NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
542252 | 2lsj | 18433 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H ALA 23 H ALA 23 3.928 13.657 13.502 2 HA ALA 23 HA ALA 23 1.943 11.626 14.207 3 HB1 ALA 23 HB1 ALA 23 2.177 13.423 15.792 4 HB2 ALA 23 HB2 ALA 23 1.910 14.623 14.527 5 HB3 ALA 23 HB3 ALA 23 0.600 13.544 15.010 6 H ALA 24 H ALA 24 2.677 11.796 11.484 7 HA ALA 24 HA ALA 24 0.202 12.875 10.300 8 HB1 ALA 24 HB1 ALA 24 1.868 12.718 8.173 9 HB2 ALA 24 HB2 ALA 24 1.632 14.171 9.146 10 HB3 ALA 24 HB3 ALA 24 3.007 13.113 9.459 11 HA PRO 25 HA PRO 25 -0.797 8.889 8.760 12 HB2 PRO 25 HB2 PRO 25 -1.824 9.456 6.311 13 HB3 PRO 25 HB3 PRO 25 -2.670 9.830 7.818 14 HG2 PRO 25 HG2 PRO 25 -1.044 11.627 6.060 15 HG3 PRO 25 HG3 PRO 25 -2.596 11.946 6.857 16 HD2 PRO 25 HD2 PRO 25 -0.240 12.845 7.844 17 HD3 PRO 25 HD3 PRO 25 -1.603 12.397 8.888 18 H ASN 26 H ASN 26 1.427 8.156 8.624 19 HA ASN 26 HA ASN 26 2.367 7.954 5.839 20 HB2 ASN 26 HB2 ASN 26 4.272 7.816 8.152 21 HB3 ASN 26 HB3 ASN 26 4.592 8.240 6.473 22 HD21 ASN 26 HD21 ASN 26 2.681 10.141 6.012 23 HD22 ASN 26 HD22 ASN 26 2.987 11.524 7.001 24 H LEU 27 H LEU 27 3.033 5.967 5.130 25 HA LEU 27 HA LEU 27 2.576 3.727 6.983 26 HB2 LEU 27 HB2 LEU 27 1.188 4.085 4.813 27 HB3 LEU 27 HB3 LEU 27 2.616 3.442 4.006 28 HG LEU 27 HG LEU 27 2.267 1.501 5.797 29 HD11 LEU 27 HD11 LEU 27 -0.060 1.041 6.185 30 HD12 LEU 27 HD12 LEU 27 -0.537 2.478 5.281 31 HD13 LEU 27 HD13 LEU 27 0.319 2.644 6.814 32 HD21 LEU 27 HD21 LEU 27 2.233 1.537 3.210 33 HD22 LEU 27 HD22 LEU 27 0.479 1.520 3.395 34 HD23 LEU 27 HD23 LEU 27 1.448 0.204 4.059 35 H ALA 28 H ALA 28 4.403 2.883 7.722 36 HA ALA 28 HA ALA 28 6.556 2.148 7.860 37 HB1 ALA 28 HB1 ALA 28 5.395 0.848 5.794 38 HB2 ALA 28 HB2 ALA 28 6.785 1.571 4.984 39 HB3 ALA 28 HB3 ALA 28 7.027 0.520 6.379 40 H GLY 29 H GLY 29 6.084 4.979 7.172 41 HA2 GLY 29 HA2 GLY 29 7.734 6.671 7.090 42 HA3 GLY 29 HA3 GLY 29 8.802 5.557 6.251 43 H ALA 30 H ALA 30 5.643 5.551 5.026 44 HA ALA 30 HA ALA 30 6.508 7.238 2.771 45 HB1 ALA 30 HB1 ALA 30 5.717 4.634 2.694 46 HB2 ALA 30 HB2 ALA 30 4.212 5.476 2.322 47 HB3 ALA 30 HB3 ALA 30 5.646 5.753 1.332 48 H VAL 31 H VAL 31 5.621 9.192 2.804 49 HA VAL 31 HA VAL 31 3.058 9.622 4.121 50 HB VAL 31 HB VAL 31 4.828 11.699 2.833 51 HG11 VAL 31 HG11 VAL 31 3.528 12.849 4.950 52 HG12 VAL 31 HG12 VAL 31 3.027 12.958 3.262 53 HG13 VAL 31 HG13 VAL 31 2.313 11.739 4.318 54 HG21 VAL 31 HG21 VAL 31 6.318 11.093 4.410 55 HG22 VAL 31 HG22 VAL 31 5.255 11.996 5.489 56 HG23 VAL 31 HG23 VAL 31 5.110 10.243 5.374 57 H GLU 32 H GLU 32 4.522 9.834 0.922 58 HA GLU 32 HA GLU 32 2.255 11.002 -0.348 59 HB2 GLU 32 HB2 GLU 32 4.476 9.390 -1.613 60 HB3 GLU 32 HB3 GLU 32 3.390 10.502 -2.432 61 HG2 GLU 32 HG2 GLU 32 4.352 12.377 -1.297 62 HG3 GLU 32 HG3 GLU 32 5.327 11.318 -0.281 63 H PHE 33 H PHE 33 0.635 10.061 -1.550 64 HA PHE 33 HA PHE 33 -0.357 7.588 -0.711 65 HB2 PHE 33 HB2 PHE 33 -1.929 9.105 -1.596 66 HB3 PHE 33 HB3 PHE 33 -0.994 9.348 -3.069 67 HD1 PHE 33 HD1 PHE 33 -2.846 6.707 -1.211 68 HD2 PHE 33 HD2 PHE 33 -1.581 8.211 -4.988 69 HE1 PHE 33 HE1 PHE 33 -4.194 4.987 -2.344 70 HE2 PHE 33 HE2 PHE 33 -2.928 6.494 -6.125 71 HZ PHE 33 HZ PHE 33 -4.237 4.881 -4.804 72 H SER 34 H SER 34 1.185 8.451 -3.804 73 HA SER 34 HA SER 34 1.129 5.988 -5.037 74 HB2 SER 34 HB2 SER 34 2.011 7.447 -6.526 75 HB3 SER 34 HB3 SER 34 2.772 8.418 -5.267 76 HG SER 34 HG SER 34 3.730 6.010 -6.415 77 H ASP 35 H ASP 35 3.354 7.172 -2.583 78 HA ASP 35 HA ASP 35 5.107 4.912 -2.729 79 HB2 ASP 35 HB2 ASP 35 5.537 7.330 -1.799 80 HB3 ASP 35 HB3 ASP 35 4.912 6.651 -0.299 81 H VAL 36 H VAL 36 2.248 5.751 -0.906 82 HA VAL 36 HA VAL 36 2.490 3.727 1.075 83 HB VAL 36 HB VAL 36 0.017 5.153 0.087 84 HG11 VAL 36 HG11 VAL 36 -1.140 3.769 1.380 85 HG12 VAL 36 HG12 VAL 36 0.339 2.961 1.902 86 HG13 VAL 36 HG13 VAL 36 -0.249 4.376 2.775 87 HG21 VAL 36 HG21 VAL 36 1.092 5.859 2.705 88 HG22 VAL 36 HG22 VAL 36 2.188 6.232 1.375 89 HG23 VAL 36 HG23 VAL 36 0.554 6.896 1.385 90 H LYS 37 H LYS 37 0.363 3.957 -1.781 91 HA LYS 37 HA LYS 37 -0.717 1.404 -1.647 92 HB2 LYS 37 HB2 LYS 37 -1.158 1.661 -4.081 93 HB3 LYS 37 HB3 LYS 37 -1.645 3.060 -3.133 94 HG2 LYS 37 HG2 LYS 37 0.158 4.348 -3.904 95 HG3 LYS 37 HG3 LYS 37 1.005 2.933 -4.532 96 HD2 LYS 37 HD2 LYS 37 -1.517 2.994 -5.789 97 HD3 LYS 37 HD3 LYS 37 -0.882 4.640 -5.846 98 HE2 LYS 37 HE2 LYS 37 1.234 3.732 -6.771 99 HE3 LYS 37 HE3 LYS 37 0.491 2.135 -6.813 100 HZ1 LYS 37 HZ1 LYS 37 0.463 3.777 -8.876 101 HZ2 LYS 37 HZ2 LYS 37 -0.962 4.293 -8.124 102 HZ3 LYS 37 HZ3 LYS 37 -0.786 2.673 -8.580 103 H THR 38 H THR 38 2.376 2.476 -2.860 104 HA THR 38 HA THR 38 3.046 0.130 -4.304 105 HB THR 38 HB THR 38 4.815 2.244 -3.065 106 HG1 THR 38 HG1 THR 38 4.338 1.854 -5.822 107 HG21 THR 38 HG21 THR 38 6.574 1.361 -4.569 108 HG22 THR 38 HG22 THR 38 5.513 0.012 -4.976 109 HG23 THR 38 HG23 THR 38 6.099 0.206 -3.324 110 H LEU 39 H LEU 39 3.537 1.140 -0.959 111 HA LEU 39 HA LEU 39 5.197 -1.051 -0.234 112 HB2 LEU 39 HB2 LEU 39 3.537 0.872 1.377 113 HB3 LEU 39 HB3 LEU 39 4.534 -0.382 2.112 114 HG LEU 39 HG LEU 39 5.529 1.907 0.416 115 HD11 LEU 39 HD11 LEU 39 4.855 2.749 2.531 116 HD12 LEU 39 HD12 LEU 39 6.609 2.580 2.579 117 HD13 LEU 39 HD13 LEU 39 5.587 1.386 3.380 118 HD21 LEU 39 HD21 LEU 39 7.759 1.069 1.339 119 HD22 LEU 39 HD22 LEU 39 7.020 0.142 0.035 120 HD23 LEU 39 HD23 LEU 39 6.907 -0.432 1.699 121 H LEU 40 H LEU 40 1.731 -0.492 -0.219 122 HA LEU 40 HA LEU 40 1.064 -2.822 1.282 123 HB2 LEU 40 HB2 LEU 40 -0.699 -1.349 -0.662 124 HB3 LEU 40 HB3 LEU 40 -1.202 -2.366 0.687 125 HG LEU 40 HG LEU 40 0.385 0.107 1.228 126 HD11 LEU 40 HD11 LEU 40 -2.433 0.600 1.439 127 HD12 LEU 40 HD12 LEU 40 -2.012 0.170 -0.218 128 HD13 LEU 40 HD13 LEU 40 -1.197 1.516 0.577 129 HD21 LEU 40 HD21 LEU 40 -1.812 -1.323 2.721 130 HD22 LEU 40 HD22 LEU 40 -0.889 0.064 3.301 131 HD23 LEU 40 HD23 LEU 40 -0.083 -1.482 3.033 132 H LYS 41 H LYS 41 1.048 -2.052 -2.187 133 HA LYS 41 HA LYS 41 0.042 -4.429 -3.178 134 HB2 LYS 41 HB2 LYS 41 0.947 -2.164 -4.314 135 HB3 LYS 41 HB3 LYS 41 2.305 -3.223 -4.670 136 HG2 LYS 41 HG2 LYS 41 0.412 -4.839 -5.505 137 HG3 LYS 41 HG3 LYS 41 -0.500 -3.335 -5.651 138 HD2 LYS 41 HD2 LYS 41 0.511 -3.661 -7.753 139 HD3 LYS 41 HD3 LYS 41 1.490 -2.432 -6.950 140 HE2 LYS 41 HE2 LYS 41 3.037 -4.267 -6.230 141 HE3 LYS 41 HE3 LYS 41 2.114 -5.365 -7.255 142 HZ1 LYS 41 HZ1 LYS 41 2.764 -3.137 -8.792 143 HZ2 LYS 41 HZ2 LYS 41 3.347 -4.716 -8.956 144 HZ3 LYS 41 HZ3 LYS 41 4.178 -3.604 -7.989 145 H GLU 42 H GLU 42 3.395 -3.623 -2.350 146 HA GLU 42 HA GLU 42 4.402 -6.194 -3.114 147 HB2 GLU 42 HB2 GLU 42 6.503 -5.434 -2.083 148 HB3 GLU 42 HB3 GLU 42 5.848 -4.239 -3.194 149 HG2 GLU 42 HG2 GLU 42 4.868 -3.068 -1.208 150 HG3 GLU 42 HG3 GLU 42 5.784 -4.179 -0.191 151 H TRP 43 H TRP 43 3.547 -4.629 -0.061 152 HA TRP 43 HA TRP 43 4.426 -6.688 1.647 153 HB2 TRP 43 HB2 TRP 43 3.972 -4.522 2.569 154 HB3 TRP 43 HB3 TRP 43 2.308 -4.564 1.997 155 HD1 TRP 43 HD1 TRP 43 4.476 -6.763 4.368 156 HE1 TRP 43 HE1 TRP 43 3.021 -7.396 6.395 157 HE3 TRP 43 HE3 TRP 43 0.128 -4.450 3.000 158 HZ2 TRP 43 HZ2 TRP 43 0.380 -6.972 7.294 159 HZ3 TRP 43 HZ3 TRP 43 -1.817 -4.612 4.499 160 HH2 TRP 43 HH2 TRP 43 -1.692 -5.848 6.601 161 H ILE 44 H ILE 44 1.829 -6.565 -0.525 162 HA ILE 44 HA ILE 44 0.353 -8.663 0.901 163 HB ILE 44 HB ILE 44 -0.444 -7.013 -1.500 164 HG12 ILE 44 HG12 ILE 44 -1.805 -7.001 1.174 165 HG13 ILE 44 HG13 ILE 44 -0.358 -6.030 0.922 166 HG21 ILE 44 HG21 ILE 44 -2.701 -8.056 -1.076 167 HG22 ILE 44 HG22 ILE 44 -1.476 -9.128 -1.751 168 HG23 ILE 44 HG23 ILE 44 -1.877 -9.216 -0.036 169 HD11 ILE 44 HD11 ILE 44 -1.462 -4.498 -0.260 170 HD12 ILE 44 HD12 ILE 44 -2.369 -5.709 -1.166 171 HD13 ILE 44 HD13 ILE 44 -2.909 -5.220 0.440 172 H THR 45 H THR 45 2.542 -8.186 -1.653 173 HA THR 45 HA THR 45 1.788 -10.695 -2.972 174 HB THR 45 HB THR 45 3.407 -10.051 -4.722 175 HG1 THR 45 HG1 THR 45 4.645 -8.302 -4.509 176 HG21 THR 45 HG21 THR 45 1.080 -8.389 -3.968 177 HG22 THR 45 HG22 THR 45 1.393 -9.296 -5.448 178 HG23 THR 45 HG23 THR 45 2.150 -7.724 -5.201 179 H THR 46 H THR 46 4.744 -9.076 -1.798 180 HA THR 46 HA THR 46 6.352 -11.399 -1.901 181 HB THR 46 HB THR 46 7.231 -9.054 -1.842 182 HG1 THR 46 HG1 THR 46 8.959 -10.159 -1.344 183 HG21 THR 46 HG21 THR 46 7.429 -8.813 1.004 184 HG22 THR 46 HG22 THR 46 5.731 -8.938 0.545 185 HG23 THR 46 HG23 THR 46 6.744 -7.679 -0.159 186 H ILE 47 H ILE 47 3.951 -10.393 0.291 187 HA ILE 47 HA ILE 47 4.789 -12.490 2.180 188 HB ILE 47 HB ILE 47 3.588 -9.809 2.883 189 HG12 ILE 47 HG12 ILE 47 5.969 -10.544 4.325 190 HG13 ILE 47 HG13 ILE 47 6.265 -10.660 2.593 191 HG21 ILE 47 HG21 ILE 47 3.786 -10.614 5.234 192 HG22 ILE 47 HG22 ILE 47 2.571 -11.463 4.281 193 HG23 ILE 47 HG23 ILE 47 4.130 -12.224 4.602 194 HD11 ILE 47 HD11 ILE 47 5.048 -8.287 2.659 195 HD12 ILE 47 HD12 ILE 47 5.748 -8.298 4.277 196 HD13 ILE 47 HD13 ILE 47 6.789 -8.488 2.867 197 H SER 48 H SER 48 3.298 -13.996 2.548 198 HA SER 48 HA SER 48 0.551 -13.477 1.634 199 HB2 SER 48 HB2 SER 48 1.957 -16.126 2.055 200 HB3 SER 48 HB3 SER 48 0.323 -15.913 1.426 201 HG SER 48 HG SER 48 2.659 -15.815 0.113 202 H ASP 49 H ASP 49 2.492 -14.275 4.374 203 HA ASP 49 HA ASP 49 0.062 -14.683 5.990 204 HB2 ASP 49 HB2 ASP 49 1.823 -15.651 7.661 205 HB3 ASP 49 HB3 ASP 49 1.274 -16.637 6.309 206 HA PRO 50 HA PRO 50 1.762 -10.571 7.228 207 HB2 PRO 50 HB2 PRO 50 -0.675 -9.409 7.521 208 HB3 PRO 50 HB3 PRO 50 0.168 -9.496 5.969 209 HG2 PRO 50 HG2 PRO 50 -2.030 -11.230 7.033 210 HG3 PRO 50 HG3 PRO 50 -1.828 -10.549 5.407 211 HD2 PRO 50 HD2 PRO 50 -1.205 -13.117 5.999 212 HD3 PRO 50 HD3 PRO 50 -0.327 -12.179 4.774 213 H MET 51 H MET 51 1.792 -9.628 9.275 214 HA MET 51 HA MET 51 0.621 -11.286 11.393 215 HB2 MET 51 HB2 MET 51 2.947 -9.373 11.339 216 HB3 MET 51 HB3 MET 51 2.261 -9.958 12.849 217 HG2 MET 51 HG2 MET 51 2.729 -12.263 12.150 218 HG3 MET 51 HG3 MET 51 3.459 -11.649 10.668 219 HE1 MET 51 HE1 MET 51 4.948 -9.354 11.145 220 HE2 MET 51 HE2 MET 51 6.429 -9.551 12.081 221 HE3 MET 51 HE3 MET 51 6.129 -10.578 10.678 222 H GLU 52 H GLU 52 -0.099 -10.128 13.381 223 HA GLU 52 HA GLU 52 -2.126 -8.280 12.769 224 HB2 GLU 52 HB2 GLU 52 -2.043 -9.848 14.749 225 HB3 GLU 52 HB3 GLU 52 -0.911 -8.729 15.495 226 HG2 GLU 52 HG2 GLU 52 -2.650 -6.953 15.283 227 HG3 GLU 52 HG3 GLU 52 -3.774 -8.200 14.748 228 H GLU 53 H GLU 53 1.165 -7.866 13.915 229 HA GLU 53 HA GLU 53 0.959 -5.134 14.620 230 HB2 GLU 53 HB2 GLU 53 3.314 -6.855 13.848 231 HB3 GLU 53 HB3 GLU 53 3.481 -5.174 14.334 232 HG2 GLU 53 HG2 GLU 53 2.401 -7.437 15.995 233 HG3 GLU 53 HG3 GLU 53 3.937 -6.596 16.209 234 H ASP 54 H ASP 54 2.082 -6.749 11.661 235 HA ASP 54 HA ASP 54 2.739 -4.424 10.233 236 HB2 ASP 54 HB2 ASP 54 2.174 -7.259 9.529 237 HB3 ASP 54 HB3 ASP 54 2.114 -6.076 8.227 238 H ILE 55 H ILE 55 -0.256 -6.335 10.291 239 HA ILE 55 HA ILE 55 -1.668 -4.753 8.433 240 HB ILE 55 HB ILE 55 -2.771 -6.454 10.672 241 HG12 ILE 55 HG12 ILE 55 -2.565 -7.219 7.769 242 HG13 ILE 55 HG13 ILE 55 -1.232 -7.508 8.882 243 HG21 ILE 55 HG21 ILE 55 -4.819 -6.519 9.316 244 HG22 ILE 55 HG22 ILE 55 -4.426 -4.886 9.850 245 HG23 ILE 55 HG23 ILE 55 -4.095 -5.376 8.188 246 HD11 ILE 55 HD11 ILE 55 -3.866 -8.832 8.685 247 HD12 ILE 55 HD12 ILE 55 -2.278 -9.502 9.061 248 HD13 ILE 55 HD13 ILE 55 -3.182 -8.626 10.297 249 H LEU 56 H LEU 56 -1.113 -4.438 11.865 250 HA LEU 56 HA LEU 56 -3.169 -2.600 12.451 251 HB2 LEU 56 HB2 LEU 56 -0.657 -3.485 13.735 252 HB3 LEU 56 HB3 LEU 56 -1.298 -1.927 14.249 253 HG LEU 56 HG LEU 56 -3.047 -4.358 14.252 254 HD11 LEU 56 HD11 LEU 56 -1.375 -3.546 16.610 255 HD12 LEU 56 HD12 LEU 56 -0.856 -4.789 15.473 256 HD13 LEU 56 HD13 LEU 56 -2.344 -5.004 16.394 257 HD21 LEU 56 HD21 LEU 56 -3.015 -2.016 16.132 258 HD22 LEU 56 HD22 LEU 56 -4.321 -3.158 15.818 259 HD23 LEU 56 HD23 LEU 56 -3.873 -1.973 14.592 260 H GLN 57 H GLN 57 0.130 -2.193 11.279 261 HA GLN 57 HA GLN 57 0.433 0.543 11.582 262 HB2 GLN 57 HB2 GLN 57 1.565 -1.514 9.776 263 HB3 GLN 57 HB3 GLN 57 1.736 0.156 9.252 264 HG2 GLN 57 HG2 GLN 57 2.495 -0.589 12.035 265 HG3 GLN 57 HG3 GLN 57 3.581 -0.971 10.699 266 HE21 GLN 57 HE21 GLN 57 2.294 1.482 12.720 267 HE22 GLN 57 HE22 GLN 57 3.225 2.797 12.097 268 H VAL 58 H VAL 58 -1.437 -1.248 9.241 269 HA VAL 58 HA VAL 58 -1.861 0.909 7.429 270 HB VAL 58 HB VAL 58 -3.667 -1.477 7.803 271 HG11 VAL 58 HG11 VAL 58 -4.787 -0.538 6.131 272 HG12 VAL 58 HG12 VAL 58 -3.570 0.729 5.959 273 HG13 VAL 58 HG13 VAL 58 -3.377 -0.803 5.105 274 HG21 VAL 58 HG21 VAL 58 -2.074 -2.181 5.741 275 HG22 VAL 58 HG22 VAL 58 -0.921 -1.304 6.747 276 HG23 VAL 58 HG23 VAL 58 -1.799 -2.683 7.410 277 H VAL 59 H VAL 59 -3.529 -0.281 10.281 278 HA VAL 59 HA VAL 59 -5.917 1.188 9.979 279 HB VAL 59 HB VAL 59 -4.576 0.207 12.502 280 HG11 VAL 59 HG11 VAL 59 -6.868 0.388 13.475 281 HG12 VAL 59 HG12 VAL 59 -6.119 1.939 13.095 282 HG13 VAL 59 HG13 VAL 59 -7.356 1.272 12.029 283 HG21 VAL 59 HG21 VAL 59 -5.699 -1.235 10.421 284 HG22 VAL 59 HG22 VAL 59 -5.397 -1.819 12.058 285 HG23 VAL 59 HG23 VAL 59 -6.979 -1.164 11.634 286 H ARG 60 H ARG 60 -2.971 1.886 11.853 287 HA ARG 60 HA ARG 60 -3.781 4.363 12.868 288 HB2 ARG 60 HB2 ARG 60 -0.967 3.502 12.174 289 HB3 ARG 60 HB3 ARG 60 -1.419 4.784 13.290 290 HG2 ARG 60 HG2 ARG 60 -2.272 1.937 13.706 291 HG3 ARG 60 HG3 ARG 60 -0.725 2.556 14.290 292 HD2 ARG 60 HD2 ARG 60 -3.460 3.605 15.004 293 HD3 ARG 60 HD3 ARG 60 -2.402 2.654 16.045 294 HE ARG 60 HE ARG 60 -0.932 4.861 15.328 295 HH11 ARG 60 HH11 ARG 60 -3.967 4.276 16.932 296 HH12 ARG 60 HH12 ARG 60 -3.872 5.702 17.912 297 HH21 ARG 60 HH21 ARG 60 -0.797 6.740 16.613 298 HH22 ARG 60 HH22 ARG 60 -2.070 7.103 17.729 299 H TYR 61 H TYR 61 -2.612 3.451 9.733 300 HA TYR 61 HA TYR 61 -1.894 6.091 8.886 301 HB2 TYR 61 HB2 TYR 61 -0.827 4.259 7.780 302 HB3 TYR 61 HB3 TYR 61 -2.373 3.516 7.384 303 HD1 TYR 61 HD2 TYR 61 -0.275 6.506 6.691 304 HD2 TYR 61 HD1 TYR 61 -3.429 3.987 5.347 305 HE1 TYR 61 HE2 TYR 61 -0.270 7.666 4.523 306 HE2 TYR 61 HE1 TYR 61 -3.432 5.138 3.175 307 HH TYR 61 HH TYR 61 -1.421 6.565 1.847 308 H CYS 62 H CYS 62 -4.617 3.927 8.106 309 HA CYS 62 HA CYS 62 -6.044 5.833 6.592 310 HB2 CYS 62 HB2 CYS 62 -6.775 3.243 7.920 311 HB3 CYS 62 HB3 CYS 62 -8.025 4.248 7.197 312 HG CYS 62 HG CYS 62 -5.834 2.221 5.741 313 H THR 63 H THR 63 -6.232 4.873 9.994 314 HA THR 63 HA THR 63 -8.466 6.371 10.731 315 HB THR 63 HB THR 63 -7.488 6.344 13.042 316 HG1 THR 63 HG1 THR 63 -5.278 6.401 12.476 317 HG21 THR 63 HG21 THR 63 -8.343 4.171 11.422 318 HG22 THR 63 HG22 THR 63 -8.497 4.363 13.168 319 HG23 THR 63 HG23 THR 63 -7.068 3.586 12.489 320 H ASP 64 H ASP 64 -5.177 7.339 10.144 321 HA ASP 64 HA ASP 64 -5.356 9.873 11.456 322 HB2 ASP 64 HB2 ASP 64 -3.390 8.507 9.685 323 HB3 ASP 64 HB3 ASP 64 -3.308 10.263 9.787 324 H LEU 65 H LEU 65 -5.871 8.710 8.177 325 HA LEU 65 HA LEU 65 -5.980 11.109 6.795 326 HB2 LEU 65 HB2 LEU 65 -6.982 8.395 6.420 327 HB3 LEU 65 HB3 LEU 65 -7.982 9.620 5.639 328 HG LEU 65 HG LEU 65 -6.198 