.531 4.051 -9.029 61 HE ARG 9 HE ARG 9 4.326 2.824 -12.587 62 HB2 ARG 9 1HB ARG 9 0.374 2.343 -10.323 63 HB3 ARG 9 2HB ARG 9 -0.734 3.131 -11.434 64 HG2 ARG 9 1HG ARG 9 1.021 3.045 -12.831 65 HG3 ARG 9 2HG ARG 9 1.533 4.496 -11.965 66 HD2 ARG 9 1HD ARG 9 3.125 3.365 -10.738 67 HD3 ARG 9 2HD ARG 9 2.299 1.814 -10.905 68 HH11 ARG 9 1HH1 ARG 9 1.309 1.073 -12.722 69 HH12 ARG 9 2HH1 ARG 9 1.718 0.235 -14.182 70 HH21 ARG 9 1HH2 ARG 9 4.864 1.722 -14.507 71 HH22 ARG 9 2HH2 ARG 9 3.736 0.602 -15.195 72 H LEU 10 H LEU 10 1.298 3.608 -7.874 73 HA LEU 10 HA LEU 10 3.588 5.391 -8.370 74 HG LEU 10 HG LEU 10 1.162 4.260 -5.794 75 HB2 LEU 10 1HB LEU 10 3.636 4.619 -5.648 76 HB3 LEU 10 2HB LEU 10 3.398 6.219 -6.315 77 HD11 LEU 10 1HD1 LEU 10 0.636 5.728 -3.867 78 HD12 LEU 10 2HD1 LEU 10 2.159 6.574 -4.134 79 HD13 LEU 10 3HD1 LEU 10 2.167 4.869 -3.685 80 HD21 LEU 10 3HD2 LEU 10 -0.228 5.752 -6.704 81 HD22 LEU 10 1HD2 LEU 10 1.212 6.464 -7.431 82 HD23 LEU 10 2HD2 LEU 10 0.577 7.111 -5.919 83 H ARG 11 H ARG 11 5.655 4.563 -7.432 84 HA ARG 11 HA ARG 11 5.818 1.670 -7.896 85 HE ARG 11 HE ARG 11 10.281 0.091 -8.809 86 HB2 ARG 11 1HB ARG 11 7.276 3.794 -8.970 87 HB3 ARG 11 2HB ARG 11 8.375 3.043 -7.822 88 HG2 ARG 11 1HG ARG 11 6.931 1.616 -10.046 89 HG3 ARG 11 2HG ARG 11 8.618 2.132 -10.080 90 HD2 ARG 11 1HD ARG 11 8.362 0.683 -7.716 91 HD3 ARG 11 2HD ARG 11 7.429 -0.228 -8.904 92 HH11 ARG 11 1HH1 ARG 11 7.553 -0.555 -10.889 93 HH12 ARG 11 2HH1 ARG 11 8.497 -1.391 -12.075 94 HH21 ARG 11 1HH2 ARG 11 11.523 -1.008 -10.369 95 HH22 ARG 11 2HH2 ARG 11 10.751 -1.649 -11.780 96 H ILE 12 H ILE 12 6.898 0.323 -6.451 97 HA ILE 12 HA ILE 12 8.048 1.488 -4.043 98 HB ILE 12 HB ILE 12 5.463 0.060 -4.105 99 HG12 ILE 12 1HG1 ILE 12 6.718 1.691 -1.903 100 HG13 ILE 12 2HG1 ILE 12 5.967 2.424 -3.318 101 HG21 ILE 12 1HG2 ILE 12 5.941 -0.836 -1.741 102 HG22 ILE 12 2HG2 ILE 12 7.634 -0.792 -2.228 103 HG23 ILE 12 3HG2 ILE 12 6.483 -1.779 -3.128 104 HD11 ILE 12 3HD1 ILE 12 4.543 2.236 -1.240 105 HD12 ILE 12 1HD1 ILE 12 4.500 0.500 -1.548 106 HD13 ILE 12 2HD1 ILE 12 3.840 1.623 -2.735 107 H ARG 13 H ARG 13 10.033 0.694 -4.384 108 HA ARG 13 HA ARG 13 10.313 -2.151 -5.055 109 HE ARG 13 HE ARG 13 14.788 2.406 -6.061 110 HB2 ARG 13 1HB ARG 13 12.686 -1.601 -5.529 111 HB3 ARG 13 2HB ARG 13 11.550 -0.694 -6.518 112 HG2 ARG 13 1HG ARG 13 11.892 1.025 -4.464 113 HG3 ARG 13 2HG ARG 13 13.467 0.232 -4.489 114 HD2 ARG 13 1HD ARG 13 12.676 0.834 -7.168 115 HD3 ARG 13 2HD ARG 13 12.513 2.284 -6.180 116 HH11 ARG 13 1HH1 ARG 13 13.904 -0.828 -7.031 117 HH12 ARG 13 2HH1 ARG 13 15.536 -1.319 -7.328 118 HH21 ARG 13 1HH2 ARG 13 16.936 1.762 -6.455 119 HH22 ARG 13 2HH2 ARG 13 17.259 0.151 -7.003 120 H PHE 14 H PHE 14 11.864 -3.459 -3.999 121 HA PHE 14 HA PHE 14 12.636 -2.656 -1.290 122 HD1 PHE 14 HD2 PHE 14 9.846 -2.357 -1.430 123 HD2 PHE 14 HD1 PHE 14 11.277 -5.346 1.247 124 HE1 PHE 14 HE2 PHE 14 8.457 -1.410 0.364 125 HE2 PHE 14 HE1 PHE 14 9.885 -4.403 3.042 126 HZ PHE 14 HZ PHE 14 8.474 -2.433 2.602 127 HB2 PHE 14 1HB PHE 14 10.843 -4.886 -2.074 128 HB3 PHE 14 2HB PHE 14 12.093 -5.294 -0.906 129 H GLU 15 H GLU 15 14.588 -3.501 -0.626 130 HA GLU 15 HA GLU 15 16.585 -3.943 -2.396 131 HB2 GLU 15 1HB GLU 15 16.231 -4.581 0.460 132 HB3 GLU 15 2HB GLU 15 17.472 -5.515 -0.356 133 HG2 GLU 15 1HG GLU 15 18.093 -3.297 0.808 134 HG3 GLU 15 2HG GLU 15 18.786 -3.686 -0.764 135 H SER 16 H SER 16 14.294 -6.366 -1.338 136 HA SER 16 HA SER 16 15.655 -8.296 -3.102 137 HG SER 16 HG SER 16 16.251 -8.156 -0.047 138 HB2 SER 16 1HB SER 16 14.223 -8.896 -0.506 139 HB3 SER 16 2HB SER 16 14.911 -10.101 -1.596 140 H ALA 17 H ALA 17 13.264 -6.399 -3.456 141 HA ALA 17 HA ALA 17 11.761 -8.084 -5.133 142 HB1 ALA 17 3HB ALA 17 10.059 -8.918 -3.937 143 HB2 ALA 17 1HB ALA 17 9.873 -7.446 -2.984 144 HB3 ALA 17 2HB ALA 17 11.101 -8.634 -2.545 145 H GLU 18 H GLU 18 9.960 -7.041 -6.174 146 HA GLU 18 HA GLU 18 9.468 -4.242 -5.514 147 HB2 GLU 18 1HB GLU 18 10.021 -3.431 -7.758 148 HB3 GLU 18 2HB GLU 18 11.432 -4.119 -6.962 149 HG2 GLU 18 1HG GLU 18 11.018 -6.229 -8.226 150 HG3 GLU 18 2HG GLU 18 9.761 -5.377 -9.121 151 H CYS 19 H CYS 19 7.584 -3.350 -6.415 152 HA CYS 19 HA CYS 19 6.000 -4.801 -8.319 153 HG CYS 19 HG CYS 19 5.543 -5.145 -4.185 154 HB2 CYS 19 1HB CYS 19 4.163 -4.675 -6.168 155 HB3 CYS 19 2HB CYS 19 4.783 -6.112 -6.968 156 H GLU 20 H GLU 20 4.159 -3.615 -9.049 157 HA GLU 20 HA GLU 20 4.200 -0.805 -8.167 158 HB2 GLU 20 1HB GLU 20 2.891 -1.626 -10.720 159 HB3 GLU 20 2HB GLU 20 3.732 -0.134 -10.324 160 HG2 GLU 20 1HG GLU 20 5.830 -1.675 -10.237 161 HG3 GLU 20 2HG GLU 20 4.833 -2.749 -11.211 162 H VAL 21 H VAL 21 2.172 0.349 -8.088 163 HA VAL 21 HA VAL 21 -0.254 -1.244 -7.960 164 HB VAL 21 HB VAL 21 -0.344 -1.433 -5.753 165 HG11 VAL 21 1HG1 VAL 21 2.013 -1.530 -5.616 166 HG12 VAL 21 2HG1 VAL 21 1.468 -0.506 -4.286 167 HG13 VAL 21 3HG1 VAL 21 2.165 0.224 -5.735 168 HG21 VAL 21 3HG2 VAL 21 -1.597 0.692 -5.859 169 HG22 VAL 21 1HG2 VAL 21 -0.100 1.567 -5.538 170 HG23 VAL 21 2HG2 VAL 21 -0.759 0.469 -4.324 171 H GLU 22 H GLU 22 -2.091 -0.121 -8.391 172 HA GLU 22 HA GLU 22 -1.725 2.601 -9.357 173 HB2 GLU 22 1HB GLU 22 -3.880 0.536 -9.695 174 HB3 GLU 22 2HB GLU 22 -4.159 2.216 -10.134 175 HG2 GLU 22 1HG GLU 22 -3.016 2.017 -12.027 176 HG3 GLU 22 2HG GLU 22 -1.676 1.193 -11.228 177 H LEU 23 H LEU 23 -3.986 3.910 -9.053 178 HA LEU 23 HA LEU 23 -4.917 3.653 -6.309 179 HG LEU 23 HG LEU 23 -5.555 6.688 -6.097 180 HB2 LEU 23 1HB LEU 23 -3.056 5.048 -5.911 181 HB3 LEU 23 2HB LEU 23 -3.350 5.994 -7.353 182 HD11 LEU 23 1HD1 LEU 23 -5.679 5.618 -4.111 183 HD12 LEU 23 2HD1 LEU 23 -4.621 6.927 -3.589 184 HD13 LEU 23 3HD1 LEU 23 -3.937 5.360 -4.020 185 HD21 LEU 23 3HD2 LEU 23 -4.106 8.391 -6.653 186 HD22 LEU 23 1HD2 LEU 23 -2.764 7.686 -5.752 187 HD23 LEU 23 2HD2 LEU 23 -4.093 8.462 -4.890 188 H TYR 24 H TYR 24 -6.965 4.304 -6.026 189 HA TYR 24 HA TYR 24 -8.267 5.689 -8.283 190 HD1 TYR 24 HD1 TYR 24 -7.677 4.134 -9.558 191 HD2 TYR 24 HD2 TYR 24 -9.905 1.411 -7.164 192 HE1 TYR 24 HE1 TYR 24 -6.839 2.264 -10.916 193 HE2 TYR 24 HE2 TYR 24 -9.072 -0.466 -8.515 194 HH TYR 24 HH TYR 24 -7.245 -1.012 -9.983 195 HB2 TYR 24 1HB TYR 24 -9.592 3.674 -6.445 196 HB3 TYR 24 2HB TYR 24 -10.279 4.414 -7.886 197 H GLU 25 H GLU 25 -9.660 7.352 -7.846 198 HA GLU 25 HA GLU 25 -9.260 8.838 -5.511 199 HB2 GLU 25 1HB GLU 25 -11.513 9.033 -7.509 200 HB3 GLU 25 2HB GLU 25 -11.162 10.234 -6.273 201 HG2 GLU 25 1HG GLU 25 -9.424 11.092 -7.413 202 HG3 GLU 25 2HG GLU 25 -8.902 9.522 -8.023 203 H GLU 26 H GLU 26 -11.174 6.076 -5.805 204 HA GLU 26 HA GLU 26 -13.475 6.515 -4.426 205 HB2 GLU 26 1HB GLU 26 -13.468 4.224 -3.793 206 HB3 GLU 26 2HB GLU 26 -12.631 4.317 -5.335 207 HG2 GLU 26 1HG GLU 26 -10.473 4.304 -4.059 208 HG3 GLU 26 2HG GLU 26 -11.416 3.969 -2.608 209 H TRP 27 H TRP 27 -10.233 6.583 -3.125 210 HA TRP 27 HA TRP 27 -11.075 6.556 -0.378 211 HD1 TRP 27 HD1 TRP 27 -6.286 7.590 -0.432 212 HE1 TRP 27 HE1 TRP 27 -5.898 8.747 1.827 213 HE3 TRP 27 HE3 TRP 27 -11.050 7.389 1.414 214 HZ2 TRP 27 HZ2 TRP 27 -7.413 9.492 4.096 215 HZ3 TRP 27 HZ3 TRP 27 -11.494 8.350 3.631 216 HH2 TRP 27 HH2 TRP 27 -9.715 9.376 4.945 217 HB2 TRP 27 1HB TRP 27 -8.909 5.692 -0.730 218 HB3 TRP 27 2HB TRP 27 -8.459 7.011 -1.803 219 H ALA 28 H ALA 28 -9.610 9.011 -2.534 220 HA ALA 28 HA ALA 28 -11.275 11.072 -2.317 221 HB1 ALA 28 3HB ALA 28 -11.516 11.237 -0.029 222 HB2 ALA 28 1HB ALA 28 -10.254 12.430 -0.335 223 HB3 ALA 28 2HB ALA 28 -9.827 10.836 0.286 224 HA PRO 29 HA PRO 29 -7.913 12.457 -4.947 225 HB2 PRO 29 1HB PRO 29 -9.040 15.091 -4.937 226 HB3 PRO 29 2HB PRO 29 -9.085 13.895 -6.229 227 HG2 PRO 29 1HG PRO 29 -11.150 14.622 -4.281 228 HG3 PRO 29 2HG PRO 29 -11.312 13.763 -5.820 229 HD2 PRO 29 1HD PRO 29 -11.605 12.580 -3.375 230 HD3 PRO 29 2HD PRO 29 -11.087 11.708 -4.830 231 H GLU 30 H GLU 30 -9.060 14.193 -2.090 232 HA GLU 30 HA GLU 30 -6.995 16.029 -1.807 233 HB2 GLU 30 1HB GLU 30 -9.068 16.154 -0.516 234 HB3 GLU 30 2HB GLU 30 -8.629 14.691 0.358 235 HG2 GLU 30 1HG GLU 30 -6.504 16.566 0.555 236 HG3 GLU 30 2HG GLU 30 -8.016 17.358 0.997 237 H THR 31 H THR 31 -7.289 12.800 -0.290 238 HA THR 31 HA THR 31 -4.731 12.930 0.958 239 HB THR 31 HB THR 31 -5.314 10.205 0.525 240 HG1 THR 31 HG1 THR 31 -7.673 11.595 1.242 241 HG21 THR 31 3HG2 THR 31 -4.513 10.946 2.630 242 HG22 THR 31 1HG2 THR 31 -6.119 10.265 2.888 243 HG23 THR 31 2HG2 THR 31 -5.900 12.014 2.855 244 H VAL 32 H VAL 32 -5.848 11.503 -2.086 245 HA VAL 32 HA VAL 32 -3.652 10.171 -2.986 246 HB VAL 32 HB VAL 32 -5.472 11.993 -4.569 247 HG11 VAL 32 1HG1 VAL 32 -3.802 11.770 -6.103 248 HG12 VAL 32 2HG1 VAL 32 -4.680 10.276 -6.424 249 HG13 VAL 32 3HG1 VAL 32 -3.226 10.248 -5.424 250 HG21 VAL 32 3HG2 VAL 32 -6.204 9.519 -5.257 251 HG22 VAL 32 1HG2 VAL 32 -6.898 10.372 -3.879 252 HG23 VAL 32 2HG2 VAL 32 -5.614 9.190 -3.629 253 H ARG 33 H ARG 33 -4.052 13.643 -2.729 254 HA ARG 33 HA ARG 33 -1.871 14.422 -4.335 255 HE ARG 33 HE ARG 33 -0.661 19.157 -3.712 256 HB2 ARG 33 1HB ARG 33 -3.800 15.846 -3.354 257 HB3 ARG 33 2HB ARG 33 -2.781 15.978 -1.928 258 HG2 ARG 33 1HG ARG 33 -0.973 16.869 -3.446 259 HG3 ARG 33 2HG ARG 33 -2.203 16.963 -4.709 260 HD2 ARG 33 1HD ARG 33 -3.466 18.545 -3.492 261 HD3 ARG 33 2HD ARG 33 -2.548 18.253 -2.015 262 HH11 ARG 33 1HH1 ARG 33 -3.808 20.378 -2.823 263 HH12 ARG 33 2HH1 ARG 33 -3.373 22.036 -3.067 264 HH21 ARG 33 1HH2 ARG 33 -0.086 21.338 -4.033 265 HH22 ARG 33 2HH2 ARG 33 -1.259 22.581 -3.753 266 H ALA 34 H ALA 34 -2.123 13.569 -0.921 267 HA ALA 34 HA ALA 34 0.473 14.364 -0.148 268 HB1 ALA 34 3HB ALA 34 -0.107 12.271 1.518 269 HB2 ALA 34 1HB ALA 34 -1.706 12.816 1.017 270 HB3 ALA 34 2HB ALA 34 -0.586 13.948 1.772 271 H ILE 35 H ILE 35 -0.788 11.219 -1.210 272 HA ILE 35 HA ILE 35 1.569 9.740 -0.943 273 HB ILE 35 HB ILE 35 0.070 9.054 -3.377 274 HG12 ILE 35 1HG1 ILE 35 -1.797 10.032 -2.136 275 HG13 ILE 35 2HG1 ILE 35 -1.949 8.279 -2.195 276 HG21 ILE 35 1HG2 ILE 35 0.015 6.852 -2.269 277 HG22 ILE 35 2HG2 ILE 35 0.749 7.581 -0.842 278 HG23 ILE 35 3HG2 ILE 35 1.637 7.537 -2.364 279 HD11 ILE 35 3HD1 ILE 35 -0.634 9.546 0.156 280 HD12 ILE 35 1HD1 ILE 35 -1.526 8.030 0.043 281 HD13 ILE 35 2HD1 ILE 35 -2.393 9.565 0.020 282 H ALA 36 H ALA 36 0.314 11.497 -3.827 283 HA ALA 36 HA ALA 36 2.569 11.028 -5.455 284 HB1 ALA 36 3HB ALA 36 0.128 12.082 -5.895 285 HB2 ALA 36 1HB ALA 36 1.486 12.245 -7.008 286 HB3 ALA 36 2HB ALA 36 1.108 13.549 -5.882 287 H ASP 37 H ASP 37 1.918 13.336 -2.917 288 HA ASP 37 HA ASP 37 4.021 15.145 -3.623 289 HB2 ASP 37 1HB ASP 37 1.967 15.529 -2.064 290 HB3 ASP 37 2HB ASP 37 2.999 14.833 -0.817 291 H ALA 38 H ALA 38 3.863 12.147 -1.902 292 HA ALA 38 HA ALA 38 6.528 12.459 -0.784 293 HB1 ALA 38 3HB ALA 38 6.021 10.623 0.600 294 HB2 ALA 38 1HB ALA 38 4.691 10.107 -0.438 295 HB3 ALA 38 2HB ALA 38 4.536 11.577 0.527 296 H LEU 39 H LEU 39 6.747 12.388 -3.463 297 HA LEU 39 HA LEU 39 6.949 9.831 -4.643 298 HG LEU 39 HG LEU 39 6.215 13.005 -5.704 299 HB2 LEU 39 1HB LEU 39 8.438 12.359 -5.385 300 HB3 LEU 39 2HB LEU 39 8.253 10.941 -6.390 301 HD11 LEU 39 1HD1 LEU 39 7.567 11.936 -8.078 302 HD12 LEU 39 2HD1 LEU 39 6.903 13.542 -7.772 303 HD13 LEU 39 3HD1 LEU 39 5.838 12.227 -8.273 304 HD21 LEU 39 3HD2 LEU 39 5.013 11.041 -5.100 305 HD22 LEU 39 1HD2 LEU 39 5.662 10.143 -6.467 306 HD23 LEU 39 2HD2 LEU 39 4.513 11.447 -6.740 307 HA PRO 40 HA PRO 40 11.132 8.047 -4.126 308 HB2 PRO 40 1HB PRO 40 12.547 10.567 -4.925 309 HB3 PRO 40 2HB PRO 40 13.024 8.883 -5.181 310 HG2 PRO 40 1HG PRO 40 11.793 10.350 -7.097 311 HG3 PRO 40 2HG PRO 40 11.589 8.598 -6.946 312 HD2 PRO 40 1HD PRO 40 9.652 10.710 -6.499 313 HD3 PRO 40 2HD PRO 40 9.390 8.960 -6.567 314 H ILE 41 H ILE 41 10.929 7.883 -1.975 315 HA ILE 41 HA ILE 41 12.435 9.772 -0.348 316 HB ILE 41 HB ILE 41 9.521 9.116 0.101 317 HG12 ILE 41 1HG1 ILE 41 11.123 11.690 0.093 318 HG13 ILE 41 2HG1 ILE 41 9.965 11.170 -1.125 319 HG21 ILE 41 1HG2 ILE 41 9.753 10.120 2.361 320 HG22 ILE 41 2HG2 ILE 41 11.504 10.093 2.157 321 HG23 ILE 41 3HG2 ILE 41 10.600 8.583 2.190 322 HD11 ILE 41 3HD1 ILE 41 8.651 11.196 1.390 323 HD12 ILE 41 1HD1 ILE 41 8.351 12.204 -0.025 324 HD13 ILE 41 2HD1 ILE 41 9.516 12.719 1.193 325 H LYS 42 H LYS 42 13.205 8.833 1.617 326 HA LYS 42 HA LYS 42 13.487 5.962 1.408 327 HB2 LYS 42 1HB LYS 42 14.937 8.145 2.694 328 HB3 LYS 42 2HB LYS 42 14.825 6.710 3.703 329 HG2 LYS 42 1HG LYS 42 16.310 5.604 2.473 330 HG3 LYS 42 2HG LYS 42 15.539 6.081 0.959 331 HD2 LYS 42 1HD LYS 42 17.463 7.230 0.663 332 HD3 LYS 42 2HD LYS 42 16.658 8.427 1.680 333 HE2 LYS 42 1HE LYS 42 18.544 6.279 2.641 334 HE3 LYS 42 2HE LYS 42 18.946 7.983 2.434 335 HZ1 LYS 42 3HZ LYS 42 17.426 6.676 4.536 336 HZ2 LYS 42 1HZ LYS 42 16.820 8.170 4.016 337 HZ3 LYS 42 2HZ LYS 42 18.403 8.055 4.603 338 H SER 43 H SER 43 12.683 4.452 2.733 339 HA SER 43 HA SER 43 11.320 5.207 5.190 340 HG SER 43 HG SER 43 9.434 2.447 3.868 341 HB2 SER 43 1HB SER 43 9.226 4.433 4.623 342 HB3 SER 43 2HB SER 43 9.736 5.102 3.078 343 H THR 44 H THR 44 11.113 3.481 6.687 344 HA THR 44 HA THR 44 12.871 1.199 6.053 345 HB THR 44 HB THR 44 11.978 1.503 8.840 346 HG1 THR 44 HG1 THR 44 12.518 3.496 9.096 347 HG21 THR 44 3HG2 THR 44 14.260 0.528 7.426 348 HG22 THR 44 1HG2 THR 44 13.830 0.334 9.127 349 HG23 THR 44 2HG2 THR 44 14.766 1.736 8.610 350 H ALA 45 H ALA 45 12.074 -0.753 5.805 351 HA ALA 45 HA ALA 45 9.228 -1.176 6.084 352 HB1 ALA 45 3HB ALA 45 10.428 -3.556 5.228 353 HB2 ALA 45 1HB ALA 45 11.334 -2.253 4.467 354 HB3 ALA 45 2HB ALA 45 9.589 -2.360 4.245 355 H ASN 46 H ASN 46 8.194 -2.442 7.451 356 HA ASN 46 HA ASN 46 9.755 -3.831 9.528 357 HB2 ASN 46 1HB ASN 46 7.154 -2.368 9.547 358 HB3 ASN 46 2HB ASN 46 7.316 -3.754 10.624 359 HD21 ASN 46 1HD2 ASN 46 7.024 -0.943 11.274 360 HD22 ASN 46 2HD2 ASN 46 8.404 -0.516 12.220 361 H ARG 47 H ARG 47 9.713 -6.062 9.421 362 HA ARG 47 HA ARG 47 7.963 -7.292 7.502 363 HE ARG 47 HE ARG 47 7.780 -9.922 7.641 364 HB2 ARG 47 1HB ARG 47 10.394 -8.001 8.920 365 HB3 ARG 47 2HB ARG 47 9.265 -9.347 8.833 366 HG2 ARG 47 1HG ARG 47 9.561 -7.891 6.318 367 HG3 ARG 47 2HG ARG 47 11.048 -8.633 6.886 368 HD2 ARG 47 1HD ARG 47 9.205 -9.898 5.391 369 HD3 ARG 47 2HD ARG 47 10.319 -10.711 6.485 370 HH11 ARG 47 1HH1 ARG 47 9.619 -12.447 6.074 371 HH12 ARG 47 2HH1 ARG 47 8.629 -13.724 6.695 372 HH21 ARG 47 1HH2 ARG 47 6.484 -11.610 8.460 373 HH22 ARG 47 2HH2 ARG 47 6.850 -13.250 8.045 374 H TRP 48 H TRP 48 6.260 -8.606 7.806 375 HA TRP 48 HA TRP 48 5.508 -9.568 10.426 376 HD1 TRP 48 HD1 TRP 48 1.874 -9.813 9.230 377 HE1 TRP 48 HE1 TRP 48 0.282 -10.244 11.205 378 HE3 TRP 48 HE3 TRP 48 4.209 -6.978 12.787 379 HZ2 TRP 48 HZ2 TRP 48 0.048 -9.482 13.914 380 HZ3 TRP 48 HZ3 TRP 48 3.235 -6.883 15.045 381 HH2 TRP 48 HH2 TRP 48 1.197 -8.109 15.595 382 HB2 TRP 48 1HB TRP 48 4.568 -7.277 10.404 383 HB3 TRP 48 2HB TRP 48 3.693 -7.661 8.925 384 H GLY 49 H GLY 49 3.948 -11.253 10.319 385 HA2 GLY 49 1HA GLY 49 4.061 -13.117 8.432 386 HA3 GLY 49 2HA GLY 49 2.567 -12.821 9.303 387 H ASP 50 H ASP 50 4.269 -12.471 6.315 388 HA ASP 50 HA ASP 50 3.648 -11.844 4.218 389 HB2 ASP 50 1HB ASP 50 0.857 -12.617 5.038 390 HB3 ASP 50 2HB ASP 50 1.585 -12.720 3.438 391 H GLU 51 H GLU 51 3.412 -9.832 6.395 392 HA GLU 51 HA GLU 51 1.739 -7.925 4.925 393 HB2 GLU 51 1HB GLU 51 0.770 -8.931 7.191 394 HB3 GLU 51 2HB GLU 51 1.824 -7.715 7.900 395 HG2 GLU 51 1HG GLU 51 -0.022 -6.899 5.718 396 HG3 GLU 51 2HG GLU 51 -0.683 -7.192 7.326 397 H ILE 52 H ILE 52 2.620 -5.896 4.736 398 HA ILE 52 HA ILE 52 5.032 -5.326 6.306 399 HB ILE 52 HB ILE 52 5.113 -6.100 3.610 400 HG12 ILE 52 1HG1 ILE 52 7.558 -5.381 3.867 401 HG13 ILE 52 2HG1 ILE 52 7.108 -4.832 5.477 402 HG21 ILE 52 1HG2 ILE 52 4.432 -3.901 2.883 403 HG22 ILE 52 2HG2 ILE 52 6.128 -4.167 2.484 404 HG23 ILE 52 3HG2 ILE 52 5.697 -3.156 3.862 405 HD11 ILE 52 3HD1 ILE 52 8.117 -7.036 5.534 406 HD12 ILE 52 1HD1 ILE 52 6.877 -7.655 4.450 407 HD13 ILE 52 2HD1 ILE 52 6.440 -7.103 6.068 408 H TYR 53 H TYR 53 4.843 -3.441 7.258 409 HA TYR 53 HA TYR 53 3.408 -1.283 5.865 410 HD1 TYR 53 HD1 TYR 53 4.268 -0.245 9.775 411 HD2 TYR 53 HD2 TYR 53 2.356 -3.977 9.037 412 HE1 TYR 53 HE1 TYR 53 5.036 -1.065 11.960 413 HE2 TYR 53 HE2 TYR 53 3.121 -4.805 11.221 414 HH TYR 53 HH TYR 53 3.808 -3.810 13.431 415 HB2 TYR 53 1HB TYR 53 2.476 -0.516 8.024 416 HB3 TYR 53 2HB TYR 53 1.925 -2.136 7.609 417 H PHE 54 H PHE 54 4.523 0.530 5.664 418 HA PHE 54 HA PHE 54 6.672 1.108 7.574 419 HD1 PHE 54 HD1 PHE 54 6.770 3.544 4.527 420 HD2 PHE 54 HD2 PHE 54 7.048 -0.552 3.413 421 HE1 PHE 54 HE1 PHE 54 6.098 4.124 2.238 422 HE2 PHE 54 HE2 PHE 54 6.370 0.022 1.122 423 HZ PHE 54 HZ PHE 54 5.896 2.363 0.530 424 HB2 PHE 54 1HB PHE 54 8.215 1.691 5.805 425 HB3 PHE 54 2HB PHE 54 7.649 0.048 5.545 426 H THR 55 H THR 55 7.098 3.288 7.934 427 HA THR 55 HA THR 55 4.944 5.094 7.098 428 HB THR 55 HB THR 55 7.155 6.026 8.868 429 HG1 THR 55 HG1 THR 55 5.207 4.132 9.675 430 HG21 THR 55 3HG2 THR 55 4.250 6.497 8.580 431 HG22 THR 55 1HG2 THR 55 5.565 7.636 8.864 432 HG23 THR 55 2HG2 THR 55 4.952 6.647 10.190 433 H THR 56 H THR 56 5.352 7.110 6.076 434 HA THR 56 HA THR 56 7.983 7.266 4.749 435 HB THR 56 HB THR 56 6.121 8.597 3.129 436 HG1 THR 56 HG1 THR 56 4.384 7.411 3.079 437 HG21 THR 56 3HG2 THR 56 7.379 7.535 1.657 438 HG22 THR 56 1HG2 THR 56 6.503 6.053 2.037 439 HG23 THR 56 2HG2 THR 56 7.991 6.444 2.903 440 H GLN 57 H GLN 57 6.354 8.694 7.076 441 HA GLN 57 HA GLN 57 6.748 10.689 8.138 442 HB2 GLN 57 1HB GLN 57 7.925 11.909 5.648 443 HB3 GLN 57 2HB GLN 57 8.223 12.326 7.331 444 HG2 GLN 57 1HG GLN 57 8.988 9.619 6.948 445 HG3 GLN 57 2HG GLN 57 9.688 10.583 5.649 446 HE21 GLN 57 1HE2 GLN 57 11.080 9.263 7.773 447 HE22 GLN 57 2HE2 GLN 57 11.905 10.484 8.678 448 H VAL 58 H VAL 58 4.909 10.186 5.369 449 HA VAL 58 HA VAL 58 3.729 12.841 5.345 450 HB VAL 58 HB VAL 58 3.967 11.631 3.213 451 HG11 VAL 58 1HG1 VAL 58 3.585 9.352 4.170 452 HG12 VAL 58 2HG1 VAL 58 2.704 9.681 2.676 453 HG13 VAL 58 3HG1 VAL 58 1.863 9.729 4.226 454 HG21 VAL 58 3HG2 VAL 58 1.192 12.287 4.159 455 HG22 VAL 58 1HG2 VAL 58 1.541 11.852 2.486 456 HG23 VAL 58 2HG2 VAL 58 2.292 13.278 3.202 457 H ALA 59 H ALA 59 2.306 13.381 6.867 458 HA ALA 59 HA ALA 59 0.655 11.247 8.041 459 HB1 ALA 59 3HB ALA 59 2.211 12.585 9.530 460 HB2 ALA 59 1HB ALA 59 0.527 12.462 10.045 461 HB3 ALA 59 2HB ALA 59 1.110 13.943 9.284 462 H VAL 60 H VAL 60 -1.082 11.188 6.693 463 HA VAL 60 HA VAL 60 -2.752 13.621 6.650 464 HB VAL 60 HB VAL 60 -2.003 13.254 4.395 465 HG11 VAL 60 1HG1 VAL 60 -2.167 11.190 3.213 466 HG12 VAL 60 2HG1 VAL 60 -3.057 10.434 4.530 467 HG13 VAL 60 3HG1 VAL 60 -1.359 10.863 4.745 468 HG21 VAL 60 3HG2 VAL 60 -4.812 12.183 4.663 469 HG22 VAL 60 1HG2 VAL 60 -4.103 12.889 3.213 470 HG23 VAL 60 2HG2 VAL 60 -4.359 13.887 4.643 471 H GLU 61 H GLU 61 -4.289 13.256 8.153 472 HA GLU 61 HA GLU 61 -5.534 10.584 8.223 473 HB2 GLU 61 1HB GLU 61 -4.998 12.621 10.353 474 HB3 GLU 61 2HB GLU 61 -6.309 11.469 10.558 475 HG2 GLU 61 1HG GLU 61 -4.606 10.369 11.602 476 HG3 GLU 61 2HG GLU 61 -4.460 9.714 9.971 477 H LYS 62 H LYS 62 -7.569 10.399 7.599 478 HA LYS 62 HA LYS 62 -9.390 12.667 7.888 479 HB2 LYS 62 1HB LYS 62 -8.553 12.830 5.599 480 HB3 LYS 62 2HB LYS 62 -8.959 11.145 5.306 481 HG2 LYS 62 1HG LYS 62 -11.310 11.630 5.492 482 HG3 LYS 62 2HG LYS 62 -10.963 13.300 5.947 483 HD2 LYS 62 1HD LYS 62 -9.962 13.703 3.766 484 HD3 LYS 62 2HD LYS 62 -10.236 12.021 3.311 485 HE2 LYS 62 1HE LYS 62 -12.728 12.914 4.136 486 HE3 LYS 62 2HE LYS 62 -12.052 14.283 3.256 487 HZ1 LYS 62 3HZ LYS 62 -11.858 11.612 2.061 488 HZ2 LYS 62 1HZ LYS 62 -11.992 13.122 1.307 489 HZ3 LYS 62 2HZ LYS 62 -13.350 12.407 2.017 490 H GLU 63 H GLU 63 -11.716 11.952 7.506 491 HA GLU 63 HA GLU 63 -12.030 9.170 8.423 492 HB2 GLU 63 1HB GLU 63 -14.180 9.944 9.450 493 HB3 GLU 63 2HB GLU 63 -12.736 10.638 10.169 494 HG2 GLU 63 1HG GLU 63 -14.270 12.098 8.049 495 HG3 GLU 63 2HG GLU 63 -14.746 12.161 9.742 496 H GLU 64 H GLU 64 -12.251 8.225 6.417 497 HA GLU 64 HA GLU 64 -14.855 8.238 5.306 498 HB2 GLU 64 1HB GLU 64 -14.463 10.166 4.102 499 HB3 GLU 64 2HB GLU 64 -12.737 9.870 3.983 500 HG2 GLU 64 1HG GLU 64 -12.960 8.515 2.136 501 HG3 GLU 64 2HG GLU 64 -14.636 8.113 2.501 502 H ASN 65 H ASN 65 -15.091 6.638 3.580 503 HA ASN 65 HA ASN 65 -14.671 4.635 2.591 504 HB2 ASN 65 1HB ASN 65 -12.817 5.834 1.501 505 HB3 ASN 65 2HB ASN 65 -11.768 5.470 2.871 506 HD21 ASN 65 1HD2 ASN 65 -11.964 4.722 -0.121 507 HD22 ASN 65 2HD2 ASN 65 -11.659 3.021 -0.115 508 H SER 66 H SER 66 -11.721 4.682 4.507 509 HA SER 66 HA SER 66 -10.852 2.978 5.832 510 HG SER 66 HG SER 66 -10.385 3.922 7.813 511 HB2 SER 66 1HB SER 66 -13.115 4.360 7.169 512 HB3 SER 66 2HB SER 66 -12.475 2.926 7.972 513 H LYS 67 H LYS 67 -11.253 1.097 4.429 514 HA LYS 67 HA LYS 67 -13.608 -0.481 5.232 515 HB2 LYS 67 1HB LYS 67 -13.046 -1.969 3.291 516 HB3 LYS 67 2HB LYS 67 -13.516 -0.341 2.846 517 HG2 LYS 67 1HG LYS 67 -11.743 -0.776 1.449 518 HG3 LYS 67 2HG LYS 67 -10.972 0.119 2.753 519 HD2 LYS 67 1HD LYS 67 -10.404 -2.124 3.780 520 HD3 LYS 67 2HD LYS 67 -10.960 -2.854 2.278 521 HE2 LYS 67 1HE LYS 67 -9.279 -1.681 1.029 522 HE3 LYS 67 2HE LYS 67 -8.792 -0.773 2.457 523 HZ1 LYS 67 3HZ LYS 67 -7.498 -2.433 3.135 524 HZ2 LYS 67 1HZ LYS 67 -7.677 -3.096 1.591 525 HZ3 LYS 67 2HZ LYS 67 -8.678 -3.608 2.853 526 H ASP 68 H ASP 68 -13.373 -2.748 5.740 527 HA ASP 68 HA ASP 68 -10.709 -3.363 6.862 528 HB2 ASP 68 1HB ASP 68 -12.026 -4.756 8.550 529 HB3 ASP 68 2HB ASP 68 -12.112 -3.005 8.720 530 H VAL 69 H VAL 69 -12.883 -4.318 4.509 531 HA VAL 69 HA VAL 69 -11.764 -7.046 4.559 532 HB VAL 69 HB VAL 69 -14.259 -6.888 5.121 533 HG11 VAL 69 1HG1 VAL 69 -14.403 -5.337 2.878 534 HG12 VAL 69 2HG1 VAL 69 -15.770 -6.151 3.638 535 HG13 VAL 69 3HG1 VAL 69 -14.942 -6.904 2.275 536 HG21 VAL 69 3HG2 VAL 69 -14.664 -8.788 3.275 537 HG22 VAL 69 1HG2 VAL 69 -13.692 -9.041 4.726 538 HG23 VAL 69 2HG2 VAL 69 -12.907 -8.668 3.191 539 H VAL 70 H VAL 70 -11.033 -7.887 2.661 540 HA VAL 70 HA VAL 70 -11.595 -6.621 0.129 541 HB VAL 70 HB VAL 70 -9.264 -6.084 -0.431 542 HG11 VAL 70 1HG1 VAL 70 -10.107 -4.618 2.050 543 HG12 VAL 70 2HG1 VAL 70 -10.858 -4.393 0.472 544 HG13 VAL 70 3HG1 VAL 70 -9.156 -3.997 0.701 545 HG21 VAL 70 3HG2 VAL 70 -8.202 -7.626 1.249 546 HG22 VAL 70 1HG2 VAL 70 -8.609 -6.439 2.490 547 HG23 VAL 70 2HG2 VAL 70 -7.512 -6.004 1.187 548 H GLU 71 H GLU 71 -10.675 -7.763 -1.701 549 HA GLU 71 HA GLU 71 -10.279 -10.592 -1.059 550 HB2 GLU 71 1HB GLU 71 -10.614 -9.567 -3.866 551 HB3 GLU 71 2HB GLU 71 -11.028 -11.138 -3.198 552 HG2 GLU 71 1HG GLU 71 -12.954 -10.358 -2.190 553 HG3 GLU 71 2HG GLU 71 -12.438 -8.677 -2.276 554 H LEU 72 H LEU 72 -8.666 -11.837 -1.935 555 HA LEU 72 HA LEU 72 -6.088 -11.016 -1.764 556 HG LEU 72 HG LEU 72 -4.595 -12.362 -3.741 557 HB2 LEU 72 1HB LEU 72 -6.675 -13.356 -1.921 558 HB3 LEU 72 2HB LEU 72 -7.238 -13.154 -3.567 559 HD11 LEU 72 1HD1 LEU 72 -4.636 -14.854 -2.064 560 HD12 LEU 72 2HD1 LEU 72 -4.368 -13.254 -1.372 561 HD13 LEU 72 3HD1 LEU 72 -3.248 -13.897 -2.573 562 HD21 LEU 72 3HD2 LEU 72 -4.278 -14.538 -4.853 563 HD22 LEU 72 1HD2 LEU 72 -5.762 -13.729 -5.355 564 HD23 LEU 72 2HD2 LEU 72 -5.833 -15.070 -4.213 565 H GLY 73 H GLY 73 -4.725 -9.746 -2.903 566 HA2 GLY 73 1HA GLY 73 -3.721 -9.286 -5.100 567 HA3 GLY 73 2HA GLY 73 -5.341 -9.307 -5.764 568 H ASP 74 H ASP 74 -6.416 -7.637 -3.537 569 HA ASP 74 HA ASP 74 -5.751 -5.112 -4.739 570 HB2 ASP 74 1HB ASP 74 -7.427 -4.251 -2.963 571 HB3 ASP 74 2HB ASP 74 -8.025 -5.266 -4.271 572 H VAL 75 H VAL 75 -5.157 -3.210 -3.588 573 HA VAL 75 HA VAL 75 -3.379 -3.757 -1.279 574 HB VAL 75 HB VAL 75 -3.053 -1.525 -3.317 575 HG11 VAL 75 1HG1 VAL 75 -2.079 -1.217 -1.004 576 HG12 VAL 75 2HG1 VAL 75 -0.954 -1.090 -2.356 577 HG13 VAL 75 3HG1 VAL 75 -0.996 -2.559 -1.381 578 HG21 VAL 75 3HG2 VAL 75 -1.890 -2.863 -4.669 579 HG22 VAL 75 1HG2 VAL 75 -2.635 -4.201 -3.796 580 HG23 VAL 75 2HG2 VAL 75 -1.037 -3.623 -3.326 581 H ALA 76 H ALA 76 -3.282 -2.049 0.413 582 HA ALA 76 HA ALA 76 -5.198 0.111 0.198 583 HB1 ALA 76 3HB ALA 76 -5.632 -2.250 1.952 584 HB2 ALA 76 1HB ALA 76 -6.797 -1.286 1.049 585 HB3 ALA 76 2HB ALA 76 -6.107 -0.662 2.545 586 H TYR 77 H TYR 77 -4.942 1.760 1.769 587 HA TYR 77 HA TYR 77 -2.352 1.591 3.167 588 HD1 TYR 77 HD1 TYR 77 -2.043 4.805 4.622 589 HD2 TYR 77 HD2 TYR 77 -5.240 4.858 1.817 590 HE1 TYR 77 HE1 TYR 77 -3.036 6.727 5.795 591 HE2 TYR 77 HE2 TYR 77 -6.235 6.776 2.982 592 HH TYR 77 HH TYR 77 -5.806 7.627 5.833 593 HB2 TYR 77 1HB TYR 77 -1.884 3.652 2.429 594 HB3 TYR 77 2HB TYR 77 -3.302 3.525 1.398 595 H TRP 78 H TRP 78 -2.237 1.779 5.318 596 HA TRP 78 HA TRP 78 -4.599 1.579 6.879 597 HD1 TRP 78 HD1 TRP 78 -5.263 1.943 9.029 598 HE1 TRP 78 HE1 TRP 78 -5.595 0.696 11.254 599 HE3 TRP 78 HE3 TRP 78 -0.689 -0.304 9.381 600 HZ2 TRP 78 HZ2 TRP 78 -4.111 -1.022 12.936 601 HZ3 TRP 78 HZ3 TRP 78 -0.222 -1.735 11.329 602 HH2 TRP 78 HH2 TRP 78 -1.899 -2.085 13.068 603 HB2 TRP 78 1HB TRP 78 -2.149 0.742 7.349 604 HB3 TRP 78 2HB TRP 78 -1.962 2.326 8.091 605 H ILE 79 H ILE 79 -5.906 3.180 7.538 606 HA ILE 79 HA ILE 79 -5.247 5.911 7.109 607 HB ILE 79 HB ILE 79 -7.596 4.477 8.276 608 HG12 ILE 79 1HG1 ILE 79 -6.855 5.630 5.779 609 HG13 ILE 79 2HG1 ILE 79 -8.325 4.758 6.190 610 HG21 ILE 79 1HG2 ILE 79 -8.710 6.644 8.715 611 HG22 ILE 79 2HG2 ILE 79 -7.156 7.448 8.491 612 HG23 ILE 79 3HG2 ILE 79 -7.374 6.308 9.819 613 HD11 ILE 79 3HD1 ILE 79 -8.588 7.068 5.191 614 HD12 ILE 79 1HD1 ILE 79 -8.007 7.694 6.732 615 HD13 ILE 79 2HD1 ILE 79 -9.491 6.739 6.667 616 HA PRO 80 HA PRO 80 -5.110 6.432 11.906 617 HB2 PRO 80 1HB PRO 80 -5.167 4.142 13.408 618 HB3 PRO 80 2HB PRO 80 -6.601 5.098 13.024 619 HG2 PRO 80 1HG PRO 80 -5.573 2.613 11.709 620 HG3 PRO 80 2HG PRO 80 -7.239 3.040 12.147 621 HD2 PRO 80 1HD PRO 80 -6.348 3.267 9.626 622 HD3 PRO 80 2HD PRO 80 -7.496 4.430 10.313 623 H GLY 81 H GLY 81 -2.990 6.666 10.722 624 HA2 GLY 81 1HA GLY 81 -0.791 6.248 12.073 625 HA3 GLY 81 2HA GLY 81 -1.004 4.622 11.439 626 H LYS 82 H LYS 82 -2.246 6.335 9.013 627 HA LYS 82 HA LYS 82 -1.487 6.857 6.907 628 HB2 LYS 82 1HB LYS 82 1.023 8.103 7.655 629 HB3 LYS 82 2HB LYS 82 -0.406 8.811 6.920 630 HG2 LYS 82 1HG LYS 82 -0.647 9.968 8.799 631 HG3 LYS 82 2HG LYS 82 -1.140 8.460 9.571 632 HD2 LYS 82 1HD LYS 82 1.533 8.187 9.691 633 HD3 LYS 82 2HD LYS 82 1.402 9.947 9.762 634 HE2 LYS 82 1HE LYS 82 -0.482 8.500 11.488 635 HE3 LYS 82 2HE LYS 82 1.216 8.284 11.908 636 HZ1 LYS 82 3HZ LYS 82 1.124 10.918 11.537 637 HZ2 LYS 82 1HZ LYS 82 0.871 10.179 13.037 638 HZ3 LYS 82 2HZ LYS 82 -0.451 10.651 12.093 639 H ALA 83 H ALA 83 -0.647 4.308 7.988 640 HA ALA 83 HA ALA 83 1.950 3.957 6.648 641 HB1 ALA 83 3HB ALA 83 0.729 2.746 9.027 642 HB2 ALA 83 1HB ALA 83 2.427 2.986 8.618 643 HB3 ALA 83 2HB ALA 83 1.546 1.609 7.956 644 H ILE 84 H ILE 84 2.084 2.771 4.838 645 HA ILE 84 HA ILE 84 -0.366 1.650 3.731 646 HB ILE 84 HB ILE 84 2.332 1.639 2.397 647 HG12 ILE 84 1HG1 ILE 84 0.280 3.865 2.407 648 HG13 ILE 84 2HG1 ILE 84 1.882 3.935 3.132 649 HG21 ILE 84 1HG2 ILE 84 -0.428 1.048 1.622 650 HG22 ILE 84 2HG2 ILE 84 1.093 0.495 0.921 651 HG23 ILE 84 3HG2 ILE 84 0.442 2.075 0.484 652 HD11 ILE 84 3HD1 ILE 84 1.179 4.756 0.595 653 HD12 ILE 84 1HD1 ILE 84 1.998 3.218 0.331 654 HD13 ILE 84 2HD1 ILE 84 2.817 4.514 1.204 655 H CYS 85 H CYS 85 -0.667 -0.532 3.192 656 HA CYS 85 HA CYS 85 1.431 -2.393 4.064 657 HG CYS 85 HG CYS 85 -0.116 -1.001 6.535 658 HB2 CYS 85 1HB CYS 85 -1.333 -3.215 4.719 659 HB3 CYS 85 2HB CYS 85 0.157 -3.457 5.626 660 H LEU 86 H LEU 86 1.738 -4.159 2.808 661 HA LEU 86 HA LEU 86 0.139 -4.424 0.382 662 HG LEU 86 HG LEU 86 1.609 -4.276 -1.193 663 HB2 LEU 86 1HB LEU 86 2.824 -5.047 1.182 664 HB3 LEU 86 2HB LEU 86 2.061 -6.521 0.617 665 HD11 LEU 86 1HD1 LEU 86 4.416 -5.262 -1.214 666 HD12 LEU 86 2HD1 LEU 86 3.989 -3.959 -0.103 667 HD13 LEU 86 3HD1 LEU 86 3.743 -3.755 -1.837 668 HD21 LEU 86 3HD2 LEU 86 1.113 -6.506 -1.877 669 HD22 LEU 86 1HD2 LEU 86 2.727 -7.067 -1.431 670 HD23 LEU 86 2HD2 LEU 86 2.518 -5.973 -2.800 671 H PHE 87 H PHE 87 -0.712 -6.552 -0.284 672 HA PHE 87 HA PHE 87 -1.281 -8.359 1.956 673 HD1 PHE 87 HD2 PHE 87 -2.797 -7.352 3.681 674 HD2 PHE 87 HD1 PHE 87 -3.898 -5.223 0.175 675 HE1 PHE 87 HE2 PHE 87 -3.208 -5.345 5.042 676 HE2 PHE 87 HE1 PHE 87 -4.310 -3.216 1.526 677 HZ PHE 87 HZ PHE 87 -3.967 -3.267 3.961 678 HB2 PHE 87 1HB PHE 87 -3.404 -7.454 0.013 679 HB3 PHE 87 2HB PHE 87 -3.621 -8.461 1.442 680 H PHE 88 H PHE 88 -0.628 -10.321 1.432 681 HA PHE 88 HA PHE 88 -1.462 -11.579 -0.993 682 HD1 PHE 88 HD1 PHE 88 0.217 -13.020 -3.204 683 HD2 PHE 88 HD2 PHE 88 0.253 -8.820 -2.515 684 HE1 PHE 88 HE1 PHE 88 -0.357 -12.633 -5.564 685 HE2 PHE 88 HE2 PHE 88 -0.323 -8.425 -4.874 686 HZ PHE 88 HZ PHE 88 -0.630 -10.332 -6.402 687 HB2 PHE 88 1HB PHE 88 1.161 -10.321 -0.899 688 HB3 PHE 88 2HB PHE 88 1.277 -12.048 -1.217 689 H GLY 89 H GLY 89 -2.101 -12.349 1.485 690 HA2 GLY 89 1HA GLY 89 -1.519 -14.987 1.687 691 HA3 GLY 89 2HA GLY 89 -0.176 -14.240 2.534 692 H LYS 90 H LYS 90 -0.720 -12.846 4.394 693 HA LYS 90 HA LYS 90 -3.338 -13.297 5.588 694 HB2 LYS 90 1HB LYS 90 -2.550 -14.303 7.571 695 HB3 LYS 90 2HB LYS 90 -1.802 -15.199 6.266 696 HG2 LYS 90 1HG LYS 90 0.131 -14.888 7.336 697 HG3 LYS 90 2HG LYS 90 0.033 -13.205 6.826 698 HD2 LYS 90 1HD LYS 90 -0.107 -12.586 8.952 699 HD3 LYS 90 2HD LYS 90 -1.619 -13.485 9.095 700 HE2 LYS 90 1HE LYS 90 -0.613 -15.298 10.055 701 HE3 LYS 90 2HE LYS 90 0.931 -15.001 9.255 702 HZ1 LYS 90 3HZ LYS 90 0.519 -14.513 11.821 703 HZ2 LYS 90 1HZ LYS 90 0.070 -13.008 11.193 704 HZ3 LYS 90 2HZ LYS 90 1.614 -13.626 10.888 705 H THR 91 H THR 91 -2.922 -12.456 8.086 706 HA THR 91 HA THR 91 -1.437 -9.983 8.169 707 HB THR 91 HB THR 91 -3.962 -9.149 9.043 708 HG1 THR 91 HG1 THR 91 -4.961 -10.826 7.933 709 HG21 THR 91 3HG2 THR 91 -3.816 -8.102 6.537 710 HG22 THR 91 1HG2 THR 91 -2.129 -8.474 6.881 711 HG23 THR 91 2HG2 THR 91 -3.044 -7.430 7.969 712 HA PRO 92 HA PRO 92 -1.126 -10.400 12.571 713 HB2 PRO 92 1HB PRO 92 -3.278 -8.699 13.447 714 HB3 PRO 92 2HB PRO 92 -1.543 -8.394 13.509 715 HG2 PRO 92 1HG PRO 92 -3.535 -7.499 11.535 716 HG3 PRO 92 2HG PRO 92 -1.953 -6.808 11.931 717 HD2 PRO 92 1HD PRO 92 -2.404 -8.101 9.620 718 HD3 PRO 92 2HD PRO 92 -0.840 -8.198 10.449 719 H ILE 93 H ILE 93 -4.343 -10.650 11.164 720 HA ILE 93 HA ILE 93 -4.902 -12.825 13.050 721 HB ILE 93 HB ILE 93 -7.082 -10.917 12.258 722 HG12 ILE 93 1HG1 ILE 93 -6.653 -10.232 14.821 723 HG13 ILE 93 2HG1 ILE 93 -4.998 -10.605 14.353 724 HG21 ILE 93 1HG2 ILE 93 -8.279 -11.892 14.081 725 HG22 ILE 93 2HG2 ILE 93 -6.847 -12.766 14.624 726 HG23 ILE 93 3HG2 ILE 93 -7.621 -13.202 13.101 727 HD11 ILE 93 3HD1 ILE 93 -5.243 -9.018 12.460 728 HD12 ILE 93 1HD1 ILE 93 -5.374 -8.269 14.051 729 HD13 ILE 93 2HD1 ILE 93 -6.827 -8.575 13.098 730 H SER 94 H SER 94 -4.070 -13.765 10.810 731 HA SER 94 HA SER 94 -5.664 -13.829 8.537 732 HG SER 94 HG SER 94 -2.888 -15.779 10.232 733 HB2 SER 94 1HB SER 94 -4.549 -16.452 9.139 734 HB3 SER 94 2HB SER 94 -4.140 -15.332 7.841 735 H ASP 95 H ASP 95 -5.594 -16.342 11.064 736 HA ASP 95 HA ASP 95 -7.117 -17.906 11.698 737 HB2 ASP 95 1HB ASP 95 -8.000 -15.979 12.874 738 HB3 ASP 95 2HB ASP 95 -8.909 -15.480 11.453 739 H ASP 96 H ASP 96 -9.652 -16.274 9.891 740 HA ASP 96 HA ASP 96 -9.751 -18.599 8.087 741 HB2 ASP 96 1HB ASP 96 -12.171 -18.208 7.917 742 HB3 ASP 96 2HB ASP 96 -11.685 -18.478 9.588 743 H LYS 97 H LYS 97 -10.359 -15.110 8.300 744 HA LYS 97 HA LYS 97 -9.896 -14.949 5.396 745 HB2 LYS 97 1HB LYS 97 -11.681 -13.228 7.128 746 HB3 LYS 97 2HB LYS 97 -11.308 -12.887 5.444 747 HG2 LYS 97 1HG LYS 97 -12.459 -15.536 6.179 748 HG3 LYS 97 2HG LYS 97 -13.509 -14.121 6.084 749 HD2 LYS 97 1HD LYS 97 -13.669 -14.711 3.913 750 HD3 LYS 97 2HD LYS 97 -12.130 -13.859 3.779 751 HE2 LYS 97 1HE LYS 97 -11.317 -16.340 4.551 752 HE3 LYS 97 2HE LYS 97 -12.731 -16.723 3.571 753 HZ1 LYS 97 3HZ LYS 97 -11.629 -15.082 1.913 754 HZ2 LYS 97 1HZ LYS 97 -11.074 -16.677 2.009 755 HZ3 LYS 97 2HZ LYS 97 -10.215 -15.435 2.771 756 H ILE 98 H ILE 98 -8.904 -12.924 4.656 757 HA ILE 98 HA ILE 98 -6.700 -12.199 6.368 758 HB ILE 98 HB ILE 98 -7.456 -11.262 3.594 759 HG12 ILE 98 1HG1 ILE 98 -5.060 -12.893 4.423 760 HG13 ILE 98 2HG1 ILE 98 -6.605 -13.652 4.035 761 HG21 ILE 98 1HG2 ILE 98 -6.277 -9.465 4.674 762 HG22 ILE 98 2HG2 ILE 98 -5.205 -10.248 3.513 763 HG23 ILE 98 3HG2 ILE 98 -5.029 -10.576 5.236 764 HD11 ILE 98 3HD1 ILE 98 -6.255 -13.450 1.853 765 HD12 ILE 98 1HD1 ILE 98 -4.587 -13.053 2.268 766 HD13 ILE 98 2HD1 ILE 98 -5.761 -11.761 2.003 767 H ARG 99 H ARG 99 -7.177 -10.890 8.030 768 HA ARG 99 HA ARG 99 -8.883 -8.552 7.548 769 HE ARG 99 HE ARG 99 -12.781 -10.363 10.370 770 HB2 ARG 99 1HB ARG 99 -7.864 -9.738 10.138 771 HB3 ARG 99 2HB ARG 99 -8.919 -8.337 10.013 772 HG2 ARG 99 1HG ARG 99 -9.793 -10.861 8.719 773 HG3 ARG 99 2HG ARG 99 -9.862 -10.753 10.480 774 HD2 ARG 99 1HD ARG 99 -10.923 -8.342 9.488 775 HD3 ARG 99 2HD ARG 99 -11.630 -9.633 8.519 776 HH11 ARG 99 1HH1 ARG 99 -10.384 -8.022 11.350 777 HH12 ARG 99 2HH1 ARG 99 -11.009 -7.872 12.958 778 HH21 ARG 99 1HH2 ARG 99 -13.602 -10.165 12.484 779 HH22 ARG 99 2HH2 ARG 99 -12.834 -9.088 13.602 780 HA PRO 100 HA PRO 100 -4.802 -6.555 7.266 781 HB2 PRO 100 1HB PRO 100 -5.697 -4.309 6.032 782 HB3 PRO 100 2HB PRO 100 -5.376 -5.818 5.173 783 HG2 PRO 100 1HG PRO 100 -7.986 -4.723 6.142 784 HG3 PRO 100 2HG PRO 100 -7.596 -5.474 4.581 785 HD2 PRO 100 1HD PRO 100 -8.829 -6.825 6.568 786 HD3 PRO 100 2HD PRO 100 -7.703 -7.609 5.443 787 H ALA 101 H ALA 101 -7.829 -5.214 8.482 788 HA ALA 101 HA ALA 101 -6.758 -4.298 10.899 789 HB1 ALA 101 3HB ALA 101 -5.857 -2.300 10.536 790 HB2 ALA 101 1HB ALA 101 -7.257 -1.764 9.608 791 HB3 ALA 101 2HB ALA 101 -5.951 -2.637 8.808 792 H SER 102 H SER 102 -8.282 -1.960 11.305 793 HA SER 102 HA SER 102 -10.993 -3.068 11.102 794 HG SER 102 HG SER 102 -8.812 -2.794 13.336 795 HB2 SER 102 1HB SER 102 -10.945 -0.954 12.987 796 HB3 SER 102 2HB SER 102 -11.119 -2.681 13.301 797 H ALA 103 H ALA 103 -9.058 -0.664 9.760 798 HA ALA 103 HA ALA 103 -11.254 0.523 8.414 799 HB1 ALA 103 3HB ALA 103 -11.673 1.622 10.502 800 HB2 ALA 103 1HB ALA 103 -11.052 2.805 9.349 801 HB3 ALA 103 2HB ALA 103 -9.994 2.157 10.604 802 H VAL 104 H VAL 104 -9.524 -0.317 6.868 803 HA VAL 104 HA VAL 104 -7.605 1.867 6.342 804 HB VAL 104 HB VAL 104 -6.068 0.331 5.288 805 HG11 VAL 104 1HG1 VAL 104 -6.820 -0.999 7.863 806 HG12 VAL 104 2HG1 VAL 104 -6.191 0.648 7.834 807 HG13 VAL 104 3HG1 VAL 104 -5.216 -0.681 7.201 808 HG21 VAL 104 3HG2 VAL 104 -6.433 -1.898 4.865 809 HG22 VAL 104 1HG2 VAL 104 -8.054 -1.254 4.615 810 HG23 VAL 104 2HG2 VAL 104 -7.647 -2.056 6.130 811 H ASN 105 H ASN 105 -7.412 2.703 4.318 812 HA ASN 105 HA ASN 105 -9.683 2.337 2.588 813 HB2 ASN 105 1HB ASN 105 -7.265 4.068 2.064 814 HB3 ASN 105 2HB ASN 105 -8.878 4.246 1.386 815 HD21 ASN 105 1HD2 ASN 105 -9.947 3.573 4.173 816 HD22 ASN 105 2HD2 ASN 105 -9.827 5.075 5.014 817 H VAL 106 H VAL 106 -9.633 1.790 0.388 818 HA VAL 106 HA VAL 106 -7.607 -0.156 -0.330 819 HB VAL 106 HB VAL 106 -9.318 0.292 -2.545 820 HG11 VAL 106 1HG1 VAL 106 -8.211 -1.808 -1.281 821 HG12 VAL 106 2HG1 VAL 106 -9.471 -1.944 -2.507 822 HG13 VAL 106 3HG1 VAL 106 -9.897 -1.995 -0.797 823 HG21 VAL 106 3HG2 VAL 106 -10.998 1.364 -1.313 824 HG22 VAL 106 1HG2 VAL 106 -10.798 0.282 0.066 825 HG23 VAL 106 2HG2 VAL 106 -11.521 -0.317 -1.427 826 H ILE 107 H ILE 107 -5.867 1.324 -0.464 827 HA ILE 107 HA ILE 107 -5.831 3.560 -2.171 828 HB ILE 107 HB ILE 107 -4.303 2.891 -0.170 829 HG12 ILE 107 1HG1 ILE 107 -4.207 4.816 -2.178 830 HG13 ILE 107 2HG1 ILE 107 -3.359 4.861 -0.640 831 HG21 ILE 107 1HG2 ILE 107 -2.148 1.988 -0.764 832 HG22 ILE 107 2HG2 ILE 107 -2.625 1.858 -2.453 833 HG23 ILE 107 3HG2 ILE 107 -3.410 0.854 -1.236 834 HD11 ILE 107 3HD1 ILE 107 -1.426 3.812 -1.674 835 HD12 ILE 107 1HD1 ILE 107 -1.866 5.310 -2.495 836 HD13 ILE 107 2HD1 ILE 107 -2.278 3.753 -3.216 837 H GLY 108 H GLY 108 -6.506 0.791 -3.416 838 HA2 GLY 108 1HA GLY 108 -6.292 0.719 -5.874 839 HA3 GLY 108 2HA GLY 108 -4.583 1.045 -5.640 840 H ARG 109 H ARG 109 -4.041 -0.822 -6.830 841 HA ARG 109 HA ARG 109 -3.920 -3.209 -5.208 842 HE ARG 109 HE ARG 109 -6.676 -5.851 -6.312 843 HB2 ARG 109 1HB ARG 109 -5.168 -3.441 -7.943 844 HB3 ARG 109 2HB ARG 109 -5.024 -4.690 -6.715 845 HG2 ARG 109 1HG ARG 109 -6.604 -3.450 -5.295 846 HG3 ARG 109 2HG ARG 109 -6.772 -2.241 -6.567 847 HD2 ARG 109 1HD ARG 109 -8.616 -3.764 -6.715 848 HD3 ARG 109 2HD ARG 109 -7.552 -4.032 -8.095 849 HH11 ARG 109 1HH1 ARG 109 -9.857 -5.081 -7.526 850 HH12 ARG 109 2HH1 ARG 109 -10.452 -6.697 -7.348 851 HH21 ARG 109 1HH2 ARG 109 -7.459 -7.977 -6.077 852 HH22 ARG 109 2HH2 ARG 109 -9.092 -8.341 -6.526 853 H ILE 110 H ILE 110 -2.656 -4.959 -6.350 854 HA ILE 110 HA ILE 110 -0.458 -3.705 -7.837 855 HB ILE 110 HB ILE 110 -0.589 -6.375 -6.435 856 HG12 ILE 110 1HG1 ILE 110 1.385 -4.408 -5.539 857 HG13 ILE 110 2HG1 ILE 110 -0.270 -3.851 -5.341 858 HG21 ILE 110 1HG2 ILE 110 0.896 -6.515 -8.336 859 HG22 ILE 110 2HG2 ILE 110 1.834 -6.496 -6.843 860 HG23 ILE 110 3HG2 ILE 110 1.723 -5.040 -7.830 861 HD11 ILE 110 3HD1 ILE 110 -0.799 -5.761 -3.978 862 HD12 ILE 110 1HD1 ILE 110 0.645 -4.971 -3.347 863 HD13 ILE 110 2HD1 ILE 110 0.793 -6.459 -4.281 864 H VAL 111 H VAL 111 -0.542 -3.887 -9.981 865 HA VAL 111 HA VAL 111 -1.984 -6.141 -11.169 866 HB VAL 111 HB VAL 111 -1.338 -4.678 -13.336 867 HG11 VAL 111 1HG1 VAL 111 -3.658 -3.682 -11.776 868 HG12 VAL 111 2HG1 VAL 111 -3.600 -5.400 -12.170 869 HG13 VAL 111 3HG1 VAL 111 -3.559 -4.198 -13.460 870 HG21 VAL 111 3HG2 VAL 111 -0.228 -3.011 -11.693 871 HG22 VAL 111 1HG2 VAL 111 -1.882 -2.516 -11.338 872 HG23 VAL 111 2HG2 VAL 111 -1.257 -2.386 -12.982 873 H ASN 112 H ASN 112 0.718 -4.394 -12.648 874 HA ASN 112 HA ASN 112 1.900 -6.907 -13.437 875 HB2 ASN 112 1HB ASN 112 3.507 -5.514 -14.669 876 HB3 ASN 112 2HB ASN 112 1.849 -5.026 -15.010 877 HD21 ASN 112 1HD2 ASN 112 1.074 -3.080 -14.163 878 HD22 ASN 112 2HD2 ASN 112 2.143 -1.841 -13.612 879 H SER 113 H SER 113 4.056 -7.550 -12.982 880 HA SER 113 HA SER 113 5.832 -7.976 -11.632 881 HG SER 113 HG SER 113 7.948 -5.482 -10.766 882 HB2 SER 113 1HB SER 113 6.246 -5.509 -12.144 883 HB3 SER 113 2HB SER 113 5.557 -5.171 -10.555 884 H MET 114 H MET 114 3.165 -8.545 -10.700 885 HA MET 114 HA MET 114 2.579 -7.849 -8.108 886 HB2 MET 114 1HB MET 114 1.731 -10.352 -7.986 887 HB3 MET 114 2HB MET 114 0.922 -9.158 -8.988 888 HG2 MET 114 1HG MET 114 3.065 -10.501 -10.406 889 HG3 MET 114 2HG MET 114 1.859 -11.628 -9.786 890 HE1 MET 114 3HE MET 114 2.033 -11.858 -12.721 891 HE2 MET 114 1HE MET 114 0.386 -11.572 -13.281 892 HE3 MET 114 2HE MET 114 0.669 -12.509 -11.814 893 H GLU 115 H GLU 115 4.155 -10.960 -8.857 894 HA GLU 115 HA GLU 115 5.707 -12.182 -7.743 895 HB2 GLU 115 1HB GLU 115 6.531 -9.380 -7.319 896 HB3 GLU 115 2HB GLU 115 7.208 -10.538 -6.182 897 HG2 GLU 115 1HG GLU 115 8.572 -11.429 -7.709 898 HG3 GLU 115 2HG GLU 115 7.340 -11.399 -8.971 899 H GLY 116 H GLY 116 6.771 -12.273 -5.330 900 HA2 GLY 116 1HA GLY 116 4.449 -12.259 -3.502 901 HA3 GLY 116 2HA GLY 116 5.702 -13.491 -3.484 902 H LEU 117 H LEU 117 5.932 -9.944 -3.634 903 HA LEU 117 HA LEU 117 8.160 -9.566 -2.165 904 HG LEU 117 HG LEU 117 8.281 -7.400 -0.847 905 HB2 LEU 117 1HB LEU 117 7.000 -7.730 -3.229 906 HB3 LEU 117 2HB LEU 117 5.663 -7.873 -2.104 907 HD11 LEU 117 1HD1 LEU 117 6.987 -5.271 -2.531 908 HD12 LEU 117 2HD1 LEU 117 8.586 -5.978 -2.769 909 HD13 LEU 117 3HD1 LEU 117 8.259 -4.996 -1.343 910 HD21 LEU 117 3HD2 LEU 117 6.999 -6.645 0.807 911 HD22 LEU 117 1HD2 LEU 117 5.621 -7.247 -0.115 912 HD23 LEU 117 2HD2 LEU 117 6.118 -5.562 -0.269 913 H LYS 118 H LYS 118 4.955 -10.249 -0.842 914 HA LYS 118 HA LYS 118 5.208 -9.627 1.786 915 HB2 LYS 118 1HB LYS 118 3.917 -11.817 2.250 916 HB3 LYS 118 2HB LYS 118 3.171 -10.585 1.247 917 HG2 LYS 118 1HG LYS 118 2.772 -12.212 -0.199 918 HG3 LYS 118 2HG LYS 118 4.486 -12.169 -0.586 919 HD2 LYS 118 1HD LYS 118 3.399 -13.835 1.666 920 HD3 LYS 118 2HD LYS 118 3.459 -14.435 0.009 921 HE2 LYS 118 1HE LYS 118 5.955 -13.722 0.114 922 HE3 LYS 118 2HE LYS 118 5.709 -13.749 1.860 923 HZ1 LYS 118 3HZ LYS 118 5.563 -15.982 1.894 924 HZ2 LYS 118 1HZ LYS 118 6.449 -15.874 0.456 925 HZ3 LYS 118 2HZ LYS 118 4.772 -16.082 0.404 926 H GLY 119 H GLY 119 7.147 -11.987 0.132 927 HA2 GLY 119 1HA GLY 119 8.054 -13.193 2.633 928 HA3 GLY 119 2HA GLY 119 8.515 -13.692 1.012 929 H VAL 120 H VAL 120 8.587 -10.417 2.254 930 HA VAL 120 HA VAL 120 11.253 -9.953 1.376 931 HB VAL 120 HB VAL 120 11.029 -7.808 2.714 932 HG11 VAL 120 1HG1 VAL 120 8.647 -7.718 1.058 933 HG12 VAL 120 2HG1 VAL 120 9.989 -8.544 0.262 934 HG13 VAL 120 3HG1 VAL 120 10.194 -6.901 0.861 935 HG21 VAL 120 3HG2 VAL 120 9.493 -7.815 4.331 936 HG22 VAL 120 1HG2 VAL 120 8.681 -9.231 3.669 937 HG23 VAL 120 2HG2 VAL 120 8.295 -7.627 3.052 938 H ALA 121 H ALA 121 13.111 -9.386 2.697 939 HA ALA 121 HA ALA 121 13.459 -11.158 4.922 940 HB1 ALA 121 3HB ALA 121 15.725 -10.377 4.992 941 HB2 ALA 121 1HB ALA 121 15.322 -8.963 4.020 942 HB3 ALA 121 2HB ALA 121 15.271 -10.572 3.299 943 H ASP 122 H ASP 122 13.747 -10.613 7.121 944 HA ASP 122 HA ASP 122 12.119 -8.594 8.134 945 HB2 ASP 122 1HB ASP 122 12.956 -9.142 10.295 946 HB3 ASP 122 2HB ASP 122 12.873 -10.638 9.367 947 H GLY 123 H GLY 123 12.330 -6.494 8.248 948 HA2 GLY 123 1HA GLY 123 13.242 -4.402 8.395 949 HA3 GLY 123 2HA GLY 123 14.609 -5.158 9.193 950 H GLU 124 H GLU 124 13.445 -3.694 6.334 951 HA GLU 124 HA GLU 124 16.121 -3.612 5.269 952 HB2 GLU 124 1HB GLU 124 15.208 -4.339 2.943 953 HB3 GLU 124 2HB GLU 124 15.663 -5.568 4.110 954 HG2 GLU 124 1HG GLU 124 13.401 -6.021 4.642 955 HG3 GLU 124 2HG GLU 124 12.841 -4.607 3.748 956 H SER 125 H SER 125 16.438 -1.996 3.693 957 HA SER 125 HA SER 125 15.057 0.362 4.083 958 HG SER 125 HG SER 125 15.929 2.051 1.978 959 HB2 SER 125 1HB SER 125 17.327 -0.253 2.802 960 HB3 SER 125 2HB SER 125 16.277 -0.033 1.401 961 H VAL 126 H VAL 126 13.903 1.664 2.450 962 HA VAL 126 HA VAL 126 12.321 0.309 0.465 963 HB VAL 126 HB VAL 126 10.894 1.538 2.833 964 HG11 VAL 126 1HG1 VAL 126 8.874 0.627 1.757 965 HG12 VAL 126 2HG1 VAL 126 9.849 0.180 0.362 966 HG13 VAL 126 3HG1 VAL 126 9.659 1.878 0.800 967 HG21 VAL 126 3HG2 VAL 126 10.055 -0.785 3.189 968 HG22 VAL 126 1HG2 VAL 126 11.763 -0.546 3.551 969 HG23 VAL 126 2HG2 VAL 126 11.281 -1.333 2.047 970 H VAL 127 H VAL 127 11.940 1.705 -1.181 971 HA VAL 127 HA VAL 127 11.999 4.586 -0.562 972 HB VAL 127 HB VAL 127 13.133 4.980 -2.734 973 HG11 VAL 127 1HG1 VAL 127 15.095 4.969 -1.677 974 HG12 VAL 127 2HG1 VAL 127 15.091 3.214 -1.505 975 HG13 VAL 127 3HG1 VAL 127 14.242 4.219 -0.329 976 HG21 VAL 127 3HG2 VAL 127 13.079 3.331 -4.228 977 HG22 VAL 127 1HG2 VAL 127 12.687 2.126 -3.001 978 HG23 VAL 127 2HG2 VAL 127 14.369 2.570 -3.295 979 H VAL 128 H VAL 128 9.999 5.292 -0.873 980 HA VAL 128 HA VAL 128 8.256 4.126 -2.868 981 HB VAL 128 HB VAL 128 7.413 6.633 -1.549 982 HG11 VAL 128 1HG1 VAL 128 5.647 5.615 -2.597 983 HG12 VAL 128 2HG1 VAL 128 5.469 4.968 -0.968 984 HG13 VAL 128 3HG1 VAL 128 6.221 3.988 -2.224 985 HG21 VAL 128 3HG2 VAL 128 8.304 6.042 0.447 986 HG22 VAL 128 1HG2 VAL 128 8.414 4.334 0.018 987 HG23 VAL 128 2HG2 VAL 128 6.870 5.019 0.520 988 H GLU 129 H GLU 129 7.927 4.954 -4.910 989 HA GLU 129 HA GLU 129 8.391 7.756 -5.451 990 HB2 GLU 129 1HB GLU 129 9.924 7.174 -7.389 991 HB3 GLU 129 2HB GLU 129 10.621 7.035 -5.781 992 HG2 GLU 129 1HG GLU 129 10.045 4.570 -5.903 993 HG3 GLU 129 2HG GLU 129 9.733 4.836 -7.617 994 H ARG 130 H ARG 130 6.946 8.474 -6.913 995 HA ARG 130 HA ARG 130 5.093 6.656 -8.112 996 HE ARG 130 HE ARG 130 4.095 7.395 -11.437 997 HB2 ARG 130 1HB ARG 130 4.454 8.910 -7.322 998 HB3 ARG 130 2HB ARG 130 5.459 9.623 -8.575 999 HG2 ARG 130 1HG ARG 130 3.374 7.702 -9.430 1000 HG3 ARG 130 2HG ARG 130 2.850 9.286 -8.857 1001 HD2 ARG 130 1HD ARG 130 3.297 10.097 -10.871 1002 HD3 ARG 130 2HD ARG 130 5.005 9.787 -10.567 1003 HH11 ARG 130 1HH1 ARG 130 3.861 10.637 -12.712 1004 HH12 ARG 130 2HH1 ARG 130 3.798 10.117 -14.362 1005 HH21 ARG 130 1HH2 ARG 130 4.009 6.711 -13.608 1006 HH22 ARG 130 2HH2 ARG 130 3.884 7.890 -14.870 1007 H ALA 131 H ALA 131 6.285 5.341 -9.491 1008 HA ALA 131 HA ALA 131 7.470 4.714 -11.357 1009 HB1 ALA 131 3HB ALA 131 5.691 6.827 -12.557 1010 HB2 ALA 131 1HB ALA 131 5.234 5.155 -12.224 1011 HB3 ALA 131 2HB ALA 131 6.475 5.508 -13.426 Start of MODEL 12 1 H MET 1 H MET 1 -20.294 13.352 -17.956 2 HA MET 1 HA MET 1 -18.601 13.652 -20.326 3 HB2 MET 1 1HB MET 1 -20.495 15.195 -19.940 4 HB3 MET 1 2HB MET 1 -19.837 15.591 -18.359 5 HG2 MET 1 1HG MET 1 -17.968 15.951 -20.586 6 HG3 MET 1 2HG MET 1 -19.385 16.997 -20.632 7 HE1 MET 1 3HE MET 1 -19.680 19.002 -19.469 8 HE2 MET 1 1HE MET 1 -18.114 19.388 -20.183 9 HE3 MET 1 2HE MET 1 -18.443 19.802 -18.500 10 H GLY 2 H GLY 2 -16.760 12.561 -19.518 11 HA2 GLY 2 1HA GLY 2 -14.744 13.959 -18.431 12 HA3 GLY 2 2HA GLY 2 -15.605 13.417 -16.998 13 H GLU 3 H GLU 3 -12.908 12.750 -17.808 14 HA GLU 3 HA GLU 3 -13.127 9.916 -18.517 15 HB2 GLU 3 1HB GLU 3 -10.730 9.986 -18.895 16 HB3 GLU 3 2HB GLU 3 -11.512 11.298 -19.769 17 HG2 GLU 3 1HG GLU 3 -10.917 12.733 -17.722 18 HG3 GLU 3 2HG GLU 3 -9.806 11.425 -17.316 19 H ARG 4 H ARG 4 -13.875 11.029 -15.873 20 HA ARG 4 HA ARG 4 -13.673 10.523 -13.669 21 HE ARG 4 HE ARG 4 -15.515 9.878 -13.226 22 HB2 ARG 4 1HB ARG 4 -12.019 8.128 -14.428 23 HB3 ARG 4 2HB ARG 4 -13.190 8.290 -13.127 24 HG2 ARG 4 1HG ARG 4 -13.924 8.313 -16.044 25 HG3 ARG 4 2HG ARG 4 -13.912 6.860 -15.046 26 HD2 ARG 4 1HD ARG 4 -15.922 8.914 -15.279 27 HD3 ARG 4 2HD ARG 4 -16.019 7.334 -14.507 28 HH11 ARG 4 1HH1 ARG 4 -15.358 6.401 -12.939 29 HH12 ARG 4 2HH1 ARG 4 -15.364 6.421 -11.209 30 HH21 ARG 4 1HH2 ARG 4 -15.520 9.902 -10.950 31 HH22 ARG 4 2HH2 ARG 4 -15.456 8.406 -10.080 32 H GLY 5 H GLY 5 -11.297 8.960 -12.566 33 HA2 GLY 5 1HA GLY 5 -8.956 10.477 -13.120 34 HA3 GLY 5 2HA GLY 5 -9.757 11.077 -11.676 35 H VAL 6 H VAL 6 -9.753 7.716 -12.681 36 HA VAL 6 HA VAL 6 -8.113 7.096 -10.296 37 HB VAL 6 HB VAL 6 -9.215 4.925 -10.178 38 HG11 VAL 6 1HG1 VAL 6 -10.696 7.450 -9.967 39 HG12 VAL 6 2HG1 VAL 6 -10.454 6.168 -8.782 40 HG13 VAL 6 3HG1 VAL 6 -11.698 6.000 -10.019 41 HG21 VAL 6 3HG2 VAL 6 -11.371 5.548 -12.066 42 HG22 VAL 6 1HG2 VAL 6 -10.539 4.027 -11.751 43 HG23 VAL 6 2HG2 VAL 6 -9.812 5.224 -12.820 44 H GLU 7 H GLU 7 -6.427 7.635 -12.096 45 HA GLU 7 HA GLU 7 -5.487 5.067 -13.105 46 HB2 GLU 7 1HB GLU 7 -4.971 5.938 -15.277 47 HB3 GLU 7 2HB GLU 7 -6.670 6.229 -14.962 48 HG2 GLU 7 1HG GLU 7 -4.446 8.252 -14.770 49 HG3 GLU 7 2HG GLU 7 -5.648 8.133 -16.053 50 H MET 8 H MET 8 -4.641 6.493 -10.832 51 HA MET 8 HA MET 8 -2.022 7.541 -11.671 52 HB2 MET 8 1HB MET 8 -3.786 8.840 -10.150 53 HB3 MET 8 2HB MET 8 -2.996 7.910 -8.885 54 HG2 MET 8 1HG MET 8 -1.445 9.481 -8.807 55 HG3 MET 8 2HG MET 8 -0.914 8.955 -10.404 56 HE1 MET 8 3HE MET 8 -0.061 10.532 -11.425 57 HE2 MET 8 1HE MET 8 -0.416 12.259 -11.335 58 HE3 MET 8 2HE MET 8 -1.137 11.275 -12.608 59 H ARG 9 H ARG 9 -0.407 6.149 -11.488 60 HA ARG 9 HA ARG 9 -0.509 4.188 -9.288 61 HE ARG 9 HE ARG 9 4.385 2.872 -12.799 62 HB2 ARG 9 1HB ARG 9 0.386 2.537 -10.632 63 HB3 ARG 9 2HB ARG 9 -0.657 3.396 -11.754 64 HG2 ARG 9 1HG ARG 9 1.152 3.348 -13.078 65 HG3 ARG 9 2HG ARG 9 1.666 4.733 -12.115 66 HD2 ARG 9 1HD ARG 9 3.225 3.531 -10.961 67 HD3 ARG 9 2HD ARG 9 2.312 2.027 -11.087 68 HH11 ARG 9 1HH1 ARG 9 1.262 1.316 -12.890 69 HH12 ARG 9 2HH1 ARG 9 1.609 0.426 -14.333 70 HH21 ARG 9 1HH2 ARG 9 4.841 1.703 -14.700 71 HH22 ARG 9 2HH2 ARG 9 3.641 0.645 -15.360 72 H LEU 10 H LEU 10 1.297 3.728 -8.120 73 HA LEU 10 HA LEU 10 3.595 5.528 -8.520 74 HG LEU 10 HG LEU 10 1.015 4.536 -6.158 75 HB2 LEU 10 1HB LEU 10 3.559 4.666 -5.805 76 HB3 LEU 10 2HB LEU 10 3.444 6.293 -6.437 77 HD11 LEU 10 1HD1 LEU 10 1.872 4.623 -3.939 78 HD12 LEU 10 2HD1 LEU 10 0.613 5.856 -4.037 79 HD13 LEU 10 3HD1 LEU 10 2.311 6.325 -4.106 80 HD21 LEU 10 3HD2 LEU 10 0.798 7.421 -5.811 81 HD22 LEU 10 1HD2 LEU 10 -0.137 6.328 -6.830 82 HD23 LEU 10 2HD2 LEU 10 1.413 6.957 -7.397 83 H ARG 11 H ARG 11 5.639 4.669 -7.573 84 HA ARG 11 HA ARG 11 5.789 1.787 -8.094 85 HE ARG 11 HE ARG 11 9.429 -0.882 -9.634 86 HB2 ARG 11 1HB ARG 11 7.245 3.839 -9.182 87 HB3 ARG 11 2HB ARG 11 8.317 3.274 -7.910 88 HG2 ARG 11 1HG ARG 11 7.121 1.546 -10.066 89 HG3 ARG 11 2HG ARG 11 8.759 2.199 -10.068 90 HD2 ARG 11 1HD ARG 11 8.697 1.006 -7.642 91 HD3 ARG 11 2HD ARG 11 7.612 -0.047 -8.548 92 HH11 ARG 11 1HH1 ARG 11 10.279 2.243 -8.333 93 HH12 ARG 11 2HH1 ARG 11 11.939 2.130 -8.814 94 HH21 ARG 11 1HH2 ARG 11 11.611 -1.033 -10.265 95 HH22 ARG 11 2HH2 ARG 11 12.696 0.271 -9.911 96 H ILE 12 H ILE 12 6.897 0.413 -6.686 97 HA ILE 12 HA ILE 12 7.968 1.494 -4.214 98 HB ILE 12 HB ILE 12 5.383 0.079 -4.379 99 HG12 ILE 12 1HG1 ILE 12 6.598 1.642 -2.104 100 HG13 ILE 12 2HG1 ILE 12 5.872 2.416 -3.511 101 HG21 ILE 12 1HG2 ILE 12 6.376 -1.794 -3.433 102 HG22 ILE 12 2HG2 ILE 12 5.809 -0.889 -2.029 103 HG23 ILE 12 3HG2 ILE 12 7.512 -0.835 -2.481 104 HD11 ILE 12 3HD1 ILE 12 4.370 2.245 -1.544 105 HD12 ILE 12 1HD1 ILE 12 4.418 0.491 -1.718 106 HD13 ILE 12 2HD1 ILE 12 3.734 1.486 -3.004 107 H ARG 13 H ARG 13 9.953 0.701 -4.555 108 HA ARG 13 HA ARG 13 10.214 -2.147 -5.233 109 HE ARG 13 HE ARG 13 14.328 -0.640 -7.508 110 HB2 ARG 13 1HB ARG 13 12.575 -1.576 -5.791 111 HB3 ARG 13 2HB ARG 13 11.386 -0.730 -6.774 112 HG2 ARG 13 1HG ARG 13 11.663 1.259 -5.340 113 HG3 ARG 13 2HG ARG 13 12.912 0.402 -4.436 114 HD2 ARG 13 1HD ARG 13 12.965 1.194 -7.342 115 HD3 ARG 13 2HD ARG 13 13.985 1.813 -6.044 116 HH11 ARG 13 1HH1 ARG 13 15.043 1.051 -4.540 117 HH12 ARG 13 2HH1 ARG 13 16.453 0.106 -4.195 118 HH21 ARG 13 1HH2 ARG 13 16.180 -1.885 -7.054 119 HH22 ARG 13 2HH2 ARG 13 17.099 -1.561 -5.621 120 H PHE 14 H PHE 14 11.809 -3.422 -4.184 121 HA PHE 14 HA PHE 14 12.593 -2.518 -1.507 122 HD1 PHE 14 HD2 PHE 14 9.795 -2.378 -1.642 123 HD2 PHE 14 HD1 PHE 14 11.405 -5.248 1.061 124 HE1 PHE 14 HE2 PHE 14 8.355 -1.498 0.144 125 HE2 PHE 14 HE1 PHE 14 9.966 -4.370 2.850 126 HZ PHE 14 HZ PHE 14 8.438 -2.494 2.393 127 HB2 PHE 14 1HB PHE 14 10.938 -4.858 -2.260 128 HB3 PHE 14 2HB PHE 14 12.212 -5.175 -1.088 129 H GLU 15 H GLU 15 14.621 -3.110 -0.903 130 HA GLU 15 HA GLU 15 16.617 -3.521 -2.670 131 HB2 GLU 15 1HB GLU 15 16.342 -4.018 0.221 132 HB3 GLU 15 2HB GLU 15 17.636 -4.912 -0.560 133 HG2 GLU 15 1HG GLU 15 18.107 -2.584 0.465 134 HG3 GLU 15 2HG GLU 15 18.819 -3.028 -1.082 135 H SER 16 H SER 16 14.502 -6.017 -1.451 136 HA SER 16 HA SER 16 15.983 -7.968 -3.094 137 HG SER 16 HG SER 16 16.762 -9.557 -0.199 138 HB2 SER 16 1HB SER 16 14.878 -8.197 -0.335 139 HB3 SER 16 2HB SER 16 14.824 -9.623 -1.370 140 H ALA 17 H ALA 17 13.549 -6.210 -3.671 141 HA ALA 17 HA ALA 17 12.130 -8.140 -5.176 142 HB1 ALA 17 3HB ALA 17 11.389 -8.374 -2.594 143 HB2 ALA 17 1HB ALA 17 10.340 -8.753 -3.960 144 HB3 ALA 17 2HB ALA 17 10.210 -7.189 -3.158 145 H GLU 18 H GLU 18 10.414 -7.306 -6.445 146 HA GLU 18 HA GLU 18 10.313 -4.361 -6.546 147 HB2 GLU 18 1HB GLU 18 9.818 -4.643 -8.971 148 HB3 GLU 18 2HB GLU 18 11.414 -5.218 -8.508 149 HG2 GLU 18 1HG GLU 18 9.363 -7.284 -8.390 150 HG3 GLU 18 2HG GLU 18 9.582 -6.595 -9.999 151 H CYS 19 H CYS 19 8.289 -3.378 -7.089 152 HA CYS 19 HA CYS 19 5.921 -4.995 -7.344 153 HG CYS 19 HG CYS 19 6.976 -4.927 -3.402 154 HB2 CYS 19 1HB CYS 19 5.250 -3.449 -5.054 155 HB3 CYS 19 2HB CYS 19 5.308 -5.200 -5.202 156 H GLU 20 H GLU 20 4.015 -3.814 -7.825 157 HA GLU 20 HA GLU 20 4.314 -0.908 -8.123 158 HB2 GLU 20 1HB GLU 20 3.512 -2.819 -10.331 159 HB3 GLU 20 2HB GLU 20 3.209 -1.091 -10.393 160 HG2 GLU 20 1HG GLU 20 5.981 -1.970 -9.845 161 HG3 GLU 20 2HG GLU 20 5.348 -2.197 -11.474 162 H VAL 21 H VAL 21 2.311 0.247 -8.138 163 HA VAL 21 HA VAL 21 -0.141 -1.252 -7.808 164 HB VAL 21 HB VAL 21 -0.222 -1.306 -5.595 165 HG11 VAL 21 1HG1 VAL 21 2.144 -1.491 -5.516 166 HG12 VAL 21 2HG1 VAL 21 1.652 -0.418 -4.205 167 HG13 VAL 21 3HG1 VAL 21 2.352 0.255 -5.679 168 HG21 VAL 21 3HG2 VAL 21 -0.407 0.757 -4.259 169 HG22 VAL 21 1HG2 VAL 21 -1.421 0.795 -5.702 170 HG23 VAL 21 2HG2 VAL 21 0.095 1.695 -5.666 171 H GLU 22 H GLU 22 -1.985 -0.100 -8.152 172 HA GLU 22 HA GLU 22 -1.623 2.575 -9.275 173 HB2 GLU 22 1HB GLU 22 -3.645 0.403 -9.602 174 HB3 GLU 22 2HB GLU 22 -4.157 2.061 -9.882 175 HG2 GLU 22 1HG GLU 22 -3.073 2.198 -11.829 176 HG3 GLU 22 2HG GLU 22 -1.651 1.361 -11.207 177 H LEU 23 H LEU 23 -3.909 3.882 -8.953 178 HA LEU 23 HA LEU 23 -4.799 3.651 -6.201 179 HG LEU 23 HG LEU 23 -5.382 6.653 -5.881 180 HB2 LEU 23 1HB LEU 23 -2.887 5.001 -5.833 181 HB3 LEU 23 2HB LEU 23 -3.220 5.991 -7.237 182 HD11 LEU 23 1HD1 LEU 23 -3.665 5.288 -3.904 183 HD12 LEU 23 2HD1 LEU 23 -5.416 5.515 -3.924 184 HD13 LEU 23 3HD1 LEU 23 -4.360 6.830 -3.409 185 HD21 LEU 23 3HD2 LEU 23 -2.594 7.661 -5.371 186 HD22 LEU 23 1HD2 LEU 23 -4.055 8.491 -4.837 187 HD23 LEU 23 2HD2 LEU 23 -3.754 8.255 -6.558 188 H TYR 24 H TYR 24 -6.838 4.295 -5.913 189 HA TYR 24 HA TYR 24 -8.139 5.731 -8.138 190 HD1 TYR 24 HD1 TYR 24 -7.594 4.084 -9.411 191 HD2 TYR 24 HD2 TYR 24 -9.812 1.503 -6.857 192 HE1 TYR 24 HE1 TYR 24 -6.785 2.141 -10.681 193 HE2 TYR 24 HE2 TYR 24 -9.007 -0.447 -8.118 194 HH TYR 24 HH TYR 24 -6.479 -0.225 -10.431 195 HB2 TYR 24 1HB TYR 24 -9.511 3.783 -6.267 196 HB3 TYR 24 2HB TYR 24 -10.154 4.490 -7.744 197 H GLU 25 H GLU 25 -9.432 7.455 -7.683 198 HA GLU 25 HA GLU 25 -8.983 8.885 -5.319 199 HB2 GLU 25 1HB GLU 25 -11.230 9.267 -7.292 200 HB3 GLU 25 2HB GLU 25 -10.698 10.439 -6.092 201 HG2 GLU 25 1HG GLU 25 -9.430 9.620 -8.646 202 HG3 GLU 25 2HG GLU 25 -9.636 11.224 -7.947 203 H GLU 26 H GLU 26 -11.030 6.238 -5.678 204 HA GLU 26 HA GLU 26 -13.342 6.776 -4.355 205 HB2 GLU 26 1HB GLU 26 -13.445 4.488 -3.712 206 HB3 GLU 26 2HB GLU 26 -12.568 4.539 -5.234 207 HG2 GLU 26 1HG GLU 26 -10.444 4.424 -3.931 208 HG3 GLU 26 2HG GLU 26 -11.414 4.181 -2.479 209 H TRP 27 H TRP 27 -10.135 6.690 -2.977 210 HA TRP 27 HA TRP 27 -11.009 6.723 -0.247 211 HD1 TRP 27 HD1 TRP 27 -6.196 7.679 -0.339 212 HE1 TRP 27 HE1 TRP 27 -5.762 8.880 1.891 213 HE3 TRP 27 HE3 TRP 27 -10.935 7.573 1.579 214 HZ2 TRP 27 HZ2 TRP 27 -7.232 9.684 4.162 215 HZ3 TRP 27 HZ3 TRP 27 -11.332 8.585 3.785 216 HH2 TRP 27 HH2 TRP 27 -9.519 9.615 5.050 217 HB2 TRP 27 1HB TRP 27 -8.865 5.803 -0.545 218 HB3 TRP 27 2HB TRP 27 -8.375 7.069 -1.662 219 H ALA 28 H ALA 28 -9.478 9.113 -2.427 220 HA ALA 28 HA ALA 28 -11.142 11.209 -2.127 221 HB1 ALA 28 3HB ALA 28 -11.137 11.467 0.153 222 HB2 ALA 28 1HB ALA 28 -9.839 12.573 -0.296 223 HB3 ALA 28 2HB ALA 28 -9.454 10.967 0.320 224 HA PRO 29 HA PRO 29 -8.046 12.394 -5.158 225 HB2 PRO 29 1HB PRO 29 -9.183 15.027 -5.194 226 HB3 PRO 29 2HB PRO 29 -9.325 13.760 -6.410 227 HG2 PRO 29 1HG PRO 29 -11.237 14.600 -4.365 228 HG3 PRO 29 2HG PRO 29 -11.501 13.616 -5.810 229 HD2 PRO 29 1HD PRO 29 -11.568 12.647 -3.249 230 HD3 PRO 29 2HD PRO 29 -11.202 11.659 -4.674 231 H GLU 30 H GLU 30 -8.948 14.407 -2.376 232 HA GLU 30 HA GLU 30 -6.762 16.143 -2.418 233 HB2 GLU 30 1HB GLU 30 -8.804 16.507 -1.068 234 HB3 GLU 30 2HB GLU 30 -8.323 15.187 -0.008 235 HG2 GLU 30 1HG GLU 30 -6.208 17.108 -0.300 236 HG3 GLU 30 2HG GLU 30 -7.693 17.878 0.251 237 H THR 31 H THR 31 -7.224 13.109 -0.599 238 HA THR 31 HA THR 31 -4.692 13.141 0.666 239 HB THR 31 HB THR 31 -5.382 10.428 0.228 240 HG1 THR 31 HG1 THR 31 -7.673 11.935 0.927 241 HG21 THR 31 3HG2 THR 31 -4.591 10.996 2.343 242 HG22 THR 31 1HG2 THR 31 -6.293 10.622 2.601 243 HG23 THR 31 2HG2 THR 31 -5.763 12.301 2.537 244 H VAL 32 H VAL 32 -5.762 11.691 -2.388 245 HA VAL 32 HA VAL 32 -3.537 10.307 -3.176 246 HB VAL 32 HB VAL 32 -5.266 12.083 -4.910 247 HG11 VAL 32 1HG1 VAL 32 -3.644 11.646 -6.420 248 HG12 VAL 32 2HG1 VAL 32 -4.487 10.103 -6.551 249 HG13 VAL 32 3HG1 VAL 32 -3.051 10.238 -5.538 250 HG21 VAL 32 3HG2 VAL 32 -6.030 9.516 -5.394 251 HG22 VAL 32 1HG2 VAL 32 -6.841 10.615 -4.279 252 HG23 VAL 32 2HG2 VAL 32 -5.658 9.456 -3.671 253 H ARG 33 H ARG 33 -4.062 13.787 -3.241 254 HA ARG 33 HA ARG 33 -1.822 14.545 -4.730 255 HE ARG 33 HE ARG 33 -2.360 19.803 -5.573 256 HB2 ARG 33 1HB ARG 33 -3.805 15.972 -3.932 257 HB3 ARG 33 2HB ARG 33 -2.918 16.149 -2.426 258 HG2 ARG 33 1HG ARG 33 -1.913 17.908 -3.327 259 HG3 ARG 33 2HG ARG 33 -1.069 16.798 -4.406 260 HD2 ARG 33 1HD ARG 33 -2.172 17.599 -6.164 261 HD3 ARG 33 2HD ARG 33 -3.723 17.278 -5.389 262 HH11 ARG 33 1HH1 ARG 33 -4.708 17.940 -3.784 263 HH12 ARG 33 2HH1 ARG 33 -5.524 19.335 -3.159 264 HH21 ARG 33 1HH2 ARG 33 -3.431 21.638 -4.751 265 HH22 ARG 33 2HH2 ARG 33 -4.799 21.434 -3.708 266 H ALA 34 H ALA 34 -2.147 13.686 -1.340 267 HA ALA 34 HA ALA 34 0.404 14.638 -0.515 268 HB1 ALA 34 3HB ALA 34 -0.124 12.709 1.289 269 HB2 ALA 34 1HB ALA 34 -1.745 13.005 0.659 270 HB3 ALA 34 2HB ALA 34 -0.812 14.331 1.354 271 H ILE 35 H ILE 35 -0.781 11.425 -1.459 272 HA ILE 35 HA ILE 35 1.593 9.997 -1.063 273 HB ILE 35 HB ILE 35 0.183 9.170 -3.503 274 HG12 ILE 35 1HG1 ILE 35 -1.734 10.205 -2.375 275 HG13 ILE 35 2HG1 ILE 35 -1.882 8.450 -2.384 276 HG21 ILE 35 1HG2 ILE 35 0.643 7.786 -0.869 277 HG22 ILE 35 2HG2 ILE 35 1.763 7.788 -2.232 278 HG23 ILE 35 3HG2 ILE 35 0.181 7.026 -2.391 279 HD11 ILE 35 3HD1 ILE 35 -2.434 9.785 -0.236 280 HD12 ILE 35 1HD1 ILE 35 -0.684 9.823 -0.023 281 HD13 ILE 35 2HD1 ILE 35 -1.527 8.278 -0.118 282 H ALA 36 H ALA 36 0.376 11.655 -4.015 283 HA ALA 36 HA ALA 36 2.641 11.157 -5.620 284 HB1 ALA 36 3HB ALA 36 1.568 12.356 -7.197 285 HB2 ALA 36 1HB ALA 36 1.180 13.674 -6.091 286 HB3 ALA 36 2HB ALA 36 0.201 12.207 -6.090 287 H ASP 37 H ASP 37 1.942 13.551 -3.164 288 HA ASP 37 HA ASP 37 4.064 15.333 -3.861 289 HB2 ASP 37 1HB ASP 37 2.000 15.767 -2.347 290 HB3 ASP 37 2HB ASP 37 2.979 15.049 -1.070 291 H ALA 38 H ALA 38 3.871 12.372 -2.082 292 HA ALA 38 HA ALA 38 6.532 12.684 -0.948 293 HB1 ALA 38 3HB ALA 38 5.885 11.247 0.661 294 HB2 ALA 38 1HB ALA 38 5.035 10.197 -0.475 295 HB3 ALA 38 2HB ALA 38 4.260 11.670 0.109 296 H LEU 39 H LEU 39 6.801 12.544 -3.607 297 HA LEU 39 HA LEU 39 6.964 9.964 -4.738 298 HG LEU 39 HG LEU 39 6.323 13.122 -5.873 299 HB2 LEU 39 1HB LEU 39 8.529 12.445 -5.488 300 HB3 LEU 39 2HB LEU 39 8.341 11.012 -6.472 301 HD11 LEU 39 1HD1 LEU 39 7.075 13.609 -7.932 302 HD12 LEU 39 2HD1 LEU 39 5.994 12.307 -8.433 303 HD13 LEU 39 3HD1 LEU 39 7.711 11.984 -8.196 304 HD21 LEU 39 3HD2 LEU 39 4.613 11.584 -6.901 305 HD22 LEU 39 1HD2 LEU 39 5.096 11.168 -5.258 306 HD23 LEU 39 2HD2 LEU 39 5.738 10.260 -6.620 307 HA PRO 40 HA PRO 40 11.093 8.074 -4.126 308 HB2 PRO 40 1HB PRO 40 12.576 10.574 -4.873 309 HB3 PRO 40 2HB PRO 40 13.038 8.882 -5.111 310 HG2 PRO 40 1HG PRO 40 11.887 10.358 -7.067 311 HG3 PRO 40 2HG PRO 40 11.652 8.611 -6.918 312 HD2 PRO 40 1HD PRO 40 9.733 10.749 -6.541 313 HD3 PRO 40 2HD PRO 40 9.448 9.003 -6.601 314 H ILE 41 H ILE 41 10.875 7.873 -1.995 315 HA ILE 41 HA ILE 41 12.331 9.744 -0.298 316 HB ILE 41 HB ILE 41 9.415 9.043 0.082 317 HG12 ILE 41 1HG1 ILE 41 10.979 11.640 0.181 318 HG13 ILE 41 2HG1 ILE 41 9.878 11.131 -1.093 319 HG21 ILE 41 1HG2 ILE 41 10.495 8.481 2.178 320 HG22 ILE 41 2HG2 ILE 41 9.579 9.975 2.367 321 HG23 ILE 41 3HG2 ILE 41 11.333 10.032 2.197 322 HD11 ILE 41 3HD1 ILE 41 8.566 11.123 1.474 323 HD12 ILE 41 1HD1 ILE 41 8.137 11.973 -0.011 324 HD13 ILE 41 2HD1 ILE 41 9.283 12.693 1.118 325 H LYS 42 H LYS 42 13.130 8.759 1.619 326 HA LYS 42 HA LYS 42 13.400 5.893 1.349 327 HB2 LYS 42 1HB LYS 42 14.771 8.008 2.946 328 HB3 LYS 42 2HB LYS 42 14.888 6.338 3.486 329 HG2 LYS 42 1HG LYS 42 15.541 5.939 0.957 330 HG3 LYS 42 2HG LYS 42 16.012 7.636 1.066 331 HD2 LYS 42 1HD LYS 42 16.903 5.903 3.285 332 HD3 LYS 42 2HD LYS 42 17.637 5.584 1.710 333 HE2 LYS 42 1HE LYS 42 17.472 8.421 2.478 334 HE3 LYS 42 2HE LYS 42 18.537 7.432 3.476 335 HZ1 LYS 42 3HZ LYS 42 19.938 7.023 1.740 336 HZ2 LYS 42 1HZ LYS 42 19.403 8.568 1.305 337 HZ3 LYS 42 2HZ LYS 42 18.741 7.203 0.560 338 H SER 43 H SER 43 12.530 4.358 2.593 339 HA SER 43 HA SER 43 11.236 5.057 5.112 340 HG SER 43 HG SER 43 8.895 3.024 2.507 341 HB2 SER 43 1HB SER 43 9.128 4.341 4.551 342 HB3 SER 43 2HB SER 43 9.630 4.997 3.000 343 H THR 44 H THR 44 11.028 3.291 6.565 344 HA THR 44 HA THR 44 12.775 1.020 5.861 345 HB THR 44 HB THR 44 11.893 1.252 8.659 346 HG1 THR 44 HG1 THR 44 13.262 3.056 9.045 347 HG21 THR 44 3HG2 THR 44 14.191 0.348 7.204 348 HG22 THR 44 1HG2 THR 44 13.738 0.057 8.884 349 HG23 THR 44 2HG2 THR 44 14.672 1.491 8.460 350 H ALA 45 H ALA 45 12.009 -0.987 5.692 351 HA ALA 45 HA ALA 45 9.142 -1.371 5.967 352 HB1 ALA 45 3HB ALA 45 9.454 -2.494 4.081 353 HB2 ALA 45 1HB ALA 45 10.286 -3.737 5.014 354 HB3 ALA 45 2HB ALA 45 11.205 -2.429 4.274 355 H ASN 46 H ASN 46 8.138 -2.652 7.340 356 HA ASN 46 HA ASN 46 9.747 -4.098 9.340 357 HB2 ASN 46 1HB ASN 46 7.161 -2.624 9.454 358 HB3 ASN 46 2HB ASN 46 7.308 -4.060 10.466 359 HD21 ASN 46 1HD2 ASN 46 7.223 -1.074 10.970 360 HD22 ASN 46 2HD2 ASN 46 8.558 -0.794 12.029 361 H ARG 47 H ARG 47 9.715 -6.324 9.176 362 HA ARG 47 HA ARG 47 7.908 -7.506 7.275 363 HE ARG 47 HE ARG 47 7.817 -10.118 7.087 364 HB2 ARG 47 1HB ARG 47 10.394 -8.254 8.606 365 HB3 ARG 47 2HB ARG 47 9.279 -9.601 8.416 366 HG2 ARG 47 1HG ARG 47 9.458 -8.008 6.009 367 HG3 ARG 47 2HG ARG 47 11.031 -8.610 6.509 368 HD2 ARG 47 1HD ARG 47 9.447 -10.017 4.951 369 HD3 ARG 47 2HD ARG 47 10.464 -10.789 6.164 370 HH11 ARG 47 1HH1 ARG 47 9.791 -12.529 5.515 371 HH12 ARG 47 2HH1 ARG 47 8.746 -13.842 5.940 372 HH21 ARG 47 1HH2 ARG 47 6.442 -11.847 7.646 373 HH22 ARG 47 2HH2 ARG 47 6.845 -13.456 7.148 374 H TRP 48 H TRP 48 6.225 -8.820 7.608 375 HA TRP 48 HA TRP 48 5.616 -9.908 10.221 376 HD1 TRP 48 HD1 TRP 48 1.890 -10.063 8.976 377 HE1 TRP 48 HE1 TRP 48 0.310 -10.705 10.906 378 HE3 TRP 48 HE3 TRP 48 4.310 -7.697 12.806 379 HZ2 TRP 48 HZ2 TRP 48 0.133 -10.264 13.700 380 HZ3 TRP 48 HZ3 TRP 48 3.373 -7.858 15.075 381 HH2 TRP 48 HH2 TRP 48 1.327 -9.114 15.510 382 HB2 TRP 48 1HB TRP 48 4.607 -7.678 10.392 383 HB3 TRP 48 2HB TRP 48 3.740 -7.940 8.881 384 H GLY 49 H GLY 49 4.086 -11.607 10.125 385 HA2 GLY 49 1HA GLY 49 4.145 -13.400 8.159 386 HA3 GLY 49 2HA GLY 49 2.691 -13.170 9.113 387 H ASP 50 H ASP 50 4.255 -12.607 6.072 388 HA ASP 50 HA ASP 50 3.524 -11.920 4.037 389 HB2 ASP 50 1HB ASP 50 0.846 -12.910 5.020 390 HB3 ASP 50 2HB ASP 50 1.359 -12.739 3.345 391 H GLU 51 H GLU 51 3.345 -10.003 6.290 392 HA GLU 51 HA GLU 51 1.581 -8.070 4.971 393 HB2 GLU 51 1HB GLU 51 0.407 -8.956 6.977 394 HB3 GLU 51 2HB GLU 51 1.756 -8.423 7.969 395 HG2 GLU 51 1HG GLU 51 -0.237 -6.917 7.972 396 HG3 GLU 51 2HG GLU 51 1.291 -6.145 7.553 397 H ILE 52 H ILE 52 2.425 -6.010 4.843 398 HA ILE 52 HA ILE 52 4.883 -5.464 6.344 399 HB ILE 52 HB ILE 52 4.873 -6.159 3.619 400 HG12 ILE 52 1HG1 ILE 52 7.350 -5.323 3.894 401 HG13 ILE 52 2HG1 ILE 52 6.881 -5.103 5.576 402 HG21 ILE 52 1HG2 ILE 52 5.507 -3.234 3.966 403 HG22 ILE 52 2HG2 ILE 52 4.198 -3.922 3.002 404 HG23 ILE 52 3HG2 ILE 52 5.875 -4.199 2.537 405 HD11 ILE 52 3HD1 ILE 52 6.239 -7.495 5.657 406 HD12 ILE 52 1HD1 ILE 52 7.945 -7.227 5.319 407 HD13 ILE 52 2HD1 ILE 52 6.856 -7.677 4.014 408 H TYR 53 H TYR 53 4.777 -3.564 7.300 409 HA TYR 53 HA TYR 53 3.259 -1.397 6.018 410 HD1 TYR 53 HD1 TYR 53 4.100 -0.231 9.921 411 HD2 TYR 53 HD2 TYR 53 2.651 -4.171 9.202 412 HE1 TYR 53 HE1 TYR 53 5.024 -0.960 12.077 413 HE2 TYR 53 HE2 TYR 53 3.573 -4.907 11.358 414 HH TYR 53 HH TYR 53 4.156 -3.669 13.631 415 HB2 TYR 53 1HB TYR 53 2.388 -0.680 8.194 416 HB3 TYR 53 2HB TYR 53 1.896 -2.336 7.844 417 H PHE 54 H PHE 54 4.436 0.361 5.711 418 HA PHE 54 HA PHE 54 6.628 0.947 7.573 419 HD1 PHE 54 HD1 PHE 54 6.694 3.399 4.545 420 HD2 PHE 54 HD2 PHE 54 6.870 -0.691 3.387 421 HE1 PHE 54 HE1 PHE 54 5.986 4.013 2.274 422 HE2 PHE 54 HE2 PHE 54 6.158 -0.084 1.117 423 HZ PHE 54 HZ PHE 54 5.716 2.273 0.557 424 HB2 PHE 54 1HB PHE 54 8.129 1.510 5.774 425 HB3 PHE 54 2HB PHE 54 7.533 -0.121 5.509 426 H THR 55 H THR 55 7.069 3.116 7.931 427 HA THR 55 HA THR 55 4.916 4.945 7.146 428 HB THR 55 HB THR 55 7.114 5.937 8.864 429 HG1 THR 55 HG1 THR 55 7.111 4.135 9.970 430 HG21 THR 55 3HG2 THR 55 4.124 5.901 9.198 431 HG22 THR 55 1HG2 THR 55 5.093 7.242 8.590 432 HG23 THR 55 2HG2 THR 55 5.271 6.713 10.262 433 H THR 56 H THR 56 5.293 6.908 6.043 434 HA THR 56 HA THR 56 7.919 7.047 4.709 435 HB THR 56 HB THR 56 6.027 8.443 3.150 436 HG1 THR 56 HG1 THR 56 4.348 7.135 2.973 437 HG21 THR 56 3HG2 THR 56 7.260 7.434 1.621 438 HG22 THR 56 1HG2 THR 56 6.421 5.926 1.988 439 HG23 THR 56 2HG2 THR 56 7.923 6.328 2.828 440 H GLN 57 H GLN 57 6.313 8.514 7.065 441 HA GLN 57 HA GLN 57 6.766 10.487 8.143 442 HB2 GLN 57 1HB GLN 57 8.071 11.661 5.698 443 HB3 GLN 57 2HB GLN 57 8.354 12.038 7.393 444 HG2 GLN 57 1HG GLN 57 8.984 9.307 7.029 445 HG3 GLN 57 2HG GLN 57 9.733 10.206 5.710 446 HE21 GLN 57 1HE2 GLN 57 11.630 11.096 6.100 447 HE22 GLN 57 2HE2 GLN 57 12.301 11.416 7.660 448 H VAL 58 H VAL 58 4.967 10.095 5.332 449 HA VAL 58 HA VAL 58 3.948 12.819 5.300 450 HB VAL 58 HB VAL 58 4.181 11.642 3.156 451 HG11 VAL 58 1HG1 VAL 58 2.791 9.783 2.539 452 HG12 VAL 58 2HG1 VAL 58 1.983 9.813 4.108 453 HG13 VAL 58 3HG1 VAL 58 3.685 9.364 4.003 454 HG21 VAL 58 3HG2 VAL 58 1.413 12.412 4.031 455 HG22 VAL 58 1HG2 VAL 58 1.793 12.000 2.359 456 HG23 VAL 58 2HG2 VAL 58 2.589 13.370 3.133 457 H ALA 59 H ALA 59 2.488 13.436 6.743 458 HA ALA 59 HA ALA 59 0.750 11.392 7.938 459 HB1 ALA 59 3HB ALA 59 0.482 12.780 9.822 460 HB2 ALA 59 1HB ALA 59 1.123 14.188 8.979 461 HB3 ALA 59 2HB ALA 59 2.194 12.854 9.412 462 H VAL 60 H VAL 60 -0.900 11.198 6.501 463 HA VAL 60 HA VAL 60 -2.665 13.543 6.278 464 HB VAL 60 HB VAL 60 -1.637 13.339 4.113 465 HG11 VAL 60 1HG1 VAL 60 -0.763 11.371 3.546 466 HG12 VAL 60 2HG1 VAL 60 -2.384 10.906 3.028 467 HG13 VAL 60 3HG1 VAL 60 -1.821 10.491 4.647 468 HG21 VAL 60 3HG2 VAL 60 -3.622 12.727 2.692 469 HG22 VAL 60 1HG2 VAL 60 -3.935 13.914 3.957 470 HG23 VAL 60 2HG2 VAL 60 -4.439 12.239 4.174 471 H GLU 61 H GLU 61 -4.334 13.002 7.586 472 HA GLU 61 HA GLU 61 -5.578 10.368 7.146 473 HB2 GLU 61 1HB GLU 61 -4.467 11.469 9.594 474 HB3 GLU 61 2HB GLU 61 -6.159 11.036 9.787 475 HG2 GLU 61 1HG GLU 61 -5.609 8.784 8.870 476 HG3 GLU 61 2HG GLU 61 -3.908 9.247 8.908 477 H LYS 62 H LYS 62 -7.716 10.365 6.850 478 HA LYS 62 HA LYS 62 -9.294 12.683 7.673 479 HB2 LYS 62 1HB LYS 62 -8.692 13.160 5.366 480 HB3 LYS 62 2HB LYS 62 -9.227 11.564 4.862 481 HG2 LYS 62 1HG LYS 62 -11.517 12.121 5.360 482 HG3 LYS 62 2HG LYS 62 -11.025 13.681 6.024 483 HD2 LYS 62 1HD LYS 62 -10.015 14.143 3.722 484 HD3 LYS 62 2HD LYS 62 -10.949 12.753 3.166 485 HE2 LYS 62 1HE LYS 62 -12.963 13.812 3.472 486 HE3 LYS 62 2HE LYS 62 -12.334 14.879 4.726 487 HZ1 LYS 62 3HZ LYS 62 -12.823 15.671 2.242 488 HZ2 LYS 62 1HZ LYS 62 -11.200 15.221 2.072 489 HZ3 LYS 62 2HZ LYS 62 -11.640 16.383 3.221 490 H GLU 63 H GLU 63 -11.697 12.210 7.465 491 HA GLU 63 HA GLU 63 -12.158 9.421 8.231 492 HB2 GLU 63 1HB GLU 63 -14.217 11.578 8.489 493 HB3 GLU 63 2HB GLU 63 -14.005 10.128 9.459 494 HG2 GLU 63 1HG GLU 63 -13.275 11.705 10.928 495 HG3 GLU 63 2HG GLU 63 -11.755 11.298 10.134 496 H GLU 64 H GLU 64 -12.282 8.440 6.225 497 HA GLU 64 HA GLU 64 -14.823 8.474 4.976 498 HB2 GLU 64 1HB GLU 64 -14.376 10.327 3.710 499 HB3 GLU 64 2HB GLU 64 -12.638 10.086 3.773 500 HG2 GLU 64 1HG GLU 64 -12.665 8.575 1.995 501 HG3 GLU 64 2HG GLU 64 -14.399 8.297 2.136 502 H ASN 65 H ASN 65 -14.990 6.855 3.255 503 HA ASN 65 HA ASN 65 -14.580 4.810 2.354 504 HB2 ASN 65 1HB ASN 65 -12.681 5.907 1.276 505 HB3 ASN 65 2HB ASN 65 -11.691 5.653 2.712 506 HD21 ASN 65 1HD2 ASN 65 -12.058 4.617 -0.284 507 HD22 ASN 65 2HD2 ASN 65 -11.615 2.956 -0.122 508 H SER 66 H SER 66 -11.700 4.836 4.369 509 HA SER 66 HA SER 66 -10.927 3.147 5.773 510 HG SER 66 HG SER 66 -11.004 5.387 6.934 511 HB2 SER 66 1HB SER 66 -13.205 4.613 7.003 512 HB3 SER 66 2HB SER 66 -12.572 3.215 7.872 513 H LYS 67 H LYS 67 -11.356 1.254 4.396 514 HA LYS 67 HA LYS 67 -13.759 -0.250 5.203 515 HB2 LYS 67 1HB LYS 67 -13.241 -1.782 3.299 516 HB3 LYS 67 2HB LYS 67 -13.616 -0.143 2.803 517 HG2 LYS 67 1HG LYS 67 -11.832 -0.712 1.459 518 HG3 LYS 67 2HG LYS 67 -11.048 0.182 2.759 519 HD2 LYS 67 1HD LYS 67 -10.489 -1.954 3.856 520 HD3 LYS 67 2HD LYS 67 -11.252 -2.823 2.527 521 HE2 LYS 67 1HE LYS 67 -9.606 -2.164 1.006 522 HE3 LYS 67 2HE LYS 67 -9.038 -0.862 2.051 523 HZ1 LYS 67 3HZ LYS 67 -8.843 -3.532 3.168 524 HZ2 LYS 67 1HZ LYS 67 -7.741 -2.253 3.221 525 HZ3 LYS 67 2HZ LYS 67 -7.832 -3.231 1.848 526 H ASP 68 H ASP 68 -13.535 -2.567 5.677 527 HA ASP 68 HA ASP 68 -10.890 -3.178 6.844 528 HB2 ASP 68 1HB ASP 68 -12.190 -4.460 8.607 529 HB3 ASP 68 2HB ASP 68 -12.301 -2.704 8.686 530 H VAL 69 H VAL 69 -12.957 -4.131 4.457 531 HA VAL 69 HA VAL 69 -12.009 -6.912 4.676 532 HB VAL 69 HB VAL 69 -14.531 -6.562 5.064 533 HG11 VAL 69 1HG1 VAL 69 -15.904 -5.896 3.413 534 HG12 VAL 69 2HG1 VAL 69 -14.972 -6.721 2.165 535 HG13 VAL 69 3HG1 VAL 69 -14.452 -5.143 2.754 536 HG21 VAL 69 3HG2 VAL 69 -13.697 -8.752 4.796 537 HG22 VAL 69 1HG2 VAL 69 -13.393 -8.508 3.076 538 HG23 VAL 69 2HG2 VAL 69 -15.049 -8.613 3.672 539 H VAL 70 H VAL 70 -11.148 -7.828 2.897 540 HA VAL 70 HA VAL 70 -11.504 -6.747 0.253 541 HB VAL 70 HB VAL 70 -9.117 -6.244 -0.156 542 HG11 VAL 70 1HG1 VAL 70 -10.090 -4.531 2.104 543 HG12 VAL 70 2HG1 VAL 70 -10.843 -4.508 0.509 544 HG13 VAL 70 3HG1 VAL 70 -9.148 -4.057 0.691 545 HG21 VAL 70 3HG2 VAL 70 -8.749 -6.342 2.833 546 HG22 VAL 70 1HG2 VAL 70 -7.534 -5.958 1.622 547 HG23 VAL 70 2HG2 VAL 70 -8.180 -7.596 1.735 548 H GLU 71 H GLU 71 -10.162 -8.002 -1.394 549 HA GLU 71 HA GLU 71 -9.510 -10.678 -0.317 550 HB2 GLU 71 1HB GLU 71 -11.596 -10.126 -2.181 551 HB3 GLU 71 2HB GLU 71 -10.316 -10.942 -3.060 552 HG2 GLU 71 1HG GLU 71 -11.776 -11.911 -0.621 553 HG3 GLU 71 2HG GLU 71 -11.858 -12.564 -2.256 554 H LEU 72 H LEU 72 -8.029 -11.929 -1.599 555 HA LEU 72 HA LEU 72 -5.598 -10.884 -1.989 556 HG LEU 72 HG LEU 72 -4.434 -12.042 -4.285 557 HB2 LEU 72 1HB LEU 72 -5.946 -13.253 -2.098 558 HB3 LEU 72 2HB LEU 72 -6.910 -13.108 -3.555 559 HD11 LEU 72 1HD1 LEU 72 -3.795 -14.678 -3.075 560 HD12 LEU 72 2HD1 LEU 72 -3.793 -13.264 -2.023 561 HD13 LEU 72 3HD1 LEU 72 -2.743 -13.312 -3.439 562 HD21 LEU 72 3HD2 LEU 72 -4.524 -13.638 -5.901 563 HD22 LEU 72 1HD2 LEU 72 -6.189 -13.738 -5.329 564 HD23 LEU 72 2HD2 LEU 72 -4.994 -14.913 -4.776 565 H GLY 73 H GLY 73 -4.546 -9.563 -3.361 566 HA2 GLY 73 1HA GLY 73 -4.076 -8.972 -5.699 567 HA3 GLY 73 2HA GLY 73 -5.804 -9.037 -5.987 568 H ASP 74 H ASP 74 -6.446 -7.544 -3.513 569 HA ASP 74 HA ASP 74 -6.003 -4.908 -4.639 570 HB2 ASP 74 1HB ASP 74 -7.581 -4.234 -2.716 571 HB3 ASP 74 2HB ASP 74 -8.236 -5.201 -4.034 572 H VAL 75 H VAL 75 -5.369 -3.082 -3.398 573 HA VAL 75 HA VAL 75 -3.494 -3.734 -1.196 574 HB VAL 75 HB VAL 75 -3.202 -1.433 -3.159 575 HG11 VAL 75 1HG1 VAL 75 -2.173 -1.183 -0.873 576 HG12 VAL 75 2HG1 VAL 75 -1.060 -1.062 -2.236 577 HG13 VAL 75 3HG1 VAL 75 -1.127 -2.545 -1.282 578 HG21 VAL 75 3HG2 VAL 75 -1.189 -3.521 -3.300 579 HG22 VAL 75 1HG2 VAL 75 -2.101 -2.737 -4.589 580 HG23 VAL 75 2HG2 VAL 75 -2.800 -4.103 -3.721 581 H ALA 76 H ALA 76 -3.332 -2.083 0.563 582 HA ALA 76 HA ALA 76 -5.356 0.013 0.482 583 HB1 ALA 76 3HB ALA 76 -6.216 -0.702 2.735 584 HB2 ALA 76 1HB ALA 76 -5.359 -2.220 2.487 585 HB3 ALA 76 2HB ALA 76 -6.648 -1.747 1.383 586 H TYR 77 H TYR 77 -5.071 1.697 1.985 587 HA TYR 77 HA TYR 77 -2.415 1.713 3.261 588 HD1 TYR 77 HD1 TYR 77 -2.033 4.648 4.680 589 HD2 TYR 77 HD2 TYR 77 -5.296 5.166 1.999 590 HE1 TYR 77 HE1 TYR 77 -2.793 6.589 5.982 591 HE2 TYR 77 HE2 TYR 77 -6.058 7.108 3.295 592 HH TYR 77 HH TYR 77 -4.989 8.811 4.863 593 HB2 TYR 77 1HB TYR 77 -2.081 3.694 2.272 594 HB3 TYR 77 2HB TYR 77 -3.658 3.574 1.505 595 H TRP 78 H TRP 78 -2.318 1.802 5.415 596 HA TRP 78 HA TRP 78 -4.666 1.699 6.996 597 HD1 TRP 78 HD1 TRP 78 -5.472 1.552 8.852 598 HE1 TRP 78 HE1 TRP 78 -5.759 0.611 11.230 599 HE3 TRP 78 HE3 TRP 78 -0.572 0.571 9.932 600 HZ2 TRP 78 HZ2 TRP 78 -4.124 -0.421 13.289 601 HZ3 TRP 78 HZ3 TRP 78 -0.020 -0.394 12.127 602 HH2 TRP 78 HH2 TRP 78 -1.760 -0.878 13.769 603 HB2 TRP 78 1HB TRP 78 -2.250 0.793 7.468 604 HB3 TRP 78 2HB TRP 78 -1.993 2.386 8.169 605 H ILE 79 H ILE 79 -5.972 3.395 7.375 606 HA ILE 79 HA ILE 79 -5.133 6.081 7.073 607 HB ILE 79 HB ILE 79 -7.652 4.735 7.854 608 HG12 ILE 79 1HG1 ILE 79 -6.630 6.631 5.826 609 HG13 ILE 79 2HG1 ILE 79 -7.699 5.251 5.643 610 HG21 ILE 79 1HG2 ILE 79 -8.730 6.820 8.557 611 HG22 ILE 79 2HG2 ILE 79 -7.163 7.630 8.541 612 HG23 ILE 79 3HG2 ILE 79 -7.469 6.325 9.687 613 HD11 ILE 79 3HD1 ILE 79 -9.118 6.972 5.154 614 HD12 ILE 79 1HD1 ILE 79 -8.341 8.079 6.286 615 HD13 ILE 79 2HD1 ILE 79 -9.403 6.805 6.887 616 HA PRO 80 HA PRO 80 -5.268 6.428 11.881 617 HB2 PRO 80 1HB PRO 80 -5.434 3.673 12.881 618 HB3 PRO 80 2HB PRO 80 -6.407 5.080 13.315 619 HG2 PRO 80 1HG PRO 80 -7.409 3.027 11.886 620 HG3 PRO 80 2HG PRO 80 -7.942 4.700 11.644 621 HD2 PRO 80 1HD PRO 80 -6.030 3.066 10.022 622 HD3 PRO 80 2HD PRO 80 -7.297 4.180 9.483 623 H GLY 81 H GLY 81 -3.086 6.474 10.556 624 HA2 GLY 81 1HA GLY 81 -0.969 5.999 12.135 625 HA3 GLY 81 2HA GLY 81 -1.178 4.433 11.368 626 H LYS 82 H LYS 82 -2.223 6.314 8.983 627 HA LYS 82 HA LYS 82 -1.310 7.034 6.999 628 HB2 LYS 82 1HB LYS 82 1.169 7.973 8.352 629 HB3 LYS 82 2HB LYS 82 0.180 8.771 7.140 630 HG2 LYS 82 1HG LYS 82 -0.672 10.033 8.750 631 HG3 LYS 82 2HG LYS 82 -1.432 8.592 9.431 632 HD2 LYS 82 1HD LYS 82 0.731 8.154 10.640 633 HD3 LYS 82 2HD LYS 82 1.257 9.756 10.120 634 HE2 LYS 82 1HE LYS 82 -1.297 9.283 11.641 635 HE3 LYS 82 2HE LYS 82 0.245 9.600 12.437 636 HZ1 LYS 82 3HZ LYS 82 -0.869 11.424 10.390 637 HZ2 LYS 82 1HZ LYS 82 0.350 11.738 11.521 638 HZ3 LYS 82 2HZ LYS 82 -1.255 11.574 12.030 639 H ALA 83 H ALA 83 -0.620 4.348 8.031 640 HA ALA 83 HA ALA 83 1.951 3.951 6.646 641 HB1 ALA 83 3HB ALA 83 0.801 2.793 9.079 642 HB2 ALA 83 1HB ALA 83 2.485 2.983 8.598 643 HB3 ALA 83 2HB ALA 83 1.544 1.621 7.992 644 H ILE 84 H ILE 84 2.022 2.728 4.855 645 HA ILE 84 HA ILE 84 -0.472 1.637 3.818 646 HB ILE 84 HB ILE 84 2.197 1.519 2.434 647 HG12 ILE 84 1HG1 ILE 84 0.243 3.830 2.463 648 HG13 ILE 84 2HG1 ILE 84 1.874 3.840 3.126 649 HG21 ILE 84 1HG2 ILE 84 -0.613 1.711 1.363 650 HG22 ILE 84 2HG2 ILE 84 0.322 0.222 1.505 651 HG23 ILE 84 3HG2 ILE 84 0.860 1.502 0.418 652 HD11 ILE 84 3HD1 ILE 84 1.902 3.059 0.356 653 HD12 ILE 84 1HD1 ILE 84 2.733 4.392 1.160 654 HD13 ILE 84 2HD1 ILE 84 1.080 4.605 0.575 655 H CYS 85 H CYS 85 -0.835 -0.552 3.362 656 HA CYS 85 HA CYS 85 1.262 -2.419 4.225 657 HG CYS 85 HG CYS 85 -0.694 -0.565 6.034 658 HB2 CYS 85 1HB CYS 85 -1.491 -3.206 4.947 659 HB3 CYS 85 2HB CYS 85 0.017 -3.435 5.832 660 H LEU 86 H LEU 86 1.567 -4.164 2.974 661 HA LEU 86 HA LEU 86 -0.109 -4.497 0.617 662 HG LEU 86 HG LEU 86 1.326 -4.234 -0.966 663 HB2 LEU 86 1HB LEU 86 2.620 -5.069 1.349 664 HB3 LEU 86 2HB LEU 86 1.860 -6.530 0.748 665 HD11 LEU 86 1HD1 LEU 86 3.463 -3.720 -1.708 666 HD12 LEU 86 2HD1 LEU 86 4.175 -5.147 -0.955 667 HD13 LEU 86 3HD1 LEU 86 3.664 -3.786 0.043 668 HD21 LEU 86 3HD2 LEU 86 0.866 -6.392 -1.790 669 HD22 LEU 86 1HD2 LEU 86 2.443 -7.010 -1.290 670 HD23 LEU 86 2HD2 LEU 86 2.324 -5.871 -2.634 671 H PHE 87 H PHE 87 -0.846 -6.689 -0.011 672 HA PHE 87 HA PHE 87 -1.326 -8.477 2.265 673 HD1 PHE 87 HD1 PHE 87 -3.155 -7.387 3.970 674 HD2 PHE 87 HD2 PHE 87 -3.903 -5.542 0.214 675 HE1 PHE 87 HE1 PHE 87 -3.714 -5.289 5.120 676 HE2 PHE 87 HE2 PHE 87 -4.474 -3.447 1.356 677 HZ PHE 87 HZ PHE 87 -4.376 -3.311 3.812 678 HB2 PHE 87 1HB PHE 87 -3.513 -7.814 0.298 679 HB3 PHE 87 2HB PHE 87 -3.647 -8.691 1.819 680 H PHE 88 H PHE 88 -0.839 -10.509 1.796 681 HA PHE 88 HA PHE 88 -1.402 -11.688 -0.749 682 HD1 PHE 88 HD1 PHE 88 -0.169 -9.629 -2.602 683 HD2 PHE 88 HD2 PHE 88 1.417 -13.550 -2.147 684 HE1 PHE 88 HE1 PHE 88 -0.310 -9.962 -5.037 685 HE2 PHE 88 HE2 PHE 88 1.281 -13.892 -4.580 686 HZ PHE 88 HZ PHE 88 0.417 -12.097 -6.029 687 HB2 PHE 88 1HB PHE 88 1.037 -10.344 -0.552 688 HB3 PHE 88 2HB PHE 88 1.453 -12.042 -0.336 689 H GLY 89 H GLY 89 -2.405 -12.564 1.556 690 HA2 GLY 89 1HA GLY 89 -2.056 -15.177 1.785 691 HA3 GLY 89 2HA GLY 89 -0.634 -14.618 2.650 692 H LYS 90 H LYS 90 -1.052 -13.118 4.504 693 HA LYS 90 HA LYS 90 -3.676 -13.152 5.649 694 HB2 LYS 90 1HB LYS 90 -2.951 -14.314 7.771 695 HB3 LYS 90 2HB LYS 90 -3.192 -15.340 6.371 696 HG2 LYS 90 1HG LYS 90 -0.536 -14.435 7.498 697 HG3 LYS 90 2HG LYS 90 -1.249 -16.041 7.605 698 HD2 LYS 90 1HD LYS 90 -1.293 -15.874 4.993 699 HD3 LYS 90 2HD LYS 90 -0.025 -14.676 5.260 700 HE2 LYS 90 1HE LYS 90 1.380 -16.236 6.289 701 HE3 LYS 90 2HE LYS 90 0.064 -17.383 6.532 702 HZ1 LYS 90 3HZ LYS 90 1.493 -16.729 4.031 703 HZ2 LYS 90 1HZ LYS 90 -0.034 -17.459 4.001 704 HZ3 LYS 90 2HZ LYS 90 1.265 -18.242 4.749 705 H THR 91 H THR 91 -3.559 -12.303 8.037 706 HA THR 91 HA THR 91 -1.397 -10.345 8.317 707 HB THR 91 HB THR 91 -3.887 -9.240 9.250 708 HG1 THR 91 HG1 THR 91 -5.180 -9.507 7.623 709 HG21 THR 91 3HG2 THR 91 -1.581 -8.357 7.926 710 HG22 THR 91 1HG2 THR 91 -2.916 -7.388 8.548 711 HG23 THR 91 2HG2 THR 91 -2.944 -7.962 6.881 712 HA PRO 92 HA PRO 92 -1.297 -10.936 12.714 713 HB2 PRO 92 1HB PRO 92 -3.241 -8.729 13.256 714 HB3 PRO 92 2HB PRO 92 -1.680 -9.066 14.017 715 HG2 PRO 92 1HG PRO 92 -1.902 -7.130 12.211 716 HG3 PRO 92 2HG PRO 92 -0.474 -8.183 12.238 717 HD2 PRO 92 1HD PRO 92 -2.787 -8.170 10.364 718 HD3 PRO 92 2HD PRO 92 -1.084 -8.564 10.052 719 H ILE 93 H ILE 93 -4.458 -10.613 11.261 720 HA ILE 93 HA ILE 93 -5.458 -12.632 13.148 721 HB ILE 93 HB ILE 93 -7.155 -10.371 12.099 722 HG12 ILE 93 1HG1 ILE 93 -6.980 -9.982 14.802 723 HG13 ILE 93 2HG1 ILE 93 -5.348 -10.524 14.420 724 HG21 ILE 93 1HG2 ILE 93 -8.831 -11.152 13.575 725 HG22 ILE 93 2HG2 ILE 93 -7.711 -12.253 14.377 726 HG23 ILE 93 3HG2 ILE 93 -8.224 -12.570 12.719 727 HD11 ILE 93 3HD1 ILE 93 -5.357 -8.161 14.308 728 HD12 ILE 93 1HD1 ILE 93 -6.805 -8.148 13.303 729 HD13 ILE 93 2HD1 ILE 93 -5.284 -8.754 12.649 730 H SER 94 H SER 94 -4.653 -13.897 11.170 731 HA SER 94 HA SER 94 -6.071 -13.804 8.730 732 HG SER 94 HG SER 94 -2.861 -15.571 9.420 733 HB2 SER 94 1HB SER 94 -5.134 -16.476 9.390 734 HB3 SER 94 2HB SER 94 -4.589 -15.379 8.123 735 H ASP 95 H ASP 95 -6.208 -16.523 11.021 736 HA ASP 95 HA ASP 95 -7.884 -17.974 11.551 737 HB2 ASP 95 1HB ASP 95 -9.172 -15.272 11.739 738 HB3 ASP 95 2HB ASP 95 -10.119 -16.723 12.048 739 H ASP 96 H ASP 96 -7.460 -18.254 8.955 740 HA ASP 96 HA ASP 96 -8.391 -19.140 7.078 741 HB2 ASP 96 1HB ASP 96 -10.481 -19.390 9.061 742 HB3 ASP 96 2HB ASP 96 -11.170 -19.094 7.468 743 H LYS 97 H LYS 97 -8.691 -16.069 8.028 744 HA LYS 97 HA LYS 97 -9.751 -15.231 5.442 745 HB2 LYS 97 1HB LYS 97 -10.651 -13.962 8.036 746 HB3 LYS 97 2HB LYS 97 -11.168 -13.522 6.414 747 HG2 LYS 97 1HG LYS 97 -12.882 -14.900 6.644 748 HG3 LYS 97 2HG LYS 97 -11.748 -16.250 6.681 749 HD2 LYS 97 1HD LYS 97 -12.808 -16.586 8.677 750 HD3 LYS 97 2HD LYS 97 -11.511 -15.515 9.212 751 HE2 LYS 97 1HE LYS 97 -13.719 -14.871 10.109 752 HE3 LYS 97 2HE LYS 97 -12.987 -13.610 9.116 753 HZ1 LYS 97 3HZ LYS 97 -14.478 -13.977 7.406 754 HZ2 LYS 97 1HZ LYS 97 -15.452 -14.181 8.775 755 HZ3 LYS 97 2HZ LYS 97 -14.883 -15.532 7.932 756 H ILE 98 H ILE 98 -9.464 -12.651 5.400 757 HA ILE 98 HA ILE 98 -6.810 -12.094 6.551 758 HB ILE 98 HB ILE 98 -7.810 -11.358 3.800 759 HG12 ILE 98 1HG1 ILE 98 -5.363 -12.939 4.596 760 HG13 ILE 98 2HG1 ILE 98 -6.915 -13.691 4.233 761 HG21 ILE 98 1HG2 ILE 98 -5.238 -10.578 3.782 762 HG22 ILE 98 2HG2 ILE 98 -5.648 -10.225 5.460 763 HG23 ILE 98 3HG2 ILE 98 -6.578 -9.494 4.153 764 HD11 ILE 98 3HD1 ILE 98 -6.511 -13.599 2.063 765 HD12 ILE 98 1HD1 ILE 98 -4.880 -13.052 2.450 766 HD13 ILE 98 2HD1 ILE 98 -6.157 -11.873 2.142 767 H ARG 99 H ARG 99 -7.547 -10.895 8.264 768 HA ARG 99 HA ARG 99 -9.183 -8.531 7.691 769 HE ARG 99 HE ARG 99 -10.931 -9.729 12.096 770 HB2 ARG 99 1HB ARG 99 -9.402 -10.291 9.725 771 HB3 ARG 99 2HB ARG 99 -8.310 -9.130 10.465 772 HG2 ARG 99 1HG ARG 99 -10.045 -7.860 10.969 773 HG3 ARG 99 2HG ARG 99 -10.356 -7.633 9.248 774 HD2 ARG 99 1HD ARG 99 -12.363 -8.464 10.189 775 HD3 ARG 99 2HD ARG 99 -11.632 -9.805 9.310 776 HH11 ARG 99 1HH1 ARG 99 -13.285 -10.830 9.767 777 HH12 ARG 99 2HH1 ARG 99 -13.862 -12.117 10.770 778 HH21 ARG 99 1HH2 ARG 99 -11.690 -11.422 13.420 779 HH22 ARG 99 2HH2 ARG 99 -12.957 -12.453 12.846 780 HA PRO 100 HA PRO 100 -5.066 -6.581 7.639 781 HB2 PRO 100 1HB PRO 100 -5.840 -4.340 6.339 782 HB3 PRO 100 2HB PRO 100 -5.574 -5.876 5.508 783 HG2 PRO 100 1HG PRO 100 -8.155 -4.689 6.472 784 HG3 PRO 100 2HG PRO 100 -7.773 -5.381 4.876 785 HD2 PRO 100 1HD PRO 100 -9.068 -6.800 6.754 786 HD3 PRO 100 2HD PRO 100 -7.888 -7.559 5.663 787 H ALA 101 H ALA 101 -8.130 -5.138 8.670 788 HA ALA 101 HA ALA 101 -7.140 -4.218 11.133 789 HB1 ALA 101 3HB ALA 101 -6.378 -2.127 10.830 790 HB2 ALA 101 1HB ALA 101 -7.573 -1.756 9.587 791 HB3 ALA 101 2HB ALA 101 -6.110 -2.646 9.167 792 H SER 102 H SER 102 -8.697 -1.764 11.249 793 HA SER 102 HA SER 102 -11.400 -2.886 10.950 794 HG SER 102 HG SER 102 -9.938 -2.007 14.415 795 HB2 SER 102 1HB SER 102 -11.088 -0.795 12.989 796 HB3 SER 102 2HB SER 102 -11.916 -2.349 13.082 797 H ALA 103 H ALA 103 -9.355 -0.496 9.821 798 HA ALA 103 HA ALA 103 -11.486 0.853 8.493 799 HB1 ALA 103 3HB ALA 103 -11.143 3.079 9.480 800 HB2 ALA 103 1HB ALA 103 -10.061 2.364 10.675 801 HB3 ALA 103 2HB ALA 103 -11.766 1.912 10.646 802 H VAL 104 H VAL 104 -9.754 -0.159 6.990 803 HA VAL 104 HA VAL 104 -7.748 1.935 6.419 804 HB VAL 104 HB VAL 104 -6.246 0.307 5.465 805 HG11 VAL 104 1HG1 VAL 104 -5.418 -0.074 7.483 806 HG12 VAL 104 2HG1 VAL 104 -6.656 -1.285 7.809 807 HG13 VAL 104 3HG1 VAL 104 -6.963 0.411 8.182 808 HG21 VAL 104 3HG2 VAL 104 -8.275 -1.208 4.767 809 HG22 VAL 104 1HG2 VAL 104 -7.946 -1.992 6.311 810 HG23 VAL 104 2HG2 VAL 104 -6.689 -1.910 5.079 811 H ASN 105 H ASN 105 -7.483 2.669 4.354 812 HA ASN 105 HA ASN 105 -9.754 2.316 2.606 813 HB2 ASN 105 1HB ASN 105 -7.329 3.981 1.970 814 HB3 ASN 105 2HB ASN 105 -8.996 4.233 1.465 815 HD21 ASN 105 1HD2 ASN 105 -9.981 3.660 4.196 816 HD22 ASN 105 2HD2 ASN 105 -9.651 5.088 5.104 817 H VAL 106 H VAL 106 -9.652 1.799 0.385 818 HA VAL 106 HA VAL 106 -7.670 -0.228 -0.265 819 HB VAL 106 HB VAL 106 -9.333 0.260 -2.517 820 HG11 VAL 106 1HG1 VAL 106 -9.403 -1.960 -2.504 821 HG12 VAL 106 2HG1 VAL 106 -10.121 -2.011 -0.894 822 HG13 VAL 106 3HG1 VAL 106 -8.372 -1.881 -1.076 823 HG21 VAL 106 3HG2 VAL 106 -11.569 -0.277 -1.426 824 HG22 VAL 106 1HG2 VAL 106 -10.995 1.386 -1.305 825 HG23 VAL 106 2HG2 VAL 106 -10.846 0.296 0.076 826 H ILE 107 H ILE 107 -5.853 1.079 -0.453 827 HA ILE 107 HA ILE 107 -5.706 3.378 -2.085 828 HB ILE 107 HB ILE 107 -4.237 2.589 -0.090 829 HG12 ILE 107 1HG1 ILE 107 -3.859 4.431 -2.264 830 HG13 ILE 107 2HG1 ILE 107 -3.438 4.617 -0.569 831 HG21 ILE 107 1HG2 ILE 107 -3.492 0.530 -1.331 832 HG22 ILE 107 2HG2 ILE 107 -2.211 1.489 -0.592 833 HG23 ILE 107 3HG2 ILE 107 -2.495 1.591 -2.328 834 HD11 ILE 107 3HD1 ILE 107 -1.472 4.945 -1.842 835 HD12 ILE 107 1HD1 ILE 107 -1.743 3.465 -2.764 836 HD13 ILE 107 2HD1 ILE 107 -1.326 3.374 -1.053 837 H GLY 108 H GLY 108 -6.562 0.792 -3.482 838 HA2 GLY 108 1HA GLY 108 -6.303 0.715 -5.905 839 HA3 GLY 108 2HA GLY 108 -4.589 1.012 -5.662 840 H ARG 109 H ARG 109 -3.969 -0.813 -6.827 841 HA ARG 109 HA ARG 109 -3.996 -3.266 -5.300 842 HE ARG 109 HE ARG 109 -8.310 -5.689 -6.291 843 HB2 ARG 109 1HB ARG 109 -5.010 -3.394 -8.135 844 HB3 ARG 109 2HB ARG 109 -5.016 -4.666 -6.923 845 HG2 ARG 109 1HG ARG 109 -6.675 -3.363 -5.624 846 HG3 ARG 109 2HG ARG 109 -6.720 -2.183 -6.935 847 HD2 ARG 109 1HD ARG 109 -8.165 -3.430 -8.066 848 HD3 ARG 109 2HD ARG 109 -7.071 -4.810 -8.010 849 HH11 ARG 109 1HH1 ARG 109 -9.231 -2.358 -6.778 850 HH12 ARG 109 2HH1 ARG 109 -10.597 -2.450 -5.716 851 HH21 ARG 109 1HH2 ARG 109 -10.104 -5.812 -4.895 852 HH22 ARG 109 2HH2 ARG 109 -11.092 -4.410 -4.647 853 H ILE 110 H ILE 110 -2.657 -4.980 -6.393 854 HA ILE 110 HA ILE 110 -0.345 -3.699 -7.669 855 HB ILE 110 HB ILE 110 -0.581 -6.397 -6.340 856 HG12 ILE 110 1HG1 ILE 110 1.299 -4.478 -5.207 857 HG13 ILE 110 2HG1 ILE 110 -0.349 -3.864 -5.197 858 HG21 ILE 110 1HG2 ILE 110 1.860 -6.512 -6.552 859 HG22 ILE 110 2HG2 ILE 110 1.842 -5.013 -7.480 860 HG23 ILE 110 3HG2 ILE 110 1.064 -6.460 -8.123 861 HD11 ILE 110 3HD1 ILE 110 -1.088 -5.811 -3.956 862 HD12 ILE 110 1HD1 ILE 110 0.233 -4.997 -3.119 863 HD13 ILE 110 2HD1 ILE 110 0.543 -6.485 -4.014 864 H VAL 111 H VAL 111 -0.269 -3.823 -9.811 865 HA VAL 111 HA VAL 111 -1.401 -6.201 -11.128 866 HB VAL 111 HB VAL 111 -1.142 -4.520 -13.206 867 HG11 VAL 111 1HG1 VAL 111 -3.428 -4.457 -13.234 868 HG12 VAL 111 2HG1 VAL 111 -3.551 -4.115 -11.508 869 HG13 VAL 111 3HG1 VAL 111 -3.170 -5.746 -12.059 870 HG21 VAL 111 3HG2 VAL 111 -2.061 -2.609 -11.100 871 HG22 VAL 111 1HG2 VAL 111 -1.458 -2.283 -12.724 872 HG23 VAL 111 2HG2 VAL 111 -0.340 -2.767 -11.449 873 H ASN 112 H ASN 112 0.819 -3.850 -12.578 874 HA ASN 112 HA ASN 112 2.443 -5.910 -13.679 875 HB2 ASN 112 1HB ASN 112 3.940 -4.032 -14.356 876 HB3 ASN 112 2HB ASN 112 2.259 -3.784 -14.817 877 HD21 ASN 112 1HD2 ASN 112 4.617 -1.982 -14.180 878 HD22 ASN 112 2HD2 ASN 112 3.966 -0.826 -13.074 879 H SER 113 H SER 113 4.936 -5.715 -13.387 880 HA SER 113 HA SER 113 6.746 -6.130 -12.071 881 HG SER 113 HG SER 113 6.881 -5.413 -9.049 882 HB2 SER 113 1HB SER 113 6.515 -3.813 -11.360 883 HB3 SER 113 2HB SER 113 5.300 -4.271 -10.167 884 H MET 114 H MET 114 7.461 -7.239 -10.083 885 HA MET 114 HA MET 114 5.904 -9.494 -9.537 886 HB2 MET 114 1HB MET 114 8.469 -8.963 -9.166 887 HB3 MET 114 2HB MET 114 7.924 -8.573 -7.540 888 HG2 MET 114 1HG MET 114 8.625 -10.820 -7.495 889 HG3 MET 114 2HG MET 114 6.863 -10.845 -7.461 890 HE1 MET 114 3HE MET 114 10.071 -11.669 -9.174 891 HE2 MET 114 1HE MET 114 9.592 -12.898 -10.345 892 HE3 MET 114 2HE MET 114 9.347 -13.179 -8.621 893 H GLU 115 H GLU 115 4.329 -9.923 -8.122 894 HA GLU 115 HA GLU 115 3.632 -7.829 -6.176 895 HB2 GLU 115 1HB GLU 115 1.349 -8.690 -6.266 896 HB3 GLU 115 2HB GLU 115 1.914 -8.260 -7.874 897 HG2 GLU 115 1HG GLU 115 2.305 -11.065 -7.039 898 HG3 GLU 115 2HG GLU 115 0.645 -10.541 -7.326 899 H GLY 116 H GLY 116 5.619 -9.948 -5.763 900 HA2 GLY 116 1HA GLY 116 4.272 -11.504 -3.647 901 HA3 GLY 116 2HA GLY 116 5.730 -12.016 -4.484 902 H LEU 117 H LEU 117 4.909 -8.886 -3.017 903 HA LEU 117 HA LEU 117 7.411 -8.387 -1.945 904 HG LEU 117 HG LEU 117 7.200 -7.077 0.316 905 HB2 LEU 117 1HB LEU 117 5.753 -6.646 -2.103 906 HB3 LEU 117 2HB LEU 117 4.702 -7.483 -0.976 907 HD11 LEU 117 1HD1 LEU 117 7.366 -4.661 0.350 908 HD12 LEU 117 2HD1 LEU 117 6.068 -4.537 -0.835 909 HD13 LEU 117 3HD1 LEU 117 7.608 -5.275 -1.285 910 HD21 LEU 117 3HD2 LEU 117 4.741 -7.223 1.150 911 HD22 LEU 117 1HD2 LEU 117 4.765 -5.474 0.928 912 HD23 LEU 117 2HD2 LEU 117 5.915 -6.239 2.021 913 H LYS 118 H LYS 118 4.692 -10.121 -0.526 914 HA LYS 118 HA LYS 118 5.349 -10.372 2.087 915 HB2 LYS 118 1HB LYS 118 4.453 -12.755 1.949 916 HB3 LYS 118 2HB LYS 118 3.393 -11.470 1.393 917 HG2 LYS 118 1HG LYS 118 3.115 -13.018 -0.265 918 HG3 LYS 118 2HG LYS 118 4.418 -12.048 -0.948 919 HD2 LYS 118 1HD LYS 118 5.159 -14.226 -1.272 920 HD3 LYS 118 2HD LYS 118 5.977 -13.753 0.215 921 HE2 LYS 118 1HE LYS 118 5.146 -15.888 0.668 922 HE3 LYS 118 2HE LYS 118 3.990 -14.799 1.431 923 HZ1 LYS 118 3HZ LYS 118 2.549 -16.121 0.329 924 HZ2 LYS 118 1HZ LYS 118 3.654 -16.539 -0.882 925 HZ3 LYS 118 2HZ LYS 118 2.864 -15.045 -0.938 926 H GLY 119 H GLY 119 7.186 -11.733 -0.550 927 HA2 GLY 119 1HA GLY 119 8.669 -13.529 1.179 928 HA3 GLY 119 2HA GLY 119 8.933 -13.276 -0.537 929 H VAL 120 H VAL 120 8.822 -10.606 1.726 930 HA VAL 120 HA VAL 120 11.509 -9.851 0.980 931 HB VAL 120 HB VAL 120 11.097 -7.881 2.493 932 HG11 VAL 120 1HG1 VAL 120 10.125 -8.448 -0.069 933 HG12 VAL 120 2HG1 VAL 120 10.410 -6.864 0.649 934 HG13 VAL 120 3HG1 VAL 120 8.821 -7.611 0.771 935 HG21 VAL 120 3HG2 VAL 120 8.789 -9.485 3.197 936 HG22 VAL 120 1HG2 VAL 120 8.330 -7.863 2.683 937 HG23 VAL 120 2HG2 VAL 120 9.473 -8.078 4.007 938 H ALA 121 H ALA 121 13.220 -9.393 2.511 939 HA ALA 121 HA ALA 121 13.368 -11.373 4.614 940 HB1 ALA 121 3HB ALA 121 15.267 -10.551 3.010 941 HB2 ALA 121 1HB ALA 121 15.641 -10.967 4.682 942 HB3 ALA 121 2HB ALA 121 15.463 -9.276 4.214 943 H ASP 122 H ASP 122 13.651 -10.927 6.849 944 HA ASP 122 HA ASP 122 12.025 -8.925 7.886 945 HB2 ASP 122 1HB ASP 122 12.812 -9.548 10.059 946 HB3 ASP 122 2HB ASP 122 12.664 -11.006 9.082 947 H GLY 123 H GLY 123 12.297 -6.822 7.772 948 HA2 GLY 123 1HA GLY 123 13.229 -4.762 8.203 949 HA3 GLY 123 2HA GLY 123 14.607 -5.582 8.915 950 H GLU 124 H GLU 124 13.374 -3.946 6.172 951 HA GLU 124 HA GLU 124 16.025 -3.792 5.053 952 HB2 GLU 124 1HB GLU 124 14.707 -4.364 2.713 953 HB3 GLU 124 2HB GLU 124 15.769 -5.466 3.576 954 HG2 GLU 124 1HG GLU 124 13.802 -6.382 4.748 955 HG3 GLU 124 2HG GLU 124 12.772 -5.330 3.775 956 H SER 125 H SER 125 16.256 -2.141 3.463 957 HA SER 125 HA SER 125 14.836 0.183 4.021 958 HG SER 125 HG SER 125 15.771 2.048 2.211 959 HB2 SER 125 1HB SER 125 16.984 0.447 3.087 960 HB3 SER 125 2HB SER 125 16.610 -0.597 1.716 961 H VAL 126 H VAL 126 13.727 1.545 2.359 962 HA VAL 126 HA VAL 126 12.159 0.221 0.341 963 HB VAL 126 HB VAL 126 10.710 1.434 2.707 964 HG11 VAL 126 1HG1 VAL 126 8.696 0.542 1.589 965 HG12 VAL 126 2HG1 VAL 126 9.692 0.124 0.197 966 HG13 VAL 126 3HG1 VAL 126 9.499 1.813 0.669 967 HG21 VAL 126 3HG2 VAL 126 11.560 -0.667 3.406 968 HG22 VAL 126 1HG2 VAL 126 11.081 -1.433 1.891 969 HG23 VAL 126 2HG2 VAL 126 9.852 -0.886 3.031 970 H VAL 127 H VAL 127 11.812 1.647 -1.292 971 HA VAL 127 HA VAL 127 11.881 4.517 -0.624 972 HB VAL 127 HB VAL 127 13.066 4.939 -2.766 973 HG11 VAL 127 1HG1 VAL 127 15.038 4.860 -1.707 974 HG12 VAL 127 2HG1 VAL 127 14.948 3.116 -1.463 975 HG13 VAL 127 3HG1 VAL 127 14.116 4.207 -0.354 976 HG21 VAL 127 3HG2 VAL 127 13.055 3.316 -4.286 977 HG22 VAL 127 1HG2 VAL 127 12.607 2.098 -3.093 978 HG23 VAL 127 2HG2 VAL 127 14.302 2.524 -3.324 979 H VAL 128 H VAL 128 9.895 5.244 -0.966 980 HA VAL 128 HA VAL 128 8.184 4.120 -3.013 981 HB VAL 128 HB VAL 128 7.324 6.607 -1.669 982 HG11 VAL 128 1HG1 VAL 128 5.582 5.599 -2.775 983 HG12 VAL 128 2HG1 VAL 128 5.363 4.949 -1.153 984 HG13 VAL 128 3HG1 VAL 128 6.140 3.969 -2.394 985 HG21 VAL 128 3HG2 VAL 128 8.183 5.979 0.332 986 HG22 VAL 128 1HG2 VAL 128 8.285 4.278 -0.118 987 HG23 VAL 128 2HG2 VAL 128 6.739 4.969 0.368 988 H GLU 129 H GLU 129 7.901 4.983 -5.046 989 HA GLU 129 HA GLU 129 8.394 7.794 -5.532 990 HB2 GLU 129 1HB GLU 129 9.936 7.228 -7.466 991 HB3 GLU 129 2HB GLU 129 10.618 7.043 -5.856 992 HG2 GLU 129 1HG GLU 129 9.381 4.600 -6.794 993 HG3 GLU 129 2HG GLU 129 10.637 5.175 -7.891 994 H ARG 130 H ARG 130 6.994 8.560 -7.014 995 HA ARG 130 HA ARG 130 5.114 6.791 -8.251 996 HE ARG 130 HE ARG 130 4.113 7.846 -11.732 997 HB2 ARG 130 1HB ARG 130 4.454 9.009 -7.444 998 HB3 ARG 130 2HB ARG 130 5.546 9.766 -8.594 999 HG2 ARG 130 1HG ARG 130 3.523 7.932 -9.718 1000 HG3 ARG 130 2HG ARG 130 2.933 9.447 -9.031 1001 HD2 ARG 130 1HD ARG 130 3.514 10.487 -10.900 1002 HD3 ARG 130 2HD ARG 130 5.200 10.095 -10.566 1003 HH11 ARG 130 1HH1 ARG 130 4.593 11.185 -12.625 1004 HH12 ARG 130 2HH1 ARG 130 4.722 10.845 -14.317 1005 HH21 ARG 130 1HH2 ARG 130 4.280 7.396 -13.959 1006 HH22 ARG 130 2HH2 ARG 130 4.545 8.694 -15.076 1007 H ALA 131 H ALA 131 6.317 5.481 -9.642 1008 HA ALA 131 HA ALA 131 7.502 4.879 -11.515 1009 HB1 ALA 131 3HB ALA 131 5.319 5.302 -12.438 1010 HB2 ALA 131 1HB ALA 131 6.556 5.809 -13.588 1011 HB3 ALA 131 2HB ALA 131 5.697 7.015 -12.629 Start of MODEL 13 1 H MET 1 H MET 1 -2.465 9.700 -21.627 2 HA MET 1 HA MET 1 -1.467 8.098 -19.379 3 HB2 MET 1 1HB MET 1 -0.004 9.520 -21.601 4 HB3 MET 1 2HB MET 1 0.754 9.165 -20.056 5 HG2 MET 1 1HG MET 1 1.134 7.057 -20.624 6 HG3 MET 1 2HG MET 1 -0.525 6.827 -21.170 7 HE1 MET 1 3HE MET 1 -0.569 6.934 -24.749 8 HE2 MET 1 1HE MET 1 -1.322 6.663 -23.177 9 HE3 MET 1 2HE MET 1 -0.159 5.498 -23.810 10 H GLY 2 H GLY 2 -1.482 9.250 -17.556 11 HA2 GLY 2 1HA GLY 2 -0.671 11.684 -16.909 12 HA3 GLY 2 2HA GLY 2 -2.190 12.080 -17.697 13 H GLU 3 H GLU 3 -3.438 12.746 -16.045 14 HA GLU 3 HA GLU 3 -3.608 11.043 -13.658 15 HB2 GLU 3 1HB GLU 3 -3.065 13.365 -13.191 16 HB3 GLU 3 2HB GLU 3 -4.464 13.909 -14.107 17 HG2 GLU 3 1HG GLU 3 -5.408 12.117 -12.142 18 HG3 GLU 3 2HG GLU 3 -4.276 13.214 -11.350 19 H ARG 4 H ARG 4 -5.752 12.984 -15.748 20 HA ARG 4 HA ARG 4 -7.885 12.662 -16.461 21 HE ARG 4 HE ARG 4 -4.698 9.835 -16.477 22 HB2 ARG 4 1HB ARG 4 -6.998 9.836 -15.978 23 HB3 ARG 4 2HB ARG 4 -8.669 10.172 -16.406 24 HG2 ARG 4 1HG ARG 4 -7.719 9.742 -18.457 25 HG3 ARG 4 2HG ARG 4 -7.646 11.502 -18.379 26 HD2 ARG 4 1HD ARG 4 -5.559 10.286 -19.187 27 HD3 ARG 4 2HD ARG 4 -5.342 11.498 -17.924 28 HH11 ARG 4 1HH1 ARG 4 -6.132 8.393 -19.314 29 HH12 ARG 4 2HH1 ARG 4 -5.647 6.786 -18.896 30 HH21 ARG 4 1HH2 ARG 4 -4.059 7.721 -15.926 31 HH22 ARG 4 2HH2 ARG 4 -4.471 6.402 -16.972 32 H GLY 5 H GLY 5 -7.924 10.065 -14.040 33 HA2 GLY 5 1HA GLY 5 -9.239 11.666 -12.061 34 HA3 GLY 5 2HA GLY 5 -10.369 10.645 -12.936 35 H VAL 6 H VAL 6 -9.400 8.280 -13.181 36 HA VAL 6 HA VAL 6 -8.346 7.484 -10.533 37 HB VAL 6 HB VAL 6 -9.769 5.487 -10.569 38 HG11 VAL 6 1HG1 VAL 6 -12.050 6.894 -10.583 39 HG12 VAL 6 2HG1 VAL 6 -10.890 8.220 -10.519 40 HG13 VAL 6 3HG1 VAL 6 -10.873 6.971 -9.273 41 HG21 VAL 6 3HG2 VAL 6 -11.585 6.476 -12.652 42 HG22 VAL 6 1HG2 VAL 6 -11.063 4.833 -12.286 43 HG23 VAL 6 2HG2 VAL 6 -10.033 5.891 -13.249 44 H GLU 7 H GLU 7 -6.332 7.632 -11.934 45 HA GLU 7 HA GLU 7 -5.595 4.961 -12.694 46 HB2 GLU 7 1HB GLU 7 -5.829 7.135 -14.762 47 HB3 GLU 7 2HB GLU 7 -4.727 5.781 -14.970 48 HG2 GLU 7 1HG GLU 7 -7.723 5.699 -14.758 49 HG3 GLU 7 2HG GLU 7 -6.722 5.276 -16.145 50 H MET 8 H MET 8 -4.673 6.552 -10.649 51 HA MET 8 HA MET 8 -2.050 7.492 -11.584 52 HB2 MET 8 1HB MET 8 -3.750 8.908 -10.120 53 HB3 MET 8 2HB MET 8 -2.997 8.014 -8.806 54 HG2 MET 8 1HG MET 8 -1.370 9.506 -8.794 55 HG3 MET 8 2HG MET 8 -0.888 8.934 -10.390 56 HE1 MET 8 3HE MET 8 -1.417 10.453 -12.731 57 HE2 MET 8 1HE MET 8 -0.052 10.625 -11.627 58 HE3 MET 8 2HE MET 8 -0.888 12.058 -12.225 59 H ARG 9 H ARG 9 -0.562 5.949 -11.478 60 HA ARG 9 HA ARG 9 -0.608 4.123 -9.171 61 HE ARG 9 HE ARG 9 4.438 3.148 -12.327 62 HB2 ARG 9 1HB ARG 9 0.283 2.442 -10.477 63 HB3 ARG 9 2HB ARG 9 -0.729 3.289 -11.635 64 HG2 ARG 9 1HG ARG 9 1.115 3.165 -12.913 65 HG3 ARG 9 2HG ARG 9 1.586 4.603 -12.007 66 HD2 ARG 9 1HD ARG 9 2.999 3.380 -10.584 67 HD3 ARG 9 2HD ARG 9 2.272 1.841 -11.050 68 HH11 ARG 9 1HH1 ARG 9 1.607 1.219 -13.000 69 HH12 ARG 9 2HH1 ARG 9 2.255 0.555 -14.462 70 HH21 ARG 9 1HH2 ARG 9 5.289 2.276 -14.251 71 HH22 ARG 9 2HH2 ARG 9 4.346 1.154 -15.172 72 H LEU 10 H LEU 10 1.197 3.695 -7.983 73 HA LEU 10 HA LEU 10 3.496 5.488 -8.416 74 HG LEU 10 HG LEU 10 0.955 4.447 -5.982 75 HB2 LEU 10 1HB LEU 10 3.474 4.688 -5.693 76 HB3 LEU 10 2HB LEU 10 3.304 6.299 -6.354 77 HD11 LEU 10 1HD1 LEU 10 0.493 5.854 -3.947 78 HD12 LEU 10 2HD1 LEU 10 2.145 6.459 -4.077 79 HD13 LEU 10 3HD1 LEU 10 1.854 4.744 -3.790 80 HD21 LEU 10 3HD2 LEU 10 -0.287 6.114 -6.788 81 HD22 LEU 10 1HD2 LEU 10 1.224 6.809 -7.378 82 HD23 LEU 10 2HD2 LEU 10 0.562 7.323 -5.826 83 H ARG 11 H ARG 11 5.540 4.637 -7.444 84 HA ARG 11 HA ARG 11 5.670 1.736 -7.880 85 HE ARG 11 HE ARG 11 9.304 0.015 -10.269 86 HB2 ARG 11 1HB ARG 11 7.130 3.809 -9.029 87 HB3 ARG 11 2HB ARG 11 8.239 3.104 -7.862 88 HG2 ARG 11 1HG ARG 11 6.809 1.645 -10.076 89 HG3 ARG 11 2HG ARG 11 8.518 2.079 -10.036 90 HD2 ARG 11 1HD ARG 11 8.260 0.724 -7.696 91 HD3 ARG 11 2HD ARG 11 7.090 -0.120 -8.710 92 HH11 ARG 11 1HH1 ARG 11 8.709 -1.132 -7.028 93 HH12 ARG 11 2HH1 ARG 11 9.959 -2.329 -7.088 94 HH21 ARG 11 1HH2 ARG 11 10.947 -1.559 -10.351 95 HH22 ARG 11 2HH2 ARG 11 11.230 -2.573 -8.975 96 H ILE 12 H ILE 12 6.773 0.413 -6.431 97 HA ILE 12 HA ILE 12 7.955 1.605 -4.056 98 HB ILE 12 HB ILE 12 5.355 0.203 -4.064 99 HG12 ILE 12 1HG1 ILE 12 6.648 1.853 -1.900 100 HG13 ILE 12 2HG1 ILE 12 5.899 2.576 -3.323 101 HG21 ILE 12 1HG2 ILE 12 6.374 -1.627 -3.070 102 HG22 ILE 12 2HG2 ILE 12 5.850 -0.659 -1.694 103 HG23 ILE 12 3HG2 ILE 12 7.540 -0.632 -2.195 104 HD11 ILE 12 3HD1 ILE 12 4.449 0.733 -1.445 105 HD12 ILE 12 1HD1 ILE 12 3.762 1.734 -2.723 106 HD13 ILE 12 2HD1 ILE 12 4.456 2.489 -1.289 107 H ARG 13 H ARG 13 9.926 0.780 -4.416 108 HA ARG 13 HA ARG 13 10.160 -2.074 -5.050 109 HE ARG 13 HE ARG 13 14.304 -0.547 -7.318 110 HB2 ARG 13 1HB ARG 13 12.541 -1.538 -5.561 111 HB3 ARG 13 2HB ARG 13 11.382 -0.682 -6.567 112 HG2 ARG 13 1HG ARG 13 11.651 1.292 -5.062 113 HG3 ARG 13 2HG ARG 13 12.947 0.417 -4.243 114 HD2 ARG 13 1HD ARG 13 12.861 1.227 -7.147 115 HD3 ARG 13 2HD ARG 13 13.885 1.918 -5.890 116 HH11 ARG 13 1HH1 ARG 13 15.044 1.257 -4.423 117 HH12 ARG 13 2HH1 ARG 13 16.518 0.402 -4.117 118 HH21 ARG 13 1HH2 ARG 13 16.242 -1.672 -6.916 119 HH22 ARG 13 2HH2 ARG 13 17.198 -1.262 -5.531 120 H PHE 14 H PHE 14 11.720 -3.381 -4.012 121 HA PHE 14 HA PHE 14 12.509 -2.556 -1.310 122 HD1 PHE 14 HD1 PHE 14 9.782 -2.286 -1.405 123 HD2 PHE 14 HD2 PHE 14 11.185 -5.378 1.169 124 HE1 PHE 14 HE1 PHE 14 8.372 -1.411 0.409 125 HE2 PHE 14 HE2 PHE 14 9.775 -4.505 2.984 126 HZ PHE 14 HZ PHE 14 8.365 -2.522 2.606 127 HB2 PHE 14 1HB PHE 14 10.786 -4.828 -2.117 128 HB3 PHE 14 2HB PHE 14 12.052 -5.216 -0.959 129 H GLU 15 H GLU 15 14.505 -3.301 -0.676 130 HA GLU 15 HA GLU 15 16.499 -3.713 -2.461 131 HB2 GLU 15 1HB GLU 15 16.190 -4.300 0.411 132 HB3 GLU 15 2HB GLU 15 17.443 -5.223 -0.397 133 HG2 GLU 15 1HG GLU 15 18.022 -2.963 0.713 134 HG3 GLU 15 2HG GLU 15 18.714 -3.377 -0.852 135 H SER 16 H SER 16 14.270 -6.153 -1.338 136 HA SER 16 HA SER 16 15.650 -8.106 -3.062 137 HG SER 16 HG SER 16 16.412 -10.096 -0.593 138 HB2 SER 16 1HB SER 16 14.650 -8.370 -0.276 139 HB3 SER 16 2HB SER 16 14.430 -9.756 -1.344 140 H ALA 17 H ALA 17 13.276 -6.240 -3.511 141 HA ALA 17 HA ALA 17 11.736 -8.080 -5.029 142 HB1 ALA 17 3HB ALA 17 10.010 -7.013 -2.852 143 HB2 ALA 17 1HB ALA 17 11.017 -8.423 -2.515 144 HB3 ALA 17 2HB ALA 17 9.838 -8.474 -3.826 145 H GLU 18 H GLU 18 10.132 -7.130 -6.322 146 HA GLU 18 HA GLU 18 9.865 -4.202 -6.149 147 HB2 GLU 18 1HB GLU 18 10.054 -4.153 -8.680 148 HB3 GLU 18 2HB GLU 18 11.547 -4.426 -7.792 149 HG2 GLU 18 1HG GLU 18 11.831 -6.473 -8.649 150 HG3 GLU 18 2HG GLU 18 10.117 -6.869 -8.537 151 H CYS 19 H CYS 19 7.894 -3.351 -6.790 152 HA CYS 19 HA CYS 19 5.982 -4.895 -8.270 153 HG CYS 19 HG CYS 19 6.851 -6.160 -4.930 154 HB2 CYS 19 1HB CYS 19 4.474 -4.455 -5.930 155 HB3 CYS 19 2HB CYS 19 4.951 -6.002 -6.615 156 H GLU 20 H GLU 20 4.122 -3.698 -8.886 157 HA GLU 20 HA GLU 20 4.273 -0.833 -8.197 158 HB2 GLU 20 1HB GLU 20 2.926 -1.743 -10.700 159 HB3 GLU 20 2HB GLU 20 3.783 -0.243 -10.376 160 HG2 GLU 20 1HG GLU 20 5.888 -1.717 -10.294 161 HG3 GLU 20 2HG GLU 20 4.888 -2.919 -11.103 162 H VAL 21 H VAL 21 2.210 0.328 -8.170 163 HA VAL 21 HA VAL 21 -0.195 -1.282 -7.963 164 HB VAL 21 HB VAL 21 -0.292 -1.444 -5.756 165 HG11 VAL 21 1HG1 VAL 21 2.282 0.118 -5.759 166 HG12 VAL 21 2HG1 VAL 21 2.077 -1.636 -5.702 167 HG13 VAL 21 3HG1 VAL 21 1.591 -0.646 -4.325 168 HG21 VAL 21 3HG2 VAL 21 -0.540 0.492 -4.306 169 HG22 VAL 21 1HG2 VAL 21 -1.461 0.712 -5.794 170 HG23 VAL 21 2HG2 VAL 21 0.079 1.544 -5.578 171 H GLU 22 H GLU 22 -2.016 -0.193 -8.446 172 HA GLU 22 HA GLU 22 -1.719 2.584 -9.287 173 HB2 GLU 22 1HB GLU 22 -3.752 0.437 -9.816 174 HB3 GLU 22 2HB GLU 22 -4.127 2.122 -10.151 175 HG2 GLU 22 1HG GLU 22 -2.796 2.198 -11.961 176 HG3 GLU 22 2HG GLU 22 -1.571 1.160 -11.236 177 H LEU 23 H LEU 23 -4.047 3.787 -8.985 178 HA LEU 23 HA LEU 23 -5.149 3.285 -6.366 179 HG LEU 23 HG LEU 23 -5.499 6.642 -6.336 180 HB2 LEU 23 1HB LEU 23 -3.496 4.570 -5.447 181 HB3 LEU 23 2HB LEU 23 -3.256 5.503 -6.908 182 HD11 LEU 23 1HD1 LEU 23 -5.394 6.565 -3.592 183 HD12 LEU 23 2HD1 LEU 23 -5.151 4.877 -4.034 184 HD13 LEU 23 3HD1 LEU 23 -6.582 5.737 -4.598 185 HD21 LEU 23 3HD2 LEU 23 -3.550 7.925 -6.195 186 HD22 LEU 23 1HD2 LEU 23 -2.930 7.002 -4.827 187 HD23 LEU 23 2HD2 LEU 23 -4.300 8.091 -4.607 188 H TYR 24 H TYR 24 -7.085 4.392 -5.945 189 HA TYR 24 HA TYR 24 -8.200 5.872 -8.231 190 HD1 TYR 24 HD1 TYR 24 -8.082 4.674 -9.869 191 HD2 TYR 24 HD2 TYR 24 -9.879 1.590 -7.554 192 HE1 TYR 24 HE1 TYR 24 -7.394 3.019 -11.551 193 HE2 TYR 24 HE2 TYR 24 -9.196 -0.074 -9.230 194 HH TYR 24 HH TYR 24 -6.913 0.395 -11.465 195 HB2 TYR 24 1HB TYR 24 -9.653 3.739 -6.639 196 HB3 TYR 24 2HB TYR 24 -10.360 4.735 -7.905 197 H GLU 25 H GLU 25 -9.718 7.454 -7.765 198 HA GLU 25 HA GLU 25 -9.314 8.932 -5.435 199 HB2 GLU 25 1HB GLU 25 -11.691 9.079 -7.294 200 HB3 GLU 25 2HB GLU 25 -11.204 10.314 -6.144 201 HG2 GLU 25 1HG GLU 25 -8.941 10.193 -7.525 202 HG3 GLU 25 2HG GLU 25 -10.031 9.592 -8.773 203 H GLU 26 H GLU 26 -11.144 6.104 -5.671 204 HA GLU 26 HA GLU 26 -13.420 6.480 -4.235 205 HB2 GLU 26 1HB GLU 26 -13.329 4.196 -3.592 206 HB3 GLU 26 2HB GLU 26 -12.530 4.304 -5.154 207 HG2 GLU 26 1HG GLU 26 -10.345 4.344 -3.948 208 HG3 GLU 26 2HG GLU 26 -11.229 4.031 -2.456 209 H TRP 27 H TRP 27 -10.152 6.651 -3.017 210 HA TRP 27 HA TRP 27 -10.960 6.651 -0.249 211 HD1 TRP 27 HD1 TRP 27 -6.166 7.591 -0.248 212 HE1 TRP 27 HE1 TRP 27 -5.798 8.682 2.049 213 HE3 TRP 27 HE3 TRP 27 -10.970 7.439 1.513 214 HZ2 TRP 27 HZ2 TRP 27 -7.331 9.390 4.306 215 HZ3 TRP 27 HZ3 TRP 27 -11.426 8.350 3.751 216 HH2 TRP 27 HH2 TRP 27 -9.646 9.302 5.119 217 HB2 TRP 27 1HB TRP 27 -8.799 5.749 -0.653 218 HB3 TRP 27 2HB TRP 27 -8.339 7.104 -1.677 219 H ALA 28 H ALA 28 -9.499 9.047 -2.468 220 HA ALA 28 HA ALA 28 -11.149 11.139 -2.189 221 HB1 ALA 28 3HB ALA 28 -9.533 10.888 0.304 222 HB2 ALA 28 1HB ALA 28 -11.205 11.407 0.087 223 HB3 ALA 28 2HB ALA 28 -9.883 12.500 -0.323 224 HA PRO 29 HA PRO 29 -7.974 12.339 -5.127 225 HB2 PRO 29 1HB PRO 29 -9.076 14.983 -5.177 226 HB3 PRO 29 2HB PRO 29 -9.216 13.722 -6.400 227 HG2 PRO 29 1HG PRO 29 -11.146 14.577 -4.373 228 HG3 PRO 29 2HG PRO 29 -11.407 13.621 -5.838 229 HD2 PRO 29 1HD PRO 29 -11.536 12.609 -3.298 230 HD3 PRO 29 2HD PRO 29 -11.148 11.638 -4.728 231 H GLU 30 H GLU 30 -8.908 14.305 -2.330 232 HA GLU 30 HA GLU 30 -6.702 16.028 -2.321 233 HB2 GLU 30 1HB GLU 30 -8.776 16.410 -1.023 234 HB3 GLU 30 2HB GLU 30 -8.329 15.086 0.048 235 HG2 GLU 30 1HG GLU 30 -6.182 16.970 -0.185 236 HG3 GLU 30 2HG GLU 30 -7.669 17.780 0.301 237 H THR 31 H THR 31 -7.246 12.966 -0.587 238 HA THR 31 HA THR 31 -4.757 12.964 0.774 239 HB THR 31 HB THR 31 -5.461 10.264 0.311 240 HG1 THR 31 HG1 THR 31 -7.493 10.340 -0.140 241 HG21 THR 31 3HG2 THR 31 -4.760 10.839 2.458 242 HG22 THR 31 1HG2 THR 31 -6.471 10.465 2.639 243 HG23 THR 31 2HG2 THR 31 -5.940 12.142 2.599 244 H VAL 32 H VAL 32 -5.749 11.552 -2.325 245 HA VAL 32 HA VAL 32 -3.484 10.155 -3.013 246 HB VAL 32 HB VAL 32 -5.124 11.856 -4.898 247 HG11 VAL 32 1HG1 VAL 32 -3.040 9.789 -5.270 248 HG12 VAL 32 2HG1 VAL 32 -3.455 11.179 -6.274 249 HG13 VAL 32 3HG1 VAL 32 -4.437 9.716 -6.344 250 HG21 VAL 32 3HG2 VAL 32 -6.788 10.556 -4.084 251 HG22 VAL 32 1HG2 VAL 32 -5.684 9.305 -3.515 252 HG23 VAL 32 2HG2 VAL 32 -6.115 9.391 -5.223 253 H ARG 33 H ARG 33 -4.033 13.622 -3.092 254 HA ARG 33 HA ARG 33 -1.835 14.401 -4.631 255 HE ARG 33 HE ARG 33 -0.637 19.056 -3.620 256 HB2 ARG 33 1HB ARG 33 -3.812 15.807 -3.747 257 HB3 ARG 33 2HB ARG 33 -2.843 16.006 -2.294 258 HG2 ARG 33 1HG ARG 33 -1.017 16.921 -3.758 259 HG3 ARG 33 2HG ARG 33 -2.181 16.913 -5.084 260 HD2 ARG 33 1HD ARG 33 -3.371 18.648 -4.231 261 HD3 ARG 33 2HD ARG 33 -3.037 18.198 -2.559 262 HH11 ARG 33 1HH1 ARG 33 -3.805 20.414 -3.065 263 HH12 ARG 33 2HH1 ARG 33 -3.213 22.027 -2.852 264 HH21 ARG 33 1HH2 ARG 33 0.143 21.177 -3.340 265 HH22 ARG 33 2HH2 ARG 33 -0.972 22.460 -3.008 266 H ALA 34 H ALA 34 -2.087 13.628 -1.199 267 HA ALA 34 HA ALA 34 0.480 14.552 -0.447 268 HB1 ALA 34 3HB ALA 34 0.025 12.638 1.374 269 HB2 ALA 34 1HB ALA 34 -1.616 12.869 0.766 270 HB3 ALA 34 2HB ALA 34 -0.722 14.234 1.434 271 H ILE 35 H ILE 35 -0.699 11.337 -1.389 272 HA ILE 35 HA ILE 35 1.689 9.922 -1.035 273 HB ILE 35 HB ILE 35 0.240 9.102 -3.455 274 HG12 ILE 35 1HG1 ILE 35 -1.662 10.102 -2.284 275 HG13 ILE 35 2HG1 ILE 35 -1.789 8.347 -2.287 276 HG21 ILE 35 1HG2 ILE 35 0.853 7.737 -0.841 277 HG22 ILE 35 2HG2 ILE 35 1.835 7.685 -2.305 278 HG23 ILE 35 3HG2 ILE 35 0.232 6.949 -2.292 279 HD11 ILE 35 3HD1 ILE 35 -1.386 8.181 -0.030 280 HD12 ILE 35 1HD1 ILE 35 -2.307 9.682 -0.128 281 HD13 ILE 35 2HD1 ILE 35 -0.552 9.733 0.043 282 H ALA 36 H ALA 36 0.416 11.552 -3.982 283 HA ALA 36 HA ALA 36 2.674 11.082 -5.600 284 HB1 ALA 36 3HB ALA 36 0.216 12.097 -6.054 285 HB2 ALA 36 1HB ALA 36 1.568 12.249 -7.177 286 HB3 ALA 36 2HB ALA 36 1.179 13.574 -6.080 287 H ASP 37 H ASP 37 1.974 13.468 -3.140 288 HA ASP 37 HA ASP 37 4.065 15.275 -3.878 289 HB2 ASP 37 1HB ASP 37 1.993 15.672 -2.343 290 HB3 ASP 37 2HB ASP 37 3.031 15.031 -1.071 291 H ALA 38 H ALA 38 3.929 12.327 -2.075 292 HA ALA 38 HA ALA 38 6.594 12.697 -0.965 293 HB1 ALA 38 3HB ALA 38 4.525 11.823 0.322 294 HB2 ALA 38 1HB ALA 38 6.081 11.022 0.556 295 HB3 ALA 38 2HB ALA 38 4.866 10.299 -0.500 296 H LEU 39 H LEU 39 6.832 12.519 -3.623 297 HA LEU 39 HA LEU 39 7.012 9.924 -4.716 298 HG LEU 39 HG LEU 39 6.306 13.059 -5.881 299 HB2 LEU 39 1HB LEU 39 8.530 12.413 -5.532 300 HB3 LEU 39 2HB LEU 39 8.342 10.965 -6.493 301 HD11 LEU 39 1HD1 LEU 39 5.950 12.192 -8.433 302 HD12 LEU 39 2HD1 LEU 39 7.684 11.944 -8.212 303 HD13 LEU 39 3HD1 LEU 39 6.983 13.543 -7.960 304 HD21 LEU 39 3HD2 LEU 39 5.753 10.176 -6.565 305 HD22 LEU 39 1HD2 LEU 39 4.609 11.475 -6.884 306 HD23 LEU 39 2HD2 LEU 39 5.098 11.117 -5.229 307 HA PRO 40 HA PRO 40 11.173 8.102 -4.135 308 HB2 PRO 40 1HB PRO 40 12.607 10.606 -4.958 309 HB3 PRO 40 2HB PRO 40 13.090 8.916 -5.172 310 HG2 PRO 40 1HG PRO 40 11.880 10.341 -7.134 311 HG3 PRO 40 2HG PRO 40 11.680 8.591 -6.949 312 HD2 PRO 40 1HD PRO 40 9.727 10.700 -6.582 313 HD3 PRO 40 2HD PRO 40 9.475 8.949 -6.595 314 H ILE 41 H ILE 41 10.968 7.951 -1.995 315 HA ILE 41 HA ILE 41 12.451 9.852 -0.358 316 HB ILE 41 HB ILE 41 9.535 9.188 0.060 317 HG12 ILE 41 1HG1 ILE 41 11.127 11.766 0.117 318 HG13 ILE 41 2HG1 ILE 41 10.019 11.252 -1.147 319 HG21 ILE 41 1HG2 ILE 41 9.728 10.162 2.330 320 HG22 ILE 41 2HG2 ILE 41 11.482 10.160 2.153 321 HG23 ILE 41 3HG2 ILE 41 10.595 8.638 2.159 322 HD11 ILE 41 3HD1 ILE 41 8.285 12.121 -0.070 323 HD12 ILE 41 1HD1 ILE 41 9.442 12.854 1.040 324 HD13 ILE 41 2HD1 ILE 41 8.715 11.294 1.428 325 H LYS 42 H LYS 42 13.212 8.909 1.614 326 HA LYS 42 HA LYS 42 13.515 6.042 1.391 327 HB2 LYS 42 1HB LYS 42 14.920 8.228 2.749 328 HB3 LYS 42 2HB LYS 42 14.858 6.735 3.673 329 HG2 LYS 42 1HG LYS 42 16.386 5.765 2.386 330 HG3 LYS 42 2HG LYS 42 15.559 6.252 0.907 331 HD2 LYS 42 1HD LYS 42 17.395 7.520 0.593 332 HD3 LYS 42 2HD LYS 42 16.591 8.625 1.711 333 HE2 LYS 42 1HE LYS 42 17.784 7.406 3.574 334 HE3 LYS 42 2HE LYS 42 18.734 6.602 2.325 335 HZ1 LYS 42 3HZ LYS 42 18.596 9.500 2.160 336 HZ2 LYS 42 1HZ LYS 42 19.905 8.461 1.894 337 HZ3 LYS 42 2HZ LYS 42 19.463 8.879 3.473 338 H SER 43 H SER 43 12.714 4.511 2.694 339 HA SER 43 HA SER 43 11.349 5.226 5.162 340 HG SER 43 HG SER 43 9.054 3.185 2.523 341 HB2 SER 43 1HB SER 43 9.250 4.492 4.582 342 HB3 SER 43 2HB SER 43 9.766 5.156 3.039 343 H THR 44 H THR 44 11.135 3.473 6.625 344 HA THR 44 HA THR 44 12.878 1.192 5.946 345 HB THR 44 HB THR 44 11.999 1.443 8.740 346 HG1 THR 44 HG1 THR 44 13.707 3.433 7.671 347 HG21 THR 44 3HG2 THR 44 14.788 1.689 8.492 348 HG22 THR 44 1HG2 THR 44 14.272 0.495 7.300 349 HG23 THR 44 2HG2 THR 44 13.858 0.280 9.001 350 H ALA 45 H ALA 45 12.100 -0.793 5.763 351 HA ALA 45 HA ALA 45 9.239 -1.184 6.020 352 HB1 ALA 45 3HB ALA 45 10.418 -3.562 5.124 353 HB2 ALA 45 1HB ALA 45 11.316 -2.251 4.365 354 HB3 ALA 45 2HB ALA 45 9.569 -2.352 4.165 355 H ASN 46 H ASN 46 8.211 -2.455 7.388 356 HA ASN 46 HA ASN 46 9.791 -3.886 9.423 357 HB2 ASN 46 1HB ASN 46 7.208 -2.395 9.507 358 HB3 ASN 46 2HB ASN 46 7.361 -3.808 10.550 359 HD21 ASN 46 1HD2 ASN 46 7.201 -0.890 11.108 360 HD22 ASN 46 2HD2 ASN 46 8.568 -0.554 12.111 361 H ARG 47 H ARG 47 9.687 -6.118 9.355 362 HA ARG 47 HA ARG 47 7.940 -7.320 7.413 363 HE ARG 47 HE ARG 47 7.727 -9.947 7.533 364 HB2 ARG 47 1HB ARG 47 10.353 -8.065 8.847 365 HB3 ARG 47 2HB ARG 47 9.207 -9.394 8.745 366 HG2 ARG 47 1HG ARG 47 9.533 -7.937 6.239 367 HG3 ARG 47 2HG ARG 47 11.015 -8.688 6.813 368 HD2 ARG 47 1HD ARG 47 9.185 -9.944 5.301 369 HD3 ARG 47 2HD ARG 47 10.272 -10.765 6.417 370 HH11 ARG 47 1HH1 ARG 47 9.547 -12.494 5.982 371 HH12 ARG 47 2HH1 ARG 47 8.529 -13.758 6.583 372 HH21 ARG 47 1HH2 ARG 47 6.394 -11.617 8.329 373 HH22 ARG 47 2HH2 ARG 47 6.739 -13.261 7.912 374 H TRP 48 H TRP 48 6.216 -8.615 7.708 375 HA TRP 48 HA TRP 48 5.443 -9.569 10.325 376 HD1 TRP 48 HD1 TRP 48 1.752 -9.655 9.071 377 HE1 TRP 48 HE1 TRP 48 0.158 -10.110 11.041 378 HE3 TRP 48 HE3 TRP 48 4.246 -7.111 12.739 379 HZ2 TRP 48 HZ2 TRP 48 -0.019 -9.473 13.785 380 HZ3 TRP 48 HZ3 TRP 48 3.296 -7.083 15.009 381 HH2 TRP 48 HH2 TRP 48 1.207 -8.239 15.519 382 HB2 TRP 48 1HB TRP 48 4.540 -7.270 10.321 383 HB3 TRP 48 2HB TRP 48 3.671 -7.621 8.829 384 H GLY 49 H GLY 49 3.857 -11.225 10.221 385 HA2 GLY 49 1HA GLY 49 3.930 -13.100 8.350 386 HA3 GLY 49 2HA GLY 49 2.437 -12.759 9.203 387 H ASP 50 H ASP 50 4.103 -12.646 6.218 388 HA ASP 50 HA ASP 50 3.551 -11.949 4.115 389 HB2 ASP 50 1HB ASP 50 0.697 -12.602 4.744 390 HB3 ASP 50 2HB ASP 50 1.630 -12.951 3.292 391 H GLU 51 H GLU 51 3.413 -9.882 6.159 392 HA GLU 51 HA GLU 51 1.758 -7.979 4.685 393 HB2 GLU 51 1HB GLU 51 1.040 -8.977 7.228 394 HB3 GLU 51 2HB GLU 51 1.643 -7.347 7.495 395 HG2 GLU 51 1HG GLU 51 -0.493 -8.072 5.505 396 HG3 GLU 51 2HG GLU 51 -0.797 -7.463 7.131 397 H ILE 52 H ILE 52 2.608 -5.896 4.630 398 HA ILE 52 HA ILE 52 5.034 -5.402 6.191 399 HB ILE 52 HB ILE 52 5.118 -6.122 3.485 400 HG12 ILE 52 1HG1 ILE 52 7.556 -5.413 3.743 401 HG13 ILE 52 2HG1 ILE 52 7.116 -4.848 5.349 402 HG21 ILE 52 1HG2 ILE 52 4.411 -3.896 2.821 403 HG22 ILE 52 2HG2 ILE 52 6.091 -4.177 2.368 404 HG23 ILE 52 3HG2 ILE 52 5.714 -3.182 3.773 405 HD11 ILE 52 3HD1 ILE 52 6.847 -7.680 4.361 406 HD12 ILE 52 1HD1 ILE 52 6.463 -7.102 5.982 407 HD13 ILE 52 2HD1 ILE 52 8.125 -7.063 5.402 408 H TYR 53 H TYR 53 4.960 -3.489 7.135 409 HA TYR 53 HA TYR 53 3.504 -1.305 5.809 410 HD1 TYR 53 HD1 TYR 53 4.630 -0.484 9.660 411 HD2 TYR 53 HD2 TYR 53 2.268 -3.965 8.992 412 HE1 TYR 53 HE1 TYR 53 5.403 -1.415 11.798 413 HE2 TYR 53 HE2 TYR 53 3.038 -4.901 11.130 414 HH TYR 53 HH TYR 53 5.655 -3.659 12.848 415 HB2 TYR 53 1HB TYR 53 2.648 -0.548 8.018 416 HB3 TYR 53 2HB TYR 53 2.030 -2.132 7.555 417 H PHE 54 H PHE 54 4.529 0.585 5.733 418 HA PHE 54 HA PHE 54 6.756 1.094 7.561 419 HD1 PHE 54 HD2 PHE 54 6.816 3.561 4.524 420 HD2 PHE 54 HD1 PHE 54 7.009 -0.536 3.397 421 HE1 PHE 54 HE2 PHE 54 6.084 4.153 2.255 422 HE2 PHE 54 HE1 PHE 54 6.274 0.049 1.127 423 HZ PHE 54 HZ PHE 54 5.811 2.398 0.553 424 HB2 PHE 54 1HB PHE 54 8.262 1.701 5.765 425 HB3 PHE 54 2HB PHE 54 7.695 0.058 5.505 426 H THR 55 H THR 55 7.196 3.273 7.938 427 HA THR 55 HA THR 55 5.026 5.091 7.177 428 HB THR 55 HB THR 55 7.281 6.005 8.896 429 HG1 THR 55 HG1 THR 55 7.095 4.167 9.959 430 HG21 THR 55 3HG2 THR 55 4.371 6.470 8.685 431 HG22 THR 55 1HG2 THR 55 5.687 7.603 8.995 432 HG23 THR 55 2HG2 THR 55 5.093 6.565 10.291 433 H THR 56 H THR 56 5.397 7.120 6.173 434 HA THR 56 HA THR 56 7.998 7.324 4.797 435 HB THR 56 HB THR 56 6.100 8.634 3.204 436 HG1 THR 56 HG1 THR 56 4.604 6.937 2.837 437 HG21 THR 56 3HG2 THR 56 8.004 6.531 2.942 438 HG22 THR 56 1HG2 THR 56 7.317 7.578 1.697 439 HG23 THR 56 2HG2 THR 56 6.507 6.072 2.128 440 H GLN 57 H GLN 57 6.314 8.719 7.138 441 HA GLN 57 HA GLN 57 6.633 10.717 8.214 442 HB2 GLN 57 1HB GLN 57 7.990 11.872 5.774 443 HB3 GLN 57 2HB GLN 57 8.135 12.385 7.448 444 HG2 GLN 57 1HG GLN 57 9.417 10.442 8.006 445 HG3 GLN 57 2HG GLN 57 9.131 9.735 6.418 446 HE21 GLN 57 1HE2 GLN 57 9.688 11.543 4.641 447 HE22 GLN 57 2HE2 GLN 57 11.296 12.158 4.795 448 H VAL 58 H VAL 58 4.921 10.223 5.383 449 HA VAL 58 HA VAL 58 3.796 12.901 5.271 450 HB VAL 58 HB VAL 58 4.111 11.672 3.163 451 HG11 VAL 58 1HG1 VAL 58 2.831 9.741 2.578 452 HG12 VAL 58 2HG1 VAL 58 1.938 9.807 4.100 453 HG13 VAL 58 3HG1 VAL 58 3.654 9.404 4.103 454 HG21 VAL 58 3HG2 VAL 58 1.323 12.407 3.989 455 HG22 VAL 58 1HG2 VAL 58 1.700 11.907 2.339 456 HG23 VAL 58 2HG2 VAL 58 2.474 13.335 3.027 457 H ALA 59 H ALA 59 2.292 13.487 6.697 458 HA ALA 59 HA ALA 59 0.581 11.388 7.844 459 HB1 ALA 59 3HB ALA 59 0.923 14.148 8.981 460 HB2 ALA 59 1HB ALA 59 2.006 12.811 9.373 461 HB3 ALA 59 2HB ALA 59 0.291 12.702 9.769 462 H VAL 60 H VAL 60 -1.050 11.229 6.394 463 HA VAL 60 HA VAL 60 -2.805 13.590 6.170 464 HB VAL 60 HB VAL 60 -1.800 13.252 3.994 465 HG11 VAL 60 1HG1 VAL 60 -1.996 10.470 4.673 466 HG12 VAL 60 2HG1 VAL 60 -1.086 11.244 3.380 467 HG13 VAL 60 3HG1 VAL 60 -2.760 10.763 3.111 468 HG21 VAL 60 3HG2 VAL 60 -4.653 12.306 4.163 469 HG22 VAL 60 1HG2 VAL 60 -3.844 12.673 2.641 470 HG23 VAL 60 2HG2 VAL 60 -4.064 13.939 3.848 471 H GLU 61 H GLU 61 -4.455 13.114 7.544 472 HA GLU 61 HA GLU 61 -5.656 10.431 7.298 473 HB2 GLU 61 1HB GLU 61 -4.595 11.781 9.624 474 HB3 GLU 61 2HB GLU 61 -6.295 11.391 9.853 475 HG2 GLU 61 1HG GLU 61 -5.909 9.088 9.540 476 HG3 GLU 61 2HG GLU 61 -4.286 9.368 8.913 477 H LYS 62 H LYS 62 -7.794 10.298 7.027 478 HA LYS 62 HA LYS 62 -9.494 12.600 7.586 479 HB2 LYS 62 1HB LYS 62 -8.837 12.935 5.264 480 HB3 LYS 62 2HB LYS 62 -9.291 11.285 4.868 481 HG2 LYS 62 1HG LYS 62 -11.611 11.772 5.243 482 HG3 LYS 62 2HG LYS 62 -11.217 13.387 5.835 483 HD2 LYS 62 1HD LYS 62 -10.311 12.594 3.109 484 HD3 LYS 62 2HD LYS 62 -12.009 13.005 3.354 485 HE2 LYS 62 1HE LYS 62 -11.568 15.193 3.668 486 HE3 LYS 62 2HE LYS 62 -10.074 14.871 4.547 487 HZ1 LYS 62 3HZ LYS 62 -10.049 14.259 1.704 488 HZ2 LYS 62 1HZ LYS 62 -8.849 14.955 2.674 489 HZ3 LYS 62 2HZ LYS 62 -10.132 15.900 2.105 490 H GLU 63 H GLU 63 -11.868 11.979 7.323 491 HA GLU 63 HA GLU 63 -12.197 9.194 8.206 492 HB2 GLU 63 1HB GLU 63 -14.194 11.423 8.508 493 HB3 GLU 63 2HB GLU 63 -14.189 9.873 9.330 494 HG2 GLU 63 1HG GLU 63 -11.764 10.951 10.042 495 HG3 GLU 63 2HG GLU 63 -12.834 12.354 10.011 496 H GLU 64 H GLU 64 -12.325 8.201 6.217 497 HA GLU 64 HA GLU 64 -14.887 8.110 5.022 498 HB2 GLU 64 1HB GLU 64 -14.591 9.932 3.692 499 HB3 GLU 64 2HB GLU 64 -12.839 9.857 3.800 500 HG2 GLU 64 1HG GLU 64 -12.700 8.275 2.063 501 HG3 GLU 64 2HG GLU 64 -14.428 7.937 2.125 502 H ASN 65 H ASN 65 -14.995 6.516 3.255 503 HA ASN 65 HA ASN 65 -14.509 4.506 2.317 504 HB2 ASN 65 1HB ASN 65 -12.596 5.686 1.333 505 HB3 ASN 65 2HB ASN 65 -11.639 5.379 2.783 506 HD21 ASN 65 1HD2 ASN 65 -11.695 4.533 -0.217 507 HD22 ASN 65 2HD2 ASN 65 -11.328 2.847 -0.136 508 H SER 66 H SER 66 -11.680 4.534 4.392 509 HA SER 66 HA SER 66 -10.912 2.818 5.763 510 HG SER 66 HG SER 66 -11.570 5.125 8.166 511 HB2 SER 66 1HB SER 66 -13.180 4.286 7.008 512 HB3 SER 66 2HB SER 66 -12.558 2.877 7.866 513 H LYS 67 H LYS 67 -11.344 0.924 4.388 514 HA LYS 67 HA LYS 67 -13.758 -0.569 5.175 515 HB2 LYS 67 1HB LYS 67 -13.179 -2.133 3.300 516 HB3 LYS 67 2HB LYS 67 -13.596 -0.510 2.787 517 HG2 LYS 67 1HG LYS 67 -11.795 -1.032 1.458 518 HG3 LYS 67 2HG LYS 67 -11.039 -0.115 2.757 519 HD2 LYS 67 1HD LYS 67 -10.542 -2.320 3.873 520 HD3 LYS 67 2HD LYS 67 -11.111 -3.107 2.406 521 HE2 LYS 67 1HE LYS 67 -9.364 -2.177 1.120 522 HE3 LYS 67 2HE LYS 67 -8.926 -1.048 2.398 523 HZ1 LYS 67 3HZ LYS 67 -7.874 -3.574 1.942 524 HZ2 LYS 67 1HZ LYS 67 -8.768 -3.691 3.373 525 HZ3 LYS 67 2HZ LYS 67 -7.540 -2.540 3.233 526 H ASP 68 H ASP 68 -13.563 -2.860 5.718 527 HA ASP 68 HA ASP 68 -10.968 -3.423 7.017 528 HB2 ASP 68 1HB ASP 68 -12.364 -4.820 8.624 529 HB3 ASP 68 2HB ASP 68 -12.536 -3.072 8.747 530 H VAL 69 H VAL 69 -13.017 -4.500 4.564 531 HA VAL 69 HA VAL 69 -11.747 -7.158 4.690 532 HB VAL 69 HB VAL 69 -14.233 -7.177 5.226 533 HG11 VAL 69 1HG1 VAL 69 -15.757 -6.384 3.810 534 HG12 VAL 69 2HG1 VAL 69 -15.027 -7.221 2.442 535 HG13 VAL 69 3HG1 VAL 69 -14.425 -5.637 2.927 536 HG21 VAL 69 3HG2 VAL 69 -13.899 -8.861 2.828 537 HG22 VAL 69 1HG2 VAL 69 -14.337 -9.303 4.478 538 HG23 VAL 69 2HG2 VAL 69 -12.648 -9.010 4.064 539 H VAL 70 H VAL 70 -10.999 -8.031 2.784 540 HA VAL 70 HA VAL 70 -11.564 -6.759 0.248 541 HB VAL 70 HB VAL 70 -9.242 -6.211 -0.303 542 HG11 VAL 70 1HG1 VAL 70 -9.188 -4.119 0.723 543 HG12 VAL 70 2HG1 VAL 70 -9.931 -4.725 2.204 544 HG13 VAL 70 3HG1 VAL 70 -10.892 -4.568 0.735 545 HG21 VAL 70 3HG2 VAL 70 -8.186 -7.774 1.375 546 HG22 VAL 70 1HG2 VAL 70 -8.564 -6.572 2.612 547 HG23 VAL 70 2HG2 VAL 70 -7.475 -6.159 1.293 548 H GLU 71 H GLU 71 -10.657 -7.867 -1.578 549 HA GLU 71 HA GLU 71 -10.273 -10.704 -1.034 550 HB2 GLU 71 1HB GLU 71 -10.375 -9.559 -3.812 551 HB3 GLU 71 2HB GLU 71 -10.878 -11.143 -3.242 552 HG2 GLU 71 1HG GLU 71 -12.855 -10.346 -2.346 553 HG3 GLU 71 2HG GLU 71 -12.296 -8.677 -2.345 554 H LEU 72 H LEU 72 -8.613 -11.931 -1.885 555 HA LEU 72 HA LEU 72 -6.040 -11.090 -1.488 556 HG LEU 72 HG LEU 72 -4.398 -12.482 -3.316 557 HB2 LEU 72 1HB LEU 72 -6.660 -13.437 -1.670 558 HB3 LEU 72 2HB LEU 72 -7.023 -13.243 -3.372 