10.323 4.250 329 HD11 LEU 65 HD11 LEU 65 -3.921 9.370 4.459 330 HD12 LEU 65 HD12 LEU 65 -4.418 8.600 5.966 331 HD13 LEU 65 HD13 LEU 65 -4.396 10.359 5.839 332 HD21 LEU 65 HD21 LEU 65 -6.387 8.574 2.892 333 HD22 LEU 65 HD22 LEU 65 -7.172 7.716 4.220 334 HD23 LEU 65 HD23 LEU 65 -5.433 7.553 3.968 335 H ILE 66 H ILE 66 -8.344 9.639 8.915 336 HA ILE 66 HA ILE 66 -10.562 11.232 8.206 337 HB ILE 66 HB ILE 66 -9.874 9.726 10.719 338 HG12 ILE 66 HG12 ILE 66 -12.299 9.099 9.175 339 HG13 ILE 66 HG13 ILE 66 -10.797 8.876 8.284 340 HG21 ILE 66 HG21 ILE 66 -12.002 11.714 10.265 341 HG22 ILE 66 HG22 ILE 66 -12.508 10.199 11.010 342 HG23 ILE 66 HG23 ILE 66 -11.250 11.177 11.766 343 HD11 ILE 66 HD11 ILE 66 -9.978 7.423 10.094 344 HD12 ILE 66 HD12 ILE 66 -11.533 7.600 10.906 345 HD13 ILE 66 HD13 ILE 66 -11.446 6.813 9.331 346 H GLU 67 H GLU 67 -8.135 11.586 10.781 347 HA GLU 67 HA GLU 67 -9.211 14.059 11.725 348 HB2 GLU 67 HB2 GLU 67 -6.409 13.055 12.194 349 HB3 GLU 67 HB3 GLU 67 -7.358 14.126 13.214 350 HG2 GLU 67 HG2 GLU 67 -8.967 12.120 13.426 351 HG3 GLU 67 HG3 GLU 67 -7.602 11.172 12.842 352 H GLU 68 H GLU 68 -6.717 13.132 9.442 353 HA GLU 68 HA GLU 68 -5.738 15.829 9.124 354 HB2 GLU 68 HB2 GLU 68 -5.178 13.285 7.593 355 HB3 GLU 68 HB3 GLU 68 -4.392 14.823 7.267 356 HG2 GLU 68 HG2 GLU 68 -4.218 14.112 10.062 357 HG3 GLU 68 HG3 GLU 68 -3.544 12.858 9.022 358 H LYS 69 H LYS 69 -8.400 14.136 8.018 359 HA LYS 69 HA LYS 69 -10.011 14.584 6.476 360 HB2 LYS 69 HB2 LYS 69 -8.587 17.204 6.005 361 HB3 LYS 69 HB3 LYS 69 -10.277 16.836 5.684 362 HG2 LYS 69 HG2 LYS 69 -9.047 16.845 8.432 363 HG3 LYS 69 HG3 LYS 69 -9.888 18.221 7.712 364 HD2 LYS 69 HD2 LYS 69 -11.581 15.998 7.387 365 HD3 LYS 69 HD3 LYS 69 -10.974 15.921 9.044 366 HE2 LYS 69 HE2 LYS 69 -11.785 18.599 8.169 367 HE3 LYS 69 HE3 LYS 69 -13.096 17.422 8.215 368 HZ1 LYS 69 HZ1 LYS 69 -13.156 18.122 10.353 369 HZ2 LYS 69 HZ2 LYS 69 -11.515 18.530 10.404 370 HZ3 LYS 69 HZ3 LYS 69 -11.988 16.911 10.542 371 H ASP 70 H ASP 70 -7.782 13.094 5.657 372 HA ASP 70 HA ASP 70 -7.404 13.973 2.871 373 HB2 ASP 70 HB2 ASP 70 -5.693 12.380 4.747 374 HB3 ASP 70 HB3 ASP 70 -5.525 12.153 3.008 375 H LEU 71 H LEU 71 -9.790 12.676 3.765 376 HA LEU 71 HA LEU 71 -9.903 9.937 3.399 377 HB2 LEU 71 HB2 LEU 71 -12.015 11.828 2.400 378 HB3 LEU 71 HB3 LEU 71 -12.225 10.185 3.002 379 HG LEU 71 HG LEU 71 -11.566 12.646 4.615 380 HD11 LEU 71 HD11 LEU 71 -13.966 12.005 3.764 381 HD12 LEU 71 HD12 LEU 71 -13.709 12.573 5.414 382 HD13 LEU 71 HD13 LEU 71 -13.890 10.848 5.093 383 HD21 LEU 71 HD21 LEU 71 -10.542 11.276 6.041 384 HD22 LEU 71 HD22 LEU 71 -11.062 9.842 5.155 385 HD23 LEU 71 HD23 LEU 71 -12.128 10.573 6.357 386 H GLU 72 H GLU 72 -9.438 12.445 1.062 387 HA GLU 72 HA GLU 72 -10.315 11.310 -1.286 388 HB2 GLU 72 HB2 GLU 72 -9.431 13.543 -1.274 389 HB3 GLU 72 HB3 GLU 72 -7.850 12.972 -0.762 390 HG2 GLU 72 HG2 GLU 72 -7.417 11.989 -2.865 391 HG3 GLU 72 HG3 GLU 72 -9.093 12.182 -3.378 392 H LYS 73 H LYS 73 -7.200 10.794 0.338 393 HA LYS 73 HA LYS 73 -6.331 8.864 -1.611 394 HB2 LYS 73 HB2 LYS 73 -5.177 9.483 1.114 395 HB3 LYS 73 HB3 LYS 73 -4.383 8.585 -0.172 396 HG2 LYS 73 HG2 LYS 73 -3.775 10.442 -1.273 397 HG3 LYS 73 HG3 LYS 73 -5.293 11.272 -0.923 398 HD2 LYS 73 HD2 LYS 73 -4.141 12.506 0.535 399 HD3 LYS 73 HD3 LYS 73 -4.061 11.064 1.549 400 HE2 LYS 73 HE2 LYS 73 -1.986 10.448 0.182 401 HE3 LYS 73 HE3 LYS 73 -2.017 12.117 -0.384 402 HZ1 LYS 73 HZ1 LYS 73 -1.067 12.769 1.489 403 HZ2 LYS 73 HZ2 LYS 73 -0.923 11.156 1.973 404 HZ3 LYS 73 HZ3 LYS 73 -2.283 12.054 2.424 405 H LEU 74 H LEU 74 -8.131 8.812 1.326 406 HA LEU 74 HA LEU 74 -7.639 6.228 2.247 407 HB2 LEU 74 HB2 LEU 74 -8.958 8.028 3.394 408 HB3 LEU 74 HB3 LEU 74 -10.297 7.643 2.314 409 HG LEU 74 HG LEU 74 -10.246 5.309 3.262 410 HD11 LEU 74 HD11 LEU 74 -9.152 4.992 5.415 411 HD12 LEU 74 HD12 LEU 74 -8.458 6.610 5.311 412 HD13 LEU 74 HD13 LEU 74 -7.975 5.368 4.156 413 HD21 LEU 74 HD21 LEU 74 -11.795 7.204 3.949 414 HD22 LEU 74 HD22 LEU 74 -10.758 7.397 5.362 415 HD23 LEU 74 HD23 LEU 74 -11.609 5.875 5.092 416 H ASP 75 H ASP 75 -10.425 7.273 0.274 417 HA ASP 75 HA ASP 75 -11.401 4.747 -0.326 418 HB2 ASP 75 HB2 ASP 75 -12.103 7.332 -0.974 419 HB3 ASP 75 HB3 ASP 75 -11.665 6.648 -2.538 420 H LEU 76 H LEU 76 -8.674 6.439 -1.633 421 HA LEU 76 HA LEU 76 -8.425 4.824 -3.991 422 HB2 LEU 76 HB2 LEU 76 -6.438 6.633 -2.625 423 HB3 LEU 76 HB3 LEU 76 -6.223 5.903 -4.215 424 HG LEU 76 HG LEU 76 -8.472 7.800 -3.575 425 HD11 LEU 76 HD11 LEU 76 -6.317 8.865 -5.200 426 HD12 LEU 76 HD12 LEU 76 -5.799 8.480 -3.559 427 HD13 LEU 76 HD13 LEU 76 -7.154 9.576 -3.820 428 HD21 LEU 76 HD21 LEU 76 -8.221 8.093 -6.128 429 HD22 LEU 76 HD22 LEU 76 -9.025 6.648 -5.513 430 HD23 LEU 76 HD23 LEU 76 -7.349 6.562 -6.059 431 H VAL 77 H VAL 77 -6.854 4.920 -0.816 432 HA VAL 77 HA VAL 77 -5.069 2.767 -1.353 433 HB VAL 77 HB VAL 77 -5.999 3.891 1.293 434 HG11 VAL 77 HG11 VAL 77 -4.911 2.223 2.273 435 HG12 VAL 77 HG12 VAL 77 -4.481 1.551 0.700 436 HG13 VAL 77 HG13 VAL 77 -3.426 2.736 1.472 437 HG21 VAL 77 HG21 VAL 77 -4.707 5.333 -0.452 438 HG22 VAL 77 HG22 VAL 77 -4.210 5.349 1.240 439 HG23 VAL 77 HG23 VAL 77 -3.318 4.379 0.068 440 H ILE 78 H ILE 78 -8.212 3.015 0.255 441 HA ILE 78 HA ILE 78 -8.390 0.396 1.213 442 HB ILE 78 HB ILE 78 -10.580 2.264 0.306 443 HG12 ILE 78 HG12 ILE 78 -9.233 3.068 2.201 444 HG13 ILE 78 HG13 ILE 78 -10.873 2.675 2.704 445 HG21 ILE 78 HG21 ILE 78 -11.624 0.481 2.170 446 HG22 ILE 78 HG22 ILE 78 -11.968 0.533 0.442 447 HG23 ILE 78 HG23 ILE 78 -10.693 -0.520 1.055 448 HD11 ILE 78 HD11 ILE 78 -8.362 1.619 3.631 449 HD12 ILE 78 HD12 ILE 78 -9.976 1.468 4.326 450 HD13 ILE 78 HD13 ILE 78 -9.438 0.331 3.091 451 H LYS 79 H LYS 79 -9.805 1.738 -1.777 452 HA LYS 79 HA LYS 79 -10.679 -0.725 -2.809 453 HB2 LYS 79 HB2 LYS 79 -11.023 0.431 -4.883 454 HB3 LYS 79 HB3 LYS 79 -11.436 1.532 -3.576 455 HG2 LYS 79 HG2 LYS 79 -10.211 2.948 -4.843 456 HG3 LYS 79 HG3 LYS 79 -8.897 2.246 -3.896 457 HD2 LYS 79 HD2 LYS 79 -7.986 1.898 -5.935 458 HD3 LYS 79 HD3 LYS 79 -9.023 0.469 -5.916 459 HE2 LYS 79 HE2 LYS 79 -10.797 2.050 -6.949 460 HE3 LYS 79 HE3 LYS 79 -9.418 3.078 -7.333 461 HZ1 LYS 79 HZ1 LYS 79 -10.072 0.399 -8.356 462 HZ2 LYS 79 HZ2 LYS 79 -8.460 0.909 -8.326 463 HZ3 LYS 79 HZ3 LYS 79 -9.607 1.785 -9.207 464 H TYR 80 H TYR 80 -7.609 0.957 -3.030 465 HA TYR 80 HA TYR 80 -6.480 -0.604 -5.099 466 HB2 TYR 80 HB2 TYR 80 -5.541 1.559 -4.449 467 HB3 TYR 80 HB3 TYR 80 -5.124 0.920 -2.863 468 HD1 TYR 80 HD1 TYR 80 -3.277 -0.674 -2.611 469 HD2 TYR 80 HD2 TYR 80 -4.208 1.048 -6.389 470 HE1 TYR 80 HE1 TYR 80 -1.085 -1.388 -3.471 471 HE2 TYR 80 HE2 TYR 80 -2.021 0.338 -7.259 472 HH TYR 80 HH TYR 80 0.331 -0.191 -6.112 473 H MET 81 H MET 81 -6.067 -0.774 -1.561 474 HA MET 81 HA MET 81 -4.501 -3.126 -1.598 475 HB2 MET 81 HB2 MET 81 -4.780 -3.172 0.773 476 HB3 MET 81 HB3 MET 81 -4.655 -1.484 0.298 477 HG2 MET 81 HG2 MET 81 -7.025 -1.189 0.515 478 HG3 MET 81 HG3 MET 81 -7.251 -2.910 0.818 479 HE1 MET 81 HE1 MET 81 -6.486 0.410 1.814 480 HE2 MET 81 HE2 MET 81 -6.766 0.409 3.556 481 HE3 MET 81 HE3 MET 81 -5.128 0.233 2.926 482 H LYS 82 H LYS 82 -7.924 -2.556 -1.701 483 HA LYS 82 HA LYS 82 -8.852 -5.055 -0.819 484 HB2 LYS 82 HB2 LYS 82 -9.953 -2.705 -2.050 485 HB3 LYS 82 HB3 LYS 82 -10.599 -4.135 -2.843 486 HG2 LYS 82 HG2 LYS 82 -10.580 -4.310 0.073 487 HG3 LYS 82 HG3 LYS 82 -11.585 -3.008 -0.566 488 HD2 LYS 82 HD2 LYS 82 -11.890 -5.519 -2.021 489 HD3 LYS 82 HD3 LYS 82 -12.329 -5.645 -0.315 490 HE2 LYS 82 HE2 LYS 82 -13.849 -3.758 -0.554 491 HE3 LYS 82 HE3 LYS 82 -13.381 -3.576 -2.244 492 HZ1 LYS 82 HZ1 LYS 82 -14.272 -5.788 -2.679 493 HZ2 LYS 82 HZ2 LYS 82 -15.463 -4.762 -2.056 494 HZ3 LYS 82 HZ3 LYS 82 -14.750 -5.931 -1.062 495 H ARG 83 H ARG 83 -8.433 -3.889 -4.168 496 HA ARG 83 HA ARG 83 -8.993 -6.262 -5.476 497 HB2 ARG 83 HB2 ARG 83 -8.140 -5.276 -7.385 498 HB3 ARG 83 HB3 ARG 83 -8.478 -3.867 -6.388 499 HG2 ARG 83 HG2 ARG 83 -5.982 -4.222 -5.632 500 HG3 ARG 83 HG3 ARG 83 -5.873 -5.049 -7.187 501 HD2 ARG 83 HD2 ARG 83 -7.019 -2.939 -8.132 502 HD3 ARG 83 HD3 ARG 83 -6.532 -2.182 -6.615 503 HE ARG 83 HE ARG 83 -4.325 -3.477 -7.808 504 HH11 ARG 83 HH11 ARG 83 -6.362 -0.675 -8.159 505 HH12 ARG 83 HH12 ARG 83 -5.140 0.277 -8.934 506 HH21 ARG 83 HH21 ARG 83 -2.707 -2.232 -8.827 507 HH22 ARG 83 HH22 ARG 83 -3.062 -0.609 -9.314 508 H LEU 84 H LEU 84 -6.152 -5.330 -3.719 509 HA LEU 84 HA LEU 84 -4.489 -7.417 -4.813 510 HB2 LEU 84 HB2 LEU 84 -4.081 -5.641 -2.411 511 HB3 LEU 84 HB3 LEU 84 -2.866 -6.703 -3.120 512 HG LEU 84 HG LEU 84 -4.123 -4.450 -4.665 513 HD11 LEU 84 HD11 LEU 84 -1.736 -3.444 -4.073 514 HD12 LEU 84 HD12 LEU 84 -1.997 -4.381 -2.603 515 HD13 LEU 84 HD13 LEU 84 -3.161 -3.144 -3.077 516 HD21 LEU 84 HD21 LEU 84 -1.615 -6.091 -4.980 517 HD22 LEU 84 HD22 LEU 84 -1.982 -4.653 -5.933 518 HD23 LEU 84 HD23 LEU 84 -3.026 -6.070 -6.038 519 H MET 85 H MET 85 -5.915 -6.761 -1.611 520 HA MET 85 HA MET 85 -5.186 -9.203 -0.441 521 HB2 MET 85 HB2 MET 85 -7.464 -7.317 0.174 522 HB3 MET 85 HB3 MET 85 -7.050 -8.700 1.178 523 HG2 MET 85 HG2 MET 85 -4.689 -7.632 1.229 524 HG3 MET 85 HG3 MET 85 -5.536 -6.170 0.730 525 HE1 MET 85 HE1 MET 85 -4.642 -5.011 2.417 526 HE2 MET 85 HE2 MET 85 -5.735 -4.593 3.736 527 HE3 MET 85 HE3 MET 85 -4.346 -5.636 4.039 528 H GLN 86 H GLN 86 -7.794 -8.350 -2.571 529 HA GLN 86 HA GLN 86 -9.335 -10.724 -2.045 530 HB2 GLN 86 HB2 GLN 86 -9.531 -8.593 -4.172 531 HB3 GLN 86 HB3 GLN 86 -10.633 -9.959 -4.071 532 HG2 GLN 86 HG2 GLN 86 -10.286 -8.367 -1.611 533 HG3 GLN 86 HG3 GLN 86 -11.120 -7.582 -2.952 534 HE21 GLN 86 HE21 GLN 86 -12.699 -7.769 -0.984 535 HE22 GLN 86 HE22 GLN 86 -13.786 -9.110 -1.067 536 H GLN 87 H GLN 87 -7.345 -9.548 -4.749 537 HA GLN 87 HA GLN 87 -7.570 -11.939 -6.263 538 HB2 GLN 87 HB2 GLN 87 -6.010 -10.978 -7.751 539 HB3 GLN 87 HB3 GLN 87 -6.939 -9.626 -7.117 540 HG2 GLN 87 HG2 GLN 87 -5.121 -9.171 -5.514 541 HG3 GLN 87 HG3 GLN 87 -4.185 -10.473 -6.248 542 HE21 GLN 87 HE21 GLN 87 -6.186 -7.882 -7.611 543 HE22 GLN 87 HE22 GLN 87 -4.949 -7.221 -8.620 544 H SER 88 H SER 88 -5.672 -11.047 -3.562 545 HA SER 88 HA SER 88 -3.336 -12.483 -3.873 546 HB2 SER 88 HB2 SER 88 -5.004 -11.842 -1.454 547 HB3 SER 88 HB3 SER 88 -3.531 -12.801 -1.304 548 HG SER 88 HG SER 88 -2.399 -11.052 -1.555 549 H VAL 89 H VAL 89 -2.674 -14.578 -3.320 550 HA VAL 89 HA VAL 89 -4.545 -16.629 -3.955 551 HB VAL 89 HB VAL 89 -2.265 -16.951 -4.609 552 HG11 VAL 89 HG11 VAL 89 -1.631 -16.624 -1.685 553 HG12 VAL 89 HG12 VAL 89 -0.489 -17.287 -2.857 554 HG13 VAL 89 HG13 VAL 89 -1.076 -15.633 -3.034 555 HG21 VAL 89 HG21 VAL 89 -3.531 -18.962 -3.988 556 HG22 VAL 89 HG22 VAL 89 -1.804 -19.155 -3.692 557 HG23 VAL 89 HG23 VAL 89 -2.900 -18.843 -2.346 558 H GLU 90 H GLU 90 -3.226 -15.345 -0.980 559 HA GLU 90 HA GLU 90 -4.325 -17.490 0.629 560 HB2 GLU 90 HB2 GLU 90 -2.586 -15.139 1.093 561 HB3 GLU 90 HB3 GLU 90 -3.598 -15.628 2.444 562 HG2 GLU 90 HG2 GLU 90 -1.796 -17.528 0.973 563 HG3 GLU 90 HG3 GLU 90 -1.285 -16.606 2.385 564 H SER 91 H SER 91 -6.302 -17.526 1.461 565 HA SER 91 HA SER 91 -8.156 -15.422 0.952 566 HB2 SER 91 HB2 SER 91 -9.798 -16.865 1.765 567 HB3 SER 91 HB3 SER 91 -8.570 -17.989 1.183 568 HG SER 91 HG SER 91 -8.791 -18.745 3.150 569 H VAL 92 H VAL 92 -6.061 -16.210 3.574 570 HA VAL 92 HA VAL 92 -7.364 -15.048 5.739 571 HB VAL 92 HB VAL 92 -5.172 -14.771 6.766 572 HG11 VAL 92 HG11 VAL 92 -6.070 -16.990 6.805 573 HG12 VAL 92 HG12 VAL 92 -5.490 -17.308 5.170 574 HG13 VAL 92 HG13 VAL 92 -4.338 -17.105 6.491 575 HG21 VAL 92 HG21 VAL 92 -3.377 -15.794 4.896 576 HG22 VAL 92 HG22 VAL 92 -4.319 -14.592 4.014 577 HG23 VAL 92 HG23 VAL 92 -3.463 -14.135 5.488 578 H TRP 93 H TRP 93 -5.858 -13.579 3.000 579 HA TRP 93 HA TRP 93 -5.334 -11.026 4.085 580 HB2 TRP 93 HB2 TRP 93 -5.623 -12.152 1.340 581 HB3 TRP 93 HB3 TRP 93 -5.700 -10.402 1.526 582 HD1 TRP 93 HD1 TRP 93 -3.271 -12.968 0.799 583 HE1 TRP 93 HE1 TRP 93 -0.873 -12.197 1.327 584 HE3 TRP 93 HE3 TRP 93 -4.346 -8.880 3.675 585 HZ2 TRP 93 HZ2 TRP 93 0.395 -10.130 2.772 586 HZ3 TRP 93 HZ3 TRP 93 -2.484 -7.561 4.592 587 HH2 TRP 93 HH2 TRP 93 -0.163 -8.174 4.150 588 H ASN 94 H ASN 94 -8.201 -12.478 2.661 589 HA ASN 94 HA ASN 94 -9.752 -10.206 2.259 590 HB2 ASN 94 HB2 ASN 94 -10.397 -13.070 2.868 591 HB3 ASN 94 HB3 ASN 94 -11.692 -11.876 2.828 592 HD21 ASN 94 HD21 ASN 94 -8.763 -12.215 0.868 593 HD22 ASN 94 HD22 ASN 94 -9.583 -12.324 -0.648 594 H MET 95 H MET 95 -9.223 -12.100 5.193 595 HA MET 95 HA MET 95 -11.121 -10.687 6.776 596 HB2 MET 95 HB2 MET 95 -8.713 -12.221 7.759 597 HB3 MET 95 HB3 MET 95 -10.184 -11.861 8.652 598 HG2 MET 95 HG2 MET 95 -11.337 -13.206 6.742 599 HG3 MET 95 HG3 MET 95 -9.720 -13.858 6.492 600 HE1 MET 95 HE1 MET 95 -8.347 -14.817 9.128 601 HE2 MET 95 HE2 MET 95 -9.182 -16.370 9.087 602 HE3 MET 95 HE3 MET 95 -8.727 -15.573 7.581 603 H ALA 96 H ALA 96 -7.646 -10.373 6.234 604 HA ALA 96 HA ALA 96 -6.991 -8.541 8.198 605 HB1 ALA 96 HB1 ALA 96 -5.110 -7.920 6.837 606 HB2 ALA 96 HB2 ALA 96 -5.386 -9.654 6.667 607 HB3 ALA 96 HB3 ALA 96 -5.896 -8.552 5.390 608 H PHE 97 H PHE 97 -8.432 -7.972 5.019 609 HA PHE 97 HA PHE 97 -8.306 -5.181 5.005 610 HB2 PHE 97 HB2 PHE 97 -8.886 -6.475 3.015 611 HB3 PHE 97 HB3 PHE 97 -10.388 -6.996 3.771 612 HD1 PHE 97 HD2 PHE 97 -8.652 -3.729 3.252 613 HD2 PHE 97 HD1 PHE 97 -12.241 -5.988 2.895 614 HE1 PHE 97 HE2 PHE 97 -9.796 -1.758 2.325 615 HE2 PHE 97 HE1 PHE 97 -13.391 -4.022 1.966 616 HZ PHE 97 HZ PHE 97 -12.168 -1.903 1.681 617 H ASP 98 H ASP 98 -10.883 -7.338 6.158 618 HA ASP 98 HA ASP 98 -12.640 -5.295 6.990 619 HB2 ASP 98 HB2 ASP 98 -12.951 -7.919 6.697 620 HB3 ASP 98 HB3 ASP 98 -12.612 -7.909 8.426 621 H PHE 99 H PHE 99 -9.990 -6.955 8.591 622 HA PHE 99 HA PHE 99 -10.469 -6.142 11.219 623 HB2 PHE 99 HB2 PHE 99 -8.821 -7.798 10.928 624 HB3 PHE 99 HB3 PHE 99 -7.956 -6.848 9.724 625 HD1 PHE 99 HD2 PHE 99 -8.617 -7.281 13.305 626 HD2 PHE 99 HD1 PHE 99 -6.381 -5.165 10.366 627 HE1 PHE 99 HE2 PHE 99 -7.121 -6.428 15.062 628 HE2 PHE 99 HE1 PHE 99 -4.880 -4.310 12.118 629 HZ PHE 99 HZ PHE 99 -5.250 -4.940 14.470 630 H ILE 100 H ILE 100 -8.662 -4.550 8.621 631 HA ILE 100 HA ILE 100 -7.819 -2.339 10.191 632 HB ILE 100 HB ILE 100 -8.105 -2.560 7.192 633 HG12 ILE 100 HG12 ILE 100 -5.470 -2.614 8.567 634 HG13 ILE 100 HG13 ILE 100 -6.471 -4.055 8.706 635 HG21 ILE 100 HG21 ILE 100 -7.627 -0.395 7.111 636 HG22 ILE 100 HG22 ILE 100 -7.504 -0.321 8.869 637 HG23 ILE 100 HG23 ILE 100 -6.088 -0.734 7.902 638 HD11 ILE 100 HD11 ILE 100 -4.743 -3.830 6.778 639 HD12 ILE 100 HD12 ILE 100 -6.334 -4.526 6.465 640 HD13 ILE 100 HD13 ILE 100 -6.001 -2.852 6.022 641 H LEU 101 H LEU 101 -10.588 -2.918 8.080 642 HA LEU 101 HA LEU 101 -11.585 -0.264 8.148 643 HB2 LEU 101 HB2 LEU 101 -12.742 -2.927 7.425 644 HB3 LEU 101 HB3 LEU 101 -13.777 -1.504 7.524 645 HG LEU 101 HG LEU 101 -11.340 -1.603 5.763 646 HD11 LEU 101 HD11 LEU 101 -14.066 -2.709 5.319 647 HD12 LEU 101 HD12 LEU 101 -12.499 -3.306 4.772 648 HD13 LEU 101 HD13 LEU 101 -13.240 -1.919 3.975 649 HD21 LEU 101 HD21 LEU 101 -12.481 0.578 6.442 650 HD22 LEU 101 HD22 LEU 101 -13.834 0.039 5.445 651 HD23 LEU 101 HD23 LEU 101 -12.246 0.287 4.718 652 H ASP 102 H ASP 102 -12.047 -3.088 10.177 653 HA ASP 102 HA ASP 102 -14.281 -2.235 11.631 654 HB2 ASP 102 HB2 ASP 102 -12.928 -4.511 11.618 655 HB3 ASP 102 HB3 ASP 102 -12.122 -3.778 13.003 656 H ASN 103 H ASN 103 -10.950 -1.285 11.788 657 HA ASN 103 HA ASN 103 -11.379 0.144 14.306 658 HB2 ASN 103 HB2 ASN 103 -8.904 -0.486 12.700 659 HB3 ASN 103 HB3 ASN 103 -8.885 0.636 14.058 660 HD21 ASN 103 HD21 ASN 103 -9.393 -2.681 13.091 661 HD22 ASN 103 HD22 ASN 103 -9.171 -3.375 14.657 662 H VAL 104 H VAL 104 -10.543 0.703 10.921 663 HA VAL 104 HA VAL 104 -10.231 3.525 11.185 664 HB VAL 104 HB VAL 104 -10.727 1.819 8.742 665 HG11 VAL 104 HG11 VAL 104 -9.950 3.790 7.463 666 HG12 VAL 104 HG12 VAL 104 -11.482 4.068 8.294 667 HG13 VAL 104 HG13 VAL 104 -9.987 4.736 8.951 668 HG21 VAL 104 HG21 VAL 104 -8.389 1.954 8.354 669 HG22 VAL 104 HG22 VAL 104 -8.176 3.148 9.635 670 HG23 VAL 104 HG23 VAL 104 -8.594 1.484 10.041 671 H GLN 105 H GLN 105 -12.781 1.587 9.606 672 HA GLN 105 HA GLN 105 -14.560 3.593 9.025 673 HB2 GLN 105 HB2 GLN 105 -15.268 0.819 9.994 674 HB3 GLN 105 HB3 GLN 105 -16.321 1.893 9.083 675 HG2 GLN 105 HG2 GLN 105 -13.675 1.035 7.982 676 HG3 GLN 105 HG3 GLN 105 -15.100 0.006 7.844 677 HE21 GLN 105 HE21 GLN 105 -13.676 3.065 6.947 678 HE22 GLN 105 HE22 GLN 105 -14.729 3.387 5.615 679 H VAL 106 H VAL 106 -13.849 2.168 12.120 680 HA VAL 106 HA VAL 106 -16.151 3.139 13.488 681 HB VAL 106 HB VAL 106 -13.503 2.050 14.379 682 HG11 VAL 106 HG11 VAL 106 -14.564 2.223 16.738 683 HG12 VAL 106 HG12 VAL 106 -13.746 3.632 16.056 684 HG13 VAL 106 HG13 VAL 106 -15.507 3.536 16.032 685 HG21 VAL 106 HG21 VAL 106 -15.436 0.607 13.613 686 HG22 VAL 106 HG22 VAL 106 -14.784 0.243 15.212 687 HG23 VAL 106 HG23 VAL 106 -16.291 1.145 15.059 688 H VAL 107 H VAL 107 -12.744 4.205 13.531 689 HA VAL 107 HA VAL 107 -13.223 6.549 15.027 690 HB VAL 107 HB VAL 107 -10.993 5.638 14.904 691 HG11 VAL 107 HG11 VAL 107 -9.755 6.088 12.642 692 HG12 VAL 107 HG12 VAL 107 -10.718 4.624 12.857 693 HG13 VAL 107 HG13 VAL 107 -11.381 5.996 11.967 694 HG21 VAL 107 HG21 VAL 107 -9.726 7.670 14.340 695 HG22 VAL 107 HG22 VAL 107 -11.158 8.331 13.553 696 HG23 VAL 107 HG23 VAL 107 -11.168 8.030 15.290 697 H LEU 108 H LEU 108 -13.539 5.810 11.654 698 HA LEU 108 HA LEU 108 -13.493 8.512 10.719 699 HB2 LEU 108 HB2 LEU 108 -13.366 7.504 8.753 700 HB3 LEU 108 HB3 LEU 108 -13.519 5.953 9.576 701 HG LEU 108 HG LEU 108 -16.036 6.256 9.353 702 HD11 LEU 108 HD11 LEU 108 -16.136 7.775 7.041 703 HD12 LEU 108 HD12 LEU 108 -15.102 8.706 8.124 704 HD13 LEU 108 HD13 LEU 108 -16.725 8.244 8.636 705 HD21 LEU 108 HD21 LEU 108 -14.120 5.168 7.659 706 HD22 LEU 108 HD22 LEU 108 -15.190 6.081 6.594 707 HD23 LEU 108 HD23 LEU 108 -15.853 4.834 7.652 708 H GLN 109 H GLN 109 -16.008 6.239 11.685 709 HA GLN 109 HA GLN 109 -18.209 7.817 10.862 710 HB2 GLN 109 HB2 GLN 109 -17.839 5.482 12.688 711 HB3 GLN 109 HB3 GLN 109 -19.359 6.364 12.742 712 HG2 GLN 109 HG2 GLN 109 -19.784 5.903 10.435 713 HG3 GLN 109 HG3 GLN 109 -18.181 5.198 10.232 714 HE21 GLN 109 HE21 GLN 109 -17.829 3.481 12.147 715 HE22 GLN 109 HE22 GLN 109 -19.065 2.274 12.198 716 H GLN 110 H GLN 110 -16.445 7.542 13.914 717 HA GLN 110 HA GLN 110 -18.137 9.189 15.446 718 HB2 GLN 110 HB2 GLN 110 -15.208 8.520 15.723 719 HB3 GLN 110 HB3 GLN 110 -16.095 9.465 16.911 720 HG2 GLN 110 HG2 GLN 110 -17.691 7.501 17.065 721 HG3 GLN 110 HG3 GLN 110 -16.488 6.590 16.152 722 HE21 GLN 110 HE21 GLN 110 -15.002 5.557 17.277 723 HE22 GLN 110 HE22 GLN 110 -14.569 5.874 18.919 724 H THR 111 H THR 111 -16.021 9.928 12.909 725 HA THR 111 HA THR 111 -15.625 12.692 13.775 726 HB THR 111 HB THR 111 -14.550 11.193 11.381 727 HG1 THR 111 HG1 THR 111 -13.480 11.996 13.879 728 HG21 THR 111 HG21 THR 111 -14.862 13.532 10.799 729 HG22 THR 111 HG22 THR 111 -13.145 13.189 11.010 730 HG23 THR 111 HG23 THR 111 -14.038 14.032 12.275 731 H TYR 112 H TYR 112 -16.675 11.061 10.777 732 HA TYR 112 HA TYR 112 -18.322 13.411 10.162 733 HB2 TYR 112 HB2 TYR 112 -17.697 11.138 8.284 734 HB3 TYR 112 HB3 TYR 112 -18.255 12.757 7.881 735 HD1 TYR 112 HD1 TYR 112 -15.361 10.736 8.881 736 HD2 TYR 112 HD2 TYR 112 -16.715 14.619 7.794 737 HE1 TYR 112 HE1 TYR 112 -13.030 11.454 8.567 738 HE2 TYR 112 HE2 TYR 112 -14.388 15.348 7.476 739 HH TYR 112 HH TYR 112 -11.993 13.670 6.925 740 H GLY 113 H GLY 113 -18.459 9.878 10.386 741 HA2 GLY 113 HA2 GLY 113 -20.413 8.892 11.460 742 HA3 GLY 113 HA3 GLY 113 -21.389 10.117 10.662 743 H SER 114 H SER 114 -19.476 9.536 8.256 744 HA SER 114 HA SER 114 -21.216 7.484 7.128 745 HB2 SER 114 HB2 SER 114 -19.140 9.221 5.772 746 HB3 SER 114 HB3 SER 114 -20.300 8.169 4.963 747 HG SER 114 HG SER 114 -20.653 10.662 6.080 748 H THR 115 H THR 115 -19.813 6.234 5.271 749 HA THR 115 HA THR 115 -17.291 5.269 6.328 750 HB THR 115 HB THR 115 -17.987 2.904 6.355 751 HG1 THR 115 HG1 THR 115 -20.421 2.685 6.502 752 HG21 THR 115 HG21 THR 115 -19.032 2.927 8.482 753 HG22 THR 115 HG22 THR 115 -19.795 4.487 8.171 754 HG23 THR 115 HG23 THR 115 -18.051 4.390 8.409 755 H LEU 116 H LEU 116 -16.706 3.185 4.865 756 HA LEU 116 HA LEU 116 -16.855 4.188 2.128 757 HB2 LEU 116 HB2 LEU 116 -14.847 2.978 3.682 758 HB3 LEU 116 HB3 LEU 116 -15.251 1.829 2.407 759 HG LEU 116 HG LEU 116 -14.988 4.123 0.977 760 HD11 LEU 116 HD11 LEU 116 -12.531 4.480 2.414 761 HD12 LEU 116 HD12 LEU 116 -13.906 4.756 3.482 762 HD13 LEU 116 HD13 LEU 116 -13.757 5.670 1.982 763 HD21 LEU 116 HD21 LEU 116 -12.480 2.655 1.517 764 HD22 LEU 116 HD22 LEU 116 -13.274 3.027 -0.014 765 HD23 LEU 116 HD23 LEU 116 -13.860 1.695 0.982 766 H LYS 117 H LYS 117 -17.521 2.936 0.379 767 HA LYS 117 HA LYS 117 -19.383 0.793 1.081 768 HB2 LYS 117 HB2 LYS 117 -20.281 2.582 -0.293 769 HB3 LYS 117 HB3 LYS 117 -19.003 2.354 -1.479 770 HG2 LYS 117 HG2 LYS 117 -20.606 -0.038 -0.907 771 HG3 LYS 117 HG3 LYS 117 -21.480 1.293 -1.670 772 HD2 LYS 117 HD2 LYS 117 -20.548 0.831 -3.637 773 HD3 LYS 117 HD3 LYS 117 -18.930 0.951 -2.939 774 HE2 LYS 117 HE2 LYS 117 -18.823 -1.320 -2.482 775 HE3 LYS 117 HE3 LYS 117 -20.575 -1.511 -2.512 776 HZ1 LYS 117 HZ1 LYS 117 -19.318 -0.665 -4.997 777 HZ2 LYS 117 HZ2 LYS 117 -20.604 -1.734 -4.743 778 HZ3 LYS 117 HZ3 LYS 117 -19.012 -2.256 -4.510 779 H VAL 118 H VAL 118 -18.324 -1.103 1.242 780 HA VAL 118 HA VAL 118 -16.605 -1.895 -1.020 781 HB VAL 118 HB VAL 118 -15.605 -3.550 0.639 782 HG11 VAL 118 HG11 VAL 118 -14.972 -0.904 0.027 783 HG12 VAL 118 HG12 VAL 118 -14.763 -1.035 1.773 784 HG13 VAL 118 HG13 VAL 118 -13.895 -2.129 0.695 785 HG21 VAL 118 HG21 VAL 118 -17.620 -2.684 2.275 786 HG22 VAL 118 HG22 VAL 118 -16.175 -3.545 2.807 787 HG23 VAL 118 HG23 VAL 118 -16.230 -1.784 2.884 788 H THR 119 H THR 119 -17.691 -3.229 -2.309 789 HA THR 119 HA THR 119 -19.998 -4.643 -1.691 790 HB THR 119 HB THR 119 -19.295 -4.221 -3.999 791 HG1 THR 119 HG1 THR 119 -20.619 -5.856 -4.253 792 HG21 THR 119 HG21 THR 119 -17.165 -6.289 -3.437 793 HG22 THR 119 HG22 THR 119 -16.903 -4.579 -3.780 794 HG23 THR 119 HG23 THR 119 -17.554 -5.640 -5.030 795 H LYS 207 H LYS 207 7.858 -7.923 16.150 796 HA LYS 207 HA LYS 207 9.593 -7.007 13.986 797 HB2 LYS 207 HB2 LYS 207 9.850 -9.305 14.914 798 HB3 LYS 207 HB3 LYS 207 8.230 -9.682 14.343 799 HG2 LYS 207 HG2 LYS 207 9.742 -10.562 12.755 800 HG3 LYS 207 HG3 LYS 207 9.024 -9.123 12.028 801 HD2 LYS 207 HD2 LYS 207 11.141 -7.964 13.120 802 HD3 LYS 207 HD3 LYS 207 11.803 -9.595 12.981 803 HE2 LYS 207 HE2 LYS 207 10.553 -8.060 10.706 804 HE3 LYS 207 HE3 LYS 207 12.286 -8.130 11.025 805 HZ1 LYS 207 HZ1 LYS 207 12.387 -10.038 9.938 806 HZ2 LYS 207 HZ2 LYS 207 10.735 -9.944 9.587 807 HZ3 LYS 207 HZ3 LYS 207 11.258 -10.744 10.982 808 H SER 208 H SER 208 8.912 -6.667 11.903 809 HA SER 208 HA SER 208 6.402 -7.359 10.857 810 HB2 SER 208 HB2 SER 208 5.018 -5.615 11.286 811 HB3 SER 208 HB3 SER 208 6.080 -5.347 12.668 812 HG SER 208 HG SER 208 6.133 -3.430 11.701 813 H PHE 209 H PHE 209 6.336 -7.012 8.684 814 HA PHE 209 HA PHE 209 8.667 -6.480 7.287 815 HB2 PHE 209 HB2 PHE 209 6.881 -7.683 6.224 816 HB3 PHE 209 HB3 PHE 209 5.786 -6.316 6.395 817 HD1 PHE 209 HD2 PHE 209 8.904 -7.411 4.716 818 HD2 PHE 209 HD1 PHE 209 5.615 -4.709 4.716 819 HE1 PHE 209 HE2 PHE 209 9.569 -6.608 2.488 820 HE2 PHE 209 HE1 PHE 209 6.275 -3.902 2.487 821 HZ PHE 209 HZ PHE 209 8.254 -4.850 1.371 822 H PHE 210 H PHE 210 6.010 -4.304 8.113 823 HA PHE 210 HA PHE 210 6.913 -2.083 6.627 824 HB2 PHE 210 HB2 PHE 210 5.089 -2.368 9.005 825 HB3 PHE 210 HB3 PHE 210 5.481 -0.789 8.331 826 HD1 PHE 210 HD1 PHE 210 5.441 -1.161 5.496 827 HD2 PHE 210 HD2 PHE 210 2.926 -2.902 8.456 828 HE1 PHE 210 HE1 PHE 210 3.663 -1.436 3.818 829 HE2 PHE 210 HE2 PHE 210 1.145 -3.181 6.783 830 HZ PHE 210 HZ PHE 210 1.512 -2.449 4.460 831 H ASP 211 H ASP 211 7.844 -3.396 9.695 832 HA ASP 211 HA ASP 211 9.133 -1.033 10.674 833 HB2 ASP 211 HB2 ASP 211 8.271 -2.933 12.103 834 HB3 ASP 211 HB3 ASP 211 9.647 -3.880 11.542 835 H LYS 212 H LYS 212 10.255 -4.044 9.163 836 HA LYS 212 HA LYS 212 13.003 -3.280 9.163 837 HB2 LYS 212 HB2 LYS 212 13.396 -5.266 7.904 838 HB3 LYS 212 HB3 LYS 212 12.142 -5.643 9.079 839 HG2 LYS 212 HG2 LYS 212 10.438 -5.462 7.377 840 HG3 LYS 212 HG3 LYS 212 11.643 -4.963 6.187 841 HD2 LYS 212 HD2 LYS 212 12.742 -7.274 7.033 842 HD3 LYS 212 HD3 LYS 212 11.031 -7.643 7.266 843 HE2 LYS 212 HE2 LYS 212 10.898 -6.569 4.826 844 HE3 LYS 212 HE3 LYS 212 12.557 -7.162 4.771 845 HZ1 LYS 212 HZ1 LYS 212 10.267 -8.867 5.566 846 HZ2 LYS 212 HZ2 LYS 212 11.835 -9.358 5.162 847 HZ3 LYS 212 HZ3 LYS 212 10.807 -8.744 3.967 848 H LYS 213 H LYS 213 10.320 -2.701 7.065 849 HA LYS 213 HA LYS 213 11.943 -1.968 4.789 850 HB2 LYS 213 HB2 LYS 213 9.809 -2.920 4.295 851 HB3 LYS 213 HB3 LYS 213 8.985 -1.786 5.359 852 HG2 LYS 213 HG2 LYS 213 8.626 -1.195 3.041 853 HG3 LYS 213 HG3 LYS 213 9.576 0.051 3.853 854 HD2 LYS 213 HD2 LYS 213 11.095 -0.145 2.240 855 HD3 LYS 213 HD3 LYS 213 11.435 -1.776 2.823 856 HE2 LYS 213 HE2 LYS 213 9.843 -2.721 1.313 857 HE3 LYS 213 HE3 LYS 213 9.242 -1.128 0.861 858 HZ1 LYS 213 HZ1 LYS 213 11.068 -0.701 -0.428 859 HZ2 LYS 213 HZ2 LYS 213 10.923 -2.371 -0.657 860 HZ3 LYS 213 HZ3 LYS 213 12.076 -1.763 0.421 861 H ARG 214 H ARG 214 9.955 -0.290 7.205 862 HA ARG 214 HA ARG 214 10.382 2.313 6.208 863 HB2 ARG 214 HB2 ARG 214 9.420 3.096 8.234 864 HB3 ARG 214 HB3 ARG 214 8.603 1.586 7.852 865 HG2 ARG 214 HG2 ARG 214 9.954 0.408 9.481 866 HG3 ARG 214 HG3 ARG 214 10.857 1.885 9.826 867 HD2 ARG 214 HD2 ARG 214 8.948 2.933 10.770 868 HD3 ARG 214 HD3 ARG 214 7.876 1.668 10.170 869 HE ARG 214 HE ARG 214 8.390 0.422 12.013 870 HH11 ARG 214 HH11 ARG 214 10.806 2.898 11.619 871 HH12 ARG 214 HH12 ARG 214 11.598 2.547 13.120 872 HH21 ARG 214 HH21 ARG 214 9.423 -0.050 13.991 873 HH22 ARG 214 HH22 ARG 214 10.810 0.869 14.468 874 H SER 215 H SER 215 12.224 0.260 8.359 875 HA SER 215 HA SER 215 13.981 2.343 9.257 876 HB2 SER 215 HB2 SER 215 13.885 0.622 10.805 877 HB3 SER 215 HB3 SER 215 13.868 -0.632 9.566 878 HG SER 215 HG SER 215 16.018 0.723 10.705 879 H GLU 216 H GLU 216 13.862 0.162 6.571 880 HA GLU 216 HA GLU 216 16.590 0.153 5.867 881 HB2 GLU 216 HB2 GLU 216 14.031 -0.466 4.482 882 HB3 GLU 216 HB3 GLU 216 15.446 -0.187 3.477 883 HG2 GLU 216 HG2 GLU 216 15.673 -2.069 5.767 884 HG3 GLU 216 HG3 GLU 216 14.817 -2.590 4.317 885 H ARG 217 H ARG 217 13.903 2.249 4.886 886 HA ARG 217 HA ARG 217 15.479 3.836 3.120 887 HB2 ARG 217 HB2 ARG 217 13.532 5.367 3.133 888 HB3 ARG 217 HB3 ARG 217 13.084 3.698 2.806 889 HG2 ARG 217 HG2 ARG 217 12.371 3.442 5.138 890 HG3 ARG 217 HG3 ARG 217 12.792 5.130 5.438 891 HD2 ARG 217 HD2 ARG 217 10.633 4.036 3.654 892 HD3 ARG 217 HD3 ARG 217 10.456 5.083 5.060 893 HE ARG 217 HE ARG 217 11.942 6.588 3.398 894 HH11 ARG 217 HH11 ARG 217 8.985 4.809 2.949 895 HH12 ARG 217 HH12 ARG 217 8.369 5.883 1.738 896 HH21 ARG 217 HH21 ARG 217 11.143 8.010 1.804 897 HH22 ARG 217 HH22 ARG 217 9.599 7.703 1.086 898 H ILE 218 H ILE 218 14.473 4.134 6.488 899 HA ILE 218 HA ILE 218 15.469 6.763 6.874 900 HB ILE 218 HB ILE 218 14.978 4.593 8.916 901 HG12 ILE 218 HG12 ILE 218 13.191 6.940 8.328 902 HG13 ILE 218 HG13 ILE 218 13.048 5.441 7.419 903 HG21 ILE 218 HG21 ILE 218 16.075 5.997 10.273 904 HG22 ILE 218 HG22 ILE 218 15.984 7.329 9.123 905 HG23 ILE 218 HG23 ILE 218 14.618 6.985 10.184 906 HD11 ILE 218 HD11 ILE 218 13.072 4.654 10.083 907 HD12 ILE 218 HD12 ILE 218 12.066 6.102 10.039 908 HD13 ILE 218 HD13 ILE 218 11.680 4.729 9.002 909 H SER 219 H SER 219 16.862 3.554 7.228 910 HA SER 219 HA SER 219 19.288 4.531 8.437 911 HB2 SER 219 HB2 SER 219 18.396 2.267 8.927 912 HB3 SER 219 HB3 SER 219 18.698 1.807 7.252 913 HG SER 219 HG SER 219 20.574 1.245 8.033 914 H ASN 220 H ASN 220 21.424 4.123 7.457 915 HA ASN 220 HA ASN 220 21.602 3.874 4.599 916 HB2 ASN 220 HB2 ASN 220 20.980 6.354 5.253 917 HB3 ASN 220 HB3 ASN 220 22.696 6.457 5.635 918 HD21 ASN 220 HD21 ASN 220 24.185 6.452 4.005 919 HD22 ASN 220 HD22 ASN 220 23.762 6.555 2.333 Start of MODEL 2 1 H ALA 23 H ALA 23 3.324 13.259 13.049 2 HA ALA 23 HA ALA 23 1.114 11.761 14.299 3 HB1 ALA 23 HB1 ALA 23 1.118 14.739 13.945 4 HB2 ALA 23 HB2 ALA 23 0.161 13.753 15.052 5 HB3 ALA 23 HB3 ALA 23 1.887 13.977 15.338 6 H ALA 24 H ALA 24 2.147 11.771 11.469 7 HA ALA 24 HA ALA 24 -0.362 12.590 10.155 8 HB1 ALA 24 HB1 ALA 24 1.471 12.453 8.122 9 HB2 ALA 24 HB2 ALA 24 0.942 13.929 8.930 10 HB3 ALA 24 HB3 ALA 24 2.419 13.119 9.452 11 HA PRO 25 HA PRO 25 -0.956 8.480 8.737 12 HB2 PRO 25 HB2 PRO 25 -1.923 8.864 6.230 13 HB3 PRO 25 HB3 PRO 25 -2.859 9.220 7.686 14 HG2 PRO 25 HG2 PRO 25 -1.318 11.084 5.922 15 HG3 PRO 25 HG3 PRO 25 -2.924 11.298 6.644 16 HD2 PRO 25 HD2 PRO 25 -0.696 12.432 7.683 17 HD3 PRO 25 HD3 PRO 25 -2.059 11.908 8.691 18 H ASN 26 H ASN 26 1.346 7.972 8.725 19 HA ASN 26 HA ASN 26 2.443 7.800 5.994 20 HB2 ASN 26 HB2 ASN 26 4.159 7.752 8.463 21 HB3 ASN 26 HB3 ASN 26 4.619 8.135 6.807 22 HD21 ASN 26 HD21 ASN 26 2.682 9.949 6.119 23 HD22 ASN 26 HD22 ASN 26 2.858 11.373 7.083 24 H LEU 27 H LEU 27 3.056 5.842 5.256 25 HA LEU 27 HA LEU 27 2.752 3.566 7.098 26 HB2 LEU 27 HB2 LEU 27 1.345 3.969 4.877 27 HB3 LEU 27 HB3 LEU 27 2.744 3.177 4.156 28 HG LEU 27 HG LEU 27 2.367 1.226 5.601 29 HD11 LEU 27 HD11 LEU 27 0.787 3.006 7.073 30 HD12 LEU 27 HD12 LEU 27 1.042 1.288 7.377 31 HD13 LEU 27 HD13 LEU 27 -0.326 1.817 6.398 32 HD21 LEU 27 HD21 LEU 27 0.093 0.604 4.582 33 HD22 LEU 27 HD22 LEU 27 1.420 0.985 3.484 34 HD23 LEU 27 HD23 LEU 27 0.167 2.186 3.804 35 H ALA 28 H ALA 28 4.628 2.761 7.750 36 HA ALA 28 HA ALA 28 6.797 2.070 7.791 37 HB1 ALA 28 HB1 ALA 28 7.519 0.737 6.016 38 HB2 ALA 28 HB2 ALA 28 5.760 0.637 5.938 39 HB3 ALA 28 HB3 ALA 28 6.634 1.686 4.822 40 H GLY 29 H GLY 29 6.170 4.925 7.197 41 HA2 GLY 29 HA2 GLY 29 7.740 6.695 7.184 42 HA3 GLY 29 HA3 GLY 29 8.866 5.657 6.324 