559 HD11 LEU 72 1HD1 LEU 72 -4.336 -14.913 -1.620 560 HD12 LEU 72 2HD1 LEU 72 -4.612 -13.367 -0.817 561 HD13 LEU 72 3HD1 LEU 72 -3.157 -13.612 -1.783 562 HD21 LEU 72 3HD2 LEU 72 -4.007 -14.919 -4.026 563 HD22 LEU 72 1HD2 LEU 72 -5.131 -13.945 -4.973 564 HD23 LEU 72 2HD2 LEU 72 -5.746 -15.115 -3.804 565 H GLY 73 H GLY 73 -4.610 -9.824 -2.540 566 HA2 GLY 73 1HA GLY 73 -3.442 -9.387 -4.656 567 HA3 GLY 73 2HA GLY 73 -5.007 -9.428 -5.444 568 H ASP 74 H ASP 74 -6.299 -7.777 -3.384 569 HA ASP 74 HA ASP 74 -5.751 -5.255 -4.545 570 HB2 ASP 74 1HB ASP 74 -7.575 -4.447 -3.314 571 HB3 ASP 74 2HB ASP 74 -7.957 -6.143 -3.576 572 H VAL 75 H VAL 75 -5.307 -3.264 -3.310 573 HA VAL 75 HA VAL 75 -3.313 -3.722 -1.170 574 HB VAL 75 HB VAL 75 -3.239 -1.443 -3.173 575 HG11 VAL 75 1HG1 VAL 75 -1.072 -0.973 -2.379 576 HG12 VAL 75 2HG1 VAL 75 -0.981 -2.482 -1.471 577 HG13 VAL 75 3HG1 VAL 75 -2.069 -1.195 -0.941 578 HG21 VAL 75 3HG2 VAL 75 -1.110 -3.285 -3.586 579 HG22 VAL 75 1HG2 VAL 75 -2.375 -2.785 -4.706 580 HG23 VAL 75 2HG2 VAL 75 -2.634 -4.169 -3.643 581 H ALA 76 H ALA 76 -3.235 -2.017 0.546 582 HA ALA 76 HA ALA 76 -5.340 -0.012 0.441 583 HB1 ALA 76 3HB ALA 76 -6.618 -0.757 2.211 584 HB2 ALA 76 1HB ALA 76 -5.318 -1.748 2.863 585 HB3 ALA 76 2HB ALA 76 -6.188 -2.270 1.422 586 H TYR 77 H TYR 77 -5.159 1.657 1.991 587 HA TYR 77 HA TYR 77 -2.497 1.804 3.244 588 HD1 TYR 77 HD2 TYR 77 -1.722 5.067 4.080 589 HD2 TYR 77 HD1 TYR 77 -5.711 4.873 2.615 590 HE1 TYR 77 HE2 TYR 77 -2.307 7.036 5.427 591 HE2 TYR 77 HE1 TYR 77 -6.306 6.842 3.959 592 HH TYR 77 HH TYR 77 -5.050 8.837 4.959 593 HB2 TYR 77 1HB TYR 77 -2.274 3.729 2.121 594 HB3 TYR 77 2HB TYR 77 -3.925 3.625 1.530 595 H TRP 78 H TRP 78 -2.348 2.063 5.389 596 HA TRP 78 HA TRP 78 -4.709 1.836 6.990 597 HD1 TRP 78 HD1 TRP 78 -5.518 1.369 8.709 598 HE1 TRP 78 HE1 TRP 78 -5.784 0.309 11.035 599 HE3 TRP 78 HE3 TRP 78 -0.582 0.908 9.960 600 HZ2 TRP 78 HZ2 TRP 78 -4.124 -0.617 13.123 601 HZ3 TRP 78 HZ3 TRP 78 -0.006 -0.077 12.140 602 HH2 TRP 78 HH2 TRP 78 -1.741 -0.824 13.688 603 HB2 TRP 78 1HB TRP 78 -2.217 1.024 7.415 604 HB3 TRP 78 2HB TRP 78 -2.094 2.587 8.213 605 H ILE 79 H ILE 79 -5.602 3.325 8.451 606 HA ILE 79 HA ILE 79 -5.088 6.116 7.735 607 HB ILE 79 HB ILE 79 -7.338 5.201 9.506 608 HG12 ILE 79 1HG1 ILE 79 -6.959 4.410 6.808 609 HG13 ILE 79 2HG1 ILE 79 -8.388 4.188 7.808 610 HG21 ILE 79 1HG2 ILE 79 -6.834 7.617 7.794 611 HG22 ILE 79 2HG2 ILE 79 -7.051 7.541 9.544 612 HG23 ILE 79 3HG2 ILE 79 -8.416 7.233 8.470 613 HD11 ILE 79 3HD1 ILE 79 -9.047 5.248 5.794 614 HD12 ILE 79 1HD1 ILE 79 -7.796 6.477 5.957 615 HD13 ILE 79 2HD1 ILE 79 -9.153 6.443 7.082 616 HA PRO 80 HA PRO 80 -4.663 6.299 12.520 617 HB2 PRO 80 1HB PRO 80 -4.519 3.556 13.501 618 HB3 PRO 80 2HB PRO 80 -5.627 4.846 13.972 619 HG2 PRO 80 1HG PRO 80 -6.435 2.661 12.590 620 HG3 PRO 80 2HG PRO 80 -7.196 4.251 12.401 621 HD2 PRO 80 1HD PRO 80 -5.143 2.919 10.671 622 HD3 PRO 80 2HD PRO 80 -6.607 3.796 10.191 623 H GLY 81 H GLY 81 -2.644 6.643 11.115 624 HA2 GLY 81 1HA GLY 81 -0.337 6.374 12.314 625 HA3 GLY 81 2HA GLY 81 -0.504 4.726 11.728 626 H LYS 82 H LYS 82 -2.012 6.358 9.384 627 HA LYS 82 HA LYS 82 -1.443 6.888 7.218 628 HB2 LYS 82 1HB LYS 82 1.093 8.178 8.082 629 HB3 LYS 82 2HB LYS 82 -0.154 8.764 6.992 630 HG2 LYS 82 1HG LYS 82 -0.744 10.140 8.637 631 HG3 LYS 82 2HG LYS 82 -1.426 8.728 9.443 632 HD2 LYS 82 1HD LYS 82 1.027 8.402 10.293 633 HD3 LYS 82 2HD LYS 82 1.166 10.122 9.926 634 HE2 LYS 82 1HE LYS 82 -0.965 10.406 11.305 635 HE3 LYS 82 2HE LYS 82 -0.670 8.765 11.878 636 HZ1 LYS 82 3HZ LYS 82 0.233 10.594 13.307 637 HZ2 LYS 82 1HZ LYS 82 1.350 10.922 12.078 638 HZ3 LYS 82 2HZ LYS 82 1.360 9.417 12.851 639 H ALA 83 H ALA 83 -0.500 4.369 8.221 640 HA ALA 83 HA ALA 83 2.028 4.049 6.750 641 HB1 ALA 83 3HB ALA 83 2.592 3.095 8.709 642 HB2 ALA 83 1HB ALA 83 1.735 1.697 8.056 643 HB3 ALA 83 2HB ALA 83 0.916 2.795 9.166 644 H ILE 84 H ILE 84 2.086 2.880 4.931 645 HA ILE 84 HA ILE 84 -0.393 1.768 3.902 646 HB ILE 84 HB ILE 84 2.258 1.633 2.502 647 HG12 ILE 84 1HG1 ILE 84 0.371 3.996 2.577 648 HG13 ILE 84 2HG1 ILE 84 2.008 3.955 3.220 649 HG21 ILE 84 1HG2 ILE 84 -0.557 1.899 1.466 650 HG22 ILE 84 2HG2 ILE 84 0.362 0.397 1.561 651 HG23 ILE 84 3HG2 ILE 84 0.901 1.696 0.496 652 HD11 ILE 84 3HD1 ILE 84 2.045 3.195 0.462 653 HD12 ILE 84 1HD1 ILE 84 2.827 4.564 1.254 654 HD13 ILE 84 2HD1 ILE 84 1.176 4.717 0.653 655 H CYS 85 H CYS 85 -0.624 -0.416 3.171 656 HA CYS 85 HA CYS 85 1.408 -2.300 4.123 657 HG CYS 85 HG CYS 85 -1.891 -0.862 5.216 658 HB2 CYS 85 1HB CYS 85 -1.165 -3.425 4.708 659 HB3 CYS 85 2HB CYS 85 0.176 -3.105 5.804 660 H LEU 86 H LEU 86 1.743 -4.056 2.860 661 HA LEU 86 HA LEU 86 0.253 -4.223 0.358 662 HG LEU 86 HG LEU 86 1.735 -4.151 -1.206 663 HB2 LEU 86 1HB LEU 86 2.894 -4.859 1.194 664 HB3 LEU 86 2HB LEU 86 2.151 -6.363 0.673 665 HD11 LEU 86 1HD1 LEU 86 4.488 -5.248 -1.273 666 HD12 LEU 86 2HD1 LEU 86 4.154 -3.958 -0.114 667 HD13 LEU 86 3HD1 LEU 86 3.871 -3.693 -1.836 668 HD21 LEU 86 3HD2 LEU 86 1.147 -6.410 -1.776 669 HD22 LEU 86 1HD2 LEU 86 2.776 -6.979 -1.402 670 HD23 LEU 86 2HD2 LEU 86 2.506 -5.910 -2.782 671 H PHE 87 H PHE 87 -0.514 -6.367 -0.427 672 HA PHE 87 HA PHE 87 -1.288 -8.173 1.748 673 HD1 PHE 87 HD2 PHE 87 -2.881 -7.597 3.354 674 HD2 PHE 87 HD1 PHE 87 -3.929 -4.984 0.175 675 HE1 PHE 87 HE2 PHE 87 -3.486 -5.865 4.990 676 HE2 PHE 87 HE1 PHE 87 -4.531 -3.249 1.799 677 HZ PHE 87 HZ PHE 87 -4.317 -3.681 4.212 678 HB2 PHE 87 1HB PHE 87 -3.193 -7.079 -0.327 679 HB3 PHE 87 2HB PHE 87 -3.578 -8.332 0.850 680 H PHE 88 H PHE 88 -0.660 -10.125 1.309 681 HA PHE 88 HA PHE 88 -1.164 -11.353 -1.241 682 HD1 PHE 88 HD2 PHE 88 0.662 -12.794 -3.178 683 HD2 PHE 88 HD1 PHE 88 1.222 -8.690 -2.197 684 HE1 PHE 88 HE2 PHE 88 0.631 -12.222 -5.570 685 HE2 PHE 88 HE1 PHE 88 1.191 -8.112 -4.587 686 HZ PHE 88 HZ PHE 88 0.896 -9.879 -6.278 687 HB2 PHE 88 1HB PHE 88 1.506 -10.360 -0.545 688 HB3 PHE 88 2HB PHE 88 1.487 -12.071 -0.957 689 H GLY 89 H GLY 89 -1.933 -11.649 1.549 690 HA2 GLY 89 1HA GLY 89 -2.159 -14.331 1.859 691 HA3 GLY 89 2HA GLY 89 -0.582 -13.993 2.559 692 H LYS 90 H LYS 90 -1.319 -14.653 4.621 693 HA LYS 90 HA LYS 90 -3.578 -13.781 5.946 694 HB2 LYS 90 1HB LYS 90 -2.559 -14.460 7.972 695 HB3 LYS 90 2HB LYS 90 -1.988 -15.559 6.735 696 HG2 LYS 90 1HG LYS 90 0.001 -15.156 7.693 697 HG3 LYS 90 2HG LYS 90 -0.027 -13.708 6.685 698 HD2 LYS 90 1HD LYS 90 -0.043 -12.409 8.497 699 HD3 LYS 90 2HD LYS 90 -1.469 -13.240 9.118 700 HE2 LYS 90 1HE LYS 90 -0.200 -14.795 10.299 701 HE3 LYS 90 2HE LYS 90 1.258 -14.447 9.372 702 HZ1 LYS 90 3HZ LYS 90 1.766 -13.249 11.191 703 HZ2 LYS 90 1HZ LYS 90 0.156 -13.070 11.680 704 HZ3 LYS 90 2HZ LYS 90 0.790 -12.070 10.472 705 H THR 91 H THR 91 -3.067 -12.593 8.224 706 HA THR 91 HA THR 91 -1.592 -10.139 7.947 707 HB THR 91 HB THR 91 -4.227 -9.298 8.656 708 HG1 THR 91 HG1 THR 91 -5.432 -10.437 7.406 709 HG21 THR 91 3HG2 THR 91 -4.013 -8.081 6.399 710 HG22 THR 91 1HG2 THR 91 -2.378 -8.741 6.381 711 HG23 THR 91 2HG2 THR 91 -2.884 -7.679 7.692 712 HA PRO 92 HA PRO 92 -1.539 -9.801 12.397 713 HB2 PRO 92 1HB PRO 92 -4.090 -8.226 12.459 714 HB3 PRO 92 2HB PRO 92 -2.598 -7.979 13.375 715 HG2 PRO 92 1HG PRO 92 -3.112 -6.485 11.244 716 HG3 PRO 92 2HG PRO 92 -1.470 -7.083 11.549 717 HD2 PRO 92 1HD PRO 92 -3.460 -7.962 9.531 718 HD3 PRO 92 2HD PRO 92 -1.689 -7.979 9.447 719 H ILE 93 H ILE 93 -4.590 -10.694 10.908 720 HA ILE 93 HA ILE 93 -4.899 -12.787 12.908 721 HB ILE 93 HB ILE 93 -7.393 -12.306 13.010 722 HG12 ILE 93 1HG1 ILE 93 -7.247 -10.624 11.102 723 HG13 ILE 93 2HG1 ILE 93 -8.201 -10.141 12.499 724 HG21 ILE 93 1HG2 ILE 93 -6.173 -11.999 14.977 725 HG22 ILE 93 2HG2 ILE 93 -7.031 -10.475 14.755 726 HG23 ILE 93 3HG2 ILE 93 -5.321 -10.592 14.339 727 HD11 ILE 93 3HD1 ILE 93 -5.946 -9.015 13.237 728 HD12 ILE 93 1HD1 ILE 93 -7.032 -8.229 12.094 729 HD13 ILE 93 2HD1 ILE 93 -5.609 -9.088 11.509 730 H SER 94 H SER 94 -4.349 -14.220 11.230 731 HA SER 94 HA SER 94 -5.913 -14.365 8.810 732 HG SER 94 HG SER 94 -2.368 -15.847 9.614 733 HB2 SER 94 1HB SER 94 -4.399 -16.745 9.221 734 HB3 SER 94 2HB SER 94 -4.094 -15.432 8.086 735 H ASP 95 H ASP 95 -7.292 -14.749 11.447 736 HA ASP 95 HA ASP 95 -7.872 -17.434 11.941 737 HB2 ASP 95 1HB ASP 95 -9.147 -14.835 12.602 738 HB3 ASP 95 2HB ASP 95 -10.139 -16.281 12.776 739 H ASP 96 H ASP 96 -8.072 -18.299 9.764 740 HA ASP 96 HA ASP 96 -9.345 -19.309 8.174 741 HB2 ASP 96 1HB ASP 96 -11.213 -18.664 10.216 742 HB3 ASP 96 2HB ASP 96 -11.973 -18.301 8.668 743 H LYS 97 H LYS 97 -9.200 -15.960 8.565 744 HA LYS 97 HA LYS 97 -9.745 -15.574 5.734 745 HB2 LYS 97 1HB LYS 97 -11.134 -14.050 7.944 746 HB3 LYS 97 2HB LYS 97 -11.062 -13.485 6.281 747 HG2 LYS 97 1HG LYS 97 -12.087 -16.225 6.750 748 HG3 LYS 97 2HG LYS 97 -13.110 -14.870 7.225 749 HD2 LYS 97 1HD LYS 97 -13.773 -14.735 5.103 750 HD3 LYS 97 2HD LYS 97 -12.143 -14.196 4.694 751 HE2 LYS 97 1HE LYS 97 -12.342 -15.990 3.288 752 HE3 LYS 97 2HE LYS 97 -11.644 -16.778 4.701 753 HZ1 LYS 97 3HZ LYS 97 -13.375 -18.165 4.373 754 HZ2 LYS 97 1HZ LYS 97 -14.320 -17.006 3.581 755 HZ3 LYS 97 2HZ LYS 97 -14.217 -17.005 5.269 756 H ILE 98 H ILE 98 -9.384 -12.964 5.421 757 HA ILE 98 HA ILE 98 -6.774 -12.439 6.690 758 HB ILE 98 HB ILE 98 -7.759 -11.589 3.963 759 HG12 ILE 98 1HG1 ILE 98 -5.492 -13.435 4.743 760 HG13 ILE 98 2HG1 ILE 98 -7.073 -13.966 4.166 761 HG21 ILE 98 1HG2 ILE 98 -5.838 -10.351 3.634 762 HG22 ILE 98 2HG2 ILE 98 -4.963 -11.168 4.927 763 HG23 ILE 98 3HG2 ILE 98 -6.215 -9.991 5.317 764 HD11 ILE 98 3HD1 ILE 98 -6.268 -13.879 2.110 765 HD12 ILE 98 1HD1 ILE 98 -4.776 -13.127 2.674 766 HD13 ILE 98 2HD1 ILE 98 -6.173 -12.123 2.273 767 H ARG 99 H ARG 99 -7.381 -11.148 8.395 768 HA ARG 99 HA ARG 99 -9.023 -8.790 7.759 769 HE ARG 99 HE ARG 99 -13.416 -9.970 9.748 770 HB2 ARG 99 1HB ARG 99 -8.885 -10.522 10.026 771 HB3 ARG 99 2HB ARG 99 -8.409 -8.909 10.537 772 HG2 ARG 99 1HG ARG 99 -10.590 -8.536 10.773 773 HG3 ARG 99 2HG ARG 99 -10.617 -8.397 9.014 774 HD2 ARG 99 1HD ARG 99 -11.464 -10.529 8.727 775 HD3 ARG 99 2HD ARG 99 -10.878 -11.083 10.296 776 HH11 ARG 99 1HH1 ARG 99 -10.894 -9.941 12.161 777 HH12 ARG 99 2HH1 ARG 99 -11.975 -9.583 13.466 778 HH21 ARG 99 1HH2 ARG 99 -14.839 -9.498 11.462 779 HH22 ARG 99 2HH2 ARG 99 -14.214 -9.331 13.068 780 HA PRO 100 HA PRO 100 -4.899 -6.877 7.717 781 HB2 PRO 100 1HB PRO 100 -5.648 -4.671 6.331 782 HB3 PRO 100 2HB PRO 100 -5.318 -6.223 5.558 783 HG2 PRO 100 1HG PRO 100 -7.949 -5.016 6.321 784 HG3 PRO 100 2HG PRO 100 -7.486 -5.829 4.809 785 HD2 PRO 100 1HD PRO 100 -8.878 -7.079 6.761 786 HD3 PRO 100 2HD PRO 100 -7.711 -7.932 5.731 787 H ALA 101 H ALA 101 -7.978 -5.439 8.650 788 HA ALA 101 HA ALA 101 -7.028 -4.432 11.094 789 HB1 ALA 101 3HB ALA 101 -5.995 -2.895 9.120 790 HB2 ALA 101 1HB ALA 101 -6.338 -2.316 10.749 791 HB3 ALA 101 2HB ALA 101 -7.498 -2.033 9.449 792 H SER 102 H SER 102 -8.600 -2.150 11.395 793 HA SER 102 HA SER 102 -11.291 -3.276 11.044 794 HG SER 102 HG SER 102 -9.116 -1.837 13.558 795 HB2 SER 102 1HB SER 102 -11.075 -1.090 12.972 796 HB3 SER 102 2HB SER 102 -11.764 -2.701 13.169 797 H ALA 103 H ALA 103 -9.270 -0.790 9.943 798 HA ALA 103 HA ALA 103 -11.427 0.401 8.484 799 HB1 ALA 103 3HB ALA 103 -11.795 1.507 10.603 800 HB2 ALA 103 1HB ALA 103 -11.212 2.664 9.406 801 HB3 ALA 103 2HB ALA 103 -10.115 2.043 10.640 802 H VAL 104 H VAL 104 -9.736 -0.491 6.950 803 HA VAL 104 HA VAL 104 -7.734 1.618 6.425 804 HB VAL 104 HB VAL 104 -6.248 0.015 5.373 805 HG11 VAL 104 1HG1 VAL 104 -6.422 -1.588 7.695 806 HG12 VAL 104 2HG1 VAL 104 -6.913 0.047 8.140 807 HG13 VAL 104 3HG1 VAL 104 -5.347 -0.228 7.377 808 HG21 VAL 104 3HG2 VAL 104 -6.672 -2.212 5.023 809 HG22 VAL 104 1HG2 VAL 104 -8.277 -1.536 4.772 810 HG23 VAL 104 2HG2 VAL 104 -7.875 -2.305 6.306 811 H ASN 105 H ASN 105 -7.538 2.449 4.407 812 HA ASN 105 HA ASN 105 -9.797 2.052 2.645 813 HB2 ASN 105 1HB ASN 105 -7.427 3.899 2.289 814 HB3 ASN 105 2HB ASN 105 -8.955 3.972 1.421 815 HD21 ASN 105 1HD2 ASN 105 -7.781 6.060 2.902 816 HD22 ASN 105 2HD2 ASN 105 -8.859 6.457 4.191 817 H VAL 106 H VAL 106 -9.735 1.485 0.466 818 HA VAL 106 HA VAL 106 -7.586 -0.311 -0.297 819 HB VAL 106 HB VAL 106 -9.260 -0.072 -2.505 820 HG11 VAL 106 1HG1 VAL 106 -9.302 -2.280 -2.281 821 HG12 VAL 106 2HG1 VAL 106 -10.092 -2.185 -0.707 822 HG13 VAL 106 3HG1 VAL 106 -8.338 -2.051 -0.822 823 HG21 VAL 106 3HG2 VAL 106 -11.534 -0.393 -1.613 824 HG22 VAL 106 1HG2 VAL 106 -10.893 1.219 -1.289 825 HG23 VAL 106 2HG2 VAL 106 -10.933 0.009 -0.003 826 H ILE 107 H ILE 107 -5.823 0.908 -0.791 827 HA ILE 107 HA ILE 107 -6.033 3.317 -2.342 828 HB ILE 107 HB ILE 107 -4.407 2.902 -0.448 829 HG12 ILE 107 1HG1 ILE 107 -3.854 4.143 -3.082 830 HG13 ILE 107 2HG1 ILE 107 -3.916 4.877 -1.485 831 HG21 ILE 107 1HG2 ILE 107 -3.637 0.693 -1.173 832 HG22 ILE 107 2HG2 ILE 107 -2.294 1.821 -0.995 833 HG23 ILE 107 3HG2 ILE 107 -2.901 1.421 -2.601 834 HD11 ILE 107 3HD1 ILE 107 -1.691 4.998 -2.428 835 HD12 ILE 107 1HD1 ILE 107 -1.656 3.242 -2.600 836 HD13 ILE 107 2HD1 ILE 107 -1.708 3.972 -0.993 837 H GLY 108 H GLY 108 -6.688 0.603 -3.565 838 HA2 GLY 108 1HA GLY 108 -6.590 0.512 -6.028 839 HA3 GLY 108 2HA GLY 108 -4.882 0.887 -5.889 840 H ARG 109 H ARG 109 -4.233 -0.937 -7.031 841 HA ARG 109 HA ARG 109 -4.131 -3.356 -5.444 842 HE ARG 109 HE ARG 109 -8.496 -2.325 -8.145 843 HB2 ARG 109 1HB ARG 109 -5.198 -3.518 -8.263 844 HB3 ARG 109 2HB ARG 109 -5.059 -4.824 -7.098 845 HG2 ARG 109 1HG ARG 109 -6.810 -3.878 -5.749 846 HG3 ARG 109 2HG ARG 109 -6.886 -2.450 -6.779 847 HD2 ARG 109 1HD ARG 109 -7.181 -4.658 -8.488 848 HD3 ARG 109 2HD ARG 109 -8.202 -4.983 -7.088 849 HH11 ARG 109 1HH1 ARG 109 -9.562 -5.639 -8.395 850 HH12 ARG 109 2HH1 ARG 109 -11.084 -5.228 -9.110 851 HH21 ARG 109 1HH2 ARG 109 -10.498 -1.782 -9.084 852 HH22 ARG 109 2HH2 ARG 109 -11.616 -3.037 -9.502 853 H ILE 110 H ILE 110 -2.777 -5.055 -6.542 854 HA ILE 110 HA ILE 110 -0.494 -3.747 -7.848 855 HB ILE 110 HB ILE 110 -0.641 -6.474 -6.553 856 HG12 ILE 110 1HG1 ILE 110 1.099 -4.656 -5.189 857 HG13 ILE 110 2HG1 ILE 110 -0.469 -3.880 -5.378 858 HG21 ILE 110 1HG2 ILE 110 1.064 -6.282 -8.311 859 HG22 ILE 110 2HG2 ILE 110 1.775 -6.489 -6.710 860 HG23 ILE 110 3HG2 ILE 110 1.758 -4.897 -7.468 861 HD11 ILE 110 3HD1 ILE 110 -0.285 -5.068 -3.261 862 HD12 ILE 110 1HD1 ILE 110 0.010 -6.577 -4.125 863 HD13 ILE 110 2HD1 ILE 110 -1.547 -5.762 -4.278 864 H VAL 111 H VAL 111 -0.454 -3.911 -10.009 865 HA VAL 111 HA VAL 111 -1.755 -6.210 -11.275 866 HB VAL 111 HB VAL 111 -1.064 -4.710 -13.401 867 HG11 VAL 111 1HG1 VAL 111 -3.260 -5.192 -13.430 868 HG12 VAL 111 2HG1 VAL 111 -3.427 -3.552 -12.802 869 HG13 VAL 111 3HG1 VAL 111 -3.451 -4.928 -11.697 870 HG21 VAL 111 3HG2 VAL 111 -1.099 -2.417 -13.030 871 HG22 VAL 111 1HG2 VAL 111 -0.100 -3.011 -11.704 872 HG23 VAL 111 2HG2 VAL 111 -1.787 -2.588 -11.414 873 H ASN 112 H ASN 112 0.937 -4.355 -12.629 874 HA ASN 112 HA ASN 112 2.245 -6.804 -13.399 875 HB2 ASN 112 1HB ASN 112 3.947 -5.247 -14.393 876 HB3 ASN 112 2HB ASN 112 2.303 -4.991 -14.970 877 HD21 ASN 112 1HD2 ASN 112 4.208 -3.055 -15.251 878 HD22 ASN 112 2HD2 ASN 112 3.839 -1.719 -14.221 879 H SER 113 H SER 113 3.360 -7.919 -11.940 880 HA SER 113 HA SER 113 5.696 -6.950 -10.751 881 HG SER 113 HG SER 113 3.146 -7.536 -7.779 882 HB2 SER 113 1HB SER 113 5.051 -6.908 -8.372 883 HB3 SER 113 2HB SER 113 4.193 -5.673 -9.292 884 H MET 114 H MET 114 3.310 -9.008 -9.122 885 HA MET 114 HA MET 114 3.392 -11.193 -8.485 886 HB2 MET 114 1HB MET 114 4.305 -11.201 -11.324 887 HB3 MET 114 2HB MET 114 4.449 -12.692 -10.405 888 HG2 MET 114 1HG MET 114 1.906 -11.966 -9.818 889 HG3 MET 114 2HG MET 114 2.072 -11.338 -11.457 890 HE1 MET 114 3HE MET 114 4.339 -13.669 -12.429 891 HE2 MET 114 1HE MET 114 3.128 -12.847 -13.414 892 HE3 MET 114 2HE MET 114 3.185 -14.609 -13.375 893 H GLU 115 H GLU 115 5.337 -9.837 -7.256 894 HA GLU 115 HA GLU 115 7.687 -11.604 -7.435 895 HB2 GLU 115 1HB GLU 115 7.450 -8.668 -7.149 896 HB3 GLU 115 2HB GLU 115 8.680 -9.440 -6.159 897 HG2 GLU 115 1HG GLU 115 9.939 -9.065 -7.986 898 HG3 GLU 115 2HG GLU 115 9.240 -10.603 -8.489 899 H GLY 116 H GLY 116 5.266 -12.023 -5.871 900 HA2 GLY 116 1HA GLY 116 4.537 -12.117 -3.617 901 HA3 GLY 116 2HA GLY 116 5.847 -13.281 -3.687 902 H LEU 117 H LEU 117 5.892 -9.722 -3.608 903 HA LEU 117 HA LEU 117 8.106 -9.323 -2.117 904 HG LEU 117 HG LEU 117 8.188 -7.175 -0.779 905 HB2 LEU 117 1HB LEU 117 6.829 -7.494 -3.070 906 HB3 LEU 117 2HB LEU 117 5.521 -7.772 -1.938 907 HD11 LEU 117 1HD1 LEU 117 6.486 -5.085 -2.114 908 HD12 LEU 117 2HD1 LEU 117 8.129 -5.551 -2.560 909 HD13 LEU 117 3HD1 LEU 117 7.826 -4.759 -1.015 910 HD21 LEU 117 3HD2 LEU 117 5.769 -5.760 0.092 911 HD22 LEU 117 1HD2 LEU 117 6.998 -6.597 1.036 912 HD23 LEU 117 2HD2 LEU 117 5.709 -7.514 0.260 913 H LYS 118 H LYS 118 4.940 -10.233 -0.858 914 HA LYS 118 HA LYS 118 5.139 -9.778 1.809 915 HB2 LYS 118 1HB LYS 118 3.925 -11.983 2.155 916 HB3 LYS 118 2HB LYS 118 3.170 -10.837 1.057 917 HG2 LYS 118 1HG LYS 118 2.951 -12.851 -0.052 918 HG3 LYS 118 2HG LYS 118 4.389 -12.157 -0.798 919 HD2 LYS 118 1HD LYS 118 5.467 -14.038 -0.279 920 HD3 LYS 118 2HD LYS 118 5.318 -13.588 1.419 921 HE2 LYS 118 1HE LYS 118 4.402 -15.728 1.333 922 HE3 LYS 118 2HE LYS 118 2.994 -14.667 1.298 923 HZ1 LYS 118 3HZ LYS 118 3.506 -14.939 -1.309 924 HZ2 LYS 118 1HZ LYS 118 2.435 -15.932 -0.453 925 HZ3 LYS 118 2HZ LYS 118 4.019 -16.448 -0.743 926 H GLY 119 H GLY 119 7.094 -12.033 -0.007 927 HA2 GLY 119 1HA GLY 119 8.130 -13.295 2.411 928 HA3 GLY 119 2HA GLY 119 8.556 -13.706 0.756 929 H VAL 120 H VAL 120 8.608 -10.507 2.219 930 HA VAL 120 HA VAL 120 11.269 -9.992 1.298 931 HB VAL 120 HB VAL 120 11.027 -7.859 2.636 932 HG11 VAL 120 1HG1 VAL 120 10.234 -6.989 0.756 933 HG12 VAL 120 2HG1 VAL 120 8.647 -7.702 1.029 934 HG13 VAL 120 3HG1 VAL 120 9.900 -8.628 0.202 935 HG21 VAL 120 3HG2 VAL 120 8.653 -9.292 3.558 936 HG22 VAL 120 1HG2 VAL 120 8.325 -7.647 3.020 937 HG23 VAL 120 2HG2 VAL 120 9.516 -7.940 4.284 938 H ALA 121 H ALA 121 13.110 -9.424 2.637 939 HA ALA 121 HA ALA 121 13.454 -11.208 4.854 940 HB1 ALA 121 3HB ALA 121 15.309 -8.995 3.976 941 HB2 ALA 121 1HB ALA 121 15.270 -10.599 3.244 942 HB3 ALA 121 2HB ALA 121 15.715 -10.414 4.940 943 H ASP 122 H ASP 122 13.730 -10.672 7.055 944 HA ASP 122 HA ASP 122 12.088 -8.647 8.056 945 HB2 ASP 122 1HB ASP 122 12.894 -9.222 10.233 946 HB3 ASP 122 2HB ASP 122 12.760 -10.705 9.293 947 H GLY 123 H GLY 123 12.345 -6.548 7.991 948 HA2 GLY 123 1HA GLY 123 13.290 -4.477 8.294 949 HA3 GLY 123 2HA GLY 123 14.660 -5.276 9.044 950 H GLU 124 H GLU 124 13.446 -3.747 6.234 951 HA GLU 124 HA GLU 124 16.103 -3.644 5.125 952 HB2 GLU 124 1HB GLU 124 15.139 -4.324 2.800 953 HB3 GLU 124 2HB GLU 124 15.635 -5.573 3.930 954 HG2 GLU 124 1HG GLU 124 13.377 -6.027 4.530 955 HG3 GLU 124 2HG GLU 124 12.798 -4.630 3.620 956 H SER 125 H SER 125 16.393 -2.000 3.577 957 HA SER 125 HA SER 125 15.011 0.348 4.036 958 HG SER 125 HG SER 125 17.488 1.796 2.768 959 HB2 SER 125 1HB SER 125 17.263 -0.291 2.672 960 HB3 SER 125 2HB SER 125 16.180 0.089 1.331 961 H VAL 126 H VAL 126 13.871 1.691 2.409 962 HA VAL 126 HA VAL 126 12.260 0.369 0.421 963 HB VAL 126 HB VAL 126 10.874 1.584 2.822 964 HG11 VAL 126 1HG1 VAL 126 9.642 1.993 0.784 965 HG12 VAL 126 2HG1 VAL 126 8.822 0.772 1.752 966 HG13 VAL 126 3HG1 VAL 126 9.760 0.288 0.344 967 HG21 VAL 126 3HG2 VAL 126 9.998 -0.729 3.138 968 HG22 VAL 126 1HG2 VAL 126 11.717 -0.534 3.472 969 HG23 VAL 126 2HG2 VAL 126 11.190 -1.275 1.960 970 H VAL 127 H VAL 127 11.878 1.781 -1.211 971 HA VAL 127 HA VAL 127 11.952 4.655 -0.568 972 HB VAL 127 HB VAL 127 13.069 5.040 -2.776 973 HG11 VAL 127 1HG1 VAL 127 14.746 5.311 -1.328 974 HG12 VAL 127 2HG1 VAL 127 15.257 3.686 -1.788 975 HG13 VAL 127 3HG1 VAL 127 14.249 3.922 -0.362 976 HG21 VAL 127 3HG2 VAL 127 13.428 3.395 -4.221 977 HG22 VAL 127 1HG2 VAL 127 12.512 2.325 -3.159 978 HG23 VAL 127 2HG2 VAL 127 14.266 2.434 -3.002 979 H VAL 128 H VAL 128 9.952 5.364 -0.880 980 HA VAL 128 HA VAL 128 8.197 4.210 -2.863 981 HB VAL 128 HB VAL 128 7.398 6.763 -1.612 982 HG11 VAL 128 1HG1 VAL 128 5.425 5.155 -0.987 983 HG12 VAL 128 2HG1 VAL 128 6.163 4.118 -2.202 984 HG13 VAL 128 3HG1 VAL 128 5.620 5.740 -2.636 985 HG21 VAL 128 3HG2 VAL 128 6.829 5.197 0.498 986 HG22 VAL 128 1HG2 VAL 128 8.258 6.226 0.409 987 HG23 VAL 128 2HG2 VAL 128 8.379 4.508 0.022 988 H GLU 129 H GLU 129 7.891 4.990 -4.924 989 HA GLU 129 HA GLU 129 8.417 7.768 -5.531 990 HB2 GLU 129 1HB GLU 129 9.933 7.135 -7.446 991 HB3 GLU 129 2HB GLU 129 10.628 6.947 -5.843 992 HG2 GLU 129 1HG GLU 129 9.712 4.486 -6.128 993 HG3 GLU 129 2HG GLU 129 9.867 4.891 -7.837 994 H ARG 130 H ARG 130 7.029 8.500 -7.039 995 HA ARG 130 HA ARG 130 5.096 6.717 -8.176 996 HE ARG 130 HE ARG 130 5.462 11.238 -10.300 997 HB2 ARG 130 1HB ARG 130 4.507 8.985 -7.434 998 HB3 ARG 130 2HB ARG 130 5.576 9.667 -8.650 999 HG2 ARG 130 1HG ARG 130 3.558 7.835 -9.718 1000 HG3 ARG 130 2HG ARG 130 2.906 9.280 -8.940 1001 HD2 ARG 130 1HD ARG 130 4.919 9.190 -11.181 1002 HD3 ARG 130 2HD ARG 130 3.238 9.704 -11.294 1003 HH11 ARG 130 1HH1 ARG 130 1.992 10.859 -10.269 1004 HH12 ARG 130 2HH1 ARG 130 1.691 12.509 -9.841 1005 HH21 ARG 130 1HH2 ARG 130 5.067 13.408 -9.736 1006 HH22 ARG 130 2HH2 ARG 130 3.436 13.956 -9.539 1007 H ALA 131 H ALA 131 6.137 5.336 -9.588 1008 HA ALA 131 HA ALA 131 7.313 4.637 -11.441 1009 HB1 ALA 131 3HB ALA 131 5.150 5.098 -12.362 1010 HB2 ALA 131 1HB ALA 131 6.383 5.571 -13.531 1011 HB3 ALA 131 2HB ALA 131 5.557 6.801 -12.575 Start of MODEL 14 1 H MET 1 H MET 1 -4.166 20.147 -11.003 2 HA MET 1 HA MET 1 -3.165 22.508 -9.576 3 HB2 MET 1 1HB MET 1 -5.007 22.227 -11.917 4 HB3 MET 1 2HB MET 1 -5.359 23.453 -10.707 5 HG2 MET 1 1HG MET 1 -3.142 24.425 -11.050 6 HG3 MET 1 2HG MET 1 -2.805 23.206 -12.277 7 HE1 MET 1 3HE MET 1 -3.377 26.989 -13.440 8 HE2 MET 1 1HE MET 1 -2.562 25.734 -14.373 9 HE3 MET 1 2HE MET 1 -2.244 25.894 -12.646 10 H GLY 2 H GLY 2 -6.313 21.119 -10.490 11 HA2 GLY 2 1HA GLY 2 -7.127 21.282 -7.682 12 HA3 GLY 2 2HA GLY 2 -8.198 21.073 -9.059 13 H GLU 3 H GLU 3 -7.403 18.916 -10.339 14 HA GLU 3 HA GLU 3 -6.968 16.784 -8.393 15 HB2 GLU 3 1HB GLU 3 -9.512 17.372 -9.116 16 HB3 GLU 3 2HB GLU 3 -9.090 16.273 -10.418 17 HG2 GLU 3 1HG GLU 3 -8.397 14.633 -8.578 18 HG3 GLU 3 2HG GLU 3 -9.252 15.712 -7.472 19 H ARG 4 H ARG 4 -7.557 14.671 -10.264 20 HA ARG 4 HA ARG 4 -5.829 15.168 -12.546 21 HE ARG 4 HE ARG 4 -2.253 14.152 -11.311 22 HB2 ARG 4 1HB ARG 4 -5.064 12.666 -11.217 23 HB3 ARG 4 2HB ARG 4 -4.065 13.890 -11.977 24 HG2 ARG 4 1HG ARG 4 -5.283 14.581 -9.366 25 HG3 ARG 4 2HG ARG 4 -4.001 13.375 -9.364 26 HD2 ARG 4 1HD ARG 4 -3.884 16.257 -10.186 27 HD3 ARG 4 2HD ARG 4 -2.880 15.393 -9.025 28 HH11 ARG 4 1HH1 ARG 4 -2.459 17.544 -10.509 29 HH12 ARG 4 2HH1 ARG 4 -1.245 18.014 -11.650 30 HH21 ARG 4 1HH2 ARG 4 -0.657 14.771 -12.810 31 HH22 ARG 4 2HH2 ARG 4 -0.220 16.441 -12.955 32 H GLY 5 H GLY 5 -6.941 12.203 -10.915 33 HA2 GLY 5 1HA GLY 5 -9.191 11.647 -12.413 34 HA3 GLY 5 2HA GLY 5 -7.844 11.074 -13.386 35 H VAL 6 H VAL 6 -9.339 9.100 -12.901 36 HA VAL 6 HA VAL 6 -8.532 7.825 -10.367 37 HB VAL 6 HB VAL 6 -10.612 6.866 -12.353 38 HG11 VAL 6 1HG1 VAL 6 -10.515 6.120 -9.456 39 HG12 VAL 6 2HG1 VAL 6 -9.515 5.268 -10.635 40 HG13 VAL 6 3HG1 VAL 6 -11.269 5.277 -10.808 41 HG21 VAL 6 3HG2 VAL 6 -10.990 9.155 -11.162 42 HG22 VAL 6 1HG2 VAL 6 -11.340 8.150 -9.755 43 HG23 VAL 6 2HG2 VAL 6 -12.291 7.969 -11.228 44 H GLU 7 H GLU 7 -6.387 7.855 -11.791 45 HA GLU 7 HA GLU 7 -5.859 5.135 -12.428 46 HB2 GLU 7 1HB GLU 7 -4.991 5.943 -14.814 47 HB3 GLU 7 2HB GLU 7 -6.610 5.306 -14.574 48 HG2 GLU 7 1HG GLU 7 -6.568 7.334 -15.960 49 HG3 GLU 7 2HG GLU 7 -7.523 7.530 -14.491 50 H MET 8 H MET 8 -4.696 6.598 -10.545 51 HA MET 8 HA MET 8 -2.123 7.479 -11.656 52 HB2 MET 8 1HB MET 8 -3.680 8.942 -10.083 53 HB3 MET 8 2HB MET 8 -2.864 8.028 -8.823 54 HG2 MET 8 1HG MET 8 -1.244 9.530 -8.916 55 HG3 MET 8 2HG MET 8 -0.815 8.858 -10.490 56 HE1 MET 8 3HE MET 8 -2.796 11.923 -8.697 57 HE2 MET 8 1HE MET 8 -1.818 13.034 -9.653 58 HE3 MET 8 2HE MET 8 -1.040 11.767 -8.705 59 H ARG 9 H ARG 9 -0.540 6.056 -11.525 60 HA ARG 9 HA ARG 9 -0.586 4.107 -9.318 61 HE ARG 9 HE ARG 9 2.750 2.206 -13.691 62 HB2 ARG 9 1HB ARG 9 0.382 2.510 -10.691 63 HB3 ARG 9 2HB ARG 9 -0.695 3.359 -11.789 64 HG2 ARG 9 1HG ARG 9 1.092 3.440 -13.132 65 HG3 ARG 9 2HG ARG 9 1.610 4.774 -12.100 66 HD2 ARG 9 1HD ARG 9 3.293 3.592 -11.214 67 HD3 ARG 9 2HD ARG 9 2.310 2.136 -11.053 68 HH11 ARG 9 1HH1 ARG 9 4.930 2.560 -10.987 69 HH12 ARG 9 2HH1 ARG 9 6.288 1.907 -11.839 70 HH21 ARG 9 1HH2 ARG 9 4.536 1.346 -14.808 71 HH22 ARG 9 2HH2 ARG 9 6.065 1.219 -14.007 72 H LEU 10 H LEU 10 1.212 3.636 -8.142 73 HA LEU 10 HA LEU 10 3.496 5.473 -8.459 74 HG LEU 10 HG LEU 10 0.894 4.378 -6.147 75 HB2 LEU 10 1HB LEU 10 3.419 4.536 -5.767 76 HB3 LEU 10 2HB LEU 10 3.302 6.178 -6.358 77 HD11 LEU 10 1HD1 LEU 10 2.075 6.239 -4.088 78 HD12 LEU 10 2HD1 LEU 10 1.748 4.513 -3.916 79 HD13 LEU 10 3HD1 LEU 10 0.411 5.658 -4.041 80 HD21 LEU 10 3HD2 LEU 10 0.614 7.263 -5.829 81 HD22 LEU 10 1HD2 LEU 10 -0.287 6.141 -6.848 82 HD23 LEU 10 2HD2 LEU 10 1.257 6.792 -7.402 83 H ARG 11 H ARG 11 5.533 4.595 -7.462 84 HA ARG 11 HA ARG 11 5.700 1.720 -8.030 85 HE ARG 11 HE ARG 11 10.515 0.750 -8.721 86 HB2 ARG 11 1HB ARG 11 7.129 3.812 -9.130 87 HB3 ARG 11 2HB ARG 11 8.241 3.159 -7.936 88 HG2 ARG 11 1HG ARG 11 6.860 1.467 -10.000 89 HG3 ARG 11 2HG ARG 11 8.438 2.212 -10.252 90 HD2 ARG 11 1HD ARG 11 8.453 0.875 -7.735 91 HD3 ARG 11 2HD ARG 11 7.826 -0.233 -8.955 92 HH11 ARG 11 1HH1 ARG 11 8.129 -0.549 -10.912 93 HH12 ARG 11 2HH1 ARG 11 9.304 -1.154 -12.032 94 HH21 ARG 11 1HH2 ARG 11 12.061 -0.044 -10.192 95 HH22 ARG 11 2HH2 ARG 11 11.537 -0.867 -11.624 96 H ILE 12 H ILE 12 6.839 0.353 -6.645 97 HA ILE 12 HA ILE 12 7.967 1.461 -4.203 98 HB ILE 12 HB ILE 12 5.411 0.003 -4.303 99 HG12 ILE 12 1HG1 ILE 12 6.633 1.429 -1.958 100 HG13 ILE 12 2HG1 ILE 12 6.016 2.323 -3.343 101 HG21 ILE 12 1HG2 ILE 12 7.608 -0.953 -2.501 102 HG22 ILE 12 2HG2 ILE 12 6.469 -1.894 -3.466 103 HG23 ILE 12 3HG2 ILE 12 5.915 -1.055 -2.017 104 HD11 ILE 12 3HD1 ILE 12 4.438 0.445 -1.601 105 HD12 ILE 12 1HD1 ILE 12 3.815 1.315 -3.004 106 HD13 ILE 12 2HD1 ILE 12 4.359 2.207 -1.584 107 H ARG 13 H ARG 13 9.969 0.731 -4.572 108 HA ARG 13 HA ARG 13 10.314 -2.082 -5.343 109 HE ARG 13 HE ARG 13 12.480 1.709 -7.661 110 HB2 ARG 13 1HB ARG 13 12.660 -1.438 -5.854 111 HB3 ARG 13 2HB ARG 13 11.471 -0.552 -6.800 112 HG2 ARG 13 1HG ARG 13 11.759 1.402 -5.465 113 HG3 ARG 13 2HG ARG 13 12.755 0.524 -4.302 114 HD2 ARG 13 1HD ARG 13 14.388 1.555 -5.527 115 HD3 ARG 13 2HD ARG 13 14.230 0.047 -6.427 116 HH11 ARG 13 1HH1 ARG 13 15.865 1.956 -6.848 117 HH12 ARG 13 2HH1 ARG 13 16.242 2.975 -8.196 118 HH21 ARG 13 1HH2 ARG 13 12.976 3.049 -9.437 119 HH22 ARG 13 2HH2 ARG 13 14.603 3.594 -9.666 120 H PHE 14 H PHE 14 11.930 -3.360 -4.335 121 HA PHE 14 HA PHE 14 12.704 -2.557 -1.626 122 HD1 PHE 14 HD1 PHE 14 9.836 -2.393 -1.812 123 HD2 PHE 14 HD2 PHE 14 11.470 -5.229 0.907 124 HE1 PHE 14 HE1 PHE 14 8.402 -1.502 -0.027 125 HE2 PHE 14 HE2 PHE 14 10.039 -4.342 2.697 126 HZ PHE 14 HZ PHE 14 8.501 -2.476 2.232 127 HB2 PHE 14 1HB PHE 14 10.991 -4.843 -2.428 128 HB3 PHE 14 2HB PHE 14 12.245 -5.201 -1.247 129 H GLU 15 H GLU 15 14.724 -3.198 -1.057 130 HA GLU 15 HA GLU 15 16.688 -3.655 -2.855 131 HB2 GLU 15 1HB GLU 15 16.443 -4.139 0.044 132 HB3 GLU 15 2HB GLU 15 17.701 -5.068 -0.753 133 HG2 GLU 15 1HG GLU 15 18.263 -2.765 0.262 134 HG3 GLU 15 2HG GLU 15 18.922 -3.210 -1.310 135 H SER 16 H SER 16 14.527 -6.089 -1.596 136 HA SER 16 HA SER 16 15.903 -8.079 -3.277 137 HG SER 16 HG SER 16 15.645 -7.713 0.265 138 HB2 SER 16 1HB SER 16 14.354 -8.959 -0.882 139 HB3 SER 16 2HB SER 16 15.744 -9.713 -1.660 140 H ALA 17 H ALA 17 13.497 -6.261 -3.740 141 HA ALA 17 HA ALA 17 11.947 -8.173 -5.154 142 HB1 ALA 17 3HB ALA 17 10.080 -8.538 -3.894 143 HB2 ALA 17 1HB ALA 17 10.251 -7.030 -2.995 144 HB3 ALA 17 2HB ALA 17 11.280 -8.411 -2.610 145 H GLU 18 H GLU 18 10.307 -7.292 -6.447 146 HA GLU 18 HA GLU 18 10.166 -4.343 -6.485 147 HB2 GLU 18 1HB GLU 18 10.143 -4.411 -8.928 148 HB3 GLU 18 2HB GLU 18 11.613 -5.140 -8.298 149 HG2 GLU 18 1HG GLU 18 10.097 -7.332 -8.499 150 HG3 GLU 18 2HG GLU 18 9.369 -6.358 -9.776 151 H CYS 19 H CYS 19 8.172 -3.416 -6.903 152 HA CYS 19 HA CYS 19 5.966 -4.967 -7.896 153 HG CYS 19 HG CYS 19 6.687 -5.992 -4.105 154 HB2 CYS 19 1HB CYS 19 4.868 -4.146 -5.431 155 HB3 CYS 19 2HB CYS 19 5.142 -5.794 -5.983 156 H GLU 20 H GLU 20 4.105 -3.722 -8.376 157 HA GLU 20 HA GLU 20 4.362 -0.831 -7.885 158 HB2 GLU 20 1HB GLU 20 3.149 -1.776 -10.445 159 HB3 GLU 20 2HB GLU 20 3.985 -0.269 -10.098 160 HG2 GLU 20 1HG GLU 20 6.041 -1.906 -9.808 161 HG3 GLU 20 2HG GLU 20 5.070 -2.900 -10.887 162 H VAL 21 H VAL 21 2.280 0.336 -8.023 163 HA VAL 21 HA VAL 21 -0.118 -1.285 -7.871 164 HB VAL 21 HB VAL 21 -0.335 -1.369 -5.666 165 HG11 VAL 21 1HG1 VAL 21 2.275 0.134 -5.602 166 HG12 VAL 21 2HG1 VAL 21 2.032 -1.613 -5.528 167 HG13 VAL 21 3HG1 VAL 21 1.513 -0.593 -4.185 168 HG21 VAL 21 3HG2 VAL 21 -0.493 0.664 -4.268 169 HG22 VAL 21 1HG2 VAL 21 -1.477 0.760 -5.729 170 HG23 VAL 21 2HG2 VAL 21 0.058 1.623 -5.641 171 H GLU 22 H GLU 22 -1.964 -0.209 -8.363 172 HA GLU 22 HA GLU 22 -1.659 2.544 -9.295 173 HB2 GLU 22 1HB GLU 22 -3.848 0.504 -9.726 174 HB3 GLU 22 2HB GLU 22 -3.891 2.144 -10.359 175 HG2 GLU 22 1HG GLU 22 -2.567 1.633 -12.069 176 HG3 GLU 22 2HG GLU 22 -1.437 0.752 -11.041 177 H LEU 23 H LEU 23 -4.013 3.735 -9.055 178 HA LEU 23 HA LEU 23 -5.151 3.263 -6.447 179 HG LEU 23 HG LEU 23 -5.562 6.582 -6.359 180 HB2 LEU 23 1HB LEU 23 -3.478 4.558 -5.546 181 HB3 LEU 23 2HB LEU 23 -3.294 5.522 -6.994 182 HD11 LEU 23 1HD1 LEU 23 -5.083 4.818 -4.066 183 HD12 LEU 23 2HD1 LEU 23 -6.576 5.559 -4.640 184 HD13 LEU 23 3HD1 LEU 23 -5.458 6.486 -3.642 185 HD21 LEU 23 3HD2 LEU 23 -4.386 8.053 -4.653 186 HD22 LEU 23 1HD2 LEU 23 -3.623 7.902 -6.236 187 HD23 LEU 23 2HD2 LEU 23 -2.991 6.996 -4.861 188 H TYR 24 H TYR 24 -7.111 4.295 -6.091 189 HA TYR 24 HA TYR 24 -8.201 5.772 -8.394 190 HD1 TYR 24 HD2 TYR 24 -7.870 4.419 -9.897 191 HD2 TYR 24 HD1 TYR 24 -10.005 1.521 -7.629 192 HE1 TYR 24 HE2 TYR 24 -7.117 2.663 -11.444 193 HE2 TYR 24 HE1 TYR 24 -9.258 -0.242 -9.170 194 HH TYR 24 HH TYR 24 -6.864 -0.210 -10.986 195 HB2 TYR 24 1HB TYR 24 -9.701 3.700 -6.763 196 HB3 TYR 24 2HB TYR 24 -10.341 4.628 -8.116 197 H GLU 25 H GLU 25 -9.737 7.366 -7.950 198 HA GLU 25 HA GLU 25 -9.305 8.886 -5.654 199 HB2 GLU 25 1HB GLU 25 -11.617 8.967 -7.591 200 HB3 GLU 25 2HB GLU 25 -11.323 10.182 -6.351 201 HG2 GLU 25 1HG GLU 25 -9.530 11.072 -7.450 202 HG3 GLU 25 2HG GLU 25 -9.124 9.557 -8.256 203 H GLU 26 H GLU 26 -11.157 6.065 -5.808 204 HA GLU 26 HA GLU 26 -13.405 6.483 -4.341 205 HB2 GLU 26 1HB GLU 26 -13.326 4.206 -3.675 206 HB3 GLU 26 2HB GLU 26 -12.553 4.289 -5.251 207 HG2 GLU 26 1HG GLU 26 -10.347 4.361 -4.036 208 HG3 GLU 26 2HG GLU 26 -11.242 3.979 -2.568 209 H TRP 27 H TRP 27 -10.122 6.687 -3.185 210 HA TRP 27 HA TRP 27 -10.873 6.684 -0.402 211 HD1 TRP 27 HD1 TRP 27 -6.078 7.592 -0.472 212 HE1 TRP 27 HE1 TRP 27 -5.664 8.667 1.822 213 HE3 TRP 27 HE3 TRP 27 -10.862 7.520 1.347 214 HZ2 TRP 27 HZ2 TRP 27 -7.158 9.401 4.099 215 HZ3 TRP 27 HZ3 TRP 27 -11.277 8.436 3.590 216 HH2 TRP 27 HH2 TRP 27 -9.465 9.351 4.938 217 HB2 TRP 27 1HB TRP 27 -8.713 5.800 -0.867 218 HB3 TRP 27 2HB TRP 27 -8.286 7.173 -1.880 219 H ALA 28 H ALA 28 -9.481 9.099 -2.651 220 HA ALA 28 HA ALA 28 -11.123 11.170 -2.432 221 HB1 ALA 28 3HB ALA 28 -11.341 11.378 -0.151 222 HB2 ALA 28 1HB ALA 28 -10.059 12.544 -0.477 223 HB3 ALA 28 2HB ALA 28 -9.659 10.950 0.160 224 HA PRO 29 HA PRO 29 -7.750 12.369 -5.197 225 HB2 PRO 29 1HB PRO 29 -9.338 14.890 -4.977 226 HB3 PRO 29 2HB PRO 29 -8.674 14.100 -6.408 227 HG2 PRO 29 1HG PRO 29 -11.282 13.920 -5.736 228 HG3 PRO 29 2HG PRO 29 -10.417 12.622 -6.571 229 HD2 PRO 29 1HD PRO 29 -11.422 12.717 -3.814 230 HD3 PRO 29 2HD PRO 29 -10.943 11.319 -4.794 231 H GLU 30 H GLU 30 -8.861 14.126 -2.341 232 HA GLU 30 HA GLU 30 -6.792 16.005 -2.183 233 HB2 GLU 30 1HB GLU 30 -8.898 16.158 -0.898 234 HB3 GLU 30 2HB GLU 30 -8.386 14.789 0.083 235 HG2 GLU 30 1HG GLU 30 -6.370 16.833 0.024 236 HG3 GLU 30 2HG GLU 30 -7.915 17.484 0.564 237 H THR 31 H THR 31 -7.134 12.827 -0.594 238 HA THR 31 HA THR 31 -4.614 12.949 0.722 239 HB THR 31 HB THR 31 -5.192 10.222 0.275 240 HG1 THR 31 HG1 THR 31 -7.222 10.795 -0.521 241 HG21 THR 31 3HG2 THR 31 -4.472 10.870 2.408 242 HG22 THR 31 1HG2 THR 31 -6.141 10.347 2.621 243 HG23 THR 31 2HG2 THR 31 -5.760 12.065 2.575 244 H VAL 32 H VAL 32 -5.633 11.468 -2.342 245 HA VAL 32 HA VAL 32 -3.342 10.189 -3.123 246 HB VAL 32 HB VAL 32 -5.021 11.881 -4.976 247 HG11 VAL 32 1HG1 VAL 32 -3.355 11.139 -6.333 248 HG12 VAL 32 2HG1 VAL 32 -4.413 9.731 -6.413 249 HG13 VAL 32 3HG1 VAL 32 -3.018 9.725 -5.336 250 HG21 VAL 32 3HG2 VAL 32 -6.692 10.632 -4.062 251 HG22 VAL 32 1HG2 VAL 32 -5.605 9.332 -3.573 252 HG23 VAL 32 2HG2 VAL 32 -6.111 9.474 -5.257 253 H ARG 33 H ARG 33 -3.927 13.624 -2.955 254 HA ARG 33 HA ARG 33 -1.807 14.489 -4.603 255 HE ARG 33 HE ARG 33 -1.006 19.827 -3.244 256 HB2 ARG 33 1HB ARG 33 -3.806 15.824 -3.657 257 HB3 ARG 33 2HB ARG 33 -2.805 16.045 -2.230 258 HG2 ARG 33 1HG ARG 33 -1.032 16.938 -3.861 259 HG3 ARG 33 2HG ARG 33 -2.367 17.068 -5.009 260 HD2 ARG 33 1HD ARG 33 -3.557 18.549 -3.550 261 HD3 ARG 33 2HD ARG 33 -2.388 18.293 -2.256 262 HH11 ARG 33 1HH1 ARG 33 -3.462 18.880 -5.535 263 HH12 ARG 33 2HH1 ARG 33 -3.022 20.086 -6.695 264 HH21 ARG 33 1HH2 ARG 33 -0.427 21.415 -4.769 265 HH22 ARG 33 2HH2 ARG 33 -1.298 21.526 -6.261 266 H ALA 34 H ALA 34 -1.981 13.720 -1.159 267 HA ALA 34 HA ALA 34 0.607 14.666 -0.492 268 HB1 ALA 34 3HB ALA 34 -0.551 14.404 1.425 269 HB2 ALA 34 1HB ALA 34 0.192 12.806 1.388 270 HB3 ALA 34 2HB ALA 34 -1.462 13.023 0.814 271 H ILE 35 H ILE 35 -0.622 11.451 -1.345 272 HA ILE 35 HA ILE 35 1.743 9.999 -1.020 273 HB ILE 35 HB ILE 35 0.251 9.193 -3.419 274 HG12 ILE 35 1HG1 ILE 35 -1.614 10.239 -2.217 275 HG13 ILE 35 2HG1 ILE 35 -1.779 8.486 -2.228 276 HG21 ILE 35 1HG2 ILE 35 0.434 7.595 -0.917 277 HG22 ILE 35 2HG2 ILE 35 1.909 7.946 -1.817 278 HG23 ILE 35 3HG2 ILE 35 0.584 7.086 -2.599 279 HD11 ILE 35 3HD1 ILE 35 -1.358 8.298 0.021 280 HD12 ILE 35 1HD1 ILE 35 -2.236 9.825 -0.054 281 HD13 ILE 35 2HD1 ILE 35 -0.479 9.825 0.095 282 H ALA 36 H ALA 36 0.467 11.637 -3.959 283 HA ALA 36 HA ALA 36 2.700 11.115 -5.601 284 HB1 ALA 36 3HB ALA 36 1.240 13.630 -6.080 285 HB2 ALA 36 1HB ALA 36 0.253 12.169 -6.034 286 HB3 ALA 36 2HB ALA 36 1.594 12.292 -7.174 287 H ASP 37 H ASP 37 2.059 13.546 -3.164 288 HA ASP 37 HA ASP 37 4.183 15.299 -3.934 289 HB2 ASP 37 1HB ASP 37 2.131 15.757 -2.389 290 HB3 ASP 37 2HB ASP 37 3.163 15.109 -1.116 291 H ALA 38 H ALA 38 3.996 12.376 -2.095 292 HA ALA 38 HA ALA 38 6.678 12.701 -1.009 293 HB1 ALA 38 3HB ALA 38 4.615 11.889 0.315 294 HB2 ALA 38 1HB ALA 38 6.147 11.037 0.526 295 HB3 ALA 38 2HB ALA 38 4.889 10.351 -0.504 296 H LEU 39 H LEU 39 6.895 12.495 -3.660 297 HA LEU 39 HA LEU 39 7.011 9.896 -4.744 298 HG LEU 39 HG LEU 39 6.376 13.037 -5.925 299 HB2 LEU 39 1HB LEU 39 8.583 12.345 -5.574 300 HB3 LEU 39 2HB LEU 39 8.363 10.896 -6.526 301 HD11 LEU 39 1HD1 LEU 39 7.726 11.873 -8.246 302 HD12 LEU 39 2HD1 LEU 39 7.059 13.489 -8.009 303 HD13 LEU 39 3HD1 LEU 39 5.999 12.156 -8.469 304 HD21 LEU 39 3HD2 LEU 39 5.143 11.105 -5.252 305 HD22 LEU 39 1HD2 LEU 39 5.749 10.168 -6.613 306 HD23 LEU 39 2HD2 LEU 39 4.632 11.498 -6.891 307 HA PRO 40 HA PRO 40 11.134 7.974 -4.191 308 HB2 PRO 40 1HB PRO 40 12.617 10.454 -5.002 309 HB3 PRO 40 2HB PRO 40 13.068 8.757 -5.221 310 HG2 PRO 40 1HG PRO 40 11.885 10.207 -7.180 311 HG3 PRO 40 2HG PRO 40 11.645 8.463 -6.996 312 HD2 PRO 40 1HD PRO 40 9.744 10.619 -6.619 313 HD3 PRO 40 2HD PRO 40 9.449 8.874 -6.641 314 H ILE 41 H ILE 41 10.961 7.799 -2.053 315 HA ILE 41 HA ILE 41 12.473 9.665 -0.406 316 HB ILE 41 HB ILE 41 9.548 9.047 0.026 317 HG12 ILE 41 1HG1 ILE 41 11.175 11.605 0.063 318 HG13 ILE 41 2HG1 ILE 41 10.055 11.100 -1.197 319 HG21 ILE 41 1HG2 ILE 41 10.629 8.497 2.118 320 HG22 ILE 41 2HG2 ILE 41 9.776 10.028 2.290 321 HG23 ILE 41 3HG2 ILE 41 11.528 10.012 2.094 322 HD11 ILE 41 3HD1 ILE 41 8.770 11.172 1.389 323 HD12 ILE 41 1HD1 ILE 41 8.332 11.984 -0.116 324 HD13 ILE 41 2HD1 ILE 41 9.503 12.722 0.977 325 H LYS 42 H LYS 42 13.246 8.698 1.538 326 HA LYS 42 HA LYS 42 13.455 5.821 1.316 327 HB2 LYS 42 1HB LYS 42 14.875 7.935 2.874 328 HB3 LYS 42 2HB LYS 42 14.960 6.272 3.439 329 HG2 LYS 42 1HG LYS 42 15.596 5.819 0.916 330 HG3 LYS 42 2HG LYS 42 16.101 7.508 0.995 331 HD2 LYS 42 1HD LYS 42 16.972 5.858 3.265 332 HD3 LYS 42 2HD LYS 42 17.653 5.389 1.706 333 HE2 LYS 42 1HE LYS 42 19.059 7.020 2.900 334 HE3 LYS 42 2HE LYS 42 18.481 7.631 1.349 335 HZ1 LYS 42 3HZ LYS 42 18.239 9.350 2.946 336 HZ2 LYS 42 1HZ LYS 42 17.461 8.327 4.046 337 HZ3 LYS 42 2HZ LYS 42 16.684 8.774 2.611 338 H SER 43 H SER 43 12.564 4.329 2.602 339 HA SER 43 HA SER 43 11.277 5.115 5.101 340 HG SER 43 HG SER 43 9.619 3.119 2.179 341 HB2 SER 43 1HB SER 43 9.161 4.369 4.561 342 HB3 SER 43 2HB SER 43 9.663 5.041 3.015 343 H THR 44 H THR 44 11.035 3.402 6.600 344 HA THR 44 HA THR 44 12.741 1.077 5.982 345 HB THR 44 HB THR 44 11.810 1.501 8.760 346 HG1 THR 44 HG1 THR 44 13.719 3.251 7.612 347 HG21 THR 44 3HG2 THR 44 14.590 1.460 8.643 348 HG22 THR 44 1HG2 THR 44 14.054 0.317 7.412 349 HG23 THR 44 2HG2 THR 44 13.515 0.133 9.083 350 H ALA 45 H ALA 45 11.899 -0.879 5.777 351 HA ALA 45 HA ALA 45 9.038 -1.212 6.124 352 HB1 ALA 45 3HB ALA 45 11.048 -2.345 4.402 353 HB2 ALA 45 1HB ALA 45 9.293 -2.334 4.224 354 HB3 ALA 45 2HB ALA 45 10.079 -3.607 5.157 355 H ASN 46 H ASN 46 8.052 -2.362 7.588 356 HA ASN 46 HA ASN 46 9.655 -3.835 9.565 357 HB2 ASN 46 1HB ASN 46 7.001 -2.453 9.643 358 HB3 ASN 46 2HB ASN 46 7.271 -3.811 10.733 359 HD21 ASN 46 1HD2 ASN 46 6.983 -0.827 11.087 360 HD22 ASN 46 2HD2 ASN 46 8.329 -0.388 12.076 361 H ARG 47 H ARG 47 9.650 -6.062 9.417 362 HA ARG 47 HA ARG 47 7.821 -7.267 7.535 363 HE ARG 47 HE ARG 47 7.823 -9.833 7.191 364 HB2 ARG 47 1HB ARG 47 10.374 -7.965 8.775 365 HB3 ARG 47 2HB ARG 47 9.294 -9.337 8.565 366 HG2 ARG 47 1HG ARG 47 9.329 -7.697 6.200 367 HG3 ARG 47 2HG ARG 47 10.960 -8.181 6.649 368 HD2 ARG 47 1HD ARG 47 9.580 -9.708 5.096 369 HD3 ARG 47 2HD ARG 47 10.496 -10.437 6.411 370 HH11 ARG 47 1HH1 ARG 47 9.757 -12.137 5.422 371 HH12 ARG 47 2HH1 ARG 47 8.646 -13.443 5.660 372 HH21 ARG 47 1HH2 ARG 47 6.360 -11.552 7.506 373 HH22 ARG 47 2HH2 ARG 47 6.718 -13.112 6.843 374 H TRP 48 H TRP 48 6.191 -8.626 7.910 375 HA TRP 48 HA TRP 48 5.743 -9.870 10.471 376 HD1 TRP 48 HD1 TRP 48 2.010 -9.818 9.081 377 HE1 TRP 48 HE1 TRP 48 0.296 -10.668 10.803 378 HE3 TRP 48 HE3 TRP 48 4.202 -8.047 13.348 379 HZ2 TRP 48 HZ2 TRP 48 -0.077 -10.597 13.602 380 HZ3 TRP 48 HZ3 TRP 48 3.102 -8.482 15.505 381 HH2 TRP 48 HH2 TRP 48 1.007 -9.730 15.629 382 HB2 TRP 48 1HB TRP 48 4.701 -7.769 10.994 383 HB3 TRP 48 2HB TRP 48 3.894 -7.707 9.433 384 H GLY 49 H GLY 49 4.232 -11.600 10.301 385 HA2 GLY 49 1HA GLY 49 4.212 -13.213 8.189 386 HA3 GLY 49 2HA GLY 49 2.793 -13.081 9.213 387 H ASP 50 H ASP 50 4.290 -12.046 6.225 388 HA ASP 50 HA ASP 50 3.405 -11.453 4.219 389 HB2 ASP 50 1HB ASP 50 1.671 -13.118 4.531 390 HB3 ASP 50 2HB ASP 50 0.751 -12.020 5.548 391 H GLU 51 H GLU 51 1.968 -9.995 7.088 392 HA GLU 51 HA GLU 51 1.088 -7.621 5.780 393 HB2 GLU 51 1HB GLU 51 0.388 -8.703 8.082 394 HB3 GLU 51 2HB GLU 51 1.699 -7.713 8.706 395 HG2 GLU 51 1HG GLU 51 -0.261 -6.364 6.958 396 HG3 GLU 51 2HG GLU 51 -0.828 -6.876 8.544 397 H ILE 52 H ILE 52 2.144 -5.753 5.408 398 HA ILE 52 HA ILE 52 4.729 -5.300 6.711 399 HB ILE 52 HB ILE 52 4.483 -6.095 3.996 400 HG12 ILE 52 1HG1 ILE 52 7.040 -5.457 4.120 401 HG13 ILE 52 2HG1 ILE 52 6.684 -5.198 5.822 402 HG21 ILE 52 1HG2 ILE 52 5.402 -3.235 4.252 403 HG22 ILE 52 2HG2 ILE 52 3.971 -3.805 3.390 404 HG23 ILE 52 3HG2 ILE 52 5.579 -4.244 2.817 405 HD11 ILE 52 3HD1 ILE 52 7.561 -7.399 5.530 406 HD12 ILE 52 1HD1 ILE 52 6.381 -7.763 4.275 407 HD13 ILE 52 2HD1 ILE 52 5.856 -7.535 5.945 408 H TYR 53 H TYR 53 4.850 -3.284 7.490 409 HA TYR 53 HA TYR 53 3.321 -1.159 6.162 410 HD1 TYR 53 HD1 TYR 53 2.806 -3.804 9.400 411 HD2 TYR 53 HD2 TYR 53 4.100 0.197 10.069 412 HE1 TYR 53 HE1 TYR 53 3.734 -4.473 11.575 413 HE2 TYR 53 HE2 TYR 53 5.030 -0.464 12.245 414 HH TYR 53 HH TYR 53 4.320 -3.423 13.730 415 HB2 TYR 53 1HB TYR 53 2.497 -0.318 8.310 416 HB3 TYR 53 2HB TYR 53 1.951 -1.971 8.040 417 H PHE 54 H PHE 54 4.450 0.647 5.879 418 HA PHE 54 HA PHE 54 6.704 1.212 7.664 419 HD1 PHE 54 HD1 PHE 54 6.658 3.631 4.639 420 HD2 PHE 54 HD2 PHE 54 6.952 -0.446 3.455 421 HE1 PHE 54 HE1 PHE 54 5.940 4.240 2.372 422 HE2 PHE 54 HE2 PHE 54 6.228 0.157 1.188 423 HZ PHE 54 HZ PHE 54 5.721 2.503 0.642 424 HB2 PHE 54 1HB PHE 54 8.180 1.737 5.838 425 HB3 PHE 54 2HB PHE 54 7.557 0.115 5.590 426 H THR 55 H THR 55 7.176 3.392 7.975 427 HA THR 55 HA THR 55 5.003 5.208 7.212 428 HB THR 55 HB THR 55 7.246 6.173 8.901 429 HG1 THR 55 HG1 THR 55 5.483 4.114 9.704 430 HG21 THR 55 3HG2 THR 55 5.621 7.714 9.073 431 HG22 THR 55 1HG2 THR 55 5.021 6.624 10.321 432 HG23 THR 55 2HG2 THR 55 4.337 6.566 8.696 433 H THR 56 H THR 56 5.371 7.190 6.133 434 HA THR 56 HA THR 56 7.979 7.363 4.769 435 HB THR 56 HB THR 56 6.032 8.659 3.188 436 HG1 THR 56 HG1 THR 56 4.542 7.028 2.850 437 HG21 THR 56 3HG2 THR 56 7.326 7.695 1.683 438 HG22 THR 56 1HG2 THR 56 6.542 6.159 2.049 439 HG23 THR 56 2HG2 THR 56 8.017 6.620 2.902 440 H GLN 57 H GLN 57 6.371 8.792 7.115 441 HA GLN 57 HA GLN 57 6.705 10.808 8.153 442 HB2 GLN 57 1HB GLN 57 8.010 11.923 5.667 443 HB3 GLN 57 2HB GLN 57 8.197 12.458 7.330 444 HG2 GLN 57 1HG GLN 57 9.487 10.525 7.884 445 HG3 GLN 57 2HG GLN 57 9.152 9.787 6.320 446 HE21 GLN 57 1HE2 GLN 57 11.713 10.339 7.501 447 HE22 GLN 57 2HE2 GLN 57 12.534 11.418 6.431 448 H VAL 58 H VAL 58 4.921 10.266 5.386 449 HA VAL 58 HA VAL 58 3.802 12.947 5.249 450 HB VAL 58 HB VAL 58 4.095 11.700 3.150 451 HG11 VAL 58 1HG1 VAL 58 1.940 9.837 4.132 452 HG12 VAL 58 2HG1 VAL 58 3.659 9.442 4.122 453 HG13 VAL 58 3HG1 VAL 58 2.818 9.758 2.602 454 HG21 VAL 58 3HG2 VAL 58 1.308 12.422 3.997 455 HG22 VAL 58 1HG2 VAL 58 1.680 11.920 2.349 456 HG23 VAL 58 2HG2 VAL 58 2.446 13.357 3.027 457 H ALA 59 H ALA 59 2.310 13.549 6.680 458 HA ALA 59 HA ALA 59 0.609 11.470 7.876 459 HB1 ALA 59 3HB ALA 59 0.927 14.262 8.942 460 HB2 ALA 59 1HB ALA 59 2.030 12.950 9.364 461 HB3 ALA 59 2HB ALA 59 0.318 12.829 9.770 462 H VAL 60 H VAL 60 -1.024 11.265 6.432 463 HA VAL 60 HA VAL 60 -2.797 13.607 6.158 464 HB VAL 60 HB VAL 60 -1.679 13.244 4.010 465 HG11 VAL 60 1HG1 VAL 60 -1.509 11.244 2.903 466 HG12 VAL 60 2HG1 VAL 60 -2.947 10.568 3.660 467 HG13 VAL 60 3HG1 VAL 60 -1.440 10.684 4.571 468 HG21 VAL 60 3HG2 VAL 60 -4.591 12.498 4.127 469 HG22 VAL 60 1HG2 VAL 60 -3.737 12.749 2.605 470 HG23 VAL 60 2HG2 VAL 60 -3.873 14.069 3.765 471 H GLU 61 H GLU 61 -4.476 13.088 7.489 472 HA GLU 61 HA GLU 61 -5.687 10.426 7.113 473 HB2 GLU 61 1HB GLU 61 -4.622 11.624 9.532 474 HB3 GLU 61 2HB GLU 61 -6.314 11.192 9.722 475 HG2 GLU 61 1HG GLU 61 -5.819 8.908 9.031 476 HG3 GLU 61 2HG GLU 61 -4.124 9.339 8.815 477 H LYS 62 H LYS 62 -7.826 10.367 6.806 478 HA LYS 62 HA LYS 62 -9.454 12.681 7.522 479 HB2 LYS 62 1HB LYS 62 -8.577 12.696 5.047 480 HB3 LYS 62 2HB LYS 62 -9.810 11.470 4.798 481 HG2 LYS 62 1HG LYS 62 -10.989 13.331 4.241 482 HG3 LYS 62 2HG LYS 62 -11.350 13.263 5.966 483 HD2 LYS 62 1HD LYS 62 -8.980 14.802 4.977 484 HD3 LYS 62 2HD LYS 62 -10.595 15.510 4.903 485 HE2 LYS 62 1HE LYS 62 -10.411 14.448 7.467 486 HE3 LYS 62 2HE LYS 62 -8.828 15.164 7.170 487 HZ1 LYS 62 3HZ LYS 62 -11.381 16.605 6.717 488 HZ2 LYS 62 1HZ LYS 62 -9.818 17.255 6.724 489 HZ3 LYS 62 2HZ LYS 62 -10.506 16.693 8.162 490 H GLU 63 H GLU 63 -11.815 12.162 7.472 491 HA GLU 63 HA GLU 63 -12.212 9.368 8.202 492 HB2 GLU 63 1HB GLU 63 -14.099 10.012 9.417 493 HB3 GLU 63 2HB GLU 63 -12.979 11.342 9.647 494 HG2 GLU 63 1HG GLU 63 -14.714 12.640 9.142 495 HG3 GLU 63 2HG GLU 63 -14.409 12.179 7.470 496 H GLU 64 H GLU 64 -12.231 8.359 6.208 497 HA GLU 64 HA GLU 64 -14.753 8.219 4.926 498 HB2 GLU 64 1HB GLU 64 -14.427 10.060 3.623 499 HB3 GLU 64 2HB GLU 64 -12.679 9.981 3.760 500 HG2 GLU 64 1HG GLU 64 -12.502 8.427 2.015 501 HG3 GLU 64 2HG GLU 64 -14.220 8.045 2.066 502 H ASN 65 H ASN 65 -14.780 6.615 3.173 503 HA ASN 65 HA ASN 65 -14.232 4.610 2.261 504 HB2 ASN 65 1HB ASN 65 -12.295 5.842 1.347 505 HB3 ASN 65 2HB ASN 65 -11.380 5.483 2.812 506 HD21 ASN 65 1HD2 ASN 65 -11.151 4.756 -0.133 507 HD22 ASN 65 2HD2 ASN 65 -10.892 3.047 -0.116 508 H SER 66 H SER 66 -11.466 4.711 4.429 509 HA SER 66 HA SER 66 -10.721 2.974 5.806 510 HG SER 66 HG SER 66 -11.608 2.205 8.108 511 HB2 SER 66 1HB SER 66 -11.343 4.532 7.415 512 HB3 SER 66 2HB SER 66 -13.061 4.377 7.051 513 H LYS 67 H LYS 67 -11.151 1.057 4.480 514 HA LYS 67 HA LYS 67 -13.621 -0.364 5.219 515 HB2 LYS 67 1HB LYS 67 -12.989 -1.973 3.382 516 HB3 LYS 67 2HB LYS 67 -13.413 -0.358 2.851 517 HG2 LYS 67 1HG LYS 67 -11.580 -0.878 1.558 518 HG3 LYS 67 2HG LYS 67 -10.860 0.065 2.858 519 HD2 LYS 67 1HD LYS 67 -10.307 -2.073 4.010 520 HD3 LYS 67 2HD LYS 67 -10.923 -2.937 2.606 521 HE2 LYS 67 1HE LYS 67 -9.230 -2.013 1.208 522 HE3 LYS 67 2HE LYS 67 -8.714 -0.902 2.473 523 HZ1 LYS 67 3HZ LYS 67 -7.437 -2.457 3.399 524 HZ2 LYS 67 1HZ LYS 67 -7.614 -3.325 1.959 525 HZ3 LYS 67 2HZ LYS 67 -8.619 -3.658 3.277 526 H ASP 68 H ASP 68 -13.504 -2.647 5.801 527 HA ASP 68 HA ASP 68 -10.971 -3.259 7.201 528 HB2 ASP 68 1HB ASP 68 -12.458 -4.602 8.767 529 HB3 ASP 68 2HB ASP 68 -12.599 -2.849 8.863 530 H VAL 69 H VAL 69 -12.913 -4.289 4.668 531 HA VAL 69 HA VAL 69 -11.689 -6.965 4.815 532 HB VAL 69 HB VAL 69 -14.494 -6.492 3.779 533 HG11 VAL 69 1HG1 VAL 69 -13.249 -8.345 2.734 534 HG12 VAL 69 2HG1 VAL 69 -14.633 -8.902 3.675 535 HG13 VAL 69 3HG1 VAL 69 -13.003 -9.055 4.331 536 HG21 VAL 69 3HG2 VAL 69 -13.518 -6.920 6.481 537 HG22 VAL 69 1HG2 VAL 69 -14.641 -8.180 5.973 538 HG23 VAL 69 2HG2 VAL 69 -15.133 -6.487 5.919 539 H VAL 70 H VAL 70 -11.022 -7.864 2.885 540 HA VAL 70 HA VAL 70 -11.586 -6.570 0.366 541 HB VAL 70 HB VAL 70 -9.252 -6.058 -0.198 542 HG11 VAL 70 1HG1 VAL 70 -9.124 -3.984 0.915 543 HG12 VAL 70 2HG1 VAL 70 -10.000 -4.604 2.314 544 HG13 VAL 70 3HG1 VAL 70 -10.840 -4.371 0.782 545 HG21 VAL 70 3HG2 VAL 70 -8.236 -7.652 1.492 546 HG22 VAL 70 1HG2 VAL 70 -8.562 -6.414 2.709 547 HG23 VAL 70 2HG2 VAL 70 -7.478 -6.062 1.370 548 H GLU 71 H GLU 71 -10.670 -7.695 -1.483 549 HA GLU 71 HA GLU 71 -10.340 -10.542 -0.903 550 HB2 GLU 71 1HB GLU 71 -10.574 -9.444 -3.691 551 HB3 GLU 71 2HB GLU 71 -11.059 -11.013 -3.070 552 HG2 GLU 71 1HG GLU 71 -12.981 -10.188 -2.091 553 HG3 GLU 71 2HG GLU 71 -12.408 -8.523 -2.133 554 H LEU 72 H LEU 72 -8.734 -11.805 -1.817 555 HA LEU 72 HA LEU 72 -6.142 -11.008 -1.559 556 HG LEU 72 HG LEU 72 -4.624 -12.370 -3.520 557 HB2 LEU 72 1HB LEU 72 -6.787 -13.342 -1.755 558 HB3 LEU 72 2HB LEU 72 -7.251 -13.109 -3.428 559 HD11 LEU 72 1HD1 LEU 72 -3.301 -13.504 -2.070 560 HD12 LEU 72 2HD1 LEU 72 -4.450 -14.830 -1.883 561 HD13 LEU 72 3HD1 LEU 72 -4.708 -13.312 -1.023 562 HD21 LEU 72 3HD2 LEU 72 -5.827 -15.115 -3.857 563 HD22 LEU 72 1HD2 LEU 72 -4.244 -14.623 -4.461 564 HD23 LEU 72 2HD2 LEU 72 -5.704 -13.853 -5.084 565 H GLY 73 H GLY 73 -4.768 -9.711 -2.649 566 HA2 GLY 73 1HA GLY 73 -3.702 -9.245 -4.814 567 HA3 GLY 73 2HA GLY 73 -5.303 -9.263 -5.523 568 H ASP 74 H ASP 74 -6.469 -7.609 -3.357 569 HA ASP 74 HA ASP 74 -5.818 -5.082 -4.526 570 HB2 ASP 74 1HB ASP 74 -7.453 -4.229 -2.708 571 HB3 ASP 74 2HB ASP 74 -8.073 -5.239 -4.009 572 H VAL 75 H VAL 75 -5.207 -3.164 -3.395 573 HA VAL 75 HA VAL 75 -3.342 -3.692 -1.156 574 HB VAL 75 HB VAL 75 -3.161 -1.394 -3.137 575 HG11 VAL 75 1HG1 VAL 75 -0.983 -2.496 -1.373 576 HG12 VAL 75 2HG1 VAL 75 -2.047 -1.175 -0.882 577 HG13 VAL 75 3HG1 VAL 75 -1.003 -0.989 -2.289 578 HG21 VAL 75 3HG2 VAL 75 -2.176 -2.697 -4.640 579 HG22 VAL 75 1HG2 VAL 75 -2.689 -4.089 -3.688 580 HG23 VAL 75 2HG2 VAL 75 -1.094 -3.382 -3.429 581 H ALA 76 H ALA 76 -3.225 -2.000 0.572 582 HA ALA 76 HA ALA 76 -5.299 0.036 0.468 583 HB1 ALA 76 3HB ALA 76 -6.581 -1.735 1.351 584 HB2 ALA 76 1HB ALA 76 -6.175 -0.697 2.716 585 HB3 ALA 76 2HB ALA 76 -5.298 -2.200 2.468 586 H TYR 77 H TYR 77 -5.083 1.738 1.951 587 HA TYR 77 HA TYR 77 -2.427 1.908 3.198 588 HD1 TYR 77 HD1 TYR 77 -5.824 4.590 3.265 589 HD2 TYR 77 HD2 TYR 77 -1.689 5.424 3.812 590 HE1 TYR 77 HE1 TYR 77 -6.396 6.459 4.759 591 HE2 TYR 77 HE2 TYR 77 -2.255 7.289 5.301 592 HH TYR 77 HH TYR 77 -4.266 7.894 6.812 593 HB2 TYR 77 1HB TYR 77 -2.350 3.893 2.151 594 HB3 TYR 77 2HB TYR 77 -4.029 3.756 1.658 595 H TRP 78 H TRP 78 -2.237 1.981 5.356 596 HA TRP 78 HA TRP 78 -4.521 1.563 6.997 597 HD1 TRP 78 HD1 TRP 78 -4.864 2.202 9.515 598 HE1 TRP 78 HE1 TRP 78 -5.181 0.600 11.503 599 HE3 TRP 78 HE3 TRP 78 -0.829 -0.836 8.750 600 HZ2 TRP 78 HZ2 TRP 78 -3.888 -1.658 12.602 601 HZ3 TRP 78 HZ3 TRP 78 -0.438 -2.695 10.316 602 HH2 TRP 78 HH2 TRP 78 -1.936 -3.096 12.202 603 HB2 TRP 78 1HB TRP 78 -1.990 0.886 7.341 604 HB3 TRP 78 2HB TRP 78 -1.920 2.431 8.183 605 H ILE 79 H ILE 79 -5.930 3.062 7.676 606 HA ILE 79 HA ILE 79 -5.478 5.833 7.359 607 HB ILE 79 HB ILE 79 -7.641 4.269 8.745 608 HG12 ILE 79 1HG1 ILE 79 -7.178 5.302 6.102 609 HG13 ILE 79 2HG1 ILE 79 -8.482 4.271 6.675 610 HG21 ILE 79 1HG2 ILE 79 -8.857 6.391 9.091 611 HG22 ILE 79 2HG2 ILE 79 -7.399 7.271 8.632 612 HG23 ILE 79 3HG2 ILE 79 -7.401 6.265 10.081 613 HD11 ILE 79 3HD1 ILE 79 -8.407 7.270 6.562 614 HD12 ILE 79 1HD1 ILE 79 -9.628 6.375 7.468 615 HD13 ILE 79 2HD1 ILE 79 -9.499 6.167 5.723 616 HA PRO 80 HA PRO 80 -5.061 6.305 12.136 617 HB2 PRO 80 1HB PRO 80 -4.981 4.014 13.633 618 HB3 PRO 80 2HB PRO 80 -6.458 4.936 13.329 619 HG2 PRO 80 1HG PRO 80 -5.438 2.484 11.943 620 HG3 PRO 80 2HG PRO 80 -7.085 2.857 12.486 621 HD2 PRO 80 1HD PRO 80 -6.377 3.127 9.917 622 HD3 PRO 80 2HD PRO 80 -7.491 4.271 10.692 623 H GLY 81 H GLY 81 -2.995 6.665 10.977 624 HA2 GLY 81 1HA GLY 81 -0.741 6.230 12.203 625 HA3 GLY 81 2HA GLY 81 -0.937 4.627 11.504 626 H LYS 82 H LYS 82 -2.309 6.375 9.190 627 HA LYS 82 HA LYS 82 -1.629 7.013 7.086 628 HB2 LYS 82 1HB LYS 82 0.846 8.274 8.145 629 HB3 LYS 82 2HB LYS 82 -0.339 8.903 7.015 630 HG2 LYS 82 1HG LYS 82 -1.068 10.187 8.668 631 HG3 LYS 82 2HG LYS 82 -1.727 8.733 9.413 632 HD2 LYS 82 1HD LYS 82 0.501 8.407 10.521 633 HD3 LYS 82 2HD LYS 82 0.960 10.000 9.915 634 HE2 LYS 82 1HE LYS 82 -1.360 10.646 11.063 635 HE3 LYS 82 2HE LYS 82 -0.944 9.252 12.060 636 HZ1 LYS 82 3HZ LYS 82 0.193 10.776 13.225 637 HZ2 LYS 82 1HZ LYS 82 0.286 11.872 11.939 638 HZ3 LYS 82 2HZ LYS 82 1.372 10.578 12.028 639 H ALA 83 H ALA 83 -0.661 4.460 8.084 640 HA ALA 83 HA ALA 83 1.915 4.248 6.680 641 HB1 ALA 83 3HB ALA 83 1.448 1.844 8.018 642 HB2 ALA 83 1HB ALA 83 0.901 3.103 9.124 643 HB3 ALA 83 2HB ALA 83 2.549 3.136 8.500 644 H ILE 84 H ILE 84 2.103 3.033 4.879 645 HA ILE 84 HA ILE 84 -0.321 1.850 3.774 646 HB ILE 84 HB ILE 84 2.371 1.919 2.438 647 HG12 ILE 84 1HG1 ILE 84 0.247 4.069 2.377 648 HG13 ILE 84 2HG1 ILE 84 1.821 4.210 3.149 649 HG21 ILE 84 1HG2 ILE 84 -0.376 1.253 1.658 650 HG22 ILE 84 2HG2 ILE 84 1.162 0.692 1.002 651 HG23 ILE 84 3HG2 ILE 84 0.507 2.252 0.504 652 HD11 ILE 84 3HD1 ILE 84 2.016 3.445 0.357 653 HD12 ILE 84 1HD1 ILE 84 2.810 4.754 1.233 654 HD13 ILE 84 2HD1 ILE 84 1.182 4.982 0.591 655 H CYS 85 H CYS 85 -0.517 -0.334 3.184 656 HA CYS 85 HA CYS 85 1.651 -2.113 4.001 657 HG CYS 85 HG CYS 85 0.619 -4.541 5.864 658 HB2 CYS 85 1HB CYS 85 0.278 -2.093 5.941 659 HB3 CYS 85 2HB CYS 85 -1.193 -2.241 4.983 660 H LEU 86 H LEU 86 1.544 -4.254 3.183 661 HA LEU 86 HA LEU 86 0.061 -4.455 0.640 662 HG LEU 86 HG LEU 86 1.469 -4.223 -0.989 663 HB2 LEU 86 1HB LEU 86 2.802 -4.882 1.318 664 HB3 LEU 86 2HB LEU 86 2.124 -6.427 0.841 665 HD11 LEU 86 1HD1 LEU 86 3.853 -3.766 -0.133 666 HD12 LEU 86 2HD1 LEU 86 3.587 -3.839 -1.876 667 HD13 LEU 86 3HD1 LEU 86 4.295 -5.218 -1.032 668 HD21 LEU 86 3HD2 LEU 86 2.323 -5.971 -2.612 669 HD22 LEU 86 1HD2 LEU 86 0.914 -6.422 -1.650 670 HD23 LEU 86 2HD2 LEU 86 2.511 -7.038 -1.218 671 H PHE 87 H PHE 87 -0.772 -6.592 0.050 672 HA PHE 87 HA PHE 87 -1.071 -8.453 2.297 673 HD1 PHE 87 HD2 PHE 87 -2.722 -7.213 4.153 674 HD2 PHE 87 HD1 PHE 87 -3.817 -5.526 0.406 675 HE1 PHE 87 HE2 PHE 87 -3.172 -5.063 5.260 676 HE2 PHE 87 HE1 PHE 87 -4.270 -3.380 1.504 677 HZ PHE 87 HZ PHE 87 -3.948 -3.139 3.932 678 HB2 PHE 87 1HB PHE 87 -3.433 -7.800 0.557 679 HB3 PHE 87 2HB PHE 87 -3.407 -8.605 2.122 680 H PHE 88 H PHE 88 -0.692 -10.485 1.735 681 HA PHE 88 HA PHE 88 -1.500 -11.621 -0.737 682 HD1 PHE 88 HD1 PHE 88 -0.533 -9.538 -2.737 683 HD2 PHE 88 HD2 PHE 88 1.127 -13.444 -2.483 684 HE1 PHE 88 HE1 PHE 88 -0.979 -9.876 -5.136 685 HE2 PHE 88 HE2 PHE 88 0.688 -13.793 -4.880 686 HZ PHE 88 HZ PHE 88 -0.366 -12.008 -6.210 687 HB2 PHE 88 1HB PHE 88 0.913 -10.232 -0.859 688 HB3 PHE 88 2HB PHE 88 1.391 -11.917 -0.699 689 H GLY 89 H GLY 89 -2.095 -12.427 1.762 690 HA2 GLY 89 1HA GLY 89 -1.539 -15.107 1.836 691 HA3 GLY 89 2HA GLY 89 -0.231 -14.384 2.758 692 H LYS 90 H LYS 90 -0.792 -13.147 4.673 693 HA LYS 90 HA LYS 90 -3.478 -13.379 5.688 694 HB2 LYS 90 1HB LYS 90 -2.670 -14.481 7.838 695 HB3 LYS 90 2HB LYS 90 -2.888 -15.515 6.444 696 HG2 LYS 90 1HG LYS 90 -0.288 -14.542 7.633 697 HG3 LYS 90 2HG LYS 90 -0.913 -16.187 7.578 698 HD2 LYS 90 1HD LYS 90 -0.881 -15.770 4.981 699 HD3 LYS 90 2HD LYS 90 0.337 -14.569 5.417 700 HE2 LYS 90 1HE LYS 90 1.441 -16.439 6.753 701 HE3 LYS 90 2HE LYS 90 0.376 -17.533 5.873 702 HZ1 LYS 90 3HZ LYS 90 1.491 -17.217 3.943 703 HZ2 LYS 90 1HZ LYS 90 2.772 -16.900 5.001 704 HZ3 LYS 90 2HZ LYS 90 1.918 -15.621 4.299 705 H THR 91 H THR 91 -3.468 -12.646 8.129 706 HA THR 91 HA THR 91 -1.467 -10.584 8.631 707 HB THR 91 HB THR 91 -4.063 -9.499 9.230 708 HG1 THR 91 HG1 THR 91 -3.692 -10.321 6.544 709 HG21 THR 91 3HG2 THR 91 -2.880 -8.204 6.995 710 HG22 THR 91 1HG2 THR 91 -1.615 -8.621 8.151 711 HG23 THR 91 2HG2 THR 91 -2.997 -7.652 8.666 712 HA PRO 92 HA PRO 92 -1.960 -11.165 13.018 713 HB2 PRO 92 1HB PRO 92 -4.109 -9.088 13.214 714 HB3 PRO 92 2HB PRO 92 -2.702 -9.349 14.253 715 HG2 PRO 92 1HG PRO 92 -2.672 -7.411 12.445 716 HG3 PRO 92 2HG PRO 92 -1.228 -8.407 12.717 717 HD2 PRO 92 1HD PRO 92 -3.168 -8.452 10.461 718 HD3 PRO 92 2HD PRO 92 -1.427 -8.795 10.458 719 H ILE 93 H ILE 93 -4.883 -11.030 11.097 720 HA ILE 93 HA ILE 93 -6.029 -13.133 12.806 721 HB ILE 93 HB ILE 93 -7.704 -11.023 11.457 722 HG12 ILE 93 1HG1 ILE 93 -7.975 -10.494 14.102 723 HG13 ILE 93 2HG1 ILE 93 -6.287 -10.993 14.056 724 HG21 ILE 93 1HG2 ILE 93 -8.795 -13.168 11.915 725 HG22 ILE 93 2HG2 ILE 93 -9.471 -11.869 12.894 726 HG23 ILE 93 3HG2 ILE 93 -8.352 -13.025 13.616 727 HD11 ILE 93 3HD1 ILE 93 -7.588 -8.712 12.604 728 HD12 ILE 93 1HD1 ILE 93 -5.980 -9.313 12.196 729 HD13 ILE 93 2HD1 ILE 93 -6.295 -8.657 13.803 730 H SER 94 H SER 94 -5.020 -14.532 11.157 731 HA SER 94 HA SER 94 -6.243 -14.516 8.516 732 HG SER 94 HG SER 94 -3.262 -15.852 10.395 733 HB2 SER 94 1HB SER 94 -4.564 -16.810 9.027 734 HB3 SER 94 2HB SER 94 -4.338 -15.500 7.871 735 H ASP 95 H ASP 95 -7.855 -15.139 10.921 736 HA ASP 95 HA ASP 95 -8.315 -17.929 11.065 737 HB2 ASP 95 1HB ASP 95 -9.879 -15.519 11.957 738 HB3 ASP 95 2HB ASP 95 -10.517 -17.150 12.147 739 H ASP 96 H ASP 96 -8.402 -18.347 8.720 740 HA ASP 96 HA ASP 96 -9.655 -19.195 7.009 741 HB2 ASP 96 1HB ASP 96 -11.550 -18.947 9.009 742 HB3 ASP 96 2HB ASP 96 -12.254 -18.044 7.671 743 H LYS 97 H LYS 97 -9.382 -15.938 7.792 744 HA LYS 97 HA LYS 97 -9.812 -15.207 5.007 745 HB2 LYS 97 1HB LYS 97 -11.046 -13.607 7.257 746 HB3 LYS 97 2HB LYS 97 -11.169 -13.272 5.537 747 HG2 LYS 97 1HG LYS 97 -13.180 -14.262 5.842 748 HG3 LYS 97 2HG LYS 97 -12.224 -15.710 5.524 749 HD2 LYS 97 1HD LYS 97 -11.975 -16.090 7.914 750 HD3 LYS 97 2HD LYS 97 -12.877 -14.613 8.257 751 HE2 LYS 97 1HE LYS 97 -14.250 -16.502 6.483 752 HE3 LYS 97 2HE LYS 97 -13.963 -17.106 8.113 753 HZ1 LYS 97 3HZ LYS 97 -15.184 -15.356 9.044 754 HZ2 LYS 97 1HZ LYS 97 -16.111 -15.867 7.724 755 HZ3 LYS 97 2HZ LYS 97 -15.183 -14.458 7.610 756 H ILE 98 H ILE 98 -9.393 -12.520 5.140 757 HA ILE 98 HA ILE 98 -6.786 -12.295 6.499 758 HB ILE 98 HB ILE 98 -7.562 -11.359 3.740 759 HG12 ILE 98 1HG1 ILE 98 -5.121 -12.926 4.562 760 HG13 ILE 98 2HG1 ILE 98 -6.654 -13.721 4.205 761 HG21 ILE 98 1HG2 ILE 98 -6.300 -9.550 4.092 762 HG22 ILE 98 2HG2 ILE 98 -4.923 -10.650 4.058 763 HG23 ILE 98 3HG2 ILE 98 -5.647 -10.191 5.598 764 HD11 ILE 98 3HD1 ILE 98 -5.862 -11.838 2.141 765 HD12 ILE 98 1HD1 ILE 98 -6.345 -13.531 2.016 766 HD13 ILE 98 2HD1 ILE 98 -4.675 -13.118 2.404 767 H ARG 99 H ARG 99 -7.166 -10.980 8.175 768 HA ARG 99 HA ARG 99 -8.824 -8.595 7.761 769 HE ARG 99 HE ARG 99 -12.137 -7.877 9.297 770 HB2 ARG 99 1HB ARG 99 -8.704 -10.388 9.863 771 HB3 ARG 99 2HB ARG 99 -7.760 -9.028 10.456 772 HG2 ARG 99 1HG ARG 99 -9.731 -8.213 11.112 773 HG3 ARG 99 2HG ARG 99 -9.937 -7.768 9.416 774 HD2 ARG 99 1HD ARG 99 -10.841 -10.245 9.247 775 HD3 ARG 99 2HD ARG 99 -11.153 -10.001 10.966 776 HH11 ARG 99 1HH1 ARG 99 -12.853 -11.004 10.666 777 HH12 ARG 99 2HH1 ARG 99 -14.569 -10.795 10.567 778 HH21 ARG 99 1HH2 ARG 99 -14.393 -7.598 9.166 779 HH22 ARG 99 2HH2 ARG 99 -15.443 -8.860 9.715 780 HA PRO 100 HA PRO 100 -4.697 -6.719 7.299 781 HB2 PRO 100 1HB PRO 100 -5.579 -4.440 6.118 782 HB3 PRO 100 2HB PRO 100 -5.363 -5.958 5.237 783 HG2 PRO 100 1HG PRO 100 -7.875 -4.786 6.381 784 HG3 PRO 100 2HG PRO 100 -7.605 -5.506 4.779 785 HD2 PRO 100 1HD PRO 100 -8.762 -6.883 6.780 786 HD3 PRO 100 2HD PRO 100 -7.692 -7.667 5.600 787 H ALA 101 H ALA 101 -7.621 -5.285 8.658 788 HA ALA 101 HA ALA 101 -6.387 -4.396 11.014 789 HB1 ALA 101 3HB ALA 101 -6.923 -1.841 9.864 790 HB2 ALA 101 1HB ALA 101 -5.801 -2.711 8.817 791 HB3 ALA 101 2HB ALA 101 -5.411 -2.468 10.520 792 H SER 102 H SER 102 -7.854 -2.087 11.576 793 HA SER 102 HA SER 102 -10.587 -3.155 11.502 794 HG SER 102 HG SER 102 -8.253 -1.162 13.497 795 HB2 SER 102 1HB SER 102 -10.478 -1.117 13.426 796 HB3 SER 102 2HB SER 102 -10.511 -2.856 13.721 797 H ALA 103 H ALA 103 -8.748 -0.824 10.003 798 HA ALA 103 HA ALA 103 -10.981 0.434 8.829 799 HB1 ALA 103 3HB ALA 103 -10.649 2.722 9.777 800 HB2 ALA 103 1HB ALA 103 -9.616 1.996 11.009 801 HB3 ALA 103 2HB ALA 103 -11.318 1.543 10.908 802 H VAL 104 H VAL 104 -9.496 -0.294 7.108 803 HA VAL 104 HA VAL 104 -7.547 1.832 6.503 804 HB VAL 104 HB VAL 