43 H ALA 30 H ALA 30 5.721 5.541 5.068 44 HA ALA 30 HA ALA 30 6.541 7.292 2.848 45 HB1 ALA 30 HB1 ALA 30 6.204 5.067 2.080 46 HB2 ALA 30 HB2 ALA 30 4.658 4.944 2.921 47 HB3 ALA 30 HB3 ALA 30 4.825 6.021 1.534 48 H VAL 31 H VAL 31 5.644 9.239 2.907 49 HA VAL 31 HA VAL 31 3.072 9.628 4.233 50 HB VAL 31 HB VAL 31 4.881 11.732 3.046 51 HG11 VAL 31 HG11 VAL 31 3.559 12.939 5.050 52 HG12 VAL 31 HG12 VAL 31 2.982 12.910 3.383 53 HG13 VAL 31 HG13 VAL 31 2.348 11.757 4.557 54 HG21 VAL 31 HG21 VAL 31 5.206 11.975 5.718 55 HG22 VAL 31 HG22 VAL 31 5.048 10.224 5.568 56 HG23 VAL 31 HG23 VAL 31 6.303 11.077 4.669 57 H GLU 32 H GLU 32 4.516 9.692 1.057 58 HA GLU 32 HA GLU 32 2.294 10.993 -0.215 59 HB2 GLU 32 HB2 GLU 32 4.509 9.370 -1.477 60 HB3 GLU 32 HB3 GLU 32 3.437 10.495 -2.298 61 HG2 GLU 32 HG2 GLU 32 4.383 12.338 -0.989 62 HG3 GLU 32 HG3 GLU 32 5.476 11.203 -0.199 63 H PHE 33 H PHE 33 0.655 10.092 -1.407 64 HA PHE 33 HA PHE 33 -0.370 7.624 -0.614 65 HB2 PHE 33 HB2 PHE 33 -1.920 9.162 -1.496 66 HB3 PHE 33 HB3 PHE 33 -0.965 9.423 -2.952 67 HD1 PHE 33 HD1 PHE 33 -3.075 6.947 -1.187 68 HD2 PHE 33 HD2 PHE 33 -1.328 8.145 -4.878 69 HE1 PHE 33 HE1 PHE 33 -4.424 5.263 -2.368 70 HE2 PHE 33 HE2 PHE 33 -2.674 6.463 -6.066 71 HZ PHE 33 HZ PHE 33 -4.225 5.018 -4.811 72 H SER 34 H SER 34 1.194 8.493 -3.695 73 HA SER 34 HA SER 34 1.118 6.029 -4.935 74 HB2 SER 34 HB2 SER 34 3.424 6.871 -5.923 75 HB3 SER 34 HB3 SER 34 1.914 7.686 -6.333 76 HG SER 34 HG SER 34 2.535 9.389 -5.247 77 H ASP 35 H ASP 35 3.345 7.199 -2.480 78 HA ASP 35 HA ASP 35 5.098 4.938 -2.639 79 HB2 ASP 35 HB2 ASP 35 4.796 7.260 -0.765 80 HB3 ASP 35 HB3 ASP 35 5.817 5.898 -0.314 81 H VAL 36 H VAL 36 2.226 5.761 -0.836 82 HA VAL 36 HA VAL 36 2.471 3.743 1.154 83 HB VAL 36 HB VAL 36 -0.002 5.161 0.150 84 HG11 VAL 36 HG11 VAL 36 -1.174 3.792 1.447 85 HG12 VAL 36 HG12 VAL 36 0.300 2.956 1.941 86 HG13 VAL 36 HG13 VAL 36 -0.262 4.365 2.843 87 HG21 VAL 36 HG21 VAL 36 2.155 6.242 1.455 88 HG22 VAL 36 HG22 VAL 36 0.521 6.904 1.453 89 HG23 VAL 36 HG23 VAL 36 1.051 5.868 2.778 90 H LYS 37 H LYS 37 0.359 3.961 -1.715 91 HA LYS 37 HA LYS 37 -0.710 1.401 -1.583 92 HB2 LYS 37 HB2 LYS 37 -1.111 1.655 -4.038 93 HB3 LYS 37 HB3 LYS 37 -1.656 3.022 -3.077 94 HG2 LYS 37 HG2 LYS 37 0.082 4.391 -3.817 95 HG3 LYS 37 HG3 LYS 37 1.034 3.022 -4.396 96 HD2 LYS 37 HD2 LYS 37 -1.448 2.954 -5.751 97 HD3 LYS 37 HD3 LYS 37 -0.864 4.618 -5.813 98 HE2 LYS 37 HE2 LYS 37 1.328 3.737 -6.616 99 HE3 LYS 37 HE3 LYS 37 0.599 2.136 -6.703 100 HZ1 LYS 37 HZ1 LYS 37 -1.084 3.895 -8.055 101 HZ2 LYS 37 HZ2 LYS 37 -0.146 2.649 -8.708 102 HZ3 LYS 37 HZ3 LYS 37 0.490 4.212 -8.593 103 H THR 38 H THR 38 2.390 2.483 -2.761 104 HA THR 38 HA THR 38 3.091 0.178 -4.235 105 HB THR 38 HB THR 38 4.841 2.226 -2.864 106 HG1 THR 38 HG1 THR 38 3.702 1.954 -5.429 107 HG21 THR 38 HG21 THR 38 5.538 -0.038 -4.726 108 HG22 THR 38 HG22 THR 38 6.202 0.301 -3.127 109 HG23 THR 38 HG23 THR 38 6.586 1.359 -4.484 110 H LEU 39 H LEU 39 3.724 1.132 -0.872 111 HA LEU 39 HA LEU 39 5.242 -1.144 -0.185 112 HB2 LEU 39 HB2 LEU 39 3.551 0.597 1.603 113 HB3 LEU 39 HB3 LEU 39 4.829 -0.498 2.126 114 HG LEU 39 HG LEU 39 5.494 1.715 0.237 115 HD11 LEU 39 HD11 LEU 39 4.628 2.011 3.050 116 HD12 LEU 39 HD12 LEU 39 4.549 3.153 1.708 117 HD13 LEU 39 HD13 LEU 39 6.073 2.895 2.558 118 HD21 LEU 39 HD21 LEU 39 6.988 -0.250 1.221 119 HD22 LEU 39 HD22 LEU 39 7.156 0.894 2.553 120 HD23 LEU 39 HD23 LEU 39 7.635 1.364 0.921 121 H LEU 40 H LEU 40 1.799 -0.511 -0.249 122 HA LEU 40 HA LEU 40 1.033 -2.820 1.236 123 HB2 LEU 40 HB2 LEU 40 -0.603 -1.265 -0.759 124 HB3 LEU 40 HB3 LEU 40 -1.209 -2.333 0.504 125 HG LEU 40 HG LEU 40 0.369 0.114 1.208 126 HD11 LEU 40 HD11 LEU 40 -2.435 0.576 1.453 127 HD12 LEU 40 HD12 LEU 40 -2.061 0.158 -0.217 128 HD13 LEU 40 HD13 LEU 40 -1.229 1.504 0.562 129 HD21 LEU 40 HD21 LEU 40 -1.593 -1.692 2.582 130 HD22 LEU 40 HD22 LEU 40 -1.239 -0.075 3.194 131 HD23 LEU 40 HD23 LEU 40 0.052 -1.271 3.061 132 H LYS 41 H LYS 41 1.091 -2.060 -2.238 133 HA LYS 41 HA LYS 41 0.096 -4.438 -3.235 134 HB2 LYS 41 HB2 LYS 41 1.044 -2.174 -4.358 135 HB3 LYS 41 HB3 LYS 41 2.380 -3.262 -4.712 136 HG2 LYS 41 HG2 LYS 41 0.424 -4.830 -5.536 137 HG3 LYS 41 HG3 LYS 41 -0.412 -3.286 -5.720 138 HD2 LYS 41 HD2 LYS 41 0.612 -3.691 -7.801 139 HD3 LYS 41 HD3 LYS 41 1.643 -2.503 -7.000 140 HE2 LYS 41 HE2 LYS 41 3.276 -3.933 -7.633 141 HE3 LYS 41 HE3 LYS 41 2.815 -4.757 -6.145 142 HZ1 LYS 41 HZ1 LYS 41 2.758 -5.760 -8.740 143 HZ2 LYS 41 HZ2 LYS 41 1.148 -5.624 -8.238 144 HZ3 LYS 41 HZ3 LYS 41 2.247 -6.527 -7.321 145 H GLU 42 H GLU 42 3.410 -3.648 -2.277 146 HA GLU 42 HA GLU 42 4.447 -6.210 -3.057 147 HB2 GLU 42 HB2 GLU 42 6.514 -5.460 -1.947 148 HB3 GLU 42 HB3 GLU 42 5.898 -4.260 -3.073 149 HG2 GLU 42 HG2 GLU 42 4.883 -3.059 -1.154 150 HG3 GLU 42 HG3 GLU 42 5.669 -4.209 -0.075 151 H TRP 43 H TRP 43 3.502 -4.675 -0.013 152 HA TRP 43 HA TRP 43 4.325 -6.760 1.693 153 HB2 TRP 43 HB2 TRP 43 3.864 -4.599 2.626 154 HB3 TRP 43 HB3 TRP 43 2.212 -4.625 2.015 155 HD1 TRP 43 HD1 TRP 43 4.313 -6.867 4.409 156 HE1 TRP 43 HE1 TRP 43 2.809 -7.512 6.396 157 HE3 TRP 43 HE3 TRP 43 0.012 -4.506 2.973 158 HZ2 TRP 43 HZ2 TRP 43 0.152 -7.078 7.242 159 HZ3 TRP 43 HZ3 TRP 43 -1.966 -4.670 4.428 160 HH2 TRP 43 HH2 TRP 43 -1.896 -5.931 6.517 161 H ILE 44 H ILE 44 1.787 -6.589 -0.545 162 HA ILE 44 HA ILE 44 0.258 -8.694 0.816 163 HB ILE 44 HB ILE 44 -0.476 -7.029 -1.597 164 HG12 ILE 44 HG12 ILE 44 -1.863 -6.958 1.062 165 HG13 ILE 44 HG13 ILE 44 -0.393 -6.022 0.818 166 HG21 ILE 44 HG21 ILE 44 -2.770 -8.025 -1.127 167 HG22 ILE 44 HG22 ILE 44 -1.573 -9.089 -1.866 168 HG23 ILE 44 HG23 ILE 44 -1.926 -9.221 -0.144 169 HD11 ILE 44 HD11 ILE 44 -1.446 -4.479 -0.398 170 HD12 ILE 44 HD12 ILE 44 -2.375 -5.680 -1.296 171 HD13 ILE 44 HD13 ILE 44 -2.918 -5.158 0.298 172 H THR 45 H THR 45 2.581 -8.256 -1.585 173 HA THR 45 HA THR 45 1.823 -10.733 -2.973 174 HB THR 45 HB THR 45 3.479 -10.071 -4.690 175 HG1 THR 45 HG1 THR 45 4.914 -8.677 -3.971 176 HG21 THR 45 HG21 THR 45 2.164 -7.714 -5.105 177 HG22 THR 45 HG22 THR 45 1.062 -8.554 -4.013 178 HG23 THR 45 HG23 THR 45 1.539 -9.306 -5.534 179 H THR 46 H THR 46 4.749 -9.101 -1.745 180 HA THR 46 HA THR 46 6.358 -11.432 -1.821 181 HB THR 46 HB THR 46 7.242 -9.085 -1.793 182 HG1 THR 46 HG1 THR 46 8.260 -10.736 0.296 183 HG21 THR 46 HG21 THR 46 7.405 -8.847 1.071 184 HG22 THR 46 HG22 THR 46 5.719 -8.904 0.556 185 HG23 THR 46 HG23 THR 46 6.805 -7.686 -0.113 186 H ILE 47 H ILE 47 3.963 -10.360 0.355 187 HA ILE 47 HA ILE 47 4.780 -12.434 2.279 188 HB ILE 47 HB ILE 47 3.612 -9.723 2.909 189 HG12 ILE 47 HG12 ILE 47 5.927 -10.521 4.435 190 HG13 ILE 47 HG13 ILE 47 6.265 -10.646 2.712 191 HG21 ILE 47 HG21 ILE 47 3.758 -10.512 5.294 192 HG22 ILE 47 HG22 ILE 47 2.489 -11.260 4.325 193 HG23 ILE 47 HG23 ILE 47 3.978 -12.143 4.659 194 HD11 ILE 47 HD11 ILE 47 5.799 -8.274 4.387 195 HD12 ILE 47 HD12 ILE 47 6.829 -8.487 2.971 196 HD13 ILE 47 HD13 ILE 47 5.095 -8.236 2.772 197 H SER 48 H SER 48 3.290 -13.940 2.642 198 HA SER 48 HA SER 48 0.544 -13.425 1.722 199 HB2 SER 48 HB2 SER 48 2.319 -15.781 1.640 200 HB3 SER 48 HB3 SER 48 0.647 -16.125 2.082 201 HG SER 48 HG SER 48 1.544 -14.761 -0.240 202 H ASP 49 H ASP 49 2.484 -14.245 4.463 203 HA ASP 49 HA ASP 49 0.048 -14.597 6.083 204 HB2 ASP 49 HB2 ASP 49 1.412 -16.598 6.136 205 HB3 ASP 49 HB3 ASP 49 2.842 -15.656 6.551 206 HA PRO 50 HA PRO 50 1.873 -10.553 7.351 207 HB2 PRO 50 HB2 PRO 50 -0.528 -9.337 7.707 208 HB3 PRO 50 HB3 PRO 50 0.282 -9.426 6.137 209 HG2 PRO 50 HG2 PRO 50 -1.935 -11.119 7.224 210 HG3 PRO 50 HG3 PRO 50 -1.750 -10.423 5.603 211 HD2 PRO 50 HD2 PRO 50 -1.178 -13.013 6.152 212 HD3 PRO 50 HD3 PRO 50 -0.301 -12.082 4.921 213 H MET 51 H MET 51 1.801 -9.505 9.400 214 HA MET 51 HA MET 51 0.703 -11.209 11.528 215 HB2 MET 51 HB2 MET 51 3.021 -9.282 11.484 216 HB3 MET 51 HB3 MET 51 2.365 -9.938 12.978 217 HG2 MET 51 HG2 MET 51 2.791 -12.229 12.014 218 HG3 MET 51 HG3 MET 51 3.698 -11.423 10.735 219 HE1 MET 51 HE1 MET 51 5.591 -9.479 11.516 220 HE2 MET 51 HE2 MET 51 4.632 -8.947 12.897 221 HE3 MET 51 HE3 MET 51 6.301 -9.468 13.130 222 H GLU 52 H GLU 52 -0.092 -10.121 13.478 223 HA GLU 52 HA GLU 52 -2.098 -8.273 12.932 224 HB2 GLU 52 HB2 GLU 52 -2.167 -9.692 14.901 225 HB3 GLU 52 HB3 GLU 52 -0.738 -8.904 15.557 226 HG2 GLU 52 HG2 GLU 52 -1.959 -6.825 15.795 227 HG3 GLU 52 HG3 GLU 52 -3.386 -7.560 15.065 228 H GLU 53 H GLU 53 1.229 -7.785 13.926 229 HA GLU 53 HA GLU 53 1.010 -5.045 14.598 230 HB2 GLU 53 HB2 GLU 53 2.908 -6.606 15.199 231 HB3 GLU 53 HB3 GLU 53 3.475 -6.430 13.544 232 HG2 GLU 53 HG2 GLU 53 4.698 -4.952 14.999 233 HG3 GLU 53 HG3 GLU 53 3.702 -4.014 13.889 234 H ASP 54 H ASP 54 2.144 -6.657 11.633 235 HA ASP 54 HA ASP 54 2.667 -4.367 10.137 236 HB2 ASP 54 HB2 ASP 54 2.203 -7.220 9.566 237 HB3 ASP 54 HB3 ASP 54 1.840 -6.134 8.227 238 H ILE 55 H ILE 55 -0.314 -6.300 10.309 239 HA ILE 55 HA ILE 55 -1.811 -4.737 8.515 240 HB ILE 55 HB ILE 55 -2.860 -6.362 10.833 241 HG12 ILE 55 HG12 ILE 55 -2.475 -7.223 7.962 242 HG13 ILE 55 HG13 ILE 55 -1.340 -7.599 9.253 243 HG21 ILE 55 HG21 ILE 55 -4.916 -6.498 9.543 244 HG22 ILE 55 HG22 ILE 55 -4.495 -4.816 9.862 245 HG23 ILE 55 HG23 ILE 55 -4.199 -5.511 8.269 246 HD11 ILE 55 HD11 ILE 55 -4.198 -8.501 9.030 247 HD12 ILE 55 HD12 ILE 55 -2.744 -9.491 8.891 248 HD13 ILE 55 HD13 ILE 55 -3.176 -8.770 10.441 249 H LEU 56 H LEU 56 -1.144 -4.399 11.930 250 HA LEU 56 HA LEU 56 -3.163 -2.533 12.557 251 HB2 LEU 56 HB2 LEU 56 -0.638 -3.452 13.782 252 HB3 LEU 56 HB3 LEU 56 -1.223 -1.870 14.295 253 HG LEU 56 HG LEU 56 -2.751 -4.465 14.503 254 HD11 LEU 56 HD11 LEU 56 -1.115 -4.612 16.141 255 HD12 LEU 56 HD12 LEU 56 -2.466 -3.872 16.998 256 HD13 LEU 56 HD13 LEU 56 -1.120 -2.876 16.445 257 HD21 LEU 56 HD21 LEU 56 -4.320 -2.718 14.214 258 HD22 LEU 56 HD22 LEU 56 -3.421 -1.636 15.277 259 HD23 LEU 56 HD23 LEU 56 -4.251 -3.041 15.947 260 H GLN 57 H GLN 57 0.136 -2.157 11.355 261 HA GLN 57 HA GLN 57 0.436 0.584 11.608 262 HB2 GLN 57 HB2 GLN 57 1.491 -1.397 9.613 263 HB3 GLN 57 HB3 GLN 57 1.870 0.314 9.465 264 HG2 GLN 57 HG2 GLN 57 2.664 0.146 11.896 265 HG3 GLN 57 HG3 GLN 57 2.639 -1.597 11.635 266 HE21 GLN 57 HE21 GLN 57 4.786 -1.986 11.702 267 HE22 GLN 57 HE22 GLN 57 5.924 -1.351 10.566 268 H VAL 58 H VAL 58 -1.449 -1.246 9.319 269 HA VAL 58 HA VAL 58 -1.868 0.885 7.467 270 HB VAL 58 HB VAL 58 -3.656 -1.513 7.855 271 HG11 VAL 58 HG11 VAL 58 -4.759 -0.661 6.128 272 HG12 VAL 58 HG12 VAL 58 -3.619 0.683 6.027 273 HG13 VAL 58 HG13 VAL 58 -3.303 -0.813 5.145 274 HG21 VAL 58 HG21 VAL 58 -1.784 -2.712 7.485 275 HG22 VAL 58 HG22 VAL 58 -2.038 -2.223 5.809 276 HG23 VAL 58 HG23 VAL 58 -0.904 -1.334 6.827 277 H VAL 59 H VAL 59 -3.540 -0.292 10.322 278 HA VAL 59 HA VAL 59 -5.939 1.154 9.993 279 HB VAL 59 HB VAL 59 -4.609 0.214 12.536 280 HG11 VAL 59 HG11 VAL 59 -6.197 1.945 13.057 281 HG12 VAL 59 HG12 VAL 59 -7.417 1.188 12.031 282 HG13 VAL 59 HG13 VAL 59 -6.883 0.384 13.508 283 HG21 VAL 59 HG21 VAL 59 -5.679 -1.271 10.460 284 HG22 VAL 59 HG22 VAL 59 -5.394 -1.831 12.107 285 HG23 VAL 59 HG23 VAL 59 -6.978 -1.207 11.651 286 H ARG 60 H ARG 60 -2.956 1.909 11.770 287 HA ARG 60 HA ARG 60 -3.798 4.378 12.810 288 HB2 ARG 60 HB2 ARG 60 -0.968 3.622 12.075 289 HB3 ARG 60 HB3 ARG 60 -1.476 4.809 13.270 290 HG2 ARG 60 HG2 ARG 60 -1.865 1.828 13.426 291 HG3 ARG 60 HG3 ARG 60 -0.729 2.796 14.366 292 HD2 ARG 60 HD2 ARG 60 -3.220 3.993 14.760 293 HD3 ARG 60 HD3 ARG 60 -3.523 2.258 14.842 294 HE ARG 60 HE ARG 60 -2.397 2.197 16.831 295 HH11 ARG 60 HH11 ARG 60 -1.624 5.165 15.183 296 HH12 ARG 60 HH12 ARG 60 -0.748 5.832 16.521 297 HH21 ARG 60 HH21 ARG 60 -1.246 3.064 18.599 298 HH22 ARG 60 HH22 ARG 60 -0.533 4.635 18.463 299 H TYR 61 H TYR 61 -2.464 3.478 9.705 300 HA TYR 61 HA TYR 61 -1.868 6.121 8.832 301 HB2 TYR 61 HB2 TYR 61 -0.739 4.324 7.742 302 HB3 TYR 61 HB3 TYR 61 -2.254 3.517 7.357 303 HD1 TYR 61 HD2 TYR 61 0.029 6.226 6.436 304 HD2 TYR 61 HD1 TYR 61 -3.626 4.262 5.497 305 HE1 TYR 61 HE2 TYR 61 -0.006 7.351 4.250 306 HE2 TYR 61 HE1 TYR 61 -3.671 5.381 3.306 307 HH TYR 61 HH TYR 61 -2.251 7.934 2.516 308 H CYS 62 H CYS 62 -4.575 3.904 8.200 309 HA CYS 62 HA CYS 62 -6.027 5.725 6.586 310 HB2 CYS 62 HB2 CYS 62 -6.688 3.163 7.994 311 HB3 CYS 62 HB3 CYS 62 -7.981 4.127 7.290 312 HG CYS 62 HG CYS 62 -6.206 1.899 5.826 313 H THR 63 H THR 63 -6.229 4.852 10.016 314 HA THR 63 HA THR 63 -8.461 6.399 10.682 315 HB THR 63 HB THR 63 -7.548 6.371 13.014 316 HG1 THR 63 HG1 THR 63 -5.608 5.205 13.344 317 HG21 THR 63 HG21 THR 63 -8.592 4.408 13.126 318 HG22 THR 63 HG22 THR 63 -7.152 3.602 12.503 319 HG23 THR 63 HG23 THR 63 -8.384 4.193 11.389 320 H ASP 64 H ASP 64 -5.177 7.300 10.062 321 HA ASP 64 HA ASP 64 -5.264 9.830 11.394 322 HB2 ASP 64 HB2 ASP 64 -3.379 8.432 9.562 323 HB3 ASP 64 HB3 ASP 64 -3.256 10.186 9.669 324 H LEU 65 H LEU 65 -5.901 8.698 8.126 325 HA LEU 65 HA LEU 65 -5.994 11.107 6.760 326 HB2 LEU 65 HB2 LEU 65 -7.144 8.429 6.414 327 HB3 LEU 65 HB3 LEU 65 -8.027 9.719 5.600 328 HG LEU 65 HG LEU 65 -6.254 10.197 4.170 329 HD11 LEU 65 HD11 LEU 65 -4.449 10.456 5.670 330 HD12 LEU 65 HD12 LEU 65 -3.966 9.195 4.536 331 HD13 LEU 65 HD13 LEU 65 -4.511 8.762 6.156 332 HD21 LEU 65 HD21 LEU 65 -6.337 8.319 2.975 333 HD22 LEU 65 HD22 LEU 65 -7.199 7.601 4.337 334 HD23 LEU 65 HD23 LEU 65 -5.451 7.411 4.200 335 H ILE 66 H ILE 66 -8.432 9.590 8.803 336 HA ILE 66 HA ILE 66 -10.580 11.292 8.204 337 HB ILE 66 HB ILE 66 -9.926 9.725 10.692 338 HG12 ILE 66 HG12 ILE 66 -12.312 9.098 9.094 339 HG13 ILE 66 HG13 ILE 66 -10.793 8.899 8.226 340 HG21 ILE 66 HG21 ILE 66 -11.295 11.286 11.652 341 HG22 ILE 66 HG22 ILE 66 -12.152 11.621 10.147 342 HG23 ILE 66 HG23 ILE 66 -12.503 10.149 11.053 343 HD11 ILE 66 HD11 ILE 66 -9.993 7.430 10.032 344 HD12 ILE 66 HD12 ILE 66 -11.564 7.584 10.819 345 HD13 ILE 66 HD13 ILE 66 -11.441 6.817 9.235 346 H GLU 67 H GLU 67 -8.071 11.515 10.704 347 HA GLU 67 HA GLU 67 -9.082 13.955 11.796 348 HB2 GLU 67 HB2 GLU 67 -6.267 12.921 12.094 349 HB3 GLU 67 HB3 GLU 67 -7.167 13.946 13.203 350 HG2 GLU 67 HG2 GLU 67 -7.734 11.052 12.600 351 HG3 GLU 67 HG3 GLU 67 -6.988 11.691 14.064 352 H GLU 68 H GLU 68 -6.635 13.107 9.415 353 HA GLU 68 HA GLU 68 -5.734 15.840 9.133 354 HB2 GLU 68 HB2 GLU 68 -5.077 13.305 7.630 355 HB3 GLU 68 HB3 GLU 68 -4.386 14.871 7.229 356 HG2 GLU 68 HG2 GLU 68 -4.010 13.265 9.735 357 HG3 GLU 68 HG3 GLU 68 -2.794 13.756 8.556 358 H LYS 69 H LYS 69 -8.448 14.293 8.191 359 HA LYS 69 HA LYS 69 -10.045 14.631 6.605 360 HB2 LYS 69 HB2 LYS 69 -8.677 17.288 6.165 361 HB3 LYS 69 HB3 LYS 69 -10.355 16.889 5.828 362 HG2 LYS 69 HG2 LYS 69 -9.220 16.762 8.602 363 HG3 LYS 69 HG3 LYS 69 -9.875 18.251 7.917 364 HD2 LYS 69 HD2 LYS 69 -11.535 15.792 7.742 365 HD3 LYS 69 HD3 LYS 69 -11.374 16.570 9.319 366 HE2 LYS 69 HE2 LYS 69 -13.013 17.937 8.684 367 HE3 LYS 69 HE3 LYS 69 -11.854 18.669 7.575 368 HZ1 LYS 69 HZ1 LYS 69 -14.186 17.286 6.943 369 HZ2 LYS 69 HZ2 LYS 69 -12.895 16.332 6.410 370 HZ3 LYS 69 HZ3 LYS 69 -13.041 17.930 5.878 371 H ASP 70 H ASP 70 -7.822 13.184 5.733 372 HA ASP 70 HA ASP 70 -7.499 14.103 2.954 373 HB2 ASP 70 HB2 ASP 70 -5.591 13.188 4.854 374 HB3 ASP 70 HB3 ASP 70 -5.688 11.983 3.573 375 H LEU 71 H LEU 71 -9.811 12.689 3.949 376 HA LEU 71 HA LEU 71 -9.839 9.962 3.531 377 HB2 LEU 71 HB2 LEU 71 -12.039 11.820 2.658 378 HB3 LEU 71 HB3 LEU 71 -12.188 10.139 3.168 379 HG LEU 71 HG LEU 71 -11.508 12.497 4.923 380 HD11 LEU 71 HD11 LEU 71 -13.970 11.549 4.029 381 HD12 LEU 71 HD12 LEU 71 -13.675 12.651 5.373 382 HD13 LEU 71 HD13 LEU 71 -13.800 10.916 5.666 383 HD21 LEU 71 HD21 LEU 71 -12.073 10.399 6.574 384 HD22 LEU 71 HD22 LEU 71 -10.453 10.965 6.170 385 HD23 LEU 71 HD23 LEU 71 -11.161 9.615 5.285 386 H GLU 72 H GLU 72 -9.513 12.509 1.221 387 HA GLU 72 HA GLU 72 -10.437 11.400 -1.120 388 HB2 GLU 72 HB2 GLU 72 -9.511 13.670 -0.955 389 HB3 GLU 72 HB3 GLU 72 -7.898 13.001 -0.747 390 HG2 GLU 72 HG2 GLU 72 -7.692 12.438 -2.943 391 HG3 GLU 72 HG3 GLU 72 -9.426 12.213 -3.163 392 H LYS 73 H LYS 73 -7.290 10.872 0.431 393 HA LYS 73 HA LYS 73 -6.439 9.002 -1.584 394 HB2 LYS 73 HB2 LYS 73 -5.245 9.590 1.131 395 HB3 LYS 73 HB3 LYS 73 -4.468 8.693 -0.166 396 HG2 LYS 73 HG2 LYS 73 -3.863 10.551 -1.262 397 HG3 LYS 73 HG3 LYS 73 -5.384 11.377 -0.911 398 HD2 LYS 73 HD2 LYS 73 -4.468 12.485 0.791 399 HD3 LYS 73 HD3 LYS 73 -3.828 10.996 1.492 400 HE2 LYS 73 HE2 LYS 73 -1.793 11.239 0.487 401 HE3 LYS 73 HE3 LYS 73 -2.459 12.097 -0.902 402 HZ1 LYS 73 HZ1 LYS 73 -2.826 14.014 0.633 403 HZ2 LYS 73 HZ2 LYS 73 -1.201 13.642 0.347 404 HZ3 LYS 73 HZ3 LYS 73 -1.929 13.186 1.805 405 H LEU 74 H LEU 74 -8.141 8.864 1.418 406 HA LEU 74 HA LEU 74 -7.626 6.271 2.265 407 HB2 LEU 74 HB2 LEU 74 -8.948 8.002 3.479 408 HB3 LEU 74 HB3 LEU 74 -10.290 7.673 2.384 409 HG LEU 74 HG LEU 74 -10.368 5.352 3.236 410 HD11 LEU 74 HD11 LEU 74 -9.117 4.707 5.178 411 HD12 LEU 74 HD12 LEU 74 -8.387 6.307 5.297 412 HD13 LEU 74 HD13 LEU 74 -7.987 5.256 3.939 413 HD21 LEU 74 HD21 LEU 74 -11.726 5.923 4.957 414 HD22 LEU 74 HD22 LEU 74 -11.486 7.538 4.291 415 HD23 LEU 74 HD23 LEU 74 -10.540 7.007 5.683 416 H ASP 75 H ASP 75 -10.415 7.322 0.301 417 HA ASP 75 HA ASP 75 -11.395 4.805 -0.320 418 HB2 ASP 75 HB2 ASP 75 -12.132 7.360 -0.927 419 HB3 ASP 75 HB3 ASP 75 -11.592 6.778 -2.500 420 H LEU 76 H LEU 76 -8.654 6.494 -1.608 421 HA LEU 76 HA LEU 76 -8.388 4.872 -3.960 422 HB2 LEU 76 HB2 LEU 76 -6.370 6.649 -2.595 423 HB3 LEU 76 HB3 LEU 76 -6.219 5.965 -4.212 424 HG LEU 76 HG LEU 76 -8.379 7.909 -3.408 425 HD11 LEU 76 HD11 LEU 76 -7.050 9.654 -3.852 426 HD12 LEU 76 HD12 LEU 76 -6.250 8.832 -5.191 427 HD13 LEU 76 HD13 LEU 76 -5.730 8.527 -3.534 428 HD21 LEU 76 HD21 LEU 76 -8.638 6.305 -5.405 429 HD22 LEU 76 HD22 LEU 76 -7.404 7.302 -6.177 430 HD23 LEU 76 HD23 LEU 76 -8.931 8.024 -5.666 431 H VAL 77 H VAL 77 -6.756 5.017 -0.809 432 HA VAL 77 HA VAL 77 -5.000 2.847 -1.321 433 HB VAL 77 HB VAL 77 -5.927 4.020 1.304 434 HG11 VAL 77 HG11 VAL 77 -4.377 1.656 0.730 435 HG12 VAL 77 HG12 VAL 77 -3.426 2.834 1.636 436 HG13 VAL 77 HG13 VAL 77 -4.967 2.265 2.276 437 HG21 VAL 77 HG21 VAL 77 -4.734 5.730 0.363 438 HG22 VAL 77 HG22 VAL 77 -3.422 4.832 1.126 439 HG23 VAL 77 HG23 VAL 77 -3.730 4.648 -0.602 440 H ILE 78 H ILE 78 -8.180 3.102 0.183 441 HA ILE 78 HA ILE 78 -8.339 0.474 1.176 442 HB ILE 78 HB ILE 78 -10.517 2.379 0.321 443 HG12 ILE 78 HG12 ILE 78 -9.164 3.112 2.235 444 HG13 ILE 78 HG13 ILE 78 -10.804 2.711 2.736 445 HG21 ILE 78 HG21 ILE 78 -11.874 0.605 0.344 446 HG22 ILE 78 HG22 ILE 78 -10.651 -0.427 1.083 447 HG23 ILE 78 HG23 ILE 78 -11.654 0.613 2.094 448 HD11 ILE 78 HD11 ILE 78 -8.277 1.580 3.573 449 HD12 ILE 78 HD12 ILE 78 -9.868 1.487 4.330 450 HD13 ILE 78 HD13 ILE 78 -9.428 0.346 3.061 451 H LYS 79 H LYS 79 -9.797 1.847 -1.778 452 HA LYS 79 HA LYS 79 -10.687 -0.600 -2.826 453 HB2 LYS 79 HB2 LYS 79 -11.127 0.572 -4.837 454 HB3 LYS 79 HB3 LYS 79 -11.376 1.736 -3.543 455 HG2 LYS 79 HG2 LYS 79 -10.147 3.036 -4.919 456 HG3 LYS 79 HG3 LYS 79 -8.816 2.252 -4.065 457 HD2 LYS 79 HD2 LYS 79 -8.117 1.848 -6.186 458 HD3 LYS 79 HD3 LYS 79 -9.188 0.455 -6.010 459 HE2 LYS 79 HE2 LYS 79 -11.016 1.904 -6.984 460 HE3 LYS 79 HE3 LYS 79 -9.759 3.074 -7.380 461 HZ1 LYS 79 HZ1 LYS 79 -8.951 1.783 -9.027 462 HZ2 LYS 79 HZ2 LYS 79 -10.527 1.169 -9.044 463 HZ3 LYS 79 HZ3 LYS 79 -9.300 0.329 -8.237 464 H TYR 80 H TYR 80 -7.598 1.032 -3.006 465 HA TYR 80 HA TYR 80 -6.497 -0.490 -5.124 466 HB2 TYR 80 HB2 TYR 80 -5.519 1.638 -4.443 467 HB3 TYR 80 HB3 TYR 80 -5.130 0.979 -2.859 468 HD1 TYR 80 HD1 TYR 80 -3.318 -0.664 -2.609 469 HD2 TYR 80 HD2 TYR 80 -4.164 1.143 -6.366 470 HE1 TYR 80 HE1 TYR 80 -1.129 -1.404 -3.450 471 HE2 TYR 80 HE2 TYR 80 -1.977 0.407 -7.219 472 HH TYR 80 HH TYR 80 0.491 -0.386 -5.506 473 H MET 81 H MET 81 -6.003 -0.725 -1.597 474 HA MET 81 HA MET 81 -4.499 -3.104 -1.695 475 HB2 MET 81 HB2 MET 81 -4.759 -3.198 0.678 476 HB3 MET 81 HB3 MET 81 -4.609 -1.503 0.235 477 HG2 MET 81 HG2 MET 81 -6.973 -1.172 0.477 478 HG3 MET 81 HG3 MET 81 -7.223 -2.894 0.752 479 HE1 MET 81 HE1 MET 81 -5.045 0.183 2.906 480 HE2 MET 81 HE2 MET 81 -6.400 0.393 1.796 481 HE3 MET 81 HE3 MET 81 -6.682 0.365 3.538 482 H LYS 82 H LYS 82 -7.913 -2.485 -1.757 483 HA LYS 82 HA LYS 82 -8.874 -4.981 -0.912 484 HB2 LYS 82 HB2 LYS 82 -9.944 -2.598 -2.098 485 HB3 LYS 82 HB3 LYS 82 -10.608 -4.001 -2.925 486 HG2 LYS 82 HG2 LYS 82 -10.600 -4.248 -0.015 487 HG3 LYS 82 HG3 LYS 82 -11.581 -2.911 -0.621 488 HD2 LYS 82 HD2 LYS 82 -11.921 -5.385 -2.135 489 HD3 LYS 82 HD3 LYS 82 -12.381 -5.533 -0.437 490 HE2 LYS 82 HE2 LYS 82 -13.874 -3.636 -0.647 491 HE3 LYS 82 HE3 LYS 82 -13.364 -3.388 -2.317 492 HZ1 LYS 82 HZ1 LYS 82 -14.893 -5.681 -1.226 493 HZ2 LYS 82 HZ2 LYS 82 -14.226 -5.665 -2.780 494 HZ3 LYS 82 HZ3 LYS 82 -15.417 -4.540 -2.359 495 H ARG 83 H ARG 83 -8.440 -3.778 -4.245 496 HA ARG 83 HA ARG 83 -9.041 -6.126 -5.583 497 HB2 ARG 83 HB2 ARG 83 -8.176 -5.129 -7.482 498 HB3 ARG 83 HB3 ARG 83 -8.504 -3.730 -6.469 499 HG2 ARG 83 HG2 ARG 83 -6.001 -4.145 -5.718 500 HG3 ARG 83 HG3 ARG 83 -5.915 -4.904 -7.309 501 HD2 ARG 83 HD2 ARG 83 -7.153 -2.201 -7.019 502 HD3 ARG 83 HD3 ARG 83 -5.396 -2.360 -7.033 503 HE ARG 83 HE ARG 83 -6.485 -3.770 -9.213 504 HH11 ARG 83 HH11 ARG 83 -5.964 -0.516 -8.087 505 HH12 ARG 83 HH12 ARG 83 -5.865 0.158 -9.680 506 HH21 ARG 83 HH21 ARG 83 -6.356 -2.894 -11.315 507 HH22 ARG 83 HH22 ARG 83 -6.089 -1.196 -11.515 508 H LEU 84 H LEU 84 -6.195 -5.267 -3.806 509 HA LEU 84 HA LEU 84 -4.556 -7.354 -4.940 510 HB2 LEU 84 HB2 LEU 84 -4.137 -5.596 -2.527 511 HB3 LEU 84 HB3 LEU 84 -2.936 -6.695 -3.204 512 HG LEU 84 HG LEU 84 -4.105 -4.395 -4.757 513 HD11 LEU 84 HD11 LEU 84 -1.865 -4.466 -2.791 514 HD12 LEU 84 HD12 LEU 84 -3.068 -3.212 -3.085 515 HD13 LEU 84 HD13 LEU 84 -1.734 -3.436 -4.216 516 HD21 LEU 84 HD21 LEU 84 -3.131 -5.896 -6.249 517 HD22 LEU 84 HD22 LEU 84 -1.824 -6.303 -5.137 518 HD23 LEU 84 HD23 LEU 84 -1.844 -4.731 -5.936 519 H MET 85 H MET 85 -5.998 -6.733 -1.738 520 HA MET 85 HA MET 85 -5.297 -9.214 -0.615 521 HB2 MET 85 HB2 MET 85 -7.537 -7.305 0.066 522 HB3 MET 85 HB3 MET 85 -7.106 -8.701 1.045 523 HG2 MET 85 HG2 MET 85 -4.728 -7.613 1.006 524 HG3 MET 85 HG3 MET 85 -5.634 -6.150 0.624 525 HE1 MET 85 HE1 MET 85 -5.413 -4.647 2.490 526 HE2 MET 85 HE2 MET 85 -5.400 -5.076 4.201 527 HE3 MET 85 HE3 MET 85 -4.094 -5.618 3.145 528 H GLN 86 H GLN 86 -7.861 -8.272 -2.744 529 HA GLN 86 HA GLN 86 -9.457 -10.628 -2.240 530 HB2 GLN 86 HB2 GLN 86 -9.663 -8.419 -4.287 531 HB3 GLN 86 HB3 GLN 86 -10.785 -9.771 -4.208 532 HG2 GLN 86 HG2 GLN 86 -10.366 -8.289 -1.697 533 HG3 GLN 86 HG3 GLN 86 -11.193 -7.420 -2.990 534 HE21 GLN 86 HE21 GLN 86 -12.742 -7.664 -0.993 535 HE22 GLN 86 HE22 GLN 86 -13.871 -8.964 -1.130 536 H GLN 87 H GLN 87 -7.394 -9.408 -4.859 537 HA GLN 87 HA GLN 87 -7.712 -11.757 -6.462 538 HB2 GLN 87 HB2 GLN 87 -6.281 -10.734 -8.002 539 HB3 GLN 87 HB3 GLN 87 -7.100 -9.379 -7.236 540 HG2 GLN 87 HG2 GLN 87 -5.151 -9.065 -5.767 541 HG3 GLN 87 HG3 GLN 87 -4.330 -10.376 -6.613 542 HE21 GLN 87 HE21 GLN 87 -6.313 -7.674 -7.762 543 HE22 GLN 87 HE22 GLN 87 -5.116 -7.021 -8.823 544 H SER 88 H SER 88 -6.010 -11.154 -3.664 545 HA SER 88 HA SER 88 -3.550 -12.402 -4.051 546 HB2 SER 88 HB2 SER 88 -3.482 -12.695 -1.642 547 HB3 SER 88 HB3 SER 88 -4.202 -11.128 -2.011 548 HG SER 88 HG SER 88 -5.329 -13.371 -0.855 549 H VAL 89 H VAL 89 -3.116 -14.523 -2.596 550 HA VAL 89 HA VAL 89 -4.792 -16.603 -3.822 551 HB VAL 89 HB VAL 89 -2.512 -16.854 -4.468 552 HG11 VAL 89 HG11 VAL 89 -1.990 -15.902 -1.806 553 HG12 VAL 89 HG12 VAL 89 -1.077 -17.378 -2.124 554 HG13 VAL 89 HG13 VAL 89 -0.909 -15.987 -3.196 555 HG21 VAL 89 HG21 VAL 89 -3.736 -18.913 -3.855 556 HG22 VAL 89 HG22 VAL 89 -1.992 -19.062 -3.643 557 HG23 VAL 89 HG23 VAL 89 -3.033 -18.819 -2.240 558 H GLU 90 H GLU 90 -3.558 -15.412 -0.774 559 HA GLU 90 HA GLU 90 -4.693 -17.651 0.699 560 HB2 GLU 90 HB2 GLU 90 -3.205 -15.192 1.636 561 HB3 GLU 90 HB3 GLU 90 -3.762 -16.483 2.691 562 HG2 GLU 90 HG2 GLU 90 -1.964 -17.079 0.379 563 HG3 GLU 90 HG3 GLU 90 -1.311 -16.471 1.900 564 H SER 91 H SER 91 -6.719 -17.654 1.384 565 HA SER 91 HA SER 91 -8.490 -15.503 1.040 566 HB2 SER 91 HB2 SER 91 -9.675 -17.456 1.128 567 HB3 SER 91 HB3 SER 91 -8.608 -18.173 2.335 568 HG SER 91 HG SER 91 -10.522 -17.744 3.352 569 H VAL 92 H VAL 92 -6.258 -16.202 3.533 570 HA VAL 92 HA VAL 92 -7.491 -15.005 5.748 571 HB VAL 92 HB VAL 92 -5.266 -14.778 6.703 572 HG11 VAL 92 HG11 VAL 92 -6.349 -17.196 5.621 573 HG12 VAL 92 HG12 VAL 92 -4.586 -17.284 5.619 574 HG13 VAL 92 HG13 VAL 92 -5.452 -16.951 7.119 575 HG21 VAL 92 HG21 VAL 92 -3.794 -13.989 5.152 576 HG22 VAL 92 HG22 VAL 92 -3.383 -15.704 5.081 577 HG23 VAL 92 HG23 VAL 92 -4.442 -14.999 3.859 578 H TRP 93 H TRP 93 -5.799 -13.637 3.012 579 HA TRP 93 HA TRP 93 -5.273 -11.079 4.021 580 HB2 TRP 93 HB2 TRP 93 -5.538 -12.287 1.321 581 HB3 TRP 93 HB3 TRP 93 -5.679 -10.534 1.419 582 HD1 TRP 93 HD1 TRP 93 -3.159 -12.948 0.697 583 HE1 TRP 93 HE1 TRP 93 -0.792 -12.102 1.254 584 HE3 TRP 93 HE3 TRP 93 -4.393 -8.990 3.687 585 HZ2 TRP 93 HZ2 TRP 93 0.395 -10.031 2.761 586 HZ3 TRP 93 HZ3 TRP 93 -2.583 -7.627 4.647 587 HH2 TRP 93 HH2 TRP 93 -0.240 -8.139 4.193 588 H ASN 94 H ASN 94 -8.170 -12.438 2.537 589 HA ASN 94 HA ASN 94 -9.636 -10.102 2.166 590 HB2 ASN 94 HB2 ASN 94 -10.376 -12.964 2.647 591 HB3 ASN 94 HB3 ASN 94 -11.640 -11.736 2.642 592 HD21 ASN 94 HD21 ASN 94 -8.696 -12.159 0.713 593 HD22 ASN 94 HD22 ASN 94 -9.493 -12.143 -0.820 594 H MET 95 H MET 95 -9.107 -12.024 5.058 595 HA MET 95 HA MET 95 -11.056 -10.680 6.651 596 HB2 MET 95 HB2 MET 95 -8.635 -12.199 7.624 597 HB3 MET 95 HB3 MET 95 -10.118 -11.877 8.512 598 HG2 MET 95 HG2 MET 95 -11.217 -13.197 6.532 599 HG3 MET 95 HG3 MET 95 -9.588 -13.848 6.350 600 HE1 MET 95 HE1 MET 95 -8.533 -14.987 9.476 601 HE2 MET 95 HE2 MET 95 -9.099 -16.398 8.583 602 HE3 MET 95 HE3 MET 95 -8.368 -15.043 7.721 603 H ALA 96 H ALA 96 -7.574 -10.324 6.163 604 HA ALA 96 HA ALA 96 -6.973 -8.509 8.161 605 HB1 ALA 96 HB1 ALA 96 -5.789 -9.314 5.623 606 HB2 ALA 96 HB2 ALA 96 -5.420 -7.647 6.065 607 HB3 ALA 96 HB3 ALA 96 -5.022 -8.960 7.172 608 H PHE 97 H PHE 97 -8.389 -7.925 4.977 609 HA PHE 97 HA PHE 97 -8.281 -5.129 4.989 610 HB2 PHE 97 HB2 PHE 97 -8.819 -6.419 2.980 611 HB3 PHE 97 HB3 PHE 97 -10.333 -6.945 3.707 612 HD1 PHE 97 HD2 PHE 97 -8.588 -3.675 3.236 613 HD2 PHE 97 HD1 PHE 97 -12.173 -5.930 2.809 614 HE1 PHE 97 HE2 PHE 97 -9.717 -1.699 2.302 615 HE2 PHE 97 HE1 PHE 97 -13.307 -3.957 1.874 616 HZ PHE 97 HZ PHE 97 -12.079 -1.837 1.621 617 H ASP 98 H ASP 98 -10.859 -7.322 6.072 618 HA ASP 98 HA ASP 98 -12.655 -5.315 6.894 619 HB2 ASP 98 HB2 ASP 98 -13.031 -7.867 6.553 620 HB3 ASP 98 HB3 ASP 98 -12.513 -8.002 8.231 621 H PHE 99 H PHE 99 -10.019 -6.956 8.549 622 HA PHE 99 HA PHE 99 -10.548 -6.117 11.161 623 HB2 PHE 99 HB2 PHE 99 -8.900 -7.780 10.919 624 HB3 PHE 99 HB3 PHE 99 -8.008 -6.846 9.723 625 HD1 PHE 99 HD2 PHE 99 -8.687 -7.312 13.283 626 HD2 PHE 99 HD1 PHE 99 -6.496 -5.089 10.389 627 HE1 PHE 99 HE2 PHE 99 -7.221 -6.447 15.061 628 HE2 PHE 99 HE1 PHE 99 -5.027 -4.222 12.162 629 HZ PHE 99 HZ PHE 99 -5.389 -4.900 14.501 630 H ILE 100 H ILE 100 -8.595 -4.581 8.624 631 HA ILE 100 HA ILE 100 -7.793 -2.357 10.170 632 HB ILE 100 HB ILE 100 -8.060 -2.586 7.170 633 HG12 ILE 100 HG12 ILE 100 -5.451 -2.685 8.614 634 HG13 ILE 100 HG13 ILE 100 -6.469 -4.121 8.650 635 HG21 ILE 100 HG21 ILE 100 -7.545 -0.430 7.079 636 HG22 ILE 100 HG22 ILE 100 -7.460 -0.347 8.838 637 HG23 ILE 100 HG23 ILE 100 -6.027 -0.779 7.905 638 HD11 ILE 100 HD11 ILE 100 -6.256 -4.489 6.393 639 HD12 ILE 100 HD12 ILE 100 -5.869 -2.803 6.046 640 HD13 ILE 100 HD13 ILE 100 -4.668 -3.845 6.808 641 H LEU 101 H LEU 101 -10.564 -2.937 8.068 642 HA LEU 101 HA LEU 101 -11.535 -0.265 8.120 643 HB2 LEU 101 HB2 LEU 101 -12.694 -2.915 7.361 644 HB3 LEU 101 HB3 LEU 101 -13.728 -1.492 7.464 645 HG LEU 101 HG LEU 101 -11.274 -1.579 5.727 646 HD11 LEU 101 HD11 LEU 101 -12.424 -3.258 4.694 647 HD12 LEU 101 HD12 LEU 101 -13.172 -1.860 3.922 648 HD13 LEU 101 HD13 LEU 101 -13.995 -2.678 5.251 649 HD21 LEU 101 HD21 LEU 101 -12.388 0.603 6.408 650 HD22 LEU 101 HD22 LEU 101 -13.763 0.082 5.433 651 HD23 LEU 101 HD23 LEU 101 -12.186 0.320 4.679 652 H ASP 102 H ASP 102 -12.015 -3.087 10.141 653 HA ASP 102 HA ASP 102 -14.272 -2.244 11.566 654 HB2 ASP 102 HB2 ASP 102 -12.938 -4.519 11.570 655 HB3 ASP 102 HB3 ASP 102 -12.109 -3.787 12.941 656 H ASN 103 H ASN 103 -10.948 -1.277 11.761 657 HA ASN 103 HA ASN 103 -11.414 0.148 14.275 658 HB2 ASN 103 HB2 ASN 103 -8.910 -0.447 12.694 659 HB3 ASN 103 HB3 ASN 103 -8.926 0.643 14.078 660 HD21 ASN 103 HD21 ASN 103 -9.869 -2.633 13.125 661 HD22 ASN 103 HD22 ASN 103 -9.480 -3.372 14.638 662 H VAL 104 H VAL 104 -10.562 0.708 10.895 663 HA VAL 104 HA VAL 104 -10.260 3.533 11.165 664 HB VAL 104 HB VAL 104 -10.722 1.829 8.714 665 HG11 VAL 104 HG11 VAL 104 -9.972 4.743 8.933 666 HG12 VAL 104 HG12 VAL 104 -9.945 3.796 7.443 667 HG13 VAL 104 HG13 VAL 104 -11.472 4.087 8.276 668 HG21 VAL 104 HG21 VAL 104 -8.387 1.934 8.362 669 HG22 VAL 104 HG22 VAL 104 -8.178 3.162 9.610 670 HG23 VAL 104 HG23 VAL 104 -8.602 1.510 10.061 671 H GLN 105 H GLN 105 -12.782 1.576 9.563 672 HA GLN 105 HA GLN 105 -14.566 3.571 8.955 673 HB2 GLN 105 HB2 GLN 105 -15.273 0.798 9.933 674 HB3 GLN 105 HB3 GLN 105 -16.317 1.863 9.000 675 HG2 GLN 105 HG2 GLN 105 -13.654 1.028 7.931 676 HG3 GLN 105 HG3 GLN 105 -15.054 -0.037 7.802 677 HE21 GLN 105 HE21 GLN 105 -13.713 3.058 6.881 678 HE22 GLN 105 HE22 GLN 105 -14.759 3.330 5.534 679 H VAL 106 H VAL 106 -13.876 2.166 12.064 680 HA VAL 106 HA VAL 106 -16.198 3.133 13.405 681 HB VAL 106 HB VAL 106 -13.550 2.071 14.337 682 HG11 VAL 106 HG11 VAL 106 -15.606 3.529 15.946 683 HG12 VAL 106 HG12 VAL 106 -14.669 2.224 16.674 684 HG13 VAL 106 HG13 VAL 106 -13.848 3.640 16.014 685 HG21 VAL 106 HG21 VAL 106 -16.313 1.109 15.016 686 HG22 VAL 106 HG22 VAL 106 -15.499 0.630 13.526 687 HG23 VAL 106 HG23 VAL 106 -14.788 