104 -6.039 0.266 5.437 805 HG11 VAL 104 1HG1 VAL 104 -6.665 -0.929 8.113 806 HG12 VAL 104 2HG1 VAL 104 -6.026 0.706 7.960 807 HG13 VAL 104 3HG1 VAL 104 -5.094 -0.664 7.358 808 HG21 VAL 104 3HG2 VAL 104 -6.399 -1.979 5.131 809 HG22 VAL 104 1HG2 VAL 104 -8.040 -1.364 4.937 810 HG23 VAL 104 2HG2 VAL 104 -7.545 -2.091 6.465 811 H ASN 105 H ASN 105 -7.447 2.590 4.433 812 HA ASN 105 HA ASN 105 -9.763 2.066 2.773 813 HB2 ASN 105 1HB ASN 105 -7.521 3.935 2.050 814 HB3 ASN 105 2HB ASN 105 -9.229 4.057 1.643 815 HD21 ASN 105 1HD2 ASN 105 -7.680 6.107 2.721 816 HD22 ASN 105 2HD2 ASN 105 -8.314 6.505 4.276 817 H VAL 106 H VAL 106 -9.691 1.593 0.528 818 HA VAL 106 HA VAL 106 -7.550 -0.223 -0.229 819 HB VAL 106 HB VAL 106 -9.201 0.030 -2.447 820 HG11 VAL 106 1HG1 VAL 106 -9.358 -2.183 -2.217 821 HG12 VAL 106 2HG1 VAL 106 -10.003 -2.069 -0.580 822 HG13 VAL 106 3HG1 VAL 106 -8.263 -1.959 -0.854 823 HG21 VAL 106 3HG2 VAL 106 -11.488 -0.297 -1.568 824 HG22 VAL 106 1HG2 VAL 106 -10.852 1.322 -1.272 825 HG23 VAL 106 2HG2 VAL 106 -10.899 0.136 0.035 826 H ILE 107 H ILE 107 -5.776 0.952 -0.749 827 HA ILE 107 HA ILE 107 -5.978 3.377 -2.290 828 HB ILE 107 HB ILE 107 -4.373 2.981 -0.375 829 HG12 ILE 107 1HG1 ILE 107 -3.787 4.191 -3.018 830 HG13 ILE 107 2HG1 ILE 107 -3.874 4.945 -1.431 831 HG21 ILE 107 1HG2 ILE 107 -3.595 0.767 -1.051 832 HG22 ILE 107 2HG2 ILE 107 -2.248 1.894 -0.901 833 HG23 ILE 107 3HG2 ILE 107 -2.859 1.460 -2.497 834 HD11 ILE 107 3HD1 ILE 107 -1.673 4.067 -0.896 835 HD12 ILE 107 1HD1 ILE 107 -1.637 5.054 -2.357 836 HD13 ILE 107 2HD1 ILE 107 -1.596 3.293 -2.480 837 H GLY 108 H GLY 108 -6.634 0.679 -3.505 838 HA2 GLY 108 1HA GLY 108 -6.505 0.550 -5.959 839 HA3 GLY 108 2HA GLY 108 -4.798 0.923 -5.807 840 H ARG 109 H ARG 109 -4.102 -0.908 -6.893 841 HA ARG 109 HA ARG 109 -3.996 -3.299 -5.281 842 HE ARG 109 HE ARG 109 -8.804 -4.314 -5.605 843 HB2 ARG 109 1HB ARG 109 -5.098 -3.575 -8.073 844 HB3 ARG 109 2HB ARG 109 -4.997 -4.807 -6.825 845 HG2 ARG 109 1HG ARG 109 -6.697 -3.634 -5.521 846 HG3 ARG 109 2HG ARG 109 -6.792 -2.387 -6.763 847 HD2 ARG 109 1HD ARG 109 -8.057 -3.653 -8.111 848 HD3 ARG 109 2HD ARG 109 -7.111 -5.106 -7.790 849 HH11 ARG 109 1HH1 ARG 109 -8.628 -6.128 -8.581 850 HH12 ARG 109 2HH1 ARG 109 -9.937 -7.181 -8.163 851 HH21 ARG 109 1HH2 ARG 109 -10.526 -5.697 -5.053 852 HH22 ARG 109 2HH2 ARG 109 -11.016 -6.936 -6.160 853 H ILE 110 H ILE 110 -2.676 -5.028 -6.385 854 HA ILE 110 HA ILE 110 -0.423 -3.748 -7.772 855 HB ILE 110 HB ILE 110 -0.560 -6.431 -6.387 856 HG12 ILE 110 1HG1 ILE 110 1.280 -4.494 -5.259 857 HG13 ILE 110 2HG1 ILE 110 -0.358 -3.856 -5.278 858 HG21 ILE 110 1HG2 ILE 110 1.882 -6.455 -6.630 859 HG22 ILE 110 2HG2 ILE 110 1.795 -4.965 -7.568 860 HG23 ILE 110 3HG2 ILE 110 1.062 -6.443 -8.192 861 HD11 ILE 110 3HD1 ILE 110 -1.147 -5.757 -4.010 862 HD12 ILE 110 1HD1 ILE 110 0.203 -4.986 -3.178 863 HD13 ILE 110 2HD1 ILE 110 0.459 -6.488 -4.065 864 H VAL 111 H VAL 111 -0.422 -3.962 -9.926 865 HA VAL 111 HA VAL 111 -1.762 -6.281 -11.115 866 HB VAL 111 HB VAL 111 -1.158 -4.808 -13.284 867 HG11 VAL 111 1HG1 VAL 111 -3.480 -4.995 -11.484 868 HG12 VAL 111 2HG1 VAL 111 -3.353 -5.305 -13.215 869 HG13 VAL 111 3HG1 VAL 111 -3.501 -3.650 -12.624 870 HG21 VAL 111 3HG2 VAL 111 -1.188 -2.509 -12.945 871 HG22 VAL 111 1HG2 VAL 111 -0.138 -3.081 -11.649 872 HG23 VAL 111 2HG2 VAL 111 -1.813 -2.658 -11.303 873 H ASN 112 H ASN 112 0.865 -4.428 -12.591 874 HA ASN 112 HA ASN 112 2.164 -6.874 -13.380 875 HB2 ASN 112 1HB ASN 112 3.922 -5.186 -14.281 876 HB3 ASN 112 2HB ASN 112 2.330 -5.232 -15.029 877 HD21 ASN 112 1HD2 ASN 112 3.928 -3.638 -12.286 878 HD22 ASN 112 2HD2 ASN 112 3.268 -2.073 -12.594 879 H SER 113 H SER 113 4.775 -6.598 -13.234 880 HA SER 113 HA SER 113 6.602 -6.846 -11.911 881 HG SER 113 HG SER 113 6.127 -4.150 -12.263 882 HB2 SER 113 1HB SER 113 5.087 -4.791 -10.309 883 HB3 SER 113 2HB SER 113 6.645 -5.418 -9.775 884 H MET 114 H MET 114 7.357 -7.750 -9.822 885 HA MET 114 HA MET 114 5.949 -10.046 -9.130 886 HB2 MET 114 1HB MET 114 8.453 -9.090 -8.629 887 HB3 MET 114 2HB MET 114 7.723 -8.979 -7.034 888 HG2 MET 114 1HG MET 114 8.333 -11.101 -6.795 889 HG3 MET 114 2HG MET 114 6.965 -11.476 -7.842 890 HE1 MET 114 3HE MET 114 10.605 -11.597 -7.208 891 HE2 MET 114 1HE MET 114 11.162 -12.627 -8.526 892 HE3 MET 114 2HE MET 114 9.921 -13.208 -7.418 893 H GLU 115 H GLU 115 4.026 -10.144 -8.184 894 HA GLU 115 HA GLU 115 3.274 -8.116 -6.217 895 HB2 GLU 115 1HB GLU 115 0.999 -9.015 -6.456 896 HB3 GLU 115 2HB GLU 115 1.678 -8.547 -8.008 897 HG2 GLU 115 1HG GLU 115 2.188 -10.882 -8.496 898 HG3 GLU 115 2HG GLU 115 1.520 -11.354 -6.935 899 H GLY 116 H GLY 116 5.227 -9.876 -5.337 900 HA2 GLY 116 1HA GLY 116 3.732 -11.343 -3.265 901 HA3 GLY 116 2HA GLY 116 5.056 -12.123 -4.117 902 H LEU 117 H LEU 117 4.771 -8.812 -2.864 903 HA LEU 117 HA LEU 117 7.351 -8.544 -1.959 904 HG LEU 117 HG LEU 117 7.185 -7.245 0.507 905 HB2 LEU 117 1HB LEU 117 5.912 -6.637 -2.053 906 HB3 LEU 117 2HB LEU 117 4.804 -7.341 -0.891 907 HD11 LEU 117 1HD1 LEU 117 8.083 -5.039 0.270 908 HD12 LEU 117 2HD1 LEU 117 6.912 -4.647 -0.986 909 HD13 LEU 117 3HD1 LEU 117 8.161 -5.853 -1.290 910 HD21 LEU 117 3HD2 LEU 117 4.671 -6.529 0.965 911 HD22 LEU 117 1HD2 LEU 117 5.358 -4.923 0.712 912 HD23 LEU 117 2HD2 LEU 117 6.008 -5.974 1.971 913 H LYS 118 H LYS 118 4.684 -10.190 -0.437 914 HA LYS 118 HA LYS 118 5.331 -10.361 2.180 915 HB2 LYS 118 1HB LYS 118 4.528 -12.815 2.044 916 HB3 LYS 118 2HB LYS 118 3.417 -11.525 1.618 917 HG2 LYS 118 1HG LYS 118 3.015 -12.677 -0.233 918 HG3 LYS 118 2HG LYS 118 4.597 -12.156 -0.795 919 HD2 LYS 118 1HD LYS 118 4.220 -14.624 0.879 920 HD3 LYS 118 2HD LYS 118 4.083 -14.655 -0.878 921 HE2 LYS 118 1HE LYS 118 6.406 -13.506 -0.832 922 HE3 LYS 118 2HE LYS 118 6.483 -14.104 0.825 923 HZ1 LYS 118 3HZ LYS 118 6.103 -16.348 -0.029 924 HZ2 LYS 118 1HZ LYS 118 7.507 -15.664 -0.681 925 HZ3 LYS 118 2HZ LYS 118 6.098 -15.756 -1.613 926 H GLY 119 H GLY 119 7.286 -11.668 -0.387 927 HA2 GLY 119 1HA GLY 119 8.765 -13.410 1.406 928 HA3 GLY 119 2HA GLY 119 9.060 -13.187 -0.310 929 H VAL 120 H VAL 120 8.796 -10.454 1.853 930 HA VAL 120 HA VAL 120 11.447 -9.587 1.142 931 HB VAL 120 HB VAL 120 10.922 -7.688 2.776 932 HG11 VAL 120 1HG1 VAL 120 10.703 -6.975 0.639 933 HG12 VAL 120 2HG1 VAL 120 9.011 -6.878 1.120 934 HG13 VAL 120 3HG1 VAL 120 9.589 -8.265 0.198 935 HG21 VAL 120 3HG2 VAL 120 9.126 -7.810 4.065 936 HG22 VAL 120 1HG2 VAL 120 8.747 -9.394 3.390 937 HG23 VAL 120 2HG2 VAL 120 8.092 -7.938 2.643 938 H ALA 121 H ALA 121 13.147 -9.082 2.671 939 HA ALA 121 HA ALA 121 13.377 -11.074 4.755 940 HB1 ALA 121 3HB ALA 121 15.252 -10.358 3.190 941 HB2 ALA 121 1HB ALA 121 15.653 -10.460 4.905 942 HB3 ALA 121 2HB ALA 121 15.361 -8.890 4.161 943 H ASP 122 H ASP 122 13.607 -10.642 6.992 944 HA ASP 122 HA ASP 122 11.956 -8.706 8.063 945 HB2 ASP 122 1HB ASP 122 12.811 -9.267 10.213 946 HB3 ASP 122 2HB ASP 122 12.791 -10.744 9.252 947 H GLY 123 H GLY 123 12.085 -6.591 8.113 948 HA2 GLY 123 1HA GLY 123 12.924 -4.465 8.265 949 HA3 GLY 123 2HA GLY 123 14.274 -5.166 9.141 950 H GLU 124 H GLU 124 13.168 -3.875 6.159 951 HA GLU 124 HA GLU 124 15.899 -3.744 5.215 952 HB2 GLU 124 1HB GLU 124 15.235 -4.575 2.916 953 HB3 GLU 124 2HB GLU 124 15.382 -5.795 4.169 954 HG2 GLU 124 1HG GLU 124 13.076 -6.110 4.298 955 HG3 GLU 124 2HG GLU 124 12.727 -4.599 3.460 956 H SER 125 H SER 125 16.295 -2.091 3.752 957 HA SER 125 HA SER 125 14.901 0.248 4.003 958 HG SER 125 HG SER 125 15.725 1.918 2.150 959 HB2 SER 125 1HB SER 125 17.174 -0.453 2.727 960 HB3 SER 125 2HB SER 125 16.129 -0.158 1.337 961 H VAL 126 H VAL 126 13.776 1.533 2.359 962 HA VAL 126 HA VAL 126 12.209 0.193 0.349 963 HB VAL 126 HB VAL 126 10.753 1.444 2.687 964 HG11 VAL 126 1HG1 VAL 126 9.752 0.080 0.198 965 HG12 VAL 126 2HG1 VAL 126 9.554 1.778 0.635 966 HG13 VAL 126 3HG1 VAL 126 8.744 0.525 1.574 967 HG21 VAL 126 3HG2 VAL 126 9.892 -0.868 3.055 968 HG22 VAL 126 1HG2 VAL 126 11.596 -0.641 3.440 969 HG23 VAL 126 2HG2 VAL 126 11.129 -1.441 1.938 970 H VAL 127 H VAL 127 11.886 1.607 -1.297 971 HA VAL 127 HA VAL 127 11.968 4.483 -0.651 972 HB VAL 127 HB VAL 127 13.082 4.861 -2.848 973 HG11 VAL 127 1HG1 VAL 127 15.004 3.087 -1.532 974 HG12 VAL 127 2HG1 VAL 127 14.195 4.214 -0.443 975 HG13 VAL 127 3HG1 VAL 127 15.082 4.823 -1.840 976 HG21 VAL 127 3HG2 VAL 127 14.230 2.271 -3.193 977 HG22 VAL 127 1HG2 VAL 127 13.290 3.231 -4.336 978 HG23 VAL 127 2HG2 VAL 127 12.472 2.131 -3.226 979 H VAL 128 H VAL 128 9.974 5.220 -0.942 980 HA VAL 128 HA VAL 128 8.198 4.092 -2.929 981 HB VAL 128 HB VAL 128 7.386 6.614 -1.634 982 HG11 VAL 128 1HG1 VAL 128 5.599 5.586 -2.625 983 HG12 VAL 128 2HG1 VAL 128 5.456 4.935 -0.994 984 HG13 VAL 128 3HG1 VAL 128 6.191 3.962 -2.266 985 HG21 VAL 128 3HG2 VAL 128 8.376 4.331 -0.026 986 HG22 VAL 128 1HG2 VAL 128 6.862 5.075 0.483 987 HG23 VAL 128 2HG2 VAL 128 8.323 6.051 0.357 988 H GLU 129 H GLU 129 7.880 4.911 -4.973 989 HA GLU 129 HA GLU 129 8.401 7.702 -5.532 990 HB2 GLU 129 1HB GLU 129 9.908 7.105 -7.464 991 HB3 GLU 129 2HB GLU 129 10.610 6.878 -5.867 992 HG2 GLU 129 1HG GLU 129 9.529 4.427 -6.346 993 HG3 GLU 129 2HG GLU 129 10.021 4.929 -7.964 994 H ARG 130 H ARG 130 6.996 8.457 -7.016 995 HA ARG 130 HA ARG 130 5.076 6.673 -8.187 996 HE ARG 130 HE ARG 130 3.881 7.805 -11.718 997 HB2 ARG 130 1HB ARG 130 4.407 8.882 -7.385 998 HB3 ARG 130 2HB ARG 130 5.501 9.649 -8.525 999 HG2 ARG 130 1HG ARG 130 3.480 7.829 -9.671 1000 HG3 ARG 130 2HG ARG 130 2.888 9.336 -8.968 1001 HD2 ARG 130 1HD ARG 130 3.488 10.415 -10.810 1002 HD3 ARG 130 2HD ARG 130 5.169 9.979 -10.503 1003 HH11 ARG 130 1HH1 ARG 130 4.933 11.044 -12.478 1004 HH12 ARG 130 2HH1 ARG 130 5.159 10.711 -14.162 1005 HH21 ARG 130 1HH2 ARG 130 4.176 7.365 -13.935 1006 HH22 ARG 130 2HH2 ARG 130 4.729 8.623 -14.990 1007 H ALA 131 H ALA 131 6.173 5.360 -9.627 1008 HA ALA 131 HA ALA 131 7.326 4.738 -11.515 1009 HB1 ALA 131 3HB ALA 131 5.461 6.874 -12.507 1010 HB2 ALA 131 1HB ALA 131 5.201 5.131 -12.471 1011 HB3 ALA 131 2HB ALA 131 6.389 5.823 -13.576 Start of MODEL 15 1 H MET 1 H MET 1 -16.504 14.508 -19.173 2 HA MET 1 HA MET 1 -13.808 13.673 -20.007 3 HB2 MET 1 1HB MET 1 -14.945 14.841 -17.472 4 HB3 MET 1 2HB MET 1 -13.452 13.917 -17.476 5 HG2 MET 1 1HG MET 1 -12.321 15.511 -18.736 6 HG3 MET 1 2HG MET 1 -13.814 16.264 -19.293 7 HE1 MET 1 3HE MET 1 -11.290 15.925 -16.216 8 HE2 MET 1 1HE MET 1 -12.769 15.078 -15.763 9 HE3 MET 1 2HE MET 1 -12.324 16.573 -14.941 10 H GLY 2 H GLY 2 -13.095 11.883 -18.425 11 HA2 GLY 2 1HA GLY 2 -15.119 10.204 -17.307 12 HA3 GLY 2 2HA GLY 2 -14.559 9.594 -18.856 13 H GLU 3 H GLU 3 -12.498 11.318 -16.606 14 HA GLU 3 HA GLU 3 -11.281 8.821 -15.706 15 HB2 GLU 3 1HB GLU 3 -9.859 10.970 -17.269 16 HB3 GLU 3 2HB GLU 3 -8.995 9.849 -16.225 17 HG2 GLU 3 1HG GLU 3 -10.853 8.683 -18.208 18 HG3 GLU 3 2HG GLU 3 -9.368 9.412 -18.819 19 H ARG 4 H ARG 4 -10.858 12.362 -15.624 20 HA ARG 4 HA ARG 4 -10.554 13.821 -13.912 21 HE ARG 4 HE ARG 4 -13.338 10.614 -12.779 22 HB2 ARG 4 1HB ARG 4 -11.800 11.568 -12.333 23 HB3 ARG 4 2HB ARG 4 -11.410 13.135 -11.642 24 HG2 ARG 4 1HG ARG 4 -13.679 13.270 -12.160 25 HG3 ARG 4 2HG ARG 4 -12.872 14.139 -13.464 26 HD2 ARG 4 1HD ARG 4 -14.670 12.679 -14.286 27 HD3 ARG 4 2HD ARG 4 -13.095 12.217 -14.929 28 HH11 ARG 4 1HH1 ARG 4 -15.498 11.312 -15.431 29 HH12 ARG 4 2HH1 ARG 4 -16.248 9.752 -15.392 30 HH21 ARG 4 1HH2 ARG 4 -14.323 8.564 -12.727 31 HH22 ARG 4 2HH2 ARG 4 -15.582 8.192 -13.857 32 H GLY 5 H GLY 5 -9.972 10.863 -12.035 33 HA2 GLY 5 1HA GLY 5 -7.109 11.161 -12.176 34 HA3 GLY 5 2HA GLY 5 -7.785 11.659 -10.633 35 H VAL 6 H VAL 6 -9.134 9.066 -12.562 36 HA VAL 6 HA VAL 6 -8.448 7.195 -10.392 37 HB VAL 6 HB VAL 6 -10.438 6.787 -12.642 38 HG11 VAL 6 1HG1 VAL 6 -9.442 4.800 -11.313 39 HG12 VAL 6 2HG1 VAL 6 -11.185 4.888 -11.559 40 HG13 VAL 6 3HG1 VAL 6 -10.492 5.363 -10.010 41 HG21 VAL 6 3HG2 VAL 6 -12.165 7.604 -11.346 42 HG22 VAL 6 1HG2 VAL 6 -10.863 8.734 -10.973 43 HG23 VAL 6 2HG2 VAL 6 -11.262 7.438 -9.841 44 H GLU 7 H GLU 7 -6.239 7.533 -11.686 45 HA GLU 7 HA GLU 7 -5.647 5.032 -12.852 46 HB2 GLU 7 1HB GLU 7 -4.815 6.319 -15.050 47 HB3 GLU 7 2HB GLU 7 -6.385 5.540 -14.942 48 HG2 GLU 7 1HG GLU 7 -6.454 7.804 -15.930 49 HG3 GLU 7 2HG GLU 7 -7.458 7.632 -14.491 50 H MET 8 H MET 8 -4.640 6.597 -10.737 51 HA MET 8 HA MET 8 -2.007 7.440 -11.730 52 HB2 MET 8 1HB MET 8 -3.598 8.920 -10.235 53 HB3 MET 8 2HB MET 8 -2.902 7.969 -8.932 54 HG2 MET 8 1HG MET 8 -1.217 9.396 -8.892 55 HG3 MET 8 2HG MET 8 -0.726 8.769 -10.465 56 HE1 MET 8 3HE MET 8 -1.848 12.324 -8.783 57 HE2 MET 8 1HE MET 8 -0.615 12.772 -9.962 58 HE3 MET 8 2HE MET 8 -0.352 11.396 -8.889 59 H ARG 9 H ARG 9 -0.418 6.028 -11.527 60 HA ARG 9 HA ARG 9 -0.558 4.084 -9.317 61 HE ARG 9 HE ARG 9 3.340 1.087 -12.472 62 HB2 ARG 9 1HB ARG 9 0.373 2.447 -10.649 63 HB3 ARG 9 2HB ARG 9 -0.613 3.327 -11.807 64 HG2 ARG 9 1HG ARG 9 1.262 3.258 -13.044 65 HG3 ARG 9 2HG ARG 9 1.715 4.657 -12.067 66 HD2 ARG 9 1HD ARG 9 3.396 3.547 -11.107 67 HD3 ARG 9 2HD ARG 9 2.361 2.169 -10.734 68 HH11 ARG 9 1HH1 ARG 9 3.543 4.514 -13.098 69 HH12 ARG 9 2HH1 ARG 9 4.431 4.318 -14.573 70 HH21 ARG 9 1HH2 ARG 9 4.507 0.827 -14.411 71 HH22 ARG 9 2HH2 ARG 9 4.977 2.226 -15.318 72 H LEU 10 H LEU 10 1.217 3.620 -8.098 73 HA LEU 10 HA LEU 10 3.498 5.463 -8.386 74 HG LEU 10 HG LEU 10 0.920 4.247 -6.079 75 HB2 LEU 10 1HB LEU 10 3.429 4.513 -5.710 76 HB3 LEU 10 2HB LEU 10 3.245 6.155 -6.288 77 HD11 LEU 10 1HD1 LEU 10 2.008 6.178 -4.032 78 HD12 LEU 10 2HD1 LEU 10 1.776 4.438 -3.848 79 HD13 LEU 10 3HD1 LEU 10 0.378 5.506 -3.978 80 HD21 LEU 10 3HD2 LEU 10 0.464 7.098 -5.766 81 HD22 LEU 10 1HD2 LEU 10 -0.326 5.936 -6.832 82 HD23 LEU 10 2HD2 LEU 10 1.189 6.697 -7.322 83 H ARG 11 H ARG 11 5.538 4.607 -7.410 84 HA ARG 11 HA ARG 11 5.737 1.733 -7.983 85 HE ARG 11 HE ARG 11 10.420 0.851 -8.586 86 HB2 ARG 11 1HB ARG 11 7.180 3.901 -9.001 87 HB3 ARG 11 2HB ARG 11 8.286 3.115 -7.885 88 HG2 ARG 11 1HG ARG 11 6.789 1.631 -10.029 89 HG3 ARG 11 2HG ARG 11 8.384 2.343 -10.278 90 HD2 ARG 11 1HD ARG 11 8.254 0.739 -7.860 91 HD3 ARG 11 2HD ARG 11 7.843 -0.190 -9.301 92 HH11 ARG 11 1HH1 ARG 11 8.393 -0.168 -11.236 93 HH12 ARG 11 2HH1 ARG 11 9.725 -0.532 -12.279 94 HH21 ARG 11 1HH2 ARG 11 12.174 0.372 -9.957 95 HH22 ARG 11 2HH2 ARG 11 11.873 -0.227 -11.554 96 H ILE 12 H ILE 12 6.818 0.367 -6.567 97 HA ILE 12 HA ILE 12 7.944 1.495 -4.128 98 HB ILE 12 HB ILE 12 5.405 0.004 -4.238 99 HG12 ILE 12 1HG1 ILE 12 6.608 1.478 -1.912 100 HG13 ILE 12 2HG1 ILE 12 5.940 2.335 -3.297 101 HG21 ILE 12 1HG2 ILE 12 7.604 -0.911 -2.421 102 HG22 ILE 12 2HG2 ILE 12 6.481 -1.872 -3.386 103 HG23 ILE 12 3HG2 ILE 12 5.912 -1.033 -1.944 104 HD11 ILE 12 3HD1 ILE 12 4.444 1.963 -1.256 105 HD12 ILE 12 1HD1 ILE 12 4.326 0.297 -1.820 106 HD13 ILE 12 2HD1 ILE 12 3.777 1.617 -2.851 107 H ARG 13 H ARG 13 9.957 0.791 -4.490 108 HA ARG 13 HA ARG 13 10.354 -2.002 -5.290 109 HE ARG 13 HE ARG 13 14.983 0.349 -4.747 110 HB2 ARG 13 1HB ARG 13 12.717 -1.316 -5.694 111 HB3 ARG 13 2HB ARG 13 11.545 -0.449 -6.677 112 HG2 ARG 13 1HG ARG 13 11.694 1.466 -5.164 113 HG3 ARG 13 2HG ARG 13 12.866 0.589 -4.176 114 HD2 ARG 13 1HD ARG 13 13.408 0.906 -7.085 115 HD3 ARG 13 2HD ARG 13 13.633 2.301 -6.032 116 HH11 ARG 13 1HH1 ARG 13 15.054 1.518 -8.034 117 HH12 ARG 13 2HH1 ARG 13 16.724 1.123 -8.270 118 HH21 ARG 13 1HH2 ARG 13 17.180 -0.169 -5.055 119 HH22 ARG 13 2HH2 ARG 13 17.930 0.165 -6.579 120 H PHE 14 H PHE 14 11.962 -3.288 -4.280 121 HA PHE 14 HA PHE 14 12.683 -2.564 -1.539 122 HD1 PHE 14 HD1 PHE 14 9.806 -2.367 -1.675 123 HD2 PHE 14 HD2 PHE 14 11.500 -5.283 0.919 124 HE1 PHE 14 HE1 PHE 14 8.438 -1.505 0.179 125 HE2 PHE 14 HE2 PHE 14 10.135 -4.428 2.779 126 HZ PHE 14 HZ PHE 14 8.601 -2.535 2.410 127 HB2 PHE 14 1HB PHE 14 10.914 -4.774 -2.398 128 HB3 PHE 14 2HB PHE 14 12.175 -5.229 -1.260 129 H GLU 15 H GLU 15 14.676 -3.253 -0.946 130 HA GLU 15 HA GLU 15 16.656 -3.732 -2.739 131 HB2 GLU 15 1HB GLU 15 16.379 -4.195 0.162 132 HB3 GLU 15 2HB GLU 15 17.629 -5.144 -0.621 133 HG2 GLU 15 1HG GLU 15 18.207 -2.837 0.385 134 HG3 GLU 15 2HG GLU 15 18.883 -3.311 -1.169 135 H SER 16 H SER 16 14.439 -6.113 -1.484 136 HA SER 16 HA SER 16 15.795 -8.145 -3.135 137 HG SER 16 HG SER 16 15.215 -10.686 -1.781 138 HB2 SER 16 1HB SER 16 15.744 -8.286 -0.455 139 HB3 SER 16 2HB SER 16 14.200 -9.063 -0.805 140 H ALA 17 H ALA 17 13.412 -6.284 -3.608 141 HA ALA 17 HA ALA 17 11.857 -8.147 -5.065 142 HB1 ALA 17 3HB ALA 17 10.160 -7.083 -2.865 143 HB2 ALA 17 1HB ALA 17 11.187 -8.482 -2.538 144 HB3 ALA 17 2HB ALA 17 9.984 -8.552 -3.825 145 H GLU 18 H GLU 18 10.221 -7.222 -6.335 146 HA GLU 18 HA GLU 18 9.956 -4.291 -6.185 147 HB2 GLU 18 1HB GLU 18 10.151 -4.154 -8.642 148 HB3 GLU 18 2HB GLU 18 11.628 -4.732 -7.885 149 HG2 GLU 18 1HG GLU 18 10.594 -7.087 -8.391 150 HG3 GLU 18 2HG GLU 18 9.678 -6.184 -9.597 151 H CYS 19 H CYS 19 7.977 -3.434 -6.806 152 HA CYS 19 HA CYS 19 5.994 -5.029 -8.139 153 HG CYS 19 HG CYS 19 5.954 -5.926 -4.016 154 HB2 CYS 19 1HB CYS 19 4.577 -4.442 -5.778 155 HB3 CYS 19 2HB CYS 19 5.022 -6.032 -6.384 156 H GLU 20 H GLU 20 4.132 -3.841 -8.756 157 HA GLU 20 HA GLU 20 4.302 -0.951 -8.179 158 HB2 GLU 20 1HB GLU 20 3.042 -1.961 -10.698 159 HB3 GLU 20 2HB GLU 20 3.826 -0.419 -10.385 160 HG2 GLU 20 1HG GLU 20 5.994 -1.752 -10.224 161 HG3 GLU 20 2HG GLU 20 5.085 -3.072 -10.956 162 H VAL 21 H VAL 21 2.268 0.205 -8.178 163 HA VAL 21 HA VAL 21 -0.159 -1.384 -8.014 164 HB VAL 21 HB VAL 21 -0.306 -1.486 -5.804 165 HG11 VAL 21 1HG1 VAL 21 2.252 0.101 -5.764 166 HG12 VAL 21 2HG1 VAL 21 2.070 -1.654 -5.698 167 HG13 VAL 21 3HG1 VAL 21 1.528 -0.660 -4.345 168 HG21 VAL 21 3HG2 VAL 21 -1.477 0.671 -5.954 169 HG22 VAL 21 1HG2 VAL 21 0.052 1.508 -5.689 170 HG23 VAL 21 2HG2 VAL 21 -0.621 0.482 -4.425 171 H GLU 22 H GLU 22 -2.031 -0.235 -8.358 172 HA GLU 22 HA GLU 22 -1.658 2.490 -9.366 173 HB2 GLU 22 1HB GLU 22 -3.584 0.286 -9.941 174 HB3 GLU 22 2HB GLU 22 -4.135 1.942 -10.162 175 HG2 GLU 22 1HG GLU 22 -2.943 2.218 -12.025 176 HG3 GLU 22 2HG GLU 22 -1.527 1.407 -11.357 177 H LEU 23 H LEU 23 -3.988 3.721 -9.147 178 HA LEU 23 HA LEU 23 -5.103 3.321 -6.506 179 HG LEU 23 HG LEU 23 -5.620 6.560 -6.445 180 HB2 LEU 23 1HB LEU 23 -3.388 4.670 -5.734 181 HB3 LEU 23 2HB LEU 23 -3.326 5.617 -7.203 182 HD11 LEU 23 1HD1 LEU 23 -6.400 5.471 -4.627 183 HD12 LEU 23 2HD1 LEU 23 -5.350 6.593 -3.763 184 HD13 LEU 23 3HD1 LEU 23 -4.793 4.958 -4.111 185 HD21 LEU 23 3HD2 LEU 23 -3.866 8.063 -6.497 186 HD22 LEU 23 1HD2 LEU 23 -2.930 7.175 -5.295 187 HD23 LEU 23 2HD2 LEU 23 -4.348 8.102 -4.802 188 H TYR 24 H TYR 24 -7.106 4.224 -6.217 189 HA TYR 24 HA TYR 24 -8.238 5.658 -8.528 190 HD1 TYR 24 HD1 TYR 24 -7.904 4.295 -10.053 191 HD2 TYR 24 HD2 TYR 24 -9.829 1.344 -7.666 192 HE1 TYR 24 HE1 TYR 24 -7.076 2.540 -11.565 193 HE2 TYR 24 HE2 TYR 24 -9.004 -0.419 -9.171 194 HH TYR 24 HH TYR 24 -7.268 -0.797 -10.788 195 HB2 TYR 24 1HB TYR 24 -9.676 3.555 -6.881 196 HB3 TYR 24 2HB TYR 24 -10.333 4.436 -8.256 197 H GLU 25 H GLU 25 -9.767 7.254 -8.101 198 HA GLU 25 HA GLU 25 -9.420 8.699 -5.724 199 HB2 GLU 25 1HB GLU 25 -11.612 8.895 -7.790 200 HB3 GLU 25 2HB GLU 25 -11.393 10.044 -6.475 201 HG2 GLU 25 1HG GLU 25 -9.260 10.721 -7.348 202 HG3 GLU 25 2HG GLU 25 -9.314 9.461 -8.579 203 H GLU 26 H GLU 26 -11.276 5.909 -6.111 204 HA GLU 26 HA GLU 26 -13.601 6.276 -4.751 205 HB2 GLU 26 1HB GLU 26 -13.569 3.970 -4.183 206 HB3 GLU 26 2HB GLU 26 -12.714 4.119 -5.712 207 HG2 GLU 26 1HG GLU 26 -10.573 4.110 -4.391 208 HG3 GLU 26 2HG GLU 26 -11.540 3.686 -2.980 209 H TRP 27 H TRP 27 -10.381 6.392 -3.415 210 HA TRP 27 HA TRP 27 -11.264 6.277 -0.676 211 HD1 TRP 27 HD1 TRP 27 -10.361 7.653 1.236 212 HE1 TRP 27 HE1 TRP 27 -8.647 8.420 2.998 213 HE3 TRP 27 HE3 TRP 27 -6.056 6.377 -1.207 214 HZ2 TRP 27 HZ2 TRP 27 -5.842 8.474 3.309 215 HZ3 TRP 27 HZ3 TRP 27 -3.898 6.818 -0.109 216 HH2 TRP 27 HH2 TRP 27 -3.797 7.845 2.103 217 HB2 TRP 27 1HB TRP 27 -9.065 5.428 -1.093 218 HB3 TRP 27 2HB TRP 27 -8.601 6.878 -1.980 219 H ALA 28 H ALA 28 -9.791 8.783 -2.761 220 HA ALA 28 HA ALA 28 -11.459 10.839 -2.501 221 HB1 ALA 28 3HB ALA 28 -9.992 10.551 0.088 222 HB2 ALA 28 1HB ALA 28 -11.684 10.952 -0.206 223 HB3 ALA 28 2HB ALA 28 -10.428 12.155 -0.498 224 HA PRO 29 HA PRO 29 -8.072 12.197 -5.126 225 HB2 PRO 29 1HB PRO 29 -9.244 14.808 -5.202 226 HB3 PRO 29 2HB PRO 29 -9.242 13.579 -6.464 227 HG2 PRO 29 1HG PRO 29 -11.360 14.320 -4.582 228 HG3 PRO 29 2HG PRO 29 -11.471 13.411 -6.095 229 HD2 PRO 29 1HD PRO 29 -11.790 12.305 -3.614 230 HD3 PRO 29 2HD PRO 29 -11.242 11.395 -5.035 231 H GLU 30 H GLU 30 -9.302 14.021 -2.354 232 HA GLU 30 HA GLU 30 -7.180 15.841 -2.105 233 HB2 GLU 30 1HB GLU 30 -9.264 14.804 -0.228 234 HB3 GLU 30 2HB GLU 30 -7.905 15.693 0.440 235 HG2 GLU 30 1HG GLU 30 -9.269 16.947 -1.858 236 HG3 GLU 30 2HG GLU 30 -10.181 16.848 -0.353 237 H THR 31 H THR 31 -7.675 12.710 -0.471 238 HA THR 31 HA THR 31 -5.222 12.764 0.955 239 HB THR 31 HB THR 31 -5.824 10.053 0.444 240 HG1 THR 31 HG1 THR 31 -7.790 10.560 -0.437 241 HG21 THR 31 3HG2 THR 31 -5.255 10.549 2.628 242 HG22 THR 31 1HG2 THR 31 -6.988 10.238 2.736 243 HG23 THR 31 2HG2 THR 31 -6.389 11.898 2.733 244 H VAL 32 H VAL 32 -6.098 11.334 -2.170 245 HA VAL 32 HA VAL 32 -3.817 10.001 -2.863 246 HB VAL 32 HB VAL 32 -5.494 11.761 -4.662 247 HG11 VAL 32 1HG1 VAL 32 -3.724 11.358 -6.040 248 HG12 VAL 32 2HG1 VAL 32 -4.653 9.886 -6.326 249 HG13 VAL 32 3HG1 VAL 32 -3.281 9.862 -5.219 250 HG21 VAL 32 3HG2 VAL 32 -6.266 9.252 -5.221 251 HG22 VAL 32 1HG2 VAL 32 -7.053 10.262 -4.008 252 HG23 VAL 32 2HG2 VAL 32 -5.855 9.066 -3.516 253 H ARG 33 H ARG 33 -4.314 13.471 -2.767 254 HA ARG 33 HA ARG 33 -2.109 14.306 -4.261 255 HE ARG 33 HE ARG 33 -1.292 19.135 -4.057 256 HB2 ARG 33 1HB ARG 33 -4.054 15.689 -3.286 257 HB3 ARG 33 2HB ARG 33 -3.076 15.788 -1.828 258 HG2 ARG 33 1HG ARG 33 -1.225 16.662 -3.406 259 HG3 ARG 33 2HG ARG 33 -2.555 16.951 -4.533 260 HD2 ARG 33 1HD ARG 33 -3.690 18.271 -2.762 261 HD3 ARG 33 2HD ARG 33 -2.265 18.068 -1.746 262 HH11 ARG 33 1HH1 ARG 33 -3.769 20.077 -1.785 263 HH12 ARG 33 2HH1 ARG 33 -3.559 21.772 -2.067 264 HH21 ARG 33 1HH2 ARG 33 -1.013 21.364 -4.428 265 HH22 ARG 33 2HH2 ARG 33 -1.994 22.504 -3.568 266 H ALA 34 H ALA 34 -2.338 13.388 -0.854 267 HA ALA 34 HA ALA 34 0.251 14.224 -0.096 268 HB1 ALA 34 3HB ALA 34 -0.884 13.810 1.797 269 HB2 ALA 34 1HB ALA 34 -0.228 12.183 1.607 270 HB3 ALA 34 2HB ALA 34 -1.865 12.545 1.058 271 H ILE 35 H ILE 35 -0.972 11.077 -1.188 272 HA ILE 35 HA ILE 35 1.383 9.601 -0.937 273 HB ILE 35 HB ILE 35 -0.085 8.982 -3.408 274 HG12 ILE 35 1HG1 ILE 35 -1.962 9.927 -2.158 275 HG13 ILE 35 2HG1 ILE 35 -2.118 8.177 -2.275 276 HG21 ILE 35 1HG2 ILE 35 0.449 7.386 -0.912 277 HG22 ILE 35 2HG2 ILE 35 1.517 7.484 -2.312 278 HG23 ILE 35 3HG2 ILE 35 -0.079 6.753 -2.471 279 HD11 ILE 35 3HD1 ILE 35 -0.732 8.598 0.092 280 HD12 ILE 35 1HD1 ILE 35 -2.432 8.161 -0.086 281 HD13 ILE 35 2HD1 ILE 35 -1.968 9.856 0.057 282 H ALA 36 H ALA 36 0.173 11.438 -3.785 283 HA ALA 36 HA ALA 36 2.439 11.006 -5.408 284 HB1 ALA 36 3HB ALA 36 1.378 12.282 -6.933 285 HB2 ALA 36 1HB ALA 36 0.987 13.547 -5.768 286 HB3 ALA 36 2HB ALA 36 0.006 12.082 -5.842 287 H ASP 37 H ASP 37 1.766 13.250 -2.817 288 HA ASP 37 HA ASP 37 3.889 15.065 -3.440 289 HB2 ASP 37 1HB ASP 37 1.822 15.404 -1.885 290 HB3 ASP 37 2HB ASP 37 2.843 14.665 -0.655 291 H ALA 38 H ALA 38 3.693 12.015 -1.815 292 HA ALA 38 HA ALA 38 6.338 12.263 -0.641 293 HB1 ALA 38 3HB ALA 38 4.062 11.152 0.299 294 HB2 ALA 38 1HB ALA 38 5.681 10.700 0.843 295 HB3 ALA 38 2HB ALA 38 4.860 9.733 -0.384 296 H LEU 39 H LEU 39 6.599 12.310 -3.331 297 HA LEU 39 HA LEU 39 6.845 9.792 -4.593 298 HG LEU 39 HG LEU 39 6.079 12.996 -5.555 299 HB2 LEU 39 1HB LEU 39 8.305 12.362 -5.241 300 HB3 LEU 39 2HB LEU 39 8.144 10.977 -6.294 301 HD11 LEU 39 1HD1 LEU 39 7.464 12.027 -7.949 302 HD12 LEU 39 2HD1 LEU 39 6.765 13.608 -7.599 303 HD13 LEU 39 3HD1 LEU 39 5.731 12.287 -8.151 304 HD21 LEU 39 3HD2 LEU 39 4.887 11.011 -5.023 305 HD22 LEU 39 1HD2 LEU 39 5.567 10.148 -6.398 306 HD23 LEU 39 2HD2 LEU 39 4.407 11.443 -6.662 307 HA PRO 40 HA PRO 40 11.045 8.060 -4.065 308 HB2 PRO 40 1HB PRO 40 12.448 10.604 -4.808 309 HB3 PRO 40 2HB PRO 40 12.933 8.928 -5.098 310 HG2 PRO 40 1HG PRO 40 11.708 10.431 -6.988 311 HG3 PRO 40 2HG PRO 40 11.512 8.675 -6.877 312 HD2 PRO 40 1HD PRO 40 9.563 10.770 -6.391 313 HD3 PRO 40 2HD PRO 40 9.309 9.022 -6.512 314 H ILE 41 H ILE 41 10.949 7.816 -1.933 315 HA ILE 41 HA ILE 41 12.399 9.699 -0.266 316 HB ILE 41 HB ILE 41 9.492 9.012 0.208 317 HG12 ILE 41 1HG1 ILE 41 11.036 11.620 0.138 318 HG13 ILE 41 2HG1 ILE 41 9.907 11.044 -1.081 319 HG21 ILE 41 1HG2 ILE 41 10.670 8.556 2.285 320 HG22 ILE 41 2HG2 ILE 41 9.728 10.037 2.442 321 HG23 ILE 41 3HG2 ILE 41 11.473 10.122 2.203 322 HD11 ILE 41 3HD1 ILE 41 9.368 12.678 1.116 323 HD12 ILE 41 1HD1 ILE 41 8.631 11.120 1.486 324 HD13 ILE 41 2HD1 ILE 41 8.207 11.965 -0.004 325 H LYS 42 H LYS 42 13.232 8.721 1.630 326 HA LYS 42 HA LYS 42 13.454 5.847 1.403 327 HB2 LYS 42 1HB LYS 42 14.944 8.000 2.749 328 HB3 LYS 42 2HB LYS 42 14.923 6.465 3.603 329 HG2 LYS 42 1HG LYS 42 16.385 5.560 2.199 330 HG3 LYS 42 2HG LYS 42 15.478 6.105 0.789 331 HD2 LYS 42 1HD LYS 42 17.252 7.427 0.412 332 HD3 LYS 42 2HD LYS 42 16.566 8.441 1.682 333 HE2 LYS 42 1HE LYS 42 18.858 8.109 2.217 334 HE3 LYS 42 2HE LYS 42 17.916 7.122 3.334 335 HZ1 LYS 42 3HZ LYS 42 19.476 6.228 0.982 336 HZ2 LYS 42 1HZ LYS 42 18.321 5.239 1.727 337 HZ3 LYS 42 2HZ LYS 42 19.669 5.772 2.599 338 H SER 43 H SER 43 12.653 4.341 2.738 339 HA SER 43 HA SER 43 11.438 5.092 5.273 340 HG SER 43 HG SER 43 9.649 3.213 2.360 341 HB2 SER 43 1HB SER 43 9.287 4.376 4.809 342 HB3 SER 43 2HB SER 43 9.730 5.104 3.270 343 H THR 44 H THR 44 11.251 3.345 6.745 344 HA THR 44 HA THR 44 12.863 1.003 5.958 345 HB THR 44 HB THR 44 12.152 1.322 8.803 346 HG1 THR 44 HG1 THR 44 13.746 3.228 7.446 347 HG21 THR 44 3HG2 THR 44 13.928 0.026 8.997 348 HG22 THR 44 1HG2 THR 44 14.938 1.323 8.360 349 HG23 THR 44 2HG2 THR 44 14.228 0.139 7.263 350 H ALA 45 H ALA 45 11.950 -0.880 5.687 351 HA ALA 45 HA ALA 45 9.121 -1.203 6.150 352 HB1 ALA 45 3HB ALA 45 10.150 -3.614 5.181 353 HB2 ALA 45 1HB ALA 45 11.083 -2.347 4.395 354 HB3 ALA 45 2HB ALA 45 9.327 -2.357 4.261 355 H ASN 46 H ASN 46 8.138 -2.351 7.634 356 HA ASN 46 HA ASN 46 9.761 -3.829 9.590 357 HB2 ASN 46 1HB ASN 46 7.192 -2.341 9.708 358 HB3 ASN 46 2HB ASN 46 7.287 -3.800 10.690 359 HD21 ASN 46 1HD2 ASN 46 7.123 -0.989 11.475 360 HD22 ASN 46 2HD2 ASN 46 8.500 -0.696 12.479 361 H ARG 47 H ARG 47 9.649 -6.070 9.605 362 HA ARG 47 HA ARG 47 7.878 -7.266 7.650 363 HE ARG 47 HE ARG 47 7.595 -9.089 6.672 364 HB2 ARG 47 1HB ARG 47 10.368 -8.022 9.010 365 HB3 ARG 47 2HB ARG 47 9.272 -9.357 8.673 366 HG2 ARG 47 1HG ARG 47 9.620 -7.522 6.429 367 HG3 ARG 47 2HG ARG 47 11.100 -8.330 6.928 368 HD2 ARG 47 1HD ARG 47 9.963 -9.619 5.228 369 HD3 ARG 47 2HD ARG 47 9.975 -10.495 6.755 370 HH11 ARG 47 1HH1 ARG 47 9.156 -11.599 4.814 371 HH12 ARG 47 2HH1 ARG 47 7.668 -12.319 4.301 372 HH21 ARG 47 1HH2 ARG 47 5.636 -10.036 5.996 373 HH22 ARG 47 2HH2 ARG 47 5.669 -11.431 4.969 374 H TRP 48 H TRP 48 6.191 -8.558 8.000 375 HA TRP 48 HA TRP 48 5.680 -9.791 10.555 376 HD1 TRP 48 HD1 TRP 48 1.948 -9.886 9.535 377 HE1 TRP 48 HE1 TRP 48 0.461 -10.598 11.511 378 HE3 TRP 48 HE3 TRP 48 4.499 -7.605 13.335 379 HZ2 TRP 48 HZ2 TRP 48 0.381 -10.242 14.310 380 HZ3 TRP 48 HZ3 TRP 48 3.651 -7.840 15.632 381 HH2 TRP 48 HH2 TRP 48 1.633 -9.131 16.108 382 HB2 TRP 48 1HB TRP 48 4.722 -7.551 10.919 383 HB3 TRP 48 2HB TRP 48 3.766 -7.714 9.448 384 H GLY 49 H GLY 49 4.139 -11.491 10.366 385 HA2 GLY 49 1HA GLY 49 4.110 -13.138 8.306 386 HA3 GLY 49 2HA GLY 49 2.652 -12.912 9.255 387 H ASP 50 H ASP 50 4.343 -11.998 6.326 388 HA ASP 50 HA ASP 50 3.566 -11.463 4.254 389 HB2 ASP 50 1HB ASP 50 1.703 -13.050 4.736 390 HB3 ASP 50 2HB ASP 50 0.776 -11.703 5.389 391 H GLU 51 H GLU 51 1.974 -9.848 6.968 392 HA GLU 51 HA GLU 51 1.281 -7.508 5.511 393 HB2 GLU 51 1HB GLU 51 0.102 -8.172 7.556 394 HB3 GLU 51 2HB GLU 51 1.573 -7.945 8.490 395 HG2 GLU 51 1HG GLU 51 1.547 -5.562 7.951 396 HG3 GLU 51 2HG GLU 51 0.065 -5.792 7.022 397 H ILE 52 H ILE 52 2.539 -5.877 4.910 398 HA ILE 52 HA ILE 52 5.022 -5.401 6.415 399 HB ILE 52 HB ILE 52 4.935 -6.343 3.805 400 HG12 ILE 52 1HG1 ILE 52 7.420 -5.588 3.861 401 HG13 ILE 52 2HG1 ILE 52 7.044 -5.033 5.488 402 HG21 ILE 52 1HG2 ILE 52 5.933 -4.561 2.440 403 HG22 ILE 52 2HG2 ILE 52 5.603 -3.410 3.734 404 HG23 ILE 52 3HG2 ILE 52 4.269 -4.211 2.903 405 HD11 ILE 52 3HD1 ILE 52 8.001 -7.191 5.661 406 HD12 ILE 52 1HD1 ILE 52 6.919 -7.847 4.437 407 HD13 ILE 52 2HD1 ILE 52 6.283 -7.359 6.009 408 H TYR 53 H TYR 53 4.784 -3.553 7.422 409 HA TYR 53 HA TYR 53 3.511 -1.320 5.977 410 HD1 TYR 53 HD1 TYR 53 4.337 -0.004 9.798 411 HD2 TYR 53 HD2 TYR 53 2.697 -3.906 9.308 412 HE1 TYR 53 HE1 TYR 53 5.193 -0.640 12.011 413 HE2 TYR 53 HE2 TYR 53 3.552 -4.546 11.521 414 HH TYR 53 HH TYR 53 4.167 -3.095 13.749 415 HB2 TYR 53 1HB TYR 53 2.599 -0.486 8.081 416 HB3 TYR 53 2HB TYR 53 2.076 -2.146 7.808 417 H PHE 54 H PHE 54 4.530 0.562 5.868 418 HA PHE 54 HA PHE 54 6.786 1.098 7.649 419 HD1 PHE 54 HD1 PHE 54 6.787 3.552 4.605 420 HD2 PHE 54 HD2 PHE 54 6.967 -0.545 3.481 421 HE1 PHE 54 HE1 PHE 54 6.018 4.141 2.348 422 HE2 PHE 54 HE2 PHE 54 6.195 0.035 1.224 423 HZ PHE 54 HZ PHE 54 5.719 2.382 0.652 424 HB2 PHE 54 1HB PHE 54 8.248 1.718 5.826 425 HB3 PHE 54 2HB PHE 54 7.704 0.064 5.581 426 H THR 55 H THR 55 7.193 3.285 8.009 427 HA THR 55 HA THR 55 5.002 5.065 7.204 428 HB THR 55 HB THR 55 7.153 6.058 8.991 429 HG1 THR 55 HG1 THR 55 6.302 4.868 10.749 430 HG21 THR 55 3HG2 THR 55 4.999 6.548 10.370 431 HG22 THR 55 1HG2 THR 55 4.189 6.254 8.831 432 HG23 THR 55 2HG2 THR 55 5.401 7.530 8.960 433 H THR 56 H THR 56 5.368 7.069 6.163 434 HA THR 56 HA THR 56 8.030 7.321 4.918 435 HB THR 56 HB THR 56 6.166 8.570 3.229 436 HG1 THR 56 HG1 THR 56 4.512 7.378 4.185 437 HG21 THR 56 3HG2 THR 56 7.434 7.530 1.751 438 HG22 THR 56 1HG2 THR 56 6.745 5.981 2.238 439 HG23 THR 56 2HG2 THR 56 8.187 6.598 3.048 440 H GLN 57 H GLN 57 6.227 8.698 7.170 441 HA GLN 57 HA GLN 57 6.506 10.709 8.241 442 HB2 GLN 57 1HB GLN 57 7.779 11.947 5.809 443 HB3 GLN 57 2HB GLN 57 7.971 12.388 7.501 444 HG2 GLN 57 1HG GLN 57 8.836 9.700 7.176 445 HG3 GLN 57 2HG GLN 57 9.587 10.686 5.925 446 HE21 GLN 57 1HE2 GLN 57 10.185 9.448 8.796 447 HE22 GLN 57 2HE2 GLN 57 11.182 10.674 9.495 448 H VAL 58 H VAL 58 4.817 10.144 5.393 449 HA VAL 58 HA VAL 58 3.593 12.770 5.266 450 HB VAL 58 HB VAL 58 3.924 11.516 3.176 451 HG11 VAL 58 1HG1 VAL 58 3.570 9.250 4.133 452 HG12 VAL 58 2HG1 VAL 58 2.673 9.542 2.638 453 HG13 VAL 58 3HG1 VAL 58 1.840 9.592 4.192 454 HG21 VAL 58 3HG2 VAL 58 1.540 11.691 2.341 455 HG22 VAL 58 1HG2 VAL 58 2.217 13.139 3.088 456 HG23 VAL 58 2HG2 VAL 58 1.095 12.119 3.992 457 H ALA 59 H ALA 59 2.082 13.345 6.671 458 HA ALA 59 HA ALA 59 0.434 11.232 7.889 459 HB1 ALA 59 3HB ALA 59 1.872 12.733 9.354 460 HB2 ALA 59 1HB ALA 59 0.177 12.561 9.802 461 HB3 ALA 59 2HB ALA 59 0.723 14.018 8.975 462 H VAL 60 H VAL 60 -1.218 11.028 6.455 463 HA VAL 60 HA VAL 60 -2.944 13.400 6.114 464 HB VAL 60 HB VAL 60 -2.049 12.790 3.954 465 HG11 VAL 60 1HG1 VAL 60 -1.487 10.428 4.595 466 HG12 VAL 60 2HG1 VAL 60 -2.180 10.619 2.986 467 HG13 VAL 60 3HG1 VAL 60 -3.178 10.017 4.305 468 HG21 VAL 60 3HG2 VAL 60 -4.328 13.519 3.875 469 HG22 VAL 60 1HG2 VAL 60 -4.913 11.909 4.297 470 HG23 VAL 60 2HG2 VAL 60 -4.144 12.188 2.734 471 H GLU 61 H GLU 61 -4.557 13.149 7.579 472 HA GLU 61 HA GLU 61 -5.838 10.499 7.731 473 HB2 GLU 61 1HB GLU 61 -4.717 12.116 9.802 474 HB3 GLU 61 2HB GLU 61 -6.454 12.013 10.058 475 HG2 GLU 61 1HG GLU 61 -6.366 9.620 10.099 476 HG3 GLU 61 2HG GLU 61 -4.662 9.631 9.645 477 H LYS 62 H LYS 62 -7.988 10.368 7.495 478 HA LYS 62 HA LYS 62 -9.696 12.683 7.724 479 HB2 LYS 62 1HB LYS 62 -8.581 12.507 5.319 480 HB3 LYS 62 2HB LYS 62 -9.842 11.310 5.070 481 HG2 LYS 62 1HG LYS 62 -10.861 13.201 4.288 482 HG3 LYS 62 2HG LYS 62 -11.412 13.200 5.962 483 HD2 LYS 62 1HD LYS 62 -8.925 14.665 5.130 484 HD3 LYS 62 2HD LYS 62 -10.522 15.400 4.976 485 HE2 LYS 62 1HE LYS 62 -10.602 14.444 7.526 486 HE3 LYS 62 2HE LYS 62 -8.903 14.891 7.365 487 HZ1 LYS 62 3HZ LYS 62 -9.874 16.830 8.098 488 HZ2 LYS 62 1HZ LYS 62 -11.290 16.606 7.198 489 HZ3 LYS 62 2HZ LYS 62 -9.860 17.073 6.424 490 H GLU 63 H GLU 63 -12.034 12.058 7.359 491 HA GLU 63 HA GLU 63 -12.420 9.265 8.183 492 HB2 GLU 63 1HB GLU 63 -14.559 11.345 8.383 493 HB3 GLU 63 2HB GLU 63 -14.312 9.912 9.366 494 HG2 GLU 63 1HG GLU 63 -13.578 11.383 10.884 495 HG3 GLU 63 2HG GLU 63 -12.077 11.296 9.962 496 H GLU 64 H GLU 64 -12.379 8.376 6.098 497 HA GLU 64 HA GLU 64 -14.899 8.261 4.807 498 HB2 GLU 64 1HB GLU 64 -14.366 9.273 2.681 499 HB3 GLU 64 2HB GLU 64 -14.061 10.449 3.949 500 HG2 GLU 64 1HG GLU 64 -11.620 9.373 3.758 501 HG3 GLU 64 2HG GLU 64 -12.186 9.111 2.109 502 H ASN 65 H ASN 65 -14.999 6.542 3.240 503 HA ASN 65 HA ASN 65 -14.365 4.640 2.178 504 HB2 ASN 65 1HB ASN 65 -12.458 6.072 1.350 505 HB3 ASN 65 2HB ASN 65 -11.491 5.441 2.682 506 HD21 ASN 65 1HD2 ASN 65 -10.345 4.954 0.474 507 HD22 ASN 65 2HD2 ASN 65 -10.601 3.351 -0.118 508 H SER 66 H SER 66 -11.554 4.775 4.302 509 HA SER 66 HA SER 66 -10.724 3.026 5.610 510 HG SER 66 HG SER 66 -10.837 5.261 6.791 511 HB2 SER 66 1HB SER 66 -13.017 4.422 6.904 512 HB3 SER 66 2HB SER 66 -12.321 3.034 7.738 513 H LYS 67 H LYS 67 -11.132 1.135 4.235 514 HA LYS 67 HA LYS 67 -13.523 -0.401 5.009 515 HB2 LYS 67 1HB LYS 67 -12.898 -1.942 3.116 516 HB3 LYS 67 2HB LYS 67 -13.373 -0.327 2.630 517 HG2 LYS 67 1HG LYS 67 -11.564 -0.761 1.284 518 HG3 LYS 67 2HG LYS 67 -10.829 0.153 2.596 519 HD2 LYS 67 1HD LYS 67 -10.295 -2.094 3.661 520 HD3 LYS 67 2HD LYS 67 -10.770 -2.820 2.130 521 HE2 LYS 67 1HE LYS 67 -9.060 -1.537 0.976 522 HE3 LYS 67 2HE LYS 67 -8.610 -0.751 2.484 523 HZ1 LYS 67 3HZ LYS 67 -8.542 -3.582 2.742 524 HZ2 LYS 67 1HZ LYS 67 -7.314 -2.455 3.016 525 HZ3 LYS 67 2HZ LYS 67 -7.558 -3.074 1.465 526 H ASP 68 H ASP 68 -13.308 -2.683 5.537 527 HA ASP 68 HA ASP 68 -10.680 -3.286 6.749 528 HB2 ASP 68 1HB ASP 68 -12.044 -4.627 8.442 529 HB3 ASP 68 2HB ASP 68 -12.126 -2.872 8.565 530 H VAL 69 H VAL 69 -12.763 -4.275 4.345 531 HA VAL 69 HA VAL 69 -11.678 -7.010 4.504 532 HB VAL 69 HB VAL 69 -14.186 -6.821 5.001 533 HG11 VAL 69 1HG1 VAL 69 -15.653 -6.111 3.465 534 HG12 VAL 69 2HG1 VAL 69 -14.811 -6.926 2.147 535 HG13 VAL 69 3HG1 VAL 69 -14.261 -5.346 2.698 536 HG21 VAL 69 3HG2 VAL 69 -13.412 -8.970 4.660 537 HG22 VAL 69 1HG2 VAL 69 -12.928 -8.646 2.996 538 HG23 VAL 69 2HG2 VAL 69 -14.636 -8.815 3.402 539 H VAL 70 H VAL 70 -10.889 -7.896 2.650 540 HA VAL 70 HA VAL 70 -11.385 -6.707 0.070 541 HB VAL 70 HB VAL 70 -9.043 -6.168 -0.439 542 HG11 VAL 70 1HG1 VAL 70 -8.984 -4.049 0.624 543 HG12 VAL 70 2HG1 VAL 70 -9.957 -4.633 1.974 544 HG13 VAL 70 3HG1 VAL 70 -10.678 -4.465 0.375 545 HG21 VAL 70 3HG2 VAL 70 -8.452 -6.394 2.505 546 HG22 VAL 70 1HG2 VAL 70 -7.327 -6.051 1.196 547 HG23 VAL 70 2HG2 VAL 70 -8.041 -7.659 1.343 548 H GLU 71 H GLU 71 -10.395 -7.896 -1.699 549 HA GLU 71 HA GLU 71 -10.031 -10.706 -0.974 550 HB2 GLU 71 1HB GLU 71 -10.222 -9.750 -3.816 551 HB3 GLU 71 2HB GLU 71 -10.692 -11.296 -3.129 552 HG2 GLU 71 1HG GLU 71 -12.649 -10.459 -2.229 553 HG3 GLU 71 2HG GLU 71 -12.107 -8.788 -2.352 554 H LEU 72 H LEU 72 -8.388 -11.984 -1.773 555 HA LEU 72 HA LEU 72 -5.814 -11.148 -1.497 556 HG LEU 72 HG LEU 72 -4.225 -12.586 -3.333 557 HB2 LEU 72 1HB LEU 72 -6.445 -13.496 -1.608 558 HB3 LEU 72 2HB LEU 72 -6.856 -13.340 -3.303 559 HD11 LEU 72 1HD1 LEU 72 -4.288 -14.939 -1.481 560 HD12 LEU 72 2HD1 LEU 72 -4.234 -13.294 -0.850 561 HD13 LEU 72 3HD1 LEU 72 -2.939 -13.882 -1.894 562 HD21 LEU 72 3HD2 LEU 72 -5.542 -15.264 -3.698 563 HD22 LEU 72 1HD2 LEU 72 -3.842 -14.980 -4.072 564 HD23 LEU 72 2HD2 LEU 72 -5.094 -14.084 -4.929 565 H GLY 73 H GLY 73 -4.419 -9.895 -2.618 566 HA2 GLY 73 1HA GLY 73 -3.316 -9.511 -4.783 567 HA3 GLY 73 2HA GLY 73 -4.905 -9.573 -5.520 568 H ASP 74 H ASP 74 -6.109 -7.836 -3.424 569 HA ASP 74 HA ASP 74 -5.433 -5.353 -4.688 570 HB2 ASP 74 1HB ASP 74 -7.143 -4.437 -2.973 571 HB3 ASP 74 2HB ASP 74 -7.711 -5.507 -4.249 572 H VAL 75 H VAL 75 -4.876 -3.394 -3.593 573 HA VAL 75 HA VAL 75 -3.111 -3.850 -1.257 574 HB VAL 75 HB VAL 75 -2.815 -1.637 -3.316 575 HG11 VAL 75 1HG1 VAL 75 -0.709 -2.697 -1.444 576 HG12 VAL 75 2HG1 VAL 75 -1.792 -1.372 -1.007 577 HG13 VAL 75 3HG1 VAL 75 -0.705 -1.204 -2.384 578 HG21 VAL 75 3HG2 VAL 75 -2.293 -4.393 -3.671 579 HG22 VAL 75 1HG2 VAL 75 -0.735 -3.583 -3.504 580 HG23 VAL 75 2HG2 VAL 75 -1.874 -3.054 -4.739 581 H ALA 76 H ALA 76 -3.050 -2.097 0.401 582 HA ALA 76 HA ALA 76 -5.011 0.018 0.109 583 HB1 ALA 76 3HB ALA 76 -6.599 -1.312 1.026 584 HB2 ALA 76 1HB ALA 76 -5.854 -0.743 2.520 585 HB3 ALA 76 2HB ALA 76 -5.428 -2.323 1.866 586 H TYR 77 H TYR 77 -4.823 1.717 1.618 587 HA TYR 77 HA TYR 77 -2.230 1.769 2.998 588 HD1 TYR 77 HD2 TYR 77 -5.415 4.766 3.022 589 HD2 TYR 77 HD1 TYR 77 -1.224 5.042 3.694 590 HE1 TYR 77 HE2 TYR 77 -5.787 6.633 4.577 591 HE2 TYR 77 HE1 TYR 77 -1.586 6.909 5.244 592 HH TYR 77 HH TYR 77 -3.237 8.591 5.747 593 HB2 TYR 77 1HB TYR 77 -2.055 3.726 1.897 594 HB3 TYR 77 2HB TYR 77 -3.759 3.724 1.468 595 H TRP 78 H TRP 78 -2.178 1.650 5.151 596 HA TRP 78 HA TRP 78 -4.552 1.396 6.677 597 HD1 TRP 78 HD1 TRP 78 -5.264 1.707 8.772 598 HE1 TRP 78 HE1 TRP 78 -5.618 0.597 11.066 599 HE3 TRP 78 HE3 TRP 78 -0.648 -0.408 9.360 600 HZ2 TRP 78 HZ2 TRP 78 -4.132 -0.977 12.883 601 HZ3 TRP 78 HZ3 TRP 78 -0.196 -1.701 11.405 602 HH2 TRP 78 HH2 TRP 78 -1.903 -1.979 13.128 603 HB2 TRP 78 1HB TRP 78 -2.192 0.455 7.168 604 HB3 TRP 78 2HB TRP 78 -1.873 2.028 7.890 605 H ILE 79 H ILE 79 -5.877 2.974 7.365 606 HA ILE 79 HA ILE 79 -5.145 5.710 7.160 607 HB ILE 79 HB ILE 79 -7.579 4.286 8.161 608 HG12 ILE 79 1HG1 ILE 79 -6.719 5.483 5.731 609 HG13 ILE 79 2HG1 ILE 79 -8.225 4.646 6.066 610 HG21 ILE 79 1HG2 ILE 79 -8.636 6.486 8.619 611 HG22 ILE 79 2HG2 ILE 79 -7.040 7.230 8.495 612 HG23 ILE 79 3HG2 ILE 79 -7.368 6.053 9.768 613 HD11 ILE 79 3HD1 ILE 79 -9.236 6.747 6.786 614 HD12 ILE 79 1HD1 ILE 79 -8.624 6.856 5.137 615 HD13 ILE 79 2HD1 ILE 79 -7.722 7.591 6.462 616 HA PRO 80 HA PRO 80 -5.184 5.918 12.014 617 HB2 PRO 80 1HB PRO 80 -5.186 3.044 12.745 618 HB3 PRO 80 2HB PRO 80 -6.034 4.396 13.499 619 HG2 PRO 80 1HG PRO 80 -7.331 2.588 12.015 620 HG3 PRO 80 2HG PRO 80 -7.789 4.301 12.004 621 HD2 PRO 80 1HD PRO 80 -6.279 2.729 9.969 622 HD3 PRO 80 2HD PRO 80 -7.455 4.034 9.752 623 H GLY 81 H GLY 81 -3.067 6.425 11.067 624 HA2 GLY 81 1HA GLY 81 -0.847 5.966 12.239 625 HA3 GLY 81 2HA GLY 81 -1.022 4.351 11.565 626 H LYS 82 H LYS 82 -2.363 6.130 9.235 627 HA LYS 82 HA LYS 82 -1.664 6.672 7.109 628 HB2 LYS 82 1HB LYS 82 0.755 8.065 8.091 629 HB3 LYS 82 2HB LYS 82 -0.515 8.631 7.021 630 HG2 LYS 82 1HG LYS 82 -1.113 9.931 8.729 631 HG3 LYS 82 2HG LYS 82 -1.826 8.475 9.420 632 HD2 LYS 82 1HD LYS 82 0.506 8.056 10.415 633 HD3 LYS 82 2HD LYS 82 0.818 9.749 10.033 634 HE2 LYS 82 1HE LYS 82 -1.712 9.567 11.326 635 HE3 LYS 82 2HE LYS 82 -0.533 8.663 12.278 636 HZ1 LYS 82 3HZ LYS 82 -0.893 11.288 12.487 637 HZ2 LYS 82 1HZ LYS 82 0.340 11.263 11.328 638 HZ3 LYS 82 2HZ LYS 82 0.577 10.523 12.830 639 H ALA 83 H ALA 83 -0.754 4.149 7.928 640 HA ALA 83 HA ALA 83 1.906 4.014 6.660 641 HB1 ALA 83 3HB ALA 83 2.577 2.821 8.408 642 HB2 ALA 83 1HB ALA 83 1.348 1.605 8.057 643 HB3 ALA 83 2HB ALA 83 0.973 2.956 9.126 644 H ILE 84 H ILE 84 2.186 2.749 4.888 645 HA ILE 84 HA ILE 84 -0.177 1.588 3.656 646 HB ILE 84 HB ILE 84 2.649 1.529 2.611 647 HG12 ILE 84 1HG1 ILE 84 0.506 3.586 2.059 648 HG13 ILE 84 2HG1 ILE 84 1.939 3.857 3.044 649 HG21 ILE 84 1HG2 ILE 84 0.013 0.752 1.557 650 HG22 ILE 84 2HG2 ILE 84 1.615 0.110 1.200 651 HG23 ILE 84 3HG2 ILE 84 1.074 1.605 0.438 652 HD11 ILE 84 3HD1 ILE 84 1.636 4.214 0.273 653 HD12 ILE 84 1HD1 ILE 84 2.734 2.853 0.497 654 HD13 ILE 84 2HD1 ILE 84 3.096 4.410 1.242 655 H CYS 85 H CYS 85 -0.465 -0.617 3.170 656 HA CYS 85 HA CYS 85 1.548 -2.476 4.217 657 HG CYS 85 HG CYS 85 0.380 -1.081 6.611 658 HB2 CYS 85 1HB CYS 85 -1.327 -3.004 4.869 659 HB3 CYS 85 2HB CYS 85 0.122 -3.607 5.668 660 H LEU 86 H LEU 86 1.883 -4.256 2.990 661 HA LEU 86 HA LEU 86 0.279 -4.585 0.579 662 HG LEU 86 HG LEU 86 1.755 -4.426 -0.997 663 HB2 LEU 86 1HB LEU 86 2.972 -5.157 1.368 664 HB3 LEU 86 2HB LEU 86 2.227 -6.656 0.844 665 HD11 LEU 86 1HD1 LEU 86 4.538 -5.493 -1.027 666 HD12 LEU 86 2HD1 LEU 86 4.149 -4.132 0.029 667 HD13 LEU 86 3HD1 LEU 86 3.894 -3.999 -1.711 668 HD21 LEU 86 3HD2 LEU 86 2.833 -7.235 -1.256 669 HD22 LEU 86 1HD2 LEU 86 2.528 -6.148 -2.614 670 HD23 LEU 86 2HD2 LEU 86 1.190 -6.685 -1.597 671 H PHE 87 H PHE 87 -0.570 -6.718 -0.046 672 HA PHE 87 HA PHE 87 -1.094 -8.512 2.216 673 HD1 PHE 87 HD1 PHE 87 -2.761 -7.392 3.958 674 HD2 PHE 87 HD2 PHE 87 -3.616 -5.428 0.286 675 HE1 PHE 87 HE1 PHE 87 -3.176 -5.300 5.182 676 HE2 PHE 87 HE2 PHE 87 -4.034 -3.338 1.502 677 HZ PHE 87 HZ PHE 87 -3.814 -3.264 3.952 678 HB2 PHE 87 1HB PHE 87 -3.271 -7.707 0.291 679 HB3 PHE 87 2HB PHE 87 -3.432 -8.617 1.791 680 H PHE 88 H PHE 88 -0.360 -10.439 1.678 681 HA PHE 88 HA PHE 88 -1.176 -11.671 -0.796 682 HD1 PHE 88 HD2 PHE 88 0.089 -9.472 -2.675 683 HD2 PHE 88 HD1 PHE 88 1.346 -13.532 -2.464 684 HE1 PHE 88 HE2 PHE 88 -0.233 -9.695 -5.104 685 HE2 PHE 88 HE1 PHE 88 1.027 -13.763 -4.891 686 HZ PHE 88 HZ PHE 88 0.234 -11.843 -6.216 687 HB2 PHE 88 1HB PHE 88 1.312 -10.355 -0.730 688 HB3 PHE 88 2HB PHE 88 1.676 -12.072 -0.616 689 H GLY 89 H GLY 89 -1.753 -12.239 1.897 690 HA2 GLY 89 1HA GLY 89 -1.394 -14.987 2.011 691 HA3 GLY 89 2HA GLY 89 -0.070 -14.299 2.938 692 H LYS 90 H LYS 90 -0.536 -13.180 4.879 693 HA LYS 90 HA LYS 90 -3.288 -13.368 5.860 694 HB2 LYS 90 1HB LYS 90 -2.696 -14.434 7.858 695 HB3 LYS 90 2HB LYS 90 -1.868 -15.340 6.611 696 HG2 LYS 90 1HG LYS 90 0.050 -15.036 7.679 697 HG3 LYS 90 2HG LYS 90 -0.118 -13.291 7.493 698 HD2 LYS 90 1HD LYS 90 -1.799 -13.614 9.500 699 HD3 LYS 90 2HD LYS 90 -0.804 -15.038 9.796 700 HE2 LYS 90 1HE LYS 90 0.721 -12.599 9.253 701 HE3 LYS 90 2HE LYS 90 -0.268 -12.517 10.709 702 HZ1 LYS 90 3HZ LYS 90 1.670 -14.686 10.107 703 HZ2 LYS 90 1HZ LYS 90 0.785 -14.493 11.537 704 HZ3 LYS 90 2HZ LYS 90 1.980 -13.371 11.126 705 H THR 91 H THR 91 -2.960 -12.514 8.389 706 HA THR 91 HA THR 91 -1.387 -10.083 8.445 707 HB THR 91 HB THR 91 -4.042 -9.342 9.247 708 HG1 THR 91 HG1 THR 91 -4.871 -10.808 7.812 709 HG21 THR 91 3HG2 THR 91 -1.895 -8.246 7.757 710 HG22 THR 91 1HG2 THR 91 -3.303 -7.430 8.435 711 HG23 THR 91 2HG2 THR 91 -3.370 -8.098 6.805 712 HA PRO 92 HA PRO 92 -1.311 -10.349 12.869 713 HB2 PRO 92 1HB PRO 92 -3.557 -8.397 13.176 714 HB3 PRO 92 2HB PRO 92 -1.995 -8.455 14.004 715 HG2 PRO 92 1HG PRO 92 -2.400 -6.717 12.040 716 HG3 PRO 92 2HG PRO 92 -0.851 -7.568 12.183 717 HD2 PRO 92 1HD PRO 92 -3.087 -8.012 10.267 718 HD3 PRO 92 2HD PRO 92 -1.339 -8.194 10.022 719 H ILE 93 H ILE 93 -4.365 -10.742 11.257 720 HA ILE 93 HA ILE 93 -5.120 -12.739 13.245 721 HB ILE 93 HB ILE 93 -7.516 -11.862 13.128 722 HG12 ILE 93 1HG1 ILE 93 -6.013 -9.422 12.152 723 HG13 ILE 93 2HG1 ILE 93 -7.248 -10.315 11.273 724 HG21 ILE 93 1HG2 ILE 93 -5.311 -10.421 14.579 725 HG22 ILE 93 2HG2 ILE 93 -6.360 -11.706 15.179 726 HG23 ILE 93 3HG2 ILE 93 -7.017 -10.098 14.881 727 HD11 ILE 93 3HD1 ILE 93 -7.846 -8.993 13.891 728 HD12 ILE 93 1HD1 ILE 93 -8.961 -9.498 12.622 729 HD13 ILE 93 2HD1 ILE 93 -7.906 -8.108 12.367 730 H SER 94 H SER 94 -4.241 -13.777 11.052 731 HA SER 94 HA SER 94 -5.763 -13.860 8.735 732 HG SER 94 HG SER 94 -2.645 -15.937 9.796 733 HB2 SER 94 1HB SER 94 -4.759 -16.500 9.441 734 HB3 SER 94 2HB SER 94 -4.272 -15.427 8.130 735 H ASP 95 H ASP 95 -5.802 -16.486 11.135 736 HA ASP 95 HA ASP 95 -7.438 -17.857 11.896 737 HB2 ASP 95 1HB ASP 95 -8.987 -15.351 11.334 738 HB3 ASP 95 2HB ASP 95 -9.832 -16.815 11.827 739 H ASP 96 H ASP 96 -9.796 -16.497 9.701 740 HA ASP 96 HA ASP 96 -9.527 -18.887 8.001 741 HB2 ASP 96 1HB ASP 96 -11.885 -17.726 9.358 742 HB3 ASP 96 2HB ASP 96 -12.142 -18.238 7.692 743 H LYS 97 H LYS 97 -9.272 -15.584 8.084 744 HA LYS 97 HA LYS 97 -9.340 -15.416 5.190 745 HB2 LYS 97 1HB LYS 97 -10.865 -13.376 6.802 746 HB3 LYS 97 2HB LYS 97 -10.845 -13.583 5.056 747 HG2 LYS 97 1HG LYS 97 -11.928 -15.830 5.430 748 HG3 LYS 97 2HG LYS 97 -12.161 -15.336 7.109 749 HD2 LYS 97 1HD LYS 97 -13.033 -13.269 5.291 750 HD3 LYS 97 2HD LYS 97 -13.837 -14.800 4.940 751 HE2 LYS 97 1HE LYS 97 -15.259 -14.114 6.550 752 HE3 LYS 97 2HE LYS 97 -14.027 -14.773 7.625 753 HZ1 LYS 97 3HZ LYS 97 -13.101 -12.311 7.284 754 HZ2 LYS 97 1HZ LYS 97 -14.170 -12.730 8.527 755 HZ3 LYS 97 2HZ LYS 97 -14.755 -12.006 7.113 756 H ILE 98 H ILE 98 -9.110 -12.601 5.039 757 HA ILE 98 HA ILE 98 -6.589 -12.164 6.503 758 HB ILE 98 HB ILE 98 -7.340 -11.374 3.694 759 HG12 ILE 98 1HG1 ILE 98 -4.863 -12.785 4.701 760 HG13 ILE 98 2HG1 ILE 98 -6.317 -13.643 4.189 761 HG21 ILE 98 1HG2 ILE 98 -5.545 -10.021 5.556 762 HG22 ILE 98 2HG2 ILE 98 -6.229 -9.464 4.029 763 HG23 ILE 98 3HG2 ILE 98 -4.777 -10.466 4.032 764 HD11 ILE 98 3HD1 ILE 98 -5.669 -13.526 2.084 765 HD12 ILE 98 1HD1 ILE 98 -4.179 -12.744 2.609 766 HD13 ILE 98 2HD1 ILE 98 -5.581 -11.765 2.173 767 H ARG 99 H ARG 99 -7.201 -10.880 8.155 768 HA ARG 99 HA ARG 99 -8.888 -8.552 7.571 769 HE ARG 99 HE ARG 99 -12.713 -8.187 8.125 770 HB2 ARG 99 1HB ARG 99 -8.768 -10.321 9.758 771 HB3 ARG 99 2HB ARG 99 -8.118 -8.799 10.347 772 HG2 ARG 99 1HG ARG 99 -10.485 -8.895 10.764 773 HG3 ARG 99 2HG ARG 99 -10.144 -7.650 9.560 774 HD2 ARG 99 1HD ARG 99 -10.736 -9.277 7.784 775 HD3 ARG 99 2HD ARG 99 -11.188 -10.431 9.038 776 HH11 ARG 99 1HH1 ARG 99 -12.103 -10.277 10.853 777 HH12 ARG 99 2HH1 ARG 99 -13.659 -10.009 11.565 778 HH21 ARG 99 1HH2 ARG 99 -14.760 -7.833 9.062 779 HH22 ARG 99 2HH2 ARG 99 -15.167 -8.622 10.548 780 HA PRO 100 HA PRO 100 -4.795 -6.560 7.439 781 HB2 PRO 100 1HB PRO 100 -5.642 -4.325 6.149 782 HB3 PRO 100 2HB PRO 100 -5.299 -5.845 5.316 783 HG2 PRO 100 1HG PRO 100 -7.936 -4.738 6.206 784 HG3 PRO 100 2HG PRO 100 -7.504 -5.482 4.653 785 HD2 PRO 100 1HD PRO 100 -8.793 -6.848 6.582 786 HD3 PRO 100 2HD PRO 100 -7.612 -7.624 5.507 787 H ALA 101 H ALA 101 -7.871 -5.210 8.513 788 HA ALA 101 HA ALA 101 -6.925 -4.279 10.973 789 HB1 ALA 101 3HB ALA 101 -7.330 -1.758 9.598 790 HB2 ALA 101 1HB ALA 101 -5.957 -2.650 8.942 791 HB3 ALA 101 2HB ALA 101 -6.020 -2.270 10.663 792 H SER 102 H SER 102 -8.468 -1.884 11.206 793 HA SER 102 HA SER 102 -11.164 -3.001 10.843 794 HG SER 102 HG SER 102 -9.396 -1.584 13.974 795 HB2 SER 102 1HB SER 102 -10.957 -0.841 12.799 796 HB3 SER 102 2HB SER 102 -11.660 -2.450 12.966 797 H ALA 103 H ALA 103 -9.135 -0.581 9.688 798 HA ALA 103 HA ALA 103 -11.282 0.664 8.276 799 HB1 ALA 103 3HB ALA 103 -11.666 1.782 10.358 800 HB2 ALA 103 1HB ALA 103 -10.978 2.936 9.214 801 HB3 ALA 103 2HB ALA 103 -9.965 2.237 10.477 802 H VAL 104 H VAL 104 -9.537 -0.286 6.777 803 HA VAL 104 HA VAL 104 -7.542 1.828 6.245 804 HB VAL 104 HB VAL 104 -6.005 0.246 5.323 805 HG11 VAL 104 1HG1 VAL 104 -5.296 -0.714 7.267 806 HG12 VAL 104 2HG1 VAL 104 -6.905 -1.275 7.710 807 HG13 VAL 104 3HG1 VAL 104 -6.479 0.422 7.912 808 HG21 VAL 104 3HG2 VAL 104 -6.415 -1.988 4.857 809 HG22 VAL 104 1HG2 VAL 104 -7.925 -1.219 4.377 810 HG23 VAL 104 2HG2 VAL 104 -7.817 -2.063 5.920 811 H ASN 105 H ASN 105 -7.253 2.597 4.205 812 HA ASN 105 HA ASN 105 -9.519 2.339 2.442 813 HB2 ASN 105 1HB ASN 105 -7.019 3.932 1.891 814 HB3 ASN 105 2HB ASN 105 -8.652 4.227 1.300 815 HD21 ASN 105 1HD2 ASN 105 -9.942 3.787 3.820 816 HD22 ASN 105 2HD2 ASN 105 -9.582 5.153 4.811 817 H VAL 106 H VAL 106 -9.455 1.800 0.230 818 HA VAL 106 HA VAL 106 -7.465 -0.213 -0.452 819 HB VAL 106 HB VAL 106 -9.163 0.235 -2.678 820 HG11 VAL 106 1HG1 VAL 106 -9.632 -2.026 -0.812 821 HG12 VAL 106 2HG1 VAL 106 -8.045 -1.862 -1.569 822 HG13 VAL 106 3HG1 VAL 106 -9.489 -2.015 -2.571 823 HG21 VAL 106 3HG2 VAL 106 -10.865 1.305 -1.508 824 HG22 VAL 106 1HG2 VAL 106 -10.640 0.306 -0.072 825 HG23 VAL 106 2HG2 VAL 106 -11.370 -0.386 -1.520 826 H ILE 107 H ILE 107 -5.665 1.116 -0.712 827 HA ILE 107 HA ILE 107 -5.627 3.379 -2.414 828 HB ILE 107 HB ILE 107 -4.056 2.634 -0.438 829 HG12 ILE 107 1HG1 ILE 107 -3.966 4.593 -2.473 830 HG13 ILE 107 2HG1 ILE 107 -3.237 4.657 -0.876 831 HG21 ILE 107 1HG2 ILE 107 -3.211 0.638 -1.626 832 HG22 ILE 107 2HG2 ILE 107 -1.935 1.741 -1.120 833 HG23 ILE 107 3HG2 ILE 107 -2.443 1.701 -2.804 834 HD11 ILE 107 3HD1 ILE 107 -1.956 3.636 -3.394 835 HD12 ILE 107 1HD1 ILE 107 -1.223 3.586 -1.791 836 HD13 ILE 107 2HD1 ILE 107 -1.588 5.139 -2.546 837 H GLY 108 H GLY 108 -6.424 0.613 -3.564 838 HA2 GLY 108 1HA GLY 108 -6.344 0.385 -5.991 839 HA3 GLY 108 2HA GLY 108 -4.640 0.797 -5.903 840 H ARG 109 H ARG 109 -4.023 -1.086 -6.998 841 HA ARG 109 HA ARG 109 -3.738 -3.384 -5.278 842 HE ARG 109 HE ARG 109 -6.390 -6.199 -6.184 843 HB2 ARG 109 1HB ARG 109 -5.064 -3.818 -7.950 844 HB3 ARG 109 2HB ARG 109 -4.824 -4.989 -6.661 845 HG2 ARG 109 1HG ARG 109 -6.414 -3.751 -5.257 846 HG3 ARG 109 2HG ARG 109 -6.674 -2.614 -6.580 847 HD2 ARG 109 1HD ARG 109 -8.451 -4.229 -6.580 848 HD3 ARG 109 2HD ARG 109 -7.430 -4.497 -7.991 849 HH11 ARG 109 1HH1 ARG 109 -9.653 -5.643 -7.291 850 HH12 ARG 109 2HH1 ARG 109 -10.155 -7.278 -7.022 851 HH21 ARG 109 1HH2 ARG 109 -7.050 -8.350 -5.831 852 HH22 ARG 109 2HH2 ARG 109 -8.678 -8.814 -6.194 853 H ILE 110 H ILE 110 -2.465 -5.145 -6.400 854 HA ILE 110 HA ILE 110 -0.319 -3.876 -7.936 855 HB ILE 110 HB ILE 110 -0.413 -6.610 -6.650 856 HG12 ILE 110 1HG1 ILE 110 1.525 -4.840 -5.491 857 HG13 ILE 110 2HG1 ILE 110 -0.038 -4.031 -5.495 858 HG21 ILE 110 1HG2 ILE 110 1.912 -5.114 -7.851 859 HG22 ILE 110 2HG2 ILE 110 1.104 -6.511 -8.562 860 HG23 ILE 110 3HG2 ILE 110 1.989 -6.681 -7.047 861 HD11 ILE 110 3HD1 ILE 110 -1.019 -5.898 -4.284 862 HD12 ILE 110 1HD1 ILE 110 0.367 -5.237 -3.418 863 HD13 ILE 110 2HD1 ILE 110 0.529 -6.745 -4.317 864 H VAL 111 H VAL 111 -0.478 -3.998 -10.090 865 HA VAL 111 HA VAL 111 -1.750 -6.376 -11.269 866 HB VAL 111 HB VAL 111 -1.647 -4.734 -13.386 867 HG11 VAL 111 1HG1 VAL 111 -3.923 -4.602 -13.198 868 HG12 VAL 111 2HG1 VAL 111 -3.872 -4.239 -11.473 869 HG13 VAL 111 3HG1 VAL 111 -3.590 -5.886 -12.037 870 HG21 VAL 111 3HG2 VAL 111 -1.846 -2.485 -12.925 871 HG22 VAL 111 1HG2 VAL 111 -0.642 -2.977 -11.734 872 HG23 VAL 111 2HG2 VAL 111 -2.324 -2.760 -11.250 873 H ASN 112 H ASN 112 0.384 -4.098 -12.941 874 HA ASN 112 HA ASN 112 1.858 -6.219 -14.142 875 HB2 ASN 112 1HB ASN 112 3.320 -4.380 -14.998 876 HB3 ASN 112 2HB ASN 112 1.607 -4.133 -15.328 877 HD21 ASN 112 1HD2 ASN 112 2.876 -1.949 -15.598 878 HD22 ASN 112 2HD2 ASN 112 2.767 -0.900 -14.228 879 H SER 113 H SER 113 4.030 -6.800 -13.854 880 HA SER 113 HA SER 113 5.916 -7.307 -12.687 881 HG SER 113 HG SER 113 7.690 -6.166 -12.384 882 HB2 SER 113 1HB SER 113 5.842 -4.638 -12.562 883 HB3 SER 113 2HB SER 113 5.635 -4.982 -10.846 884 H MET 114 H MET 114 3.362 -8.318 -11.836 885 HA MET 114 HA MET 114 2.963 -8.233 -9.073 886 HB2 MET 114 1HB MET 114 1.716 -9.459 -11.175 887 HB3 MET 114 2HB MET 114 2.432 -10.835 -10.346 888 HG2 MET 114 1HG MET 114 0.851 -10.793 -8.805 889 HG3 MET 114 2HG MET 114 1.202 -9.108 -8.429 890 HE1 MET 114 3HE MET 114 -1.051 -11.617 -9.547 891 HE2 MET 114 1HE MET 114 -0.981 -11.258 -11.274 892 HE3 MET 114 2HE MET 114 -2.414 -10.826 -10.339 893 H GLU 115 H GLU 115 4.345 -8.761 -7.516 894 HA GLU 115 HA GLU 115 6.096 -11.092 -7.939 895 HB2 GLU 115 1HB GLU 115 6.949 -8.493 -7.689 896 HB3 GLU 115 2HB GLU 115 7.088 -9.092 -6.041 897 HG2 GLU 115 1HG GLU 115 9.166 -9.537 -6.946 898 HG3 GLU 115 2HG GLU 115 8.329 -11.081 -7.088 899 H GLY 116 H GLY 116 7.080 -11.750 -5.699 900 HA2 GLY 116 1HA GLY 116 4.790 -12.112 -3.884 901 HA3 GLY 116 2HA GLY 116 6.150 -13.214 -4.032 902 H LEU 117 H LEU 117 6.062 -9.686 -3.613 903 HA LEU 117 HA LEU 117 8.222 -9.353 -2.031 904 HG LEU 117 HG LEU 117 8.205 -7.322 -0.522 905 HB2 LEU 117 1HB LEU 117 6.885 -7.493 -2.849 906 HB3 LEU 117 2HB LEU 117 5.576 -7.920 -1.765 907 HD11 LEU 117 1HD1 LEU 117 8.191 -5.526 -2.057 908 HD12 LEU 117 2HD1 LEU 117 7.600 -4.883 -0.524 909 HD13 LEU 117 3HD1 LEU 117 6.464 -5.248 -1.821 910 HD21 LEU 117 3HD2 LEU 117 6.976 -6.950 1.321 911 HD22 LEU 117 1HD2 LEU 117 5.736 -7.856 0.454 912 HD23 LEU 117 2HD2 LEU 117 5.717 -6.092 0.435 913 H LYS 118 H LYS 118 5.062 -10.483 -0.968 914 HA LYS 118 HA LYS 118 5.148 -10.294 1.734 915 HB2 LYS 118 1HB LYS 118 3.993 -12.558 1.797 916 HB3 LYS 118 2HB LYS 118 3.246 -11.322 0.797 917 HG2 LYS 118 1HG LYS 118 3.128 -13.130 -0.594 918 HG3 LYS 118 2HG LYS 118 4.667 -12.444 -1.105 919 HD2 LYS 118 1HD LYS 118 4.909 -14.827 -0.840 920 HD3 LYS 118 2HD LYS 118 5.816 -14.017 0.435 921 HE2 LYS 118 1HE LYS 118 3.112 -14.510 1.284 922 HE3 LYS 118 2HE LYS 118 3.864 -16.003 0.725 923 HZ1 LYS 118 3HZ LYS 118 5.729 -15.551 2.223 924 HZ2 LYS 118 1HZ LYS 118 4.269 -15.695 3.064 925 HZ3 LYS 118 2HZ LYS 118 4.942 -14.167 2.794 926 H GLY 119 H GLY 119 7.304 -12.263 -0.185 927 HA2 GLY 119 1HA GLY 119 8.221 -13.727 2.173 928 HA3 GLY 119 2HA GLY 119 8.714 -14.023 0.512 929 H VAL 120 H VAL 120 8.704 -10.918 2.174 930 HA VAL 120 HA VAL 120 11.443 -10.450 1.434 931 HB VAL 120 HB VAL 120 11.101 -8.308 2.789 932 HG11 VAL 120 1HG1 VAL 120 10.615 -7.382 0.830 933 HG12 VAL 120 2HG1 VAL 120 9.019 -8.129 0.797 934 HG13 VAL 120 3HG1 VAL 120 10.420 -9.018 0.198 935 HG21 VAL 120 3HG2 VAL 120 9.238 -7.979 3.954 936 HG22 VAL 120 1HG2 VAL 120 8.815 -9.663 3.648 937 HG23 VAL 120 2HG2 VAL 120 8.231 -8.398 2.569 938 H ALA 121 H ALA 121 13.174 -9.911 2.915 939 HA ALA 121 HA ALA 121 13.249 -11.650 5.213 940 HB1 ALA 121 3HB ALA 121 15.366 -9.644 4.476 941 HB2 ALA 121 1HB ALA 121 15.182 -11.168 3.605 942 HB3 ALA 121 2HB ALA 121 15.551 -11.178 5.328 943 H ASP 122 H ASP 122 13.520 -10.996 7.402 944 HA ASP 122 HA ASP 122 11.920 -8.956 8.290 945 HB2 ASP 122 1HB ASP 122 12.848 -9.239 10.467 946 HB3 ASP 122 2HB ASP 122 12.771 -10.819 9.689 947 H GLY 123 H GLY 123 12.024 -6.877 7.876 948 HA2 GLY 123 1HA GLY 123 12.786 -4.718 7.912 949 HA3 GLY 123 2HA GLY 123 14.178 -5.292 8.808 950 H GLU 124 H GLU 124 13.144 -3.920 5.939 951 HA GLU 124 HA GLU 124 15.812 -3.981 4.876 952 HB2 GLU 124 1HB GLU 124 15.118 -4.772 2.616 953 HB3 GLU 124 2HB GLU 124 15.047 -6.015 3.852 954 HG2 GLU 124 1HG GLU 124 12.523 -4.589 3.481 955 HG3 GLU 124 2HG GLU 124 13.081 -5.447 2.049 956 H SER 125 H SER 125 16.287 -2.202 3.663 957 HA SER 125 HA SER 125 14.955 0.147 3.939 958 HG SER 125 HG SER 125 15.600 1.650 1.606 959 HB2 SER 125 1HB SER 125 17.229 -0.329 2.816 960 HB3 SER 125 2HB SER 125 16.310 -0.467 1.319 961 H VAL 126 H VAL 126 13.779 1.515 2.437 962 HA VAL 126 HA VAL 126 12.180 0.253 0.380 963 HB VAL 126 HB VAL 126 10.787 1.495 2.761 964 HG11 VAL 126 1HG1 VAL 126 9.734 0.193 0.262 965 HG12 VAL 126 2HG1 VAL 126 9.543 1.876 0.755 966 HG13 VAL 126 3HG1 VAL 126 8.749 0.593 1.667 967 HG21 VAL 126 3HG2 VAL 126 11.535 -0.582 3.539 968 HG22 VAL 126 1HG2 VAL 126 11.201 -1.375 1.998 969 HG23 VAL 126 2HG2 VAL 126 9.871 -0.854 3.031 970 H VAL 127 H VAL 127 11.845 1.685 -1.238 971 HA VAL 127 HA VAL 127 11.943 4.553 -0.572 972 HB VAL 127 HB VAL 127 13.068 4.973 -2.741 973 HG11 VAL 127 1HG1 VAL 127 14.189 4.173 -0.364 974 HG12 VAL 127 2HG1 VAL 127 15.049 4.904 -1.717 975 HG13 VAL 127 3HG1 VAL 127 15.003 3.150 -1.548 976 HG21 VAL 127 3HG2 VAL 127 13.170 3.390 -4.287 977 HG22 VAL 127 1HG2 VAL 127 12.459 2.227 -3.170 978 HG23 VAL 127 2HG2 VAL 127 14.208 2.430 -3.235 979 H VAL 128 H VAL 128 9.935 5.270 -0.852 980 HA VAL 128 HA VAL 128 8.177 4.142 -2.854 981 HB VAL 128 HB VAL 128 7.323 6.626 -1.514 982 HG11 VAL 128 1HG1 VAL 128 5.416 4.918 -0.912 983 HG12 VAL 128 2HG1 VAL 128 6.173 3.960 -2.182 984 HG13 VAL 128 3HG1 VAL 128 5.562 5.577 -2.539 985 HG21 VAL 128 3HG2 VAL 128 8.350 4.328 0.050 986 HG22 VAL 128 1HG2 VAL 128 6.823 5.037 0.572 987 HG23 VAL 128 2HG2 VAL 128 8.270 6.041 0.466 988 H GLU 129 H GLU 129 7.845 4.987 -4.885 989 HA GLU 129 HA GLU 129 8.303 7.798 -5.398 990 HB2 GLU 129 1HB GLU 129 9.826 7.262 -7.339 991 HB3 GLU 129 2HB GLU 129 10.531 7.039 -5.744 992 HG2 GLU 129 1HG GLU 129 9.486 4.565 -6.286 993 HG3 GLU 129 2HG GLU 129 10.046 5.109 -7.867 994 H ARG 130 H ARG 130 6.858 8.540 -6.846 995 HA ARG 130 HA ARG 130 4.990 6.739 -8.057 996 HE ARG 130 HE ARG 130 2.340 10.895 -10.237 997 HB2 ARG 130 1HB ARG 130 4.256 8.910 -7.246 998 HB3 ARG 130 2HB ARG 130 5.369 9.727 -8.332 999 HG2 ARG 130 1HG ARG 130 3.433 7.912 -9.610 1000 HG3 ARG 130 2HG ARG 130 2.764 9.358 -8.851 1001 HD2 ARG 130 1HD ARG 130 4.987 10.284 -10.220 1002 HD3 ARG 130 2HD ARG 130 4.286 9.084 -11.305 1003 HH11 ARG 130 1HH1 ARG 130 4.745 10.466 -12.729 1004 HH12 ARG 130 2HH1 ARG 130 3.999 11.589 -13.816 1005 HH21 ARG 130 1HH2 ARG 130 1.359 12.373 -11.665 1006 HH22 ARG 130 2HH2 ARG 130 2.076 12.672 -13.212 1007 H ALA 131 H ALA 131 6.198 5.460 -9.472 1008 HA ALA 131 HA ALA 131 7.365 4.890 -11.364 1009 HB1 ALA 131 3HB ALA 131 5.156 5.294 -12.246 1010 HB2 ALA 131 1HB ALA 131 6.374 5.801 -13.417 1011 HB3 ALA 131 2HB ALA 131 5.521 7.007 -12.452 Start of MODEL 16 1 H MET 1 H MET 1 -18.377 4.554 -15.239 2 HA MET 1 HA MET 1 -16.963 3.917 -13.378 3 HB2 MET 1 1HB MET 1 -16.604 1.636 -14.830 4 HB3 MET 1 2HB MET 1 -15.125 2.508 -15.208 5 HG2 MET 1 1HG MET 1 -14.415 1.419 -13.362 6 HG3 MET 1 2HG MET 1 -15.105 2.837 -12.576 7 HE1 MET 1 3HE MET 1 -16.336 0.679 -9.857 8 HE2 MET 1 1HE MET 1 -15.131 1.816 -10.460 9 HE3 MET 1 2HE MET 1 -14.869 0.080 -10.632 10 H GLY 2 H GLY 2 -15.065 5.143 -13.061 11 HA2 GLY 2 1HA GLY 2 -13.170 6.353 -13.981 12 HA3 GLY 2 2HA GLY 2 -14.126 6.637 -15.426 13 H GLU 3 H GLU 3 -12.950 8.059 -12.710 14 HA GLU 3 HA GLU 3 -15.120 10.052 -12.657 15 HB2 GLU 3 1HB GLU 3 -14.479 8.628 -10.534 16 HB3 GLU 3 2HB GLU 3 -13.167 9.791 -10.407 17 HG2 GLU 3 1HG GLU 3 -14.984 10.520 -9.038 18 HG3 GLU 3 2HG GLU 3 -14.837 11.613 -10.412 19 H ARG 4 H ARG 4 -12.903 9.989 -14.515 20 HA ARG 4 HA ARG 4 -11.395 11.406 -15.461 21 HE ARG 4 HE ARG 4 -15.073 12.288 -13.314 22 HB2 ARG 4 1HB ARG 4 -12.804 13.283 -13.574 23 HB3 ARG 4 2HB ARG 4 -11.497 13.829 -14.616 24 HG2 ARG 4 1HG ARG 4 -13.402 14.344 -15.828 25 HG3 ARG 4 2HG ARG 4 -12.873 12.816 -16.533 26 HD2 ARG 4 1HD ARG 4 -15.353 13.050 -16.043 27 HD3 ARG 4 2HD ARG 4 -14.559 11.601 -15.426 28 HH11 ARG 4 1HH1 ARG 4 -15.230 15.056 -15.433 29 HH12 ARG 4 2HH1 ARG 4 -15.843 16.116 -14.209 30 HH21 ARG 4 1HH2 ARG 4 -15.878 13.681 -11.702 31 HH22 ARG 4 2HH2 ARG 4 -16.210 15.335 -12.090 32 H GLY 5 H GLY 5 -10.818 9.930 -12.823 33 HA2 GLY 5 1HA GLY 5 -8.140 10.921 -12.548 34 HA3 GLY 5 2HA GLY 5 -9.131 11.283 -11.142 35 H VAL 6 H VAL 6 -9.061 8.424 -13.245 36 HA VAL 6 HA VAL 6 -8.282 6.829 -10.882 37 HB VAL 6 HB VAL 6 -9.683 4.976 -11.705 38 HG11 VAL 6 1HG1 VAL 6 -10.885 7.595 -10.952 39 HG12 VAL 6 2HG1 VAL 6 -10.811 6.082 -10.047 40 HG13 VAL 6 3HG1 VAL 6 -11.952 6.258 -11.381 41 HG21 VAL 6 3HG2 VAL 6 -9.689 6.196 -14.116 42 HG22 VAL 6 1HG2 VAL 6 -11.268 6.687 -13.503 43 HG23 VAL 6 2HG2 VAL 6 -10.863 4.976 -13.624 44 H GLU 7 H GLU 7 -6.127 7.248 -11.852 45 HA GLU 7 HA GLU 7 -5.181 4.951 -13.156 46 HB2 GLU 7 1HB GLU 7 -4.305 6.590 -15.161 47 HB3 GLU 7 2HB GLU 7 -5.638 5.458 -15.298 48 HG2 GLU 7 1HG GLU 7 -7.242 7.147 -15.040 49 HG3 GLU 7 2HG GLU 7 -6.057 8.294 -14.414 50 H MET 8 H MET 8 -4.573 6.533 -10.876 51 HA MET 8 HA MET 8 -1.939 7.643 -11.543 52 HB2 MET 8 1HB MET 8 -3.802 8.903 -10.169 53 HB3 MET 8 2HB MET 8 -3.176 7.940 -8.838 54 HG2 MET 8 1HG MET 8 -1.570 9.423 -8.545 55 HG3 MET 8 2HG MET 8 -0.947 9.046 -10.151 56 HE1 MET 8 3HE MET 8 -2.628 9.660 -12.055 57 HE2 MET 8 1HE MET 8 -2.222 11.313 -12.518 58 HE3 MET 8 2HE MET 8 -3.839 10.934 -11.921 59 H ARG 9 H ARG 9 -0.420 6.121 -11.446 60 HA ARG 9 HA ARG 9 -0.497 4.230 -9.189 61 HE ARG 9 HE ARG 9 4.484 2.731 -12.502 62 HB2 ARG 9 1HB ARG 9 0.437 2.588 -10.507 63 HB3 ARG 9 2HB ARG 9 -0.535 3.455 -11.687 64 HG2 ARG 9 1HG ARG 9 1.371 3.348 -12.885 65 HG3 ARG 9 2HG ARG 9 1.769 4.794 -11.956 66 HD2 ARG 9 1HD ARG 9 3.388 3.748 -10.793 67 HD3 ARG 9 2HD ARG 9 2.437 2.272 -10.617 68 HH11 ARG 9 1HH1 ARG 9 1.335 1.253 -12.218 69 HH12 ARG 9 2HH1 ARG 9 1.628 0.095 -13.470 70 HH21 ARG 9 1HH2 ARG 9 4.871 1.208 -14.150 71 HH22 ARG 9 2HH2 ARG 9 3.636 0.067 -14.567 72 H LEU 10 H LEU 10 1.303 3.823 -7.966 73 HA LEU 10 HA LEU 10 3.543 5.706 -8.318 74 HG LEU 10 HG LEU 10 1.078 4.382 -5.912 75 HB2 LEU 10 1HB LEU 10 3.561 4.823 -5.638 76 HB3 LEU 10 2HB LEU 10 3.258 6.438 -6.239 77 HD11 LEU 10 1HD1 LEU 10 1.952 4.699 -3.721 78 HD12 LEU 10 2HD1 LEU 10 0.512 5.711 -3.844 79 HD13 LEU 10 3HD1 LEU 10 2.115 6.438 -3.967 80 HD21 LEU 10 3HD2 LEU 10 -0.293 5.938 -6.720 81 HD22 LEU 10 1HD2 LEU 10 1.146 6.822 -7.228 82 HD23 LEU 10 2HD2 LEU 10 0.391 7.184 -5.676 83 H ARG 11 H ARG 11 5.618 4.909 -7.407 84 HA ARG 11 HA ARG 11 5.871 2.037 -7.954 85 HE ARG 11 HE ARG 11 9.757 0.711 -10.162 86 HB2 ARG 11 1HB ARG 11 7.295 4.252 -8.918 87 HB3 ARG 11 2HB ARG 11 8.398 3.439 -7.817 88 HG2 ARG 11 1HG ARG 11 7.010 2.241 -10.206 89 HG3 ARG 11 2HG ARG 11 8.730 2.602 -10.040 90 HD2 ARG 11 1HD ARG 11 8.348 1.014 -7.888 91 HD3 ARG 11 2HD ARG 11 7.150 0.343 -8.995 92 HH11 ARG 11 1HH1 ARG 11 7.695 -1.456 -8.364 93 HH12 ARG 11 2HH1 ARG 11 8.557 -2.878 -8.847 94 HH21 ARG 11 1HH2 ARG 11 10.890 -1.157 -10.798 95 HH22 ARG 11 2HH2 ARG 11 10.371 -2.708 -10.230 96 H ILE 12 H ILE 12 6.938 0.674 -6.527 97 HA ILE 12 HA ILE 12 8.058 1.790 -4.086 98 HB ILE 12 HB ILE 12 5.470 0.405 -4.199 99 HG12 ILE 12 1HG1 ILE 12 6.760 1.846 -1.890 100 HG13 ILE 12 2HG1 ILE 12 6.058 2.701 -3.260 101 HG21 ILE 12 1HG2 ILE 12 5.904 -0.671 -1.917 102 HG22 ILE 12 2HG2 ILE 12 7.609 -0.606 -2.359 103 HG23 ILE 12 3HG2 ILE 12 6.472 -1.519 -3.353 104 HD11 ILE 12 3HD1 ILE 12 4.589 2.453 -1.238 105 HD12 ILE 12 1HD1 ILE 12 4.511 0.731 -1.607 106 HD13 ILE 12 2HD1 ILE 12 3.891 1.909 -2.762 107 H ARG 13 H ARG 13 10.042 1.020 -4.384 108 HA ARG 13 HA ARG 13 10.342 -1.813 -5.114 109 HE ARG 13 HE ARG 13 11.300 2.724 -8.417 110 HB2 ARG 13 1HB ARG 13 12.609 0.187 -5.068 111 HB3 ARG 13 2HB ARG 13 12.564 -1.400 -5.819 112 HG2 ARG 13 1HG ARG 13 11.595 -0.658 -7.660 113 HG3 ARG 13 2HG ARG 13 10.476 0.380 -6.778 114 HD2 ARG 13 1HD ARG 13 12.282 2.026 -6.466 115 HD3 ARG 13 2HD ARG 13 13.363 0.995 -7.402 116 HH11 ARG 13 1HH1 ARG 13 13.257 -0.091 -9.069 117 HH12 ARG 13 2HH1 ARG 13 13.108 0.048 -10.788 118 HH21 ARG 13 1HH2 ARG 13 11.103 2.909 -10.677 119 HH22 ARG 13 2HH2 ARG 13 11.884 1.751 -11.702 120 H PHE 14 H PHE 14 11.924 -3.098 -4.162 121 HA PHE 14 HA PHE 14 12.679 -2.406 -1.413 122 HD1 PHE 14 HD1 PHE 14 9.855 -2.163 -1.589 123 HD2 PHE 14 HD2 PHE 14 11.363 -5.195 0.991 124 HE1 PHE 14 HE1 PHE 14 8.430 -1.322 0.227 125 HE2 PHE 14 HE2 PHE 14 9.940 -4.355 2.811 126 HZ PHE 14 HZ PHE 14 8.470 -2.418 2.432 127 HB2 PHE 14 1HB PHE 14 10.935 -4.627 -2.315 128 HB3 PHE 14 2HB PHE 14 12.176 -5.061 -1.147 129 H GLU 15 H GLU 15 14.684 -3.091 -0.850 130 HA GLU 15 HA GLU 15 16.646 -3.550 -2.666 131 HB2 GLU 15 1HB GLU 15 16.398 -4.036 0.234 132 HB3 GLU 15 2HB GLU 15 17.641 -4.982 -0.568 133 HG2 GLU 15 1HG GLU 15 18.231 -2.683 0.448 134 HG3 GLU 15 2HG GLU 15 18.890 -3.146 -1.117 135 H SER 16 H SER 16 14.444 -5.945 -1.416 136 HA SER 16 HA SER 16 15.799 -7.965 -3.084 137 HG SER 16 HG SER 16 13.580 -8.625 -0.002 138 HB2 SER 16 1HB SER 16 14.797 -9.639 -1.407 139 HB3 SER 16 2HB SER 16 16.197 -8.700 -0.888 140 H ALA 17 H ALA 17 13.431 -6.091 -3.570 141 HA ALA 17 HA ALA 17 11.886 -7.930 -5.062 142 HB1 ALA 17 3HB ALA 17 9.978 -8.319 -3.854 143 HB2 ALA 17 1HB ALA 17 10.192 -6.893 -2.840 144 HB3 ALA 17 2HB ALA 17 11.184 -8.325 -2.567 145 H GLU 18 H GLU 18 10.283 -6.986 -6.348 146 HA GLU 18 HA GLU 18 9.986 -4.062 -6.150 147 HB2 GLU 18 1HB GLU 18 10.286 -3.835 -8.568 148 HB3 GLU 18 2HB GLU 18 11.726 -4.501 -7.812 149 HG2 GLU 18 1HG GLU 18 10.345 -6.756 -8.486 150 HG3 GLU 18 2HG GLU 18 9.936 -5.660 -9.806 151 H CYS 19 H CYS 19 8.016 -3.214 -6.835 152 HA CYS 19 HA CYS 19 6.098 -4.800 -8.257 153 HG CYS 19 HG CYS 19 5.829 -5.474 -4.012 154 HB2 CYS 19 1HB CYS 19 4.580 -4.350 -5.946 155 HB3 CYS 19 2HB CYS 19 5.141 -5.906 -6.551 156 H GLU 20 H GLU 20 4.243 -3.619 -8.904 157 HA GLU 20 HA GLU 20 4.363 -0.747 -8.236 158 HB2 GLU 20 1HB GLU 20 3.065 -1.709 -10.751 159 HB3 GLU 20 2HB GLU 20 3.859 -0.178 -10.423 160 HG2 GLU 20 1HG GLU 20 6.027 -1.511 -10.336 161 HG3 GLU 20 2HG GLU 20 5.101 -2.826 -11.060 162 H VAL 21 H VAL 21 2.322 0.389 -8.179 163 HA VAL 21 HA VAL 21 -0.089 -1.220 -8.020 164 HB VAL 21 HB VAL 21 -0.085 -1.449 -5.808 165 HG11 VAL 21 1HG1 VAL 21 1.618 -0.284 -4.345 166 HG12 VAL 21 2HG1 VAL 21 2.262 0.429 -5.825 167 HG13 VAL 21 3HG1 VAL 21 2.255 -1.324 -5.620 168 HG21 VAL 21 3HG2 VAL 21 -0.139 1.564 -5.626 169 HG22 VAL 21 1HG2 VAL 21 -0.697 0.420 -4.403 170 HG23 VAL 21 2HG2 VAL 21 -1.541 0.542 -5.946 171 H GLU 22 H GLU 22 -1.912 -0.128 -8.495 172 HA GLU 22 HA GLU 22 -1.595 2.653 -9.338 173 HB2 GLU 22 1HB GLU 22 -3.789 0.640 -9.855 174 HB3 GLU 22 2HB GLU 22 -3.800 2.292 -10.454 175 HG2 GLU 22 1HG GLU 22 -2.580 1.717 -12.203 176 HG3 GLU 22 2HG GLU 22 -1.328 1.044 -11.159 177 H LEU 23 H LEU 23 -3.942 3.832 -9.112 178 HA LEU 23 HA LEU 23 -5.145 3.320 -6.537 179 HG LEU 23 HG LEU 23 -5.577 6.594 -6.345 180 HB2 LEU 23 1HB LEU 23 -3.452 4.588 -5.607 181 HB3 LEU 23 2HB LEU 23 -3.285 5.602 -7.022 182 HD11 LEU 23 1HD1 LEU 23 -6.489 5.355 -4.669 183 HD12 LEU 23 2HD1 LEU 23 -5.566 6.490 -3.687 184 HD13 LEU 23 3HD1 LEU 23 -4.922 4.882 -4.011 185 HD21 LEU 23 3HD2 LEU 23 -3.701 7.978 -6.209 186 HD22 LEU 23 1HD2 LEU 23 -2.981 7.030 -4.907 187 HD23 LEU 23 2HD2 LEU 23 -4.399 8.029 -4.590 188 H TYR 24 H TYR 24 -7.136 4.307 -6.259 189 HA TYR 24 HA TYR 24 -8.115 5.884 -8.547 190 HD1 TYR 24 HD2 TYR 24 -7.983 4.777 -10.263 191 HD2 TYR 24 HD1 TYR 24 -9.725 1.561 -8.089 192 HE1 TYR 24 HE2 TYR 24 -7.191 3.199 -11.974 193 HE2 TYR 24 HE1 TYR 24 -8.937 -0.025 -9.795 194 HH TYR 24 HH TYR 24 -7.146 -0.139 -11.517 195 HB2 TYR 24 1HB TYR 24 -9.646 3.686 -7.121 196 HB3 TYR 24 2HB TYR 24 -10.288 4.729 -8.383 197 H GLU 25 H GLU 25 -9.669 7.457 -8.116 198 HA GLU 25 HA GLU 25 -9.389 8.868 -5.736 199 HB2 GLU 25 1HB GLU 25 -11.608 8.980 -7.777 200 HB3 GLU 25 2HB GLU 25 -11.434 10.131 -6.458 201 HG2 GLU 25 1HG GLU 25 -9.582 11.122 -7.383 202 HG3 GLU 25 2HG GLU 25 -9.138 9.688 -8.309 203 H GLU 26 H GLU 26 -11.168 6.014 -6.111 204 HA GLU 26 HA GLU 26 -13.478 6.308 -4.709 205 HB2 GLU 26 1HB GLU 26 -13.370 4.001 -4.155 206 HB3 GLU 26 2HB GLU 26 -12.543 4.180 -5.695 207 HG2 GLU 26 1HG GLU 26 -10.383 4.208 -4.435 208 HG3 GLU 26 2HG GLU 26 -11.298 3.807 -2.984 209 H TRP 27 H TRP 27 -10.237 6.484 -3.430 210 HA TRP 27 HA TRP 27 -11.081 6.354 -0.678 211 HD1 TRP 27 HD1 TRP 27 -10.147 7.606 1.277 212 HE1 TRP 27 HE1 TRP 27 -8.413 8.484 2.964 213 HE3 TRP 27 HE3 TRP 27 -5.887 6.708 -1.399 214 HZ2 TRP 27 HZ2 TRP 27 -5.607 8.756 3.135 215 HZ3 TRP 27 HZ3 TRP 27 -3.718 7.305 -0.404 216 HH2 TRP 27 HH2 TRP 27 -3.583 8.308 1.819 217 HB2 TRP 27 1HB TRP 27 -8.889 5.513 -1.108 218 HB3 TRP 27 2HB TRP 27 -8.444 6.948 -2.028 219 H ALA 28 H ALA 28 -9.642 8.872 -2.771 220 HA ALA 28 HA ALA 28 -11.292 10.931 -2.497 221 HB1 ALA 28 3HB ALA 28 -10.263 12.221 -0.468 222 HB2 ALA 28 1HB ALA 28 -9.868 10.601 0.107 223 HB3 ALA 28 2HB ALA 28 -11.547 11.040 -0.212 224 HA PRO 29 HA PRO 29 -7.833 12.268 -5.061 225 HB2 PRO 29 1HB PRO 29 -9.042 14.862 -5.210 226 HB3 PRO 29 2HB PRO 29 -8.976 13.618 -6.455 227 HG2 PRO 29 1HG PRO 29 -11.173 14.351 -4.668 228 HG3 PRO 29 2HG PRO 29 -11.211 13.407 -6.163 229 HD2 PRO 29 1HD PRO 29 -11.597 12.350 -3.668 230 HD3 PRO 29 2HD PRO 29 -10.996 11.421 -5.053 231 H GLU 30 H GLU 30 -9.181 14.145 -2.375 232 HA GLU 30 HA GLU 30 -7.084 15.980 -2.082 233 HB2 GLU 30 1HB GLU 30 -9.221 14.956 -0.260 234 HB3 GLU 30 2HB GLU 30 -7.890 15.859 0.444 235 HG2 GLU 30 1HG GLU 30 -9.186 17.077 -1.914 236 HG3 GLU 30 2HG GLU 30 -10.143 16.994 -0.436 237 H THR 31 H THR 31 -7.616 12.893 -0.384 238 HA THR 31 HA THR 31 -5.195 12.983 1.093 239 HB THR 31 HB THR 31 -5.806 10.259 0.642 240 HG1 THR 31 HG1 THR 31 -7.755 10.720 -0.264 241 HG21 THR 31 3HG2 THR 31 -5.278 10.758 2.820 242 HG22 THR 31 1HG2 THR 31 -7.026 10.548 2.914 243 HG23 THR 31 2HG2 THR 31 -6.336 12.171 2.874 244 H VAL 32 H VAL 32 -6.003 11.444 -2.004 245 HA VAL 32 HA VAL 32 -3.706 10.088 -2.592 246 HB VAL 32 HB VAL 32 -5.267 11.808 -4.529 247 HG11 VAL 32 1HG1 VAL 32 -4.474 9.810 -6.054 248 HG12 VAL 32 2HG1 VAL 32 -3.163 9.735 -4.877 249 HG13 VAL 32 3HG1 VAL 32 -3.449 11.220 -5.784 250 HG21 VAL 32 3HG2 VAL 32 -6.175 9.333 -4.975 251 HG22 VAL 32 1HG2 VAL 32 -6.927 10.437 -3.823 252 HG23 VAL 32 2HG2 VAL 32 -5.811 9.195 -3.255 253 H ARG 33 H ARG 33 -4.178 13.547 -2.530 254 HA ARG 33 HA ARG 33 -1.942 14.355 -4.007 255 HE ARG 33 HE ARG 33 -0.681 18.934 -2.684 256 HB2 ARG 33 1HB ARG 33 -3.906 15.756 -3.059 257 HB3 ARG 33 2HB ARG 33 -2.924 15.880 -1.608 258 HG2 ARG 33 1HG ARG 33 -1.092 16.823 -3.037 259 HG3 ARG 33 2HG ARG 33 -2.253 16.875 -4.366 260 HD2 ARG 33 1HD ARG 33 -3.433 18.589 -3.451 261 HD3 ARG 33 2HD ARG 33 -3.080 18.094 -1.797 262 HH11 ARG 33 1HH1 ARG 33 -3.852 20.391 -2.744 263 HH12 ARG 33 2HH1 ARG 33 -3.245 22.012 -2.663 264 HH21 ARG 33 1HH2 ARG 33 0.118 21.064 -2.575 265 HH22 ARG 33 2HH2 ARG 33 -0.992 22.393 -2.568 266 H ALA 34 H ALA 34 -2.258 13.474 -0.594 267 HA ALA 34 HA ALA 34 0.314 14.282 0.232 268 HB1 ALA 34 3HB ALA 34 -1.824 12.571 1.310 269 HB2 ALA 34 1HB ALA 34 -0.885 13.846 2.087 270 HB3 ALA 34 2HB ALA 34 -0.199 12.232 1.903 271 H ILE 35 H ILE 35 -0.886 11.152 -0.927 272 HA ILE 35 HA ILE 35 1.494 9.700 -0.661 273 HB ILE 35 HB ILE 35 0.027 9.048 -3.123 274 HG12 ILE 35 1HG1 ILE 35 -1.858 9.983 -1.876 275 HG13 ILE 35 2HG1 ILE 35 -1.999 8.231 -1.992 276 HG21 ILE 35 1HG2 ILE 35 1.631 7.559 -2.058 277 HG22 ILE 35 2HG2 ILE 35 0.029 6.824 -2.129 278 HG23 ILE 35 3HG2 ILE 35 0.623 7.496 -0.612 279 HD11 ILE 35 3HD1 ILE 35 -1.603 7.918 0.246 280 HD12 ILE 35 1HD1 ILE 35 -2.479 9.448 0.256 281 HD13 ILE 35 2HD1 ILE 35 -0.722 9.436 0.414 282 H ALA 36 H ALA 36 0.241 11.580 -3.457 283 HA ALA 36 HA ALA 36 2.481 11.174 -5.131 284 HB1 ALA 36 3HB ALA 36 0.035 12.235 -5.510 285 HB2 ALA 36 1HB ALA 36 1.387 12.467 -6.619 286 HB3 ALA 36 2HB ALA 36 1.001 13.709 -5.425 287 H ASP 37 H ASP 37 1.839 13.352 -2.486 288 HA ASP 37 HA ASP 37 3.937 15.201 -3.114 289 HB2 ASP 37 1HB ASP 37 1.875 15.510 -1.548 290 HB3 ASP 37 2HB ASP 37 2.906 14.767 -0.328 291 H ALA 38 H ALA 38 3.790 12.124 -1.548 292 HA ALA 38 HA ALA 38 6.435 12.391 -0.374 293 HB1 ALA 38 3HB ALA 38 4.168 11.244 0.558 294 HB2 ALA 38 1HB ALA 38 5.793 10.817 1.103 295 HB3 ALA 38 2HB ALA 38 4.991 9.842 -0.129 296 H LEU 39 H LEU 39 6.659 12.463 -3.073 297 HA LEU 39 HA LEU 39 6.933 9.965 -4.361 298 HG LEU 39 HG LEU 39 6.111 13.169 -5.273 299 HB2 LEU 39 1HB LEU 39 8.351 12.562 -4.997 300 HB3 LEU 39 2HB LEU 39 8.192 11.186 -6.064 301 HD11 LEU 39 1HD1 LEU 39 7.488 12.277 -7.694 302 HD12 LEU 39 2HD1 LEU 39 6.726 13.825 -7.320 303 HD13 LEU 39 3HD1 LEU 39 5.743 12.470 -7.879 304 HD21 LEU 39 3HD2 LEU 39 4.889 11.228 -4.767 305 HD22 LEU 39 1HD2 LEU 39 5.643 10.306 -6.062 306 HD23 LEU 39 2HD2 LEU 39 4.477 11.567 -6.445 307 HA PRO 40 HA PRO 40 11.159 8.280 -3.902 308 HB2 PRO 40 1HB PRO 40 12.529 10.847 -4.624 309 HB3 PRO 40 2HB PRO 40 13.026 9.180 -4.943 310 HG2 PRO 40 1HG PRO 40 11.764 10.698 -6.797 311 HG3 PRO 40 2HG PRO 40 11.590 8.939 -6.711 312 HD2 PRO 40 1HD PRO 40 9.622 11.002 -6.174 313 HD3 PRO 40 2HD PRO 40 9.387 9.254 -6.316 314 H ILE 41 H ILE 41 11.066 8.011 -1.769 315 HA ILE 41 HA ILE 41 12.541 9.864 -0.092 316 HB ILE 41 HB ILE 41 9.637 9.185 0.408 317 HG12 ILE 41 1HG1 ILE 41 11.191 11.786 0.334 318 HG13 ILE 41 2HG1 ILE 41 10.033 11.227 -0.866 319 HG21 ILE 41 1HG2 ILE 41 10.838 8.702 2.462 320 HG22 ILE 41 2HG2 ILE 41 9.905 10.187 2.648 321 HG23 ILE 41 3HG2 ILE 41 11.646 10.265 2.388 322 HD11 ILE 41 3HD1 ILE 41 9.536 12.869 1.312 323 HD12 ILE 41 1HD1 ILE 41 8.845 11.308 1.761 324 HD13 ILE 41 2HD1 ILE 41 8.341 12.101 0.267 325 H LYS 42 H LYS 42 13.364 8.857 1.804 326 HA LYS 42 HA LYS 42 13.575 5.984 1.530 327 HB2 LYS 42 1HB LYS 42 15.018 8.075 3.098 328 HB3 LYS 42 2HB LYS 42 15.117 6.403 3.633 329 HG2 LYS 42 1HG LYS 42 15.716 5.989 1.097 330 HG3 LYS 42 2HG LYS 42 16.207 7.681 1.185 331 HD2 LYS 42 1HD LYS 42 17.134 6.010 3.418 332 HD3 LYS 42 2HD LYS 42 17.793 5.572 1.840 333 HE2 LYS 42 1HE LYS 42 18.380 8.002 1.538 334 HE3 LYS 42 2HE LYS 42 17.946 8.240 3.230 335 HZ1 LYS 42 3HZ LYS 42 19.830 6.093 2.638 336 HZ2 LYS 42 1HZ LYS 42 19.784 7.162 3.948 337 HZ3 LYS 42 2HZ LYS 42 20.402 7.675 2.460 338 H SER 43 H SER 43 12.731 4.463 2.826 339 HA SER 43 HA SER 43 11.490 5.211 5.356 340 HG SER 43 HG SER 43 9.083 3.281 2.726 341 HB2 SER 43 1HB SER 43 9.355 4.464 4.851 342 HB3 SER 43 2HB SER 43 9.822 5.220 3.331 343 H THR 44 H THR 44 11.257 3.475 6.824 344 HA THR 44 HA THR 44 12.927 1.144 6.138 345 HB THR 44 HB THR 44 12.051 1.504 8.938 346 HG1 THR 44 HG1 THR 44 13.382 3.249 9.307 347 HG21 THR 44 3HG2 THR 44 14.798 1.487 8.862 348 HG22 THR 44 1HG2 THR 44 14.345 0.464 7.500 349 HG23 THR 44 2HG2 THR 44 13.752 0.090 9.119 350 H ALA 45 H ALA 45 11.976 -0.701 5.699 351 HA ALA 45 HA ALA 45 9.154 -1.049 6.079 352 HB1 ALA 45 3HB ALA 45 9.453 -2.230 4.225 353 HB2 ALA 45 1HB ALA 45 10.237 -3.474 5.198 354 HB3 ALA 45 2HB ALA 45 11.203 -2.210 4.440 355 H ASN 46 H ASN 46 8.096 -2.145 7.541 356 HA ASN 46 HA ASN 46 9.606 -3.654 9.567 357 HB2 ASN 46 1HB ASN 46 7.130 -2.026 9.620 358 HB3 ASN 46 2HB ASN 46 7.097 -3.493 10.593 359 HD21 ASN 46 1HD2 ASN 46 7.395 -0.427 11.012 360 HD22 ASN 46 2HD2 ASN 46 8.635 -0.332 12.211 361 H ARG 47 H ARG 47 9.470 -5.875 9.471 362 HA ARG 47 HA ARG 47 7.625 -7.016 7.561 363 HE ARG 47 HE ARG 47 7.472 -9.518 7.055 364 HB2 ARG 47 1HB ARG 47 10.130 -7.807 8.844 365 HB3 ARG 47 2HB ARG 47 8.996 -9.135 8.632 366 HG2 ARG 47 1HG ARG 47 9.110 -7.548 6.244 367 HG3 ARG 47 2HG ARG 47 10.731 -8.041 6.726 368 HD2 ARG 47 1HD ARG 47 9.497 -9.618 5.196 369 HD3 ARG 47 2HD ARG 47 10.163 -10.328 6.661 370 HH11 ARG 47 1HH1 ARG 47 9.417 -12.005 5.564 371 HH12 ARG 47 2HH1 ARG 47 8.174 -13.208 5.659 372 HH21 ARG 47 1HH2 ARG 47 5.836 -11.099 7.175 373 HH22 ARG 47 2HH2 ARG 47 6.141 -12.694 6.572 374 H TRP 48 H TRP 48 5.937 -8.324 7.928 375 HA TRP 48 HA TRP 48 5.410 -9.450 10.542 376 HD1 TRP 48 HD1 TRP 48 1.692 -9.580 9.216 377 HE1 TRP 48 HE1 TRP 48 0.055 -10.307 11.068 378 HE3 TRP 48 HE3 TRP 48 3.972 -7.358 13.215 379 HZ2 TRP 48 HZ2 TRP 48 -0.219 -9.977 13.867 380 HZ3 TRP 48 HZ3 TRP 48 2.961 -7.612 15.444 381 HH2 TRP 48 HH2 TRP 48 0.908 -8.894 15.759 382 HB2 TRP 48 1HB TRP 48 4.367 -7.269 10.822 383 HB3 TRP 48 2HB TRP 48 3.531 -7.430 9.280 384 H GLY 49 H GLY 49 3.906 -11.185 10.438 385 HA2 GLY 49 1HA GLY 49 3.945 -12.914 8.400 386 HA3 GLY 49 2HA GLY 49 2.517 -12.748 9.408 387 H ASP 50 H ASP 50 3.987 -11.989 6.353 388 HA ASP 50 HA ASP 50 3.065 -11.570 4.312 389 HB2 ASP 50 1HB ASP 50 1.155 -12.978 4.898 390 HB3 ASP 50 2HB ASP 50 0.404 -11.633 5.745 391 H GLU 51 H GLU 51 1.733 -9.697 7.008 392 HA GLU 51 HA GLU 51 1.224 -7.377 5.422 393 HB2 GLU 51 1HB GLU 51 0.727 -8.250 8.113 394 HB3 GLU 51 2HB GLU 51 1.430 -6.640 8.143 395 HG2 GLU 51 1HG GLU 51 -0.493 -6.559 6.128 396 HG3 GLU 51 2HG GLU 51 -1.230 -7.472 7.441 397 H ILE 52 H ILE 52 2.367 -5.501 5.271 398 HA ILE 52 HA ILE 52 4.900 -5.220 6.673 399 HB ILE 52 HB ILE 52 4.747 -6.030 3.902 400 HG12 ILE 52 1HG1 ILE 52 7.413 -5.765 4.530 401 HG13 ILE 52 2HG1 ILE 52 6.678 -5.913 6.120 402 HG21 ILE 52 1HG2 ILE 52 6.094 -3.397 4.436 403 HG22 ILE 52 2HG2 ILE 52 4.853 -3.760 3.237 404 HG23 ILE 52 3HG2 ILE 52 6.477 -4.421 3.053 405 HD11 ILE 52 3HD1 ILE 52 7.388 -8.068 5.359 406 HD12 ILE 52 1HD1 ILE 52 6.493 -7.890 3.852 407 HD13 ILE 52 2HD1 ILE 52 5.628 -8.034 5.386 408 H TYR 53 H TYR 53 4.780 -3.269 7.526 409 HA TYR 53 HA TYR 53 3.615 -1.097 5.907 410 HD1 TYR 53 HD2 TYR 53 4.424 0.193 9.749 411 HD2 TYR 53 HD1 TYR 53 2.315 -3.472 9.230 412 HE1 TYR 53 HE2 TYR 53 5.083 -0.504 12.011 413 HE2 TYR 53 HE1 TYR 53 2.969 -4.173 11.492 414 HH TYR 53 HH TYR 53 4.855 -3.633 13.115 415 HB2 TYR 53 1HB TYR 53 2.675 -0.105 7.961 416 HB3 TYR 53 2HB TYR 53 2.030 -1.717 7.656 417 H PHE 54 H PHE 54 4.715 0.721 5.733 418 HA PHE 54 HA PHE 54 6.960 1.210 7.564 419 HD1 PHE 54 HD1 PHE 54 6.825 3.756 4.589 420 HD2 PHE 54 HD2 PHE 54 7.111 -0.304 3.347 421 HE1 PHE 54 HE1 PHE 54 6.011 4.384 2.358 422 HE2 PHE 54 HE2 PHE 54 6.291 0.318 1.116 423 HZ PHE 54 HZ PHE 54 5.742 2.665 0.617 424 HB2 PHE 54 1HB PHE 54 8.376 1.910 5.723 425 HB3 PHE 54 2HB PHE 54 7.838 0.259 5.453 426 H THR 55 H THR 55 7.356 3.365 8.048 427 HA THR 55 HA THR 55 5.169 5.186 7.347 428 HB THR 55 HB THR 55 7.263 6.218 9.131 429 HG1 THR 55 HG1 THR 55 5.851 3.861 9.823 430 HG21 THR 55 3HG2 THR 55 4.891 7.090 8.814 431 HG22 THR 55 1HG2 THR 55 5.492 6.936 10.464 432 HG23 THR 55 2HG2 THR 55 4.389 5.726 9.811 433 H THR 56 H THR 56 5.479 7.154 6.276 434 HA THR 56 HA THR 56 8.152 7.525 5.096 435 HB THR 56 HB THR 56 6.214 8.770 3.451 436 HG1 THR 56 HG1 THR 56 4.700 7.301 3.157 437 HG21 THR 56 3HG2 THR 56 8.429 7.122 3.138 438 HG22 THR 56 1HG2 THR 56 7.454 7.856 1.864 439 HG23 THR 56 2HG2 THR 56 7.085 6.227 2.430 440 H GLN 57 H GLN 57 6.361 8.778 7.395 441 HA GLN 57 HA GLN 57 6.541 10.766 8.518 442 HB2 GLN 57 1HB GLN 57 7.862 12.053 6.124 443 HB3 GLN 57 2HB GLN 57 7.953 12.536 7.811 444 HG2 GLN 57 1HG GLN 57 9.335 10.652 8.346 445 HG3 GLN 57 2HG GLN 57 9.122 9.978 6.731 446 HE21 GLN 57 1HE2 GLN 57 11.470 11.004 8.375 447 HE22 GLN 57 2HE2 GLN 57 12.311 12.044 7.281 448 H VAL 58 H VAL 58 4.888 10.231 5.666 449 HA VAL 58 HA VAL 58 3.654 12.847 5.526 450 HB VAL 58 HB VAL 58 3.969 11.579 3.447 451 HG11 VAL 58 1HG1 VAL 58 2.721 9.592 2.935 452 HG12 VAL 58 2HG1 VAL 58 1.916 9.644 4.504 453 HG13 VAL 58 3HG1 VAL 58 3.646 9.319 4.414 454 HG21 VAL 58 3HG2 VAL 58 2.241 13.189 3.373 455 HG22 VAL 58 1HG2 VAL 58 1.134 12.152 4.274 456 HG23 VAL 58 2HG2 VAL 58 1.585 11.735 2.621 457 H ALA 59 H ALA 59 2.151 13.441 6.922 458 HA ALA 59 HA ALA 59 0.506 11.361 8.197 459 HB1 ALA 59 3HB ALA 59 0.224 12.762 10.059 460 HB2 ALA 59 1HB ALA 59 0.768 14.190 9.181 461 HB3 ALA 59 2HB ALA 59 1.922 12.927 9.616 462 H VAL 60 H VAL 60 -1.321 11.059 7.128 463 HA VAL 60 HA VAL 60 -3.032 13.401 6.629 464 HB VAL 60 HB VAL 60 -2.099 12.910 4.463 465 HG11 VAL 60 1HG1 VAL 60 -1.425 10.555 5.064 466 HG12 VAL 60 2HG1 VAL 60 -2.060 10.777 3.434 467 HG13 VAL 60 3HG1 VAL 60 -3.079 10.071 4.686 468 HG21 VAL 60 3HG2 VAL 60 -4.898 11.799 4.690 469 HG22 VAL 60 1HG2 VAL 60 -4.122 12.292 3.187 470 HG23 VAL 60 2HG2 VAL 60 -4.451 13.487 4.439 471 H GLU 61 H GLU 61 -4.647 13.042 8.061 472 HA GLU 61 HA GLU 61 -5.890 10.368 8.040 473 HB2 GLU 61 1HB GLU 61 -4.796 11.877 10.252 474 HB3 GLU 61 2HB GLU 61 -6.502 11.541 10.510 475 HG2 GLU 61 1HG GLU 61 -6.110 9.171 10.209 476 HG3 GLU 61 2HG GLU 61 -4.408 9.478 9.861 477 H LYS 62 H LYS 62 -8.028 10.274 7.744 478 HA LYS 62 HA LYS 62 -9.726 12.558 8.260 479 HB2 LYS 62 1HB LYS 62 -8.931 13.101 6.029 480 HB3 LYS 62 2HB LYS 62 -9.328 11.488 5.457 481 HG2 LYS 62 1HG LYS 62 -11.643 11.904 5.568 482 HG3 LYS 62 2HG LYS 62 -11.412 13.369 6.527 483 HD2 LYS 62 1HD LYS 62 -10.369 14.475 4.637 484 HD3 LYS 62 2HD LYS 62 -10.491 13.000 3.677 485 HE2 LYS 62 1HE LYS 62 -12.759 13.214 3.388 486 HE3 LYS 62 2HE LYS 62 -12.967 14.139 4.875 487 HZ1 LYS 62 3HZ LYS 62 -12.227 15.054 2.204 488 HZ2 LYS 62 1HZ LYS 62 -11.518 15.855 3.515 489 HZ3 LYS 62 2HZ LYS 62 -13.202 15.797 3.369 490 H GLU 63 H GLU 63 -12.074 11.989 7.807 491 HA GLU 63 HA GLU 63 -12.478 9.154 8.448 492 HB2 GLU 63 1HB GLU 63 -14.637 11.213 8.665 493 HB3 GLU 63 2HB GLU 63 -14.413 9.739 9.595 494 HG2 GLU 63 1HG GLU 63 -13.757 11.168 11.193 495 HG3 GLU 63 2HG GLU 63 -12.215 11.091 10.342 496 H GLU 64 H GLU 64 -12.385 8.330 6.347 497 HA GLU 64 HA GLU 64 -14.856 8.297 4.962 498 HB2 GLU 64 1HB GLU 64 -14.270 9.387 2.912 499 HB3 GLU 64 2HB GLU 64 -13.911 10.504 4.220 500 HG2 GLU 64 1HG GLU 64 -11.530 9.772 4.090 501 HG3 GLU 64 2HG GLU 64 -11.956 8.849 2.649 502 H ASN 65 H ASN 65 -14.930 6.626 3.348 503 HA ASN 65 HA ASN 65 -14.306 4.719 2.288 504 HB2 ASN 65 1HB ASN 65 -12.413 6.177 1.456 505 HB3 ASN 65 2HB ASN 65 -11.431 5.533 2.767 506 HD21 ASN 65 1HD2 ASN 65 -10.303 5.079 0.548 507 HD22 ASN 65 2HD2 ASN 65 -10.563 3.488 -0.070 508 H SER 66 H SER 66 -11.483 4.877 4.407 509 HA SER 66 HA SER 66 -10.619 3.090 5.657 510 HG SER 66 HG SER 66 -10.059 4.181 7.388 511 HB2 SER 66 1HB SER 66 -12.841 4.527 7.018 512 HB3 SER 66 2HB SER 66 -12.167 3.113 7.828 513 H LYS 67 H LYS 67 -11.083 1.206 4.301 514 HA LYS 67 HA LYS 67 -13.475 -0.299 5.129 515 HB2 LYS 67 1HB LYS 67 -12.905 -1.844 3.218 516 HB3 LYS 67 2HB LYS 67 -13.384 -0.225 2.749 517 HG2 LYS 67 1HG LYS 67 -11.609 -0.669 1.357 518 HG3 LYS 67 2HG LYS 67 -10.844 0.249 2.648 519 HD2 LYS 67 1HD LYS 67 -10.262 -1.971 3.710 520 HD3 LYS 67 2HD LYS 67 -10.811 -2.731 2.219 521 HE2 LYS 67 1HE LYS 67 -9.148 -1.519 0.954 522 HE3 LYS 67 2HE LYS 67 -8.642 -0.650 2.401 523 HZ1 LYS 67 3HZ LYS 67 -7.569 -2.976 1.471 524 HZ2 LYS 67 1HZ LYS 67 -8.556 -3.490 2.745 525 HZ3 LYS 67 2HZ LYS 67 -7.353 -2.338 3.020 526 H ASP 68 H ASP 68 -13.274 -2.591 5.641 527 HA ASP 68 HA ASP 68 -10.634 -3.214 6.815 528 HB2 ASP 68 1HB ASP 68 -11.975 -4.554 8.517 529 HB3 ASP 68 2HB ASP 68 -12.071 -2.800 8.642 530 H VAL 69 H VAL 69 -12.757 -4.187 4.433 531 HA VAL 69 HA VAL 69 -11.667 -6.923 4.555 532 HB VAL 69 HB VAL 69 -14.163 -6.742 5.102 533 HG11 VAL 69 1HG1 VAL 69 -15.658 -6.008 3.607 534 HG12 VAL 69 2HG1 VAL 69 -14.854 -6.820 2.265 535 HG13 VAL 69 3HG1 VAL 69 -14.281 -5.246 2.812 536 HG21 VAL 69 3HG2 VAL 69 -12.755 -8.755 4.215 537 HG22 VAL 69 1HG2 VAL 69 -13.718 -8.529 2.755 538 HG23 VAL 69 2HG2 VAL 69 -14.514 -8.866 4.293 539 H VAL 70 H VAL 70 -10.912 -7.801 2.683 540 HA VAL 70 HA VAL 70 -11.458 -6.596 0.117 541 HB VAL 70 HB VAL 70 -9.123 -6.053 -0.432 542 HG11 VAL 70 1HG1 VAL 70 -10.007 -4.524 1.997 543 HG12 VAL 70 2HG1 VAL 70 -10.745 -4.349 0.406 544 HG13 VAL 70 3HG1 VAL 70 -9.047 -3.934 0.640 545 HG21 VAL 70 3HG2 VAL 70 -8.099 -7.549 1.336 546 HG22 VAL 70 1HG2 VAL 70 -8.490 -6.282 2.504 547 HG23 VAL 70 2HG2 VAL 70 -7.383 -5.941 1.179 548 H GLU 71 H GLU 71 -10.485 -7.757 -1.681 549 HA GLU 71 HA GLU 71 -10.120 -10.579 -1.010 550 HB2 GLU 71 1HB GLU 71 -10.277 -9.571 -3.835 551 HB3 GLU 71 2HB GLU 71 -10.781 -11.119 -3.176 552 HG2 GLU 71 1HG GLU 71 -12.729 -10.258 -2.276 553 HG3 GLU 71 2HG GLU 71 -12.159 -8.594 -2.382 554 H LEU 72 H LEU 72 -8.480 -11.849 -1.871 555 HA LEU 72 HA LEU 72 -5.899 -11.000 -1.559 556 HG LEU 72 HG LEU 72 -4.294 -12.438 -3.382 557 HB2 LEU 72 1HB LEU 72 -6.545 -13.355 -1.690 558 HB3 LEU 72 2HB LEU 72 -6.913 -13.183 -3.392 559 HD11 LEU 72 1HD1 LEU 72 -4.249 -14.788 -1.558 560 HD12 LEU 72 2HD1 LEU 72 -4.440 -13.183 -0.853 561 HD13 LEU 72 3HD1 LEU 72 -3.025 -13.550 -1.839 562 HD21 LEU 72 3HD2 LEU 72 -5.496 -14.106 -4.812 563 HD22 LEU 72 1HD2 LEU 72 -5.232 -15.297 -3.537 564 HD23 LEU 72 2HD2 LEU 72 -3.854 -14.564 -4.361 565 H GLY 73 H GLY 73 -4.501 -9.747 -2.685 566 HA2 GLY 73 1HA GLY 73 -3.412 -9.357 -4.854 567 HA3 GLY 73 2HA GLY 73 -5.004 -9.425 -5.583 568 H ASP 74 H ASP 74 -6.165 -7.677 -3.432 569 HA ASP 74 HA ASP 74 -5.509 -5.204 -4.734 570 HB2 ASP 74 1HB ASP 74 -7.211 -4.276 -3.023 571 HB3 ASP 74 2HB ASP 74 -7.787 -5.358 -4.284 572 H VAL 75 H VAL 75 -4.934 -3.252 -3.667 573 HA VAL 75 HA VAL 75 -3.170 -3.700 -1.327 574 HB VAL 75 HB VAL 75 -2.897 -1.491 -3.397 575 HG11 VAL 75 1HG1 VAL 75 -0.816 -2.459 -1.449 576 HG12 VAL 75 2HG1 VAL 75 -1.929 -1.137 -1.090 577 HG13 VAL 75 3HG1 VAL 75 -0.805 -0.999 -2.439 578 HG21 VAL 75 3HG2 VAL 75 -2.390 -4.181 -3.814 579 HG22 VAL 75 1HG2 VAL 75 -0.812 -3.505 -3.407 580 HG23 VAL 75 2HG2 VAL 75 -1.740 -2.831 -4.745 581 H ALA 76 H ALA 76 -3.120 -1.966 0.336 582 HA ALA 76 HA ALA 76 -5.081 0.142 0.062 583 HB1 ALA 76 3HB ALA 76 -5.628 -2.264 1.592 584 HB2 ALA 76 1HB ALA 76 -6.717 -0.989 1.060 585 HB3 ALA 76 2HB ALA 76 -5.793 -0.793 2.547 586 H TYR 77 H TYR 77 -4.773 1.895 1.445 587 HA TYR 77 HA TYR 77 -2.221 1.857 2.890 588 HD1 TYR 77 HD1 TYR 77 -1.250 4.869 3.921 589 HD2 TYR 77 HD2 TYR 77 -5.308 5.118 2.682 590 HE1 TYR 77 HE1 TYR 77 -1.609 6.703 5.508 591 HE2 TYR 77 HE2 TYR 77 -5.683 6.953 4.275 592 HH TYR 77 HH TYR 77 -4.318 8.693 5.436 593 HB2 TYR 77 1HB TYR 77 -2.005 3.834 1.837 594 HB3 TYR 77 2HB TYR 77 -3.705 3.859 1.382 595 H TRP 78 H TRP 78 -2.065 2.161 5.066 596 HA TRP 78 HA TRP 78 -4.478 1.807 6.601 597 HD1 TRP 78 HD1 TRP 78 -4.752 2.513 9.218 598 HE1 TRP 78 HE1 TRP 78 -5.340 0.884 11.121 599 HE3 TRP 78 HE3 TRP 78 -1.246 -1.086 8.300 600 HZ2 TRP 78 HZ2 TRP 78 -4.428 -1.605 12.105 601 HZ3 TRP 78 HZ3 TRP 78 -1.166 -3.059 9.768 602 HH2 TRP 78 HH2 TRP 78 -2.725 -3.311 11.631 603 HB2 TRP 78 1HB TRP 78 -2.037 0.880 7.023 604 HB3 TRP 78 2HB TRP 78 -1.855 2.392 7.899 605 H ILE 79 H ILE 79 -5.723 3.400 7.374 606 HA ILE 79 HA ILE 79 -4.977 6.130 7.060 607 HB ILE 79 HB ILE 79 -7.394 4.752 8.168 608 HG12 ILE 79 1HG1 ILE 79 -6.566 5.863 5.660 609 HG13 ILE 79 2HG1 ILE 79 -8.019 4.952 6.041 610 HG21 ILE 79 1HG2 ILE 79 -8.436 6.973 8.525 611 HG22 ILE 79 2HG2 ILE 79 -6.851 7.714 8.300 612 HG23 ILE 79 3HG2 ILE 79 -7.129 6.623 9.657 613 HD11 ILE 79 3HD1 ILE 79 -8.672 7.020 5.067 614 HD12 ILE 79 1HD1 ILE 79 -7.642 7.931 6.172 615 HD13 ILE 79 2HD1 ILE 79 -9.067 7.091 6.784 616 HA PRO 80 HA PRO 80 -5.466 6.253 12.079 617 HB2 PRO 80 1HB PRO 80 -4.358 3.473 12.230 618 HB3 PRO 80 2HB PRO 80 -5.397 4.330 13.373 619 HG2 PRO 80 1HG PRO 80 -6.344 2.527 11.577 620 HG3 PRO 80 2HG PRO 80 -7.298 3.887 12.186 621 HD2 PRO 80 1HD PRO 80 -6.266 3.438 9.506 622 HD3 PRO 80 2HD PRO 80 -7.396 4.679 10.074 623 H GLY 81 H GLY 81 -2.908 3.972 11.035 624 HA2 GLY 81 1HA GLY 81 -0.901 5.630 12.305 625 HA3 GLY 81 2HA GLY 81 -0.631 4.085 11.515 626 H LYS 82 H LYS 82 -2.365 5.838 9.349 627 HA LYS 82 HA LYS 82 -1.811 6.829 7.341 628 HB2 LYS 82 1HB LYS 82 0.555 8.174 8.557 629 HB3 LYS 82 2HB LYS 82 -0.677 8.824 7.488 630 HG2 LYS 82 1HG LYS 82 -1.564 9.818 9.258 631 HG3 LYS 82 2HG LYS 82 -2.036 8.227 9.849 632 HD2 LYS 82 1HD LYS 82 0.037 8.024 11.078 633 HD3 LYS 82 2HD LYS 82 0.618 9.549 10.404 634 HE2 LYS 82 1HE LYS 82 -1.737 10.337 11.478 635 HE3 LYS 82 2HE LYS 82 -1.290 9.044 12.588 636 HZ1 LYS 82 3HZ LYS 82 1.016 10.350 12.405 637 HZ2 LYS 82 1HZ LYS 82 -0.154 10.698 13.575 638 HZ3 LYS 82 2HZ LYS 82 -0.054 11.639 12.173 639 H ALA 83 H ALA 83 -0.503 4.300 8.147 640 HA ALA 83 HA ALA 83 1.998 4.460 6.611 641 HB1 ALA 83 3HB ALA 83 1.754 1.946 7.892 642 HB2 ALA 83 1HB ALA 83 1.289 3.183 9.058 643 HB3 ALA 83 2HB ALA 83 2.863 3.265 8.274 644 H ILE 84 H ILE 84 2.294 3.248 4.782 645 HA ILE 84 HA ILE 84 -0.054 2.039 3.588 646 HB ILE 84 HB ILE 84 2.621 1.796 2.303 647 HG12 ILE 84 1HG1 ILE 84 1.089 4.393 2.528 648 HG13 ILE 84 2HG1 ILE 84 2.731 4.084 3.076 649 HG21 ILE 84 1HG2 ILE 84 0.742 0.852 1.169 650 HG22 ILE 84 2HG2 ILE 84 1.269 2.281 0.280 651 HG23 ILE 84 3HG2 ILE 84 -0.160 2.359 1.309 652 HD11 ILE 84 3HD1 ILE 84 2.832 3.459 0.397 653 HD12 ILE 84 1HD1 ILE 84 3.376 4.965 1.140 654 HD13 ILE 84 2HD1 ILE 84 1.753 4.853 0.457 655 H CYS 85 H CYS 85 -0.236 -0.150 2.930 656 HA CYS 85 HA CYS 85 1.814 -1.995 3.874 657 HG CYS 85 HG CYS 85 0.409 -4.273 6.063 658 HB2 CYS 85 1HB CYS 85 0.339 -1.860 5.767 659 HB3 CYS 85 2HB CYS 85 -1.074 -2.103 4.742 660 H LEU 86 H LEU 86 1.687 -4.119 3.051 661 HA LEU 86 HA LEU 86 0.271 -4.303 0.468 662 HG LEU 86 HG LEU 86 1.768 -4.134 -1.092 663 HB2 LEU 86 1HB LEU 86 2.961 -4.879 1.282 664 HB3 LEU 86 2HB LEU 86 2.213 -6.371 0.748 665 HD11 LEU 86 1HD1 LEU 86 4.188 -3.921 -0.025 666 HD12 LEU 86 2HD1 LEU 86 3.899 -3.659 -1.745 667 HD13 LEU 86 3HD1 LEU 86 4.534 -5.207 -1.183 668 HD21 LEU 86 3HD2 LEU 86 1.194 -6.365 -1.732 669 HD22 LEU 86 1HD2 LEU 86 2.808 -6.956 -1.332 670 HD23 LEU 86 2HD2 LEU 86 2.580 -5.863 -2.700 671 H PHE 87 H PHE 87 -0.569 -6.460 -0.128 672 HA PHE 87 HA PHE 87 -1.107 -8.198 2.175 673 HD1 PHE 87 HD2 PHE 87 -2.715 -7.157 3.888 674 HD2 PHE 87 HD1 PHE 87 -3.714 -5.155 0.270 675 HE1 PHE 87 HE2 PHE 87 -3.165 -5.100 5.162 676 HE2 PHE 87 HE1 PHE 87 -4.158 -3.095 1.541 677 HZ PHE 87 HZ PHE 87 -3.889 -3.063 3.984 678 HB2 PHE 87 1HB PHE 87 -3.259 -7.398 0.217 679 HB3 PHE 87 2HB PHE 87 -3.447 -8.350 1.688 680 H PHE 88 H PHE 88 -0.375 -10.144 1.696 681 HA PHE 88 HA PHE 88 -1.012 -11.275 -0.924 682 HD1 PHE 88 HD1 PHE 88 0.845 -9.020 -1.900 683 HD2 PHE 88 HD2 PHE 88 1.669 -13.159 -2.443 684 HE1 PHE 88 HE1 PHE 88 1.086 -8.650 -4.320 685 HE2 PHE 88 HE2 PHE 88 1.914 -12.796 -4.865 686 HZ PHE 88 HZ PHE 88 1.622 -10.538 -5.806 687 HB2 PHE 88 1HB PHE 88 1.635 -10.557 -0.020 688 HB3 PHE 88 2HB PHE 88 1.527 -12.294 -0.291 689 H GLY 89 H GLY 89 -1.985 -11.593 1.883 690 HA2 GLY 89 1HA GLY 89 -2.751 -14.141 2.017 691 HA3 GLY 89 2HA GLY 89 -1.097 -14.272 2.591 692 H LYS 90 H LYS 90 -1.859 -15.027 4.589 693 HA LYS 90 HA LYS 90 -3.720 -14.141 6.292 694 HB2 LYS 90 1HB LYS 90 -2.257 -14.763 8.195 695 HB3 LYS 90 2HB LYS 90 -2.313 -15.972 6.931 696 HG2 LYS 90 1HG LYS 90 -0.086 -13.955 7.172 697 HG3 LYS 90 2HG LYS 90 -0.066 -15.524 7.973 698 HD2 LYS 90 1HD LYS 90 -0.717 -16.196 5.399 699 HD3 LYS 90 2HD LYS 90 0.402 -14.850 5.169 700 HE2 LYS 90 1HE LYS 90 1.783 -16.168 6.994 701 HE3 LYS 90 2HE LYS 90 0.853 -17.529 6.370 702 HZ1 LYS 90 3HZ LYS 90 3.084 -17.052 5.292 703 HZ2 LYS 90 1HZ LYS 90 2.339 -15.713 4.572 704 HZ3 LYS 90 2HZ LYS 90 1.767 -17.272 4.252 705 H THR 91 H THR 91 -3.398 -12.925 8.455 706 HA THR 91 HA THR 91 -1.699 -10.591 8.333 707 HB THR 91 HB THR 91 -4.198 -9.483 8.959 708 HG1 THR 91 HG1 THR 91 -4.389 -11.089 6.631 709 HG21 THR 91 3HG2 THR 91 -3.806 -8.826 6.308 710 HG22 THR 91 1HG2 THR 91 -2.183 -9.146 6.917 711 HG23 THR 91 2HG2 THR 91 -3.204 -7.947 7.710 712 HA PRO 92 HA PRO 92 -1.677 -10.480 12.773 713 HB2 PRO 92 1HB PRO 92 -3.804 -8.614 13.313 714 HB3 PRO 92 2HB PRO 92 -2.064 -8.368 13.464 715 HG2 PRO 92 1HG PRO 92 -3.882 -7.616 11.273 716 HG3 PRO 92 2HG PRO 92 -2.294 -6.955 11.695 717 HD2 PRO 92 1HD PRO 92 -2.668 -8.475 9.512 718 HD3 PRO 92 2HD PRO 92 -1.164 -8.541 10.444 719 H ILE 93 H ILE 93 -4.821 -10.683 11.215 720 HA ILE 93 HA ILE 93 -5.641 -12.601 13.288 721 HB ILE 93 HB ILE 93 -7.546 -10.695 11.936 722 HG12 ILE 93 1HG1 ILE 93 -7.560 -9.914 14.522 723 HG13 ILE 93 2HG1 ILE 93 -5.875 -10.399 14.366 724 HG21 ILE 93 1HG2 ILE 93 -8.121 -13.057 13.054 725 HG22 ILE 93 2HG2 ILE 93 -9.214 -11.673 13.108 726 HG23 ILE 93 3HG2 ILE 93 -8.179 -12.035 14.491 727 HD11 ILE 93 3HD1 ILE 93 -7.343 -8.297 12.806 728 HD12 ILE 93 1HD1 ILE 93 -5.751 -8.903 12.349 729 HD13 ILE 93 2HD1 ILE 93 -5.972 -8.091 13.898 730 H SER 94 H SER 94 -4.443 -13.627 11.126 731 HA SER 94 HA SER 94 -5.935 -14.078 8.819 732 HG SER 94 HG SER 94 -2.980 -14.154 9.918 733 HB2 SER 94 1HB SER 94 -4.530 -16.482 9.456 734 HB3 SER 94 2HB SER 94 -4.098 -15.228 8.295 735 H ASP 95 H ASP 95 -5.443 -16.667 11.198 736 HA ASP 95 HA ASP 95 -6.777 -18.354 11.917 737 HB2 ASP 95 1HB ASP 95 -7.869 -16.594 13.162 738 HB3 ASP 95 2HB ASP 95 -8.841 -16.148 11.765 739 H ASP 96 H ASP 96 -9.545 -17.028 10.215 740 HA ASP 96 HA ASP 96 -9.291 -19.185 8.225 741 HB2 ASP 96 1HB ASP 96 -11.018 -19.670 9.954 742 HB3 ASP 96 2HB ASP 96 -11.870 -18.208 9.468 743 H LYS 97 H LYS 97 -9.473 -15.885 8.699 744 HA LYS 97 HA LYS 97 -10.148 -15.470 5.885 745 HB2 LYS 97 1HB LYS 97 -11.461 -14.161 8.248 746 HB3 LYS 97 2HB LYS 97 -11.355 -13.317 6.709 747 HG2 LYS 97 1HG LYS 97 -12.457 -16.082 6.764 748 HG3 LYS 97 2HG LYS 97 -13.459 -14.740 7.317 749 HD2 LYS 97 1HD LYS 97 -13.983 -14.902 5.053 750 HD3 LYS 97 2HD LYS 97 -12.782 -13.608 5.101 751 HE2 LYS 97 1HE LYS 97 -11.115 -14.952 4.203 752 HE3 LYS 97 2HE LYS 97 -11.936 -16.445 4.658 753 HZ1 LYS 97 3HZ LYS 97 -13.400 -16.273 2.894 754 HZ2 LYS 97 1HZ LYS 97 -11.953 -15.724 2.211 755 HZ3 LYS 97 2HZ LYS 97 -13.140 -14.615 2.683 756 H ILE 98 H ILE 98 -9.830 -12.844 5.587 757 HA ILE 98 HA ILE 98 -7.144 -12.315 6.678 758 HB ILE 98 HB ILE 98 -8.291 -11.600 3.980 759 HG12 ILE 98 1HG1 ILE 98 -5.832 -13.205 4.717 760 HG13 ILE 98 2HG1 ILE 98 -7.394 -13.908 4.290 761 HG21 ILE 98 1HG2 ILE 98 -5.671 -10.743 5.195 762 HG22 ILE 98 2HG2 ILE 98 -7.030 -9.698 4.789 763 HG23 ILE 98 3HG2 ILE 98 -6.133 -10.514 3.510 764 HD11 ILE 98 3HD1 ILE 98 -5.304 -13.188 2.578 765 HD12 ILE 98 1HD1 ILE 98 -6.606 -12.033 2.283 766 HD13 ILE 98 2HD1 ILE 98 -6.913 -13.767 2.145 767 H ARG 99 H ARG 99 -7.107 -10.718 8.079 768 HA ARG 99 HA ARG 99 -8.933 -8.436 7.674 769 HE ARG 99 HE ARG 99 -12.603 -7.882 11.386 770 HB2 ARG 99 1HB ARG 99 -9.125 -10.103 9.772 771 HB3 ARG 99 2HB ARG 99 -7.900 -9.010 10.404 772 HG2 ARG 99 1HG ARG 99 -9.335 -7.187 10.385 773 HG3 ARG 99 2HG ARG 99 -10.436 -7.940 9.231 774 HD2 ARG 99 1HD ARG 99 -11.123 -9.554 10.927 775 HD3 ARG 99 2HD ARG 99 -10.003 -8.830 12.080 776 HH11 ARG 99 1HH1 ARG 99 -9.431 -6.861 12.421 777 HH12 ARG 99 2HH1 ARG 99 -10.005 -5.407 13.167 778 HH21 ARG 99 1HH2 ARG 99 -13.360 -5.970 12.367 779 HH22 ARG 99 2HH2 ARG 99 -12.237 -4.901 13.135 780 HA PRO 100 HA PRO 100 -4.747 -6.666 7.312 781 HB2 PRO 100 1HB PRO 100 -5.510 -4.439 5.977 782 HB3 PRO 100 2HB PRO 100 -5.325 -6.007 5.181 783 HG2 PRO 100 1HG PRO 100 -7.825 -4.697 6.198 784 HG3 PRO 100 2HG PRO 100 -7.538 -5.481 4.630 785 HD2 PRO 100 1HD PRO 100 -8.797 -6.748 6.643 786 HD3 PRO 100 2HD PRO 100 -7.719 -7.609 5.526 787 H ALA 101 H ALA 101 -7.708 -5.106 8.441 788 HA ALA 101 HA ALA 101 -6.535 -4.096 10.797 789 HB1 ALA 101 3HB ALA 101 -6.020 -1.906 10.383 790 HB2 ALA 101 1HB ALA 101 -7.110 -1.791 9.001 791 HB3 ALA 101 2HB ALA 101 -5.562 -2.620 8.837 792 H SER 102 H SER 102 -8.086 -1.748 11.123 793 HA SER 102 HA SER 102 -10.796 -2.889 11.036 794 HG SER 102 HG SER 102 -8.708 -0.993 13.688 795 HB2 SER 102 1HB SER 102 -10.645 -0.765 12.935 796 HB3 SER 102 2HB SER 102 -10.926 -2.480 13.230 797 H ALA 103 H ALA 103 -8.891 -0.508 9.658 798 HA ALA 103 HA ALA 103 -11.100 0.709 8.363 799 HB1 ALA 103 3HB ALA 103 -10.811 2.999 9.283 800 HB2 ALA 103 1HB ALA 103 -9.759 2.318 10.527 801 HB3 ALA 103 2HB ALA 103 -11.455 1.839 10.445 802 H VAL 104 H VAL 104 -9.387 -0.216 6.830 803 HA VAL 104 HA VAL 104 -7.423 1.910 6.238 804 HB VAL 104 HB VAL 104 -5.924 0.317 5.235 805 HG11 VAL 104 1HG1 VAL 104 -5.836 -1.357 7.330 806 HG12 VAL 104 2HG1 VAL 104 -6.897 -0.113 7.990 807 HG13 VAL 104 3HG1 VAL 104 -5.291 0.317 7.404 808 HG21 VAL 104 3HG2 VAL 104 -7.937 -1.189 4.490 809 HG22 VAL 104 1HG2 VAL 104 -7.624 -2.011 6.019 810 HG23 VAL 104 2HG2 VAL 104 -6.357 -1.902 4.801 811 H ASN 105 H ASN 105 -7.205 2.706 4.221 812 HA ASN 105 HA ASN 105 -9.499 2.450 2.501 813 HB2 ASN 105 1HB ASN 105 -7.015 4.049 1.912 814 HB3 ASN 105 2HB ASN 105 -8.659 4.349 1.361 815 HD21 ASN 105 1HD2 ASN 105 -9.883 3.882 3.915 816 HD22 ASN 105 2HD2 ASN 105 -9.502 5.242 4.906 817 H VAL 106 H VAL 106 -9.488 1.926 0.291 818 HA VAL 106 HA VAL 106 -7.549 -0.103 -0.458 819 HB VAL 106 HB VAL 106 -9.264 0.495 -2.658 820 HG11 VAL 106 1HG1 VAL 106 -9.652 -1.761 -2.652 821 HG12 VAL 106 2HG1 VAL 106 -9.674 -1.866 -0.893 822 HG13 VAL 106 3HG1 VAL 106 -8.140 -1.671 -1.746 823 HG21 VAL 106 3HG2 VAL 106 -11.451 -0.172 -1.497 824 HG22 VAL 106 1HG2 VAL 106 -10.928 1.508 -1.384 825 HG23 VAL 106 2HG2 VAL 106 -10.688 0.415 -0.021 826 H ILE 107 H ILE 107 -5.713 1.169 -0.672 827 HA ILE 107 HA ILE 107 -5.566 3.461 -2.324 828 HB ILE 107 HB ILE 107 -4.055 2.602 -0.345 829 HG12 ILE 107 1HG1 ILE 107 -4.009 4.787 -1.701 830 HG13 ILE 107 2HG1 ILE 107 -2.557 4.324 -0.821 831 HG21 ILE 107 1HG2 ILE 107 -3.236 0.612 -1.483 832 HG22 ILE 107 2HG2 ILE 107 -1.919 1.707 -1.073 833 HG23 ILE 107 3HG2 ILE 107 -2.503 1.621 -2.731 834 HD11 ILE 107 3HD1 ILE 107 -1.537 4.795 -2.746 835 HD12 ILE 107 1HD1 ILE 107 -3.014 4.620 -3.691 836 HD13 ILE 107 2HD1 ILE 107 -2.087 3.195 -3.233 837 H GLY 108 H GLY 108 -6.422 0.696 -3.517 838 HA2 GLY 108 1HA GLY 108 -6.351 0.502 -5.947 839 HA3 GLY 108 2HA GLY 108 -4.650 0.918 -5.863 840 H ARG 109 H ARG 109 -3.951 -0.923 -6.939 841 HA ARG 109 HA ARG 109 -3.741 -3.275 -5.277 842 HE ARG 109 HE ARG 109 -7.606 -6.198 -6.037 843 HB2 ARG 109 1HB ARG 109 -4.923 -3.618 -8.026 844 HB3 ARG 109 2HB ARG 109 -4.740 -4.834 -6.770 845 HG2 ARG 109 1HG ARG 109 -6.403 -3.639 -5.400 846 HG3 ARG 109 2HG ARG 109 -6.609 -2.475 -6.709 847 HD2 ARG 109 1HD ARG 109 -8.365 -4.144 -6.783 848 HD3 ARG 109 2HD ARG 109 -7.320 -4.281 -8.194 849 HH11 ARG 109 1HH1 ARG 109 -5.781 -5.196 -8.842 850 HH12 ARG 109 2HH1 ARG 109 -5.059 -6.751 -9.077 851 HH21 ARG 109 1HH2 ARG 109 -6.656 -8.239 -6.352 852 HH22 ARG 109 2HH2 ARG 109 -5.555 -8.478 -7.667 853 H ILE 110 H ILE 110 -2.395 -4.988 -6.363 854 HA ILE 110 HA ILE 110 -0.152 -3.689 -7.708 855 HB ILE 110 HB ILE 110 -0.392 -6.477 -6.567 856 HG12 ILE 110 1HG1 ILE 110 1.520 -4.857 -5.203 857 HG13 ILE 110 2HG1 ILE 110 0.025 -3.939 -5.311 858 HG21 ILE 110 1HG2 ILE 110 1.250 -6.494 -8.298 859 HG22 ILE 110 2HG2 ILE 110 2.093 -6.488 -6.751 860 HG23 ILE 110 3HG2 ILE 110 1.979 -5.005 -7.698 861 HD11 ILE 110 3HD1 ILE 110 -1.185 -5.754 -4.241 862 HD12 ILE 110 1HD1 ILE 110 0.167 -5.219 -3.245 863 HD13 ILE 110 2HD1 ILE 110 0.295 -6.713 -4.171 864 H VAL 111 H VAL 111 -0.127 -3.699 -9.864 865 HA VAL 111 HA VAL 111 -1.795 -5.125 -11.548 866 HB VAL 111 HB VAL 111 0.579 -4.817 -13.041 867 HG11 VAL 111 1HG1 VAL 111 -0.730 -3.537 -14.375 868 HG12 VAL 111 2HG1 VAL 111 -1.427 -2.637 -13.028 869 HG13 VAL 111 3HG1 VAL 111 -1.998 -4.267 -13.390 870 HG21 VAL 111 3HG2 VAL 111 1.445 -3.498 -11.110 871 HG22 VAL 111 1HG2 VAL 111 0.116 -2.363 -11.354 872 HG23 VAL 111 2HG2 VAL 111 1.328 -2.587 -12.616 873 H ASN 112 H ASN 112 1.696 -5.789 -11.601 874 HA ASN 112 HA ASN 112 1.282 -8.479 -12.474 875 HB2 ASN 112 1HB ASN 112 3.777 -8.680 -12.057 876 HB3 ASN 112 2HB ASN 112 3.293 -7.407 -13.175 877 HD21 ASN 112 1HD2 ASN 112 5.606 -6.872 -12.454 878 HD22 ASN 112 2HD2 ASN 112 5.734 -5.761 -11.138 879 H SER 113 H SER 113 0.182 -9.736 -11.058 880 HA SER 113 HA SER 113 0.461 -9.707 -8.264 881 HG SER 113 HG SER 113 -2.062 -11.979 -8.085 882 HB2 SER 113 1HB SER 113 -1.310 -10.845 -9.930 883 HB3 SER 113 2HB SER 113 -0.324 -12.259 -9.566 884 H MET 114 H MET 114 2.437 -11.095 -10.709 885 HA MET 114 HA MET 114 3.561 -13.282 -9.421 886 HB2 MET 114 1HB MET 114 4.738 -11.320 -11.384 887 HB3 MET 114 2HB MET 114 5.611 -12.741 -10.825 888 HG2 MET 114 1HG MET 114 3.056 -13.604 -11.656 889 HG3 MET 114 2HG MET 114 3.677 -12.520 -12.900 890 HE1 MET 114 3HE MET 114 5.578 -13.117 -14.559 891 HE2 MET 114 1HE MET 114 6.879 -14.232 -14.142 892 HE3 MET 114 2HE MET 114 6.603 -12.793 -13.161 893 H GLU 115 H GLU 115 3.961 -9.909 -8.771 894 HA GLU 115 HA GLU 115 6.462 -10.044 -7.440 895 HB2 GLU 115 1HB GLU 115 4.244 -8.044 -6.981 896 HB3 GLU 115 2HB GLU 115 5.950 -7.833 -6.610 897 HG2 GLU 115 1HG GLU 115 4.732 -8.088 -9.350 898 HG3 GLU 115 2HG GLU 115 5.369 -6.620 -8.612 899 H GLY 116 H GLY 116 6.609 -11.590 -5.898 900 HA2 GLY 116 1HA GLY 116 4.536 -11.793 -3.847 901 HA3 GLY 116 2HA GLY 116 5.882 -12.898 -4.077 902 H LEU 117 H LEU 117 5.835 -9.366 -3.682 903 HA LEU 117 HA LEU 117 8.092 -9.041 -2.235 904 HG LEU 117 HG LEU 117 8.169 -7.033 -0.711 905 HB2 LEU 117 1HB LEU 117 6.727 -7.177 -2.998 906 HB3 LEU 117 2HB LEU 117 5.486 -7.572 -1.825 907 HD11 LEU 117 1HD1 LEU 117 8.214 -5.310 -2.335 908 HD12 LEU 117 2HD1 LEU 117 7.750 -4.575 -0.802 909 HD13 LEU 117 3HD1 LEU 117 6.526 -4.896 -2.029 910 HD21 LEU 117 3HD2 LEU 117 5.690 -7.369 0.333 911 HD22 LEU 117 1HD2 LEU 117 5.793 -5.610 0.253 912 HD23 LEU 117 2HD2 LEU 117 7.007 -6.525 1.143 913 H LYS 118 H LYS 118 5.020 -10.207 -1.006 914 HA LYS 118 HA LYS 118 5.208 -9.964 1.687 915 HB2 LYS 118 1HB LYS 118 4.144 -12.274 1.836 916 HB3 LYS 118 2HB LYS 118 3.308 -11.079 0.860 917 HG2 LYS 118 1HG LYS 118 3.189 -12.903 -0.507 918 HG3 LYS 118 2HG LYS 118 4.679 -12.175 -1.094 919 HD2 LYS 118 1HD LYS 118 5.182 -14.455 -0.842 920 HD3 LYS 118 2HD LYS 118 5.868 -13.692 0.592 921 HE2 LYS 118 1HE LYS 118 4.752 -15.650 1.326 922 HE3 LYS 118 2HE LYS 118 3.744 -14.283 1.796 923 HZ1 LYS 118 3HZ LYS 118 2.142 -15.515 0.845 924 HZ2 LYS 118 1HZ LYS 118 3.218 -16.399 -0.117 925 HZ3 LYS 118 2HZ LYS 118 2.728 -14.853 -0.596 926 H GLY 119 H GLY 119 7.336 -11.901 -0.291 927 HA2 GLY 119 1HA GLY 119 8.398 -13.338 2.008 928 HA3 GLY 119 2HA GLY 119 8.892 -13.539 0.334 929 H VAL 120 H VAL 120 8.698 -10.460 2.010 930 HA VAL 120 HA VAL 120 11.393 -9.800 1.301 931 HB VAL 120 HB VAL 120 10.958 -7.749 2.745 932 HG11 VAL 120 1HG1 VAL 120 10.551 -6.969 0.710 933 HG12 VAL 120 2HG1 VAL 120 8.844 -7.297 1.000 934 HG13 VAL 120 3HG1 VAL 120 9.848 -8.502 0.193 935 HG21 VAL 120 3HG2 VAL 120 8.143 -7.824 2.736 936 HG22 VAL 120 1HG2 VAL 120 9.225 -7.761 4.127 937 HG23 VAL 120 2HG2 VAL 120 8.689 -9.317 3.497 938 H ALA 121 H ALA 121 13.114 -9.249 2.791 939 HA ALA 121 HA ALA 121 13.310 -11.106 4.978 940 HB1 ALA 121 3HB ALA 121 15.229 -10.488 3.488 941 HB2 ALA 121 1HB ALA 121 15.569 -10.355 5.212 942 HB3 ALA 121 2HB ALA 121 15.245 -8.903 4.265 943 H ASP 122 H ASP 122 13.439 -10.603 7.199 944 HA ASP 122 HA ASP 122 11.748 -8.609 8.129 945 HB2 ASP 122 1HB ASP 122 12.531 -9.124 10.351 946 HB3 ASP 122 2HB ASP 122 12.381 -10.616 9.425 947 H GLY 123 H GLY 123 11.993 -6.507 7.882 948 HA2 GLY 123 1HA GLY 123 12.869 -4.405 8.204 949 HA3 GLY 123 2HA GLY 123 14.190 -5.145 9.090 950 H GLU 124 H GLU 124 13.205 -3.702 6.161 951 HA GLU 124 HA GLU 124 15.938 -3.692 5.230 952 HB2 GLU 124 1HB GLU 124 15.170 -4.412 2.879 953 HB3 GLU 124 2HB GLU 124 15.437 -5.658 4.086 954 HG2 GLU 124 1HG GLU 124 13.104 -5.944 4.423 955 HG3 GLU 124 2HG GLU 124 12.728 -4.520 3.449 956 H SER 125 H SER 125 16.383 -2.071 3.692 957 HA SER 125 HA SER 125 15.106 0.336 4.008 958 HG SER 125 HG SER 125 17.319 1.780 1.870 959 HB2 SER 125 1HB SER 125 17.319 -0.461 2.676 960 HB3 SER 125 2HB SER 125 16.259 -0.093 1.315 961 H VAL 126 H VAL 126 13.960 1.679 2.441 962 HA VAL 126 HA VAL 126 12.326 0.418 0.430 963 HB VAL 126 HB VAL 126 10.962 1.623 2.847 964 HG11 VAL 126 1HG1 VAL 126 9.773 2.056 0.763 965 HG12 VAL 126 2HG1 VAL 126 8.891 0.919 1.780 966 HG13 VAL 126 3HG1 VAL 126 9.797 0.334 0.388 967 HG21 VAL 126 3HG2 VAL 126 10.046 -0.667 3.159 968 HG22 VAL 126 1HG2 VAL 126 11.776 -0.527 3.463 969 HG23 VAL 126 2HG2 VAL 126 11.201 -1.237 1.954 970 H VAL 127 H VAL 127 11.983 1.870 -1.176 971 HA VAL 127 HA VAL 127 12.089 4.729 -0.468 972 HB VAL 127 HB VAL 127 13.187 5.182 -2.641 973 HG11 VAL 127 1HG1 VAL 127 15.115 3.323 -1.469 974 HG12 VAL 127 2HG1 VAL 127 14.336 4.383 -0.294 975 HG13 VAL 127 3HG1 VAL 127 15.198 5.074 -1.669 976 HG21 VAL 127 3HG2 VAL 127 14.324 2.648 -3.191 977 HG22 VAL 127 1HG2 VAL 127 13.272 3.626 -4.216 978 HG23 VAL 127 2HG2 VAL 127 12.575 2.441 -3.109 979 H VAL 128 H VAL 128 10.077 5.444 -0.704 980 HA VAL 128 HA VAL 128 8.286 4.355 -2.695 981 HB VAL 128 HB VAL 128 7.460 6.836 -1.336 982 HG11 VAL 128 1HG1 VAL 128 5.679 5.790 -2.319 983 HG12 VAL 128 2HG1 VAL 128 5.569 5.121 -0.693 984 HG13 VAL 128 3HG1 VAL 128 6.302 4.174 -1.985 985 HG21 VAL 128 3HG2 VAL 128 6.997 5.261 0.764 986 HG22 VAL 128 1HG2 VAL 128 8.448 6.253 0.627 987 HG23 VAL 128 2HG2 VAL 128 8.509 4.539 0.217 988 H GLU 129 H GLU 129 7.927 5.217 -4.714 989 HA GLU 129 HA GLU 129 8.400 8.022 -5.219 990 HB2 GLU 129 1HB GLU 129 9.914 7.533 -7.151 991 HB3 GLU 129 2HB GLU 129 10.622 7.202 -5.576 992 HG2 GLU 129 1HG GLU 129 9.379 4.823 -6.431 993 HG3 GLU 129 2HG GLU 129 10.284 5.458 -7.805 994 H ARG 130 H ARG 130 6.897 8.768 -6.604 995 HA ARG 130 HA ARG 130 5.044 6.958 -7.836 996 HE ARG 130 HE ARG 130 4.864 8.922 -11.787 997 HB2 ARG 130 1HB ARG 130 4.311 9.108 -6.918 998 HB3 ARG 130 2HB ARG 130 5.329 9.960 -8.068 999 HG2 ARG 130 1HG ARG 130 3.339 8.085 -9.189 1000 HG3 ARG 130 2HG ARG 130 2.728 9.562 -8.441 1001 HD2 ARG 130 1HD ARG 130 3.196 10.649 -10.318 1002 HD3 ARG 130 2HD ARG 130 4.906 10.348 -10.020 1003 HH11 ARG 130 1HH1 ARG 130 1.638 9.090 -10.470 1004 HH12 ARG 130 2HH1 ARG 130 0.958 8.046 -11.672 1005 HH21 ARG 130 1HH2 ARG 130 3.969 7.552 -13.373 1006 HH22 ARG 130 2HH2 ARG 130 2.280 7.173 -13.319 1007 H ALA 131 H ALA 131 6.221 5.762 -9.333 1008 HA ALA 131 HA ALA 131 7.394 5.291 -11.257 1009 HB1 ALA 131 3HB ALA 131 4.949 6.073 -11.824 1010 HB2 ALA 131 1HB ALA 131 6.115 5.705 -13.095 1011 HB3 ALA 131 2HB ALA 131 5.804 7.382 -12.641 Start of MODEL 17 1 H MET 1 H MET 1 -6.799 10.403 -16.305 2 HA MET 1 HA MET 1 -7.154 13.181 -17.164 3 HB2 MET 1 1HB MET 1 -4.723 11.865 -16.423 4 HB3 MET 1 2HB MET 1 -4.731 12.078 -18.168 5 HG2 MET 1 1HG MET 1 -3.705 13.997 -17.364 6 HG3 MET 1 2HG MET 1 -5.361 14.504 -17.690 7 HE1 MET 1 3HE MET 1 -5.425 16.770 -15.210 8 HE2 MET 1 1HE MET 1 -4.381 16.424 -16.588 9 HE3 MET 1 2HE MET 1 -3.705 16.474 -14.960 10 H GLY 2 H GLY 2 -8.645 10.691 -17.645 11 HA2 GLY 2 1HA GLY 2 -8.608 10.798 -20.524 12 HA3 GLY 2 2HA GLY 2 -8.052 9.260 -19.880 13 H GLU 3 H GLU 3 -9.550 8.203 -18.285 14 HA GLU 3 HA GLU 3 -12.179 8.095 -19.444 15 HB2 GLU 3 1HB GLU 3 -11.244 6.664 -16.961 16 HB3 GLU 3 2HB GLU 3 -12.551 6.201 -18.042 17 HG2 GLU 3 1HG GLU 3 -11.106 5.426 -19.670 18 HG3 GLU 3 2HG GLU 3 -9.749 6.370 -19.059 19 H ARG 4 H ARG 4 -11.051 8.579 -16.095 20 HA ARG 4 HA ARG 4 -13.058 10.650 -15.727 21 HE ARG 4 HE ARG 4 -16.338 9.569 -15.637 22 HB2 ARG 4 1HB ARG 4 -13.088 8.799 -13.453 23 HB3 ARG 4 2HB ARG 4 -14.416 9.608 -14.264 24 HG2 ARG 4 1HG ARG 4 -13.130 7.367 -15.712 25 HG3 ARG 4 2HG ARG 4 -14.086 6.964 -14.290 26 HD2 ARG 4 1HD ARG 4 -14.957 8.226 -16.864 27 HD3 ARG 4 2HD ARG 4 -15.625 6.830 -16.024 28 HH11 ARG 4 1HH1 ARG 4 -16.101 6.471 -14.048 29 HH12 ARG 4 2HH1 ARG 4 -17.315 6.840 -12.870 30 HH21 ARG 4 1HH2 ARG 4 -17.936 10.057 -14.087 31 HH22 ARG 4 2HH2 ARG 4 -18.357 8.877 -12.892 32 H GLY 5 H GLY 5 -11.115 8.665 -13.502 33 HA2 GLY 5 1HA GLY 5 -9.083 10.595 -13.118 34 HA3 GLY 5 2HA GLY 5 -10.303 10.772 -11.867 35 H VAL 6 H VAL 6 -9.452 7.699 -13.327 36 HA VAL 6 HA VAL 6 -8.075 6.947 -10.821 37 HB VAL 6 HB VAL 6 -9.090 4.704 -10.957 38 HG11 VAL 6 1HG1 VAL 6 -11.537 5.542 -10.534 39 HG12 VAL 6 2HG1 VAL 6 -10.783 7.134 -10.622 40 HG13 VAL 6 3HG1 VAL 6 -10.236 5.963 -9.421 41 HG21 VAL 6 3HG2 VAL 6 -11.224 5.563 -12.801 42 HG22 VAL 6 1HG2 VAL 6 -10.465 3.986 -12.595 43 HG23 VAL 6 2HG2 VAL 6 -9.657 5.234 -13.540 44 H GLU 7 H GLU 7 -6.236 7.564 -12.314 45 HA GLU 7 HA GLU 7 -5.231 5.134 -13.548 46 HB2 GLU 7 1HB GLU 7 -4.580 6.217 -15.581 47 HB3 GLU 7 2HB GLU 7 -6.300 6.469 -15.356 48 HG2 GLU 7 1HG GLU 7 -4.116 8.468 -14.802 49 HG3 GLU 7 2HG GLU 7 -5.220 8.477 -16.177 50 H MET 8 H MET 8 -4.618 6.566 -11.096 51 HA MET 8 HA MET 8 -1.920 7.574 -11.678 52 HB2 MET 8 1HB MET 8 -3.745 8.880 -10.299 53 HB3 MET 8 2HB MET 8 -3.190 7.848 -8.989 54 HG2 MET 8 1HG MET 8 -1.578 9.311 -8.616 55 HG3 MET 8 2HG MET 8 -0.864 8.832 -10.154 56 HE1 MET 8 3HE MET 8 -0.658 12.015 -11.918 57 HE2 MET 8 1HE MET 8 -1.063 10.379 -12.439 58 HE3 MET 8 2HE MET 8 0.166 10.632 -11.199 59 H ARG 9 H ARG 9 -0.325 6.176 -11.405 60 HA ARG 9 HA ARG 9 -0.598 4.164 -9.269 61 HE ARG 9 HE ARG 9 4.441 2.821 -12.461 62 HB2 ARG 9 1HB ARG 9 0.291 2.507 -10.595 63 HB3 ARG 9 2HB ARG 9 -0.624 3.434 -11.775 64 HG2 ARG 9 1HG ARG 9 1.285 3.294 -12.953 65 HG3 ARG 9 2HG ARG 9 1.756 4.675 -11.958 66 HD2 ARG 9 1HD ARG 9 3.178 3.437 -10.668 67 HD3 ARG 9 2HD ARG 9 2.241 1.956 -10.871 68 HH11 ARG 9 1HH1 ARG 9 1.428 1.064 -12.587 69 HH12 ARG 9 2HH1 ARG 9 1.908 0.092 -13.939 70 HH21 ARG 9 1HH2 ARG 9 5.074 1.543 -14.238 71 HH22 ARG 9 2HH2 ARG 9 3.977 0.363 -14.875 72 H LEU 10 H LEU 10 1.141 3.661 -8.017 73 HA LEU 10 HA LEU 10 3.440 5.491 -8.232 74 HG LEU 10 HG LEU 10 0.882 4.115 -5.964 75 HB2 LEU 10 1HB LEU 10 3.376 4.431 -5.607 76 HB3 LEU 10 2HB LEU 10 3.154 6.092 -6.110 77 HD11 LEU 10 1HD1 LEU 10 1.752 4.280 -3.733 78 HD12 LEU 10 2HD1 LEU 10 0.310 5.293 -3.827 79 HD13 LEU 10 3HD1 LEU 10 1.911 6.032 -3.872 80 HD21 LEU 10 3HD2 LEU 10 1.099 6.646 -7.104 81 HD22 LEU 10 1HD2 LEU 10 0.285 6.911 -5.563 82 HD23 LEU 10 2HD2 LEU 10 -0.388 5.773 -6.729 83 H ARG 11 H ARG 11 5.476 4.599 -7.293 84 HA ARG 11 HA ARG 11 5.684 1.747 -7.962 85 HE ARG 11 HE ARG 11 10.427 0.725 -8.799 86 HB2 ARG 11 1HB ARG 11 7.065 3.911 -9.006 87 HB3 ARG 11 2HB ARG 11 8.206 3.211 -7.867 88 HG2 ARG 11 1HG ARG 11 6.795 1.637 -10.007 89 HG3 ARG 11 2HG ARG 11 8.391 2.362 -10.203 90 HD2 ARG 11 1HD ARG 11 8.391 0.899 -7.771 91 HD3 ARG 11 2HD ARG 11 7.698 -0.133 -9.022 92 HH11 ARG 11 1HH1 ARG 11 7.951 -0.341 -11.016 93 HH12 ARG 11 2HH1 ARG 11 9.080 -0.929 -12.190 94 HH21 ARG 11 1HH2 ARG 11 11.913 -0.047 -10.343 95 HH22 ARG 11 2HH2 ARG 11 11.329 -0.763 -11.807 96 H ILE 12 H ILE 12 6.858 0.366 -6.625 97 HA ILE 12 HA ILE 12 7.967 1.448 -4.156 98 HB ILE 12 HB ILE 12 5.470 -0.087 -4.289 99 HG12 ILE 12 1HG1 ILE 12 6.614 1.078 -1.793 100 HG13 ILE 12 2HG1 ILE 12 6.204 2.169 -3.113 101 HG21 ILE 12 1HG2 ILE 12 6.013 -1.333 -2.134 102 HG22 ILE 12 2HG2 ILE 12 7.707 -1.117 -2.573 103 HG23 ILE 12 3HG2 ILE 12 6.627 -2.015 -3.640 104 HD11 ILE 12 3HD1 ILE 12 4.387 1.971 -1.505 105 HD12 ILE 12 1HD1 ILE 12 4.316 0.232 -1.796 106 HD13 ILE 12 2HD1 ILE 12 3.915 1.360 -3.091 107 H ARG 13 H ARG 13 10.000 0.829 -4.479 108 HA ARG 13 HA ARG 13 10.510 -1.905 -5.417 109 HE ARG 13 HE ARG 13 14.982 0.284 -5.284 110 HB2 ARG 13 1HB ARG 13 12.836 -1.102 -5.816 111 HB3 ARG 13 2HB ARG 13 11.617 -0.246 -6.750 112 HG2 ARG 13 1HG ARG 13 11.689 1.587 -5.092 113 HG3 ARG 13 2HG ARG 13 12.989 0.734 -4.256 114 HD2 ARG 13 1HD ARG 13 13.226 1.353 -7.171 115 HD3 ARG 13 2HD ARG 13 13.562 2.601 -5.974 116 HH11 ARG 13 1HH1 ARG 13 14.952 2.761 -7.742 117 HH12 ARG 13 2HH1 ARG 13 16.651 2.638 -8.063 118 HH21 ARG 13 1HH2 ARG 13 17.214 0.119 -5.705 119 HH22 ARG 13 2HH2 ARG 13 17.934 1.139 -6.906 120 H PHE 14 H PHE 14 12.176 -3.161 -4.452 121 HA PHE 14 HA PHE 14 12.925 -2.471 -1.714 122 HD1 PHE 14 HD1 PHE 14 9.388 -3.285 -2.460 123 HD2 PHE 14 HD2 PHE 14 11.915 -3.979 0.894 124 HE1 PHE 14 HE1 PHE 14 7.686 -2.305 -0.978 125 HE2 PHE 14 HE2 PHE 14 10.216 -2.999 2.380 126 HZ PHE 14 HZ PHE 14 8.098 -2.163 1.445 127 HB2 PHE 14 1HB PHE 14 11.291 -4.840 -2.564 128 HB3 PHE 14 2HB PHE 14 12.394 -4.991 -1.201 129 H GLU 15 H GLU 15 14.909 -3.228 -1.139 130 HA GLU 15 HA GLU 15 16.850 -3.724 -2.977 131 HB2 GLU 15 1HB GLU 15 16.620 -4.191 -0.071 132 HB3 GLU 15 2HB GLU 15 17.838 -5.160 -0.882 133 HG2 GLU 15 1HG GLU 15 18.479 -2.872 0.123 134 HG3 GLU 15 2HG GLU 15 19.113 -3.348 -1.448 135 H SER 16 H SER 16 14.611 -6.064 -1.686 136 HA SER 16 HA SER 16 15.904 -8.119 -3.361 137 HG SER 16 HG SER 16 17.124 -8.440 -0.802 138 HB2 SER 16 1HB SER 16 14.965 -8.249 -0.542 139 HB3 SER 16 2HB SER 16 14.706 -9.674 -1.548 140 H ALA 17 H ALA 17 13.554 -6.216 -3.809 141 HA ALA 17 HA ALA 17 11.947 -8.041 -5.250 142 HB1 ALA 17 3HB ALA 17 10.191 -8.564 -3.944 143 HB2 ALA 17 1HB ALA 17 10.190 -6.999 -3.127 144 HB3 ALA 17 2HB ALA 17 11.325 -8.257 -2.631 145 H GLU 18 H GLU 18 10.222 -7.078 -6.417 146 HA GLU 18 HA GLU 18 10.038 -4.144 -6.255 147 HB2 GLU 18 1HB GLU 18 10.088 -4.041 -8.745 148 HB3 GLU 18 2HB GLU 18 11.611 -4.546 -8.027 149 HG2 GLU 18 1HG GLU 18 11.566 -6.209 -9.499 150 HG3 GLU 18 2HG GLU 18 10.341 -6.933 -8.458 151 H CYS 19 H CYS 19 8.039 -3.251 -6.819 152 HA CYS 19 HA CYS 19 5.982 -4.845 -8.043 153 HG CYS 19 HG CYS 19 6.079 -5.666 -3.905 154 HB2 CYS 19 1HB CYS 19 4.688 -4.170 -5.618 155 HB3 CYS 19 2HB CYS 19 5.036 -5.778 -6.241 156 H GLU 20 H GLU 20 4.092 -3.659 -8.578 157 HA GLU 20 HA GLU 20 4.255 -0.770 -8.030 158 HB2 GLU 20 1HB GLU 20 3.061 -1.694 -10.597 159 HB3 GLU 20 2HB GLU 20 3.930 -0.208 -10.237 160 HG2 GLU 20 1HG GLU 20 5.993 -1.744 -10.021 161 HG3 GLU 20 2HG GLU 20 5.011 -2.909 -10.902 162 H VAL 21 H VAL 21 2.172 0.359 -8.164 163 HA VAL 21 HA VAL 21 -0.222 -1.268 -8.110 164 HB VAL 21 HB VAL 21 -0.450 -1.476 -5.916 165 HG11 VAL 21 1HG1 VAL 21 1.909 -1.630 -5.701 166 HG12 VAL 21 2HG1 VAL 21 1.319 -0.656 -4.352 167 HG13 VAL 21 3HG1 VAL 21 2.092 0.126 -5.734 168 HG21 VAL 21 3HG2 VAL 21 -0.753 0.478 -4.442 169 HG22 VAL 21 1HG2 VAL 21 -1.689 0.599 -5.930 170 HG23 VAL 21 2HG2 VAL 21 -0.200 1.526 -5.747 171 H GLU 22 H GLU 22 -2.086 -0.141 -8.504 172 HA GLU 22 HA GLU 22 -1.725 2.581 -9.473 173 HB2 GLU 22 1HB GLU 22 -3.817 0.470 -9.847 174 HB3 GLU 22 2HB GLU 22 -4.204 2.149 -10.195 175 HG2 GLU 22 1HG GLU 22 -3.029 2.154 -12.094 176 HG3 GLU 22 2HG GLU 22 -1.693 1.248 -11.383 177 H LEU 23 H LEU 23 -4.012 3.885 -9.143 178 HA LEU 23 HA LEU 23 -4.937 3.578 -6.413 179 HG LEU 23 HG LEU 23 -5.528 6.425 -5.863 180 HB2 LEU 23 1HB LEU 23 -3.003 4.881 -5.979 181 HB3 LEU 23 2HB LEU 23 -3.317 5.935 -7.340 182 HD11 LEU 23 1HD1 LEU 23 -4.881 4.983 -4.024 183 HD12 LEU 23 2HD1 LEU 23 -4.815 6.670 -3.516 184 HD13 LEU 23 3HD1 LEU 23 -3.326 5.806 -3.897 185 HD21 LEU 23 3HD2 LEU 23 -4.045 8.332 -4.880 186 HD22 LEU 23 1HD2 LEU 23 -4.363 8.256 -6.612 187 HD23 LEU 23 2HD2 LEU 23 -2.826 7.675 -5.971 188 H TYR 24 H TYR 24 -6.996 4.112 -6.210 189 HA TYR 24 HA TYR 24 -8.231 5.705 -8.363 190 HD1 TYR 24 HD2 TYR 24 -7.684 4.091 -9.731 191 HD2 TYR 24 HD1 TYR 24 -9.879 1.416 -7.253 192 HE1 TYR 24 HE2 TYR 24 -6.819 2.189 -11.027 193 HE2 TYR 24 HE1 TYR 24 -9.020 -0.492 -8.543 194 HH TYR 24 HH TYR 24 -7.120 -1.034 -9.986 195 HB2 TYR 24 1HB TYR 24 -9.671 3.685 -6.630 196 HB3 TYR 24 2HB TYR 24 -10.245 4.442 -8.112 197 H GLU 25 H GLU 25 -9.446 7.461 -7.844 198 HA GLU 25 HA GLU 25 -9.056 8.739 -5.399 199 HB2 GLU 25 1HB GLU 25 -11.267 9.240 -7.386 200 HB3 GLU 25 2HB GLU 25 -10.778 10.332 -6.096 201 HG2 GLU 25 1HG GLU 25 -9.406 9.669 -8.647 202 HG3 GLU 25 2HG GLU 25 -9.695 11.236 -7.895 203 H GLU 26 H GLU 26 -11.134 6.139 -5.927 204 HA GLU 26 HA GLU 26 -13.443 6.640 -4.586 205 HB2 GLU 26 1HB GLU 26 -13.596 4.321 -4.084 206 HB3 GLU 26 2HB GLU 26 -12.711 4.447 -5.597 207 HG2 GLU 26 1HG GLU 26 -10.596 4.226 -4.274 208 HG3 GLU 26 2HG GLU 26 -11.595 3.871 -2.867 209 H TRP 27 H TRP 27 -10.244 6.447 -3.210 210 HA TRP 27 HA TRP 27 -11.119 6.296 -0.485 211 HD1 TRP 27 HD1 TRP 27 -10.102 7.515 1.521 212 HE1 TRP 27 HE1 TRP 27 -8.316 8.374 3.163 213 HE3 TRP 27 HE3 TRP 27 -5.926 6.587 -1.269 214 HZ2 TRP 27 HZ2 TRP 27 -5.503 8.624 3.261 215 HZ3 TRP 27 HZ3 TRP 27 -3.725 7.164 -0.332 216 HH2 TRP 27 HH2 TRP 27 -3.520 8.162 1.887 217 HB2 TRP 27 1HB TRP 27 -8.951 5.419 -0.886 218 HB3 TRP 27 2HB TRP 27 -8.468 6.825 -1.828 219 H ALA 28 H ALA 28 -9.691 8.842 -2.547 220 HA ALA 28 HA ALA 28 -11.332 10.903 -2.097 221 HB1 ALA 28 3HB ALA 28 -11.372 11.149 0.153 222 HB2 ALA 28 1HB ALA 28 -9.919 12.100 -0.152 223 HB3 ALA 28 2HB ALA 28 -9.780 10.422 0.373 224 HA PRO 29 HA PRO 29 -8.182 12.261 -5.007 225 HB2 PRO 29 1HB PRO 29 -9.397 14.857 -5.000 226 HB3 PRO 29 2HB PRO 29 -9.468 13.622 -6.255 227 HG2 PRO 29 1HG PRO 29 -11.463 14.348 -4.247 228 HG3 PRO 29 2HG PRO 29 -11.655 13.398 -5.727 229 HD2 PRO 29 1HD PRO 29 -11.765 12.359 -3.190 230 HD3 PRO 29 2HD PRO 29 -11.343 11.422 -4.632 231 H GLU 30 H GLU 30 -9.232 14.174 -2.200 232 HA GLU 30 HA GLU 30 -7.061 15.950 -2.138 233 HB2 GLU 30 1HB GLU 30 -8.902 14.964 0.038 234 HB3 GLU 30 2HB GLU 30 -7.697 16.217 0.297 235 HG2 GLU 30 1HG GLU 30 -9.597 17.444 -0.113 236 HG3 GLU 30 2HG GLU 30 -8.841 17.390 -1.704 237 H THR 31 H THR 31 -7.570 12.856 -0.459 238 HA THR 31 HA THR 31 -5.111 12.900 0.963 239 HB THR 31 HB THR 31 -5.736 10.194 0.494 240 HG1 THR 31 HG1 THR 31 -7.815 10.060 0.265 241 HG21 THR 31 3HG2 THR 31 -5.241 10.615 2.678 242 HG22 THR 31 1HG2 THR 31 -6.997 10.504 2.769 243 HG23 THR 31 2HG2 THR 31 -6.216 12.084 2.745 244 H VAL 32 H VAL 32 -6.029 11.477 -2.149 245 HA VAL 32 HA VAL 32 -3.764 10.113 -2.855 246 HB VAL 32 HB VAL 32 -5.536 11.846 -4.583 247 HG11 VAL 32 1HG1 VAL 32 -3.703 11.671 -5.964 248 HG12 VAL 32 2HG1 VAL 32 -4.608 10.223 -6.405 249 HG13 VAL 32 3HG1 VAL 32 -3.228 10.102 -5.314 250 HG21 VAL 32 3HG2 VAL 32 -6.030 9.250 -5.238 251 HG22 VAL 32 1HG2 VAL 32 -6.969 10.196 -4.082 252 HG23 VAL 32 2HG2 VAL 32 -5.689 9.124 -3.512 253 H ARG 33 H ARG 33 -4.282 13.593 -2.874 254 HA ARG 33 HA ARG 33 -2.055 14.406 -4.328 255 HE ARG 33 HE ARG 33 -1.327 19.236 -4.271 256 HB2 ARG 33 1HB ARG 33 -4.006 15.805 -3.393 257 HB3 ARG 33 2HB ARG 33 -3.044 15.922 -1.926 258 HG2 ARG 33 1HG ARG 33 -1.175 16.760 -3.520 259 HG3 ARG 33 2HG ARG 33 -2.512 17.066 -4.631 260 HD2 ARG 33 1HD ARG 33 -3.613 18.400 -2.847 261 HD3 ARG 33 2HD ARG 33 -2.176 18.180 -1.850 262 HH11 ARG 33 1HH1 ARG 33 -3.362 20.201 -1.604 263 HH12 ARG 33 2HH1 ARG 33 -3.039 21.890 -1.807 264 HH21 ARG 33 1HH2 ARG 33 -0.902 21.456 -4.540 265 HH22 ARG 33 2HH2 ARG 33 -1.644 22.603 -3.474 266 H ALA 34 H ALA 34 -2.300 13.546 -0.902 267 HA ALA 34 HA ALA 34 0.292 14.393 -0.155 268 HB1 ALA 34 3HB ALA 34 -1.812 12.692 1.031 269 HB2 ALA 34 1HB ALA 34 -0.922 14.048 1.720 270 HB3 ALA 34 2HB ALA 34 -0.168 12.457 1.628 271 H ILE 35 H ILE 35 -0.938 11.223 -1.174 272 HA ILE 35 HA ILE 35 1.424 9.762 -0.866 273 HB ILE 35 HB ILE 35 -0.030 9.045 -3.318 274 HG12 ILE 35 1HG1 ILE 35 -1.916 10.049 -2.116 275 HG13 ILE 35 2HG1 ILE 35 -2.080 8.297 -2.190 276 HG21 ILE 35 1HG2 ILE 35 1.606 7.694 -1.886 277 HG22 ILE 35 2HG2 ILE 35 0.158 6.882 -2.483 278 HG23 ILE 35 3HG2 ILE 35 0.233 7.432 -0.809 279 HD11 ILE 35 3HD1 ILE 35 -1.664 8.034 0.065 280 HD12 ILE 35 1HD1 ILE 35 -2.593 9.534 0.016 281 HD13 ILE 35 2HD1 ILE 35 -0.839 9.586 0.200 282 H ALA 36 H ALA 36 0.212 11.550 -3.744 283 HA ALA 36 HA ALA 36 2.459 11.065 -5.382 284 HB1 ALA 36 3HB ALA 36 1.023 13.608 -5.776 285 HB2 ALA 36 1HB ALA 36 0.030 12.150 -5.812 286 HB3 ALA 36 2HB ALA 36 1.393 12.317 -6.920 287 H ASP 37 H ASP 37 1.837 13.334 -2.812 288 HA ASP 37 HA ASP 37 3.965 15.134 -3.490 289 HB2 ASP 37 1HB ASP 37 1.888 15.510 -1.946 290 HB3 ASP 37 2HB ASP 37 2.920 14.823 -0.696 291 H ALA 38 H ALA 38 3.765 12.112 -1.827 292 HA ALA 38 HA ALA 38 6.403 12.383 -0.637 293 HB1 ALA 38 3HB ALA 38 4.105 11.307 0.312 294 HB2 ALA 38 1HB ALA 38 5.718 10.888 0.897 295 HB3 ALA 38 2HB ALA 38 4.922 9.868 -0.303 296 H LEU 39 H LEU 39 6.642 12.344 -3.338 297 HA LEU 39 HA LEU 39 6.883 9.793 -4.523 298 HG LEU 39 HG LEU 39 6.106 12.966 -5.574 299 HB2 LEU 39 1HB LEU 39 8.334 12.343 -5.260 300 HB3 LEU 39 2HB LEU 39 8.165 10.926 -6.270 301 HD11 LEU 39 1HD1 LEU 39 5.705 12.185 -8.130 302 HD12 LEU 39 2HD1 LEU 39 7.436 11.890 -7.960 303 HD13 LEU 39 3HD1 LEU 39 6.781 13.498 -7.647 304 HD21 LEU 39 3HD2 LEU 39 4.817 11.118 -4.988 305 HD22 LEU 39 1HD2 LEU 39 5.616 10.065 -6.147 306 HD23 LEU 39 2HD2 LEU 39 4.482 11.286 -6.708 307 HA PRO 40 HA PRO 40 11.087 8.067 -4.000 308 HB2 PRO 40 1HB PRO 40 12.485 10.598 -4.787 309 HB3 PRO 40 2HB PRO 40 12.971 8.917 -5.049 310 HG2 PRO 40 1HG PRO 40 11.736 10.387 -6.959 311 HG3 PRO 40 2HG PRO 40 11.544 8.633 -6.818 312 HD2 PRO 40 1HD PRO 40 9.592 10.729 -6.364 313 HD3 PRO 40 2HD PRO 40 9.343 8.980 -6.448 314 H ILE 41 H ILE 41 11.014 7.843 -1.868 315 HA ILE 41 HA ILE 41 12.472 9.744 -0.229 316 HB ILE 41 HB ILE 41 9.571 9.057 0.282 317 HG12 ILE 41 1HG1 ILE 41 11.104 11.668 0.153 318 HG13 ILE 41 2HG1 ILE 41 9.968 11.069 -1.047 319 HG21 ILE 41 1HG2 ILE 41 9.811 10.086 2.495 320 HG22 ILE 41 2HG2 ILE 41 11.548 10.243 2.236 321 HG23 ILE 41 3HG2 ILE 41 10.815 8.645 2.348 322 HD11 ILE 41 3HD1 ILE 41 9.423 12.763 1.077 323 HD12 ILE 41 1HD1 ILE 41 8.752 11.207 1.566 324 HD13 ILE 41 2HD1 ILE 41 8.248 11.946 0.044 325 H LYS 42 H LYS 42 13.288 8.785 1.700 326 HA LYS 42 HA LYS 42 13.537 5.912 1.480 327 HB2 LYS 42 1HB LYS 42 14.938 8.049 3.021 328 HB3 LYS 42 2HB LYS 42 15.053 6.389 3.591 329 HG2 LYS 42 1HG LYS 42 15.677 5.937 1.065 330 HG3 LYS 42 2HG LYS 42 16.156 7.635 1.132 331 HD2 LYS 42 1HD LYS 42 17.066 5.995 3.398 332 HD3 LYS 42 2HD LYS 42 17.755 5.555 1.833 333 HE2 LYS 42 1HE LYS 42 17.673 8.436 2.533 334 HE3 LYS 42 2HE LYS 42 18.829 7.424 3.399 335 HZ1 LYS 42 3HZ LYS 42 18.787 8.214 0.599 336 HZ2 LYS 42 1HZ LYS 42 19.287 6.629 0.917 337 HZ3 LYS 42 2HZ LYS 42 20.101 7.931 1.624 338 H SER 43 H SER 43 12.671 4.405 2.772 339 HA SER 43 HA SER 43 11.460 5.149 5.312 340 HG SER 43 HG SER 43 8.980 3.295 2.709 341 HB2 SER 43 1HB SER 43 9.296 4.560 4.818 342 HB3 SER 43 2HB SER 43 9.784 5.203 3.254 343 H THR 44 H THR 44 11.185 3.388 6.750 344 HA THR 44 HA THR 44 12.781 1.026 5.989 345 HB THR 44 HB THR 44 11.978 1.255 8.805 346 HG1 THR 44 HG1 THR 44 12.220 3.425 8.542 347 HG21 THR 44 3HG2 THR 44 14.195 0.276 7.294 348 HG22 THR 44 1HG2 THR 44 13.795 0.016 8.994 349 HG23 THR 44 2HG2 THR 44 14.767 1.410 8.517 350 H ALA 45 H ALA 45 11.904 -0.956 5.877 351 HA ALA 45 HA ALA 45 9.018 -1.143 6.126 352 HB1 ALA 45 3HB ALA 45 10.998 -2.304 4.448 353 HB2 ALA 45 1HB ALA 45 9.243 -2.388 4.305 354 HB3 ALA 45 2HB ALA 45 10.111 -3.590 5.256 355 H ASN 46 H ASN 46 7.901 -2.355 7.498 356 HA ASN 46 HA ASN 46 9.388 -3.804 9.583 357 HB2 ASN 46 1HB ASN 46 6.765 -2.388 9.512 358 HB3 ASN 46 2HB ASN 46 6.903 -3.788 10.569 359 HD21 ASN 46 1HD2 ASN 46 6.756 -0.744 10.909 360 HD22 ASN 46 2HD2 ASN 46 8.003 -0.413 12.055 361 H ARG 47 H ARG 47 9.440 -6.014 9.372 362 HA ARG 47 HA ARG 47 7.672 -7.253 7.446 363 HE ARG 47 HE ARG 47 9.128 -5.340 6.166 364 HB2 ARG 47 1HB ARG 47 10.173 -8.002 8.860 365 HB3 ARG 47 2HB ARG 47 9.149 -9.306 8.276 366 HG2 ARG 47 1HG ARG 47 10.757 -8.869 6.590 367 HG3 ARG 47 2HG ARG 47 9.216 -8.232 6.016 368 HD2 ARG 47 1HD ARG 47 10.799 -6.271 7.505 369 HD3 ARG 47 2HD ARG 47 11.606 -6.870 6.061 370 HH11 ARG 47 1HH1 ARG 47 11.504 -7.035 4.244 371 HH12 ARG 47 2HH1 ARG 47 10.964 -6.347 2.751 372 HH21 ARG 47 1HH2 ARG 47 8.425 -4.438 4.198 373 HH22 ARG 47 2HH2 ARG 47 9.216 -4.884 2.723 374 H TRP 48 H TRP 48 6.010 -8.568 7.818 375 HA TRP 48 HA TRP 48 5.615 -9.906 10.341 376 HD1 TRP 48 HD1 TRP 48 1.840 -9.959 9.417 377 HE1 TRP 48 HE1 TRP 48 0.398 -10.778 11.387 378 HE3 TRP 48 HE3 TRP 48 4.486 -7.894 13.274 379 HZ2 TRP 48 HZ2 TRP 48 0.384 -10.573 14.202 380 HZ3 TRP 48 HZ3 TRP 48 3.691 -8.253 15.575 381 HH2 TRP 48 HH2 TRP 48 1.682 -9.564 16.028 382 HB2 TRP 48 1HB TRP 48 4.658 -7.713 10.863 383 HB3 TRP 48 2HB TRP 48 3.664 -7.780 9.413 384 H GLY 49 H GLY 49 4.065 -11.607 10.164 385 HA2 GLY 49 1HA GLY 49 3.948 -13.141 7.998 386 HA3 GLY 49 2HA GLY 49 2.574 -13.030 9.085 387 H ASP 50 H ASP 50 3.934 -11.995 6.049 388 HA ASP 50 HA ASP 50 2.950 -11.345 4.107 389 HB2 ASP 50 1HB ASP 50 1.140 -12.939 4.647 390 HB3 ASP 50 2HB ASP 50 0.318 -11.675 5.555 391 H GLU 51 H GLU 51 1.733 -9.838 7.058 392 HA GLU 51 HA GLU 51 0.937 -7.420 5.763 393 HB2 GLU 51 1HB GLU 51 0.444 -8.571 8.216 394 HB3 GLU 51 2HB GLU 51 1.520 -7.244 8.630 395 HG2 GLU 51 1HG GLU 51 -0.389 -6.226 6.819 396 HG3 GLU 51 2HG GLU 51 -1.259 -7.184 8.013 397 H ILE 52 H ILE 52 2.079 -5.637 5.360 398 HA ILE 52 HA ILE 52 4.681 -5.270 6.654 399 HB ILE 52 HB ILE 52 4.395 -6.114 3.960 400 HG12 ILE 52 1HG1 ILE 52 6.947 -5.683 4.009 401 HG13 ILE 52 2HG1 ILE 52 6.688 -5.187 5.677 402 HG21 ILE 52 1HG2 ILE 52 5.585 -4.336 2.741 403 HG22 ILE 52 2HG2 ILE 52 5.403 -3.281 4.141 404 HG23 ILE 52 3HG2 ILE 52 3.977 -3.844 3.268 405 HD11 ILE 52 3HD1 ILE 52 6.028 -7.895 4.529 406 HD12 ILE 52 1HD1 ILE 52 5.823 -7.396 6.210 407 HD13 ILE 52 2HD1 ILE 52 7.437 -7.498 5.508 408 H TYR 53 H TYR 53 4.751 -3.292 7.489 409 HA TYR 53 HA TYR 53 3.353 -1.116 6.091 410 HD1 TYR 53 HD1 TYR 53 2.590 -3.752 9.265 411 HD2 TYR 53 HD2 TYR 53 4.117 0.146 10.049 412 HE1 TYR 53 HE1 TYR 53 3.411 -4.517 11.450 413 HE2 TYR 53 HE2 TYR 53 4.940 -0.613 12.236 414 HH TYR 53 HH TYR 53 5.035 -3.929 13.118 415 HB2 TYR 53 1HB TYR 53 2.528 -0.232 8.238 416 HB3 TYR 53 2HB TYR 53 1.898 -1.845 7.914 417 H PHE 54 H PHE 54 4.469 0.710 5.890 418 HA PHE 54 HA PHE 54 6.742 1.199 7.674 419 HD1 PHE 54 HD1 PHE 54 6.825 3.662 4.628 420 HD2 PHE 54 HD2 PHE 54 6.770 -0.447 3.518 421 HE1 PHE 54 HE1 PHE 54 6.056 4.283 2.378 422 HE2 PHE 54 HE2 PHE 54 6.000 0.169 1.268 423 HZ PHE 54 HZ PHE 54 5.642 2.536 0.694 424 HB2 PHE 54 1HB PHE 54 8.201 1.765 5.834 425 HB3 PHE 54 2HB PHE 54 7.589 0.135 5.593 426 H THR 55 H THR 55 7.222 3.361 8.045 427 HA THR 55 HA THR 55 5.088 5.225 7.283 428 HB THR 55 HB THR 55 7.240 6.208 9.039 429 HG1 THR 55 HG1 THR 55 7.305 4.299 10.006 430 HG21 THR 55 3HG2 THR 55 4.294 5.993 9.575 431 HG22 THR 55 1HG2 THR 55 5.033 7.327 8.690 432 HG23 THR 55 2HG2 THR 55 5.471 7.037 10.373 433 H THR 56 H THR 56 5.474 7.167 6.177 434 HA THR 56 HA THR 56 8.149 7.386 4.962 435 HB THR 56 HB THR 56 6.276 8.689 3.296 436 HG1 THR 56 HG1 THR 56 4.594 7.515 4.067 437 HG21 THR 56 3HG2 THR 56 8.384 6.920 3.013 438 HG22 THR 56 1HG2 THR 56 7.419 7.637 1.721 439 HG23 THR 56 2HG2 THR 56 6.988 6.054 2.370 440 H GLN 57 H GLN 57 6.360 8.791 7.219 441 HA GLN 57 HA GLN 57 6.679 10.785 8.307 442 HB2 GLN 57 1HB GLN 57 8.027 11.991 5.896 443 HB3 GLN 57 2HB GLN 57 8.198 12.431 7.590 444 HG2 GLN 57 1HG GLN 57 8.987 9.703 7.219 445 HG3 GLN 57 2HG GLN 57 9.837 10.740 6.074 446 HE21 GLN 57 1HE2 GLN 57 9.433 9.844 9.372 447 HE22 GLN 57 2HE2 GLN 57 10.718 10.803 10.017 448 H VAL 58 H VAL 58 5.003 10.291 5.438 449 HA VAL 58 HA VAL 58 3.881 12.960 5.295 450 HB VAL 58 HB VAL 58 4.155 11.687 3.213 451 HG11 VAL 58 1HG1 VAL 58 2.023 9.834 4.264 452 HG12 VAL 58 2HG1 VAL 58 3.736 9.436 4.152 453 HG13 VAL 58 3HG1 VAL 58 2.808 9.760 2.685 454 HG21 VAL 58 3HG2 VAL 58 2.500 13.370 3.137 455 HG22 VAL 58 1HG2 VAL 58 1.344 12.376 4.023 456 HG23 VAL 58 2HG2 VAL 58 1.788 11.949 2.370 457 H ALA 59 H ALA 59 2.393 13.614 6.680 458 HA ALA 59 HA ALA 59 0.752 11.610 8.049 459 HB1 ALA 59 3HB ALA 59 0.887 14.536 8.741 460 HB2 ALA 59 1HB ALA 59 2.038 13.346 9.358 461 HB3 ALA 59 2HB ALA 59 0.324 13.198 9.740 462 H VAL 60 H VAL 60 -0.844 11.104 6.629 463 HA VAL 60 HA VAL 60 -2.756 13.271 6.039 464 HB VAL 60 HB VAL 60 -1.630 12.726 3.956 465 HG11 VAL 60 1HG1 VAL 60 -1.417 10.575 3.044 466 HG12 VAL 60 2HG1 VAL 60 -2.577 9.881 4.174 467 HG13 VAL 60 3HG1 VAL 60 -0.986 10.386 4.743 468 HG21 VAL 60 3HG2 VAL 60 -3.627 11.794 2.655 469 HG22 VAL 60 1HG2 VAL 60 -3.873 13.280 3.570 470 HG23 VAL 60 2HG2 VAL 60 -4.458 11.744 4.208 471 H GLU 61 H GLU 61 -4.418 12.854 7.402 472 HA GLU 61 HA GLU 61 -5.613 10.179 7.273 473 HB2 GLU 61 1HB GLU 61 -4.352 11.395 9.596 474 HB3 GLU 61 2HB GLU 61 -6.028 10.963 9.911 475 HG2 GLU 61 1HG GLU 61 -5.366 8.688 8.852 476 HG3 GLU 61 2HG GLU 61 -3.720 9.208 9.212 477 H LYS 62 H LYS 62 -7.768 10.187 7.098 478 HA LYS 62 HA LYS 62 -9.317 12.464 8.018 479 HB2 LYS 62 1HB LYS 62 -8.740 13.151 5.765 480 HB3 LYS 62 2HB LYS 62 -9.246 11.597 5.121 481 HG2 LYS 62 1HG LYS 62 -11.523 12.063 5.504 482 HG3 LYS 62 2HG LYS 62 -11.145 13.450 6.529 483 HD2 LYS 62 1HD LYS 62 -10.277 13.383 3.662 484 HD3 LYS 62 2HD LYS 62 -11.918 13.865 4.096 485 HE2 LYS 62 1HE LYS 62 -11.247 15.854 4.882 486 HE3 LYS 62 2HE LYS 62 -9.845 15.162 5.698 487 HZ1 LYS 62 3HZ LYS 62 -10.058 16.325 3.043 488 HZ2 LYS 62 1HZ LYS 62 -9.073 14.955 3.172 489 HZ3 LYS 62 2HZ LYS 62 -8.756 16.319 4.120 490 H GLU 63 H GLU 63 -11.713 12.017 7.798 491 HA GLU 63 HA GLU 63 -12.164 9.191 8.367 492 HB2 GLU 63 1HB GLU 63 -14.064 9.790 9.584 493 HB3 GLU 63 2HB GLU 63 -12.927 11.083 9.919 494 HG2 GLU 63 1HG GLU 63 -14.619 12.448 9.458 495 HG3 GLU 63 2HG GLU 63 -14.306 12.071 7.766 496 H GLU 64 H GLU 64 -12.145 8.323 6.302 497 HA GLU 64 HA GLU 64 -14.654 8.287 4.982 498 HB2 GLU 64 1HB GLU 64 -14.050 9.292 2.862 499 HB3 GLU 64 2HB GLU 64 -13.783 10.458 4.149 500 HG2 GLU 64 1HG GLU 64 -11.340 9.400 4.040 501 HG3 GLU 64 2HG GLU 64 -11.845 9.107 2.376 502 H ASN 65 H ASN 65 -14.787 6.580 3.412 503 HA ASN 65 HA ASN 65 -14.197 4.673 2.338 504 HB2 ASN 65 1HB ASN 65 -12.253 6.095 1.532 505 HB3 ASN 65 2HB ASN 65 -11.300 5.382 2.831 506 HD21 ASN 65 1HD2 ASN 65 -10.223 4.948 0.562 507 HD22 ASN 65 2HD2 ASN 65 -10.536 3.370 -0.071 508 H SER 66 H SER 66 -11.365 4.731 4.434 509 HA SER 66 HA SER 66 -10.565 2.954 5.723 510 HG SER 66 HG SER 66 -11.038 5.507 6.980 511 HB2 SER 66 1HB SER 66 -12.883 4.283 7.092 512 HB3 SER 66 2HB SER 66 -11.979 3.004 7.902 513 H LYS 67 H LYS 67 -11.054 1.088 4.328 514 HA LYS 67 HA LYS 67 -13.469 -0.386 5.153 515 HB2 LYS 67 1HB LYS 67 -12.962 -1.928 3.241 516 HB3 LYS 67 2HB LYS 67 -13.362 -0.291 2.762 517 HG2 LYS 67 1HG LYS 67 -11.600 -0.822 1.384 518 HG3 LYS 67 2HG LYS 67 -10.795 0.056 2.681 519 HD2 LYS 67 1HD LYS 67 -10.299 -2.158 3.748 520 HD3 LYS 67 2HD LYS 67 -10.951 -2.933 2.306 521 HE2 LYS 67 1HE LYS 67 -9.237 -2.052 0.946 522 HE3 LYS 67 2HE LYS 67 -8.720 -0.926 2.200 523 HZ1 LYS 67 3HZ LYS 67 -8.613 -3.641 3.086 524 HZ2 LYS 67 1HZ LYS 67 -7.405 -2.462 3.092 525 HZ3 LYS 67 2HZ LYS 67 -7.658 -3.399 1.712 526 H ASP 68 H ASP 68 -13.301 -2.677 5.678 527 HA ASP 68 HA ASP 68 -10.679 -3.301 6.893 528 HB2 ASP 68 1HB ASP 68 -12.051 -4.678 8.533 529 HB3 ASP 68 2HB ASP 68 -12.189 -2.929 8.669 530 H VAL 69 H VAL 69 -12.791 -4.309 4.476 531 HA VAL 69 HA VAL 69 -11.597 -7.003 4.565 532 HB VAL 69 HB VAL 69 -14.072 -6.958 5.137 533 HG11 VAL 69 1HG1 VAL 69 -15.595 -6.111 3.748 534 HG12 VAL 69 2HG1 VAL 69 -14.909 -6.957 2.363 535 HG13 VAL 69 3HG1 VAL 69 -14.257 -5.394 2.852 536 HG21 VAL 69 3HG2 VAL 69 -14.540 -8.876 3.477 537 HG22 VAL 69 1HG2 VAL 69 -13.204 -9.047 4.615 538 HG23 VAL 69 2HG2 VAL 69 -12.882 -8.605 2.938 539 H VAL 70 H VAL 70 -10.906 -7.884 2.646 540 HA VAL 70 HA VAL 70 -11.470 -6.610 0.118 541 HB VAL 70 HB VAL 70 -9.142 -6.091 -0.459 542 HG11 VAL 70 1HG1 VAL 70 -9.869 -4.596 2.037 543 HG12 VAL 70 2HG1 VAL 70 -10.750 -4.408 0.521 544 HG13 VAL 70 3HG1 VAL 70 -9.038 -3.997 0.601 545 HG21 VAL 70 3HG2 VAL 70 -7.364 -6.058 1.113 546 HG22 VAL 70 1HG2 VAL 70 -8.103 -7.656 1.239 547 HG23 VAL 70 2HG2 VAL 70 -8.444 -6.422 2.454 548 H GLU 71 H GLU 71 -10.554 -7.745 -1.720 549 HA GLU 71 HA GLU 71 -10.193 -10.582 -1.110 550 HB2 GLU 71 1HB GLU 71 -10.444 -9.516 -3.910 551 HB3 GLU 71 2HB GLU 71 -10.905 -11.086 -3.271 552 HG2 GLU 71 1HG GLU 71 -12.837 -10.276 -2.294 553 HG3 GLU 71 2HG GLU 71 -12.289 -8.604 -2.362 554 H LEU 72 H LEU 72 -8.575 -11.836 -1.993 555 HA LEU 72 HA LEU 72 -5.992 -11.002 -1.755 556 HG LEU 72 HG LEU 72 -4.442 -12.417 -3.644 557 HB2 LEU 72 1HB LEU 72 -6.636 -13.349 -1.894 558 HB3 LEU 72 2HB LEU 72 -7.071 -13.159 -3.579 559 HD11 LEU 72 1HD1 LEU 72 -3.132 -13.722 -2.236 560 HD12 LEU 72 2HD1 LEU 72 -4.472 -14.787 -1.813 561 HD13 LEU 72 3HD1 LEU 72 -4.411 -13.149 -1.164 562 HD21 LEU 72 3HD2 LEU 72 -5.803 -14.084 -5.021 563 HD22 LEU 72 1HD2 LEU 72 -5.288 -15.289 -3.839 564 HD23 LEU 72 2HD2 LEU 72 -4.086 -14.420 -4.794 565 H GLY 73 H GLY 73 -4.613 -9.744 -2.897 566 HA2 GLY 73 1HA GLY 73 -3.577 -9.325 -5.086 567 HA3 GLY 73 2HA GLY 73 -5.188 -9.356 -5.773 568 H ASP 74 H ASP 74 -6.308 -7.655 -3.603 569 HA ASP 74 HA ASP 74 -5.635 -5.149 -4.830 570 HB2 ASP 74 1HB ASP 74 -7.311 -4.252 -3.089 571 HB3 ASP 74 2HB ASP 74 -7.912 -5.320 -4.349 572 H VAL 75 H VAL 75 -5.028 -3.230 -3.716 573 HA VAL 75 HA VAL 75 -3.200 -3.764 -1.444 574 HB VAL 75 HB VAL 75 -3.041 -1.418 -3.373 575 HG11 VAL 75 1HG1 VAL 75 -1.964 -1.238 -1.084 576 HG12 VAL 75 2HG1 VAL 75 -0.918 -0.971 -2.477 577 HG13 VAL 75 3HG1 VAL 75 -0.856 -2.507 -1.615 578 HG21 VAL 75 3HG2 VAL 75 -0.923 -3.334 -3.689 579 HG22 VAL 75 1HG2 VAL 75 -2.040 -2.687 -4.892 580 HG23 VAL 75 2HG2 VAL 75 -2.488 -4.106 -3.944 581 H ALA 76 H ALA 76 -3.126 -2.131 0.317 582 HA ALA 76 HA ALA 76 -5.168 -0.069 0.279 583 HB1 ALA 76 3HB ALA 76 -5.221 -2.146 2.453 584 HB2 ALA 76 1HB ALA 76 -6.310 -2.142 1.067 585 HB3 ALA 76 2HB ALA 76 -6.346 -0.811 2.224 586 H TYR 77 H TYR 77 -4.909 1.537 1.868 587 HA TYR 77 HA TYR 77 -2.268 1.510 3.153 588 HD1 TYR 77 HD2 TYR 77 -1.359 4.088 4.470 589 HD2 TYR 77 HD1 TYR 77 -5.087 5.189 2.750 590 HE1 TYR 77 HE2 TYR 77 -1.565 5.903 6.097 591 HE2 TYR 77 HE1 TYR 77 -5.307 7.012 4.388 592 HH TYR 77 HH TYR 77 -4.479 7.662 6.543 593 HB2 TYR 77 1HB TYR 77 -2.084 3.468 2.053 594 HB3 TYR 77 2HB TYR 77 -3.809 3.539 1.719 595 H TRP 78 H TRP 78 -2.065 1.813 5.320 596 HA TRP 78 HA TRP 78 -4.416 1.424 6.938 597 HD1 TRP 78 HD1 TRP 78 -5.083 1.541 8.985 598 HE1 TRP 78 HE1 TRP 78 -5.306 0.460 11.309 599 HE3 TRP 78 HE3 TRP 78 -0.308 -0.189 9.526 600 HZ2 TRP 78 HZ2 TRP 78 -3.668 -0.946 13.130 601 HZ3 TRP 78 HZ3 TRP 78 0.284 -1.393 11.588 602 HH2 TRP 78 HH2 TRP 78 -1.362 -1.763 13.353 603 HB2 TRP 78 1HB TRP 78 -2.027 0.471 7.308 604 HB3 TRP 78 2HB TRP 78 -1.682 2.038 8.028 605 H ILE 79 H ILE 79 -5.733 3.138 7.310 606 HA ILE 79 HA ILE 79 -4.870 5.818 7.216 607 HB ILE 79 HB ILE 79 -7.404 4.468 7.971 608 HG12 ILE 79 1HG1 ILE 79 -6.365 6.367 5.951 609 HG13 ILE 79 2HG1 ILE 79 -7.476 5.017 5.767 610 HG21 ILE 79 1HG2 ILE 79 -6.835 7.339 8.701 611 HG22 ILE 79 2HG2 ILE 79 -7.188 6.026 9.822 612 HG23 ILE 79 3HG2 ILE 79 -8.428 6.585 8.702 613 HD11 ILE 79 3HD1 ILE 79 -8.141 7.752 6.827 614 HD12 ILE 79 1HD1 ILE 79 -9.269 6.400 6.734 615 HD13 ILE 79 2HD1 ILE 79 -8.592 7.087 5.257 616 HA PRO 80 HA PRO 80 -5.120 5.938 12.075 617 HB2 PRO 80 1HB PRO 80 -5.060 3.043 12.721 618 HB3 PRO 80 2HB PRO 80 -5.979 4.345 13.481 619 HG2 PRO 80 1HG PRO 80 -7.168 2.551 11.897 620 HG3 PRO 80 2HG PRO 80 -7.668 4.252 11.908 621 HD2 PRO 80 1HD PRO 80 -6.020 2.774 9.907 622 HD3 PRO 80 2HD PRO 80 -7.233 4.039 9.660 623 H GLY 81 H GLY 81 -2.989 6.518 11.160 624 HA2 GLY 81 1HA GLY 81 -0.797 6.086 12.432 625 HA3 GLY 81 2HA GLY 81 -0.897 4.503 11.676 626 H LYS 82 H LYS 82 -2.198 6.404 9.394 627 HA LYS 82 HA LYS 82 -1.437 7.142 7.349 628 HB2 LYS 82 1HB LYS 82 1.015 8.299 8.569 629 HB3 LYS 82 2HB LYS 82 -0.110 9.005 7.423 630 HG2 LYS 82 1HG LYS 82 -0.859 10.228 9.122 631 HG3 LYS 82 2HG LYS 82 -1.622 8.754 9.725 632 HD2 LYS 82 1HD LYS 82 0.541 8.252 10.911 633 HD3 LYS 82 2HD LYS 82 1.066 9.880 10.480 634 HE2 LYS 82 1HE LYS 82 -1.590 9.756 11.711 635 HE3 LYS 82 2HE LYS 82 -0.283 9.207 12.760 636 HZ1 LYS 82 3HZ LYS 82 -0.672 11.863 11.534 637 HZ2 LYS 82 1HZ LYS 82 0.866 11.361 12.030 638 HZ3 LYS 82 2HZ LYS 82 -0.391 11.472 13.156 639 H ALA 83 H ALA 83 -0.638 4.515 8.075 640 HA ALA 83 HA ALA 83 2.001 4.320 6.770 641 HB1 ALA 83 3HB ALA 83 1.437 1.881 8.046 642 HB2 ALA 83 1HB ALA 83 0.981 3.153 9.181 643 HB3 ALA 83 2HB ALA 83 2.615 3.104 8.523 644 H ILE 84 H ILE 84 2.215 3.128 4.943 645 HA ILE 84 HA ILE 84 -0.199 2.032 3.727 646 HB ILE 84 HB ILE 84 2.537 1.993 2.478 647 HG12 ILE 84 1HG1 ILE 84 0.572 4.295 2.428 648 HG13 ILE 84 2HG1 ILE 84 2.134 4.298 3.240 649 HG21 ILE 84 1HG2 ILE 84 -0.217 1.511 1.615 650 HG22 ILE 84 2HG2 ILE 84 1.306 0.918 0.951 651 HG23 ILE 84 3HG2 ILE 84 0.724 2.525 0.520 652 HD11 ILE 84 3HD1 ILE 84 3.103 5.001 1.382 653 HD12 ILE 84 1HD1 ILE 84 1.531 5.021 0.582 654 HD13 ILE 84 2HD1 ILE 84 2.533 3.571 0.521 655 H CYS 85 H CYS 85 -0.340 -0.157 2.935 656 HA CYS 85 HA CYS 85 1.717 -1.993 3.880 657 HG CYS 85 HG CYS 85 -1.009 -4.465 5.377 658 HB2 CYS 85 1HB CYS 85 0.269 -1.987 5.758 659 HB3 CYS 85 2HB CYS 85 -1.167 -2.082 4.745 660 H LEU 86 H LEU 86 1.597 -4.130 3.045 661 HA LEU 86 HA LEU 86 0.253 -4.286 0.410 662 HG LEU 86 HG LEU 86 1.687 -4.246 -1.233 663 HB2 LEU 86 1HB LEU 86 2.955 -4.684 1.140 664 HB3 LEU 86 2HB LEU 86 2.318 -6.287 0.804 665 HD11 LEU 86 1HD1 LEU 86 3.790 -3.896 -2.067 666 HD12 LEU 86 2HD1 LEU 86 4.451 -5.351 -1.316 667 HD13 LEU 86 3HD1 LEU 86 4.143 -3.912 -0.339 668 HD21 LEU 86 3HD2 LEU 86 1.072 -6.545 -1.575 669 HD22 LEU 86 1HD2 LEU 86 2.725 -7.081 -1.258 670 HD23 LEU 86 2HD2 LEU 86 2.365 -6.132 -2.703 671 H PHE 87 H PHE 87 -0.468 -6.462 -0.267 672 HA PHE 87 HA PHE 87 -0.990 -8.286 1.968 673 HD1 PHE 87 HD2 PHE 87 -2.654 -7.348 3.675 674 HD2 PHE 87 HD1 PHE 87 -3.718 -5.331 0.088 675 HE1 PHE 87 HE2 PHE 87 -3.235 -5.345 4.982 676 HE2 PHE 87 HE1 PHE 87 -4.297 -3.336 1.382 677 HZ PHE 87 HZ PHE 87 -4.060 -3.330 3.833 678 HB2 PHE 87 1HB PHE 87 -3.132 -7.531 -0.015 679 HB3 PHE 87 2HB PHE 87 -3.305 -8.530 1.426 680 H PHE 88 H PHE 88 -0.807 -10.366 1.509 681 HA PHE 88 HA PHE 88 -1.247 -11.527 -1.032 682 HD1 PHE 88 HD1 PHE 88 0.464 -13.087 -2.956 683 HD2 PHE 88 HD2 PHE 88 1.133 -8.948 -2.217 684 HE1 PHE 88 HE1 PHE 88 0.331 -12.636 -5.371 685 HE2 PHE 88 HE2 PHE 88 1.001 -8.492 -4.630 686 HZ PHE 88 HZ PHE 88 0.599 -10.337 -6.211 687 HB2 PHE 88 1HB PHE 88 1.433 -10.513 -0.487 688 HB3 PHE 88 2HB PHE 88 1.437 -12.243 -0.813 689 H GLY 89 H GLY 89 -2.031 -11.915 1.670 690 HA2 GLY 89 1HA GLY 89 -2.198 -14.581 1.989 691 HA3 GLY 89 2HA GLY 89 -0.618 -14.232 2.680 692 H LYS 90 H LYS 90 -1.351 -14.932 4.730 693 HA LYS 90 HA LYS 90 -3.595 -14.094 6.096 694 HB2 LYS 90 1HB LYS 90 -2.562 -14.830 8.086 695 HB3 LYS 90 2HB LYS 90 -1.943 -15.865 6.817 696 HG2 LYS 90 1HG LYS 90 0.036 -15.427 7.761 697 HG3 LYS 90 2HG LYS 90 -0.062 -13.909 6.866 698 HD2 LYS 90 1HD LYS 90 -0.064 -12.777 8.783 699 HD3 LYS 90 2HD LYS 90 -1.511 -13.635 9.305 700 HE2 LYS 90 1HE LYS 90 -0.056 -15.492 10.081 701 HE3 LYS 90 2HE LYS 90 1.347 -14.498 9.691 702 HZ1 LYS 90 3HZ LYS 90 0.214 -12.790 11.225 703 HZ2 LYS 90 1HZ LYS 90 1.025 -14.099 11.928 704 HZ3 LYS 90 2HZ LYS 90 -0.661 -14.113 11.813 705 H THR 91 H THR 91 -3.003 -12.943 8.409 706 HA THR 91 HA THR 91 -1.531 -10.509 8.196 707 HB THR 91 HB THR 91 -4.198 -9.623 8.774 708 HG1 THR 91 HG1 THR 91 -5.261 -10.140 6.930 709 HG21 THR 91 3HG2 THR 91 -3.625 -8.538 6.354 710 HG22 THR 91 1HG2 THR 91 -2.016 -8.909 6.968 711 HG23 THR 91 2HG2 THR 91 -3.101 -7.884 7.903 712 HA PRO 92 HA PRO 92 -1.706 -10.234 12.637 713 HB2 PRO 92 1HB PRO 92 -4.116 -8.451 12.595 714 HB3 PRO 92 2HB PRO 92 -2.638 -8.317 13.556 715 HG2 PRO 92 1HG PRO 92 -2.963 -6.793 11.413 716 HG3 PRO 92 2HG PRO 92 -1.385 -7.527 11.758 717 HD2 PRO 92 1HD PRO 92 -3.415 -8.268 9.713 718 HD3 PRO 92 2HD PRO 92 -1.646 -8.381 9.636 719 H ILE 93 H ILE 93 -4.742 -10.823 10.982 720 HA ILE 93 HA ILE 93 -5.388 -12.845 12.994 721 HB ILE 93 HB ILE 93 -7.488 -10.936 11.976 722 HG12 ILE 93 1HG1 ILE 93 -7.330 -10.419 14.633 723 HG13 ILE 93 2HG1 ILE 93 -5.639 -10.752 14.279 724 HG21 ILE 93 1HG2 ILE 93 -7.572 -12.928 14.238 725 HG22 ILE 93 2HG2 ILE 93 -8.224 -13.210 12.623 726 HG23 ILE 93 3HG2 ILE 93 -8.908 -11.942 13.641 727 HD11 ILE 93 3HD1 ILE 93 -7.385 -8.553 13.286 728 HD12 ILE 93 1HD1 ILE 93 -6.003 -9.079 12.324 729 HD13 ILE 93 2HD1 ILE 93 -5.759 -8.483 13.966 730 H SER 94 H SER 94 -4.478 -14.049 11.036 731 HA SER 94 HA SER 94 -5.864 -14.231 8.599 732 HG SER 94 HG SER 94 -3.083 -14.633 9.915 733 HB2 SER 94 1HB SER 94 -4.804 -16.800 9.278 734 HB3 SER 94 2HB SER 94 -4.170 -15.606 8.148 735 H ASP 95 H ASP 95 -5.818 -16.872 10.975 736 HA ASP 95 HA ASP 95 -7.389 -18.351 11.665 737 HB2 ASP 95 1HB ASP 95 -8.421 -16.438 12.723 738 HB3 ASP 95 2HB ASP 95 -9.201 -15.971 11.216 739 H ASP 96 H ASP 96 -9.879 -16.903 9.681 740 HA ASP 96 HA ASP 96 -9.614 -19.149 7.792 741 HB2 ASP 96 1HB ASP 96 -11.637 -18.937 9.556 742 HB3 ASP 96 2HB ASP 96 -12.303 -17.981 8.236 743 H LYS 97 H LYS 97 -9.485 -15.849 8.120 744 HA LYS 97 HA LYS 97 -9.789 -15.479 5.247 745 HB2 LYS 97 1HB LYS 97 -11.342 -13.989 7.353 746 HB3 LYS 97 2HB LYS 97 -11.026 -13.277 5.778 747 HG2 LYS 97 1HG LYS 97 -12.245 -15.991 5.934 748 HG3 LYS 97 2HG LYS 97 -13.243 -14.564 6.226 749 HD2 LYS 97 1HD LYS 97 -13.515 -14.598 3.990 750 HD3 LYS 97 2HD LYS 97 -11.932 -13.819 3.975 751 HE2 LYS 97 1HE LYS 97 -11.483 -15.519 2.538 752 HE3 LYS 97 2HE LYS 97 -11.129 -16.355 4.049 753 HZ1 LYS 97 3HZ LYS 97 -12.504 -17.782 2.815 754 HZ2 LYS 97 1HZ LYS 97 -13.581 -16.544 2.400 755 HZ3 LYS 97 2HZ LYS 97 -13.513 -17.111 3.992 756 H ILE 98 H ILE 98 -9.392 -12.781 5.074 757 HA ILE 98 HA ILE 98 -6.797 -12.424 6.428 758 HB ILE 98 HB ILE 98 -7.654 -11.486 3.687 759 HG12 ILE 98 1HG1 ILE 98 -5.408 -13.340 4.514 760 HG13 ILE 98 2HG1 ILE 98 -6.978 -13.877 3.910 761 HG21 ILE 98 1HG2 ILE 98 -4.959 -11.046 4.949 762 HG22 ILE 98 2HG2 ILE 98 -6.238 -9.833 4.973 763 HG23 ILE 98 3HG2 ILE 98 -5.574 -10.384 3.436 764 HD11 ILE 98 3HD1 ILE 98 -6.003 -11.998 2.058 765 HD12 ILE 98 1HD1 ILE 98 -6.184 -13.743 1.853 766 HD13 ILE 98 2HD1 ILE 98 -4.663 -13.081 2.452 767 H ARG 99 H ARG 99 -7.187 -11.081 8.082 768 HA ARG 99 HA ARG 99 -8.845 -8.701 7.586 769 HE ARG 99 HE ARG 99 -10.336 -7.570 10.592 770 HB2 ARG 99 1HB ARG 99 -8.047 -10.164 10.092 771 HB3 ARG 99 2HB ARG 99 -8.620 -8.504 10.163 772 HG2 ARG 99 1HG ARG 99 -10.622 -9.441 8.774 773 HG3 ARG 99 2HG ARG 99 -10.095 -10.988 9.439 774 HD2 ARG 99 1HD ARG 99 -11.792 -10.033 10.866 775 HD3 ARG 99 2HD ARG 99 -10.242 -10.027 11.707 776 HH11 ARG 99 1HH1 ARG 99 -12.575 -9.365 12.576 777 HH12 ARG 99 2HH1 ARG 99 -13.254 -7.952 13.311 778 HH21 ARG 99 1HH2 ARG 99 -11.225 -5.708 11.559 779 HH22 ARG 99 2HH2 ARG 99 -12.487 -5.875 12.734 780 HA PRO 100 HA PRO 100 -4.687 -6.858 7.354 781 HB2 PRO 100 1HB PRO 100 -5.465 -4.610 6.056 782 HB3 PRO 100 2HB PRO 100 -5.222 -6.154 5.231 783 HG2 PRO 100 1HG PRO 100 -7.776 -4.915 6.192 784 HG3 PRO 100 2HG PRO 100 -7.424 -5.680 4.629 785 HD2 PRO 100 1HD PRO 100 -8.718 -6.982 6.604 786 HD3 PRO 100 2HD PRO 100 -7.611 -7.815 5.493 787 H ALA 101 H ALA 101 -7.690 -5.378 8.471 788 HA ALA 101 HA ALA 101 -6.620 -4.438 10.890 789 HB1 ALA 101 3HB ALA 101 -5.643 -2.495 10.448 790 HB2 ALA 101 1HB ALA 101 -7.074 -1.920 9.593 791 HB3 ALA 101 2HB ALA 101 -5.833 -2.822 8.725 792 H SER 102 H SER 102 -8.130 -2.076 11.235 793 HA SER 102 HA SER 102 -10.852 -3.161 10.979 794 HG SER 102 HG SER 102 -9.245 -2.049 14.349 795 HB2 SER 102 1HB SER 102 -10.604 -1.022 12.924 796 HB3 SER 102 2HB SER 102 -11.197 -2.669 13.138 797 H ALA 103 H ALA 103 -8.846 -0.725 9.788 798 HA ALA 103 HA ALA 103 -11.031 0.533 8.443 799 HB1 ALA 103 3HB ALA 103 -11.358 1.658 10.524 800 HB2 ALA 103 1HB ALA 103 -10.654 2.806 9.384 801 HB3 ALA 103 2HB ALA 103 -9.646 2.068 10.630 802 H VAL 104 H VAL 104 -9.404 -0.378 6.847 803 HA VAL 104 HA VAL 104 -7.380 1.695 6.283 804 HB VAL 104 HB VAL 104 -5.938 0.070 5.215 805 HG11 VAL 104 1HG1 VAL 104 -5.947 0.443 7.734 806 HG12 VAL 104 2HG1 VAL 104 -5.121 -0.994 7.134 807 HG13 VAL 104 3HG1 VAL 104 -6.729 -1.131 7.845 808 HG21 VAL 104 3HG2 VAL 104 -6.423 -2.137 4.835 809 HG22 VAL 104 1HG2 VAL 104 -8.019 -1.425 4.621 810 HG23 VAL 104 2HG2 VAL 104 -7.604 -2.220 6.140 811 H ASN 105 H ASN 105 -7.166 2.514 4.280 812 HA ASN 105 HA ASN 105 -9.464 2.268 2.558 813 HB2 ASN 105 1HB ASN 105 -7.014 3.918 1.975 814 HB3 ASN 105 2HB ASN 105 -8.676 4.211 1.476 815 HD21 ASN 105 1HD2 ASN 105 -9.739 3.596 4.127 816 HD22 ASN 105 2HD2 ASN 105 -9.366 4.959 5.116 817 H VAL 106 H VAL 106 -9.451 1.776 0.348 818 HA VAL 106 HA VAL 106 -7.451 -0.186 -0.441 819 HB VAL 106 HB VAL 106 -9.171 0.283 -2.624 820 HG11 VAL 106 1HG1 VAL 106 -9.337 -1.941 -2.566 821 HG12 VAL 106 2HG1 VAL 106 -9.901 -1.953 -0.896 822 HG13 VAL 106 3HG1 VAL 106 -8.174 -1.842 -1.242 823 HG21 VAL 106 3HG2 VAL 106 -10.766 1.469 -1.327 824 HG22 VAL 106 1HG2 VAL 106 -10.680 0.282 -0.022 825 HG23 VAL 106 2HG2 VAL 106 -11.402 -0.158 -1.570 826 H ILE 107 H ILE 107 -5.613 0.982 -0.845 827 HA ILE 107 HA ILE 107 -5.621 3.377 -2.415 828 HB ILE 107 HB ILE 107 -4.040 2.846 -0.520 829 HG12 ILE 107 1HG1 ILE 107 -3.369 3.992 -3.169 830 HG13 ILE 107 2HG1 ILE 107 -3.372 4.755 -1.585 831 HG21 ILE 107 1HG2 ILE 107 -3.461 0.571 -1.184 832 HG22 ILE 107 2HG2 ILE 107 -2.017 1.574 -1.071 833 HG23 ILE 107 3HG2 ILE 107 -2.693 1.183 -2.650 834 HD11 ILE 107 3HD1 ILE 107 -1.258 2.911 -2.661 835 HD12 ILE 107 1HD1 ILE 107 -1.250 3.674 -1.070 836 HD13 ILE 107 2HD1 ILE 107 -1.142 4.666 -2.524 837 H GLY 108 H GLY 108 -6.504 0.790 -3.700 838 HA2 GLY 108 1HA GLY 108 -6.398 0.589 -6.114 839 HA3 GLY 108 2HA GLY 108 -4.689 0.970 -6.009 840 H ARG 109 H ARG 109 -4.076 -0.897 -7.138 841 HA ARG 109 HA ARG 109 -3.860 -3.245 -5.475 842 HE ARG 109 HE ARG 109 -6.952 -5.911 -6.091 843 HB2 ARG 109 1HB ARG 109 -5.165 -3.585 -8.171 844 HB3 ARG 109 2HB ARG 109 -4.960 -4.792 -6.910 845 HG2 ARG 109 1HG ARG 109 -6.556 -3.597 -5.498 846 HG3 ARG 109 2HG ARG 109 -6.753 -2.376 -6.756 847 HD2 ARG 109 1HD ARG 109 -8.559 -3.765 -7.132 848 HD3 ARG 109 2HD ARG 109 -7.361 -4.377 -8.268 849 HH11 ARG 109 1HH1 ARG 109 -9.820 -5.095 -7.905 850 HH12 ARG 109 2HH1 ARG 109 -10.620 -6.589 -7.551 851 HH21 ARG 109 1HH2 ARG 109 -8.005 -7.878 -5.625 852 HH22 ARG 109 2HH2 ARG 109 -9.591 -8.168 -6.257 853 H ILE 110 H ILE 110 -2.608 -4.998 -6.623 854 HA ILE 110 HA ILE 110 -0.420 -3.748 -8.113 855 HB ILE 110 HB ILE 110 -0.567 -6.528 -6.932 856 HG12 ILE 110 1HG1 ILE 110 1.278 -4.968 -5.498 857 HG13 ILE 110 2HG1 ILE 110 -0.138 -3.941 -5.686 858 HG21 ILE 110 1HG2 ILE 110 1.820 -6.605 -7.243 859 HG22 ILE 110 2HG2 ILE 110 1.831 -4.951 -7.856 860 HG23 ILE 110 3HG2 ILE 110 1.045 -6.230 -8.783 861 HD11 ILE 110 3HD1 ILE 110 -1.528 -5.690 -4.685 862 HD12 ILE 110 1HD1 ILE 110 -0.225 -5.185 -3.610 863 HD13 ILE 110 2HD1 ILE 110 -0.099 -6.706 -4.489 864 H VAL 111 H VAL 111 -0.559 -3.830 -10.282 865 HA VAL 111 HA VAL 111 -1.997 -6.071 -11.510 866 HB VAL 111 HB VAL 111 -1.527 -4.497 -13.634 867 HG11 VAL 111 1HG1 VAL 111 -3.805 -3.347 -12.753 868 HG12 VAL 111 2HG1 VAL 111 -3.722 -4.755 -11.692 869 HG13 VAL 111 3HG1 VAL 111 -3.718 -4.970 -13.442 870 HG21 VAL 111 3HG2 VAL 111 -2.048 -2.421 -11.547 871 HG22 VAL 111 1HG2 VAL 111 -1.463 -2.229 -13.199 872 HG23 VAL 111 2HG2 VAL 111 -0.390 -2.865 -11.952 873 H ASN 112 H ASN 112 0.551 -4.150 -13.045 874 HA ASN 112 HA ASN 112 1.770 -6.547 -14.060 875 HB2 ASN 112 1HB ASN 112 3.401 -4.933 -15.093 876 HB3 ASN 112 2HB ASN 112 1.716 -4.644 -15.514 877 HD21 ASN 112 1HD2 ASN 112 4.474 -3.145 -14.747 878 HD22 ASN 112 2HD2 ASN 112 3.855 -1.700 -14.028 879 H SER 113 H SER 113 2.026 -7.103 -11.578 880 HA SER 113 HA SER 113 4.686 -7.476 -11.041 881 HG SER 113 HG SER 113 6.143 -4.619 -10.023 882 HB2 SER 113 1HB SER 113 3.910 -4.775 -10.439 883 HB3 SER 113 2HB SER 113 4.343 -5.602 -8.944 884 H MET 114 H MET 114 2.258 -8.857 -10.774 885 HA MET 114 HA MET 114 1.442 -8.980 -8.041 886 HB2 MET 114 1HB MET 114 0.320 -11.124 -8.792 887 HB3 MET 114 2HB MET 114 -0.158 -9.667 -9.654 888 HG2 MET 114 1HG MET 114 1.046 -10.265 -11.568 889 HG3 MET 114 2HG MET 114 1.980 -11.483 -10.703 890 HE1 MET 114 3HE MET 114 -0.204 -14.395 -10.187 891 HE2 MET 114 1HE MET 114 -0.955 -13.139 -9.202 892 HE3 MET 114 2HE MET 114 0.802 -13.223 -9.333 893 H GLU 115 H GLU 115 3.848 -9.082 -7.419 894 HA GLU 115 HA GLU 115 4.969 -11.762 -7.559 895 HB2 GLU 115 1HB GLU 115 6.086 -9.226 -7.510 896 HB3 GLU 115 2HB GLU 115 6.410 -9.848 -5.899 897 HG2 GLU 115 1HG GLU 115 8.258 -10.602 -6.972 898 HG3 GLU 115 2HG GLU 115 7.185 -11.972 -7.253 899 H GLY 116 H GLY 116 6.326 -11.983 -5.210 900 HA2 GLY 116 1HA GLY 116 4.151 -12.160 -3.216 901 HA3 GLY 116 2HA GLY 116 5.396 -13.386 -3.402 902 H LEU 117 H LEU 117 5.643 -9.842 -3.297 903 HA LEU 117 HA LEU 117 7.976 -9.587 -1.957 904 HG LEU 117 HG LEU 117 8.044 -7.602 -0.299 905 HB2 LEU 117 1HB LEU 117 6.842 -7.650 -2.786 906 HB3 LEU 117 2HB LEU 117 5.497 -7.895 -1.687 907 HD11 LEU 117 1HD1 LEU 117 8.249 -5.188 -0.657 908 HD12 LEU 117 2HD1 LEU 117 7.033 -5.281 -1.927 909 HD13 LEU 117 3HD1 LEU 117 8.580 -6.106 -2.125 910 HD21 LEU 117 3HD2 LEU 117 6.768 -6.598 1.274 911 HD22 LEU 117 1HD2 LEU 117 5.477 -7.430 0.411 912 HD23 LEU 117 2HD2 LEU 117 5.795 -5.727 0.089 913 H LYS 118 H LYS 118 4.846 -10.299 -0.508 914 HA LYS 118 HA LYS 118 5.228 -9.879 2.143 915 HB2 LYS 118 1HB LYS 118 3.891 -12.008 2.545 916 HB3 LYS 118 2HB LYS 118 3.152 -10.791 1.516 917 HG2 LYS 118 1HG LYS 118 2.711 -12.729 0.372 918 HG3 LYS 118 2HG LYS 118 4.183 -12.180 -0.424 919 HD2 LYS 118 1HD LYS 118 4.875 -14.292 -0.040 920 HD3 LYS 118 2HD LYS 118 5.223 -13.680 1.576 921 HE2 LYS 118 1HE LYS 118 2.849 -14.363 2.181 922 HE3 LYS 118 2HE LYS 118 2.825 -15.241 0.651 923 HZ1 LYS 118 3HZ LYS 118 3.460 -16.749 2.348 924 HZ2 LYS 118 1HZ LYS 118 4.638 -15.697 2.953 925 HZ3 LYS 118 2HZ LYS 118 4.849 -16.423 1.441 926 H GLY 119 H GLY 119 6.921 -12.257 0.227 927 HA2 GLY 119 1HA GLY 119 7.940 -13.650 2.565 928 HA3 GLY 119 2HA GLY 119 8.314 -14.014 0.888 929 H VAL 120 H VAL 120 8.606 -10.834 2.350 930 HA VAL 120 HA VAL 120 11.359 -10.660 1.531 931 HB VAL 120 HB VAL 120 11.215 -8.392 2.728 932 HG11 VAL 120 1HG1 VAL 120 9.600 -7.572 0.816 933 HG12 VAL 120 2HG1 VAL 120 9.812 -9.229 0.249 934 HG13 VAL 120 3HG1 VAL 120 11.215 -8.183 0.461 935 HG21 VAL 120 3HG2 VAL 120 8.284 -9.117 2.705 936 HG22 VAL 120 1HG2 VAL 120 8.937 -7.515 3.033 937 HG23 VAL 120 2HG2 VAL 120 9.284 -8.850 4.129 938 H ALA 121 H ALA 121 13.149 -10.151 2.945 939 HA ALA 121 HA ALA 121 13.145 -11.700 5.354 940 HB1 ALA 121 3HB ALA 121 15.122 -11.461 3.839 941 HB2 ALA 121 1HB ALA 121 15.470 -11.126 5.535 942 HB3 ALA 121 2HB ALA 121 15.282 -9.794 4.396 943 H ASP 122 H ASP 122 13.345 -10.954 7.499 944 HA ASP 122 HA ASP 122 11.803 -8.793 8.226 945 HB2 ASP 122 1HB ASP 122 12.592 -9.094 10.466 946 HB3 ASP 122 2HB ASP 122 12.450 -10.678 9.712 947 H GLY 123 H GLY 123 12.057 -6.700 8.588 948 HA2 GLY 123 1HA GLY 123 12.981 -4.603 8.540 949 HA3 GLY 123 2HA GLY 123 14.388 -5.348 9.273 950 H GLU 124 H GLU 124 13.031 -3.988 6.425 951 HA GLU 124 HA GLU 124 15.669 -4.023 5.172 952 HB2 GLU 124 1HB GLU 124 13.325 -4.627 3.407 953 HB3 GLU 124 2HB GLU 124 15.030 -4.974 3.152 954 HG2 GLU 124 1HG GLU 124 13.354 -6.368 5.221 955 HG3 GLU 124 2HG GLU 124 13.562 -6.958 3.571 956 H SER 125 H SER 125 15.976 -2.385 3.588 957 HA SER 125 HA SER 125 14.715 0.058 4.213 958 HG SER 125 HG SER 125 16.872 1.649 1.924 959 HB2 SER 125 1HB SER 125 17.052 -0.204 3.328 960 HB3 SER 125 2HB SER 125 16.355 -0.545 1.745 961 H VAL 126 H VAL 126 13.565 1.476 2.761 962 HA VAL 126 HA VAL 126 12.124 0.247 0.542 963 HB VAL 126 HB VAL 126 10.627 1.551 2.820 964 HG11 VAL 126 1HG1 VAL 126 8.630 0.690 1.633 965 HG12 VAL 126 2HG1 VAL 126 9.674 0.209 0.298 966 HG13 VAL 126 3HG1 VAL 126 9.515 1.914 0.726 967 HG21 VAL 126 3HG2 VAL 126 9.661 -0.962 2.734 968 HG22 VAL 126 1HG2 VAL 126 10.925 -0.423 3.837 969 HG23 VAL 126 2HG2 VAL 126 11.353 -1.251 2.339 970 H VAL 127 H VAL 127 11.891 1.679 -1.100 971 HA VAL 127 HA VAL 127 12.009 4.548 -0.431 972 HB VAL 127 HB VAL 127 13.177 4.960 -2.568 973 HG11 VAL 127 1HG1 VAL 127 14.256 4.137 -0.190 974 HG12 VAL 127 2HG1 VAL 127 15.158 4.826 -1.539 975 HG13 VAL 127 3HG1 VAL 127 15.052 3.077 -1.355 976 HG21 VAL 127 3HG2 VAL 127 14.290 2.424 -3.100 977 HG22 VAL 127 1HG2 VAL 127 13.244 3.396 -4.134 978 HG23 VAL 127 2HG2 VAL 127 12.541 2.217 -3.026 979 H VAL 128 H VAL 128 10.000 5.243 -0.713 980 HA VAL 128 HA VAL 128 8.252 4.139 -2.728 981 HB VAL 128 HB VAL 128 7.406 6.633 -1.401 982 HG11 VAL 128 1HG1 VAL 128 5.638 5.586 -2.415 983 HG12 VAL 128 2HG1 VAL 128 5.497 4.928 -0.787 984 HG13 VAL 128 3HG1 VAL 128 6.248 3.968 -2.059 985 HG21 VAL 128 3HG2 VAL 128 8.390 6.035 0.568 986 HG22 VAL 128 1HG2 VAL 128 8.392 4.316 0.176 987 HG23 VAL 128 2HG2 VAL 128 6.902 5.099 0.703 988 H GLU 129 H GLU 129 7.914 4.975 -4.759 989 HA GLU 129 HA GLU 129 8.386 7.777 -5.289 990 HB2 GLU 129 1HB GLU 129 9.886 7.205 -7.249 991 HB3 GLU 129 2HB GLU 129 10.604 7.029 -5.654 992 HG2 GLU 129 1HG GLU 129 9.925 4.564 -5.838 993 HG3 GLU 129 2HG GLU 129 9.712 4.898 -7.557 994 H ARG 130 H ARG 130 6.823 8.487 -6.623 995 HA ARG 130 HA ARG 130 5.010 6.662 -7.870 996 HE ARG 130 HE ARG 130 3.843 7.546 -11.163 997 HB2 ARG 130 1HB ARG 130 4.303 8.845 -6.959 998 HB3 ARG 130 2HB ARG 130 5.266 9.660 -8.183 999 HG2 ARG 130 1HG ARG 130 3.228 7.721 -9.114 1000 HG3 ARG 130 2HG ARG 130 2.667 9.257 -8.452 1001 HD2 ARG 130 1HD ARG 130 3.090 10.217 -10.404 1002 HD3 ARG 130 2HD ARG 130 4.802 9.866 -10.178 1003 HH11 ARG 130 1HH1 ARG 130 3.565 10.861 -12.224 1004 HH12 ARG 130 2HH1 ARG 130 3.434 10.445 -13.899 1005 HH21 ARG 130 1HH2 ARG 130 3.669 7.000 -13.368 1006 HH22 ARG 130 2HH2 ARG 130 3.491 8.254 -14.549 1007 H ALA 131 H ALA 131 6.045 5.461 -9.419 1008 HA ALA 131 HA ALA 131 7.202 4.956 -11.343 1009 HB1 ALA 131 3HB ALA 131 6.174 5.910 -13.322 1010 HB2 ALA 131 1HB ALA 131 5.438 7.180 -12.345 1011 HB3 ALA 131 2HB ALA 131 4.953 5.499 -12.117 Start of MODEL 18 1 H MET 1 H MET 1 -12.274 4.211 -15.939 2 HA MET 1 HA MET 1 -12.759 1.330 -15.738 3 HB2 MET 1 1HB MET 1 -10.284 2.769 -16.353 4 HB3 MET 1 2HB MET 1 -10.156 1.765 -14.916 5 HG2 MET 1 1HG MET 1 -9.548 0.240 -16.469 6 HG3 MET 1 2HG MET 1 -11.292 -0.016 -16.506 7 HE1 MET 1 3HE MET 1 -9.785 -1.183 -18.421 8 HE2 MET 1 1HE MET 1 -9.474 -0.430 -19.985 9 HE3 MET 1 2HE MET 1 -11.107 -0.950 -19.566 10 H GLY 2 H GLY 2 -13.901 3.698 -14.416 11 HA2 GLY 2 1HA GLY 2 -13.680 2.831 -11.736 12 HA3 GLY 2 2HA GLY 2 -12.696 4.268 -11.963 13 H GLU 3 H GLU 3 -13.651 6.193 -11.772 14 HA GLU 3 HA GLU 3 -16.557 6.365 -12.121 15 HB2 GLU 3 1HB GLU 3 -16.329 8.064 -10.083 16 HB3 GLU 3 2HB GLU 3 -16.660 6.356 -9.845 17 HG2 GLU 3 1HG GLU 3 -13.814 6.988 -9.959 18 HG3 GLU 3 2HG GLU 3 -14.669 7.781 -8.636 19 H ARG 4 H ARG 4 -14.056 8.647 -11.012 20 HA ARG 4 HA ARG 4 -14.332 10.153 -13.495 21 HE ARG 4 HE ARG 4 -13.640 11.263 -9.126 22 HB2 ARG 4 1HB ARG 4 -14.352 12.021 -11.293 23 HB3 ARG 4 2HB ARG 4 -15.452 11.894 -12.656 24 HG2 ARG 4 1HG ARG 4 -16.822 11.673 -10.790 25 HG3 ARG 4 2HG ARG 4 -16.582 10.015 -11.339 26 HD2 ARG 4 1HD ARG 4 -16.383 10.449 -8.839 27 HD3 ARG 4 2HD ARG 4 -15.078 9.541 -9.599 28 HH11 ARG 4 1HH1 ARG 4 -16.923 12.359 -8.669 29 HH12 ARG 4 2HH1 ARG 4 -16.452 13.855 -7.933 30 HH21 ARG 4 1HH2 ARG 4 -13.022 13.230 -8.158 31 HH22 ARG 4 2HH2 ARG 4 -14.239 14.350 -7.644 32 H GLY 5 H GLY 5 -12.249 8.605 -11.824 33 HA2 GLY 5 1HA GLY 5 -9.986 10.001 -12.632 34 HA3 GLY 5 2HA GLY 5 -10.314 10.507 -10.982 35 H VAL 6 H VAL 6 -9.359 7.849 -13.039 36 HA VAL 6 HA VAL 6 -8.122 6.556 -10.718 37 HB VAL 6 HB VAL 6 -8.957 4.315 -11.410 38 HG11 VAL 6 1HG1 VAL 6 -10.933 6.393 -10.505 39 HG12 VAL 6 2HG1 VAL 6 -10.040 5.225 -9.530 40 HG13 VAL 6 3HG1 VAL 6 -11.339 4.679 -10.589 41 HG21 VAL 6 3HG2 VAL 6 -10.272 3.955 -13.186 42 HG22 VAL 6 1HG2 VAL 6 -9.757 5.555 -13.716 43 HG23 VAL 6 2HG2 VAL 6 -11.278 5.361 -12.847 44 H GLU 7 H GLU 7 -6.235 7.410 -11.820 45 HA GLU 7 HA GLU 7 -5.091 5.454 -13.591 46 HB2 GLU 7 1HB GLU 7 -5.696 8.243 -14.554 47 HB3 GLU 7 2HB GLU 7 -4.420 7.268 -15.270 48 HG2 GLU 7 1HG GLU 7 -7.365 6.677 -15.216 49 HG3 GLU 7 2HG GLU 7 -6.365 7.051 -16.619 50 H MET 8 H MET 8 -4.622 6.649 -10.937 51 HA MET 8 HA MET 8 -1.977 7.854 -11.386 52 HB2 MET 8 1HB MET 8 -3.941 8.937 -9.939 53 HB3 MET 8 2HB MET 8 -3.237 7.915 -8.693 54 HG2 MET 8 1HG MET 8 -1.719 9.471 -8.320 55 HG3 MET 8 2HG MET 8 -1.088 9.212 -9.945 56 HE1 MET 8 3HE MET 8 -1.057 12.960 -9.284 57 HE2 MET 8 1HE MET 8 -0.675 11.520 -8.338 58 HE3 MET 8 2HE MET 8 -2.085 12.498 -7.926 59 H ARG 9 H ARG 9 -0.472 6.315 -11.369 60 HA ARG 9 HA ARG 9 -0.622 4.269 -9.253 61 HE ARG 9 HE ARG 9 2.683 2.428 -13.699 62 HB2 ARG 9 1HB ARG 9 0.311 2.681 -10.662 63 HB3 ARG 9 2HB ARG 9 -0.745 3.583 -11.738 64 HG2 ARG 9 1HG ARG 9 1.038 3.670 -13.082 65 HG3 ARG 9 2HG ARG 9 1.603 4.947 -12.005 66 HD2 ARG 9 1HD ARG 9 3.233 3.669 -11.141 67 HD3 ARG 9 2HD ARG 9 2.209 2.233 -11.082 68 HH11 ARG 9 1HH1 ARG 9 4.861 2.642 -10.975 69 HH12 ARG 9 2HH1 ARG 9 6.217 2.030 -11.858 70 HH21 ARG 9 1HH2 ARG 9 4.468 1.619 -14.853 71 HH22 ARG 9 2HH2 ARG 9 5.996 1.449 -14.057 72 H LEU 10 H LEU 10 1.164 3.731 -8.071 73 HA LEU 10 HA LEU 10 3.481 5.525 -8.352 74 HG LEU 10 HG LEU 10 0.892 4.379 -6.043 75 HB2 LEU 10 1HB LEU 10 3.422 4.534 -5.692 76 HB3 LEU 10 2HB LEU 10 3.292 6.190 -6.240 77 HD11 LEU 10 1HD1 LEU 10 1.764 4.439 -3.822 78 HD12 LEU 10 2HD1 LEU 10 0.449 5.615 -3.891 79 HD13 LEU 10 3HD1 LEU 10 2.124 6.163 -3.946 80 HD21 LEU 10 3HD2 LEU 10 0.593 7.242 -5.620 81 HD22 LEU 10 1HD2 LEU 10 -0.290 6.155 -6.692 82 HD23 LEU 10 2HD2 LEU 10 1.247 6.848 -7.209 83 H ARG 11 H ARG 11 5.511 4.607 -7.426 84 HA ARG 11 HA ARG 11 5.632 1.734 -8.023 85 HE ARG 11 HE ARG 11 9.739 0.464 -10.200 86 HB2 ARG 11 1HB ARG 11 7.046 3.794 -9.164 87 HB3 ARG 11 2HB ARG 11 8.179 3.185 -7.965 88 HG2 ARG 11 1HG ARG 11 6.821 1.501 -10.060 89 HG3 ARG 11 2HG ARG 11 8.454 2.154 -10.186 90 HD2 ARG 11 1HD ARG 11 8.474 0.905 -7.737 91 HD3 ARG 11 2HD ARG 11 7.465 -0.162 -8.713 92 HH11 ARG 11 1HH1 ARG 11 8.901 -1.259 -7.284 93 HH12 ARG 11 2HH1 ARG 11 10.227 -2.367 -7.408 94 HH21 ARG 11 1HH2 ARG 11 11.484 -0.990 -10.365 95 HH22 ARG 11 2HH2 ARG 11 11.695 -2.212 -9.155 96 H ILE 12 H ILE 12 6.826 0.352 -6.686 97 HA ILE 12 HA ILE 12 7.955 1.438 -4.233 98 HB ILE 12 HB ILE 12 5.424 -0.055 -4.342 99 HG12 ILE 12 1HG1 ILE 12 6.618 1.286 -1.942 100 HG13 ILE 12 2HG1 ILE 12 6.059 2.249 -3.307 101 HG21 ILE 12 1HG2 ILE 12 6.526 -1.961 -3.575 102 HG22 ILE 12 2HG2 ILE 12 5.947 -1.182 -2.104 103 HG23 ILE 12 3HG2 ILE 12 7.640 -1.029 -2.572 104 HD11 ILE 12 3HD1 ILE 12 4.343 2.101 -1.617 105 HD12 ILE 12 1HD1 ILE 12 4.400 0.339 -1.677 106 HD13 ILE 12 2HD1 ILE 12 3.832 1.251 -3.076 107 H ARG 13 H ARG 13 9.972 0.750 -4.585 108 HA ARG 13 HA ARG 13 10.384 -2.022 -5.445 109 HE ARG 13 HE ARG 13 14.981 2.479 -5.360 110 HB2 ARG 13 1HB ARG 13 12.740 -1.311 -5.855 111 HB3 ARG 13 2HB ARG 13 11.554 -0.440 -6.817 112 HG2 ARG 13 1HG ARG 13 11.678 1.422 -5.174 113 HG3 ARG 13 2HG ARG 13 12.983 0.555 -4.363 114 HD2 ARG 13 1HD ARG 13 13.623 0.639 -7.113 115 HD3 ARG 13 2HD ARG 13 13.099 2.259 -6.655 116 HH11 ARG 13 1HH1 ARG 13 14.625 -0.860 -6.312 117 HH12 ARG 13 2HH1 ARG 13 16.194 -1.319 -5.742 118 HH21 ARG 13 1HH2 ARG 13 17.045 1.876 -4.610 119 HH22 ARG 13 2HH2 ARG 13 17.567 0.233 -4.775 120 H PHE 14 H PHE 14 12.003 -3.313 -4.453 121 HA PHE 14 HA PHE 14 12.749 -2.607 -1.717 122 HD1 PHE 14 HD1 PHE 14 9.763 -2.475 -2.007 123 HD2 PHE 14 HD2 PHE 14 11.494 -5.153 0.811 124 HE1 PHE 14 HE1 PHE 14 8.309 -1.559 -0.250 125 HE2 PHE 14 HE2 PHE 14 10.043 -4.241 2.573 126 HZ PHE 14 HZ PHE 14 8.446 -2.442 2.044 127 HB2 PHE 14 1HB PHE 14 10.989 -4.847 -2.567 128 HB3 PHE 14 2HB PHE 14 12.212 -5.226 -1.361 129 H GLU 15 H GLU 15 14.758 -3.282 -1.181 130 HA GLU 15 HA GLU 15 16.697 -3.790 -2.991 131 HB2 GLU 15 1HB GLU 15 16.457 -4.272 -0.092 132 HB3 GLU 15 2HB GLU 15 17.688 -5.230 -0.898 133 HG2 GLU 15 1HG GLU 15 18.305 -2.938 0.116 134 HG3 GLU 15 2HG GLU 15 18.952 -3.405 -1.452 135 H SER 16 H SER 16 14.485 -6.170 -1.718 136 HA SER 16 HA SER 16 15.792 -8.189 -3.422 137 HG SER 16 HG SER 16 16.231 -8.881 0.189 138 HB2 SER 16 1HB SER 16 14.250 -9.108 -1.052 139 HB3 SER 16 2HB SER 16 15.696 -9.792 -1.795 140 H ALA 17 H ALA 17 13.411 -6.313 -3.826 141 HA ALA 17 HA ALA 17 11.809 -8.163 -5.252 142 HB1 ALA 17 3HB ALA 17 11.203 -8.423 -2.667 143 HB2 ALA 17 1HB ALA 17 10.010 -8.614 -3.953 144 HB3 ALA 17 2HB ALA 17 10.118 -7.092 -3.071 145 H GLU 18 H GLU 18 10.110 -7.221 -6.452 146 HA GLU 18 HA GLU 18 9.996 -4.276 -6.379 147 HB2 GLU 18 1HB GLU 18 9.807 -4.340 -8.875 148 HB3 GLU 18 2HB GLU 18 11.376 -4.833 -8.255 149 HG2 GLU 18 1HG GLU 18 9.691 -7.127 -8.492 150 HG3 GLU 18 2HG GLU 18 9.681 -6.227 -10.009 151 H CYS 19 H CYS 19 8.008 -3.313 -6.866 152 HA CYS 19 HA CYS 19 5.775 -4.879 -7.771 153 HG CYS 19 HG CYS 19 6.452 -4.169 -3.650 154 HB2 CYS 19 1HB CYS 19 4.708 -3.970 -5.336 155 HB3 CYS 19 2HB CYS 19 4.995 -5.639 -5.812 156 H GLU 20 H GLU 20 3.930 -3.633 -8.294 157 HA GLU 20 HA GLU 20 4.167 -0.740 -7.836 158 HB2 GLU 20 1HB GLU 20 3.069 -1.628 -10.454 159 HB3 GLU 20 2HB GLU 20 3.961 -0.170 -10.050 160 HG2 GLU 20 1HG GLU 20 5.871 -2.046 -9.685 161 HG3 GLU 20 2HG GLU 20 4.917 -2.775 -10.973 162 H VAL 21 H VAL 21 2.106 0.414 -8.081 163 HA VAL 21 HA VAL 21 -0.307 -1.174 -8.137 164 HB VAL 21 HB VAL 21 -0.456 -1.513 -5.943 165 HG11 VAL 21 1HG1 VAL 21 1.818 -1.335 -5.483 166 HG12 VAL 21 2HG1 VAL 21 1.053 -0.276 -4.295 167 HG13 VAL 21 3HG1 VAL 21 1.830 0.414 -5.722 168 HG21 VAL 21 3HG2 VAL 21 -0.679 1.489 -5.705 169 HG22 VAL 21 1HG2 VAL 21 -1.236 0.304 -4.523 170 HG23 VAL 21 2HG2 VAL 21 -1.995 0.387 -6.113 171 H GLU 22 H GLU 22 -2.188 0.007 -8.424 172 HA GLU 22 HA GLU 22 -1.771 2.745 -9.350 173 HB2 GLU 22 1HB GLU 22 -3.752 0.602 -9.913 174 HB3 GLU 22 2HB GLU 22 -4.321 2.262 -10.021 175 HG2 GLU 22 1HG GLU 22 -3.254 2.623 -11.942 176 HG3 GLU 22 2HG GLU 22 -1.781 1.832 -11.378 177 H LEU 23 H LEU 23 -4.049 4.054 -9.006 178 HA LEU 23 HA LEU 23 -4.985 3.657 -6.281 179 HG LEU 23 HG LEU 23 -5.666 6.578 -5.790 180 HB2 LEU 23 1HB LEU 23 -3.102 5.039 -5.849 181 HB3 LEU 23 2HB LEU 23 -3.477 6.095 -7.195 182 HD11 LEU 23 1HD1 LEU 23 -5.631 5.396 -3.869 183 HD12 LEU 23 2HD1 LEU 23 -4.563 6.691 -3.325 184 HD13 LEU 23 3HD1 LEU 23 -3.882 5.175 -3.914 185 HD21 LEU 23 3HD2 LEU 23 -2.953 7.721 -5.767 186 HD22 LEU 23 1HD2 LEU 23 -4.021 8.246 -4.464 187 HD23 LEU 23 2HD2 LEU 23 -4.504 8.470 -6.145 188 H TYR 24 H TYR 24 -7.042 4.189 -6.008 189 HA TYR 24 HA TYR 24 -8.370 5.670 -8.184 190 HD1 TYR 24 HD1 TYR 24 -8.075 4.124 -9.632 191 HD2 TYR 24 HD2 TYR 24 -9.791 1.397 -6.854 192 HE1 TYR 24 HE1 TYR 24 -7.286 2.241 -11.001 193 HE2 TYR 24 HE2 TYR 24 -9.005 -0.493 -8.216 194 HH TYR 24 HH TYR 24 -6.701 -0.362 -10.391 195 HB2 TYR 24 1HB TYR 24 -9.687 3.674 -6.316 196 HB3 TYR 24 2HB TYR 24 -10.387 4.423 -7.747 197 H GLU 25 H GLU 25 -9.682 7.373 -7.717 198 HA GLU 25 HA GLU 25 -9.206 8.861 -5.413 199 HB2 GLU 25 1HB GLU 25 -11.490 9.042 -7.376 200 HB3 GLU 25 2HB GLU 25 -11.207 10.221 -6.102 201 HG2 GLU 25 1HG GLU 25 -9.101 10.851 -7.074 202 HG3 GLU 25 2HG GLU 25 -9.220 9.561 -8.271 203 H GLU 26 H GLU 26 -11.156 6.116 -5.586 204 HA GLU 26 HA GLU 26 -13.390 6.593 -4.121 205 HB2 GLU 26 1HB GLU 26 -13.375 4.313 -3.454 206 HB3 GLU 26 2HB GLU 26 -12.603 4.376 -5.032 207 HG2 GLU 26 1HG GLU 26 -10.392 4.382 -3.825 208 HG3 GLU 26 2HG GLU 26 -11.293 4.028 -2.351 209 H TRP 27 H TRP 27 -10.099 6.687 -2.957 210 HA TRP 27 HA TRP 27 -10.840 6.695 -0.178 211 HD1 TRP 27 HD1 TRP 27 -6.062 7.707 -0.308 212 HE1 TRP 27 HE1 TRP 27 -5.647 8.807 1.975 213 HE3 TRP 27 HE3 TRP 27 -10.807 7.463 1.592 214 HZ2 TRP 27 HZ2 TRP 27 -7.131 9.490 4.278 215 HZ3 TRP 27 HZ3 TRP 27 -11.219 8.365 3.841 216 HH2 TRP 27 HH2 TRP 27 -9.419 9.357 5.157 217 HB2 TRP 27 1HB TRP 27 -8.681 5.814 -0.627 218 HB3 TRP 27 2HB TRP 27 -8.258 7.166 -1.669 219 H ALA 28 H ALA 28 -9.445 9.108 -2.425 220 HA ALA 28 HA ALA 28 -11.089 11.182 -2.175 221 HB1 ALA 28 3HB ALA 28 -11.232 11.391 0.116 222 HB2 ALA 28 1HB ALA 28 -9.968 12.563 -0.261 223 HB3 ALA 28 2HB ALA 28 -9.537 10.974 0.369 224 HA PRO 29 HA PRO 29 -7.805 12.444 -4.978 225 HB2 PRO 29 1HB PRO 29 -8.962 15.068 -5.038 226 HB3 PRO 29 2HB PRO 29 -9.014 13.825 -6.287 227 HG2 PRO 29 1HG PRO 29 -11.057 14.598 -4.338 228 HG3 PRO 29 2HG PRO 29 -11.227 13.664 -5.831 229 HD2 PRO 29 1HD PRO 29 -11.456 12.597 -3.325 230 HD3 PRO 29 2HD PRO 29 -10.956 11.664 -4.749 231 H GLU 30 H GLU 30 -8.907 14.317 -2.188 232 HA GLU 30 HA GLU 30 -6.802 16.141 -2.025 233 HB2 GLU 30 1HB GLU 30 -8.661 14.978 0.032 234 HB3 GLU 30 2HB GLU 30 -7.409 16.127 0.482 235 HG2 GLU 30 1HG GLU 30 -8.890 17.715 0.041 236 HG3 GLU 30 2HG GLU 30 -8.637 17.338 -1.663 237 H THR 31 H THR 31 -7.184 13.022 -0.325 238 HA THR 31 HA THR 31 -4.656 13.104 0.953 239 HB THR 31 HB THR 31 -5.269 10.380 0.482 240 HG1 THR 31 HG1 THR 31 -7.612 11.806 1.182 241 HG21 THR 31 3HG2 THR 31 -4.487 11.047 2.606 242 HG22 THR 31 1HG2 THR 31 -6.133 10.460 2.840 243 HG23 THR 31 2HG2 THR 31 -5.814 12.192 2.817 244 H VAL 32 H VAL 32 -5.686 11.635 -2.112 245 HA VAL 32 HA VAL 32 -3.419 10.334 -2.910 246 HB VAL 32 HB VAL 32 -5.243 12.036 -4.617 247 HG11 VAL 32 1HG1 VAL 32 -3.372 11.728 -5.972 248 HG12 VAL 32 2HG1 VAL 32 -4.436 10.400 -6.428 249 HG13 VAL 32 3HG1 VAL 32 -3.071 10.104 -5.352 250 HG21 VAL 32 3HG2 VAL 32 -5.403 9.308 -3.499 251 HG22 VAL 32 1HG2 VAL 32 -5.918 9.501 -5.175 252 HG23 VAL 32 2HG2 VAL 32 -6.685 10.450 -3.902 253 H ARG 33 H ARG 33 -3.972 13.784 -2.778 254 HA ARG 33 HA ARG 33 -1.832 14.638 -4.383 255 HE ARG 33 HE ARG 33 -2.588 15.745 -5.814 256 HB2 ARG 33 1HB ARG 33 -3.812 15.982 -3.358 257 HB3 ARG 33 2HB ARG 33 -2.745 16.187 -1.978 258 HG2 ARG 33 1HG ARG 33 -2.048 18.019 -3.044 259 HG3 ARG 33 2HG ARG 33 -1.114 16.906 -4.043 260 HD2 ARG 33 1HD ARG 33 -3.830 18.067 -4.636 261 HD3 ARG 33 2HD ARG 33 -2.320 18.392 -5.486 262 HH11 ARG 33 1HH1 ARG 33 -4.826 18.381 -6.294 263 HH12 ARG 33 2HH1 ARG 33 -5.695 17.576 -7.556 264 HH21 ARG 33 1HH2 ARG 33 -3.732 14.687 -7.474 265 HH22 ARG 33 2HH2 ARG 33 -5.076 15.480 -8.225 266 H ALA 34 H ALA 34 -1.983 13.782 -0.964 267 HA ALA 34 HA ALA 34 0.623 14.692 -0.298 268 HB1 ALA 34 3HB ALA 34 0.163 12.758 1.533 269 HB2 ALA 34 1HB ALA 34 -1.481 13.114 1.006 270 HB3 ALA 34 2HB ALA 34 -0.461 14.401 1.645 271 H ILE 35 H ILE 35 -0.636 11.479 -1.148 272 HA ILE 35 HA ILE 35 1.720 10.019 -0.863 273 HB ILE 35 HB ILE 35 0.232 9.237 -3.269 274 HG12 ILE 35 1HG1 ILE 35 -1.634 10.294 -2.067 275 HG13 ILE 35 2HG1 ILE 35 -1.813 8.543 -2.106 276 HG21 ILE 35 1HG2 ILE 35 0.655 7.154 -2.516 277 HG22 ILE 35 2HG2 ILE 35 0.293 7.564 -0.840 278 HG23 ILE 35 3HG2 ILE 35 1.852 8.005 -1.538 279 HD11 ILE 35 3HD1 ILE 35 -0.431 9.049 0.246 280 HD12 ILE 35 1HD1 ILE 35 -2.137 8.634 0.081 281 HD13 ILE 35 2HD1 ILE 35 -1.644 10.325 0.149 282 H ALA 36 H ALA 36 0.453 11.673 -3.800 283 HA ALA 36 HA ALA 36 2.681 11.151 -5.442 284 HB1 ALA 36 3HB ALA 36 1.590 12.351 -7.004 285 HB2 ALA 36 1HB ALA 36 1.247 13.684 -5.901 286 HB3 ALA 36 2HB ALA 36 0.246 12.232 -5.866 287 H ASP 37 H ASP 37 2.074 13.563 -2.981 288 HA ASP 37 HA ASP 37 4.205 15.310 -3.744 289 HB2 ASP 37 1HB ASP 37 2.174 15.774 -2.185 290 HB3 ASP 37 2HB ASP 37 3.192 15.082 -0.925 291 H ALA 38 H ALA 38 4.012 12.367 -1.936 292 HA ALA 38 HA ALA 38 6.698 12.659 -0.857 293 HB1 ALA 38 3HB ALA 38 5.053 10.234 -0.372 294 HB2 ALA 38 1HB ALA 38 4.515 11.755 0.343 295 HB3 ALA 38 2HB ALA 38 6.119 11.119 0.723 296 H LEU 39 H LEU 39 6.899 12.496 -3.525 297 HA LEU 39 HA LEU 39 7.014 9.906 -4.634 298 HG LEU 39 HG LEU 39 6.355 13.053 -5.788 299 HB2 LEU 39 1HB LEU 39 8.566 12.369 -5.456 300 HB3 LEU 39 2HB LEU 39 8.347 10.927 -6.417 301 HD11 LEU 39 1HD1 LEU 39 5.950 12.190 -8.328 302 HD12 LEU 39 2HD1 LEU 39 7.676 11.885 -8.130 303 HD13 LEU 39 3HD1 LEU 39 7.035 13.508 -7.877 304 HD21 LEU 39 3HD2 LEU 39 5.130 11.124 -5.110 305 HD22 LEU 39 1HD2 LEU 39 5.737 10.181 -6.466 306 HD23 LEU 39 2HD2 LEU 39 4.611 11.504 -6.750 307 HA PRO 40 HA PRO 40 11.147 7.988 -4.150 308 HB2 PRO 40 1HB PRO 40 12.608 10.486 -4.944 309 HB3 PRO 40 2HB PRO 40 13.068 8.794 -5.188 310 HG2 PRO 40 1HG PRO 40 11.853 10.263 -7.115 311 HG3 PRO 40 2HG PRO 40 11.631 8.514 -6.954 312 HD2 PRO 40 1HD PRO 40 9.710 10.638 -6.535 313 HD3 PRO 40 2HD PRO 40 9.436 8.890 -6.562 314 H ILE 41 H ILE 41 11.089 7.743 -2.033 315 HA ILE 41 HA ILE 41 12.543 9.635 -0.365 316 HB ILE 41 HB ILE 41 9.642 8.928 0.034 317 HG12 ILE 41 1HG1 ILE 41 11.227 11.494 0.328 318 HG13 ILE 41 2HG1 ILE 41 10.163 11.079 -1.010 319 HG21 ILE 41 1HG2 ILE 41 11.627 9.624 2.189 320 HG22 ILE 41 2HG2 ILE 41 10.584 8.206 2.093 321 HG23 ILE 41 3HG2 ILE 41 9.883 9.799 2.381 322 HD11 ILE 41 3HD1 ILE 41 9.484 12.531 1.215 323 HD12 ILE 41 1HD1 ILE 41 8.830 10.931 1.565 324 HD13 ILE 41 2HD1 ILE 41 8.359 11.773 0.088 325 H LYS 42 H LYS 42 13.285 8.663 1.626 326 HA LYS 42 HA LYS 42 13.603 5.793 1.327 327 HB2 LYS 42 1HB LYS 42 14.978 7.895 2.960 328 HB3 LYS 42 2HB LYS 42 15.132 6.205 3.417 329 HG2 LYS 42 1HG LYS 42 15.735 5.961 0.842 330 HG3 LYS 42 2HG LYS 42 16.215 7.644 1.065 331 HD2 LYS 42 1HD LYS 42 17.134 5.475 2.935 332 HD3 LYS 42 2HD LYS 42 17.992 5.836 1.433 333 HE2 LYS 42 1HE LYS 42 19.128 7.302 2.698 334 HE3 LYS 42 2HE LYS 42 17.705 8.322 2.482 335 HZ1 LYS 42 3HZ LYS 42 17.766 8.361 4.716 336 HZ2 LYS 42 1HZ LYS 42 18.635 6.914 4.844 337 HZ3 LYS 42 2HZ LYS 42 16.963 6.878 4.589 338 H SER 43 H SER 43 12.679 4.285 2.556 339 HA SER 43 HA SER 43 11.371 5.030 5.065 340 HG SER 43 HG SER 43 9.735 3.750 1.775 341 HB2 SER 43 1HB SER 43 9.624 3.203 3.790 342 HB3 SER 43 2HB SER 43 9.317 4.889 4.189 343 H THR 44 H THR 44 11.100 3.312 6.537 344 HA THR 44 HA THR 44 12.775 0.962 5.931 345 HB THR 44 HB THR 44 11.832 1.387 8.702 346 HG1 THR 44 HG1 THR 44 13.761 3.133 7.580 347 HG21 THR 44 3HG2 THR 44 14.162 0.302 7.341 348 HG22 THR 44 1HG2 THR 44 13.495 -0.069 8.931 349 HG23 THR 44 2HG2 THR 44 14.567 1.316 8.726 350 H ALA 45 H ALA 45 11.893 -0.989 5.713 351 HA ALA 45 HA ALA 45 9.023 -1.264 6.066 352 HB1 ALA 45 3HB ALA 45 9.247 -2.387 4.161 353 HB2 ALA 45 1HB ALA 45 10.010 -3.677 5.086 354 HB3 ALA 45 2HB ALA 45 11.002 -2.433 4.330 355 H ASN 46 H ASN 46 8.021 -2.432 7.527 356 HA ASN 46 HA ASN 46 9.623 -3.922 9.491 357 HB2 ASN 46 1HB ASN 46 6.931 -2.592 9.587 358 HB3 ASN 46 2HB ASN 46 7.300 -3.893 10.714 359 HD21 ASN 46 1HD2 ASN 46 6.862 -0.945 11.024 360 HD22 ASN 46 2HD2 ASN 46 8.227 -0.397 11.928 361 H ARG 47 H ARG 47 9.473 -6.163 9.545 362 HA ARG 47 HA ARG 47 7.695 -7.346 7.572 363 HE ARG 47 HE ARG 47 7.501 -9.265 6.573 364 HB2 ARG 47 1HB ARG 47 10.211 -8.119 8.893 365 HB3 ARG 47 2HB ARG 47 9.122 -9.441 8.495 366 HG2 ARG 47 1HG ARG 47 9.412 -7.541 6.319 367 HG3 ARG 47 2HG ARG 47 10.944 -8.263 6.799 368 HD2 ARG 47 1HD ARG 47 9.826 -9.549 5.044 369 HD3 ARG 47 2HD ARG 47 10.016 -10.484 6.522 370 HH11 ARG 47 1HH1 ARG 47 9.212 -11.716 4.773 371 HH12 ARG 47 2HH1 ARG 47 7.779 -12.606 4.380 372 HH21 ARG 47 1HH2 ARG 47 5.615 -10.433 6.056 373 HH22 ARG 47 2HH2 ARG 47 5.737 -11.878 5.107 374 H TRP 48 H TRP 48 6.022 -8.646 7.949 375 HA TRP 48 HA TRP 48 5.586 -9.931 10.492 376 HD1 TRP 48 HD1 TRP 48 1.853 -9.978 9.454 377 HE1 TRP 48 HE1 TRP 48 0.320 -10.744 11.374 378 HE3 TRP 48 HE3 TRP 48 4.338 -7.838 13.377 379 HZ2 TRP 48 HZ2 TRP 48 0.183 -10.476 14.183 380 HZ3 TRP 48 HZ3 TRP 48 3.439 -8.140 15.647 381 HH2 TRP 48 HH2 TRP 48 1.405 -9.432 16.041 382 HB2 TRP 48 1HB TRP 48 4.634 -7.736 10.979 383 HB3 TRP 48 2HB TRP 48 3.685 -7.787 9.498 384 H GLY 49 H GLY 49 4.040 -11.625 10.316 385 HA2 GLY 49 1HA GLY 49 3.934 -13.242 8.243 386 HA3 GLY 49 2HA GLY 49 2.502 -13.016 9.230 387 H ASP 50 H ASP 50 4.140 -12.042 6.279 388 HA ASP 50 HA ASP 50 3.322 -11.469 4.232 389 HB2 ASP 50 1HB ASP 50 1.473 -13.089 4.759 390 HB3 ASP 50 2HB ASP 50 0.541 -11.732 5.380 391 H GLU 51 H GLU 51 1.790 -9.939 7.022 392 HA GLU 51 HA GLU 51 1.032 -7.572 5.638 393 HB2 GLU 51 1HB GLU 51 0.351 -8.669 8.026 394 HB3 GLU 51 2HB GLU 51 1.466 -7.417 8.555 395 HG2 GLU 51 1HG GLU 51 -0.486 -6.499 6.590 396 HG3 GLU 51 2HG GLU 51 -1.200 -7.083 8.090 397 H ILE 52 H ILE 52 2.197 -5.838 5.154 398 HA ILE 52 HA ILE 52 4.716 -5.368 6.597 399 HB ILE 52 HB ILE 52 4.563 -6.187 3.908 400 HG12 ILE 52 1HG1 ILE 52 7.062 -5.537 3.985 401 HG13 ILE 52 2HG1 ILE 52 6.739 -5.020 5.635 402 HG21 ILE 52 1HG2 ILE 52 5.341 -3.279 4.073 403 HG22 ILE 52 2HG2 ILE 52 3.936 -3.939 3.233 404 HG23 ILE 52 3HG2 ILE 52 5.562 -4.325 2.671 405 HD11 ILE 52 3HD1 ILE 52 6.024 -7.292 6.198 406 HD12 ILE 52 1HD1 ILE 52 7.674 -7.250 5.583 407 HD13 ILE 52 2HD1 ILE 52 6.366 -7.806 4.543 408 H TYR 53 H TYR 53 4.809 -3.367 7.414 409 HA TYR 53 HA TYR 53 3.330 -1.222 6.059 410 HD1 TYR 53 HD1 TYR 53 4.135 0.016 9.973 411 HD2 TYR 53 HD2 TYR 53 2.568 -3.881 9.273 412 HE1 TYR 53 HE1 TYR 53 4.988 -0.716 12.158 413 HE2 TYR 53 HE2 TYR 53 3.418 -4.620 11.456 414 HH TYR 53 HH TYR 53 4.222 -2.709 13.862 415 HB2 TYR 53 1HB TYR 53 2.467 -0.391 8.207 416 HB3 TYR 53 2HB TYR 53 1.896 -2.026 7.881 417 H PHE 54 H PHE 54 4.492 0.560 5.796 418 HA PHE 54 HA PHE 54 6.710 1.103 7.641 419 HD1 PHE 54 HD1 PHE 54 6.815 3.598 4.655 420 HD2 PHE 54 HD2 PHE 54 6.859 -0.477 3.433 421 HE1 PHE 54 HE1 PHE 54 6.102 4.269 2.401 422 HE2 PHE 54 HE2 PHE 54 6.142 0.187 1.178 423 HZ PHE 54 HZ PHE 54 5.763 2.563 0.659 424 HB2 PHE 54 1HB PHE 54 8.199 1.675 5.840 425 HB3 PHE 54 2HB PHE 54 7.587 0.053 5.553 426 H THR 55 H THR 55 7.162 3.272 8.016 427 HA THR 55 HA THR 55 5.001 5.104 7.261 428 HB THR 55 HB THR 55 7.213 6.076 8.973 429 HG1 THR 55 HG1 THR 55 5.465 4.019 9.835 430 HG21 THR 55 3HG2 THR 55 4.244 6.255 8.931 431 HG22 THR 55 1HG2 THR 55 5.453 7.535 9.031 432 HG23 THR 55 2HG2 THR 55 5.108 6.537 10.442 433 H THR 56 H THR 56 5.362 7.080 6.182 434 HA THR 56 HA THR 56 7.988 7.281 4.865 435 HB THR 56 HB THR 56 6.038 8.586 3.276 436 HG1 THR 56 HG1 THR 56 4.483 7.277 4.284 437 HG21 THR 56 3HG2 THR 56 6.599 6.172 2.043 438 HG22 THR 56 1HG2 THR 56 8.044 6.537 2.988 439 HG23 THR 56 2HG2 THR 56 7.440 7.705 1.810 440 H GLN 57 H GLN 57 6.318 8.698 7.191 441 HA GLN 57 HA GLN 57 6.679 10.699 8.252 442 HB2 GLN 57 1HB GLN 57 7.917 11.910 5.789 443 HB3 GLN 57 2HB GLN 57 8.181 12.324 7.477 444 HG2 GLN 57 1HG GLN 57 8.946 9.619 7.126 445 HG3 GLN 57 2HG GLN 57 9.667 10.563 5.825 446 HE21 GLN 57 1HE2 GLN 57 10.286 12.897 6.906 447 HE22 GLN 57 2HE2 GLN 57 11.389 12.719 8.222 448 H VAL 58 H VAL 58 4.892 10.189 5.456 449 HA VAL 58 HA VAL 58 3.752 12.853 5.345 450 HB VAL 58 HB VAL 58 3.971 11.567 3.262 451 HG11 VAL 58 1HG1 VAL 58 3.558 9.328 4.284 452 HG12 VAL 58 2HG1 VAL 58 2.667 9.623 2.788 453 HG13 VAL 58 3HG1 VAL 58 1.842 9.732 4.343 454 HG21 VAL 58 3HG2 VAL 58 1.235 12.352 4.199 455 HG22 VAL 58 1HG2 VAL 58 1.508 11.763 2.558 456 HG23 VAL 58 2HG2 VAL 58 2.334 13.216 3.123 457 H ALA 59 H ALA 59 2.327 13.485 6.824 458 HA ALA 59 HA ALA 59 0.646 11.439 8.107 459 HB1 ALA 59 3HB ALA 59 1.065 14.222 9.159 460 HB2 ALA 59 1HB ALA 59 2.174 12.895 9.516 461 HB3 ALA 59 2HB ALA 59 0.486 12.794 10.015 462 H VAL 60 H VAL 60 -1.062 11.272 6.739 463 HA VAL 60 HA VAL 60 -2.825 13.629 6.615 464 HB VAL 60 HB VAL 60 -1.846 13.414 4.404 465 HG11 VAL 60 1HG1 VAL 60 -1.295 10.946 4.723 466 HG12 VAL 60 2HG1 VAL 60 -1.808 11.452 3.116 467 HG13 VAL 60 3HG1 VAL 60 -2.942 10.624 4.178 468 HG21 VAL 60 3HG2 VAL 60 -4.692 12.430 4.537 469 HG22 VAL 60 1HG2 VAL 60 -3.903 12.967 3.056 470 HG23 VAL 60 2HG2 VAL 60 -4.137 14.099 4.385 471 H GLU 61 H GLU 61 -4.444 13.053 7.983 472 HA GLU 61 HA GLU 61 -5.624 10.376 7.605 473 HB2 GLU 61 1HB GLU 61 -4.577 11.624 9.994 474 HB3 GLU 61 2HB GLU 61 -6.274 11.214 10.201 475 HG2 GLU 61 1HG GLU 61 -5.743 8.904 9.454 476 HG3 GLU 61 2HG GLU 61 -4.037 9.353 9.438 477 H LYS 62 H LYS 62 -7.766 10.248 7.314 478 HA LYS 62 HA LYS 62 -9.481 12.489 8.015 479 HB2 LYS 62 1HB LYS 62 -8.793 13.040 5.747 480 HB3 LYS 62 2HB LYS 62 -9.218 11.429 5.192 481 HG2 LYS 62 1HG LYS 62 -11.511 11.848 5.365 482 HG3 LYS 62 2HG LYS 62 -11.267 13.262 6.392 483 HD2 LYS 62 1HD LYS 62 -10.084 13.285 3.663 484 HD3 LYS 62 2HD LYS 62 -11.830 13.494 3.818 485 HE2 LYS 62 1HE LYS 62 -11.063 15.219 5.688 486 HE3 LYS 62 2HE LYS 62 -9.612 15.265 4.688 487 HZ1 LYS 62 3HZ LYS 62 -12.119 15.473 3.248 488 HZ2 LYS 62 1HZ LYS 62 -10.677 16.334 3.044 489 HZ3 LYS 62 2HZ LYS 62 -11.765 16.781 4.261 490 H GLU 63 H GLU 63 -11.843 11.890 7.666 491 HA GLU 63 HA GLU 63 -12.177 9.051 8.318 492 HB2 GLU 63 1HB GLU 63 -14.387 9.726 9.236 493 HB3 GLU 63 2HB GLU 63 -13.026 10.499 10.035 494 HG2 GLU 63 1HG GLU 63 -14.447 11.909 7.816 495 HG3 GLU 63 2HG GLU 63 -15.139 11.873 9.434 496 H GLU 64 H GLU 64 -12.257 8.121 6.302 497 HA GLU 64 HA GLU 64 -14.771 8.134 5.002 498 HB2 GLU 64 1HB GLU 64 -14.305 10.072 3.848 499 HB3 GLU 64 2HB GLU 64 -12.572 9.787 3.851 500 HG2 GLU 64 1HG GLU 64 -12.658 8.426 1.988 501 HG3 GLU 64 2HG GLU 64 -14.363 8.045 2.217 502 H ASN 65 H ASN 65 -14.893 6.539 3.272 503 HA ASN 65 HA ASN 65 -14.416 4.537 2.311 504 HB2 ASN 65 1HB ASN 65 -12.538 5.740 1.287 505 HB3 ASN 65 2HB ASN 65 -11.542 5.421 2.707 506 HD21 ASN 65 1HD2 ASN 65 -11.781 4.578 -0.320 507 HD22 ASN 65 2HD2 ASN 65 -11.365 2.902 -0.257 508 H SER 66 H SER 66 -11.554 4.611 4.356 509 HA SER 66 HA SER 66 -10.729 2.869 5.676 510 HG SER 66 HG SER 66 -10.267 3.879 7.753 511 HB2 SER 66 1HB SER 66 -12.961 4.332 6.988 512 HB3 SER 66 2HB SER 66 -12.311 2.923 7.825 513 H LYS 67 H LYS 67 -11.175 0.957 4.344 514 HA LYS 67 HA LYS 67 -13.580 -0.524 5.185 515 HB2 LYS 67 1HB LYS 67 -13.059 -2.084 3.288 516 HB3 LYS 67 2HB LYS 67 -13.488 -0.458 2.796 517 HG2 LYS 67 1HG LYS 67 -11.725 -0.971 1.415 518 HG3 LYS 67 2HG LYS 67 -10.929 -0.068 2.699 519 HD2 LYS 67 1HD LYS 67 -10.349 -2.240 3.775 520 HD3 LYS 67 2HD LYS 67 -11.045 -3.068 2.384 521 HE2 LYS 67 1HE LYS 67 -9.393 -2.236 0.936 522 HE3 LYS 67 2HE LYS 67 -8.868 -1.023 2.101 523 HZ1 LYS 67 3HZ LYS 67 -8.650 -3.717 3.082 524 HZ2 LYS 67 1HZ LYS 67 -7.509 -2.469 3.089 525 HZ3 LYS 67 2HZ LYS 67 -7.696 -3.433 1.715 526 H ASP 68 H ASP 68 -13.391 -2.801 5.742 527 HA ASP 68 HA ASP 68 -10.758 -3.393 6.950 528 HB2 ASP 68 1HB ASP 68 -12.122 -4.779 8.596 529 HB3 ASP 68 2HB ASP 68 -12.263 -3.029 8.732 530 H VAL 69 H VAL 69 -12.882 -4.432 4.554 531 HA VAL 69 HA VAL 69 -11.666 -7.114 4.646 532 HB VAL 69 HB VAL 69 -14.143 -7.078 5.224 533 HG11 VAL 69 1HG1 VAL 69 -14.998 -7.109 2.463 534 HG12 VAL 69 2HG1 VAL 69 -14.331 -5.541 2.914 535 HG13 VAL 69 3HG1 VAL 69 -15.665 -6.232 3.839 536 HG21 VAL 69 3HG2 VAL 69 -13.363 -9.180 4.744 537 HG22 VAL 69 1HG2 VAL 69 -12.870 -8.745 3.108 538 HG23 VAL 69 2HG2 VAL 69 -14.576 -8.985 3.479 539 H VAL 70 H VAL 70 -11.023 -8.025 2.721 540 HA VAL 70 HA VAL 70 -11.568 -6.747 0.193 541 HB VAL 70 HB VAL 70 -9.208 -6.295 -0.379 542 HG11 VAL 70 1HG1 VAL 70 -10.812 -4.566 0.563 543 HG12 VAL 70 2HG1 VAL 70 -9.093 -4.178 0.628 544 HG13 VAL 70 3HG1 VAL 70 -9.928 -4.734 2.079 545 HG21 VAL 70 3HG2 VAL 70 -7.461 -6.238 1.240 546 HG22 VAL 70 1HG2 VAL 70 -8.204 -7.834 1.360 547 HG23 VAL 70 2HG2 VAL 70 -8.574 -6.589 2.553 548 H GLU 71 H GLU 71 -10.480 -7.888 -1.643 549 HA GLU 71 HA GLU 71 -10.068 -10.719 -0.935 550 HB2 GLU 71 1HB GLU 71 -10.821 -11.388 -3.127 551 HB3 GLU 71 2HB GLU 71 -12.032 -10.401 -2.361 552 HG2 GLU 71 1HG GLU 71 -10.055 -9.458 -4.411 553 HG3 GLU 71 2HG GLU 71 -11.714 -9.930 -4.735 554 H LEU 72 H LEU 72 -8.396 -11.874 -1.725 555 HA LEU 72 HA LEU 72 -5.919 -10.884 -1.872 556 HG LEU 72 HG LEU 72 -4.433 -12.186 -3.850 557 HB2 LEU 72 1HB LEU 72 -6.205 -13.244 -1.879 558 HB3 LEU 72 2HB LEU 72 -7.077 -13.218 -3.396 559 HD11 LEU 72 1HD1 LEU 72 -3.858 -13.462 -1.812 560 HD12 LEU 72 2HD1 LEU 72 -3.103 -14.107 -3.267 561 HD13 LEU 72 3HD1 LEU 72 -4.507 -14.914 -2.571 562 HD21 LEU 72 3HD2 LEU 72 -6.212 -14.343 -4.820 563 HD22 LEU 72 1HD2 LEU 72 -4.487 -14.513 -5.147 564 HD23 LEU 72 2HD2 LEU 72 -5.355 -13.086 -5.713 565 H GLY 73 H GLY 73 -4.638 -9.725 -3.198 566 HA2 GLY 73 1HA GLY 73 -3.883 -9.278 -5.495 567 HA3 GLY 73 2HA GLY 73 -5.570 -9.293 -5.972 568 H ASP 74 H ASP 74 -6.424 -7.665 -3.657 569 HA ASP 74 HA ASP 74 -5.838 -5.104 -4.847 570 HB2 ASP 74 1HB ASP 74 -7.440 -4.303 -2.981 571 HB3 ASP 74 2HB ASP 74 -8.089 -5.289 -4.286 572 H VAL 75 H VAL 75 -5.202 -3.231 -3.666 573 HA VAL 75 HA VAL 75 -3.319 -3.831 -1.456 574 HB VAL 75 HB VAL 75 -3.130 -1.505 -3.404 575 HG11 VAL 75 1HG1 VAL 75 -2.050 -1.298 -1.123 576 HG12 VAL 75 2HG1 VAL 75 -1.001 -1.067 -2.521 577 HG13 VAL 75 3HG1 VAL 75 -0.958 -2.588 -1.631 578 HG21 VAL 75 3HG2 VAL 75 -1.065 -3.526 -3.642 579 HG22 VAL 75 1HG2 VAL 75 -2.057 -2.771 -4.888 580 HG23 VAL 75 2HG2 VAL 75 -2.668 -4.167 -4.002 581 H ALA 76 H ALA 76 -3.184 -2.191 0.309 582 HA ALA 76 HA ALA 76 -5.241 -0.131 0.264 583 HB1 ALA 76 3HB ALA 76 -6.161 -0.857 2.448 584 HB2 ALA 76 1HB ALA 76 -5.192 -2.321 2.326 585 HB3 ALA 76 2HB ALA 76 -6.459 -2.003 1.143 586 H TYR 77 H TYR 77 -4.959 1.549 1.766 587 HA TYR 77 HA TYR 77 -2.288 1.593 3.004 588 HD1 TYR 77 HD2 TYR 77 -1.936 4.373 4.552 589 HD2 TYR 77 HD1 TYR 77 -5.202 5.131 1.933 590 HE1 TYR 77 HE2 TYR 77 -2.625 6.262 5.963 591 HE2 TYR 77 HE1 TYR 77 -5.897 7.020 3.340 592 HH TYR 77 HH TYR 77 -4.977 8.542 4.968 593 HB2 TYR 77 1HB TYR 77 -2.048 3.596 2.031 594 HB3 TYR 77 2HB TYR 77 -3.670 3.482 1.364 595 H TRP 78 H TRP 78 -2.162 1.516 5.151 596 HA TRP 78 HA TRP 78 -4.460 1.349 6.786 597 HD1 TRP 78 HD1 TRP 78 -5.039 1.727 8.946 598 HE1 TRP 78 HE1 TRP 78 -5.327 0.540 11.210 599 HE3 TRP 78 HE3 TRP 78 -0.509 -0.619 9.200 600 HZ2 TRP 78 HZ2 TRP 78 -3.826 -1.173 12.881 601 HZ3 TRP 78 HZ3 TRP 78 -0.012 -2.016 11.164 602 HH2 TRP 78 HH2 TRP 78 -1.637 -2.285 12.965 603 HB2 TRP 78 1HB TRP 78 -2.050 0.416 7.166 604 HB3 TRP 78 2HB TRP 78 -1.741 1.989 7.892 605 H ILE 79 H ILE 79 -5.768 3.035 7.220 606 HA ILE 79 HA ILE 79 -4.928 5.727 7.038 607 HB ILE 79 HB ILE 79 -7.440 4.377 7.900 608 HG12 ILE 79 1HG1 ILE 79 -6.424 5.992 5.681 609 HG13 ILE 79 2HG1 ILE 79 -7.700 4.787 5.706 610 HG21 ILE 79 1HG2 ILE 79 -6.873 7.294 8.418 611 HG22 ILE 79 2HG2 ILE 79 -7.209 6.058 9.630 612 HG23 ILE 79 3HG2 ILE 79 -8.465 6.540 8.491 613 HD11 ILE 79 3HD1 ILE 79 -9.108 6.632 6.826 614 HD12 ILE 79 1HD1 ILE 79 -8.799 6.725 5.092 615 HD13 ILE 79 2HD1 ILE 79 -7.870 7.726 6.210 616 HA PRO 80 HA PRO 80 -5.135 5.976 11.889 617 HB2 PRO 80 1HB PRO 80 -5.151 3.103 12.627 618 HB3 PRO 80 2HB PRO 80 -6.030 4.454 13.349 619 HG2 PRO 80 1HG PRO 80 -7.273 2.642 11.827 620 HG3 PRO 80 2HG PRO 80 -7.729 4.355 11.790 621 HD2 PRO 80 1HD PRO 80 -6.136 2.772 9.826 622 HD3 PRO 80 2HD PRO 80 -7.312 4.065 9.550 623 H GLY 81 H GLY 81 -2.992 6.460 10.936 624 HA2 GLY 81 1HA GLY 81 -0.814 5.986 12.246 625 HA3 GLY 81 2HA GLY 81 -0.951 4.406 11.486 626 H LYS 82 H LYS 82 -2.199 6.265 9.168 627 HA LYS 82 HA LYS 82 -1.409 7.020 7.141 628 HB2 LYS 82 1HB LYS 82 1.075 8.103 8.358 629 HB3 LYS 82 2HB LYS 82 -0.048 8.853 7.236 630 HG2 LYS 82 1HG LYS 82 -0.805 10.052 8.941 631 HG3 LYS 82 2HG LYS 82 -1.502 8.570 9.597 632 HD2 LYS 82 1HD LYS 82 0.499 8.138 10.871 633 HD3 LYS 82 2HD LYS 82 1.306 9.525 10.137 634 HE2 LYS 82 1HE LYS 82 -1.110 10.483 11.219 635 HE3 LYS 82 2HE LYS 82 -0.401 9.427 12.439 636 HZ1 LYS 82 3HZ LYS 82 1.376 11.335 11.128 637 HZ2 LYS 82 1HZ LYS 82 1.363 10.794 12.731 638 HZ3 LYS 82 2HZ LYS 82 0.250 11.962 12.224 639 H ALA 83 H ALA 83 -0.613 4.373 8.005 640 HA ALA 83 HA ALA 83 1.999 4.113 6.665 641 HB1 ALA 83 3HB ALA 83 2.540 2.978 8.505 642 HB2 ALA 83 1HB ALA 83 1.489 1.693 7.908 643 HB3 ALA 83 2HB ALA 83 0.863 2.893 9.037 644 H ILE 84 H ILE 84 2.184 2.932 4.836 645 HA ILE 84 HA ILE 84 -0.256 1.828 3.669 646 HB ILE 84 HB ILE 84 2.460 1.940 2.368 647 HG12 ILE 84 1HG1 ILE 84 0.295 4.055 2.339 648 HG13 ILE 84 2HG1 ILE 84 1.863 4.201 3.126 649 HG21 ILE 84 1HG2 ILE 84 1.036 2.042 0.301 650 HG22 ILE 84 2HG2 ILE 84 -0.353 1.697 1.331 651 HG23 ILE 84 3HG2 ILE 84 0.958 0.526 1.197 652 HD11 ILE 84 3HD1 ILE 84 1.243 5.050 0.600 653 HD12 ILE 84 1HD1 ILE 84 2.064 3.515 0.307 654 HD13 ILE 84 2HD1 ILE 84 2.869 4.784 1.231 655 H CYS 85 H CYS 85 -0.414 -0.356 2.930 656 HA CYS 85 HA CYS 85 1.718 -2.162 3.776 657 HG CYS 85 HG CYS 85 0.740 -4.542 5.672 658 HB2 CYS 85 1HB CYS 85 0.310 -2.104 5.709 659 HB3 CYS 85 2HB CYS 85 -1.138 -2.316 4.728 660 H LEU 86 H LEU 86 1.581 -4.306 2.962 661 HA LEU 86 HA LEU 86 0.055 -4.520 0.441 662 HG LEU 86 HG LEU 86 1.371 -4.293 -1.247 663 HB2 LEU 86 1HB LEU 86 2.830 -4.874 1.013 664 HB3 LEU 86 2HB LEU 86 2.176 -6.441 0.580 665 HD11 LEU 86 1HD1 LEU 86 3.391 -3.700 -2.134 666 HD12 LEU 86 2HD1 LEU 86 4.199 -5.158 -1.553 667 HD13 LEU 86 3HD1 LEU 86 3.838 -3.842 -0.434 668 HD21 LEU 86 3HD2 LEU 86 2.415 -7.096 -1.409 669 HD22 LEU 86 1HD2 LEU 86 2.362 -6.071 -2.844 670 HD23 LEU 86 2HD2 LEU 86 0.876 -6.441 -1.969 671 H PHE 87 H PHE 87 -0.735 -6.688 -0.118 672 HA PHE 87 HA PHE 87 -0.931 -8.534 2.156 673 HD1 PHE 87 HD1 PHE 87 -2.587 -7.213 4.010 674 HD2 PHE 87 HD2 PHE 87 -3.818 -5.750 0.210 675 HE1 PHE 87 HE1 PHE 87 -3.098 -5.031 5.022 676 HE2 PHE 87 HE2 PHE 87 -4.333 -3.573 1.213 677 HZ PHE 87 HZ PHE 87 -3.972 -3.203 3.622 678 HB2 PHE 87 1HB PHE 87 -3.355 -8.004 0.468 679 HB3 PHE 87 2HB PHE 87 -3.258 -8.728 2.070 680 H PHE 88 H PHE 88 -0.635 -10.611 1.621 681 HA PHE 88 HA PHE 88 -1.461 -11.722 -0.854 682 HD1 PHE 88 HD1 PHE 88 0.241 -13.371 -2.938 683 HD2 PHE 88 HD2 PHE 88 0.266 -9.137 -2.523 684 HE1 PHE 88 HE1 PHE 88 -0.336 -13.139 -5.319 685 HE2 PHE 88 HE2 PHE 88 -0.312 -8.896 -4.903 686 HZ PHE 88 HZ PHE 88 -0.614 -10.899 -6.302 687 HB2 PHE 88 1HB PHE 88 1.143 -10.512 -0.803 688 HB3 PHE 88 2HB PHE 88 1.313 -12.252 -1.016 689 H GLY 89 H GLY 89 -2.084 -12.519 1.640 690 HA2 GLY 89 1HA GLY 89 -1.660 -15.206 1.704 691 HA3 GLY 89 2HA GLY 89 -0.283 -14.565 2.584 692 H LYS 90 H LYS 90 -0.702 -13.323 4.522 693 HA LYS 90 HA LYS 90 -3.359 -13.696 5.690 694 HB2 LYS 90 1HB LYS 90 -2.576 -14.740 7.638 695 HB3 LYS 90 2HB LYS 90 -1.758 -15.576 6.332 696 HG2 LYS 90 1HG LYS 90 0.132 -15.213 7.440 697 HG3 LYS 90 2HG LYS 90 -0.030 -13.513 7.006 698 HD2 LYS 90 1HD LYS 90 -0.257 -12.998 9.155 699 HD3 LYS 90 2HD LYS 90 -1.715 -13.988 9.228 700 HE2 LYS 90 1HE LYS 90 -0.667 -15.413 10.565 701 HE3 LYS 90 2HE LYS 90 0.495 -15.749 9.283 702 HZ1 LYS 90 3HZ LYS 90 1.044 -14.599 11.695 703 HZ2 LYS 90 1HZ LYS 90 1.046 -13.286 10.629 704 HZ3 LYS 90 2HZ LYS 90 2.061 -14.607 10.345 705 H THR 91 H THR 91 -2.881 -12.836 8.213 706 HA THR 91 HA THR 91 -1.443 -10.334 8.202 707 HB THR 91 HB THR 91 -4.063 -9.647 9.099 708 HG1 THR 91 HG1 THR 91 -4.835 -11.287 7.740 709 HG21 THR 91 3HG2 THR 91 -3.725 -8.397 6.668 710 HG22 THR 91 1HG2 THR 91 -2.079 -8.648 7.248 711 HG23 THR 91 2HG2 THR 91 -3.243 -7.773 8.243 712 HA PRO 92 HA PRO 92 -1.196 -10.517 12.628 713 HB2 PRO 92 1HB PRO 92 -3.614 -8.786 12.976 714 HB3 PRO 92 2HB PRO 92 -2.050 -8.706 13.797 715 HG2 PRO 92 1HG PRO 92 -2.606 -7.010 11.837 716 HG3 PRO 92 2HG PRO 92 -0.992 -7.736 11.964 717 HD2 PRO 92 1HD PRO 92 -3.202 -8.341 10.064 718 HD3 PRO 92 2HD PRO 92 -1.446 -8.408 9.810 719 H ILE 93 H ILE 93 -4.335 -11.105 11.194 720 HA ILE 93 HA ILE 93 -4.730 -13.286 13.079 721 HB ILE 93 HB ILE 93 -7.122 -12.667 13.429 722 HG12 ILE 93 1HG1 ILE 93 -7.195 -11.051 11.488 723 HG13 ILE 93 2HG1 ILE 93 -7.904 -10.453 12.982 724 HG21 ILE 93 1HG2 ILE 93 -5.573 -12.334 15.210 725 HG22 ILE 93 2HG2 ILE 93 -6.624 -10.919 15.140 726 HG23 ILE 93 3HG2 ILE 93 -4.985 -10.834 14.493 727 HD11 ILE 93 3HD1 ILE 93 -5.438 -9.485 13.280 728 HD12 ILE 93 1HD1 ILE 93 -6.711 -8.624 12.415 729 HD13 ILE 93 2HD1 ILE 93 -5.506 -9.548 11.519 730 H SER 94 H SER 94 -4.062 -14.143 10.809 731 HA SER 94 HA SER 94 -5.701 -14.145 8.589 732 HG SER 94 HG SER 94 -2.602 -16.365 9.501 733 HB2 SER 94 1HB SER 94 -4.705 -16.822 9.070 734 HB3 SER 94 2HB SER 94 -4.210 -15.647 7.852 735 H ASP 95 H ASP 95 -5.638 -16.908 10.828 736 HA ASP 95 HA ASP 95 -7.245 -18.304 11.600 737 HB2 ASP 95 1HB ASP 95 -8.602 -15.687 11.451 738 HB3 ASP 95 2HB ASP 95 -9.671 -17.085 11.509 739 H ASP 96 H ASP 96 -9.608 -16.716 9.542 740 HA ASP 96 HA ASP 96 -9.583 -19.090 7.796 741 HB2 ASP 96 1HB ASP 96 -12.024 -18.747 7.510 742 HB3 ASP 96 2HB ASP 96 -11.577 -19.100 9.177 743 H LYS 97 H LYS 97 -9.823 -15.617 8.017 744 HA LYS 97 HA LYS 97 -9.566 -15.464 5.090 745 HB2 LYS 97 1HB LYS 97 -11.050 -13.459 6.797 746 HB3 LYS 97 2HB LYS 97 -10.943 -13.486 5.043 747 HG2 LYS 97 1HG LYS 97 -12.128 -15.715 5.130 748 HG3 LYS 97 2HG LYS 97 -12.438 -15.378 6.833 749 HD2 LYS 97 1HD LYS 97 -13.117 -13.206 4.963 750 HD3 LYS 97 2HD LYS 97 -14.097 -14.667 4.820 751 HE2 LYS 97 1HE LYS 97 -13.604 -13.640 7.552 752 HE3 LYS 97 2HE LYS 97 -14.671 -12.686 6.523 753 HZ1 LYS 97 3HZ LYS 97 -15.700 -15.064 6.099 754 HZ2 LYS 97 1HZ LYS 97 -16.179 -14.104 7.408 755 HZ3 LYS 97 2HZ LYS 97 -15.064 -15.354 7.640 756 H ILE 98 H ILE 98 -9.183 -12.701 4.928 757 HA ILE 98 HA ILE 98 -6.641 -12.381 6.389 758 HB ILE 98 HB ILE 98 -7.406 -11.485 3.612 759 HG12 ILE 98 1HG1 ILE 98 -5.036 -13.111 4.553 760 HG13 ILE 98 2HG1 ILE 98 -6.544 -13.822 3.976 761 HG21 ILE 98 1HG2 ILE 98 -5.219 -10.386 3.470 762 HG22 ILE 98 2HG2 ILE 98 -4.950 -10.715 5.179 763 HG23 ILE 98 3HG2 ILE 98 -6.253 -9.636 4.685 764 HD11 ILE 98 3HD1 ILE 98 -5.797 -13.689 1.904 765 HD12 ILE 98 1HD1 ILE 98 -4.305 -12.946 2.482 766 HD13 ILE 98 2HD1 ILE 98 -5.684 -11.933 2.050 767 H ARG 99 H ARG 99 -7.044 -11.040 8.042 768 HA ARG 99 HA ARG 99 -8.745 -8.693 7.573 769 HE ARG 99 HE ARG 99 -11.827 -7.135 11.431 770 HB2 ARG 99 1HB ARG 99 -9.118 -10.250 9.560 771 HB3 ARG 99 2HB ARG 99 -7.621 -9.606 10.220 772 HG2 ARG 99 1HG ARG 99 -8.815 -7.990 11.146 773 HG3 ARG 99 2HG ARG 99 -9.118 -7.363 9.525 774 HD2 ARG 99 1HD ARG 99 -11.237 -8.152 9.470 775 HD3 ARG 99 2HD ARG 99 -10.829 -9.606 10.380 776 HH11 ARG 99 1HH1 ARG 99 -9.904 -9.954 12.167 777 HH12 ARG 99 2HH1 ARG 99 -10.173 -9.846 13.874 778 HH21 ARG 99 1HH2 ARG 99 -12.182 -6.992 13.675 779 HH22 ARG 99 2HH2 ARG 99 -11.466 -8.164 14.731 780 HA PRO 100 HA PRO 100 -4.663 -6.712 7.164 781 HB2 PRO 100 1HB PRO 100 -5.592 -4.470 5.949 782 HB3 PRO 100 2HB PRO 100 -5.310 -5.986 5.083 783 HG2 PRO 100 1HG PRO 100 -7.880 -4.888 6.166 784 HG3 PRO 100 2HG PRO 100 -7.556 -5.615 4.577 785 HD2 PRO 100 1HD PRO 100 -8.709 -7.003 6.573 786 HD3 PRO 100 2HD PRO 100 -7.596 -7.768 5.421 787 H ALA 101 H ALA 101 -7.656 -5.364 8.455 788 HA ALA 101 HA ALA 101 -6.533 -4.432 10.839 789 HB1 ALA 101 3HB ALA 101 -5.571 -2.482 10.395 790 HB2 ALA 101 1HB ALA 101 -7.041 -1.890 9.622 791 HB3 ALA 101 2HB ALA 101 -5.837 -2.762 8.675 792 H SER 102 H SER 102 -8.049 -2.102 11.286 793 HA SER 102 HA SER 102 -10.764 -3.208 11.111 794 HG SER 102 HG SER 102 -8.606 -3.061 13.304 795 HB2 SER 102 1HB SER 102 -10.629 -1.091 13.019 796 HB3 SER 102 2HB SER 102 -10.918 -2.807 13.304 797 H ALA 103 H ALA 103 -8.849 -0.788 9.778 798 HA ALA 103 HA ALA 103 -11.075 0.417 8.484 799 HB1 ALA 103 3HB ALA 103 -9.708 2.054 10.611 800 HB2 ALA 103 1HB ALA 103 -11.389 1.520 10.604 801 HB3 ALA 103 2HB ALA 103 -10.831 2.690 9.407 802 H VAL 104 H VAL 104 -9.474 -0.414 6.852 803 HA VAL 104 HA VAL 104 -7.515 1.715 6.265 804 HB VAL 104 HB VAL 104 -6.009 0.129 5.229 805 HG11 VAL 104 1HG1 VAL 104 -6.786 -1.035 7.885 806 HG12 VAL 104 2HG1 VAL 104 -6.009 0.538 7.728 807 HG13 VAL 104 3HG1 VAL 104 -5.181 -0.914 7.169 808 HG21 VAL 104 3HG2 VAL 104 -8.042 -1.451 4.657 809 HG22 VAL 104 1HG2 VAL 104 -7.583 -2.214 6.177 810 HG23 VAL 104 2HG2 VAL 104 -6.416 -2.095 4.865 811 H ASN 105 H ASN 105 -7.332 2.484 4.217 812 HA ASN 105 HA ASN 105 -9.634 2.110 2.523 813 HB2 ASN 105 1HB ASN 105 -7.248 3.800 1.818 814 HB3 ASN 105 2HB ASN 105 -8.937 4.047 1.388 815 HD21 ASN 105 1HD2 ASN 105 -9.937 3.535 4.038 816 HD22 ASN 105 2HD2 ASN 105 -9.531 4.912 4.995 817 H VAL 106 H VAL 106 -9.596 1.587 0.310 818 HA VAL 106 HA VAL 106 -7.619 -0.415 -0.405 819 HB VAL 106 HB VAL 106 -9.338 0.114 -2.616 820 HG11 VAL 106 1HG1 VAL 106 -9.484 -2.118 -2.638 821 HG12 VAL 106 2HG1 VAL 106 -9.968 -2.207 -0.946 822 HG13 VAL 106 3HG1 VAL 106 -8.262 -2.041 -1.368 823 HG21 VAL 106 3HG2 VAL 106 -11.535 -0.484 -1.483 824 HG22 VAL 106 1HG2 VAL 106 -10.978 1.182 -1.321 825 HG23 VAL 106 2HG2 VAL 106 -10.779 0.050 0.018 826 H ILE 107 H ILE 107 -5.847 1.012 -0.522 827 HA ILE 107 HA ILE 107 -5.705 3.283 -2.150 828 HB ILE 107 HB ILE 107 -4.194 2.426 -0.208 829 HG12 ILE 107 1HG1 ILE 107 -4.028 4.459 -2.097 830 HG13 ILE 107 2HG1 ILE 107 -3.147 4.364 -0.579 831 HG21 ILE 107 1HG2 ILE 107 -2.589 1.442 -2.562 832 HG22 ILE 107 2HG2 ILE 107 -3.432 0.407 -1.410 833 HG23 ILE 107 3HG2 ILE 107 -2.107 1.434 -0.868 834 HD11 ILE 107 3HD1 ILE 107 -1.634 4.845 -2.373 835 HD12 ILE 107 1HD1 ILE 107 -2.194 3.435 -3.273 836 HD13 ILE 107 2HD1 ILE 107 -1.315 3.223 -1.758 837 H GLY 108 H GLY 108 -6.564 0.655 -3.546 838 HA2 GLY 108 1HA GLY 108 -6.399 0.635 -5.982 839 HA3 GLY 108 2HA GLY 108 -4.684 0.966 -5.796 840 H ARG 109 H ARG 109 -4.064 -0.828 -7.011 841 HA ARG 109 HA ARG 109 -3.976 -3.298 -5.518 842 HE ARG 109 HE ARG 109 -8.521 -5.732 -6.499 843 HB2 ARG 109 1HB ARG 109 -5.129 -3.408 -8.301 844 HB3 ARG 109 2HB ARG 109 -5.031 -4.705 -7.120 845 HG2 ARG 109 1HG ARG 109 -6.671 -3.541 -5.716 846 HG3 ARG 109 2HG ARG 109 -6.784 -2.263 -6.925 847 HD2 ARG 109 1HD ARG 109 -8.188 -3.452 -8.176 848 HD3 ARG 109 2HD ARG 109 -7.152 -4.876 -8.109 849 HH11 ARG 109 1HH1 ARG 109 -9.057 -2.288 -6.683 850 HH12 ARG 109 2HH1 ARG 109 -10.385 -2.309 -5.573 851 HH21 ARG 109 1HH2 ARG 109 -10.269 -5.761 -5.039 852 HH22 ARG 109 2HH2 ARG 109 -11.073 -4.281 -4.639 853 H ILE 110 H ILE 110 -2.617 -4.946 -6.608 854 HA ILE 110 HA ILE 110 -0.350 -3.647 -7.906 855 HB ILE 110 HB ILE 110 -0.646 -6.505 -6.949 856 HG12 ILE 110 1HG1 ILE 110 1.198 -5.123 -5.341 857 HG13 ILE 110 2HG1 ILE 110 -0.166 -4.027 -5.514 858 HG21 ILE 110 1HG2 ILE 110 1.811 -4.956 -7.762 859 HG22 ILE 110 2HG2 ILE 110 1.058 -6.270 -8.667 860 HG23 ILE 110 3HG2 ILE 110 1.795 -6.588 -7.097 861 HD11 ILE 110 3HD1 ILE 110 -0.280 -6.860 -4.496 862 HD12 ILE 110 1HD1 ILE 110 -1.667 -5.787 -4.695 863 HD13 ILE 110 2HD1 ILE 110 -0.402 -5.390 -3.533 864 H VAL 111 H VAL 111 -0.277 -3.579 -10.080 865 HA VAL 111 HA VAL 111 -1.878 -5.454 -11.624 866 HB VAL 111 HB VAL 111 -0.683 -4.003 -13.558 867 HG11 VAL 111 1HG1 VAL 111 -2.817 -2.383 -12.689 868 HG12 VAL 111 2HG1 VAL 111 -3.213 -4.039 -12.226 869 HG13 VAL 111 3HG1 VAL 111 -2.841 -3.659 -13.906 870 HG21 VAL 111 3HG2 VAL 111 -1.043 -1.939 -11.418 871 HG22 VAL 111 1HG2 VAL 111 -0.224 -1.801 -12.973 872 HG23 VAL 111 2HG2 VAL 111 0.515 -2.724 -11.665 873 H ASN 112 H ASN 112 1.270 -4.219 -12.680 874 HA ASN 112 HA ASN 112 2.161 -7.017 -12.943 875 HB2 ASN 112 1HB ASN 112 3.485 -6.162 -14.943 876 HB3 ASN 112 2HB ASN 112 1.741 -6.267 -15.148 877 HD21 ASN 112 1HD2 ASN 112 4.425 -4.330 -15.484 878 HD22 ASN 112 2HD2 ASN 112 3.635 -2.808 -15.691 879 H SER 113 H SER 113 4.178 -7.537 -12.307 880 HA SER 113 HA SER 113 6.437 -6.030 -12.104 881 HG SER 113 HG SER 113 4.243 -5.793 -8.837 882 HB2 SER 113 1HB SER 113 6.249 -5.742 -9.427 883 HB3 SER 113 2HB SER 113 5.836 -4.458 -10.562 884 H MET 114 H MET 114 4.882 -7.785 -9.435 885 HA MET 114 HA MET 114 6.215 -10.245 -10.019 886 HB2 MET 114 1HB MET 114 7.454 -8.321 -8.175 887 HB3 MET 114 2HB MET 114 7.259 -9.932 -7.503 888 HG2 MET 114 1HG MET 114 8.364 -9.838 -10.221 889 HG3 MET 114 2HG MET 114 9.378 -9.129 -8.965 890 HE1 MET 114 3HE MET 114 7.213 -12.475 -9.693 891 HE2 MET 114 1HE MET 114 6.819 -11.793 -8.114 892 HE3 MET 114 2HE MET 114 7.684 -13.327 -8.222 893 H GLU 115 H GLU 115 4.657 -8.265 -7.528 894 HA GLU 115 HA GLU 115 2.976 -8.700 -6.061 895 HB2 GLU 115 1HB GLU 115 2.455 -10.614 -8.286 896 HB3 GLU 115 2HB GLU 115 1.551 -10.824 -6.794 897 HG2 GLU 115 1HG GLU 115 0.612 -8.641 -6.966 898 HG3 GLU 115 2HG GLU 115 1.672 -8.236 -8.315 899 H GLY 116 H GLY 116 5.533 -9.735 -5.440 900 HA2 GLY 116 1HA GLY 116 4.711 -11.978 -3.725 901 HA3 GLY 116 2HA GLY 116 6.150 -12.149 -4.716 902 H LEU 117 H LEU 117 5.366 -9.058 -3.313 903 HA LEU 117 HA LEU 117 7.843 -8.714 -2.114 904 HG LEU 117 HG LEU 117 7.211 -7.306 0.308 905 HB2 LEU 117 1HB LEU 117 6.433 -6.816 -2.513 906 HB3 LEU 117 2HB LEU 117 5.189 -7.448 -1.449 907 HD11 LEU 117 1HD1 LEU 117 7.709 -4.964 -1.514 908 HD12 LEU 117 2HD1 LEU 117 8.753 -6.381 -1.395 909 HD13 LEU 117 3HD1 LEU 117 8.527 -5.332 0.004 910 HD21 LEU 117 3HD2 LEU 117 4.858 -6.247 0.251 911 HD22 LEU 117 1HD2 LEU 117 5.706 -4.800 -0.295 912 HD23 LEU 117 2HD2 LEU 117 6.105 -5.521 1.262 913 H LYS 118 H LYS 118 4.880 -10.081 -0.778 914 HA LYS 118 HA LYS 118 5.312 -10.143 1.886 915 HB2 LYS 118 1HB LYS 118 4.374 -12.638 1.664 916 HB3 LYS 118 2HB LYS 118 3.371 -11.214 1.449 917 HG2 LYS 118 1HG LYS 118 3.059 -11.602 -0.741 918 HG3 LYS 118 2HG LYS 118 4.697 -12.193 -0.988 919 HD2 LYS 118 1HD LYS 118 2.701 -13.814 0.546 920 HD3 LYS 118 2HD LYS 118 2.731 -13.852 -1.218 921 HE2 LYS 118 1HE LYS 118 4.586 -15.107 -1.268 922 HE3 LYS 118 2HE LYS 118 5.367 -14.165 0.000 923 HZ1 LYS 118 3HZ LYS 118 4.446 -15.464 1.652 924 HZ2 LYS 118 1HZ LYS 118 4.775 -16.609 0.451 925 HZ3 LYS 118 2HZ LYS 118 3.196 -16.043 0.669 926 H GLY 119 H GLY 119 7.357 -11.743 -0.419 927 HA2 GLY 119 1HA GLY 119 8.509 -13.498 1.605 928 HA3 GLY 119 2HA GLY 119 8.938 -13.453 -0.098 929 H VAL 120 H VAL 120 8.757 -10.581 1.883 930 HA VAL 120 HA VAL 120 11.467 -9.882 1.250 931 HB VAL 120 HB VAL 120 10.971 -7.917 2.831 932 HG11 VAL 120 1HG1 VAL 120 9.011 -7.349 0.924 933 HG12 VAL 120 2HG1 VAL 120 10.118 -8.478 0.145 934 HG13 VAL 120 3HG1 VAL 120 10.729 -6.978 0.840 935 HG21 VAL 120 3HG2 VAL 120 8.123 -8.114 2.508 936 HG22 VAL 120 1HG2 VAL 120 9.069 -7.841 3.970 937 HG23 VAL 120 2HG2 VAL 120 8.728 -9.485 3.435 938 H ALA 121 H ALA 121 13.145 -9.401 2.808 939 HA ALA 121 HA ALA 121 13.250 -11.340 4.949 940 HB1 ALA 121 3HB ALA 121 15.188 -10.715 3.413 941 HB2 ALA 121 1HB ALA 121 15.540 -10.808 5.138 942 HB3 ALA 121 2HB ALA 121 15.324 -9.237 4.366 943 H ASP 122 H ASP 122 13.446 -10.860 7.178 944 HA ASP 122 HA ASP 122 11.827 -8.855 8.162 945 HB2 ASP 122 1HB ASP 122 12.620 -9.381 10.349 946 HB3 ASP 122 2HB ASP 122 12.544 -10.877 9.422 947 H GLY 123 H GLY 123 12.031 -6.752 7.978 948 HA2 GLY 123 1HA GLY 123 12.899 -4.645 8.247 949 HA3 GLY 123 2HA GLY 123 14.250 -5.373 9.095 950 H GLU 124 H GLU 124 13.143 -3.984 6.170 951 HA GLU 124 HA GLU 124 15.855 -3.873 5.194 952 HB2 GLU 124 1HB GLU 124 15.112 -4.636 2.868 953 HB3 GLU 124 2HB GLU 124 15.386 -5.873 4.082 954 HG2 GLU 124 1HG GLU 124 13.066 -6.216 4.383 955 HG3 GLU 124 2HG GLU 124 12.662 -4.779 3.438 956 H SER 125 H SER 125 16.224 -2.225 3.695 957 HA SER 125 HA SER 125 14.839 0.120 4.021 958 HG SER 125 HG SER 125 15.857 1.830 1.950 959 HB2 SER 125 1HB SER 125 17.108 -0.553 2.729 960 HB3 SER 125 2HB SER 125 16.062 -0.238 1.346 961 H VAL 126 H VAL 126 13.748 1.442 2.371 962 HA VAL 126 HA VAL 126 12.152 0.142 0.357 963 HB VAL 126 HB VAL 126 10.702 1.434 2.682 964 HG11 VAL 126 1HG1 VAL 126 9.512 1.760 0.636 965 HG12 VAL 126 2HG1 VAL 126 8.698 0.491 1.550 966 HG13 VAL 126 3HG1 VAL 126 9.727 0.068 0.182 967 HG21 VAL 126 3HG2 VAL 126 11.054 -1.469 1.970 968 HG22 VAL 126 1HG2 VAL 126 9.807 -0.871 3.064 969 HG23 VAL 126 2HG2 VAL 126 11.508 -0.659 3.469 970 H VAL 127 H VAL 127 11.875 1.569 -1.286 971 HA VAL 127 HA VAL 127 11.975 4.435 -0.612 972 HB VAL 127 HB VAL 127 13.124 4.849 -2.773 973 HG11 VAL 127 1HG1 VAL 127 14.208 4.102 -0.377 974 HG12 VAL 127 2HG1 VAL 127 15.110 4.763 -1.741 975 HG13 VAL 127 3HG1 VAL 127 15.020 3.017 -1.506 976 HG21 VAL 127 3HG2 VAL 127 13.271 3.262 -4.310 977 HG22 VAL 127 1HG2 VAL 127 12.513 2.110 -3.208 978 HG23 VAL 127 2HG2 VAL 127 14.268 2.293 -3.223 979 H VAL 128 H VAL 128 9.980 5.160 -0.895 980 HA VAL 128 HA VAL 128 8.214 4.070 -2.903 981 HB VAL 128 HB VAL 128 7.384 6.573 -1.593 982 HG11 VAL 128 1HG1 VAL 128 6.221 3.903 -2.216 983 HG12 VAL 128 2HG1 VAL 128 5.615 5.518 -2.592 984 HG13 VAL 128 3HG1 VAL 128 5.472 4.881 -0.956 985 HG21 VAL 128 3HG2 VAL 128 8.401 4.297 0.011 986 HG22 VAL 128 1HG2 VAL 128 6.881 5.027 0.522 987 HG23 VAL 128 2HG2 VAL 128 8.334 6.017 0.395 988 H GLU 129 H GLU 129 7.894 4.904 -4.937 989 HA GLU 129 HA GLU 129 8.419 7.701 -5.469 990 HB2 GLU 129 1HB GLU 129 9.891 7.078 -7.442 991 HB3 GLU 129 2HB GLU 129 10.617 6.915 -5.850 992 HG2 GLU 129 1HG GLU 129 9.812 4.449 -6.037 993 HG3 GLU 129 2HG GLU 129 9.755 4.800 -7.765 994 H ARG 130 H ARG 130 6.965 8.471 -6.893 995 HA ARG 130 HA ARG 130 5.059 6.693 -8.088 996 HE ARG 130 HE ARG 130 3.966 7.576 -11.389 997 HB2 ARG 130 1HB ARG 130 4.423 8.904 -7.206 998 HB3 ARG 130 2HB ARG 130 5.423 9.676 -8.427 999 HG2 ARG 130 1HG ARG 130 3.317 7.807 -9.354 1000 HG3 ARG 130 2HG ARG 130 2.817 9.375 -8.717 1001 HD2 ARG 130 1HD ARG 130 3.283 10.280 -10.686 1002 HD3 ARG 130 2HD ARG 130 4.981 9.884 -10.431 1003 HH11 ARG 130 1HH1 ARG 130 3.804 10.878 -12.510 1004 HH12 ARG 130 2HH1 ARG 130 3.680 10.437 -14.179 1005 HH21 ARG 130 1HH2 ARG 130 3.803 6.995 -13.586 1006 HH22 ARG 130 2HH2 ARG 130 3.679 8.233 -14.790 1007 H ALA 131 H ALA 131 6.107 5.427 -9.584 1008 HA ALA 131 HA ALA 131 7.253 4.854 -11.494 1009 HB1 ALA 131 3HB ALA 131 5.514 7.078 -12.544 1010 HB2 ALA 131 1HB ALA 131 5.026 5.400 -12.308 1011 HB3 ALA 131 2HB ALA 131 6.256 5.798 -13.506 Start of MODEL 19 1 H MET 1 H MET 1 -4.351 9.738 -20.996 2 HA MET 1 HA MET 1 -3.028 11.288 -19.574 3 HB2 MET 1 1HB MET 1 -5.289 13.039 -20.530 4 HB3 MET 1 2HB MET 1 -4.441 13.358 -19.023 5 HG2 MET 1 1HG MET 1 -3.162 13.220 -21.744 6 HG3 MET 1 2HG MET 1 -3.589 14.699 -20.887 7 HE1 MET 1 3HE MET 1 -0.425 13.045 -21.863 8 HE2 MET 1 1HE MET 1 -1.407 11.701 -21.279 9 HE3 MET 1 2HE MET 1 0.085 12.132 -20.442 10 H GLY 2 H GLY 2 -6.359 10.382 -20.126 11 HA2 GLY 2 1HA GLY 2 -6.771 8.709 -18.074 12 HA3 GLY 2 2HA GLY 2 -6.968 10.268 -17.288 13 H GLU 3 H GLU 3 -9.023 8.422 -17.359 14 HA GLU 3 HA GLU 3 -10.858 9.430 -19.416 15 HB2 GLU 3 1HB GLU 3 -12.324 7.511 -18.537 16 HB3 GLU 3 2HB GLU 3 -10.894 7.088 -19.470 17 HG2 GLU 3 1HG GLU 3 -10.491 7.261 -16.565 18 HG3 GLU 3 2HG GLU 3 -11.563 5.972 -17.109 19 H ARG 4 H ARG 4 -10.401 9.147 -15.949 20 HA ARG 4 HA ARG 4 -12.379 11.240 -15.546 21 HE ARG 4 HE ARG 4 -15.700 10.263 -15.965 22 HB2 ARG 4 1HB ARG 4 -12.702 9.149 -13.519 23 HB3 ARG 4 2HB ARG 4 -13.913 10.091 -14.368 24 HG2 ARG 4 1HG ARG 4 -12.532 7.978 -15.917 25 HG3 ARG 4 2HG ARG 4 -13.647 7.454 -14.660 26 HD2 ARG 4 1HD ARG 4 -14.199 9.023 -17.151 27 HD3 ARG 4 2HD ARG 4 -14.992 7.571 -16.551 28 HH11 ARG 4 1HH1 ARG 4 -15.613 7.050 -14.606 29 HH12 ARG 4 2HH1 ARG 4 -16.913 7.346 -13.503 30 HH21 ARG 4 1HH2 ARG 4 -17.412 10.655 -14.513 31 HH22 ARG 4 2HH2 ARG 4 -17.935 9.392 -13.449 32 H GLY 5 H GLY 5 -10.773 8.949 -13.349 33 HA2 GLY 5 1HA GLY 5 -8.718 10.730 -12.562 34 HA3 GLY 5 2HA GLY 5 -10.059 10.842 -11.434 35 H VAL 6 H VAL 6 -9.362 7.829 -13.029 36 HA VAL 6 HA VAL 6 -8.087 6.826 -10.560 37 HB VAL 6 HB VAL 6 -9.335 4.712 -10.774 38 HG11 VAL 6 1HG1 VAL 6 -11.676 5.788 -10.290 39 HG12 VAL 6 2HG1 VAL 6 -10.760 7.293 -10.326 40 HG13 VAL 6 3HG1 VAL 6 -10.332 6.025 -9.176 41 HG21 VAL 6 3HG2 VAL 6 -9.870 5.433 -13.329 42 HG22 VAL 6 1HG2 VAL 6 -11.394 5.845 -12.543 43 HG23 VAL 6 2HG2 VAL 6 -10.763 4.202 -12.438 44 H GLU 7 H GLU 7 -6.194 7.292 -12.020 45 HA GLU 7 HA GLU 7 -5.373 4.813 -13.266 46 HB2 GLU 7 1HB GLU 7 -5.519 7.394 -14.836 47 HB3 GLU 7 2HB GLU 7 -4.609 5.983 -15.352 48 HG2 GLU 7 1HG GLU 7 -7.582 6.001 -14.866 49 HG3 GLU 7 2HG GLU 7 -6.820 6.222 -16.440 50 H MET 8 H MET 8 -4.663 6.586 -10.983 51 HA MET 8 HA MET 8 -1.946 7.358 -11.719 52 HB2 MET 8 1HB MET 8 -1.905 8.703 -9.737 53 HB3 MET 8 2HB MET 8 -3.382 9.053 -10.611 54 HG2 MET 8 1HG MET 8 -3.376 7.077 -8.363 55 HG3 MET 8 2HG MET 8 -3.442 8.805 -8.046 56 HE1 MET 8 3HE MET 8 -5.546 8.477 -6.731 57 HE2 MET 8 1HE MET 8 -7.109 8.716 -7.509 58 HE3 MET 8 2HE MET 8 -5.840 9.928 -7.688 59 H ARG 9 H ARG 9 -0.254 6.195 -11.134 60 HA ARG 9 HA ARG 9 -0.543 4.317 -8.885 61 HE ARG 9 HE ARG 9 3.284 0.979 -11.980 62 HB2 ARG 9 1HB ARG 9 0.281 2.506 -10.067 63 HB3 ARG 9 2HB ARG 9 -0.716 3.305 -11.273 64 HG2 ARG 9 1HG ARG 9 1.105 3.022 -12.560 65 HG3 ARG 9 2HG ARG 9 1.640 4.503 -11.763 66 HD2 ARG 9 1HD ARG 9 3.264 3.443 -10.621 67 HD3 ARG 9 2HD ARG 9 2.238 2.049 -10.274 68 HH11 ARG 9 1HH1 ARG 9 3.453 4.407 -12.610 69 HH12 ARG 9 2HH1 ARG 9 4.380 4.220 -14.061 70 HH21 ARG 9 1HH2 ARG 9 4.503 0.732 -13.887 71 HH22 ARG 9 2HH2 ARG 9 4.976 2.135 -14.786 72 H LEU 10 H LEU 10 1.257 3.891 -7.670 73 HA LEU 10 HA LEU 10 3.585 5.618 -8.203 74 HG LEU 10 HG LEU 10 1.173 4.504 -5.647 75 HB2 LEU 10 1HB LEU 10 3.699 4.757 -5.507 76 HB3 LEU 10 2HB LEU 10 3.484 6.383 -6.118 77 HD11 LEU 10 1HD1 LEU 10 2.454 6.510 -3.790 78 HD12 LEU 10 2HD1 LEU 10 2.207 4.786 -3.507 79 HD13 LEU 10 3HD1 LEU 10 0.822 5.878 -3.566 80 HD21 LEU 10 3HD2 LEU 10 1.389 6.960 -6.964 81 HD22 LEU 10 1HD2 LEU 10 0.676 7.330 -5.395 82 HD23 LEU 10 2HD2 LEU 10 -0.089 6.146 -6.453 83 H ARG 11 H ARG 11 5.671 4.740 -7.385 84 HA ARG 11 HA ARG 11 5.769 1.861 -7.941 85 HE ARG 11 HE ARG 11 10.313 1.075 -8.370 86 HB2 ARG 11 1HB ARG 11 7.260 4.028 -8.929 87 HB3 ARG 11 2HB ARG 11 8.361 3.135 -7.892 88 HG2 ARG 11 1HG ARG 11 6.716 1.787 -10.007 89 HG3 ARG 11 2HG ARG 11 8.293 2.500 -10.348 90 HD2 ARG 11 1HD ARG 11 8.089 0.662 -8.029 91 HD3 ARG 11 2HD ARG 11 7.996 -0.050 -9.640 92 HH11 ARG 11 1HH1 ARG 11 8.819 0.333 -11.436 93 HH12 ARG 11 2HH1 ARG 11 10.321 0.261 -12.292 94 HH21 ARG 11 1HH2 ARG 11 12.291 0.982 -9.495 95 HH22 ARG 11 2HH2 ARG 11 12.293 0.628 -11.191 96 H ILE 12 H ILE 12 6.818 0.433 -6.562 97 HA ILE 12 HA ILE 12 8.008 1.514 -4.123 98 HB ILE 12 HB ILE 12 5.461 0.082 -4.216 99 HG12 ILE 12 1HG1 ILE 12 6.708 1.141 -1.724 100 HG13 ILE 12 2HG1 ILE 12 6.329 2.276 -3.016 101 HG21 ILE 12 1HG2 ILE 12 7.671 -1.087 -2.552 102 HG22 ILE 12 2HG2 ILE 12 6.540 -1.914 -3.623 103 HG23 ILE 12 3HG2 ILE 12 5.973 -1.234 -2.100 104 HD11 ILE 12 3HD1 ILE 12 4.536 2.133 -1.373 105 HD12 ILE 12 1HD1 ILE 12 4.372 0.408 -1.699 106 HD13 ILE 12 2HD1 ILE 12 4.002 1.582 -2.961 107 H ARG 13 H ARG 13 10.021 0.842 -4.435 108 HA ARG 13 HA ARG 13 10.475 -1.906 -5.355 109 HE ARG 13 HE ARG 13 14.631 2.962 -5.967 110 HB2 ARG 13 1HB ARG 13 12.820 -1.174 -5.730 111 HB3 ARG 13 2HB ARG 13 11.644 -0.264 -6.668 112 HG2 ARG 13 1HG ARG 13 11.865 1.265 -4.421 113 HG3 ARG 13 2HG ARG 13 13.499 0.623 -4.587 114 HD2 ARG 13 1HD ARG 13 12.491 1.464 -7.145 115 HD3 ARG 13 2HD ARG 13 12.352 2.774 -5.973 116 HH11 ARG 13 1HH1 ARG 13 13.759 -0.087 -7.422 117 HH12 ARG 13 2HH1 ARG 13 15.373 -0.449 -7.930 118 HH21 ARG 13 1HH2 ARG 13 16.757 2.488 -6.635 119 HH22 ARG 13 2HH2 ARG 13 17.076 1.013 -7.483 120 H PHE 14 H PHE 14 12.091 -3.205 -4.370 121 HA PHE 14 HA PHE 14 12.785 -2.558 -1.604 122 HD1 PHE 14 HD2 PHE 14 9.873 -2.402 -1.798 123 HD2 PHE 14 HD1 PHE 14 11.595 -5.312 0.791 124 HE1 PHE 14 HE2 PHE 14 8.459 -1.594 0.046 125 HE2 PHE 14 HE1 PHE 14 10.182 -4.507 2.637 126 HZ PHE 14 HZ PHE 14 8.613 -2.647 2.266 127 HB2 PHE 14 1HB PHE 14 11.041 -4.760 -2.540 128 HB3 PHE 14 2HB PHE 14 12.287 -5.226 -1.390 129 H GLU 15 H GLU 15 14.780 -3.273 -1.018 130 HA GLU 15 HA GLU 15 16.772 -3.679 -2.807 131 HB2 GLU 15 1HB GLU 15 16.466 -4.277 0.066 132 HB3 GLU 15 2HB GLU 15 17.723 -5.194 -0.748 133 HG2 GLU 15 1HG GLU 15 18.298 -2.939 0.371 134 HG3 GLU 15 2HG GLU 15 18.986 -3.341 -1.199 135 H SER 16 H SER 16 14.548 -6.125 -1.684 136 HA SER 16 HA SER 16 15.923 -8.068 -3.424 137 HG SER 16 HG SER 16 16.714 -10.018 -0.883 138 HB2 SER 16 1HB SER 16 14.932 -8.353 -0.633 139 HB3 SER 16 2HB SER 16 14.728 -9.735 -1.711 140 H ALA 17 H ALA 17 13.524 -6.204 -3.817 141 HA ALA 17 HA ALA 17 11.997 -7.996 -5.384 142 HB1 ALA 17 3HB ALA 17 10.209 -7.116 -3.202 143 HB2 ALA 17 1HB ALA 17 11.338 -8.416 -2.822 144 HB3 ALA 17 2HB ALA 17 10.199 -8.599 -4.156 145 H GLU 18 H GLU 18 10.288 -7.024 -6.554 146 HA GLU 18 HA GLU 18 9.993 -4.113 -6.231 147 HB2 GLU 18 1HB GLU 18 10.224 -3.759 -8.622 148 HB3 GLU 18 2HB GLU 18 11.672 -4.526 -7.986 149 HG2 GLU 18 1HG GLU 18 11.462 -5.972 -9.654 150 HG3 GLU 18 2HG GLU 18 10.123 -6.665 -8.739 151 H CYS 19 H CYS 19 7.997 -3.244 -6.828 152 HA CYS 19 HA CYS 19 6.026 -4.829 -8.193 153 HG CYS 19 HG CYS 19 6.136 -4.696 -3.945 154 HB2 CYS 19 1HB CYS 19 4.618 -4.324 -5.807 155 HB3 CYS 19 2HB CYS 19 5.081 -5.891 -6.459 156 H GLU 20 H GLU 20 4.144 -3.653 -8.766 157 HA GLU 20 HA GLU 20 4.288 -0.774 -8.133 158 HB2 GLU 20 1HB GLU 20 2.951 -1.721 -10.627 159 HB3 GLU 20 2HB GLU 20 3.791 -0.208 -10.315 160 HG2 GLU 20 1HG GLU 20 5.925 -1.588 -10.262 161 HG3 GLU 20 2HG GLU 20 4.962 -2.891 -10.954 162 H VAL 21 H VAL 21 2.235 0.364 -8.082 163 HA VAL 21 HA VAL 21 -0.178 -1.227 -7.916 164 HB VAL 21 HB VAL 21 -0.107 -1.554 -5.715 165 HG11 VAL 21 1HG1 VAL 21 2.205 -1.363 -5.483 166 HG12 VAL 21 2HG1 VAL 21 1.551 -0.310 -4.229 167 HG13 VAL 21 3HG1 VAL 21 2.182 0.384 -5.723 168 HG21 VAL 21 3HG2 VAL 21 -1.652 0.362 -5.768 169 HG22 VAL 21 1HG2 VAL 21 -0.297 1.447 -5.453 170 HG23 VAL 21 2HG2 VAL 21 -0.771 0.254 -4.244 171 H GLU 22 H GLU 22 -1.963 -0.115 -8.422 172 HA GLU 22 HA GLU 22 -1.644 2.685 -9.159 173 HB2 GLU 22 1HB GLU 22 -4.005 0.849 -9.608 174 HB3 GLU 22 2HB GLU 22 -3.749 2.425 -10.346 175 HG2 GLU 22 1HG GLU 22 -2.606 1.519 -12.002 176 HG3 GLU 22 2HG GLU 22 -1.490 0.755 -10.871 177 H LEU 23 H LEU 23 -3.968 3.892 -8.847 178 HA LEU 23 HA LEU 23 -5.034 3.359 -6.204 179 HG LEU 23 HG LEU 23 -5.577 6.621 -6.059 180 HB2 LEU 23 1HB LEU 23 -3.335 4.713 -5.417 181 HB3 LEU 23 2HB LEU 23 -3.302 5.697 -6.863 182 HD11 LEU 23 1HD1 LEU 23 -6.337 5.376 -4.307 183 HD12 LEU 23 2HD1 LEU 23 -5.411 6.576 -3.407 184 HD13 LEU 23 3HD1 LEU 23 -4.714 4.989 -3.730 185 HD21 LEU 23 3HD2 LEU 23 -2.949 7.184 -4.711 186 HD22 LEU 23 1HD2 LEU 23 -4.386 8.178 -4.474 187 HD23 LEU 23 2HD2 LEU 23 -3.676 8.023 -6.081 188 H TYR 24 H TYR 24 -7.040 4.284 -5.819 189 HA TYR 24 HA TYR 24 -8.249 5.661 -8.128 190 HD1 TYR 24 HD1 TYR 24 -7.862 4.156 -9.499 191 HD2 TYR 24 HD2 TYR 24 -9.981 1.450 -6.991 192 HE1 TYR 24 HE1 TYR 24 -7.113 2.280 -10.901 193 HE2 TYR 24 HE2 TYR 24 -9.237 -0.434 -8.385 194 HH TYR 24 HH TYR 24 -6.989 -0.700 -10.073 195 HB2 TYR 24 1HB TYR 24 -9.664 3.694 -6.304 196 HB3 TYR 24 2HB TYR 24 -10.337 4.491 -7.721 197 H GLU 25 H GLU 25 -9.732 7.296 -7.729 198 HA GLU 25 HA GLU 25 -9.258 8.899 -5.484 199 HB2 GLU 25 1HB GLU 25 -11.562 8.960 -7.431 200 HB3 GLU 25 2HB GLU 25 -11.256 10.205 -6.224 201 HG2 GLU 25 1HG GLU 25 -9.347 10.958 -7.302 202 HG3 GLU 25 2HG GLU 25 -9.139 9.460 -8.205 203 H GLU 26 H GLU 26 -11.153 6.111 -5.570 204 HA GLU 26 HA GLU 26 -13.402 6.590 -4.126 205 HB2 GLU 26 1HB GLU 26 -13.349 4.330 -3.397 206 HB3 GLU 26 2HB GLU 26 -12.569 4.363 -4.972 207 HG2 GLU 26 1HG GLU 26 -10.367 4.432 -3.766 208 HG3 GLU 26 2HG GLU 26 -11.260 4.129 -2.276 209 H TRP 27 H TRP 27 -10.118 6.770 -2.953 210 HA TRP 27 HA TRP 27 -10.886 6.859 -0.180 211 HD1 TRP 27 HD1 TRP 27 -6.114 7.844 -0.183 212 HE1 TRP 27 HE1 TRP 27 -5.779 8.926 2.124 213 HE3 TRP 27 HE3 TRP 27 -10.927 7.601 1.547 214 HZ2 TRP 27 HZ2 TRP 27 -7.339 9.593 4.376 215 HZ3 TRP 27 HZ3 TRP 27 -11.412 8.487 3.786 216 HH2 TRP 27 HH2 TRP 27 -9.658 9.461 5.173 217 HB2 TRP 27 1HB TRP 27 -8.715 5.959 -0.613 218 HB3 TRP 27 2HB TRP 27 -8.275 7.329 -1.627 219 H ALA 28 H ALA 28 -9.478 9.196 -2.494 220 HA ALA 28 HA ALA 28 -11.120 11.278 -2.324 221 HB1 ALA 28 3HB ALA 28 -11.276 11.564 -0.042 222 HB2 ALA 28 1HB ALA 28 -10.012 12.723 -0.451 223 HB3 ALA 28 2HB ALA 28 -9.582 11.157 0.235 224 HA PRO 29 HA PRO 29 -7.812 12.448 -5.137 225 HB2 PRO 29 1HB PRO 29 -8.976 15.052 -5.351 226 HB3 PRO 29 2HB PRO 29 -9.032 13.739 -6.525 227 HG2 PRO 29 1HG PRO 29 -11.065 14.624 -4.606 228 HG3 PRO 29 2HG PRO 29 -11.251 13.633 -6.058 229 HD2 PRO 29 1HD PRO 29 -11.481 12.668 -3.514 230 HD3 PRO 29 2HD PRO 29 -10.983 11.674 -4.896 231 H GLU 30 H GLU 30 -8.904 14.315 -2.358 232 HA GLU 30 HA GLU 30 -6.767 16.174 -2.321 233 HB2 GLU 30 1HB GLU 30 -8.716 15.228 -0.226 234 HB3 GLU 30 2HB GLU 30 -7.451 16.386 0.153 235 HG2 GLU 30 1HG GLU 30 -8.823 17.282 -2.182 236 HG3 GLU 30 2HG GLU 30 -10.008 16.865 -0.946 237 H THR 31 H THR 31 -7.261 13.063 -0.690 238 HA THR 31 HA THR 31 -4.838 13.169 0.808 239 HB THR 31 HB THR 31 -5.427 10.452 0.383 240 HG1 THR 31 HG1 THR 31 -7.383 10.542 -0.376 241 HG21 THR 31 3HG2 THR 31 -6.825 10.903 2.612 242 HG22 THR 31 1HG2 THR 31 -5.860 12.376 2.583 243 HG23 THR 31 2HG2 THR 31 -5.068 10.799 2.577 244 H VAL 32 H VAL 32 -5.686 11.640 -2.280 245 HA VAL 32 HA VAL 32 -3.401 10.291 -2.905 246 HB VAL 32 HB VAL 32 -4.894 12.039 -4.862 247 HG11 VAL 32 1HG1 VAL 32 -3.136 11.262 -6.092 248 HG12 VAL 32 2HG1 VAL 32 -4.252 9.913 -6.293 249 HG13 VAL 32 3HG1 VAL 32 -2.947 9.809 -5.112 250 HG21 VAL 32 3HG2 VAL 32 -6.644 10.827 -4.037 251 HG22 VAL 32 1HG2 VAL 32 -5.622 9.478 -3.544 252 HG23 VAL 32 2HG2 VAL 32 -6.043 9.690 -5.243 253 H ARG 33 H ARG 33 -3.927 13.760 -2.989 254 HA ARG 33 HA ARG 33 -1.680 14.565 -4.422 255 HE ARG 33 HE ARG 33 -0.987 19.660 -2.140 256 HB2 ARG 33 1HB ARG 33 -3.656 15.965 -3.529 257 HB3 ARG 33 2HB ARG 33 -2.713 16.103 -2.053 258 HG2 ARG 33 1HG ARG 33 -0.841 17.014 -3.492 259 HG3 ARG 33 2HG ARG 33 -2.029 17.126 -4.792 260 HD2 ARG 33 1HD ARG 33 -3.132 18.853 -3.819 261 HD3 ARG 33 2HD ARG 33 -2.801 18.285 -2.184 262 HH11 ARG 33 1HH1 ARG 33 -1.820 19.064 -5.477 263 HH12 ARG 33 2HH1 ARG 33 -0.635 20.164 -6.099 264 HH21 ARG 33 1HH2 ARG 33 0.573 21.104 -2.956 265 HH22 ARG 33 2HH2 ARG 33 0.723 21.321 -4.668 266 H ALA 34 H ALA 34 -1.998 13.705 -1.011 267 HA ALA 34 HA ALA 34 0.575 14.568 -0.207 268 HB1 ALA 34 3HB ALA 34 -1.560 12.888 0.943 269 HB2 ALA 34 1HB ALA 34 -0.662 14.231 1.651 270 HB3 ALA 34 2HB ALA 34 0.070 12.628 1.569 271 H ILE 35 H ILE 35 -0.640 11.383 -1.218 272 HA ILE 35 HA ILE 35 1.733 9.939 -0.881 273 HB ILE 35 HB ILE 35 0.305 9.166 -3.323 274 HG12 ILE 35 1HG1 ILE 35 -1.598 10.196 -2.160 275 HG13 ILE 35 2HG1 ILE 35 -1.762 8.444 -2.221 276 HG21 ILE 35 1HG2 ILE 35 0.987 7.828 -0.720 277 HG22 ILE 35 2HG2 ILE 35 1.795 7.649 -2.276 278 HG23 ILE 35 3HG2 ILE 35 0.166 7.014 -2.052 279 HD11 ILE 35 3HD1 ILE 35 -0.559 9.752 0.177 280 HD12 ILE 35 1HD1 ILE 35 -1.385 8.199 0.041 281 HD13 ILE 35 2HD1 ILE 35 -2.309 9.701 -0.035 282 H ALA 36 H ALA 36 0.504 11.689 -3.772 283 HA ALA 36 HA ALA 36 2.752 11.204 -5.409 284 HB1 ALA 36 3HB ALA 36 0.317 12.275 -5.840 285 HB2 ALA 36 1HB ALA 36 1.675 12.440 -6.954 286 HB3 ALA 36 2HB ALA 36 1.302 13.737 -5.818 287 H ASP 37 H ASP 37 2.093 13.534 -2.890 288 HA ASP 37 HA ASP 37 4.215 15.325 -3.568 289 HB2 ASP 37 1HB ASP 37 2.156 15.720 -2.025 290 HB3 ASP 37 2HB ASP 37 3.160 14.995 -0.773 291 H ALA 38 H ALA 38 4.025 12.326 -1.855 292 HA ALA 38 HA ALA 38 6.689 12.607 -0.724 293 HB1 ALA 38 3HB ALA 38 4.435 11.586 0.335 294 HB2 ALA 38 1HB ALA 38 6.059 11.106 0.839 295 HB3 ALA 38 2HB ALA 38 5.165 10.118 -0.318 296 H LEU 39 H LEU 39 6.933 12.527 -3.399 297 HA LEU 39 HA LEU 39 7.103 9.961 -4.566 298 HG LEU 39 HG LEU 39 6.412 13.135 -5.647 299 HB2 LEU 39 1HB LEU 39 8.627 12.465 -5.316 300 HB3 LEU 39 2HB LEU 39 8.430 11.043 -6.314 301 HD11 LEU 39 1HD1 LEU 39 7.779 12.065 -8.002 302 HD12 LEU 39 2HD1 LEU 39 7.077 13.660 -7.719 303 HD13 LEU 39 3HD1 LEU 39 6.046 12.316 -8.217 304 HD21 LEU 39 3HD2 LEU 39 5.831 10.274 -6.397 305 HD22 LEU 39 1HD2 LEU 39 4.696 11.589 -6.677 306 HD23 LEU 39 2HD2 LEU 39 5.190 11.185 -5.035 307 HA PRO 40 HA PRO 40 11.261 8.124 -4.022 308 HB2 PRO 40 1HB PRO 40 12.712 10.631 -4.805 309 HB3 PRO 40 2HB PRO 40 13.175 8.942 -5.054 310 HG2 PRO 40 1HG PRO 40 11.976 10.415 -6.984 311 HG3 PRO 40 2HG PRO 40 11.752 8.667 -6.831 312 HD2 PRO 40 1HD PRO 40 9.833 10.799 -6.407 313 HD3 PRO 40 2HD PRO 40 9.554 9.053 -6.472 314 H ILE 41 H ILE 41 11.038 7.953 -1.875 315 HA ILE 41 HA ILE 41 12.558 9.810 -0.224 316 HB ILE 41 HB ILE 41 9.634 9.186 0.215 317 HG12 ILE 41 1HG1 ILE 41 11.257 11.747 0.202 318 HG13 ILE 41 2HG1 ILE 41 10.105 11.229 -1.021 319 HG21 ILE 41 1HG2 ILE 41 10.744 8.657 2.305 320 HG22 ILE 41 2HG2 ILE 41 9.858 10.170 2.470 321 HG23 ILE 41 3HG2 ILE 41 11.609 10.191 2.268 322 HD11 ILE 41 3HD1 ILE 41 8.464 12.233 0.068 323 HD12 ILE 41 1HD1 ILE 41 9.639 12.821 1.242 324 HD13 ILE 41 2HD1 ILE 41 8.807 11.292 1.521 325 H LYS 42 H LYS 42 13.315 8.842 1.729 326 HA LYS 42 HA LYS 42 13.552 5.970 1.498 327 HB2 LYS 42 1HB LYS 42 15.011 8.122 2.857 328 HB3 LYS 42 2HB LYS 42 14.934 6.620 3.765 329 HG2 LYS 42 1HG LYS 42 16.428 5.637 2.448 330 HG3 LYS 42 2HG LYS 42 15.596 6.162 0.984 331 HD2 LYS 42 1HD LYS 42 17.532 7.324 0.714 332 HD3 LYS 42 2HD LYS 42 16.656 8.499 1.697 333 HE2 LYS 42 1HE LYS 42 17.755 7.706 3.695 334 HE3 LYS 42 2HE LYS 42 18.552 6.422 2.787 335 HZ1 LYS 42 3HZ LYS 42 20.076 7.833 1.958 336 HZ2 LYS 42 1HZ LYS 42 19.689 8.761 3.319 337 HZ3 LYS 42 2HZ LYS 42 18.994 9.127 1.822 338 H SER 43 H SER 43 12.709 4.459 2.786 339 HA SER 43 HA SER 43 11.407 5.176 5.287 340 HG SER 43 HG SER 43 9.267 2.572 3.851 341 HB2 SER 43 1HB SER 43 9.277 4.479 4.738 342 HB3 SER 43 2HB SER 43 9.776 5.196 3.210 343 H THR 44 H THR 44 11.180 3.406 6.730 344 HA THR 44 HA THR 44 12.824 1.080 5.964 345 HB THR 44 HB THR 44 12.006 1.396 8.790 346 HG1 THR 44 HG1 THR 44 12.415 3.546 8.311 347 HG21 THR 44 3HG2 THR 44 14.093 0.137 7.336 348 HG22 THR 44 1HG2 THR 44 13.736 0.056 9.062 349 HG23 THR 44 2HG2 THR 44 14.806 1.312 8.442 350 H ALA 45 H ALA 45 11.915 -0.799 5.624 351 HA ALA 45 HA ALA 45 9.077 -1.127 5.987 352 HB1 ALA 45 3HB ALA 45 9.400 -2.231 4.080 353 HB2 ALA 45 1HB ALA 45 10.059 -3.543 5.055 354 HB3 ALA 45 2HB ALA 45 11.136 -2.337 4.356 355 H ASN 46 H ASN 46 8.029 -2.272 7.417 356 HA ASN 46 HA ASN 46 9.561 -3.789 9.423 357 HB2 ASN 46 1HB ASN 46 6.753 -2.653 9.551 358 HB3 ASN 46 2HB ASN 46 7.535 -3.562 10.841 359 HD21 ASN 46 1HD2 ASN 46 6.902 -1.491 11.941 360 HD22 ASN 46 2HD2 ASN 46 8.074 -0.220 11.945 361 H ARG 47 H ARG 47 9.502 -6.004 9.164 362 HA ARG 47 HA ARG 47 7.603 -7.121 7.318 363 HE ARG 47 HE ARG 47 7.501 -9.700 6.954 364 HB2 ARG 47 1HB ARG 47 10.098 -7.955 8.595 365 HB3 ARG 47 2HB ARG 47 8.945 -9.264 8.365 366 HG2 ARG 47 1HG ARG 47 9.082 -7.652 5.996 367 HG3 ARG 47 2HG ARG 47 10.699 -8.166 6.475 368 HD2 ARG 47 1HD ARG 47 9.383 -9.697 4.916 369 HD3 ARG 47 2HD ARG 47 10.148 -10.434 6.321 370 HH11 ARG 47 1HH1 ARG 47 9.283 -12.039 5.073 371 HH12 ARG 47 2HH1 ARG 47 8.049 -13.250 5.178 372 HH21 ARG 47 1HH2 ARG 47 5.877 -11.291 7.093 373 HH22 ARG 47 2HH2 ARG 47 6.115 -12.825 6.323 374 H TRP 48 H TRP 48 5.890 -8.397 7.690 375 HA TRP 48 HA TRP 48 5.364 -9.469 10.337 376 HD1 TRP 48 HD1 TRP 48 1.552 -9.504 8.955 377 HE1 TRP 48 HE1 TRP 48 -0.050 -10.248 10.830 378 HE3 TRP 48 HE3 TRP 48 4.037 -7.535 12.967 379 HZ2 TRP 48 HZ2 TRP 48 -0.228 -10.027 13.643 380 HZ3 TRP 48 HZ3 TRP 48 3.084 -7.845 15.214 381 HH2 TRP 48 HH2 TRP 48 0.994 -9.065 15.543 382 HB2 TRP 48 1HB TRP 48 4.305 -7.291 10.534 383 HB3 TRP 48 2HB TRP 48 3.480 -7.507 8.993 384 H GLY 49 H GLY 49 3.873 -11.203 10.300 385 HA2 GLY 49 1HA GLY 49 3.941 -12.991 8.293 386 HA3 GLY 49 2HA GLY 49 2.549 -12.855 9.355 387 H ASP 50 H ASP 50 3.856 -12.154 6.224 388 HA ASP 50 HA ASP 50 2.807 -11.887 4.214 389 HB2 ASP 50 1HB ASP 50 0.914 -13.211 5.030 390 HB3 ASP 50 2HB ASP 50 0.232 -11.782 5.796 391 H GLU 51 H GLU 51 1.673 -9.785 6.841 392 HA GLU 51 HA GLU 51 1.236 -7.587 5.023 393 HB2 GLU 51 1HB GLU 51 0.521 -8.241 7.744 394 HB3 GLU 51 2HB GLU 51 1.185 -6.615 7.654 395 HG2 GLU 51 1HG GLU 51 -0.464 -6.406 5.621 396 HG3 GLU 51 2HG GLU 51 -1.291 -7.726 6.445 397 H ILE 52 H ILE 52 2.310 -5.592 5.096 398 HA ILE 52 HA ILE 52 4.804 -5.373 6.561 399 HB ILE 52 HB ILE 52 4.749 -6.129 3.770 400 HG12 ILE 52 1HG1 ILE 52 7.388 -5.897 4.489 401 HG13 ILE 52 2HG1 ILE 52 6.605 -6.047 6.054 402 HG21 ILE 52 1HG2 ILE 52 4.881 -3.837 3.166 403 HG22 ILE 52 2HG2 ILE 52 6.502 -4.512 3.005 404 HG23 ILE 52 3HG2 ILE 52 6.098 -3.517 4.404 405 HD11 ILE 52 3HD1 ILE 52 7.297 -8.208 5.331 406 HD12 ILE 52 1HD1 ILE 52 6.503 -8.009 3.771 407 HD13 ILE 52 2HD1 ILE 52 5.539 -8.149 5.245 408 H TYR 53 H TYR 53 4.723 -3.414 7.418 409 HA TYR 53 HA TYR 53 3.566 -1.232 5.808 410 HD1 TYR 53 HD1 TYR 53 4.437 0.073 9.617 411 HD2 TYR 53 HD2 TYR 53 2.292 -3.580 9.176 412 HE1 TYR 53 HE1 TYR 53 5.123 -0.600 11.877 413 HE2 TYR 53 HE2 TYR 53 2.975 -4.258 11.436 414 HH TYR 53 HH TYR 53 4.941 -3.685 13.016 415 HB2 TYR 53 1HB TYR 53 2.647 -0.233 7.863 416 HB3 TYR 53 2HB TYR 53 2.000 -1.849 7.581 417 H PHE 54 H PHE 54 4.542 0.699 5.785 418 HA PHE 54 HA PHE 54 6.835 1.167 7.537 419 HD1 PHE 54 HD1 PHE 54 6.774 3.691 4.556 420 HD2 PHE 54 HD2 PHE 54 6.975 -0.375 3.316 421 HE1 PHE 54 HE1 PHE 54 5.988 4.337 2.320 422 HE2 PHE 54 HE2 PHE 54 6.186 0.265 1.080 423 HZ PHE 54 HZ PHE 54 5.693 2.623 0.578 424 HB2 PHE 54 1HB PHE 54 8.274 1.817 5.704 425 HB3 PHE 54 2HB PHE 54 7.709 0.175 5.429 426 H THR 55 H THR 55 7.266 3.339 7.944 427 HA THR 55 HA THR 55 5.083 5.158 7.206 428 HB THR 55 HB THR 55 7.221 6.156 8.983 429 HG1 THR 55 HG1 THR 55 5.561 4.012 9.811 430 HG21 THR 55 3HG2 THR 55 4.563 6.762 8.522 431 HG22 THR 55 1HG2 THR 55 5.584 7.393 9.815 432 HG23 THR 55 2HG2 THR 55 4.567 5.981 10.103 433 H THR 56 H THR 56 5.447 7.143 6.146 434 HA THR 56 HA THR 56 8.107 7.372 4.887 435 HB THR 56 HB THR 56 6.252 8.726 3.272 436 HG1 THR 56 HG1 THR 56 4.677 7.211 2.897 437 HG21 THR 56 3HG2 THR 56 8.161 6.620 3.011 438 HG22 THR 56 1HG2 THR 56 7.514 7.702 1.776 439 HG23 THR 56 2HG2 THR 56 6.684 6.190 2.145 440 H GLN 57 H GLN 57 6.403 8.753 7.212 441 HA GLN 57 HA GLN 57 6.743 10.732 8.323 442 HB2 GLN 57 1HB GLN 57 8.044 12.028 5.945 443 HB3 GLN 57 2HB GLN 57 8.313 12.319 7.658 444 HG2 GLN 57 1HG GLN 57 9.104 9.713 7.388 445 HG3 GLN 57 2HG GLN 57 9.595 10.422 5.851 446 HE21 GLN 57 1HE2 GLN 57 11.052 12.183 5.866 447 HE22 GLN 57 2HE2 GLN 57 12.108 12.450 7.206 448 H VAL 58 H VAL 58 5.042 10.290 5.466 449 HA VAL 58 HA VAL 58 3.928 12.965 5.367 450 HB VAL 58 HB VAL 58 4.210 11.720 3.268 451 HG11 VAL 58 1HG1 VAL 58 3.752 9.463 4.232 452 HG12 VAL 58 2HG1 VAL 58 2.915 9.790 2.712 453 HG13 VAL 58 3HG1 VAL 58 2.037 9.875 4.240 454 HG21 VAL 58 3HG2 VAL 58 1.826 11.988 2.437 455 HG22 VAL 58 1HG2 VAL 58 2.569 13.404 3.182 456 HG23 VAL 58 2HG2 VAL 58 1.411 12.435 4.092 457 H ALA 59 H ALA 59 2.435 13.584 6.778 458 HA ALA 59 HA ALA 59 0.778 11.534 8.061 459 HB1 ALA 59 3HB ALA 59 0.934 14.417 8.903 460 HB2 ALA 59 1HB ALA 59 2.097 13.201 9.443 461 HB3 ALA 59 2HB ALA 59 0.386 13.026 9.837 462 H VAL 60 H VAL 60 -0.822 11.128 6.615 463 HA VAL 60 HA VAL 60 -2.708 13.343 6.155 464 HB VAL 60 HB VAL 60 -1.567 12.918 4.045 465 HG11 VAL 60 1HG1 VAL 60 -2.620 10.160 3.776 466 HG12 VAL 60 2HG1 VAL 60 -1.213 10.388 4.815 467 HG13 VAL 60 3HG1 VAL 60 -1.150 10.886 3.126 468 HG21 VAL 60 3HG2 VAL 60 -3.783 13.557 3.674 469 HG22 VAL 60 1HG2 VAL 60 -4.421 12.009 4.227 470 HG23 VAL 60 2HG2 VAL 60 -3.584 12.115 2.679 471 H GLU 61 H GLU 61 -4.381 12.848 7.483 472 HA GLU 61 HA GLU 61 -5.565 10.176 7.197 473 HB2 GLU 61 1HB GLU 61 -4.403 11.348 9.610 474 HB3 GLU 61 2HB GLU 61 -6.058 10.798 9.842 475 HG2 GLU 61 1HG GLU 61 -5.388 8.590 8.919 476 HG3 GLU 61 2HG GLU 61 -3.722 9.164 8.885 477 H LYS 62 H LYS 62 -7.710 10.180 6.946 478 HA LYS 62 HA LYS 62 -9.269 12.480 7.851 479 HB2 LYS 62 1HB LYS 62 -8.728 12.999 5.536 480 HB3 LYS 62 2HB LYS 62 -9.281 11.414 5.020 481 HG2 LYS 62 1HG LYS 62 -11.552 11.963 5.576 482 HG3 LYS 62 2HG LYS 62 -11.047 13.501 6.279 483 HD2 LYS 62 1HD LYS 62 -10.163 14.145 4.030 484 HD3 LYS 62 2HD LYS 62 -10.892 12.674 3.383 485 HE2 LYS 62 1HE LYS 62 -12.282 15.034 4.631 486 HE3 LYS 62 2HE LYS 62 -12.416 14.454 2.972 487 HZ1 LYS 62 3HZ LYS 62 -13.185 12.291 4.307 488 HZ2 LYS 62 1HZ LYS 62 -14.261 13.488 3.786 489 HZ3 LYS 62 2HZ LYS 62 -13.710 13.483 5.384 490 H GLU 63 H GLU 63 -11.679 12.008 7.673 491 HA GLU 63 HA GLU 63 -12.110 9.207 8.411 492 HB2 GLU 63 1HB GLU 63 -14.238 10.007 9.409 493 HB3 GLU 63 2HB GLU 63 -12.814 10.765 10.103 494 HG2 GLU 63 1HG GLU 63 -14.276 12.134 7.891 495 HG3 GLU 63 2HG GLU 63 -14.918 12.179 9.529 496 H GLU 64 H GLU 64 -12.260 8.273 6.375 497 HA GLU 64 HA GLU 64 -14.845 8.273 5.219 498 HB2 GLU 64 1HB GLU 64 -14.496 10.164 3.979 499 HB3 GLU 64 2HB GLU 64 -12.751 9.972 3.978 500 HG2 GLU 64 1HG GLU 64 -12.795 8.499 2.168 501 HG3 GLU 64 2HG GLU 64 -14.516 8.172 2.360 502 H ASN 65 H ASN 65 -15.040 6.695 3.465 503 HA ASN 65 HA ASN 65 -14.616 4.692 2.485 504 HB2 ASN 65 1HB ASN 65 -12.758 5.860 1.401 505 HB3 ASN 65 2HB ASN 65 -11.726 5.557 2.798 506 HD21 ASN 65 1HD2 ASN 65 -12.136 4.651 -0.224 507 HD22 ASN 65 2HD2 ASN 65 -11.686 2.986 -0.144 508 H SER 66 H SER 66 -11.693 4.714 4.439 509 HA SER 66 HA SER 66 -10.859 2.979 5.758 510 HG SER 66 HG SER 66 -10.358 4.048 7.743 511 HB2 SER 66 1HB SER 66 -13.103 4.399 7.112 512 HB3 SER 66 2HB SER 66 -12.384 3.012 7.931 513 H LYS 67 H LYS 67 -11.299 1.062 4.439 514 HA LYS 67 HA LYS 67 -13.706 -0.417 5.277 515 HB2 LYS 67 1HB LYS 67 -13.180 -1.975 3.376 516 HB3 LYS 67 2HB LYS 67 -13.619 -0.348 2.891 517 HG2 LYS 67 1HG LYS 67 -11.858 -0.855 1.503 518 HG3 LYS 67 2HG LYS 67 -11.068 0.059 2.784 519 HD2 LYS 67 1HD LYS 67 -10.478 -2.117 3.863 520 HD3 LYS 67 2HD LYS 67 -11.149 -2.938 2.460 521 HE2 LYS 67 1HE LYS 67 -9.493 -2.070 1.034 522 HE3 LYS 67 2HE LYS 67 -8.991 -0.869 2.221 523 HZ1 LYS 67 3HZ LYS 67 -7.801 -3.271 1.812 524 HZ2 LYS 67 1HZ LYS 67 -8.757 -3.568 3.175 525 HZ3 LYS 67 2HZ LYS 67 -7.624 -2.317 3.192 526 H ASP 68 H ASP 68 -13.515 -2.703 5.816 527 HA ASP 68 HA ASP 68 -10.882 -3.300 7.021 528 HB2 ASP 68 1HB ASP 68 -12.237 -4.683 8.672 529 HB3 ASP 68 2HB ASP 68 -12.378 -2.935 8.809 530 H VAL 69 H VAL 69 -13.015 -4.328 4.630 531 HA VAL 69 HA VAL 69 -11.810 -7.018 4.715 532 HB VAL 69 HB VAL 69 -14.291 -6.963 5.284 533 HG11 VAL 69 1HG1 VAL 69 -15.100 -6.990 2.499 534 HG12 VAL 69 2HG1 VAL 69 -14.471 -5.419 2.994 535 HG13 VAL 69 3HG1 VAL 69 -15.813 -6.148 3.874 536 HG21 VAL 69 3HG2 VAL 69 -12.804 -8.871 4.226 537 HG22 VAL 69 1HG2 VAL 69 -13.905 -8.648 2.866 538 HG23 VAL 69 2HG2 VAL 69 -14.541 -9.074 4.455 539 H VAL 70 H VAL 70 -11.093 -7.888 2.810 540 HA VAL 70 HA VAL 70 -11.660 -6.618 0.275 541 HB VAL 70 HB VAL 70 -9.330 -6.098 -0.286 542 HG11 VAL 70 1HG1 VAL 70 -10.936 -4.417 0.692 543 HG12 VAL 70 2HG1 VAL 70 -9.223 -4.013 0.795 544 HG13 VAL 70 3HG1 VAL 70 -10.073 -4.621 2.215 545 HG21 VAL 70 3HG2 VAL 70 -8.636 -6.426 2.623 546 HG22 VAL 70 1HG2 VAL 70 -7.554 -6.103 1.274 547 HG23 VAL 70 2HG2 VAL 70 -8.322 -7.682 1.426 548 H GLU 71 H GLU 71 -10.728 -7.750 -1.561 549 HA GLU 71 HA GLU 71 -10.385 -10.592 -0.963 550 HB2 GLU 71 1HB GLU 71 -10.596 -9.509 -3.759 551 HB3 GLU 71 2HB GLU 71 -11.080 -11.078 -3.135 552 HG2 GLU 71 1HG GLU 71 -13.014 -10.253 -2.171 553 HG3 GLU 71 2HG GLU 71 -12.450 -8.585 -2.233 554 H LEU 72 H LEU 72 -8.766 -11.851 -1.853 555 HA LEU 72 HA LEU 72 -6.178 -11.037 -1.572 556 HG LEU 72 HG LEU 72 -4.620 -12.427 -3.470 557 HB2 LEU 72 1HB LEU 72 -6.825 -13.378 -1.747 558 HB3 LEU 72 2HB LEU 72 -7.254 -13.168 -3.431 559 HD11 LEU 72 1HD1 LEU 72 -4.707 -14.819 -1.659 560 HD12 LEU 72 2HD1 LEU 72 -4.566 -13.181 -1.021 561 HD13 LEU 72 3HD1 LEU 72 -3.327 -13.815 -2.103 562 HD21 LEU 72 3HD2 LEU 72 -5.291 -15.317 -3.717 563 HD22 LEU 72 1HD2 LEU 72 -4.339 -14.281 -4.780 564 HD23 LEU 72 2HD2 LEU 72 -6.098 -14.164 -4.781 565 H GLY 73 H GLY 73 -4.793 -9.754 -2.670 566 HA2 GLY 73 1HA GLY 73 -3.705 -9.314 -4.831 567 HA3 GLY 73 2HA GLY 73 -5.302 -9.347 -5.555 568 H ASP 74 H ASP 74 -6.499 -7.671 -3.429 569 HA ASP 74 HA ASP 74 -5.837 -5.159 -4.619 570 HB2 ASP 74 1HB ASP 74 -7.482 -4.279 -2.829 571 HB3 ASP 74 2HB ASP 74 -8.096 -5.309 -4.116 572 H VAL 75 H VAL 75 -5.218 -3.235 -3.525 573 HA VAL 75 HA VAL 75 -3.375 -3.738 -1.260 574 HB VAL 75 HB VAL 75 -3.187 -1.453 -3.257 575 HG11 VAL 75 1HG1 VAL 75 -1.068 -0.985 -2.353 576 HG12 VAL 75 2HG1 VAL 75 -1.022 -2.495 -1.443 577 HG13 VAL 75 3HG1 VAL 75 -2.130 -1.206 -0.964 578 HG21 VAL 75 3HG2 VAL 75 -2.678 -4.139 -3.774 579 HG22 VAL 75 1HG2 VAL 75 -1.093 -3.431 -3.458 580 HG23 VAL 75 2HG2 VAL 75 -2.127 -2.750 -4.713 581 H ALA 76 H ALA 76 -3.275 -2.047 0.452 582 HA ALA 76 HA ALA 76 -5.352 -0.016 0.319 583 HB1 ALA 76 3HB ALA 76 -6.583 -1.834 1.241 584 HB2 ALA 76 1HB ALA 76 -6.253 -0.693 2.543 585 HB3 ALA 76 2HB ALA 76 -5.310 -2.172 2.412 586 H TYR 77 H TYR 77 -5.050 1.754 1.677 587 HA TYR 77 HA TYR 77 -2.402 1.861 2.950 588 HD1 TYR 77 HD1 TYR 77 -1.899 4.731 4.299 589 HD2 TYR 77 HD2 TYR 77 -5.481 5.250 2.061 590 HE1 TYR 77 HE1 TYR 77 -2.514 6.632 5.730 591 HE2 TYR 77 HE2 TYR 77 -6.103 7.152 3.491 592 HH TYR 77 HH TYR 77 -4.558 8.891 5.016 593 HB2 TYR 77 1HB TYR 77 -2.236 3.832 1.898 594 HB3 TYR 77 2HB TYR 77 -3.893 3.704 1.324 595 H TRP 78 H TRP 78 -2.277 1.746 5.093 596 HA TRP 78 HA TRP 78 -4.560 1.588 6.750 597 HD1 TRP 78 HD1 TRP 78 -5.111 1.992 8.938 598 HE1 TRP 78 HE1 TRP 78 -5.382 0.776 11.188 599 HE3 TRP 78 HE3 TRP 78 -0.605 -0.407 9.096 600 HZ2 TRP 78 HZ2 TRP 78 -3.878 -0.979 12.815 601 HZ3 TRP 78 HZ3 TRP 78 -0.097 -1.836 11.033 602 HH2 TRP 78 HH2 TRP 78 -1.700 -2.115 12.853 603 HB2 TRP 78 1HB TRP 78 -2.137 0.675 7.117 604 HB3 TRP 78 2HB TRP 78 -1.846 2.251 7.845 605 H ILE 79 H ILE 79 -5.858 3.246 7.298 606 HA ILE 79 HA ILE 79 -5.015 5.952 7.067 607 HB ILE 79 HB ILE 79 -7.541 4.605 7.875 608 HG12 ILE 79 1HG1 ILE 79 -6.502 6.364 5.749 609 HG13 ILE 79 2HG1 ILE 79 -7.671 5.055 5.661 610 HG21 ILE 79 1HG2 ILE 79 -7.315 6.252 9.652 611 HG22 ILE 79 2HG2 ILE 79 -8.575 6.742 8.518 612 HG23 ILE 79 3HG2 ILE 79 -6.989 7.513 8.463 613 HD11 ILE 79 3HD1 ILE 79 -8.960 6.864 5.121 614 HD12 ILE 79 1HD1 ILE 79 -8.098 7.946 6.214 615 HD13 ILE 79 2HD1 ILE 79 -9.236 6.764 6.859 616 HA PRO 80 HA PRO 80 -5.197 6.197 11.899 617 HB2 PRO 80 1HB PRO 80 -5.345 3.358 12.716 618 HB3 PRO 80 2HB PRO 80 -6.215 4.756 13.352 619 HG2 PRO 80 1HG PRO 80 -7.443 2.913 11.850 620 HG3 PRO 80 2HG PRO 80 -7.863 4.633 11.741 621 HD2 PRO 80 1HD PRO 80 -6.207 2.965 9.897 622 HD3 PRO 80 2HD PRO 80 -7.381 4.236 9.523 623 H GLY 81 H GLY 81 -3.029 6.493 10.813 624 HA2 GLY 81 1HA GLY 81 -0.890 5.919 12.229 625 HA3 GLY 81 2HA GLY 81 -1.085 4.377 11.407 626 H LYS 82 H LYS 82 -2.212 6.335 9.122 627 HA LYS 82 HA LYS 82 -1.349 7.114 7.134 628 HB2 LYS 82 1HB LYS 82 1.102 8.144 8.460 629 HB3 LYS 82 2HB LYS 82 0.033 8.930 7.313 630 HG2 LYS 82 1HG LYS 82 -0.755 10.110 9.017 631 HG3 LYS 82 2HG LYS 82 -1.526 8.632 9.595 632 HD2 LYS 82 1HD LYS 82 -0.186 9.693 11.347 633 HD3 LYS 82 2HD LYS 82 0.441 8.100 10.923 634 HE2 LYS 82 1HE LYS 82 2.429 9.035 10.600 635 HE3 LYS 82 2HE LYS 82 1.747 9.901 9.225 636 HZ1 LYS 82 3HZ LYS 82 2.571 11.594 10.520 637 HZ2 LYS 82 1HZ LYS 82 2.172 10.839 11.981 638 HZ3 LYS 82 2HZ LYS 82 0.961 11.547 11.036 639 H ALA 83 H ALA 83 -0.575 4.437 8.010 640 HA ALA 83 HA ALA 83 2.033 4.191 6.653 641 HB1 ALA 83 3HB ALA 83 1.102 3.152 9.132 642 HB2 ALA 83 1HB ALA 83 2.688 2.965 8.385 643 HB3 ALA 83 2HB ALA 83 1.407 1.799 8.045 644 H ILE 84 H ILE 84 2.225 2.886 4.884 645 HA ILE 84 HA ILE 84 -0.240 1.824 3.740 646 HB ILE 84 HB ILE 84 2.488 1.681 2.481 647 HG12 ILE 84 1HG1 ILE 84 0.532 3.988 2.380 648 HG13 ILE 84 2HG1 ILE 84 2.122 4.011 3.134 649 HG21 ILE 84 1HG2 ILE 84 -0.202 1.963 1.174 650 HG22 ILE 84 2HG2 ILE 84 0.528 0.402 1.549 651 HG23 ILE 84 3HG2 ILE 84 1.329 1.504 0.429 652 HD11 ILE 84 3HD1 ILE 84 3.077 4.564 1.214 653 HD12 ILE 84 1HD1 ILE 84 1.463 4.718 0.518 654 HD13 ILE 84 2HD1 ILE 84 2.335 3.190 0.393 655 H CYS 85 H CYS 85 -0.535 -0.387 3.152 656 HA CYS 85 HA CYS 85 1.496 -2.270 4.123 657 HG CYS 85 HG CYS 85 -1.327 -1.232 6.790 658 HB2 CYS 85 1HB CYS 85 -1.363 -2.759 4.878 659 HB3 CYS 85 2HB CYS 85 0.100 -3.412 5.608 660 H LEU 86 H LEU 86 1.782 -4.037 2.884 661 HA LEU 86 HA LEU 86 0.034 -4.412 0.570 662 HG LEU 86 HG LEU 86 1.397 -4.166 -1.101 663 HB2 LEU 86 1HB LEU 86 2.806 -4.866 1.153 664 HB3 LEU 86 2HB LEU 86 2.082 -6.394 0.681 665 HD11 LEU 86 1HD1 LEU 86 3.844 -3.802 -0.289 666 HD12 LEU 86 2HD1 LEU 86 3.469 -3.727 -2.011 667 HD13 LEU 86 3HD1 LEU 86 4.194 -5.185 -1.328 668 HD21 LEU 86 3HD2 LEU 86 2.219 -5.923 -2.756 669 HD22 LEU 86 1HD2 LEU 86 0.795 -6.328 -1.795 670 HD23 LEU 86 2HD2 LEU 86 2.372 -6.998 -1.365 671 H PHE 87 H PHE 87 -0.775 -6.587 0.024 672 HA PHE 87 HA PHE 87 -1.025 -8.385 2.331 673 HD1 PHE 87 HD1 PHE 87 -2.655 -7.064 4.145 674 HD2 PHE 87 HD2 PHE 87 -3.878 -5.596 0.347 675 HE1 PHE 87 HE1 PHE 87 -3.168 -4.883 5.163 676 HE2 PHE 87 HE2 PHE 87 -4.395 -3.419 1.354 677 HZ PHE 87 HZ PHE 87 -4.039 -3.053 3.763 678 HB2 PHE 87 1HB PHE 87 -3.411 -7.838 0.594 679 HB3 PHE 87 2HB PHE 87 -3.354 -8.572 2.191 680 H PHE 88 H PHE 88 -0.876 -10.497 1.865 681 HA PHE 88 HA PHE 88 -1.448 -11.488 -0.790 682 HD1 PHE 88 HD2 PHE 88 0.408 -9.546 -2.196 683 HD2 PHE 88 HD1 PHE 88 1.110 -13.742 -2.102 684 HE1 PHE 88 HE2 PHE 88 0.545 -9.574 -4.652 685 HE2 PHE 88 HE1 PHE 88 1.249 -13.778 -4.558 686 HZ PHE 88 HZ PHE 88 0.965 -11.692 -5.837 687 HB2 PHE 88 1HB PHE 88 1.203 -10.756 -0.131 688 HB3 PHE 88 2HB PHE 88 1.147 -12.517 -0.112 689 H GLY 89 H GLY 89 -2.407 -11.873 1.962 690 HA2 GLY 89 1HA GLY 89 -3.217 -14.384 2.102 691 HA3 GLY 89 2HA GLY 89 -1.544 -14.588 2.596 692 H LYS 90 H LYS 90 -2.114 -15.310 4.657 693 HA LYS 90 HA LYS 90 -3.895 -14.435 6.458 694 HB2 LYS 90 1HB LYS 90 -2.331 -15.026 8.277 695 HB3 LYS 90 2HB LYS 90 -2.407 -16.239 7.016 696 HG2 LYS 90 1HG LYS 90 -0.237 -14.153 7.132 697 HG3 LYS 90 2HG LYS 90 -0.128 -15.702 7.965 698 HD2 LYS 90 1HD LYS 90 -0.886 -16.432 5.425 699 HD3 LYS 90 2HD LYS 90 0.212 -15.080 5.138 700 HE2 LYS 90 1HE LYS 90 1.613 -16.418 6.988 701 HE3 LYS 90 2HE LYS 90 0.732 -17.762 6.262 702 HZ1 LYS 90 3HZ LYS 90 1.563 -17.006 4.079 703 HZ2 LYS 90 1HZ LYS 90 2.804 -17.477 5.129 704 HZ3 LYS 90 2HZ LYS 90 2.501 -15.836 4.857 705 H THR 91 H THR 91 -3.508 -13.141 8.559 706 HA THR 91 HA THR 91 -1.797 -10.829 8.323 707 HB THR 91 HB THR 91 -4.374 -9.750 8.888 708 HG1 THR 91 HG1 THR 91 -4.325 -11.129 6.417 709 HG21 THR 91 3HG2 THR 91 -2.608 -8.444 7.895 710 HG22 THR 91 1HG2 THR 91 -4.020 -8.446 6.840 711 HG23 THR 91 2HG2 THR 91 -2.630 -9.459 6.455 712 HA PRO 92 HA PRO 92 -1.901 -10.407 12.755 713 HB2 PRO 92 1HB PRO 92 -4.210 -8.497 12.633 714 HB3 PRO 92 2HB PRO 92 -2.737 -8.413 13.607 715 HG2 PRO 92 1HG PRO 92 -2.963 -6.956 11.399 716 HG3 PRO 92 2HG PRO 92 -1.428 -7.743 11.807 717 HD2 PRO 92 1HD PRO 92 -3.415 -8.446 9.720 718 HD3 PRO 92 2HD PRO 92 -1.660 -8.699 9.737 719 H ILE 93 H ILE 93 -4.979 -10.849 11.138 720 HA ILE 93 HA ILE 93 -5.762 -12.717 13.258 721 HB ILE 93 HB ILE 93 -7.724 -10.830 11.963 722 HG12 ILE 93 1HG1 ILE 93 -7.686 -10.068 14.557 723 HG13 ILE 93 2HG1 ILE 93 -5.996 -10.522 14.350 724 HG21 ILE 93 1HG2 ILE 93 -8.290 -12.182 14.526 725 HG22 ILE 93 2HG2 ILE 93 -8.234 -13.208 13.092 726 HG23 ILE 93 3HG2 ILE 93 -9.352 -11.846 13.157 727 HD11 ILE 93 3HD1 ILE 93 -6.003 -8.271 13.844 728 HD12 ILE 93 1HD1 ILE 93 -7.551 -8.359 13.002 729 HD13 ILE 93 2HD1 ILE 93 -6.100 -9.024 12.251 730 H SER 94 H SER 94 -4.600 -13.718 11.077 731 HA SER 94 HA SER 94 -6.077 -14.176 8.778 732 HG SER 94 HG SER 94 -2.736 -15.806 10.072 733 HB2 SER 94 1HB SER 94 -4.709 -16.595 9.474 734 HB3 SER 94 2HB SER 94 -4.266 -15.377 8.278 735 H ASP 95 H ASP 95 -5.670 -16.729 11.215 736 HA ASP 95 HA ASP 95 -7.028 -18.412 11.905 737 HB2 ASP 95 1HB ASP 95 -8.968 -16.103 11.787 738 HB3 ASP 95 2HB ASP 95 -9.421 -17.686 12.416 739 H ASP 96 H ASP 96 -9.726 -16.987 10.159 740 HA ASP 96 HA ASP 96 -9.532 -19.151 8.173 741 HB2 ASP 96 1HB ASP 96 -11.821 -18.363 9.918 742 HB3 ASP 96 2HB ASP 96 -12.172 -18.928 8.287 743 H LYS 97 H LYS 97 -9.338 -15.947 8.536 744 HA LYS 97 HA LYS 97 -10.138 -15.450 5.791 745 HB2 LYS 97 1HB LYS 97 -11.137 -13.598 7.947 746 HB3 LYS 97 2HB LYS 97 -11.581 -13.625 6.247 747 HG2 LYS 97 1HG LYS 97 -12.568 -15.922 6.699 748 HG3 LYS 97 2HG LYS 97 -12.380 -15.544 8.412 749 HD2 LYS 97 1HD LYS 97 -13.836 -13.730 6.503 750 HD3 LYS 97 2HD LYS 97 -14.643 -15.038 7.371 751 HE2 LYS 97 1HE LYS 97 -13.185 -13.691 9.321 752 HE3 LYS 97 2HE LYS 97 -13.846 -12.415 8.301 753 HZ1 LYS 97 3HZ LYS 97 -15.621 -12.689 9.632 754 HZ2 LYS 97 1HZ LYS 97 -15.212 -14.274 10.062 755 HZ3 LYS 97 2HZ LYS 97 -15.983 -13.970 8.587 756 H ILE 98 H ILE 98 -9.806 -12.755 5.659 757 HA ILE 98 HA ILE 98 -7.087 -12.334 6.719 758 HB ILE 98 HB ILE 98 -8.120 -11.413 4.035 759 HG12 ILE 98 1HG1 ILE 98 -6.055 -13.529 4.673 760 HG13 ILE 98 2HG1 ILE 98 -7.718 -13.867 4.197 761 HG21 ILE 98 1HG2 ILE 98 -6.293 -10.145 3.810 762 HG22 ILE 98 2HG2 ILE 98 -5.243 -11.374 4.517 763 HG23 ILE 98 3HG2 ILE 98 -6.144 -10.278 5.562 764 HD11 ILE 98 3HD1 ILE 98 -6.740 -12.139 2.245 765 HD12 ILE 98 1HD1 ILE 98 -7.026 -13.874 2.099 766 HD13 ILE 98 2HD1 ILE 98 -5.433 -13.282 2.565 767 H ARG 99 H ARG 99 -7.205 -10.819 8.230 768 HA ARG 99 HA ARG 99 -8.951 -8.493 7.738 769 HE ARG 99 HE ARG 99 -12.525 -11.490 9.730 770 HB2 ARG 99 1HB ARG 99 -8.233 -9.989 10.219 771 HB3 ARG 99 2HB ARG 99 -8.512 -8.257 10.352 772 HG2 ARG 99 1HG ARG 99 -10.655 -8.796 10.615 773 HG3 ARG 99 2HG ARG 99 -10.661 -9.083 8.873 774 HD2 ARG 99 1HD ARG 99 -10.320 -11.410 9.167 775 HD3 ARG 99 2HD ARG 99 -9.937 -11.208 10.875 776 HH11 ARG 99 1HH1 ARG 99 -10.793 -9.922 12.322 777 HH12 ARG 99 2HH1 