0.225 15.088 688 H VAL 107 H VAL 107 -12.796 4.213 13.469 689 HA VAL 107 HA VAL 107 -13.301 6.563 14.953 690 HB VAL 107 HB VAL 107 -11.066 5.658 14.858 691 HG11 VAL 107 HG11 VAL 107 -11.423 6.003 11.917 692 HG12 VAL 107 HG12 VAL 107 -9.802 6.101 12.610 693 HG13 VAL 107 HG13 VAL 107 -10.766 4.638 12.818 694 HG21 VAL 107 HG21 VAL 107 -11.242 8.044 15.239 695 HG22 VAL 107 HG22 VAL 107 -9.800 7.696 14.287 696 HG23 VAL 107 HG23 VAL 107 -11.238 8.348 13.503 697 H LEU 108 H LEU 108 -13.569 5.807 11.579 698 HA LEU 108 HA LEU 108 -13.527 8.505 10.633 699 HB2 LEU 108 HB2 LEU 108 -13.363 7.489 8.675 700 HB3 LEU 108 HB3 LEU 108 -13.523 5.940 9.500 701 HG LEU 108 HG LEU 108 -16.037 6.232 9.236 702 HD11 LEU 108 HD11 LEU 108 -16.723 8.215 8.503 703 HD12 LEU 108 HD12 LEU 108 -16.109 7.745 6.919 704 HD13 LEU 108 HD13 LEU 108 -15.093 8.682 8.014 705 HD21 LEU 108 HD21 LEU 108 -15.813 4.801 7.551 706 HD22 LEU 108 HD22 LEU 108 -14.086 5.157 7.567 707 HD23 LEU 108 HD23 LEU 108 -15.161 6.051 6.491 708 H GLN 109 H GLN 109 -16.041 6.217 11.571 709 HA GLN 109 HA GLN 109 -18.240 7.779 10.713 710 HB2 GLN 109 HB2 GLN 109 -17.902 5.479 12.603 711 HB3 GLN 109 HB3 GLN 109 -19.440 6.328 12.527 712 HG2 GLN 109 HG2 GLN 109 -19.715 5.776 10.225 713 HG3 GLN 109 HG3 GLN 109 -18.079 5.125 10.133 714 HE21 GLN 109 HE21 GLN 109 -17.613 3.185 11.305 715 HE22 GLN 109 HE22 GLN 109 -18.872 2.047 11.634 716 H GLN 110 H GLN 110 -16.506 7.537 13.781 717 HA GLN 110 HA GLN 110 -18.233 9.171 15.290 718 HB2 GLN 110 HB2 GLN 110 -15.295 8.553 15.604 719 HB3 GLN 110 HB3 GLN 110 -16.224 9.466 16.784 720 HG2 GLN 110 HG2 GLN 110 -17.782 7.447 16.857 721 HG3 GLN 110 HG3 GLN 110 -16.494 6.584 16.018 722 HE21 GLN 110 HE21 GLN 110 -15.254 5.460 17.318 723 HE22 GLN 110 HE22 GLN 110 -14.837 5.867 18.944 724 H THR 111 H THR 111 -16.093 9.921 12.774 725 HA THR 111 HA THR 111 -15.740 12.694 13.632 726 HB THR 111 HB THR 111 -14.613 11.185 11.268 727 HG1 THR 111 HG1 THR 111 -13.192 12.358 13.424 728 HG21 THR 111 HG21 THR 111 -14.208 14.055 12.111 729 HG22 THR 111 HG22 THR 111 -14.938 13.485 10.610 730 HG23 THR 111 HG23 THR 111 -13.223 13.214 10.916 731 H TYR 112 H TYR 112 -16.733 11.036 10.627 732 HA TYR 112 HA TYR 112 -18.398 13.364 9.979 733 HB2 TYR 112 HB2 TYR 112 -17.773 11.096 8.103 734 HB3 TYR 112 HB3 TYR 112 -18.263 12.739 7.710 735 HD1 TYR 112 HD2 TYR 112 -16.648 14.570 7.779 736 HD2 TYR 112 HD1 TYR 112 -15.470 10.572 8.633 737 HE1 TYR 112 HE2 TYR 112 -14.290 15.215 7.514 738 HE2 TYR 112 HE1 TYR 112 -13.108 11.206 8.371 739 HH TYR 112 HH TYR 112 -11.726 13.258 8.515 740 H GLY 113 H GLY 113 -18.499 9.832 10.228 741 HA2 GLY 113 HA2 GLY 113 -20.456 8.830 11.281 742 HA3 GLY 113 HA3 GLY 113 -21.435 10.040 10.463 743 H SER 114 H SER 114 -19.483 9.465 8.086 744 HA SER 114 HA SER 114 -21.191 7.395 6.944 745 HB2 SER 114 HB2 SER 114 -19.068 8.672 5.306 746 HB3 SER 114 HB3 SER 114 -20.740 8.298 4.892 747 HG SER 114 HG SER 114 -19.744 10.485 6.383 748 H THR 115 H THR 115 -19.766 6.129 5.127 749 HA THR 115 HA THR 115 -17.251 5.187 6.222 750 HB THR 115 HB THR 115 -17.945 2.816 6.251 751 HG1 THR 115 HG1 THR 115 -20.251 2.423 6.265 752 HG21 THR 115 HG21 THR 115 -19.778 4.357 8.069 753 HG22 THR 115 HG22 THR 115 -18.028 4.370 8.287 754 HG23 THR 115 HG23 THR 115 -18.918 2.852 8.390 755 H LEU 116 H LEU 116 -16.502 3.213 4.792 756 HA LEU 116 HA LEU 116 -16.719 4.133 2.036 757 HB2 LEU 116 HB2 LEU 116 -14.621 3.203 3.576 758 HB3 LEU 116 HB3 LEU 116 -14.987 1.845 2.513 759 HG LEU 116 HG LEU 116 -14.899 4.175 0.906 760 HD11 LEU 116 HD11 LEU 116 -13.099 5.379 1.504 761 HD12 LEU 116 HD12 LEU 116 -12.228 3.971 2.110 762 HD13 LEU 116 HD13 LEU 116 -13.448 4.751 3.115 763 HD21 LEU 116 HD21 LEU 116 -14.131 2.479 -0.317 764 HD22 LEU 116 HD22 LEU 116 -13.680 1.548 1.112 765 HD23 LEU 116 HD23 LEU 116 -12.573 2.757 0.460 766 H LYS 117 H LYS 117 -17.554 2.961 0.378 767 HA LYS 117 HA LYS 117 -19.310 0.781 1.058 768 HB2 LYS 117 HB2 LYS 117 -20.181 2.287 -0.539 769 HB3 LYS 117 HB3 LYS 117 -18.700 2.263 -1.490 770 HG2 LYS 117 HG2 LYS 117 -20.522 1.038 -2.572 771 HG3 LYS 117 HG3 LYS 117 -19.150 -0.007 -2.196 772 HD2 LYS 117 HD2 LYS 117 -20.877 -0.042 0.044 773 HD3 LYS 117 HD3 LYS 117 -21.877 -0.267 -1.394 774 HE2 LYS 117 HE2 LYS 117 -19.814 -1.913 -1.964 775 HE3 LYS 117 HE3 LYS 117 -19.830 -2.024 -0.205 776 HZ1 LYS 117 HZ1 LYS 117 -22.461 -2.225 -0.972 777 HZ2 LYS 117 HZ2 LYS 117 -21.465 -3.483 -0.436 778 HZ3 LYS 117 HZ3 LYS 117 -21.618 -3.172 -2.092 779 H VAL 118 H VAL 118 -18.196 -1.044 1.566 780 HA VAL 118 HA VAL 118 -16.385 -2.113 -0.502 781 HB VAL 118 HB VAL 118 -15.440 -3.511 1.417 782 HG11 VAL 118 HG11 VAL 118 -14.256 -1.270 2.312 783 HG12 VAL 118 HG12 VAL 118 -13.879 -2.015 0.757 784 HG13 VAL 118 HG13 VAL 118 -14.997 -0.653 0.835 785 HG21 VAL 118 HG21 VAL 118 -16.202 -1.385 3.305 786 HG22 VAL 118 HG22 VAL 118 -17.493 -2.497 2.852 787 HG23 VAL 118 HG23 VAL 118 -16.005 -3.118 3.565 788 H THR 119 H THR 119 -17.920 -3.264 -1.643 789 HA THR 119 HA THR 119 -19.962 -4.840 -0.589 790 HB THR 119 HB THR 119 -18.642 -5.826 -3.060 791 HG1 THR 119 HG1 THR 119 -19.071 -4.015 -4.210 792 HG21 THR 119 HG21 THR 119 -21.448 -5.215 -2.160 793 HG22 THR 119 HG22 THR 119 -20.744 -6.777 -2.577 794 HG23 THR 119 HG23 THR 119 -21.062 -5.588 -3.839 795 H LYS 207 H LYS 207 7.776 -6.206 16.058 796 HA LYS 207 HA LYS 207 9.876 -6.775 14.218 797 HB2 LYS 207 HB2 LYS 207 10.098 -8.826 15.453 798 HB3 LYS 207 HB3 LYS 207 8.359 -9.090 15.427 799 HG2 LYS 207 HG2 LYS 207 8.366 -9.866 13.293 800 HG3 LYS 207 HG3 LYS 207 9.745 -8.872 12.817 801 HD2 LYS 207 HD2 LYS 207 10.740 -10.930 12.844 802 HD3 LYS 207 HD3 LYS 207 11.016 -10.444 14.518 803 HE2 LYS 207 HE2 LYS 207 9.173 -11.753 15.278 804 HE3 LYS 207 HE3 LYS 207 8.640 -12.067 13.628 805 HZ1 LYS 207 HZ1 LYS 207 11.315 -12.927 14.515 806 HZ2 LYS 207 HZ2 LYS 207 10.361 -13.542 13.261 807 HZ3 LYS 207 HZ3 LYS 207 9.957 -13.870 14.871 808 H SER 208 H SER 208 9.147 -6.588 12.176 809 HA SER 208 HA SER 208 6.642 -7.376 11.221 810 HB2 SER 208 HB2 SER 208 5.342 -5.766 12.144 811 HB3 SER 208 HB3 SER 208 6.719 -4.720 12.495 812 HG SER 208 HG SER 208 5.138 -4.005 10.833 813 H PHE 209 H PHE 209 6.258 -6.706 9.006 814 HA PHE 209 HA PHE 209 8.640 -6.575 7.496 815 HB2 PHE 209 HB2 PHE 209 6.733 -7.657 6.535 816 HB3 PHE 209 HB3 PHE 209 5.742 -6.214 6.728 817 HD1 PHE 209 HD2 PHE 209 8.845 -7.374 5.021 818 HD2 PHE 209 HD1 PHE 209 5.444 -4.815 4.925 819 HE1 PHE 209 HE2 PHE 209 9.449 -6.661 2.745 820 HE2 PHE 209 HE1 PHE 209 6.042 -4.100 2.648 821 HZ PHE 209 HZ PHE 209 8.047 -5.022 1.555 822 H PHE 210 H PHE 210 5.998 -4.191 7.771 823 HA PHE 210 HA PHE 210 7.263 -2.129 6.389 824 HB2 PHE 210 HB2 PHE 210 5.210 -2.008 8.605 825 HB3 PHE 210 HB3 PHE 210 5.692 -0.619 7.635 826 HD1 PHE 210 HD1 PHE 210 5.792 -1.527 4.951 827 HD2 PHE 210 HD2 PHE 210 3.097 -2.679 8.037 828 HE1 PHE 210 HE1 PHE 210 4.113 -2.129 3.256 829 HE2 PHE 210 HE2 PHE 210 1.414 -3.284 6.347 830 HZ PHE 210 HZ PHE 210 1.921 -3.009 3.952 831 H ASP 211 H ASP 211 7.753 -3.304 9.598 832 HA ASP 211 HA ASP 211 9.039 -0.947 10.609 833 HB2 ASP 211 HB2 ASP 211 8.681 -3.759 11.584 834 HB3 ASP 211 HB3 ASP 211 9.864 -2.712 12.365 835 H LYS 212 H LYS 212 10.134 -4.069 9.336 836 HA LYS 212 HA LYS 212 12.914 -3.419 9.641 837 HB2 LYS 212 HB2 LYS 212 13.346 -5.528 8.555 838 HB3 LYS 212 HB3 LYS 212 12.043 -5.749 9.716 839 HG2 LYS 212 HG2 LYS 212 10.406 -5.774 7.976 840 HG3 LYS 212 HG3 LYS 212 11.611 -5.321 6.769 841 HD2 LYS 212 HD2 LYS 212 11.946 -7.816 8.395 842 HD3 LYS 212 HD3 LYS 212 10.898 -7.805 6.975 843 HE2 LYS 212 HE2 LYS 212 12.966 -6.732 5.805 844 HE3 LYS 212 HE3 LYS 212 13.859 -7.429 7.157 845 HZ1 LYS 212 HZ1 LYS 212 12.099 -9.356 6.097 846 HZ2 LYS 212 HZ2 LYS 212 13.787 -9.397 6.179 847 HZ3 LYS 212 HZ3 LYS 212 13.023 -8.706 4.838 848 H LYS 213 H LYS 213 10.504 -2.791 7.302 849 HA LYS 213 HA LYS 213 12.383 -2.408 5.120 850 HB2 LYS 213 HB2 LYS 213 9.731 -3.091 5.196 851 HB3 LYS 213 HB3 LYS 213 9.649 -1.382 4.789 852 HG2 LYS 213 HG2 LYS 213 11.420 -3.280 3.289 853 HG3 LYS 213 HG3 LYS 213 9.722 -3.048 2.868 854 HD2 LYS 213 HD2 LYS 213 11.262 -0.570 3.221 855 HD3 LYS 213 HD3 LYS 213 11.777 -1.578 1.867 856 HE2 LYS 213 HE2 LYS 213 9.167 -1.676 1.431 857 HE3 LYS 213 HE3 LYS 213 9.205 -0.154 2.319 858 HZ1 LYS 213 HZ1 LYS 213 9.577 -0.331 -0.304 859 HZ2 LYS 213 HZ2 LYS 213 11.183 -0.447 0.212 860 HZ3 LYS 213 HZ3 LYS 213 10.251 0.897 0.645 861 H ARG 214 H ARG 214 10.236 -0.424 7.137 862 HA ARG 214 HA ARG 214 10.760 2.057 6.005 863 HB2 ARG 214 HB2 ARG 214 9.967 3.025 8.061 864 HB3 ARG 214 HB3 ARG 214 9.018 1.583 7.723 865 HG2 ARG 214 HG2 ARG 214 10.145 0.338 9.393 866 HG3 ARG 214 HG3 ARG 214 11.373 1.591 9.589 867 HD2 ARG 214 HD2 ARG 214 9.264 3.074 10.159 868 HD3 ARG 214 HD3 ARG 214 8.562 1.507 10.561 869 HE ARG 214 HE ARG 214 11.108 1.821 11.772 870 HH11 ARG 214 HH11 ARG 214 7.782 2.815 12.035 871 HH12 ARG 214 HH12 ARG 214 7.861 3.085 13.744 872 HH21 ARG 214 HH21 ARG 214 11.226 2.173 14.022 873 HH22 ARG 214 HH22 ARG 214 9.821 2.720 14.874 874 H SER 215 H SER 215 12.711 0.103 8.116 875 HA SER 215 HA SER 215 14.475 2.153 8.988 876 HB2 SER 215 HB2 SER 215 14.516 0.246 10.341 877 HB3 SER 215 HB3 SER 215 14.588 -0.849 8.961 878 HG SER 215 HG SER 215 16.597 -0.399 10.265 879 H GLU 216 H GLU 216 14.244 0.226 6.119 880 HA GLU 216 HA GLU 216 16.889 0.387 5.200 881 HB2 GLU 216 HB2 GLU 216 14.337 0.303 3.582 882 HB3 GLU 216 HB3 GLU 216 15.947 -0.043 2.969 883 HG2 GLU 216 HG2 GLU 216 14.679 -1.597 5.204 884 HG3 GLU 216 HG3 GLU 216 14.512 -2.036 3.505 885 H ARG 217 H ARG 217 14.093 2.422 4.323 886 HA ARG 217 HA ARG 217 15.578 4.280 2.815 887 HB2 ARG 217 HB2 ARG 217 13.582 5.746 3.071 888 HB3 ARG 217 HB3 ARG 217 13.193 4.120 2.524 889 HG2 ARG 217 HG2 ARG 217 12.565 3.528 4.835 890 HG3 ARG 217 HG3 ARG 217 12.870 5.198 5.315 891 HD2 ARG 217 HD2 ARG 217 10.765 4.153 3.439 892 HD3 ARG 217 HD3 ARG 217 10.537 5.016 4.959 893 HE ARG 217 HE ARG 217 11.879 6.810 3.472 894 HH11 ARG 217 HH11 ARG 217 9.057 4.873 2.835 895 HH12 ARG 217 HH12 ARG 217 8.346 6.030 1.759 896 HH21 ARG 217 HH21 ARG 217 10.952 8.341 2.057 897 HH22 ARG 217 HH22 ARG 217 9.426 8.002 1.316 898 H ILE 218 H ILE 218 14.601 4.227 6.212 899 HA ILE 218 HA ILE 218 15.525 6.816 6.863 900 HB ILE 218 HB ILE 218 15.219 4.410 8.663 901 HG12 ILE 218 HG12 ILE 218 13.302 6.714 8.406 902 HG13 ILE 218 HG13 ILE 218 13.192 5.321 7.337 903 HG21 ILE 218 HG21 ILE 218 15.658 7.325 9.240 904 HG22 ILE 218 HG22 ILE 218 14.955 6.223 10.424 905 HG23 ILE 218 HG23 ILE 218 16.585 5.939 9.814 906 HD11 ILE 218 HD11 ILE 218 11.760 4.633 8.939 907 HD12 ILE 218 HD12 ILE 218 13.254 4.042 9.668 908 HD13 ILE 218 HD13 ILE 218 12.552 5.568 10.207 909 H SER 219 H SER 219 17.135 3.780 6.451 910 HA SER 219 HA SER 219 19.554 4.708 7.787 911 HB2 SER 219 HB2 SER 219 18.976 2.400 8.181 912 HB3 SER 219 HB3 SER 219 18.852 2.086 6.449 913 HG SER 219 HG SER 219 21.167 2.604 7.986 914 H ASN 220 H ASN 220 18.229 4.354 4.605 915 HA ASN 220 HA ASN 220 20.341 5.877 3.445 916 HB2 ASN 220 HB2 ASN 220 21.220 3.441 3.616 917 HB3 ASN 220 HB3 ASN 220 20.101 3.110 2.297 918 HD21 ASN 220 HD21 ASN 220 20.526 3.894 0.269 919 HD22 ASN 220 HD22 ASN 220 22.035 4.616 -0.165 Start of MODEL 3 1 H ALA 23 H ALA 23 3.164 14.004 13.581 2 HA ALA 23 HA ALA 23 1.771 11.512 14.311 3 HB1 ALA 23 HB1 ALA 23 1.605 13.330 15.974 4 HB2 ALA 23 HB2 ALA 23 0.828 14.340 14.755 5 HB3 ALA 23 HB3 ALA 23 0.040 12.863 15.308 6 H ALA 24 H ALA 24 2.506 12.138 11.624 7 HA ALA 24 HA ALA 24 -0.073 12.831 10.395 8 HB1 ALA 24 HB1 ALA 24 1.250 14.154 9.172 9 HB2 ALA 24 HB2 ALA 24 2.711 13.288 9.649 10 HB3 ALA 24 HB3 ALA 24 1.714 12.677 8.328 11 HA PRO 25 HA PRO 25 -0.802 8.758 8.937 12 HB2 PRO 25 HB2 PRO 25 -1.796 9.199 6.449 13 HB3 PRO 25 HB3 PRO 25 -2.701 9.563 7.924 14 HG2 PRO 25 HG2 PRO 25 -1.134 11.405 6.158 15 HG3 PRO 25 HG3 PRO 25 -2.722 11.655 6.907 16 HD2 PRO 25 HD2 PRO 25 -0.449 12.714 7.926 17 HD3 PRO 25 HD3 PRO 25 -1.811 12.215 8.949 18 H ASN 26 H ASN 26 1.372 8.009 8.844 19 HA ASN 26 HA ASN 26 2.450 7.883 6.106 20 HB2 ASN 26 HB2 ASN 26 4.259 7.756 8.494 21 HB3 ASN 26 HB3 ASN 26 4.637 8.216 6.837 22 HD21 ASN 26 HD21 ASN 26 2.742 10.089 6.304 23 HD22 ASN 26 HD22 ASN 26 2.958 11.457 7.336 24 H LEU 27 H LEU 27 2.991 5.906 5.361 25 HA LEU 27 HA LEU 27 2.607 3.643 7.198 26 HB2 LEU 27 HB2 LEU 27 1.287 4.070 4.941 27 HB3 LEU 27 HB3 LEU 27 2.703 3.280 4.248 28 HG LEU 27 HG LEU 27 2.266 1.316 5.685 29 HD11 LEU 27 HD11 LEU 27 0.605 3.089 7.068 30 HD12 LEU 27 HD12 LEU 27 0.825 1.366 7.369 31 HD13 LEU 27 HD13 LEU 27 -0.473 1.917 6.311 32 HD21 LEU 27 HD21 LEU 27 0.579 0.417 4.333 33 HD22 LEU 27 HD22 LEU 27 1.331 1.661 3.334 34 HD23 LEU 27 HD23 LEU 27 -0.213 1.980 4.127 35 H ALA 28 H ALA 28 4.463 2.875 7.958 36 HA ALA 28 HA ALA 28 6.619 2.153 8.093 37 HB1 ALA 28 HB1 ALA 28 6.221 1.573 5.161 38 HB2 ALA 28 HB2 ALA 28 7.472 0.887 6.198 39 HB3 ALA 28 HB3 ALA 28 5.775 0.505 6.492 40 H GLY 29 H GLY 29 6.099 4.980 7.397 41 HA2 GLY 29 HA2 GLY 29 7.721 6.699 7.325 42 HA3 GLY 29 HA3 GLY 29 8.813 5.602 6.492 43 H ALA 30 H ALA 30 5.666 5.531 5.244 44 HA ALA 30 HA ALA 30 6.523 7.205 2.979 45 HB1 ALA 30 HB1 ALA 30 4.896 5.931 1.641 46 HB2 ALA 30 HB2 ALA 30 6.128 4.897 2.366 47 HB3 ALA 30 HB3 ALA 30 4.510 4.962 3.064 48 H VAL 31 H VAL 31 5.695 9.187 3.087 49 HA VAL 31 HA VAL 31 3.102 9.633 4.343 50 HB VAL 31 HB VAL 31 4.969 11.700 3.182 51 HG11 VAL 31 HG11 VAL 31 2.912 12.733 3.469 52 HG12 VAL 31 HG12 VAL 31 2.527 11.793 4.912 53 HG13 VAL 31 HG13 VAL 31 3.733 13.079 4.990 54 HG21 VAL 31 HG21 VAL 31 6.370 11.254 4.851 55 HG22 VAL 31 HG22 VAL 31 5.115 11.786 5.970 56 HG23 VAL 31 HG23 VAL 31 5.254 10.079 5.549 57 H GLU 32 H GLU 32 4.555 9.508 1.202 58 HA GLU 32 HA GLU 32 2.391 10.899 -0.116 59 HB2 GLU 32 HB2 GLU 32 4.729 9.330 -1.216 60 HB3 GLU 32 HB3 GLU 32 3.572 10.212 -2.202 61 HG2 GLU 32 HG2 GLU 32 4.289 12.205 -0.627 62 HG3 GLU 32 HG3 GLU 32 5.744 11.225 -0.456 63 H PHE 33 H PHE 33 0.737 10.013 -1.277 64 HA PHE 33 HA PHE 33 -0.305 7.551 -0.517 65 HB2 PHE 33 HB2 PHE 33 -1.816 9.123 -1.426 66 HB3 PHE 33 HB3 PHE 33 -0.853 9.328 -2.887 67 HD1 PHE 33 HD1 PHE 33 -2.871 6.808 -1.043 68 HD2 PHE 33 HD2 PHE 33 -1.386 8.143 -4.802 69 HE1 PHE 33 HE1 PHE 33 -4.254 5.123 -2.184 70 HE2 PHE 33 HE2 PHE 33 -2.767 6.460 -5.949 71 HZ PHE 33 HZ PHE 33 -4.202 4.947 -4.640 72 H SER 34 H SER 34 1.288 8.400 -3.590 73 HA SER 34 HA SER 34 1.218 5.932 -4.817 74 HB2 SER 34 HB2 SER 34 2.111 7.382 -6.309 75 HB3 SER 34 HB3 SER 34 2.876 8.352 -5.050 76 HG SER 34 HG SER 34 3.892 6.274 -6.545 77 H ASP 35 H ASP 35 3.425 7.108 -2.348 78 HA ASP 35 HA ASP 35 5.179 4.848 -2.485 79 HB2 ASP 35 HB2 ASP 35 5.794 7.152 -1.625 80 HB3 ASP 35 HB3 ASP 35 4.877 6.767 -0.172 81 H VAL 36 H VAL 36 2.301 5.682 -0.689 82 HA VAL 36 HA VAL 36 2.524 3.656 1.293 83 HB VAL 36 HB VAL 36 0.059 5.078 0.277 84 HG11 VAL 36 HG11 VAL 36 -1.128 3.736 1.586 85 HG12 VAL 36 HG12 VAL 36 0.338 2.868 2.051 86 HG13 VAL 36 HG13 VAL 36 -0.188 4.274 2.979 87 HG21 VAL 36 HG21 VAL 36 0.559 6.815 1.602 88 HG22 VAL 36 HG22 VAL 36 1.131 5.777 2.907 89 HG23 VAL 36 HG23 VAL 36 2.203 6.179 1.567 90 H LYS 37 H LYS 37 0.445 3.886 -1.600 91 HA LYS 37 HA LYS 37 -0.641 1.333 -1.477 92 HB2 LYS 37 HB2 LYS 37 -1.030 1.587 -3.927 93 HB3 LYS 37 HB3 LYS 37 -1.551 2.975 -2.980 94 HG2 LYS 37 HG2 LYS 37 0.270 4.280 -3.696 95 HG3 LYS 37 HG3 LYS 37 1.123 2.875 -4.341 96 HD2 LYS 37 HD2 LYS 37 -1.401 2.981 -5.610 97 HD3 LYS 37 HD3 LYS 37 -0.728 4.612 -5.651 98 HE2 LYS 37 HE2 LYS 37 1.368 3.672 -6.577 99 HE3 LYS 37 HE3 LYS 37 0.601 2.085 -6.623 100 HZ1 LYS 37 HZ1 LYS 37 -0.826 4.258 -7.933 101 HZ2 LYS 37 HZ2 LYS 37 -0.652 2.642 -8.398 102 HZ3 LYS 37 HZ3 LYS 37 0.601 3.743 -8.681 103 H THR 38 H THR 38 2.466 2.405 -2.664 104 HA THR 38 HA THR 38 3.172 0.089 -4.112 105 HB THR 38 HB THR 38 4.922 2.134 -2.736 106 HG1 THR 38 HG1 THR 38 3.872 1.832 -5.349 107 HG21 THR 38 HG21 THR 38 6.725 1.278 -4.196 108 HG22 THR 38 HG22 THR 38 5.662 -0.034 -4.705 109 HG23 THR 38 HG23 THR 38 6.180 0.080 -3.023 110 H LEU 39 H LEU 39 3.769 1.047 -0.746 111 HA LEU 39 HA LEU 39 5.285 -1.224 -0.039 112 HB2 LEU 39 HB2 LEU 39 3.593 0.590 1.673 113 HB3 LEU 39 HB3 LEU 39 4.746 -0.591 2.289 114 HG LEU 39 HG LEU 39 5.677 1.562 0.434 115 HD11 LEU 39 HD11 LEU 39 4.738 1.893 3.223 116 HD12 LEU 39 HD12 LEU 39 4.772 3.046 1.891 117 HD13 LEU 39 HD13 LEU 39 6.252 2.682 2.777 118 HD21 LEU 39 HD21 LEU 39 7.220 0.681 2.783 119 HD22 LEU 39 HD22 LEU 39 7.739 0.968 1.123 120 HD23 LEU 39 HD23 LEU 39 6.939 -0.545 1.547 121 H LEU 40 H LEU 40 1.842 -0.603 -0.152 122 HA LEU 40 HA LEU 40 1.068 -2.919 1.323 123 HB2 LEU 40 HB2 LEU 40 -0.559 -1.362 -0.677 124 HB3 LEU 40 HB3 LEU 40 -1.169 -2.431 0.585 125 HG LEU 40 HG LEU 40 0.408 0.009 1.305 126 HD11 LEU 40 HD11 LEU 40 -2.458 0.391 1.423 127 HD12 LEU 40 HD12 LEU 40 -1.888 0.162 -0.230 128 HD13 LEU 40 HD13 LEU 40 -1.203 1.444 0.769 129 HD21 LEU 40 HD21 LEU 40 0.031 -1.416 3.135 130 HD22 LEU 40 HD22 LEU 40 -1.631 -1.743 2.645 131 HD23 LEU 40 HD23 LEU 40 -1.192 -0.154 3.275 132 H LYS 41 H LYS 41 1.118 -2.138 -2.148 133 HA LYS 41 HA LYS 41 0.150 -4.523 -3.155 134 HB2 LYS 41 HB2 LYS 41 1.090 -2.236 -4.262 135 HB3 LYS 41 HB3 LYS 41 2.412 -3.331 -4.644 136 HG2 LYS 41 HG2 LYS 41 0.451 -4.881 -5.465 137 HG3 LYS 41 HG3 LYS 41 -0.401 -3.341 -5.601 138 HD2 LYS 41 HD2 LYS 41 0.585 -3.706 -7.712 139 HD3 LYS 41 HD3 LYS 41 1.612 -2.513 -6.913 140 HE2 LYS 41 HE2 LYS 41 3.223 -3.935 -7.670 141 HE3 LYS 41 HE3 LYS 41 2.888 -4.694 -6.116 142 HZ1 LYS 41 HZ1 LYS 41 1.266 -6.136 -7.344 143 HZ2 LYS 41 HZ2 LYS 41 2.895 -6.402 -7.720 144 HZ3 LYS 41 HZ3 LYS 41 1.913 -5.530 -8.786 145 H GLU 42 H GLU 42 3.445 -3.705 -2.170 146 HA GLU 42 HA GLU 42 4.527 -6.236 -2.985 147 HB2 GLU 42 HB2 GLU 42 6.578 -5.481 -1.888 148 HB3 GLU 42 HB3 GLU 42 5.926 -4.228 -2.934 149 HG2 GLU 42 HG2 GLU 42 4.974 -3.099 -0.987 150 HG3 GLU 42 HG3 GLU 42 5.640 -4.351 0.060 151 H TRP 43 H TRP 43 3.362 -4.817 0.015 152 HA TRP 43 HA TRP 43 4.245 -6.926 1.707 153 HB2 TRP 43 HB2 TRP 43 3.774 -4.756 2.658 154 HB3 TRP 43 HB3 TRP 43 2.110 -4.819 2.082 155 HD1 TRP 43 HD1 TRP 43 4.230 -7.249 4.266 156 HE1 TRP 43 HE1 TRP 43 2.825 -7.874 6.329 157 HE3 TRP 43 HE3 TRP 43 0.056 -4.470 3.276 158 HZ2 TRP 43 HZ2 TRP 43 0.282 -7.271 7.395 159 HZ3 TRP 43 HZ3 TRP 43 -1.819 -4.549 4.868 160 HH2 TRP 43 HH2 TRP 43 -1.707 -5.922 6.883 161 H ILE 44 H ILE 44 1.724 -6.680 -0.543 162 HA ILE 44 HA ILE 44 0.219 -8.860 0.734 163 HB ILE 44 HB ILE 44 -0.637 -7.103 -1.568 164 HG12 ILE 44 HG12 ILE 44 -1.828 -6.989 1.179 165 HG13 ILE 44 HG13 ILE 44 -0.337 -6.114 0.848 166 HG21 ILE 44 HG21 ILE 44 -2.919 -8.085 -0.659 167 HG22 ILE 44 HG22 ILE 44 -1.945 -8.947 -1.848 168 HG23 ILE 44 HG23 ILE 44 -1.864 -9.402 -0.146 169 HD11 ILE 44 HD11 ILE 44 -1.367 -4.691 -0.667 170 HD12 ILE 44 HD12 ILE 44 -2.745 -5.770 -0.891 171 HD13 ILE 44 HD13 ILE 44 -2.561 -4.874 0.616 172 H THR 45 H THR 45 2.712 -8.612 -1.252 173 HA THR 45 HA THR 45 1.828 -10.847 -2.959 174 HB THR 45 HB THR 45 3.528 -10.091 -4.624 175 HG1 THR 45 HG1 THR 45 3.791 -8.027 -2.720 176 HG21 THR 45 HG21 THR 45 1.169 -8.405 -3.884 177 HG22 THR 45 HG22 THR 45 1.381 -9.493 -5.255 178 HG23 THR 45 HG23 THR 45 2.201 -7.931 -5.233 179 H THR 46 H THR 46 4.763 -9.308 -1.637 180 HA THR 46 HA THR 46 6.300 -11.714 -1.816 181 HB THR 46 HB THR 46 7.294 -9.417 -1.901 182 HG1 THR 46 HG1 THR 46 9.135 -10.152 -0.988 183 HG21 THR 46 HG21 THR 46 5.903 -9.115 0.535 184 HG22 THR 46 HG22 THR 46 6.953 -7.945 -0.263 185 HG23 THR 46 HG23 THR 46 7.622 -9.064 0.924 186 H ILE 47 H ILE 47 3.900 -10.754 0.277 187 HA ILE 47 HA ILE 47 4.793 -12.705 2.280 188 HB ILE 47 HB ILE 47 3.654 -9.981 2.911 189 HG12 ILE 47 HG12 ILE 47 6.063 -10.673 4.315 190 HG13 ILE 47 HG13 ILE 47 6.313 -10.892 2.586 191 HG21 ILE 47 HG21 ILE 47 4.253 -12.311 4.728 192 HG22 ILE 47 HG22 ILE 47 3.873 -10.678 5.276 193 HG23 ILE 47 HG23 ILE 47 2.670 -11.612 4.386 194 HD11 ILE 47 HD11 ILE 47 5.842 -8.426 4.142 195 HD12 ILE 47 HD12 ILE 47 6.886 -8.714 2.749 196 HD13 ILE 47 HD13 ILE 47 5.150 -8.506 2.522 197 H SER 48 H SER 48 3.279 -14.158 2.763 198 HA SER 48 HA SER 48 0.524 -13.627 1.878 199 HB2 SER 48 HB2 SER 48 0.322 -15.825 1.280 200 HB3 SER 48 HB3 SER 48 2.074 -15.690 1.134 201 HG SER 48 HG SER 48 0.534 -16.938 3.108 202 H ASP 49 H ASP 49 2.506 -14.366 4.613 203 HA ASP 49 HA ASP 49 0.103 -14.642 6.296 204 HB2 ASP 49 HB2 ASP 49 1.815 -15.583 7.983 205 HB3 ASP 49 HB3 ASP 49 1.349 -16.600 6.624 206 HA PRO 50 HA PRO 50 1.879 -10.493 7.287 207 HB2 PRO 50 HB2 PRO 50 -0.534 -9.276 7.538 208 HB3 PRO 50 HB3 PRO 50 0.293 -9.460 5.986 209 HG2 PRO 50 HG2 PRO 50 -1.922 -11.097 7.159 210 HG3 PRO 50 HG3 PRO 50 -1.725 -10.508 5.498 211 HD2 PRO 50 HD2 PRO 50 -1.139 -13.051 6.220 212 HD3 PRO 50 HD3 PRO 50 -0.257 -12.194 4.939 213 H MET 51 H MET 51 2.277 -9.819 9.317 214 HA MET 51 HA MET 51 0.998 -11.224 11.509 215 HB2 MET 51 HB2 MET 51 3.545 -10.559 11.175 216 HB3 MET 51 HB3 MET 51 3.020 -9.079 11.964 217 HG2 MET 51 HG2 MET 51 1.975 -10.759 13.691 218 HG3 MET 51 HG3 MET 51 3.201 -11.843 13.036 219 HE1 MET 51 HE1 MET 51 6.496 -10.521 14.071 220 HE2 MET 51 HE2 MET 51 5.549 -11.431 12.895 221 HE3 MET 51 HE3 MET 51 5.886 -9.721 12.622 222 H GLU 52 H GLU 52 0.136 -10.111 13.374 223 HA GLU 52 HA GLU 52 -1.798 -8.206 12.752 224 HB2 GLU 52 HB2 GLU 52 -1.651 -9.771 14.782 225 HB3 GLU 52 HB3 GLU 52 -0.641 -8.531 15.511 226 HG2 GLU 52 HG2 GLU 52 -2.370 -7.099 15.817 227 HG3 GLU 52 HG3 GLU 52 -3.238 -7.667 14.392 228 H GLU 53 H GLU 53 1.316 -7.763 14.420 229 HA GLU 53 HA GLU 53 1.182 -5.051 14.910 230 HB2 GLU 53 HB2 GLU 53 2.993 -6.649 15.639 231 HB3 GLU 53 HB3 GLU 53 3.682 -6.498 14.028 232 HG2 GLU 53 HG2 GLU 53 4.817 -5.058 15.624 233 HG3 GLU 53 HG3 GLU 53 4.013 -4.118 14.368 234 H ASP 54 H ASP 54 1.889 -6.722 11.914 235 HA ASP 54 HA ASP 54 2.769 -4.387 10.508 236 HB2 ASP 54 HB2 ASP 54 2.270 -7.229 9.863 237 HB3 ASP 54 HB3 ASP 54 2.062 -6.099 8.528 238 H ILE 55 H ILE 55 -0.274 -6.150 10.804 239 HA ILE 55 HA ILE 55 -1.683 -4.669 8.839 240 HB ILE 55 HB ILE 55 -2.779 -6.184 11.212 241 HG12 ILE 55 HG12 ILE 55 -2.606 -7.130 8.354 242 HG13 ILE 55 HG13 ILE 55 -1.324 -7.439 9.520 243 HG21 ILE 55 HG21 ILE 55 -4.839 -6.312 9.800 244 HG22 ILE 55 HG22 ILE 55 -4.451 -4.696 10.389 245 HG23 ILE 55 HG23 ILE 55 -4.098 -5.133 8.717 246 HD11 ILE 55 HD11 ILE 55 -3.416 -8.339 10.919 247 HD12 ILE 55 HD12 ILE 55 -4.002 -8.638 9.283 248 HD13 ILE 55 HD13 ILE 55 -2.477 -9.346 9.816 249 H LEU 56 H LEU 56 -1.432 -4.376 12.365 250 HA LEU 56 HA LEU 56 -3.276 -2.377 12.822 251 HB2 LEU 56 HB2 LEU 56 -0.754 -3.226 14.127 252 HB3 LEU 56 HB3 LEU 56 -1.412 -1.659 14.589 253 HG LEU 56 HG LEU 56 -2.100 -3.392 16.150 254 HD11 LEU 56 HD11 LEU 56 -4.619 -2.866 14.686 255 HD12 LEU 56 HD12 LEU 56 -3.659 -1.469 15.173 256 HD13 LEU 56 HD13 LEU 56 -4.218 -2.619 16.386 257 HD21 LEU 56 HD21 LEU 56 -2.057 -5.368 14.867 258 HD22 LEU 56 HD22 LEU 56 -3.184 -4.717 13.677 259 HD23 LEU 56 HD23 LEU 56 -3.747 -5.120 15.300 260 H GLN 57 H GLN 57 0.027 -2.100 11.622 261 HA GLN 57 HA GLN 57 0.386 0.642 11.786 262 HB2 GLN 57 HB2 GLN 57 1.430 -1.479 9.960 263 HB3 GLN 57 HB3 GLN 57 1.753 0.206 9.571 264 HG2 GLN 57 HG2 GLN 57 2.490 0.230 12.129 265 HG3 GLN 57 HG3 GLN 57 2.791 -1.469 11.771 266 HE21 GLN 57 HE21 GLN 57 3.220 1.599 10.034 267 HE22 GLN 57 HE22 GLN 57 4.870 1.321 9.605 268 H VAL 58 H VAL 58 -1.496 -1.236 9.517 269 HA VAL 58 HA VAL 58 -1.894 0.872 7.631 270 HB VAL 58 HB VAL 58 -3.684 -1.522 8.020 271 HG11 VAL 58 HG11 VAL 58 -4.720 -0.809 6.191 272 HG12 VAL 58 HG12 VAL 58 -3.728 0.649 6.234 273 HG13 VAL 58 HG13 VAL 58 -3.196 -0.754 5.307 274 HG21 VAL 58 HG21 VAL 58 -1.841 -2.755 7.671 275 HG22 VAL 58 HG22 VAL 58 -1.998 -2.220 5.998 276 HG23 VAL 58 HG23 VAL 58 -0.907 -1.375 7.095 277 H VAL 59 H VAL 59 -3.596 -0.272 10.481 278 HA VAL 59 HA VAL 59 -5.991 1.180 10.092 279 HB VAL 59 HB VAL 59 -4.725 0.212 12.659 280 HG11 VAL 59 HG11 VAL 59 -7.052 0.382 13.553 281 HG12 VAL 59 HG12 VAL 59 -6.293 1.935 13.199 282 HG13 VAL 59 HG13 VAL 59 -7.490 1.264 12.092 283 HG21 VAL 59 HG21 VAL 59 -5.674 -1.287 10.586 284 HG22 VAL 59 HG22 VAL 59 -5.610 -1.813 12.269 285 HG23 VAL 59 HG23 VAL 59 -7.102 -1.140 11.611 286 H ARG 60 H ARG 60 -3.094 1.885 12.039 287 HA ARG 60 HA ARG 60 -3.933 4.362 13.032 288 HB2 ARG 60 HB2 ARG 60 -1.117 3.441 12.423 289 HB3 ARG 60 HB3 ARG 60 -1.548 4.800 13.452 290 HG2 ARG 60 HG2 ARG 60 -2.609 2.079 14.066 291 HG3 ARG 60 HG3 ARG 60 -0.955 2.507 14.508 292 HD2 ARG 60 HD2 ARG 60 -2.106 4.635 15.515 293 HD3 ARG 60 HD3 ARG 60 -3.539 3.607 15.512 294 HE ARG 60 HE ARG 60 -1.257 2.353 16.709 295 HH11 ARG 60 HH11 ARG 60 -3.926 4.520 17.260 296 HH12 ARG 60 HH12 ARG 60 -3.983 4.226 18.966 297 HH21 ARG 60 HH21 ARG 60 -1.322 1.958 18.955 298 HH22 ARG 60 HH22 ARG 60 -2.500 2.769 19.930 299 H TYR 61 H TYR 61 -2.676 3.449 9.929 300 HA TYR 61 HA TYR 61 -1.944 6.088 9.097 301 HB2 TYR 61 HB2 TYR 61 -0.853 4.258 8.015 302 HB3 TYR 61 HB3 TYR 61 -2.388 3.511 7.587 303 HD1 TYR 61 HD2 TYR 61 -0.233 6.457 6.911 304 HD2 TYR 61 HD1 TYR 61 -3.447 4.022 5.551 305 HE1 TYR 61 HE2 TYR 61 -0.182 7.612 4.741 306 HE2 TYR 61 HE1 TYR 61 -3.404 5.170 3.376 307 HH TYR 61 HH TYR 61 -2.345 7.868 2.741 308 H CYS 62 H CYS 62 -4.646 3.923 8.245 309 HA CYS 62 HA CYS 62 -6.038 5.827 6.700 310 HB2 CYS 62 HB2 CYS 62 -6.793 3.235 8.007 311 HB3 CYS 62 HB3 CYS 62 -8.033 4.241 7.271 312 HG CYS 62 HG CYS 62 -6.026 2.099 5.846 313 H THR 63 H THR 63 -6.313 4.867 10.096 314 HA THR 63 HA THR 63 -8.559 6.383 10.770 315 HB THR 63 HB THR 63 -7.670 6.324 13.110 316 HG1 THR 63 HG1 THR 63 -5.587 6.060 13.304 317 HG21 THR 63 HG21 THR 63 -8.470 4.169 11.443 318 HG22 THR 63 HG22 THR 63 -8.673 4.338 13.188 319 HG23 THR 63 HG23 THR 63 -7.224 3.569 12.538 320 H ASP 64 H ASP 64 -5.254 7.320 10.262 321 HA ASP 64 HA ASP 64 -5.424 9.841 11.600 322 HB2 ASP 64 HB2 ASP 64 -3.445 8.457 9.868 323 HB3 ASP 64 HB3 ASP 64 -3.351 10.214 9.942 324 H LEU 65 H LEU 65 -5.918 8.717 8.306 325 HA LEU 65 HA LEU 65 -5.970 11.130 6.945 326 HB2 LEU 65 HB2 LEU 65 -6.987 8.434 6.528 327 HB3 LEU 65 HB3 LEU 65 -7.993 9.667 5.768 328 HG LEU 65 HG LEU 65 -6.219 10.392 4.381 329 HD11 LEU 65 HD11 LEU 65 -4.439 8.692 6.114 330 HD12 LEU 65 HD12 LEU 65 -4.394 10.443 5.910 331 HD13 LEU 65 HD13 LEU 65 -3.938 9.389 4.573 332 HD21 LEU 65 HD21 LEU 65 -7.175 7.777 4.328 333 HD22 LEU 65 HD22 LEU 65 -5.438 7.632 4.059 334 HD23 LEU 65 HD23 LEU 65 -6.412 8.657 3.003 335 H ILE 66 H ILE 66 -8.459 9.610 8.915 336 HA ILE 66 HA ILE 66 -10.612 11.268 8.228 337 HB ILE 66 HB ILE 66 -9.995 9.748 10.753 338 HG12 ILE 66 HG12 ILE 66 -12.362 9.103 9.131 339 HG13 ILE 66 HG13 ILE 66 -10.832 8.892 8.287 340 HG21 ILE 66 HG21 ILE 66 -12.644 10.212 10.943 341 HG22 ILE 66 HG22 ILE 66 -11.416 11.182 11.753 342 HG23 ILE 66 HG23 ILE 66 -12.107 11.731 10.227 343 HD11 ILE 66 HD11 ILE 66 -11.632 7.613 10.889 344 HD12 ILE 66 HD12 ILE 66 -11.501 6.824 9.316 345 HD13 ILE 66 HD13 ILE 66 -10.056 7.443 10.115 346 H GLU 67 H GLU 67 -8.220 11.566 10.841 347 HA GLU 67 HA GLU 67 -9.284 14.038 11.800 348 HB2 GLU 67 HB2 GLU 67 -6.498 12.997 12.293 349 HB3 GLU 67 HB3 GLU 67 -7.448 14.070 13.312 350 HG2 GLU 67 HG2 GLU 67 -9.011 12.236 13.766 351 HG3 GLU 67 HG3 GLU 67 -8.022 11.164 12.775 352 H GLU 68 H GLU 68 -6.793 13.113 9.518 353 HA GLU 68 HA GLU 68 -5.804 15.820 9.244 354 HB2 GLU 68 HB2 GLU 68 -5.161 13.246 7.802 355 HB3 GLU 68 HB3 GLU 68 -4.427 14.789 7.388 356 HG2 GLU 68 HG2 GLU 68 -4.171 14.397 10.191 357 HG3 GLU 68 HG3 GLU 68 -3.634 12.936 9.364 358 H LYS 69 H LYS 69 -8.511 14.294 8.212 359 HA LYS 69 HA LYS 69 -10.050 14.658 6.576 360 HB2 LYS 69 HB2 LYS 69 -8.613 17.280 6.151 361 HB3 LYS 69 HB3 LYS 69 -10.289 16.912 5.765 362 HG2 LYS 69 HG2 LYS 69 -9.212 16.840 8.570 363 HG3 LYS 69 HG3 LYS 69 -9.897 18.292 7.836 364 HD2 LYS 69 HD2 LYS 69 -11.622 16.002 7.459 365 HD3 LYS 69 HD3 LYS 69 -11.278 16.276 9.169 366 HE2 LYS 69 HE2 LYS 69 -12.065 18.555 7.396 367 HE3 LYS 69 HE3 LYS 69 -13.294 17.478 8.056 368 HZ1 LYS 69 HZ1 LYS 69 -11.978 17.996 10.263 369 HZ2 LYS 69 HZ2 LYS 69 -13.210 19.011 9.706 370 HZ3 LYS 69 HZ3 LYS 69 -11.591 19.415 9.427 371 H ASP 70 H ASP 70 -7.843 13.148 5.794 372 HA ASP 70 HA ASP 70 -7.400 14.031 3.019 373 HB2 ASP 70 HB2 ASP 70 -5.709 12.476 4.939 374 HB3 ASP 70 HB3 ASP 70 -5.520 12.201 3.208 375 H LEU 71 H LEU 71 -9.779 12.680 3.958 376 HA LEU 71 HA LEU 71 -9.844 9.948 3.543 377 HB2 LEU 71 HB2 LEU 71 -12.007 11.823 2.626 378 HB3 LEU 71 HB3 LEU 71 -12.179 10.159 3.177 379 HG LEU 71 HG LEU 71 -11.530 12.574 4.861 380 HD11 LEU 71 HD11 LEU 71 -13.952 11.730 3.993 381 HD12 LEU 71 HD12 LEU 71 -13.678 12.583 5.511 382 HD13 LEU 71 HD13 LEU 71 -13.799 10.824 5.499 383 HD21 LEU 71 HD21 LEU 71 -11.024 9.744 5.306 384 HD22 LEU 71 HD22 LEU 71 -12.045 10.461 6.553 385 HD23 LEU 71 HD23 LEU 71 -10.460 11.152 6.206 386 H GLU 72 H GLU 72 -9.425 12.492 1.249 387 HA GLU 72 HA GLU 72 -10.338 11.407 -1.109 388 HB2 GLU 72 HB2 GLU 72 -9.425 13.645 -1.019 389 HB3 GLU 72 HB3 GLU 72 -7.832 13.022 -0.617 390 HG2 GLU 72 HG2 GLU 72 -7.418 12.305 -2.758 391 HG3 GLU 72 HG3 GLU 72 -9.130 12.169 -3.159 392 H LYS 73 H LYS 73 -7.194 10.856 0.449 393 HA LYS 73 HA LYS 73 -6.370 8.956 -1.547 394 HB2 LYS 73 HB2 LYS 73 -5.151 9.474 1.170 395 HB3 LYS 73 HB3 LYS 73 -4.384 8.672 -0.194 396 HG2 LYS 73 HG2 LYS 73 -3.686 10.603 -1.027 397 HG3 LYS 73 HG3 LYS 73 -5.309 11.292 -0.944 398 HD2 LYS 73 HD2 LYS 73 -4.402 12.676 0.579 399 HD3 LYS 73 HD3 LYS 73 -4.590 11.307 1.678 400 HE2 LYS 73 HE2 LYS 73 -2.381 11.779 2.020 401 HE3 LYS 73 HE3 LYS 73 -2.238 10.638 0.685 402 HZ1 LYS 73 HZ1 LYS 73 -1.496 12.220 -0.690 403 HZ2 LYS 73 HZ2 LYS 73 -1.135 13.082 0.719 404 HZ3 LYS 73 HZ3 LYS 73 -2.572 13.393 -0.117 405 H LEU 74 H LEU 74 -8.105 8.859 1.431 406 HA LEU 74 HA LEU 74 -7.610 6.273 2.318 407 HB2 LEU 74 HB2 LEU 74 -8.951 8.057 3.469 408 HB3 LEU 74 HB3 LEU 74 -10.285 7.656 2.388 409 HG LEU 74 HG LEU 74 -10.217 5.327 3.329 410 HD11 LEU 74 HD11 LEU 74 -8.513 6.575 5.474 411 HD12 LEU 74 HD12 LEU 74 -7.882 5.530 4.202 412 HD13 