ARG 99 -12.178 -9.821 13.354 778 HH21 ARG 99 1HH2 ARG 99 -14.349 -11.354 11.085 779 HH22 ARG 99 2HH2 ARG 99 -14.198 -10.633 12.654 780 HA PRO 100 HA PRO 100 -4.782 -6.695 7.319 781 HB2 PRO 100 1HB PRO 100 -5.617 -4.438 6.057 782 HB3 PRO 100 2HB PRO 100 -5.381 -5.977 5.219 783 HG2 PRO 100 1HG PRO 100 -7.922 -4.767 6.260 784 HG3 PRO 100 2HG PRO 100 -7.610 -5.534 4.688 785 HD2 PRO 100 1HD PRO 100 -8.832 -6.846 6.689 786 HD3 PRO 100 2HD PRO 100 -7.728 -7.670 5.569 787 H ALA 101 H ALA 101 -7.722 -5.211 8.572 788 HA ALA 101 HA ALA 101 -6.523 -4.245 10.921 789 HB1 ALA 101 3HB ALA 101 -5.581 -2.310 10.386 790 HB2 ALA 101 1HB ALA 101 -7.090 -1.738 9.674 791 HB3 ALA 101 2HB ALA 101 -5.928 -2.623 8.686 792 H SER 102 H SER 102 -8.040 -1.926 11.375 793 HA SER 102 HA SER 102 -10.753 -3.047 11.302 794 HG SER 102 HG SER 102 -8.389 -1.175 13.297 795 HB2 SER 102 1HB SER 102 -10.612 -0.925 13.182 796 HB3 SER 102 2HB SER 102 -10.801 -2.649 13.501 797 H ALA 103 H ALA 103 -8.917 -0.691 9.814 798 HA ALA 103 HA ALA 103 -11.157 0.498 8.572 799 HB1 ALA 103 3HB ALA 103 -10.968 2.779 9.480 800 HB2 ALA 103 1HB ALA 103 -9.812 2.187 10.674 801 HB3 ALA 103 2HB ALA 103 -11.478 1.605 10.694 802 H VAL 104 H VAL 104 -9.569 -0.293 6.928 803 HA VAL 104 HA VAL 104 -7.635 1.854 6.329 804 HB VAL 104 HB VAL 104 -6.130 0.273 5.262 805 HG11 VAL 104 1HG1 VAL 104 -6.835 -0.828 7.967 806 HG12 VAL 104 2HG1 VAL 104 -6.059 0.737 7.742 807 HG13 VAL 104 3HG1 VAL 104 -5.247 -0.734 7.205 808 HG21 VAL 104 3HG2 VAL 104 -6.520 -1.954 4.936 809 HG22 VAL 104 1HG2 VAL 104 -8.167 -1.344 4.785 810 HG23 VAL 104 2HG2 VAL 104 -7.630 -2.079 6.298 811 H ASN 105 H ASN 105 -7.481 2.624 4.278 812 HA ASN 105 HA ASN 105 -9.785 2.228 2.595 813 HB2 ASN 105 1HB ASN 105 -7.406 3.907 1.850 814 HB3 ASN 105 2HB ASN 105 -9.103 4.163 1.456 815 HD21 ASN 105 1HD2 ASN 105 -10.023 3.642 4.151 816 HD22 ASN 105 2HD2 ASN 105 -9.597 5.026 5.090 817 H VAL 106 H VAL 106 -9.753 1.710 0.377 818 HA VAL 106 HA VAL 106 -7.789 -0.297 -0.353 819 HB VAL 106 HB VAL 106 -9.532 0.291 -2.545 820 HG11 VAL 106 1HG1 VAL 106 -9.759 -1.955 -2.616 821 HG12 VAL 106 2HG1 VAL 106 -10.004 -2.098 -0.876 822 HG13 VAL 106 3HG1 VAL 106 -8.377 -1.880 -1.522 823 HG21 VAL 106 3HG2 VAL 106 -11.192 1.264 -1.230 824 HG22 VAL 106 1HG2 VAL 106 -10.914 0.153 0.111 825 HG23 VAL 106 2HG2 VAL 106 -11.691 -0.422 -1.363 826 H ILE 107 H ILE 107 -5.959 0.899 -0.616 827 HA ILE 107 HA ILE 107 -5.828 3.250 -2.200 828 HB ILE 107 HB ILE 107 -4.364 2.395 -0.204 829 HG12 ILE 107 1HG1 ILE 107 -4.292 4.563 -1.684 830 HG13 ILE 107 2HG1 ILE 107 -2.976 4.189 -0.578 831 HG21 ILE 107 1HG2 ILE 107 -3.540 0.412 -1.415 832 HG22 ILE 107 2HG2 ILE 107 -2.251 1.450 -0.812 833 HG23 ILE 107 3HG2 ILE 107 -2.678 1.480 -2.520 834 HD11 ILE 107 3HD1 ILE 107 -1.866 3.086 -2.606 835 HD12 ILE 107 1HD1 ILE 107 -1.911 4.844 -2.519 836 HD13 ILE 107 2HD1 ILE 107 -3.047 3.986 -3.554 837 H GLY 108 H GLY 108 -6.657 0.575 -3.534 838 HA2 GLY 108 1HA GLY 108 -6.466 0.494 -5.971 839 HA3 GLY 108 2HA GLY 108 -4.763 0.862 -5.784 840 H ARG 109 H ARG 109 -4.091 -0.924 -6.968 841 HA ARG 109 HA ARG 109 -4.047 -3.403 -5.462 842 HE ARG 109 HE ARG 109 -8.588 -2.334 -7.895 843 HB2 ARG 109 1HB ARG 109 -4.990 -3.437 -8.330 844 HB3 ARG 109 2HB ARG 109 -4.897 -4.798 -7.222 845 HG2 ARG 109 1HG ARG 109 -6.709 -3.931 -5.914 846 HG3 ARG 109 2HG ARG 109 -6.738 -2.442 -6.855 847 HD2 ARG 109 1HD ARG 109 -6.990 -4.340 -8.799 848 HD3 ARG 109 2HD ARG 109 -7.875 -5.071 -7.462 849 HH11 ARG 109 1HH1 ARG 109 -9.162 -5.608 -8.960 850 HH12 ARG 109 2HH1 ARG 109 -10.747 -5.265 -9.567 851 HH21 ARG 109 1HH2 ARG 109 -10.672 -1.882 -8.692 852 HH22 ARG 109 2HH2 ARG 109 -11.605 -3.149 -9.417 853 H ILE 110 H ILE 110 -2.599 -5.029 -6.457 854 HA ILE 110 HA ILE 110 -0.242 -3.704 -7.571 855 HB ILE 110 HB ILE 110 -0.572 -6.517 -6.507 856 HG12 ILE 110 1HG1 ILE 110 1.175 -4.962 -4.903 857 HG13 ILE 110 2HG1 ILE 110 -0.262 -3.986 -5.174 858 HG21 ILE 110 1HG2 ILE 110 1.915 -4.996 -7.280 859 HG22 ILE 110 2HG2 ILE 110 1.235 -6.394 -8.114 860 HG23 ILE 110 3HG2 ILE 110 1.887 -6.571 -6.487 861 HD11 ILE 110 3HD1 ILE 110 -1.653 -5.796 -4.306 862 HD12 ILE 110 1HD1 ILE 110 -0.444 -5.278 -3.133 863 HD13 ILE 110 2HD1 ILE 110 -0.208 -6.773 -4.036 864 H VAL 111 H VAL 111 -0.003 -3.704 -9.721 865 HA VAL 111 HA VAL 111 -1.534 -5.208 -11.515 866 HB VAL 111 HB VAL 111 0.837 -4.669 -12.914 867 HG11 VAL 111 1HG1 VAL 111 -1.755 -4.259 -13.310 868 HG12 VAL 111 2HG1 VAL 111 -0.514 -3.412 -14.231 869 HG13 VAL 111 3HG1 VAL 111 -1.298 -2.614 -12.868 870 HG21 VAL 111 3HG2 VAL 111 1.450 -2.419 -12.394 871 HG22 VAL 111 1HG2 VAL 111 1.582 -3.372 -10.915 872 HG23 VAL 111 2HG2 VAL 111 0.198 -2.306 -11.156 873 H ASN 112 H ASN 112 2.001 -5.548 -11.440 874 HA ASN 112 HA ASN 112 1.975 -8.323 -10.791 875 HB2 ASN 112 1HB ASN 112 2.561 -9.255 -12.961 876 HB3 ASN 112 2HB ASN 112 1.005 -8.443 -13.068 877 HD21 ASN 112 1HD2 ASN 112 2.792 -9.076 -15.211 878 HD22 ASN 112 2HD2 ASN 112 3.247 -7.582 -15.951 879 H SER 113 H SER 113 4.257 -9.196 -12.047 880 HA SER 113 HA SER 113 6.530 -9.074 -12.058 881 HG SER 113 HG SER 113 7.743 -7.957 -13.444 882 HB2 SER 113 1HB SER 113 5.832 -6.620 -12.973 883 HB3 SER 113 2HB SER 113 6.700 -6.173 -11.505 884 H MET 114 H MET 114 6.706 -10.214 -10.138 885 HA MET 114 HA MET 114 7.266 -10.615 -7.971 886 HB2 MET 114 1HB MET 114 8.722 -8.169 -8.736 887 HB3 MET 114 2HB MET 114 8.584 -8.438 -7.005 888 HG2 MET 114 1HG MET 114 10.469 -9.609 -7.319 889 HG3 MET 114 2HG MET 114 9.346 -10.887 -7.777 890 HE1 MET 114 3HE MET 114 12.748 -9.518 -9.136 891 HE2 MET 114 1HE MET 114 12.584 -11.038 -10.014 892 HE3 MET 114 2HE MET 114 12.166 -10.960 -8.303 893 H GLU 115 H GLU 115 4.672 -9.809 -8.240 894 HA GLU 115 HA GLU 115 4.021 -7.660 -6.462 895 HB2 GLU 115 1HB GLU 115 1.683 -8.566 -6.696 896 HB3 GLU 115 2HB GLU 115 2.469 -8.126 -8.207 897 HG2 GLU 115 1HG GLU 115 2.836 -10.379 -8.789 898 HG3 GLU 115 2HG GLU 115 2.440 -10.939 -7.163 899 H GLY 116 H GLY 116 5.131 -10.756 -5.909 900 HA2 GLY 116 1HA GLY 116 3.559 -11.255 -3.516 901 HA3 GLY 116 2HA GLY 116 4.820 -12.287 -4.172 902 H LEU 117 H LEU 117 4.897 -8.853 -3.232 903 HA LEU 117 HA LEU 117 7.400 -8.723 -2.204 904 HG LEU 117 HG LEU 117 7.099 -7.400 0.337 905 HB2 LEU 117 1HB LEU 117 6.110 -6.733 -2.355 906 HB3 LEU 117 2HB LEU 117 4.888 -7.356 -1.264 907 HD11 LEU 117 1HD1 LEU 117 8.316 -5.359 0.096 908 HD12 LEU 117 2HD1 LEU 117 7.321 -4.867 -1.273 909 HD13 LEU 117 3HD1 LEU 117 8.414 -6.245 -1.427 910 HD21 LEU 117 3HD2 LEU 117 4.693 -6.399 0.555 911 HD22 LEU 117 1HD2 LEU 117 5.519 -4.885 0.186 912 HD23 LEU 117 2HD2 LEU 117 6.003 -5.834 1.589 913 H LYS 118 H LYS 118 4.599 -10.155 -0.678 914 HA LYS 118 HA LYS 118 5.218 -10.314 1.948 915 HB2 LYS 118 1HB LYS 118 4.194 -12.648 1.912 916 HB3 LYS 118 2HB LYS 118 3.215 -11.328 1.295 917 HG2 LYS 118 1HG LYS 118 2.869 -12.577 -0.503 918 HG3 LYS 118 2HG LYS 118 4.541 -12.283 -0.946 919 HD2 LYS 118 1HD LYS 118 4.098 -14.432 1.021 920 HD3 LYS 118 2HD LYS 118 3.470 -14.739 -0.599 921 HE2 LYS 118 1HE LYS 118 6.303 -14.114 0.197 922 HE3 LYS 118 2HE LYS 118 5.688 -15.601 -0.517 923 HZ1 LYS 118 3HZ LYS 118 4.976 -13.830 -2.370 924 HZ2 LYS 118 1HZ LYS 118 6.450 -14.662 -2.395 925 HZ3 LYS 118 2HZ LYS 118 6.379 -13.086 -1.788 926 H GLY 119 H GLY 119 7.176 -11.744 -0.539 927 HA2 GLY 119 1HA GLY 119 8.444 -13.586 1.328 928 HA3 GLY 119 2HA GLY 119 8.793 -13.438 -0.387 929 H VAL 120 H VAL 120 8.691 -10.625 1.678 930 HA VAL 120 HA VAL 120 11.437 -10.027 1.025 931 HB VAL 120 HB VAL 120 11.028 -7.975 2.458 932 HG11 VAL 120 1HG1 VAL 120 10.425 -6.916 0.595 933 HG12 VAL 120 2HG1 VAL 120 8.918 -7.812 0.459 934 HG13 VAL 120 3HG1 VAL 120 10.416 -8.512 -0.151 935 HG21 VAL 120 3HG2 VAL 120 9.245 -7.917 3.776 936 HG22 VAL 120 1HG2 VAL 120 8.665 -9.443 3.114 937 HG23 VAL 120 2HG2 VAL 120 8.215 -7.922 2.346 938 H ALA 121 H ALA 121 13.106 -9.556 2.593 939 HA ALA 121 HA ALA 121 13.140 -11.428 4.781 940 HB1 ALA 121 3HB ALA 121 15.121 -10.791 3.295 941 HB2 ALA 121 1HB ALA 121 15.418 -10.889 5.029 942 HB3 ALA 121 2HB ALA 121 15.218 -9.316 4.256 943 H ASP 122 H ASP 122 13.299 -10.904 7.018 944 HA ASP 122 HA ASP 122 11.610 -8.920 7.923 945 HB2 ASP 122 1HB ASP 122 12.463 -9.330 10.148 946 HB3 ASP 122 2HB ASP 122 12.285 -10.850 9.277 947 H GLY 123 H GLY 123 11.822 -6.843 7.465 948 HA2 GLY 123 1HA GLY 123 12.603 -4.693 7.752 949 HA3 GLY 123 2HA GLY 123 13.925 -5.347 8.697 950 H GLU 124 H GLU 124 13.071 -3.852 5.813 951 HA GLU 124 HA GLU 124 15.803 -3.892 4.917 952 HB2 GLU 124 1HB GLU 124 15.267 -4.639 2.609 953 HB3 GLU 124 2HB GLU 124 15.074 -5.906 3.809 954 HG2 GLU 124 1HG GLU 124 12.609 -4.433 3.302 955 HG3 GLU 124 2HG GLU 124 13.259 -5.224 1.869 956 H SER 125 H SER 125 16.354 -2.079 3.786 957 HA SER 125 HA SER 125 15.006 0.263 4.013 958 HG SER 125 HG SER 125 18.143 -0.848 2.127 959 HB2 SER 125 1HB SER 125 16.352 -0.031 1.393 960 HB3 SER 125 2HB SER 125 16.605 1.161 2.667 961 H VAL 126 H VAL 126 13.728 1.588 2.689 962 HA VAL 126 HA VAL 126 12.285 0.351 0.471 963 HB VAL 126 HB VAL 126 10.842 1.575 2.833 964 HG11 VAL 126 1HG1 VAL 126 8.798 0.921 1.696 965 HG12 VAL 126 2HG1 VAL 126 9.735 0.304 0.338 966 HG13 VAL 126 3HG1 VAL 126 9.739 2.031 0.699 967 HG21 VAL 126 3HG2 VAL 126 11.197 -0.462 3.706 968 HG22 VAL 126 1HG2 VAL 126 11.518 -1.201 2.136 969 HG23 VAL 126 2HG2 VAL 126 9.856 -0.912 2.652 970 H VAL 127 H VAL 127 12.018 1.773 -1.164 971 HA VAL 127 HA VAL 127 12.116 4.646 -0.510 972 HB VAL 127 HB VAL 127 13.248 5.034 -2.688 973 HG11 VAL 127 1HG1 VAL 127 15.208 5.007 -1.628 974 HG12 VAL 127 2HG1 VAL 127 15.189 3.252 -1.458 975 HG13 VAL 127 3HG1 VAL 127 14.346 4.262 -0.282 976 HG21 VAL 127 3HG2 VAL 127 13.126 3.370 -4.171 977 HG22 VAL 127 1HG2 VAL 127 12.824 2.160 -2.924 978 HG23 VAL 127 2HG2 VAL 127 14.476 2.656 -3.290 979 H VAL 128 H VAL 128 10.109 5.358 -0.796 980 HA VAL 128 HA VAL 128 8.353 4.236 -2.798 981 HB VAL 128 HB VAL 128 7.515 6.735 -1.477 982 HG11 VAL 128 1HG1 VAL 128 5.742 5.707 -2.496 983 HG12 VAL 128 2HG1 VAL 128 5.593 5.034 -0.876 984 HG13 VAL 128 3HG1 VAL 128 6.344 4.084 -2.155 985 HG21 VAL 128 3HG2 VAL 128 8.417 6.160 0.520 986 HG22 VAL 128 1HG2 VAL 128 8.538 4.452 0.098 987 HG23 VAL 128 2HG2 VAL 128 6.991 5.126 0.603 988 H GLU 129 H GLU 129 8.034 5.057 -4.835 989 HA GLU 129 HA GLU 129 8.516 7.859 -5.379 990 HB2 GLU 129 1HB GLU 129 10.006 7.253 -7.343 991 HB3 GLU 129 2HB GLU 129 10.728 7.101 -5.747 992 HG2 GLU 129 1HG GLU 129 10.149 4.653 -5.843 993 HG3 GLU 129 2HG GLU 129 9.740 4.904 -7.540 994 H ARG 130 H ARG 130 7.086 8.604 -6.848 995 HA ARG 130 HA ARG 130 5.172 6.812 -8.005 996 HE ARG 130 HE ARG 130 3.982 7.803 -11.483 997 HB2 ARG 130 1HB ARG 130 4.528 9.042 -7.218 998 HB3 ARG 130 2HB ARG 130 5.592 9.781 -8.407 999 HG2 ARG 130 1HG ARG 130 3.536 7.928 -9.440 1000 HG3 ARG 130 2HG ARG 130 2.974 9.464 -8.777 1001 HD2 ARG 130 1HD ARG 130 3.539 10.476 -10.667 1002 HD3 ARG 130 2HD ARG 130 5.220 10.023 -10.399 1003 HH11 ARG 130 1HH1 ARG 130 4.604 11.101 -12.444 1004 HH12 ARG 130 2HH1 ARG 130 4.667 10.728 -14.134 1005 HH21 ARG 130 1HH2 ARG 130 4.064 7.312 -13.706 1006 HH22 ARG 130 2HH2 ARG 130 4.359 8.577 -14.852 1007 H ALA 131 H ALA 131 6.179 5.485 -9.466 1008 HA ALA 131 HA ALA 131 7.339 4.834 -11.350 1009 HB1 ALA 131 3HB ALA 131 5.717 7.045 -12.578 1010 HB2 ALA 131 1HB ALA 131 5.059 5.483 -12.094 1011 HB3 ALA 131 2HB ALA 131 6.290 5.568 -13.353 Start of MODEL 20 1 H MET 1 H MET 1 -0.951 10.484 -22.065 2 HA MET 1 HA MET 1 -2.153 12.293 -22.726 3 HB2 MET 1 1HB MET 1 -3.898 9.934 -23.443 4 HB3 MET 1 2HB MET 1 -3.604 11.378 -24.402 5 HG2 MET 1 1HG MET 1 -2.142 10.079 -25.480 6 HG3 MET 1 2HG MET 1 -1.085 10.447 -24.119 7 HE1 MET 1 3HE MET 1 -0.401 8.386 -22.186 8 HE2 MET 1 1HE MET 1 0.361 8.834 -23.712 9 HE3 MET 1 2HE MET 1 0.088 7.135 -23.330 10 H GLY 2 H GLY 2 -3.167 13.707 -21.415 11 HA2 GLY 2 1HA GLY 2 -5.333 14.647 -20.898 12 HA3 GLY 2 2HA GLY 2 -5.911 13.019 -20.583 13 H GLU 3 H GLU 3 -6.652 13.479 -18.521 14 HA GLU 3 HA GLU 3 -4.545 13.683 -16.503 15 HB2 GLU 3 1HB GLU 3 -7.063 15.343 -16.359 16 HB3 GLU 3 2HB GLU 3 -5.706 15.373 -15.241 17 HG2 GLU 3 1HG GLU 3 -4.304 16.425 -16.811 18 HG3 GLU 3 2HG GLU 3 -5.418 16.098 -18.139 19 H ARG 4 H ARG 4 -8.025 13.229 -17.072 20 HA ARG 4 HA ARG 4 -9.563 11.857 -16.122 21 HE ARG 4 HE ARG 4 -5.699 9.434 -16.495 22 HB2 ARG 4 1HB ARG 4 -7.164 10.108 -15.526 23 HB3 ARG 4 2HB ARG 4 -8.841 9.591 -15.581 24 HG2 ARG 4 1HG ARG 4 -8.061 8.904 -17.632 25 HG3 ARG 4 2HG ARG 4 -8.794 10.460 -18.016 26 HD2 ARG 4 1HD ARG 4 -6.563 10.065 -19.070 27 HD3 ARG 4 2HD ARG 4 -6.660 11.531 -18.096 28 HH11 ARG 4 1HH1 ARG 4 -4.700 11.384 -19.208 29 HH12 ARG 4 2HH1 ARG 4 -3.013 11.264 -18.834 30 HH21 ARG 4 1HH2 ARG 4 -3.482 9.274 -15.999 31 HH22 ARG 4 2HH2 ARG 4 -2.322 10.066 -17.011 32 H GLY 5 H GLY 5 -8.869 10.008 -13.782 33 HA2 GLY 5 1HA GLY 5 -8.158 11.825 -11.655 34 HA3 GLY 5 2HA GLY 5 -9.863 11.400 -11.689 35 H VAL 6 H VAL 6 -9.605 8.718 -12.534 36 HA VAL 6 HA VAL 6 -8.386 7.551 -10.106 37 HB VAL 6 HB VAL 6 -9.934 5.690 -10.305 38 HG11 VAL 6 1HG1 VAL 6 -10.782 8.431 -9.915 39 HG12 VAL 6 2HG1 VAL 6 -11.196 6.979 -9.006 40 HG13 VAL 6 3HG1 VAL 6 -12.112 7.403 -10.450 41 HG21 VAL 6 3HG2 VAL 6 -10.105 6.295 -12.971 42 HG22 VAL 6 1HG2 VAL 6 -11.664 6.849 -12.359 43 HG23 VAL 6 2HG2 VAL 6 -11.160 5.179 -12.106 44 H GLU 7 H GLU 7 -6.437 7.879 -11.710 45 HA GLU 7 HA GLU 7 -5.756 5.231 -12.622 46 HB2 GLU 7 1HB GLU 7 -5.974 7.534 -14.560 47 HB3 GLU 7 2HB GLU 7 -5.034 6.085 -14.894 48 HG2 GLU 7 1HG GLU 7 -7.999 6.233 -14.410 49 HG3 GLU 7 2HG GLU 7 -7.193 5.935 -15.948 50 H MET 8 H MET 8 -4.722 6.696 -10.537 51 HA MET 8 HA MET 8 -2.118 7.620 -11.545 52 HB2 MET 8 1HB MET 8 -3.753 9.045 -10.000 53 HB3 MET 8 2HB MET 8 -2.951 8.128 -8.731 54 HG2 MET 8 1HG MET 8 -1.406 9.720 -8.771 55 HG3 MET 8 2HG MET 8 -0.851 8.981 -10.271 56 HE1 MET 8 3HE MET 8 -3.521 11.595 -8.889 57 HE2 MET 8 1HE MET 8 -2.871 13.013 -9.712 58 HE3 MET 8 2HE MET 8 -1.863 12.110 -8.583 59 H ARG 9 H ARG 9 -0.544 6.182 -11.387 60 HA ARG 9 HA ARG 9 -0.650 4.233 -9.181 61 HE ARG 9 HE ARG 9 4.231 2.985 -12.727 62 HB2 ARG 9 1HB ARG 9 0.299 2.622 -10.534 63 HB3 ARG 9 2HB ARG 9 -0.694 3.507 -11.679 64 HG2 ARG 9 1HG ARG 9 1.181 3.480 -12.917 65 HG3 ARG 9 2HG ARG 9 1.624 4.864 -11.915 66 HD2 ARG 9 1HD ARG 9 3.218 3.714 -10.806 67 HD3 ARG 9 2HD ARG 9 2.265 2.230 -10.772 68 HH11 ARG 9 1HH1 ARG 9 1.411 1.023 -12.115 69 HH12 ARG 9 2HH1 ARG 9 1.786 -0.126 -13.355 70 HH21 ARG 9 1HH2 ARG 9 4.727 1.476 -14.358 71 HH22 ARG 9 2HH2 ARG 9 3.670 0.131 -14.629 72 H LEU 10 H LEU 10 1.123 3.773 -7.958 73 HA LEU 10 HA LEU 10 3.398 5.624 -8.238 74 HG LEU 10 HG LEU 10 0.825 4.388 -5.924 75 HB2 LEU 10 1HB LEU 10 3.328 4.678 -5.565 76 HB3 LEU 10 2HB LEU 10 3.131 6.318 -6.141 77 HD11 LEU 10 1HD1 LEU 10 1.665 4.595 -3.700 78 HD12 LEU 10 2HD1 LEU 10 0.278 5.677 -3.832 79 HD13 LEU 10 3HD1 LEU 10 1.916 6.331 -3.891 80 HD21 LEU 10 3HD2 LEU 10 0.333 7.235 -5.626 81 HD22 LEU 10 1HD2 LEU 10 -0.438 6.058 -6.690 82 HD23 LEU 10 2HD2 LEU 10 1.067 6.839 -7.180 83 H ARG 11 H ARG 11 5.436 4.765 -7.265 84 HA ARG 11 HA ARG 11 5.643 1.900 -7.860 85 HE ARG 11 HE ARG 11 9.836 0.884 -10.102 86 HB2 ARG 11 1HB ARG 11 7.080 4.039 -8.872 87 HB3 ARG 11 2HB ARG 11 8.169 3.351 -7.674 88 HG2 ARG 11 1HG ARG 11 6.838 1.724 -9.823 89 HG3 ARG 11 2HG ARG 11 8.422 2.477 -10.011 90 HD2 ARG 11 1HD ARG 11 8.713 1.195 -7.630 91 HD3 ARG 11 2HD ARG 11 7.623 0.102 -8.481 92 HH11 ARG 11 1HH1 ARG 11 8.869 -1.277 -7.541 93 HH12 ARG 11 2HH1 ARG 11 10.079 -2.459 -7.910 94 HH21 ARG 11 1HH2 ARG 11 11.430 -0.669 -10.591 95 HH22 ARG 11 2HH2 ARG 11 11.534 -2.114 -9.642 96 H ILE 12 H ILE 12 6.741 0.518 -6.467 97 HA ILE 12 HA ILE 12 7.846 1.572 -3.999 98 HB ILE 12 HB ILE 12 5.232 0.245 -4.144 99 HG12 ILE 12 1HG1 ILE 12 6.591 1.623 -1.831 100 HG13 ILE 12 2HG1 ILE 12 5.813 2.492 -3.150 101 HG21 ILE 12 1HG2 ILE 12 6.192 -1.729 -3.356 102 HG22 ILE 12 2HG2 ILE 12 5.633 -0.912 -1.896 103 HG23 ILE 12 3HG2 ILE 12 7.343 -0.872 -2.328 104 HD11 ILE 12 3HD1 ILE 12 4.365 0.467 -1.476 105 HD12 ILE 12 1HD1 ILE 12 3.684 1.682 -2.558 106 HD13 ILE 12 2HD1 ILE 12 4.454 2.177 -1.051 107 H ARG 13 H ARG 13 9.824 0.754 -4.303 108 HA ARG 13 HA ARG 13 10.043 -2.090 -5.029 109 HE ARG 13 HE ARG 13 14.602 1.640 -5.066 110 HB2 ARG 13 1HB ARG 13 12.353 -1.567 -5.716 111 HB3 ARG 13 2HB ARG 13 11.160 -0.628 -6.600 112 HG2 ARG 13 1HG ARG 13 11.611 1.215 -4.881 113 HG3 ARG 13 2HG ARG 13 13.044 0.278 -4.452 114 HD2 ARG 13 1HD ARG 13 13.266 0.332 -7.146 115 HD3 ARG 13 2HD ARG 13 12.468 1.876 -6.858 116 HH11 ARG 13 1HH1 ARG 13 14.048 1.990 -8.494 117 HH12 ARG 13 2HH1 ARG 13 15.544 2.815 -8.779 118 HH21 ARG 13 1HH2 ARG 13 16.571 2.727 -5.439 119 HH22 ARG 13 2HH2 ARG 13 16.977 3.234 -7.044 120 H PHE 14 H PHE 14 11.659 -3.378 -4.042 121 HA PHE 14 HA PHE 14 12.525 -2.493 -1.377 122 HD1 PHE 14 HD1 PHE 14 9.806 -2.324 -1.397 123 HD2 PHE 14 HD2 PHE 14 11.345 -5.395 1.127 124 HE1 PHE 14 HE1 PHE 14 8.385 -1.526 0.439 125 HE2 PHE 14 HE2 PHE 14 9.924 -4.593 2.964 126 HZ PHE 14 HZ PHE 14 8.440 -2.659 2.621 127 HB2 PHE 14 1HB PHE 14 10.900 -4.857 -2.135 128 HB3 PHE 14 2HB PHE 14 12.207 -5.164 -0.997 129 H GLU 15 H GLU 15 14.574 -3.106 -0.815 130 HA GLU 15 HA GLU 15 16.536 -3.412 -2.643 131 HB2 GLU 15 1HB GLU 15 16.332 -4.036 0.231 132 HB3 GLU 15 2HB GLU 15 17.619 -4.878 -0.616 133 HG2 GLU 15 1HG GLU 15 18.096 -2.600 0.498 134 HG3 GLU 15 2HG GLU 15 18.765 -2.955 -1.090 135 H SER 16 H SER 16 14.477 -5.981 -1.489 136 HA SER 16 HA SER 16 15.965 -7.859 -3.207 137 HG SER 16 HG SER 16 15.348 -7.979 0.496 138 HB2 SER 16 1HB SER 16 14.791 -9.583 -1.570 139 HB3 SER 16 2HB SER 16 16.323 -8.817 -1.151 140 H ALA 17 H ALA 17 13.537 -6.085 -3.758 141 HA ALA 17 HA ALA 17 12.149 -7.949 -5.364 142 HB1 ALA 17 3HB ALA 17 10.146 -7.133 -3.394 143 HB2 ALA 17 1HB ALA 17 11.366 -8.243 -2.768 144 HB3 ALA 17 2HB ALA 17 10.406 -8.692 -4.175 145 H GLU 18 H GLU 18 10.420 -7.073 -6.595 146 HA GLU 18 HA GLU 18 10.276 -4.128 -6.545 147 HB2 GLU 18 1HB GLU 18 9.981 -4.185 -8.962 148 HB3 GLU 18 2HB GLU 18 11.476 -4.994 -8.513 149 HG2 GLU 18 1HG GLU 18 9.644 -7.042 -8.528 150 HG3 GLU 18 2HG GLU 18 9.127 -6.027 -9.873 151 H CYS 19 H CYS 19 8.237 -3.166 -7.116 152 HA CYS 19 HA CYS 19 5.930 -4.844 -7.511 153 HG CYS 19 HG CYS 19 6.795 -3.888 -3.415 154 HB2 CYS 19 1HB CYS 19 5.151 -3.400 -5.182 155 HB3 CYS 19 2HB CYS 19 5.249 -5.142 -5.402 156 H GLU 20 H GLU 20 3.998 -3.709 -7.989 157 HA GLU 20 HA GLU 20 4.210 -0.789 -8.181 158 HB2 GLU 20 1HB GLU 20 3.526 -2.646 -10.471 159 HB3 GLU 20 2HB GLU 20 3.150 -0.932 -10.480 160 HG2 GLU 20 1HG GLU 20 5.941 -1.633 -9.863 161 HG3 GLU 20 2HG GLU 20 5.390 -1.973 -11.501 162 H VAL 21 H VAL 21 2.186 0.303 -8.191 163 HA VAL 21 HA VAL 21 -0.243 -1.254 -7.996 164 HB VAL 21 HB VAL 21 -0.365 -1.444 -5.791 165 HG11 VAL 21 1HG1 VAL 21 2.171 0.178 -5.742 166 HG12 VAL 21 2HG1 VAL 21 1.994 -1.577 -5.644 167 HG13 VAL 21 3HG1 VAL 21 1.452 -0.560 -4.307 168 HG21 VAL 21 3HG2 VAL 21 -0.653 0.528 -4.349 169 HG22 VAL 21 1HG2 VAL 21 -1.616 0.637 -5.822 170 HG23 VAL 21 2HG2 VAL 21 -0.123 1.563 -5.674 171 H GLU 22 H GLU 22 -2.072 -0.128 -8.398 172 HA GLU 22 HA GLU 22 -1.728 2.632 -9.296 173 HB2 GLU 22 1HB GLU 22 -4.015 0.694 -9.699 174 HB3 GLU 22 2HB GLU 22 -3.930 2.312 -10.382 175 HG2 GLU 22 1HG GLU 22 -2.982 1.405 -12.162 176 HG3 GLU 22 2HG GLU 22 -1.557 1.116 -11.165 177 H LEU 23 H LEU 23 -4.062 3.851 -9.011 178 HA LEU 23 HA LEU 23 -5.180 3.389 -6.391 179 HG LEU 23 HG LEU 23 -5.616 6.585 -6.100 180 HB2 LEU 23 1HB LEU 23 -3.398 4.627 -5.558 181 HB3 LEU 23 2HB LEU 23 -3.329 5.667 -6.962 182 HD11 LEU 23 1HD1 LEU 23 -6.322 5.395 -4.310 183 HD12 LEU 23 2HD1 LEU 23 -5.261 6.500 -3.438 184 HD13 LEU 23 3HD1 LEU 23 -4.693 4.885 -3.864 185 HD21 LEU 23 3HD2 LEU 23 -2.923 7.138 -4.883 186 HD22 LEU 23 1HD2 LEU 23 -4.347 8.121 -4.545 187 HD23 LEU 23 2HD2 LEU 23 -3.732 7.999 -6.193 188 H TYR 24 H TYR 24 -7.171 4.293 -6.111 189 HA TYR 24 HA TYR 24 -8.194 5.936 -8.334 190 HD1 TYR 24 HD1 TYR 24 -8.098 4.828 -10.063 191 HD2 TYR 24 HD2 TYR 24 -9.815 1.614 -7.866 192 HE1 TYR 24 HE1 TYR 24 -7.349 3.250 -11.794 193 HE2 TYR 24 HE2 TYR 24 -9.070 0.028 -9.590 194 HH TYR 24 HH TYR 24 -8.425 -0.005 -11.906 195 HB2 TYR 24 1HB TYR 24 -9.710 3.734 -6.895 196 HB3 TYR 24 2HB TYR 24 -10.364 4.790 -8.141 197 H GLU 25 H GLU 25 -9.702 7.524 -7.841 198 HA GLU 25 HA GLU 25 -9.351 8.895 -5.455 199 HB2 GLU 25 1HB GLU 25 -11.635 9.058 -7.418 200 HB3 GLU 25 2HB GLU 25 -11.393 10.193 -6.096 201 HG2 GLU 25 1HG GLU 25 -9.606 11.197 -7.098 202 HG3 GLU 25 2HG GLU 25 -9.141 9.747 -7.986 203 H GLU 26 H GLU 26 -11.167 6.061 -5.800 204 HA GLU 26 HA GLU 26 -13.426 6.363 -4.314 205 HB2 GLU 26 1HB GLU 26 -13.321 4.050 -3.787 206 HB3 GLU 26 2HB GLU 26 -12.546 4.236 -5.353 207 HG2 GLU 26 1HG GLU 26 -10.343 4.233 -4.166 208 HG3 GLU 26 2HG GLU 26 -11.215 3.820 -2.690 209 H TRP 27 H TRP 27 -10.141 6.500 -3.156 210 HA TRP 27 HA TRP 27 -10.855 6.341 -0.374 211 HD1 TRP 27 HD1 TRP 27 -9.801 7.795 1.472 212 HE1 TRP 27 HE1 TRP 27 -7.956 8.538 3.106 213 HE3 TRP 27 HE3 TRP 27 -5.704 6.394 -1.240 214 HZ2 TRP 27 HZ2 TRP 27 -5.132 8.528 3.227 215 HZ3 TRP 27 HZ3 TRP 27 -3.467 6.792 -0.296 216 HH2 TRP 27 HH2 TRP 27 -3.189 7.838 1.892 217 HB2 TRP 27 1HB TRP 27 -8.683 5.518 -0.929 218 HB3 TRP 27 2HB TRP 27 -8.293 6.968 -1.847 219 H ALA 28 H ALA 28 -9.550 8.892 -2.510 220 HA ALA 28 HA ALA 28 -11.222 10.922 -2.118 221 HB1 ALA 28 3HB ALA 28 -9.950 12.180 -0.139 222 HB2 ALA 28 1HB ALA 28 -9.714 10.519 0.405 223 HB3 ALA 28 2HB ALA 28 -11.344 11.138 0.142 224 HA PRO 29 HA PRO 29 -8.016 12.369 -4.915 225 HB2 PRO 29 1HB PRO 29 -9.223 14.970 -4.850 226 HB3 PRO 29 2HB PRO 29 -9.268 13.778 -6.147 227 HG2 PRO 29 1HG PRO 29 -11.300 14.436 -4.149 228 HG3 PRO 29 2HG PRO 29 -11.469 13.544 -5.668 229 HD2 PRO 29 1HD PRO 29 -11.633 12.403 -3.183 230 HD3 PRO 29 2HD PRO 29 -11.160 11.523 -4.648 231 H GLU 30 H GLU 30 -9.106 14.170 -2.061 232 HA GLU 30 HA GLU 30 -6.948 15.954 -1.892 233 HB2 GLU 30 1HB GLU 30 -8.835 14.862 0.188 234 HB3 GLU 30 2HB GLU 30 -7.604 16.057 0.570 235 HG2 GLU 30 1HG GLU 30 -9.439 17.380 0.202 236 HG3 GLU 30 2HG GLU 30 -8.671 17.392 -1.386 237 H THR 31 H THR 31 -7.463 12.808 -0.307 238 HA THR 31 HA THR 31 -5.012 12.788 1.119 239 HB THR 31 HB THR 31 -5.641 10.101 0.499 240 HG1 THR 31 HG1 THR 31 -7.625 10.328 -0.188 241 HG21 THR 31 3HG2 THR 31 -6.175 11.857 2.863 242 HG22 THR 31 1HG2 THR 31 -5.053 10.505 2.696 243 HG23 THR 31 2HG2 THR 31 -6.787 10.205 2.803 244 H VAL 32 H VAL 32 -5.889 11.489 -2.064 245 HA VAL 32 HA VAL 32 -3.560 10.193 -2.749 246 HB VAL 32 HB VAL 32 -5.231 11.882 -4.616 247 HG11 VAL 32 1HG1 VAL 32 -4.474 9.853 -6.135 248 HG12 VAL 32 2HG1 VAL 32 -3.117 9.832 -5.009 249 HG13 VAL 32 3HG1 VAL 32 -3.469 11.288 -5.937 250 HG21 VAL 32 3HG2 VAL 32 -6.870 10.514 -3.872 251 HG22 VAL 32 1HG2 VAL 32 -5.738 9.295 -3.287 252 HG23 VAL 32 2HG2 VAL 32 -6.131 9.383 -5.004 253 H ARG 33 H ARG 33 -4.203 13.631 -2.640 254 HA ARG 33 HA ARG 33 -2.069 14.561 -4.183 255 HE ARG 33 HE ARG 33 -1.756 18.685 -1.501 256 HB2 ARG 33 1HB ARG 33 -4.060 15.855 -3.177 257 HB3 ARG 33 2HB ARG 33 -3.068 15.995 -1.733 258 HG2 ARG 33 1HG ARG 33 -1.360 17.180 -2.996 259 HG3 ARG 33 2HG ARG 33 -2.308 16.997 -4.474 260 HD2 ARG 33 1HD ARG 33 -3.094 19.029 -3.934 261 HD3 ARG 33 2HD ARG 33 -4.143 18.124 -2.844 262 HH11 ARG 33 1HH1 ARG 33 -4.522 20.375 -2.793 263 HH12 ARG 33 2HH1 ARG 33 -4.429 21.665 -1.641 264 HH21 ARG 33 1HH2 ARG 33 -1.632 20.381 0.015 265 HH22 ARG 33 2HH2 ARG 33 -2.788 21.669 -0.048 266 H ALA 34 H ALA 34 -2.187 13.556 -0.806 267 HA ALA 34 HA ALA 34 0.391 14.523 -0.104 268 HB1 ALA 34 3HB ALA 34 0.021 12.521 1.654 269 HB2 ALA 34 1HB ALA 34 -1.643 12.789 1.130 270 HB3 ALA 34 2HB ALA 34 -0.710 14.119 1.819 271 H ILE 35 H ILE 35 -0.776 11.320 -1.107 272 HA ILE 35 HA ILE 35 1.614 9.908 -0.899 273 HB ILE 35 HB ILE 35 0.170 9.222 -3.356 274 HG12 ILE 35 1HG1 ILE 35 -1.729 10.186 -2.115 275 HG13 ILE 35 2HG1 ILE 35 -1.881 8.440 -2.278 276 HG21 ILE 35 1HG2 ILE 35 0.150 7.013 -2.313 277 HG22 ILE 35 2HG2 ILE 35 0.746 7.720 -0.811 278 HG23 ILE 35 3HG2 ILE 35 1.753 7.747 -2.259 279 HD11 ILE 35 3HD1 ILE 35 -2.426 9.541 -0.019 280 HD12 ILE 35 1HD1 ILE 35 -0.677 9.630 0.181 281 HD13 ILE 35 2HD1 ILE 35 -1.459 8.064 -0.037 282 H ALA 36 H ALA 36 0.327 11.718 -3.733 283 HA ALA 36 HA ALA 36 2.559 11.339 -5.405 284 HB1 ALA 36 3HB ALA 36 1.447 12.623 -6.882 285 HB2 ALA 36 1HB ALA 36 1.094 13.878 -5.693 286 HB3 ALA 36 2HB ALA 36 0.110 12.415 -5.751 287 H ASP 37 H ASP 37 1.930 13.563 -2.784 288 HA ASP 37 HA ASP 37 4.049 15.378 -3.430 289 HB2 ASP 37 1HB ASP 37 1.973 15.716 -1.876 290 HB3 ASP 37 2HB ASP 37 3.009 15.011 -0.639 291 H ALA 38 H ALA 38 3.874 12.324 -1.832 292 HA ALA 38 HA ALA 38 6.533 12.595 -0.673 293 HB1 ALA 38 3HB ALA 38 4.272 11.561 0.372 294 HB2 ALA 38 1HB ALA 38 5.896 11.087 0.879 295 HB3 ALA 38 2HB ALA 38 5.012 10.103 -0.289 296 H LEU 39 H LEU 39 6.753 12.544 -3.351 297 HA LEU 39 HA LEU 39 6.914 9.991 -4.546 298 HG LEU 39 HG LEU 39 6.209 13.185 -5.579 299 HB2 LEU 39 1HB LEU 39 8.424 12.504 -5.289 300 HB3 LEU 39 2HB LEU 39 8.211 11.095 -6.301 301 HD11 LEU 39 1HD1 LEU 39 6.873 13.712 -7.657 302 HD12 LEU 39 2HD1 LEU 39 5.775 12.417 -8.139 303 HD13 LEU 39 3HD1 LEU 39 7.503 12.097 -7.977 304 HD21 LEU 39 3HD2 LEU 39 4.900 11.342 -4.982 305 HD22 LEU 39 1HD2 LEU 39 5.637 10.303 -6.196 306 HD23 LEU 39 2HD2 LEU 39 4.521 11.572 -6.688 307 HA PRO 40 HA PRO 40 11.076 8.155 -4.064 308 HB2 PRO 40 1HB PRO 40 12.518 10.666 -4.847 309 HB3 PRO 40 2HB PRO 40 12.976 8.978 -5.117 310 HG2 PRO 40 1HG PRO 40 11.752 10.471 -7.017 311 HG3 PRO 40 2HG PRO 40 11.531 8.720 -6.878 312 HD2 PRO 40 1HD PRO 40 9.616 10.846 -6.411 313 HD3 PRO 40 2HD PRO 40 9.338 9.100 -6.487 314 H ILE 41 H ILE 41 10.979 7.931 -1.930 315 HA ILE 41 HA ILE 41 12.475 9.806 -0.284 316 HB ILE 41 HB ILE 41 9.573 9.114 0.210 317 HG12 ILE 41 1HG1 ILE 41 11.135 11.713 0.208 318 HG13 ILE 41 2HG1 ILE 41 9.993 11.182 -1.018 319 HG21 ILE 41 1HG2 ILE 41 9.819 10.070 2.471 320 HG22 ILE 41 2HG2 ILE 41 11.565 10.151 2.232 321 HG23 ILE 41 3HG2 ILE 41 10.753 8.588 2.269 322 HD11 ILE 41 3HD1 ILE 41 9.466 12.785 1.178 323 HD12 ILE 41 1HD1 ILE 41 8.777 11.216 1.598 324 HD13 ILE 41 2HD1 ILE 41 8.282 12.027 0.112 325 H LYS 42 H LYS 42 13.329 8.821 1.609 326 HA LYS 42 HA LYS 42 13.577 5.952 1.347 327 HB2 LYS 42 1HB LYS 42 15.096 8.103 2.614 328 HB3 LYS 42 2HB LYS 42 15.034 6.636 3.577 329 HG2 LYS 42 1HG LYS 42 16.458 5.576 2.237 330 HG3 LYS 42 2HG LYS 42 15.600 6.093 0.784 331 HD2 LYS 42 1HD LYS 42 17.466 7.291 0.393 332 HD3 LYS 42 2HD LYS 42 16.765 8.421 1.553 333 HE2 LYS 42 1HE LYS 42 18.755 8.181 2.584 334 HE3 LYS 42 2HE LYS 42 18.004 6.726 3.238 335 HZ1 LYS 42 3HZ LYS 42 19.312 6.431 0.661 336 HZ2 LYS 42 1HZ LYS 42 19.298 5.391 1.996 337 HZ3 LYS 42 2HZ LYS 42 20.338 6.726 1.974 338 H SER 43 H SER 43 12.826 4.424 2.677 339 HA SER 43 HA SER 43 11.603 5.123 5.220 340 HG SER 43 HG SER 43 9.276 3.206 2.535 341 HB2 SER 43 1HB SER 43 9.466 4.402 4.750 342 HB3 SER 43 2HB SER 43 9.899 5.116 3.203 343 H THR 44 H THR 44 11.428 3.348 6.664 344 HA THR 44 HA THR 44 13.123 1.063 5.877 345 HB THR 44 HB THR 44 12.358 1.274 8.709 346 HG1 THR 44 HG1 THR 44 13.678 3.080 9.088 347 HG21 THR 44 3HG2 THR 44 14.596 0.387 7.152 348 HG22 THR 44 1HG2 THR 44 14.206 0.071 8.844 349 HG23 THR 44 2HG2 THR 44 15.125 1.512 8.406 350 H ALA 45 H ALA 45 12.282 -0.888 5.616 351 HA ALA 45 HA ALA 45 9.442 -1.256 6.011 352 HB1 ALA 45 3HB ALA 45 9.681 -2.417 4.138 353 HB2 ALA 45 1HB ALA 45 10.563 -3.642 5.048 354 HB3 ALA 45 2HB ALA 45 11.434 -2.330 4.263 355 H ASN 46 H ASN 46 8.442 -2.536 7.396 356 HA ASN 46 HA ASN 46 10.072 -3.996 9.367 357 HB2 ASN 46 1HB ASN 46 7.531 -2.452 9.549 358 HB3 ASN 46 2HB ASN 46 7.673 -3.881 10.569 359 HD21 ASN 46 1HD2 ASN 46 7.501 -1.141 11.397 360 HD22 ASN 46 2HD2 ASN 46 8.946 -0.788 12.276 361 H ARG 47 H ARG 47 9.961 -6.222 9.245 362 HA ARG 47 HA ARG 47 8.108 -7.385 7.385 363 HE ARG 47 HE ARG 47 7.881 -10.031 7.471 364 HB2 ARG 47 1HB ARG 47 10.561 -8.183 8.727 365 HB3 ARG 47 2HB ARG 47 9.389 -9.492 8.641 366 HG2 ARG 47 1HG ARG 47 9.651 -8.008 6.147 367 HG3 ARG 47 2HG ARG 47 11.147 -8.766 6.663 368 HD2 ARG 47 1HD ARG 47 9.268 -9.999 5.195 369 HD3 ARG 47 2HD ARG 47 10.388 -10.838 6.262 370 HH11 ARG 47 1HH1 ARG 47 9.648 -12.559 5.833 371 HH12 ARG 47 2HH1 ARG 47 8.650 -13.830 6.454 372 HH21 ARG 47 1HH2 ARG 47 6.574 -11.708 8.291 373 HH22 ARG 47 2HH2 ARG 47 6.904 -13.346 7.844 374 H TRP 48 H TRP 48 6.375 -8.646 7.741 375 HA TRP 48 HA TRP 48 5.685 -9.542 10.414 376 HD1 TRP 48 HD1 TRP 48 2.054 -9.870 9.296 377 HE1 TRP 48 HE1 TRP 48 0.479 -10.206 11.302 378 HE3 TRP 48 HE3 TRP 48 4.381 -6.819 12.673 379 HZ2 TRP 48 HZ2 TRP 48 0.254 -9.296 13.966 380 HZ3 TRP 48 HZ3 TRP 48 3.422 -6.606 14.928 381 HH2 TRP 48 HH2 TRP 48 1.400 -7.819 15.560 382 HB2 TRP 48 1HB TRP 48 4.740 -7.257 10.319 383 HB3 TRP 48 2HB TRP 48 3.846 -7.697 8.867 384 H GLY 49 H GLY 49 4.130 -11.216 10.423 385 HA2 GLY 49 1HA GLY 49 4.211 -13.158 8.592 386 HA3 GLY 49 2HA GLY 49 2.762 -12.861 9.533 387 H ASP 50 H ASP 50 4.279 -12.609 6.445 388 HA ASP 50 HA ASP 50 3.524 -12.101 4.361 389 HB2 ASP 50 1HB ASP 50 0.744 -12.712 5.323 390 HB3 ASP 50 2HB ASP 50 1.464 -13.041 3.753 391 H GLU 51 H GLU 51 3.592 -9.946 6.316 392 HA GLU 51 HA GLU 51 1.897 -8.059 4.878 393 HB2 GLU 51 1HB GLU 51 1.600 -8.780 7.731 394 HB3 GLU 51 2HB GLU 51 1.593 -7.058 7.377 395 HG2 GLU 51 1HG GLU 51 -0.104 -8.632 5.600 396 HG3 GLU 51 2HG GLU 51 -0.574 -8.708 7.297 397 H ILE 52 H ILE 52 2.727 -5.954 4.828 398 HA ILE 52 HA ILE 52 5.217 -5.469 6.284 399 HB ILE 52 HB ILE 52 5.201 -6.190 3.576 400 HG12 ILE 52 1HG1 ILE 52 7.651 -5.460 3.751 401 HG13 ILE 52 2HG1 ILE 52 7.260 -4.944 5.387 402 HG21 ILE 52 1HG2 ILE 52 6.155 -4.244 2.432 403 HG22 ILE 52 2HG2 ILE 52 5.805 -3.250 3.844 404 HG23 ILE 52 3HG2 ILE 52 4.484 -3.971 2.922 405 HD11 ILE 52 3HD1 ILE 52 7.020 -7.746 4.307 406 HD12 ILE 52 1HD1 ILE 52 6.604 -7.232 5.944 407 HD13 ILE 52 2HD1 ILE 52 8.270 -7.137 5.387 408 H TYR 53 H TYR 53 5.119 -3.579 7.260 409 HA TYR 53 HA TYR 53 3.646 -1.382 5.970 410 HD1 TYR 53 HD1 TYR 53 4.895 -0.709 9.824 411 HD2 TYR 53 HD2 TYR 53 2.351 -4.048 9.110 412 HE1 TYR 53 HE1 TYR 53 5.660 -1.734 11.920 413 HE2 TYR 53 HE2 TYR 53 3.114 -5.081 11.205 414 HH TYR 53 HH TYR 53 5.111 -4.958 12.700 415 HB2 TYR 53 1HB TYR 53 2.864 -0.634 8.226 416 HB3 TYR 53 2HB TYR 53 2.190 -2.180 7.718 417 H PHE 54 H PHE 54 4.705 0.465 5.821 418 HA PHE 54 HA PHE 54 6.941 1.008 7.630 419 HD1 PHE 54 HD2 PHE 54 7.029 3.452 4.563 420 HD2 PHE 54 HD1 PHE 54 7.082 -0.662 3.495 421 HE1 PHE 54 HE2 PHE 54 6.265 4.035 2.300 422 HE2 PHE 54 HE1 PHE 54 6.315 -0.091 1.231 423 HZ PHE 54 HZ PHE 54 5.907 2.263 0.630 424 HB2 PHE 54 1HB PHE 54 8.422 1.612 5.811 425 HB3 PHE 54 2HB PHE 54 7.867 -0.040 5.574 426 H THR 55 H THR 55 7.357 3.188 7.994 427 HA THR 55 HA THR 55 5.179 4.984 7.194 428 HB THR 55 HB THR 55 7.356 5.902 9.006 429 HG1 THR 55 HG1 THR 55 7.151 4.136 10.134 430 HG21 THR 55 3HG2 THR 55 5.164 6.481 10.331 431 HG22 THR 55 1HG2 THR 55 4.429 6.304 8.737 432 HG23 THR 55 2HG2 THR 55 5.719 7.480 8.987 433 H THR 56 H THR 56 5.560 7.022 6.222 434 HA THR 56 HA THR 56 8.210 7.288 4.956 435 HB THR 56 HB THR 56 6.333 8.584 3.312 436 HG1 THR 56 HG1 THR 56 4.751 7.141 2.993 437 HG21 THR 56 3HG2 THR 56 7.018 5.925 2.405 438 HG22 THR 56 1HG2 THR 56 8.420 6.815 2.998 439 HG23 THR 56 2HG2 THR 56 7.419 7.497 1.715 440 H GLN 57 H GLN 57 6.414 8.613 7.252 441 HA GLN 57 HA GLN 57 6.645 10.602 8.367 442 HB2 GLN 57 1HB GLN 57 8.080 11.816 6.003 443 HB3 GLN 57 2HB GLN 57 8.148 12.305 7.688 444 HG2 GLN 57 1HG GLN 57 9.438 10.374 8.269 445 HG3 GLN 57 2HG GLN 57 9.231 9.690 6.658 446 HE21 GLN 57 1HE2 GLN 57 11.018 9.809 5.529 447 HE22 GLN 57 2HE2 GLN 57 12.147 11.117 5.531 448 H VAL 58 H VAL 58 5.046 10.112 5.478 449 HA VAL 58 HA VAL 58 3.905 12.778 5.323 450 HB VAL 58 HB VAL 58 4.293 11.545 3.231 451 HG11 VAL 58 1HG1 VAL 58 3.849 9.276 4.140 452 HG12 VAL 58 2HG1 VAL 58 3.023 9.604 2.616 453 HG13 VAL 58 3HG1 VAL 58 2.127 9.654 4.134 454 HG21 VAL 58 3HG2 VAL 58 1.439 12.187 3.928 455 HG22 VAL 58 1HG2 VAL 58 1.960 11.791 2.291 456 HG23 VAL 58 2HG2 VAL 58 2.620 13.207 3.107 457 H ALA 59 H ALA 59 2.337 13.376 6.655 458 HA ALA 59 HA ALA 59 0.621 11.295 7.824 459 HB1 ALA 59 3HB ALA 59 1.941 12.869 9.319 460 HB2 ALA 59 1HB ALA 59 0.219 12.701 9.661 461 HB3 ALA 59 2HB ALA 59 0.812 14.129 8.811 462 H VAL 60 H VAL 60 -0.939 11.002 6.312 463 HA VAL 60 HA VAL 60 -2.706 13.317 5.801 464 HB VAL 60 HB VAL 60 -1.574 12.698 3.727 465 HG11 VAL 60 1HG1 VAL 60 -1.209 10.278 4.491 466 HG12 VAL 60 2HG1 VAL 60 -1.549 10.554 2.784 467 HG13 VAL 60 3HG1 VAL 60 -2.823 9.967 3.848 468 HG21 VAL 60 3HG2 VAL 60 -4.496 12.104 3.967 469 HG22 VAL 60 1HG2 VAL 60 -3.679 11.919 2.414 470 HG23 VAL 60 2HG2 VAL 60 -3.688 13.486 3.225 471 H GLU 61 H GLU 61 -4.414 12.982 7.157 472 HA GLU 61 HA GLU 61 -5.659 10.311 7.075 473 HB2 GLU 61 1HB GLU 61 -4.546 11.671 9.332 474 HB3 GLU 61 2HB GLU 61 -6.283 11.524 9.562 475 HG2 GLU 61 1HG GLU 61 -6.061 9.088 9.067 476 HG3 GLU 61 2HG GLU 61 -4.312 9.308 9.070 477 H LYS 62 H LYS 62 -7.813 10.227 6.817 478 HA LYS 62 HA LYS 62 -9.396 12.661 7.124 479 HB2 LYS 62 1HB LYS 62 -8.672 12.563 4.752 480 HB3 LYS 62 2HB LYS 62 -9.410 10.976 4.608 481 HG2 LYS 62 1HG LYS 62 -11.607 11.951 5.041 482 HG3 LYS 62 2HG LYS 62 -10.869 13.547 5.199 483 HD2 LYS 62 1HD LYS 62 -10.192 12.119 2.726 484 HD3 LYS 62 2HD LYS 62 -11.900 12.529 2.895 485 HE2 LYS 62 1HE LYS 62 -10.714 14.845 3.675 486 HE3 LYS 62 2HE LYS 62 -9.568 14.263 2.467 487 HZ1 LYS 62 3HZ LYS 62 -11.877 13.879 1.199 488 HZ2 LYS 62 1HZ LYS 62 -10.968 15.299 1.069 489 HZ3 LYS 62 2HZ LYS 62 -12.282 15.231 2.131 490 H GLU 63 H GLU 63 -11.792 12.149 6.978 491 HA GLU 63 HA GLU 63 -12.259 9.544 8.239 492 HB2 GLU 63 1HB GLU 63 -14.387 10.527 9.038 493 HB3 GLU 63 2HB GLU 63 -12.973 11.412 9.588 494 HG2 GLU 63 1HG GLU 63 -14.396 12.311 7.125 495 HG3 GLU 63 2HG GLU 63 -15.073 12.673 8.710 496 H GLU 64 H GLU 64 -12.156 8.507 6.114 497 HA GLU 64 HA GLU 64 -14.751 8.024 5.092 498 HB2 GLU 64 1HB GLU 64 -14.872 9.702 3.606 499 HB3 GLU 64 2HB GLU 64 -13.175 10.104 3.798 500 HG2 GLU 64 1HG GLU 64 -12.530 8.521 2.145 501 HG3 GLU 64 2HG GLU 64 -14.154 7.838 2.081 502 H ASN 65 H ASN 65 -14.745 6.409 3.346 503 HA ASN 65 HA ASN 65 -14.012 4.535 2.295 504 HB2 ASN 65 1HB ASN 65 -12.031 6.079 1.707 505 HB3 ASN 65 2HB ASN 65 -11.163 5.237 2.991 506 HD21 ASN 65 1HD2 ASN 65 -10.019 5.020 0.679 507 HD22 ASN 65 2HD2 ASN 65 -10.304 3.493 -0.075 508 H SER 66 H SER 66 -11.345 4.678 4.602 509 HA SER 66 HA SER 66 -10.593 2.853 5.883 510 HG SER 66 HG SER 66 -11.048 5.086 8.298 511 HB2 SER 66 1HB SER 66 -12.703 4.500 7.103 512 HB3 SER 66 2HB SER 66 -12.392 2.976 7.935 513 H LYS 67 H LYS 67 -11.076 0.979 4.511 514 HA LYS 67 HA LYS 67 -13.544 -0.435 5.266 515 HB2 LYS 67 1HB LYS 67 -12.964 -1.990 3.349 516 HB3 LYS 67 2HB LYS 67 -13.429 -0.360 2.904 517 HG2 LYS 67 1HG LYS 67 -11.647 -0.765 1.521 518 HG3 LYS 67 2HG LYS 67 -10.871 0.085 2.854 519 HD2 LYS 67 1HD LYS 67 -10.338 -2.179 3.830 520 HD3 LYS 67 2HD LYS 67 -10.911 -2.878 2.319 521 HE2 LYS 67 1HE LYS 67 -9.219 -1.704 1.080 522 HE3 LYS 67 2HE LYS 67 -8.705 -0.840 2.525 523 HZ1 LYS 67 3HZ LYS 67 -7.425 -2.536 3.136 524 HZ2 LYS 67 1HZ LYS 67 -7.664 -3.186 1.595 525 HZ3 LYS 67 2HZ LYS 67 -8.644 -3.676 2.884 526 H ASP 68 H ASP 68 -13.402 -2.798 5.640 527 HA ASP 68 HA ASP 68 -10.846 -3.492 6.956 528 HB2 ASP 68 1HB ASP 68 -12.290 -4.848 8.550 529 HB3 ASP 68 2HB ASP 68 -12.382 -3.096 8.706 530 H VAL 69 H VAL 69 -12.867 -4.367 4.453 531 HA VAL 69 HA VAL 69 -11.751 -7.093 4.486 532 HB VAL 69 HB VAL 69 -14.556 -6.464 3.533 533 HG11 VAL 69 1HG1 VAL 69 -13.154 -9.109 3.882 534 HG12 VAL 69 2HG1 VAL 69 -13.411 -8.292 2.340 535 HG13 VAL 69 3HG1 VAL 69 -14.793 -8.853 3.282 536 HG21 VAL 69 3HG2 VAL 69 -14.679 -8.291 5.630 537 HG22 VAL 69 1HG2 VAL 69 -15.164 -6.597 5.676 538 HG23 VAL 69 2HG2 VAL 69 -13.539 -7.064 6.176 539 H VAL 70 H VAL 70 -11.107 -7.929 2.525 540 HA VAL 70 HA VAL 70 -11.665 -6.540 0.054 541 HB VAL 70 HB VAL 70 -9.318 -6.060 -0.509 542 HG11 VAL 70 1HG1 VAL 70 -10.870 -4.353 0.483 543 HG12 VAL 70 2HG1 VAL 70 -9.152 -4.011 0.676 544 HG13 VAL 70 3HG1 VAL 70 -10.081 -4.646 2.032 545 HG21 VAL 70 3HG2 VAL 70 -8.629 -6.454 2.398 546 HG22 VAL 70 1HG2 VAL 70 -7.543 -6.150 1.048 547 HG23 VAL 70 2HG2 VAL 70 -8.356 -7.709 1.186 548 H GLU 71 H GLU 71 -10.764 -7.600 -1.834 549 HA GLU 71 HA GLU 71 -10.601 -10.469 -1.440 550 HB2 GLU 71 1HB GLU 71 -10.364 -9.161 -4.137 551 HB3 GLU 71 2HB GLU 71 -11.031 -10.729 -3.718 552 HG2 GLU 71 1HG GLU 71 -13.019 -9.843 -2.961 553 HG3 GLU 71 2HG GLU 71 -12.344 -8.229 -2.762 554 H LEU 72 H LEU 72 -8.981 -11.794 -2.210 555 HA LEU 72 HA LEU 72 -6.381 -11.134 -1.579 556 HG LEU 72 HG LEU 72 -4.699 -12.698 -3.195 557 HB2 LEU 72 1HB LEU 72 -7.201 -13.434 -1.793 558 HB3 LEU 72 2HB LEU 72 -7.355 -13.237 -3.526 559 HD11 LEU 72 1HD1 LEU 72 -5.439 -14.815 -1.176 560 HD12 LEU 72 2HD1 LEU 72 -4.761 -13.229 -0.814 561 HD13 LEU 72 3HD1 LEU 72 -3.803 -14.417 -1.699 562 HD21 LEU 72 3HD2 LEU 72 -6.310 -15.069 -3.938 563 HD22 LEU 72 1HD2 LEU 72 -4.585 -15.320 -3.666 564 HD23 LEU 72 2HD2 LEU 72 -5.127 -14.158 -4.876 565 H GLY 73 H GLY 73 -4.825 -9.947 -2.535 566 HA2 GLY 73 1HA GLY 73 -3.469 -9.625 -4.559 567 HA3 GLY 73 2HA GLY 73 -4.967 -9.601 -5.469 568 H ASP 74 H ASP 74 -6.333 -7.835 -3.556 569 HA ASP 74 HA ASP 74 -5.575 -5.377 -4.719 570 HB2 ASP 74 1HB ASP 74 -7.433 -4.459 -3.646 571 HB3 ASP 74 2HB ASP 74 -7.872 -6.152 -3.809 572 H VAL 75 H VAL 75 -5.144 -3.371 -3.427 573 HA VAL 75 HA VAL 75 -3.194 -3.896 -1.251 574 HB VAL 75 HB VAL 75 -3.035 -1.635 -3.271 575 HG11 VAL 75 1HG1 VAL 75 -1.946 -1.363 -0.994 576 HG12 VAL 75 2HG1 VAL 75 -0.909 -1.145 -2.402 577 HG13 VAL 75 3HG1 VAL 75 -0.838 -2.647 -1.484 578 HG21 VAL 75 3HG2 VAL 75 -0.928 -3.585 -3.505 579 HG22 VAL 75 1HG2 VAL 75 -2.025 -2.961 -4.737 580 HG23 VAL 75 2HG2 VAL 75 -2.506 -4.337 -3.744 581 H ALA 76 H ALA 76 -3.092 -2.187 0.464 582 HA ALA 76 HA ALA 76 -5.104 -0.103 0.272 583 HB1 ALA 76 3HB ALA 76 -6.584 -1.578 1.198 584 HB2 ALA 76 1HB ALA 76 -5.903 -0.846 2.651 585 HB3 ALA 76 2HB ALA 76 -5.336 -2.426 2.111 586 H TYR 77 H TYR 77 -4.805 1.648 1.652 587 HA TYR 77 HA TYR 77 -2.202 1.705 3.004 588 HD1 TYR 77 HD1 TYR 77 -5.386 4.697 3.138 589 HD2 TYR 77 HD2 TYR 77 -1.178 4.951 3.666 590 HE1 TYR 77 HE1 TYR 77 -5.700 6.545 4.728 591 HE2 TYR 77 HE2 TYR 77 -1.478 6.798 5.253 592 HH TYR 77 HH TYR 77 -4.346 8.483 5.593 593 HB2 TYR 77 1HB TYR 77 -2.077 3.661 1.886 594 HB3 TYR 77 2HB TYR 77 -3.798 3.658 1.526 595 H TRP 78 H TRP 78 -2.067 1.689 5.159 596 HA TRP 78 HA TRP 78 -4.385 1.359 6.764 597 HD1 TRP 78 HD1 TRP 78 -5.079 1.440 8.810 598 HE1 TRP 78 HE1 TRP 78 -5.298 0.239 11.073 599 HE3 TRP 78 HE3 TRP 78 -0.270 -0.215 9.312 600 HZ2 TRP 78 HZ2 TRP 78 -3.649 -1.227 12.837 601 HZ3 TRP 78 HZ3 TRP 78 0.327 -1.511 11.316 602 HH2 TRP 78 HH2 TRP 78 -1.328 -2.006 13.041 603 HB2 TRP 78 1HB TRP 78 -1.935 0.537 7.142 604 HB3 TRP 78 2HB TRP 78 -1.716 2.101 7.919 605 H ILE 79 H ILE 79 -5.703 2.875 7.602 606 HA ILE 79 HA ILE 79 -5.089 5.647 7.322 607 HB ILE 79 HB ILE 79 -7.426 4.116 8.367 608 HG12 ILE 79 1HG1 ILE 79 -6.798 6.037 6.185 609 HG13 ILE 79 2HG1 ILE 79 -7.716 4.539 6.131 610 HG21 ILE 79 1HG2 ILE 79 -7.006 7.058 8.889 611 HG22 ILE 79 2HG2 ILE 79 -7.141 5.788 10.104 612 HG23 ILE 79 3HG2 ILE 79 -8.530 6.196 9.099 613 HD11 ILE 79 3HD1 ILE 79 -8.605 7.296 6.738 614 HD12 ILE 79 1HD1 ILE 79 -9.411 5.974 7.580 615 HD13 ILE 79 2HD1 ILE 79 -9.402 6.022 5.817 616 HA PRO 80 HA PRO 80 -4.883 5.803 12.171 617 HB2 PRO 80 1HB PRO 80 -4.731 2.937 12.897 618 HB3 PRO 80 2HB PRO 80 -5.629 4.247 13.668 619 HG2 PRO 80 1HG PRO 80 -6.866 2.364 12.224 620 HG3 PRO 80 2HG PRO 80 -7.418 4.049 12.227 621 HD2 PRO 80 1HD PRO 80 -5.864 2.566 10.155 622 HD3 PRO 80 2HD PRO 80 -7.134 3.781 9.964 623 H GLY 81 H GLY 81 -2.830 6.398 11.126 624 HA2 GLY 81 1HA GLY 81 -0.548 6.036 12.214 625 HA3 GLY 81 2HA GLY 81 -0.685 4.412 11.554 626 H LYS 82 H LYS 82 -2.172 6.160 9.274 627 HA LYS 82 HA LYS 82 -1.567 6.719 7.122 628 HB2 LYS 82 1HB LYS 82 0.851 8.157 8.071 629 HB3 LYS 82 2HB LYS 82 -0.418 8.690 6.982 630 HG2 LYS 82 1HG LYS 82 -1.012 10.010 8.685 631 HG3 LYS 82 2HG LYS 82 -1.771 8.560 9.340 632 HD2 LYS 82 1HD LYS 82 0.666 8.165 10.298 633 HD3 LYS 82 2HD LYS 82 0.749 9.920 10.137 634 HE2 LYS 82 1HE LYS 82 -1.749 9.098 11.333 635 HE3 LYS 82 2HE LYS 82 -0.373 8.467 12.239 636 HZ1 LYS 82 3HZ LYS 82 -0.527 10.493 13.199 637 HZ2 LYS 82 1HZ LYS 82 -1.234 11.225 11.847 638 HZ3 LYS 82 2HZ LYS 82 0.436 10.950 11.885 639 H ALA 83 H ALA 83 -0.569 4.215 7.915 640 HA ALA 83 HA ALA 83 2.046 4.134 6.555 641 HB1 ALA 83 3HB ALA 83 1.212 3.040 9.039 642 HB2 ALA 83 1HB ALA 83 2.792 2.933 8.267 643 HB3 ALA 83 2HB ALA 83 1.568 1.704 7.946 644 H ILE 84 H ILE 84 2.295 2.882 4.769 645 HA ILE 84 HA ILE 84 -0.090 1.699 3.605 646 HB ILE 84 HB ILE 84 2.525 1.333 2.258 647 HG12 ILE 84 1HG1 ILE 84 1.262 4.047 2.664 648 HG13 ILE 84 2HG1 ILE 84 2.915 3.565 3.027 649 HG21 ILE 84 1HG2 ILE 84 1.279 1.583 0.300 650 HG22 ILE 84 2HG2 ILE 84 -0.014 2.451 1.125 651 HG23 ILE 84 3HG2 ILE 84 0.203 0.722 1.400 652 HD11 ILE 84 3HD1 ILE 84 3.339 4.619 1.086 653 HD12 ILE 84 1HD1 ILE 84 1.697 4.396 0.481 654 HD13 ILE 84 2HD1 ILE 84 2.859 3.073 0.386 655 H CYS 85 H CYS 85 -0.351 -0.516 3.100 656 HA CYS 85 HA CYS 85 1.733 -2.328 4.078 657 HG CYS 85 HG CYS 85 0.280 -1.617 7.187 658 HB2 CYS 85 1HB CYS 85 -1.091 -2.902 4.880 659 HB3 CYS 85 2HB CYS 85 0.410 -3.469 5.612 660 H LEU 86 H LEU 86 2.066 -4.089 2.867 661 HA LEU 86 HA LEU 86 0.185 -4.631 0.673 662 HG LEU 86 HG LEU 86 1.344 -4.194 -1.145 663 HB2 LEU 86 1HB LEU 86 3.037 -4.672 0.925 664 HB3 LEU 86 2HB LEU 86 2.508 -6.307 0.565 665 HD11 LEU 86 1HD1 LEU 86 3.989 -3.871 -0.658 666 HD12 LEU 86 2HD1 LEU 86 3.208 -3.484 -2.192 667 HD13 LEU 86 3HD1 LEU 86 4.035 -5.030 -1.989 668 HD21 LEU 86 3HD2 LEU 86 2.048 -5.957 -2.857 669 HD22 LEU 86 1HD2 LEU 86 0.780 -6.394 -1.709 670 HD23 LEU 86 2HD2 LEU 86 2.429 -6.975 -1.467 671 H PHE 87 H PHE 87 -0.877 -6.662 0.515 672 HA PHE 87 HA PHE 87 -0.168 -8.676 2.520 673 HD1 PHE 87 HD1 PHE 87 -3.845 -8.887 0.635 674 HD2 PHE 87 HD2 PHE 87 -2.907 -5.540 3.089 675 HE1 PHE 87 HE1 PHE 87 -5.540 -7.554 -0.543 676 HE2 PHE 87 HE2 PHE 87 -4.599 -4.199 1.914 677 HZ PHE 87 HZ PHE 87 -5.920 -5.205 0.097 678 HB2 PHE 87 1HB PHE 87 -2.653 -9.088 2.858 679 HB3 PHE 87 2HB PHE 87 -2.001 -7.625 3.587 680 H PHE 88 H PHE 88 -0.310 -10.739 1.854 681 HA PHE 88 HA PHE 88 -1.784 -11.479 -0.515 682 HD1 PHE 88 HD1 PHE 88 -0.433 -9.291 -2.310 683 HD2 PHE 88 HD2 PHE 88 0.004 -13.489 -2.861 684 HE1 PHE 88 HE1 PHE 88 -1.197 -9.061 -4.638 685 HE2 PHE 88 HE2 PHE 88 -0.758 -13.266 -5.190 686 HZ PHE 88 HZ PHE 88 -1.358 -11.049 -6.082 687 HB2 PHE 88 1HB PHE 88 0.920 -10.688 -0.778 688 HB3 PHE 88 2HB PHE 88 0.898 -12.442 -0.937 689 H GLY 89 H GLY 89 -2.290 -12.362 1.965 690 HA2 GLY 89 1HA GLY 89 -2.352 -15.085 1.832 691 HA3 GLY 89 2HA GLY 89 -0.808 -14.753 2.603 692 H LYS 90 H LYS 90 -0.833 -13.554 4.630 693 HA LYS 90 HA LYS 90 -3.383 -13.822 6.071 694 HB2 LYS 90 1HB LYS 90 -2.325 -14.669 7.978 695 HB3 LYS 90 2HB LYS 90 -1.574 -15.535 6.655 696 HG2 LYS 90 1HG LYS 90 0.395 -14.937 7.483 697 HG3 LYS 90 2HG LYS 90 0.017 -13.271 7.050 698 HD2 LYS 90 1HD LYS 90 0.302 -12.906 9.254 699 HD3 LYS 90 2HD LYS 90 -1.356 -13.500 9.359 700 HE2 LYS 90 1HE LYS 90 -0.436 -14.890 10.891 701 HE3 LYS 90 2HE LYS 90 -0.059 -15.835 9.451 702 HZ1 LYS 90 3HZ LYS 90 1.883 -15.646 10.821 703 HZ2 LYS 90 1HZ LYS 90 1.760 -13.959 10.860 704 HZ3 LYS 90 2HZ LYS 90 2.132 -14.746 9.411 705 H THR 91 H THR 91 -2.762 -12.745 8.427 706 HA THR 91 HA THR 91 -1.408 -10.242 8.286 707 HB THR 91 HB THR 91 -3.937 -9.270 8.906 708 HG1 THR 91 HG1 THR 91 -5.212 -9.944 7.126 709 HG21 THR 91 3HG2 THR 91 -2.307 -9.136 6.405 710 HG22 THR 91 1HG2 THR 91 -2.586 -7.890 7.620 711 HG23 THR 91 2HG2 THR 91 -3.880 -8.349 6.514 712 HA PRO 92 HA PRO 92 -1.412 -10.107 12.738 713 HB2 PRO 92 1HB PRO 92 -3.811 -8.549 13.212 714 HB3 PRO 92 2HB PRO 92 -2.128 -8.098 13.475 715 HG2 PRO 92 1HG PRO 92 -3.888 -7.483 11.212 716 HG3 PRO 92 2HG PRO 92 -2.375 -6.703 11.702 717 HD2 PRO 92 1HD PRO 92 -2.562 -8.220 9.481 718 HD3 PRO 92 2HD PRO 92 -1.080 -8.151 10.450 719 H ILE 93 H ILE 93 -4.532 -10.670 11.188 720 HA ILE 93 HA ILE 93 -4.985 -12.891 13.030 721 HB ILE 93 HB ILE 93 -7.422 -12.290 13.162 722 HG12 ILE 93 1HG1 ILE 93 -7.296 -10.625 11.262 723 HG13 ILE 93 2HG1 ILE 93 -8.155 -10.069 12.693 724 HG21 ILE 93 1HG2 ILE 93 -6.396 -11.971 15.170 725 HG22 ILE 93 2HG2 ILE 93 -6.884 -10.312 14.822 726 HG23 ILE 93 3HG2 ILE 93 -5.225 -10.825 14.517 727 HD11 ILE 93 3HD1 ILE 93 -5.670 -9.160 13.221 728 HD12 ILE 93 1HD1 ILE 93 -6.916 -8.230 12.394 729 HD13 ILE 93 2HD1 ILE 93 -5.685 -9.079 11.460 730 H SER 94 H SER 94 -4.175 -13.845 10.905 731 HA SER 94 HA SER 94 -5.443 -13.840 8.492 732 HG SER 94 HG SER 94 -2.828 -14.701 9.831 733 HB2 SER 94 1HB SER 94 -4.853 -16.580 9.187 734 HB3 SER 94 2HB SER 94 -4.014 -15.509 8.067 735 H ASP 95 H ASP 95 -6.435 -15.610 11.391 736 HA ASP 95 HA ASP 95 -8.408 -17.244 10.427 737 HB2 ASP 95 1HB ASP 95 -8.171 -15.709 12.998 738 HB3 ASP 95 2HB ASP 95 -9.586 -16.709 12.680 739 H ASP 96 H ASP 96 -10.687 -17.059 10.180 740 HA ASP 96 HA ASP 96 -12.579 -16.093 9.351 741 HB2 ASP 96 1HB ASP 96 -11.580 -13.811 11.066 742 HB3 ASP 96 2HB ASP 96 -13.153 -13.819 10.274 743 H LYS 97 H LYS 97 -10.671 -16.176 7.497 744 HA LYS 97 HA LYS 97 -10.020 -15.311 5.502 745 HB2 LYS 97 1HB LYS 97 -12.155 -13.278 6.169 746 HB3 LYS 97 2HB LYS 97 -11.288 -13.304 4.641 747 HG2 LYS 97 1HG LYS 97 -13.428 -14.365 4.380 748 HG3 LYS 97 2HG LYS 97 -12.154 -15.574 4.217 749 HD2 LYS 97 1HD LYS 97 -12.686 -16.594 6.207 750 HD3 LYS 97 2HD LYS 97 -13.367 -15.121 6.902 751 HE2 LYS 97 1HE LYS 97 -14.759 -16.224 4.544 752 HE3 LYS 97 2HE LYS 97 -14.857 -17.180 6.023 753 HZ1 LYS 97 3HZ LYS 97 -15.419 -14.811 7.012 754 HZ2 LYS 97 1HZ LYS 97 -16.613 -15.810 6.351 755 HZ3 LYS 97 2HZ LYS 97 -15.967 -14.545 5.435 756 H ILE 98 H ILE 98 -8.828 -13.482 4.519 757 HA ILE 98 HA ILE 98 -6.856 -12.491 6.260 758 HB ILE 98 HB ILE 98 -7.658 -11.576 3.491 759 HG12 ILE 98 1HG1 ILE 98 -5.167 -13.025 4.414 760 HG13 ILE 98 2HG1 ILE 98 -6.610 -13.854 3.827 761 HG21 ILE 98 1HG2 ILE 98 -6.677 -9.659 4.518 762 HG22 ILE 98 2HG2 ILE 98 -5.469 -10.377 3.452 763 HG23 ILE 98 3HG2 ILE 98 -5.366 -10.625 5.194 764 HD11 ILE 98 3HD1 ILE 98 -5.954 -13.577 1.738 765 HD12 ILE 98 1HD1 ILE 98 -4.464 -12.847 2.332 766 HD13 ILE 98 2HD1 ILE 98 -5.857 -11.828 1.960 767 H ARG 99 H ARG 99 -6.922 -10.958 7.722 768 HA ARG 99 HA ARG 99 -8.845 -8.748 7.372 769 HE ARG 99 HE ARG 99 -11.332 -11.655 9.482 770 HB2 ARG 99 1HB ARG 99 -8.689 -10.556 9.482 771 HB3 ARG 99 2HB ARG 99 -7.876 -9.124 10.098 772 HG2 ARG 99 1HG ARG 99 -9.783 -7.977 10.281 773 HG3 ARG 99 2HG ARG 99 -10.386 -8.544 8.722 774 HD2 ARG 99 1HD ARG 99 -10.297 -10.399 11.066 775 HD3 ARG 99 2HD ARG 99 -11.611 -9.234 10.912 776 HH11 ARG 99 1HH1 ARG 99 -12.344 -8.341 9.059 777 HH12 ARG 99 2HH1 ARG 99 -13.444 -8.710 7.773 778 HH21 ARG 99 1HH2 ARG 99 -12.779 -12.142 7.792 779 HH22 ARG 99 2HH2 ARG 99 -13.691 -10.868 7.053 780 HA PRO 100 HA PRO 100 -4.777 -6.726 7.008 781 HB2 PRO 100 1HB PRO 100 -5.773 -4.411 5.954 782 HB3 PRO 100 2HB PRO 100 -5.436 -5.855 4.993 783 HG2 PRO 100 1HG PRO 100 -8.046 -4.911 6.126 784 HG3 PRO 100 2HG PRO 100 -7.695 -5.544 4.505 785 HD2 PRO 100 1HD PRO 100 -8.812 -7.072 6.407 786 HD3 PRO 100 2HD PRO 100 -7.653 -7.740 5.239 787 H ALA 101 H ALA 101 -7.746 -5.468 8.442 788 HA ALA 101 HA ALA 101 -6.614 -4.705 10.871 789 HB1 ALA 101 3HB ALA 101 -7.051 -2.086 9.701 790 HB2 ALA 101 1HB ALA 101 -5.741 -2.954 8.902 791 HB3 ALA 101 2HB ALA 101 -5.690 -2.692 10.644 792 H SER 102 H SER 102 -8.075 -2.315 11.391 793 HA SER 102 HA SER 102 -10.812 -3.359 11.170 794 HG SER 102 HG SER 102 -8.806 -3.528 13.341 795 HB2 SER 102 1HB SER 102 -10.499 -1.262 13.147 796 HB3 SER 102 2HB SER 102 -11.081 -2.915 13.350 797 H ALA 103 H ALA 103 -8.863 -1.002 9.838 798 HA ALA 103 HA ALA 103 -11.037 0.304 8.591 799 HB1 ALA 103 3HB ALA 103 -9.672 1.883 10.764 800 HB2 ALA 103 1HB ALA 103 -11.348 1.330 10.762 801 HB3 ALA 103 2HB ALA 103 -10.815 2.533 9.588 802 H VAL 104 H VAL 104 -9.411 -0.498 6.962 803 HA VAL 104 HA VAL 104 -7.418 1.624 6.475 804 HB VAL 104 HB VAL 104 -5.923 0.069 5.395 805 HG11 VAL 104 1HG1 VAL 104 -6.459 -1.541 7.779 806 HG12 VAL 104 2HG1 VAL 104 -6.378 0.194 8.073 807 HG13 VAL 104 3HG1 VAL 104 -5.019 -0.638 7.317 808 HG21 VAL 104 3HG2 VAL 104 -7.940 -1.440 4.672 809 HG22 VAL 104 1HG2 VAL 104 -7.583 -2.282 6.178 810 HG23 VAL 104 2HG2 VAL 104 -6.346 -2.143 4.932 811 H ASN 105 H ASN 105 -7.212 2.476 4.476 812 HA ASN 105 HA ASN 105 -9.503 2.278 2.751 813 HB2 ASN 105 1HB ASN 105 -6.962 3.868 2.341 814 HB3 ASN 105 2HB ASN 105 -8.504 4.132 1.545 815 HD21 ASN 105 1HD2 ASN 105 -6.909 5.932 3.175 816 HD22 ASN 105 2HD2 ASN 105 -7.938 6.448 4.461 817 H VAL 106 H VAL 106 -9.513 1.789 0.524 818 HA VAL 106 HA VAL 106 -7.597 -0.245 -0.269 819 HB VAL 106 HB VAL 106 -9.302 0.383 -2.456 820 HG11 VAL 106 1HG1 VAL 106 -9.661 -1.855 -2.490 821 HG12 VAL 106 2HG1 VAL 106 -9.848 -1.968 -0.741 822 HG13 VAL 106 3HG1 VAL 106 -8.238 -1.812 -1.447 823 HG21 VAL 106 3HG2 VAL 106 -10.939 1.442 -1.172 824 HG22 VAL 106 1HG2 VAL 106 -10.744 0.314 0.171 825 HG23 VAL 106 2HG2 VAL 106 -11.512 -0.219 -1.323 826 H ILE 107 H ILE 107 -5.765 1.042 -0.438 827 HA ILE 107 HA ILE 107 -5.577 3.381 -1.988 828 HB ILE 107 HB ILE 107 -4.055 2.361 -0.108 829 HG12 ILE 107 1HG1 ILE 107 -3.953 4.605 -1.426 830 HG13 ILE 107 2HG1 ILE 107 -2.555 4.079 -0.497 831 HG21 ILE 107 1HG2 ILE 107 -2.545 1.490 -2.559 832 HG22 ILE 107 2HG2 ILE 107 -3.384 0.406 -1.450 833 HG23 ILE 107 3HG2 ILE 107 -2.017 1.360 -0.884 834 HD11 ILE 107 3HD1 ILE 107 -2.943 4.130 -3.451 835 HD12 ILE 107 1HD1 ILE 107 -1.749 3.063 -2.719 836 HD13 ILE 107 2HD1 ILE 107 -1.637 4.804 -2.479 837 H GLY 108 H GLY 108 -6.590 0.796 -3.382 838 HA2 GLY 108 1HA GLY 108 -6.530 0.782 -5.821 839 HA3 GLY 108 2HA GLY 108 -4.803 1.072 -5.711 840 H ARG 109 H ARG 109 -4.205 -0.718 -6.908 841 HA ARG 109 HA ARG 109 -4.203 -3.206 -5.442 842 HE ARG 109 HE ARG 109 -8.965 -2.636 -8.807 843 HB2 ARG 109 1HB ARG 109 -5.326 -3.220 -8.242 844 HB3 ARG 109 2HB ARG 109 -5.243 -4.564 -7.111 845 HG2 ARG 109 1HG ARG 109 -6.890 -3.477 -5.679 846 HG3 ARG 109 2HG ARG 109 -6.956 -2.105 -6.786 847 HD2 ARG 109 1HD ARG 109 -7.396 -4.261 -8.439 848 HD3 ARG 109 2HD ARG 109 -8.244 -4.714 -6.960 849 HH11 ARG 109 1HH1 ARG 109 -9.241 -3.752 -5.512 850 HH12 ARG 109 2HH1 ARG 109 -10.709 -2.885 -5.208 851 HH21 ARG 109 1HH2 ARG 109 -10.896 -1.494 -8.410 852 HH22 ARG 109 2HH2 ARG 109 -11.649 -1.604 -6.854 853 H ILE 110 H ILE 110 -2.968 -4.918 -6.644 854 HA ILE 110 HA ILE 110 -0.582 -3.701 -7.813 855 HB ILE 110 HB ILE 110 -1.142 -6.447 -6.708 856 HG12 ILE 110 1HG1 ILE 110 1.136 -4.988 -5.649 857 HG13 ILE 110 2HG1 ILE 110 -0.343 -4.045 -5.520 858 HG21 ILE 110 1HG2 ILE 110 0.349 -6.659 -8.649 859 HG22 ILE 110 2HG2 ILE 110 1.152 -7.060 -7.135 860 HG23 ILE 110 3HG2 ILE 110 1.455 -5.503 -7.905 861 HD11 ILE 110 3HD1 ILE 110 0.064 -5.324 -3.507 862 HD12 ILE 110 1HD1 ILE 110 0.082 -6.822 -4.439 863 HD13 ILE 110 2HD1 ILE 110 -1.404 -5.880 -4.307 864 H VAL 111 H VAL 111 -0.371 -3.631 -9.945 865 HA VAL 111 HA VAL 111 -2.137 -4.877 -11.753 866 HB VAL 111 HB VAL 111 0.136 -4.358 -13.278 867 HG11 VAL 111 1HG1 VAL 111 -1.292 -2.039 -13.449 868 HG12 VAL 111 2HG1 VAL 111 -2.490 -3.165 -12.810 869 HG13 VAL 111 3HG1 VAL 111 -1.654 -3.529 -14.319 870 HG21 VAL 111 3HG2 VAL 111 -0.140 -2.117 -11.284 871 HG22 VAL 111 1HG2 VAL 111 1.015 -2.252 -12.609 872 HG23 VAL 111 2HG2 VAL 111 1.139 -3.329 -11.219 873 H ASN 112 H ASN 112 1.383 -5.425 -11.741 874 HA ASN 112 HA ASN 112 1.125 -8.264 -11.471 875 HB2 ASN 112 1HB ASN 112 0.327 -8.172 -13.748 876 HB3 ASN 112 2HB ASN 112 1.675 -7.145 -14.228 877 HD21 ASN 112 1HD2 ASN 112 2.531 -8.466 -15.748 878 HD22 ASN 112 2HD2 ASN 112 3.224 -10.010 -15.404 879 H SER 113 H SER 113 3.068 -5.468 -12.315 880 HA SER 113 HA SER 113 5.596 -6.363 -12.554 881 HG SER 113 HG SER 113 5.262 -3.915 -13.487 882 HB2 SER 113 1HB SER 113 4.882 -4.093 -10.690 883 HB3 SER 113 2HB SER 113 6.376 -4.297 -11.604 884 H MET 114 H MET 114 3.703 -6.413 -9.605 885 HA MET 114 HA MET 114 5.967 -7.277 -8.005 886 HB2 MET 114 1HB MET 114 4.301 -5.782 -7.007 887 HB3 MET 114 2HB MET 114 3.046 -6.974 -7.296 888 HG2 MET 114 1HG MET 114 5.405 -7.776 -5.683 889 HG3 MET 114 2HG MET 114 4.197 -6.725 -4.948 890 HE1 MET 114 3HE MET 114 3.925 -9.657 -3.207 891 HE2 MET 114 1HE MET 114 2.271 -9.045 -3.255 892 HE3 MET 114 2HE MET 114 3.628 -7.919 -3.233 893 H GLU 115 H GLU 115 5.976 -9.291 -6.841 894 HA GLU 115 HA GLU 115 4.375 -11.405 -8.120 895 HB2 GLU 115 1HB GLU 115 7.310 -11.407 -7.439 896 HB3 GLU 115 2HB GLU 115 6.410 -12.889 -7.726 897 HG2 GLU 115 1HG GLU 115 6.133 -12.454 -9.963 898 HG3 GLU 115 2HG GLU 115 6.324 -10.714 -9.758 899 H GLY 116 H GLY 116 6.747 -11.435 -5.476 900 HA2 GLY 116 1HA GLY 116 4.587 -12.098 -3.600 901 HA3 GLY 116 2HA GLY 116 5.941 -13.204 -3.762 902 H LEU 117 H LEU 117 5.870 -9.644 -3.679 903 HA LEU 117 HA LEU 117 8.158 -9.242 -2.254 904 HG LEU 117 HG LEU 117 7.248 -7.259 -0.209 905 HB2 LEU 117 1HB LEU 117 7.039 -7.365 -3.185 906 HB3 LEU 117 2HB LEU 117 5.595 -7.666 -2.238 907 HD11 LEU 117 1HD1 LEU 117 8.493 -5.584 -2.380 908 HD12 LEU 117 2HD1 LEU 117 9.238 -6.995 -1.630 909 HD13 LEU 117 3HD1 LEU 117 8.897 -5.561 -0.666 910 HD21 LEU 117 3HD2 LEU 117 5.992 -5.108 -1.895 911 HD22 LEU 117 1HD2 LEU 117 6.584 -4.875 -0.250 912 HD23 LEU 117 2HD2 LEU 117 5.250 -5.987 -0.557 913 H LYS 118 H LYS 118 4.946 -9.935 -0.941 914 HA LYS 118 HA LYS 118 5.234 -9.487 1.716 915 HB2 LYS 118 1HB LYS 118 3.837 -11.587 2.088 916 HB3 LYS 118 2HB LYS 118 3.166 -10.361 1.025 917 HG2 LYS 118 1HG LYS 118 2.726 -12.244 -0.179 918 HG3 LYS 118 2HG LYS 118 4.301 -11.817 -0.846 919 HD2 LYS 118 1HD LYS 118 4.195 -14.197 -0.344 920 HD3 LYS 118 2HD LYS 118 5.370 -13.395 0.698 921 HE2 LYS 118 1HE LYS 118 3.787 -15.091 1.776 922 HE3 LYS 118 2HE LYS 118 3.980 -13.529 2.570 923 HZ1 LYS 118 3HZ LYS 118 1.902 -12.815 1.814 924 HZ2 LYS 118 1HZ LYS 118 1.636 -14.413 2.306 925 HZ3 LYS 118 2HZ LYS 118 1.780 -14.047 0.661 926 H GLY 119 H GLY 119 7.014 -11.863 -0.104 927 HA2 GLY 119 1HA GLY 119 7.945 -13.214 2.313 928 HA3 GLY 119 2HA GLY 119 8.340 -13.654 0.657 929 H VAL 120 H VAL 120 8.591 -10.434 2.006 930 HA VAL 120 HA VAL 120 11.267 -10.088 1.097 931 HB VAL 120 HB VAL 120 11.132 -7.949 2.490 932 HG11 VAL 120 1HG1 VAL 120 10.500 -7.038 0.568 933 HG12 VAL 120 2HG1 VAL 120 8.853 -7.630 0.774 934 HG13 VAL 120 3HG1 VAL 120 10.065 -8.648 -0.003 935 HG21 VAL 120 3HG2 VAL 120 8.816 -9.278 3.480 936 HG22 VAL 120 1HG2 VAL 120 8.309 -7.810 2.645 937 HG23 VAL 120 2HG2 VAL 120 9.483 -7.719 3.958 938 H ALA 121 H ALA 121 13.154 -9.607 2.402 939 HA ALA 121 HA ALA 121 13.452 -11.400 4.617 940 HB1 ALA 121 3HB ALA 121 15.401 -9.276 3.723 941 HB2 ALA 121 1HB ALA 121 15.262 -10.860 2.961 942 HB3 ALA 121 2HB ALA 121 15.749 -10.735 4.651 943 H ASP 122 H ASP 122 13.806 -10.870 6.810 944 HA ASP 122 HA ASP 122 12.261 -8.810 7.859 945 HB2 ASP 122 1HB ASP 122 13.132 -9.392 10.008 946 HB3 ASP 122 2HB ASP 122 12.945 -10.875 9.075 947 H GLY 123 H GLY 123 12.542 -6.715 7.816 948 HA2 GLY 123 1HA GLY 123 13.518 -4.659 8.096 949 HA3 GLY 123 2HA GLY 123 14.906 -5.478 8.784 950 H GLU 124 H GLU 124 13.629 -3.858 6.064 951 HA GLU 124 HA GLU 124 16.241 -3.760 4.865 952 HB2 GLU 124 1HB GLU 124 15.203 -4.407 2.560 953 HB3 GLU 124 2HB GLU 124 15.747 -5.668 3.655 954 HG2 GLU 124 1HG GLU 124 13.493 -6.099 4.357 955 HG3 GLU 124 2HG GLU 124 12.899 -4.740 3.401 956 H SER 125 H SER 125 16.478 -2.093 3.325 957 HA SER 125 HA SER 125 15.123 0.248 3.864 958 HG SER 125 HG SER 125 16.394 1.857 3.120 959 HB2 SER 125 1HB SER 125 17.335 -0.238 2.525 960 HB3 SER 125 2HB SER 125 16.263 -0.154 1.128 961 H VAL 126 H VAL 126 13.943 1.615 2.281 962 HA VAL 126 HA VAL 126 12.220 0.334 0.365 963 HB VAL 126 HB VAL 126 11.001 1.522 2.869 964 HG11 VAL 126 1HG1 VAL 126 9.784 2.058 0.755 965 HG12 VAL 126 2HG1 VAL 126 8.861 1.120 1.924 966 HG13 VAL 126 3HG1 VAL 126 9.562 0.324 0.518 967 HG21 VAL 126 3HG2 VAL 126 11.767 -0.689 3.310 968 HG22 VAL 126 1HG2 VAL 126 11.059 -1.289 1.811 969 HG23 VAL 126 2HG2 VAL 126 10.014 -0.739 3.122 970 H VAL 127 H VAL 127 11.836 1.756 -1.253 971 HA VAL 127 HA VAL 127 11.975 4.628 -0.609 972 HB VAL 127 HB VAL 127 13.060 5.026 -2.804 973 HG11 VAL 127 1HG1 VAL 127 14.217 4.184 -0.434 974 HG12 VAL 127 2HG1 VAL 127 15.033 4.987 -1.773 975 HG13 VAL 127 3HG1 VAL 127 15.033 3.228 -1.670 976 HG21 VAL 127 3HG2 VAL 127 13.129 3.428 -4.338 977 HG22 VAL 127 1HG2 VAL 127 12.431 2.278 -3.198 978 HG23 VAL 127 2HG2 VAL 127 14.181 2.471 -3.293 979 H VAL 128 H VAL 128 9.976 5.366 -0.857 980 HA VAL 128 HA VAL 128 8.168 4.249 -2.822 981 HB VAL 128 HB VAL 128 7.361 6.742 -1.470 982 HG11 VAL 128 1HG1 VAL 128 5.574 5.701 -2.457 983 HG12 VAL 128 2HG1 VAL 128 5.453 5.057 -0.821 984 HG13 VAL 128 3HG1 VAL 128 6.177 4.082 -2.097 985 HG21 VAL 128 3HG2 VAL 128 8.388 6.136 0.473 986 HG22 VAL 128 1HG2 VAL 128 8.364 4.416 0.082 987 HG23 VAL 128 2HG2 VAL 128 6.895 5.213 0.641 988 H GLU 129 H GLU 129 7.801 5.102 -4.844 989 HA GLU 129 HA GLU 129 8.313 7.906 -5.360 990 HB2 GLU 129 1HB GLU 129 9.729 7.290 -7.381 991 HB3 GLU 129 2HB GLU 129 10.498 7.127 -5.808 992 HG2 GLU 129 1HG GLU 129 9.708 4.662 -5.967 993 HG3 GLU 129 2HG GLU 129 9.568 5.006 -7.691 994 H ARG 130 H ARG 130 6.802 8.687 -6.722 995 HA ARG 130 HA ARG 130 4.859 6.936 -7.876 996 HE ARG 130 HE ARG 130 3.817 7.942 -11.227 997 HB2 ARG 130 1HB ARG 130 4.268 9.158 -7.006 998 HB3 ARG 130 2HB ARG 130 5.268 9.910 -8.239 999 HG2 ARG 130 1HG ARG 130 3.157 8.074 -9.185 1000 HG3 ARG 130 2HG ARG 130 2.633 9.601 -8.474 1001 HD2 ARG 130 1HD ARG 130 3.048 10.589 -10.416 1002 HD3 ARG 130 2HD ARG 130 4.760 10.247 -10.178 1003 HH11 ARG 130 1HH1 ARG 130 3.576 11.281 -12.215 1004 HH12 ARG 130 2HH1 ARG 130 3.480 10.904 -13.904 1005 HH21 ARG 130 1HH2 ARG 130 3.690 7.446 -13.447 1006 HH22 ARG 130 2HH2 ARG 130 3.546 8.727 -14.603 1007 H ALA 131 H ALA 131 6.095 5.641 -9.296 1008 HA ALA 131 HA ALA 131 7.189 5.067 -11.229 1009 HB1 ALA 131 3HB ALA 131 4.906 5.440 -11.993 1010 HB2 ALA 131 1HB ALA 131 6.076 5.861 -13.244 1011 HB3 ALA 131 2HB ALA 131 5.283 7.133 -12.315
Contact the webmaster for help, if required. Tuesday, May 14, 2024 2:30:16 AM GMT (wattos1)