LEU 74 HD13 LEU 74 -9.050 4.898 5.361 413 HD21 LEU 74 HD21 LEU 74 -11.565 5.873 5.173 414 HD22 LEU 74 HD22 LEU 74 -11.763 7.216 4.048 415 HD23 LEU 74 HD23 LEU 74 -10.713 7.391 5.455 416 H ASP 75 H ASP 75 -10.396 7.306 0.338 417 HA ASP 75 HA ASP 75 -11.365 4.785 -0.274 418 HB2 ASP 75 HB2 ASP 75 -11.513 7.432 -1.679 419 HB3 ASP 75 HB3 ASP 75 -12.192 5.993 -2.438 420 H LEU 76 H LEU 76 -8.626 6.474 -1.570 421 HA LEU 76 HA LEU 76 -8.347 4.837 -3.909 422 HB2 LEU 76 HB2 LEU 76 -6.333 6.619 -2.546 423 HB3 LEU 76 HB3 LEU 76 -6.181 5.931 -4.161 424 HG LEU 76 HG LEU 76 -8.342 7.877 -3.365 425 HD11 LEU 76 HD11 LEU 76 -5.627 8.426 -3.622 426 HD12 LEU 76 HD12 LEU 76 -6.955 9.586 -3.662 427 HD13 LEU 76 HD13 LEU 76 -6.335 8.904 -5.165 428 HD21 LEU 76 HD21 LEU 76 -8.801 6.396 -5.297 429 HD22 LEU 76 HD22 LEU 76 -7.349 7.019 -6.080 430 HD23 LEU 76 HD23 LEU 76 -8.699 8.101 -5.735 431 H VAL 77 H VAL 77 -6.770 4.981 -0.733 432 HA VAL 77 HA VAL 77 -4.990 2.821 -1.228 433 HB VAL 77 HB VAL 77 -5.952 3.967 1.397 434 HG11 VAL 77 HG11 VAL 77 -4.892 2.293 2.398 435 HG12 VAL 77 HG12 VAL 77 -4.414 1.624 0.836 436 HG13 VAL 77 HG13 VAL 77 -3.390 2.817 1.636 437 HG21 VAL 77 HG21 VAL 77 -4.067 5.354 1.382 438 HG22 VAL 77 HG22 VAL 77 -3.291 4.440 0.089 439 HG23 VAL 77 HG23 VAL 77 -4.691 5.454 -0.265 440 H ILE 78 H ILE 78 -8.185 3.070 0.251 441 HA ILE 78 HA ILE 78 -8.347 0.441 1.240 442 HB ILE 78 HB ILE 78 -10.531 2.329 0.360 443 HG12 ILE 78 HG12 ILE 78 -9.196 3.110 2.263 444 HG13 ILE 78 HG13 ILE 78 -10.826 2.685 2.775 445 HG21 ILE 78 HG21 ILE 78 -11.606 0.541 2.185 446 HG22 ILE 78 HG22 ILE 78 -11.911 0.585 0.449 447 HG23 ILE 78 HG23 ILE 78 -10.652 -0.467 1.097 448 HD11 ILE 78 HD11 ILE 78 -9.432 0.348 3.141 449 HD12 ILE 78 HD12 ILE 78 -8.268 1.593 3.596 450 HD13 ILE 78 HD13 ILE 78 -9.842 1.523 4.390 451 H LYS 79 H LYS 79 -9.777 1.815 -1.729 452 HA LYS 79 HA LYS 79 -10.663 -0.627 -2.786 453 HB2 LYS 79 HB2 LYS 79 -11.055 0.544 -4.813 454 HB3 LYS 79 HB3 LYS 79 -11.344 1.697 -3.517 455 HG2 LYS 79 HG2 LYS 79 -10.091 3.015 -4.856 456 HG3 LYS 79 HG3 LYS 79 -8.776 2.237 -3.971 457 HD2 LYS 79 HD2 LYS 79 -8.012 1.831 -6.065 458 HD3 LYS 79 HD3 LYS 79 -9.103 0.448 -5.945 459 HE2 LYS 79 HE2 LYS 79 -10.875 2.065 -6.907 460 HE3 LYS 79 HE3 LYS 79 -9.491 3.046 -7.387 461 HZ1 LYS 79 HZ1 LYS 79 -9.803 0.189 -8.119 462 HZ2 LYS 79 HZ2 LYS 79 -8.664 1.285 -8.721 463 HZ3 LYS 79 HZ3 LYS 79 -10.300 1.466 -9.111 464 H TYR 80 H TYR 80 -7.567 1.000 -2.952 465 HA TYR 80 HA TYR 80 -6.449 -0.536 -5.046 466 HB2 TYR 80 HB2 TYR 80 -5.474 1.593 -4.354 467 HB3 TYR 80 HB3 TYR 80 -5.093 0.925 -2.770 468 HD1 TYR 80 HD1 TYR 80 -3.283 -0.714 -2.514 469 HD2 TYR 80 HD2 TYR 80 -4.117 1.089 -6.276 470 HE1 TYR 80 HE1 TYR 80 -1.093 -1.458 -3.349 471 HE2 TYR 80 HE2 TYR 80 -1.928 0.349 -7.122 472 HH TYR 80 HH TYR 80 0.544 -0.567 -5.268 473 H MET 81 H MET 81 -5.980 -0.760 -1.515 474 HA MET 81 HA MET 81 -4.487 -3.145 -1.589 475 HB2 MET 81 HB2 MET 81 -4.780 -3.234 0.781 476 HB3 MET 81 HB3 MET 81 -4.615 -1.541 0.337 477 HG2 MET 81 HG2 MET 81 -6.970 -1.187 0.562 478 HG3 MET 81 HG3 MET 81 -7.250 -2.910 0.806 479 HE1 MET 81 HE1 MET 81 -6.348 0.346 1.901 480 HE2 MET 81 HE2 MET 81 -6.730 0.307 3.622 481 HE3 MET 81 HE3 MET 81 -5.062 0.096 3.084 482 H LYS 82 H LYS 82 -7.899 -2.519 -1.696 483 HA LYS 82 HA LYS 82 -8.883 -5.003 -0.853 484 HB2 LYS 82 HB2 LYS 82 -9.924 -2.626 -2.067 485 HB3 LYS 82 HB3 LYS 82 -10.567 -4.027 -2.915 486 HG2 LYS 82 HG2 LYS 82 -10.640 -4.301 -0.014 487 HG3 LYS 82 HG3 LYS 82 -11.584 -2.939 -0.621 488 HD2 LYS 82 HD2 LYS 82 -11.938 -5.367 -2.195 489 HD3 LYS 82 HD3 LYS 82 -12.415 -5.563 -0.506 490 HE2 LYS 82 HE2 LYS 82 -13.858 -3.598 -0.685 491 HE3 LYS 82 HE3 LYS 82 -13.369 -3.385 -2.366 492 HZ1 LYS 82 HZ1 LYS 82 -14.227 -5.824 -2.560 493 HZ2 LYS 82 HZ2 LYS 82 -15.314 -4.530 -2.611 494 HZ3 LYS 82 HZ3 LYS 82 -15.123 -5.418 -1.184 495 H ARG 83 H ARG 83 -8.379 -3.835 -4.188 496 HA ARG 83 HA ARG 83 -8.960 -6.201 -5.509 497 HB2 ARG 83 HB2 ARG 83 -8.087 -5.217 -7.406 498 HB3 ARG 83 HB3 ARG 83 -8.406 -3.806 -6.406 499 HG2 ARG 83 HG2 ARG 83 -5.921 -4.202 -5.637 500 HG3 ARG 83 HG3 ARG 83 -5.817 -5.029 -7.194 501 HD2 ARG 83 HD2 ARG 83 -7.095 -2.348 -7.123 502 HD3 ARG 83 HD3 ARG 83 -5.342 -2.430 -6.940 503 HE ARG 83 HE ARG 83 -6.230 -3.976 -9.156 504 HH11 ARG 83 HH11 ARG 83 -5.595 -0.715 -8.115 505 HH12 ARG 83 HH12 ARG 83 -5.261 -0.131 -9.713 506 HH21 ARG 83 HH21 ARG 83 -5.793 -3.220 -11.263 507 HH22 ARG 83 HH22 ARG 83 -5.375 -1.557 -11.502 508 H LEU 84 H LEU 84 -6.142 -5.310 -3.700 509 HA LEU 84 HA LEU 84 -4.475 -7.396 -4.789 510 HB2 LEU 84 HB2 LEU 84 -4.111 -5.626 -2.375 511 HB3 LEU 84 HB3 LEU 84 -2.890 -6.720 -3.026 512 HG LEU 84 HG LEU 84 -4.047 -4.421 -4.593 513 HD11 LEU 84 HD11 LEU 84 -1.660 -3.490 -4.032 514 HD12 LEU 84 HD12 LEU 84 -1.835 -4.504 -2.600 515 HD13 LEU 84 HD13 LEU 84 -3.013 -3.234 -2.931 516 HD21 LEU 84 HD21 LEU 84 -1.629 -6.186 -4.943 517 HD22 LEU 84 HD22 LEU 84 -1.940 -4.731 -5.888 518 HD23 LEU 84 HD23 LEU 84 -3.051 -6.099 -5.982 519 H MET 85 H MET 85 -5.947 -6.765 -1.600 520 HA MET 85 HA MET 85 -5.263 -9.236 -0.459 521 HB2 MET 85 HB2 MET 85 -7.537 -7.350 0.173 522 HB3 MET 85 HB3 MET 85 -7.094 -8.729 1.171 523 HG2 MET 85 HG2 MET 85 -4.739 -7.610 1.166 524 HG3 MET 85 HG3 MET 85 -5.647 -6.164 0.730 525 HE1 MET 85 HE1 MET 85 -4.678 -5.059 2.437 526 HE2 MET 85 HE2 MET 85 -5.746 -4.680 3.789 527 HE3 MET 85 HE3 MET 85 -4.348 -5.728 4.035 528 H GLN 86 H GLN 86 -7.856 -8.295 -2.578 529 HA GLN 86 HA GLN 86 -9.443 -10.647 -2.104 530 HB2 GLN 86 HB2 GLN 86 -9.569 -8.494 -4.216 531 HB3 GLN 86 HB3 GLN 86 -10.705 -9.833 -4.132 532 HG2 GLN 86 HG2 GLN 86 -10.341 -8.269 -1.657 533 HG3 GLN 86 HG3 GLN 86 -11.139 -7.450 -3.000 534 HE21 GLN 86 HE21 GLN 86 -12.721 -7.634 -1.012 535 HE22 GLN 86 HE22 GLN 86 -13.850 -8.935 -1.132 536 H GLN 87 H GLN 87 -7.329 -9.501 -4.721 537 HA GLN 87 HA GLN 87 -7.609 -11.874 -6.275 538 HB2 GLN 87 HB2 GLN 87 -6.030 -10.927 -7.748 539 HB3 GLN 87 HB3 GLN 87 -6.934 -9.561 -7.107 540 HG2 GLN 87 HG2 GLN 87 -5.117 -9.148 -5.498 541 HG3 GLN 87 HG3 GLN 87 -4.205 -10.471 -6.223 542 HE21 GLN 87 HE21 GLN 87 -6.142 -7.859 -7.632 543 HE22 GLN 87 HE22 GLN 87 -4.877 -7.220 -8.619 544 H SER 88 H SER 88 -5.758 -11.049 -3.533 545 HA SER 88 HA SER 88 -3.422 -12.488 -3.819 546 HB2 SER 88 HB2 SER 88 -5.136 -11.803 -1.460 547 HB3 SER 88 HB3 SER 88 -3.769 -12.896 -1.242 548 HG SER 88 HG SER 88 -3.660 -10.278 -2.335 549 H VAL 89 H VAL 89 -2.787 -14.596 -3.135 550 HA VAL 89 HA VAL 89 -4.658 -16.629 -3.904 551 HB VAL 89 HB VAL 89 -2.363 -16.936 -4.531 552 HG11 VAL 89 HG11 VAL 89 -1.819 -15.899 -1.967 553 HG12 VAL 89 HG12 VAL 89 -1.119 -17.519 -2.025 554 HG13 VAL 89 HG13 VAL 89 -0.669 -16.318 -3.236 555 HG21 VAL 89 HG21 VAL 89 -3.638 -18.959 -4.024 556 HG22 VAL 89 HG22 VAL 89 -1.930 -19.172 -3.645 557 HG23 VAL 89 HG23 VAL 89 -3.092 -18.890 -2.350 558 H GLU 90 H GLU 90 -3.349 -15.413 -0.890 559 HA GLU 90 HA GLU 90 -4.507 -17.570 0.662 560 HB2 GLU 90 HB2 GLU 90 -2.737 -15.249 1.213 561 HB3 GLU 90 HB3 GLU 90 -3.735 -15.822 2.542 562 HG2 GLU 90 HG2 GLU 90 -2.137 -17.792 0.987 563 HG3 GLU 90 HG3 GLU 90 -1.324 -16.760 2.162 564 H SER 91 H SER 91 -6.444 -17.549 1.611 565 HA SER 91 HA SER 91 -8.285 -15.442 1.075 566 HB2 SER 91 HB2 SER 91 -9.919 -16.804 2.140 567 HB3 SER 91 HB3 SER 91 -8.831 -17.919 1.316 568 HG SER 91 HG SER 91 -7.889 -18.424 3.252 569 H VAL 92 H VAL 92 -6.177 -16.215 3.710 570 HA VAL 92 HA VAL 92 -7.403 -14.932 5.843 571 HB VAL 92 HB VAL 92 -5.318 -16.288 5.994 572 HG11 VAL 92 HG11 VAL 92 -3.578 -13.983 5.489 573 HG12 VAL 92 HG12 VAL 92 -3.362 -15.684 5.071 574 HG13 VAL 92 HG13 VAL 92 -4.356 -14.643 4.051 575 HG21 VAL 92 HG21 VAL 92 -5.057 -13.538 7.203 576 HG22 VAL 92 HG22 VAL 92 -6.100 -14.815 7.829 577 HG23 VAL 92 HG23 VAL 92 -4.350 -15.035 7.811 578 H TRP 93 H TRP 93 -5.811 -13.595 3.061 579 HA TRP 93 HA TRP 93 -5.266 -11.016 4.051 580 HB2 TRP 93 HB2 TRP 93 -5.546 -12.241 1.350 581 HB3 TRP 93 HB3 TRP 93 -5.614 -10.484 1.461 582 HD1 TRP 93 HD1 TRP 93 -3.194 -13.060 0.817 583 HE1 TRP 93 HE1 TRP 93 -0.796 -12.293 1.352 584 HE3 TRP 93 HE3 TRP 93 -4.271 -8.925 3.623 585 HZ2 TRP 93 HZ2 TRP 93 0.472 -10.212 2.776 586 HZ3 TRP 93 HZ3 TRP 93 -2.409 -7.602 4.535 587 HH2 TRP 93 HH2 TRP 93 -0.088 -8.233 4.120 588 H ASN 94 H ASN 94 -8.143 -12.438 2.595 589 HA ASN 94 HA ASN 94 -9.623 -10.103 2.188 590 HB2 ASN 94 HB2 ASN 94 -10.355 -12.975 2.651 591 HB3 ASN 94 HB3 ASN 94 -11.618 -11.749 2.591 592 HD21 ASN 94 HD21 ASN 94 -8.910 -13.108 0.797 593 HD22 ASN 94 HD22 ASN 94 -9.534 -12.747 -0.773 594 H MET 95 H MET 95 -9.120 -12.047 5.071 595 HA MET 95 HA MET 95 -11.113 -10.748 6.643 596 HB2 MET 95 HB2 MET 95 -8.684 -12.251 7.625 597 HB3 MET 95 HB3 MET 95 -10.169 -11.938 8.514 598 HG2 MET 95 HG2 MET 95 -11.280 -13.254 6.558 599 HG3 MET 95 HG3 MET 95 -9.650 -13.878 6.317 600 HE1 MET 95 HE1 MET 95 -9.102 -16.329 7.584 601 HE2 MET 95 HE2 MET 95 -8.244 -14.864 8.065 602 HE3 MET 95 HE3 MET 95 -8.853 -15.974 9.294 603 H ALA 96 H ALA 96 -7.626 -10.339 6.227 604 HA ALA 96 HA ALA 96 -7.093 -8.528 8.247 605 HB1 ALA 96 HB1 ALA 96 -5.705 -9.572 6.089 606 HB2 ALA 96 HB2 ALA 96 -5.691 -7.830 5.812 607 HB3 ALA 96 HB3 ALA 96 -5.067 -8.487 7.325 608 H PHE 97 H PHE 97 -8.441 -7.944 5.034 609 HA PHE 97 HA PHE 97 -8.365 -5.153 5.042 610 HB2 PHE 97 HB2 PHE 97 -8.893 -6.473 3.040 611 HB3 PHE 97 HB3 PHE 97 -10.417 -6.974 3.766 612 HD1 PHE 97 HD2 PHE 97 -8.643 -3.721 3.295 613 HD2 PHE 97 HD1 PHE 97 -12.232 -5.958 2.817 614 HE1 PHE 97 HE2 PHE 97 -9.744 -1.742 2.333 615 HE2 PHE 97 HE1 PHE 97 -13.338 -3.984 1.853 616 HZ PHE 97 HZ PHE 97 -12.095 -1.872 1.609 617 H ASP 98 H ASP 98 -11.001 -7.328 6.041 618 HA ASP 98 HA ASP 98 -12.775 -5.324 6.880 619 HB2 ASP 98 HB2 ASP 98 -13.086 -7.922 6.547 620 HB3 ASP 98 HB3 ASP 98 -12.717 -7.972 8.268 621 H PHE 99 H PHE 99 -10.192 -7.018 8.574 622 HA PHE 99 HA PHE 99 -10.740 -6.184 11.177 623 HB2 PHE 99 HB2 PHE 99 -9.098 -7.852 10.947 624 HB3 PHE 99 HB3 PHE 99 -8.188 -6.919 9.765 625 HD1 PHE 99 HD2 PHE 99 -8.955 -7.331 13.326 626 HD2 PHE 99 HD1 PHE 99 -6.622 -5.240 10.444 627 HE1 PHE 99 HE2 PHE 99 -7.504 -6.482 15.121 628 HE2 PHE 99 HE1 PHE 99 -5.166 -4.389 12.236 629 HZ PHE 99 HZ PHE 99 -5.607 -5.008 14.578 630 H ILE 100 H ILE 100 -8.725 -4.645 8.689 631 HA ILE 100 HA ILE 100 -7.944 -2.435 10.261 632 HB ILE 100 HB ILE 100 -8.155 -2.643 7.256 633 HG12 ILE 100 HG12 ILE 100 -5.583 -2.775 8.769 634 HG13 ILE 100 HG13 ILE 100 -6.608 -4.206 8.735 635 HG21 ILE 100 HG21 ILE 100 -6.686 -0.655 8.982 636 HG22 ILE 100 HG22 ILE 100 -6.552 -0.777 7.229 637 HG23 ILE 100 HG23 ILE 100 -8.089 -0.326 7.966 638 HD11 ILE 100 HD11 ILE 100 -5.937 -2.832 6.181 639 HD12 ILE 100 HD12 ILE 100 -4.744 -3.875 6.955 640 HD13 ILE 100 HD13 ILE 100 -6.312 -4.528 6.485 641 H LEU 101 H LEU 101 -10.655 -2.959 8.058 642 HA LEU 101 HA LEU 101 -11.618 -0.294 8.112 643 HB2 LEU 101 HB2 LEU 101 -12.781 -2.939 7.346 644 HB3 LEU 101 HB3 LEU 101 -13.815 -1.514 7.439 645 HG LEU 101 HG LEU 101 -11.345 -1.605 5.724 646 HD11 LEU 101 HD11 LEU 101 -14.073 -2.680 5.214 647 HD12 LEU 101 HD12 LEU 101 -12.502 -3.289 4.694 648 HD13 LEU 101 HD13 LEU 101 -13.210 -1.885 3.897 649 HD21 LEU 101 HD21 LEU 101 -12.253 0.291 4.660 650 HD22 LEU 101 HD22 LEU 101 -12.438 0.582 6.389 651 HD23 LEU 101 HD23 LEU 101 -13.824 0.068 5.428 652 H ASP 102 H ASP 102 -12.182 -3.114 10.123 653 HA ASP 102 HA ASP 102 -14.438 -2.228 11.520 654 HB2 ASP 102 HB2 ASP 102 -13.105 -4.521 11.541 655 HB3 ASP 102 HB3 ASP 102 -12.345 -3.798 12.956 656 H ASN 103 H ASN 103 -11.114 -1.291 11.736 657 HA ASN 103 HA ASN 103 -11.571 0.118 14.260 658 HB2 ASN 103 HB2 ASN 103 -9.070 -0.473 12.676 659 HB3 ASN 103 HB3 ASN 103 -9.082 0.597 14.074 660 HD21 ASN 103 HD21 ASN 103 -9.545 -2.682 12.973 661 HD22 ASN 103 HD22 ASN 103 -9.353 -3.434 14.517 662 H VAL 104 H VAL 104 -10.636 0.709 10.901 663 HA VAL 104 HA VAL 104 -10.357 3.528 11.194 664 HB VAL 104 HB VAL 104 -10.776 1.840 8.725 665 HG11 VAL 104 HG11 VAL 104 -9.977 3.825 7.484 666 HG12 VAL 104 HG12 VAL 104 -11.532 4.089 8.274 667 HG13 VAL 104 HG13 VAL 104 -10.059 4.759 8.977 668 HG21 VAL 104 HG21 VAL 104 -8.680 1.500 10.073 669 HG22 VAL 104 HG22 VAL 104 -8.425 2.000 8.400 670 HG23 VAL 104 HG23 VAL 104 -8.260 3.173 9.706 671 H GLN 105 H GLN 105 -12.857 1.582 9.547 672 HA GLN 105 HA GLN 105 -14.630 3.581 8.920 673 HB2 GLN 105 HB2 GLN 105 -15.350 0.804 9.875 674 HB3 GLN 105 HB3 GLN 105 -16.384 1.874 8.938 675 HG2 GLN 105 HG2 GLN 105 -13.711 0.985 7.920 676 HG3 GLN 105 HG3 GLN 105 -15.159 0.003 7.710 677 HE21 GLN 105 HE21 GLN 105 -13.604 3.025 6.911 678 HE22 GLN 105 HE22 GLN 105 -14.594 3.398 5.545 679 H VAL 106 H VAL 106 -13.986 2.164 12.033 680 HA VAL 106 HA VAL 106 -16.325 3.132 13.342 681 HB VAL 106 HB VAL 106 -13.702 2.044 14.304 682 HG11 VAL 106 HG11 VAL 106 -14.014 3.644 15.963 683 HG12 VAL 106 HG12 VAL 106 -15.772 3.494 15.914 684 HG13 VAL 106 HG13 VAL 106 -14.797 2.212 16.632 685 HG21 VAL 106 HG21 VAL 106 -15.052 0.263 15.169 686 HG22 VAL 106 HG22 VAL 106 -16.535 1.148 14.812 687 HG23 VAL 106 HG23 VAL 106 -15.527 0.550 13.495 688 H VAL 107 H VAL 107 -12.922 4.199 13.459 689 HA VAL 107 HA VAL 107 -13.436 6.542 14.948 690 HB VAL 107 HB VAL 107 -11.203 5.636 14.885 691 HG11 VAL 107 HG11 VAL 107 -11.506 5.989 11.935 692 HG12 VAL 107 HG12 VAL 107 -9.900 6.046 12.665 693 HG13 VAL 107 HG13 VAL 107 -10.902 4.604 12.844 694 HG21 VAL 107 HG21 VAL 107 -9.922 7.661 14.344 695 HG22 VAL 107 HG22 VAL 107 -11.327 8.317 13.505 696 HG23 VAL 107 HG23 VAL 107 -11.392 8.033 15.244 697 H LEU 108 H LEU 108 -13.656 5.807 11.566 698 HA LEU 108 HA LEU 108 -13.594 8.510 10.639 699 HB2 LEU 108 HB2 LEU 108 -13.408 7.510 8.673 700 HB3 LEU 108 HB3 LEU 108 -13.568 5.956 9.488 701 HG LEU 108 HG LEU 108 -16.081 6.237 9.196 702 HD11 LEU 108 HD11 LEU 108 -16.765 8.223 8.464 703 HD12 LEU 108 HD12 LEU 108 -16.137 7.755 6.884 704 HD13 LEU 108 HD13 LEU 108 -15.133 8.694 7.990 705 HD21 LEU 108 HD21 LEU 108 -14.115 5.159 7.564 706 HD22 LEU 108 HD22 LEU 108 -15.144 6.074 6.463 707 HD23 LEU 108 HD23 LEU 108 -15.846 4.826 7.493 708 H GLN 109 H GLN 109 -16.125 6.222 11.523 709 HA GLN 109 HA GLN 109 -18.308 7.798 10.642 710 HB2 GLN 109 HB2 GLN 109 -18.013 5.479 12.518 711 HB3 GLN 109 HB3 GLN 109 -19.549 6.328 12.404 712 HG2 GLN 109 HG2 GLN 109 -19.753 5.794 10.088 713 HG3 GLN 109 HG3 GLN 109 -18.118 5.136 10.044 714 HE21 GLN 109 HE21 GLN 109 -17.769 3.344 11.715 715 HE22 GLN 109 HE22 GLN 109 -19.015 2.151 11.807 716 H GLN 110 H GLN 110 -16.636 7.502 13.742 717 HA GLN 110 HA GLN 110 -18.384 9.131 15.234 718 HB2 GLN 110 HB2 GLN 110 -15.450 8.515 15.615 719 HB3 GLN 110 HB3 GLN 110 -16.437 9.370 16.794 720 HG2 GLN 110 HG2 GLN 110 -17.967 7.281 16.643 721 HG3 GLN 110 HG3 GLN 110 -16.535 6.506 15.968 722 HE21 GLN 110 HE21 GLN 110 -15.397 5.447 17.407 723 HE22 GLN 110 HE22 GLN 110 -15.211 5.860 19.074 724 H THR 111 H THR 111 -16.189 9.896 12.774 725 HA THR 111 HA THR 111 -15.820 12.651 13.681 726 HB THR 111 HB THR 111 -14.680 11.185 11.295 727 HG1 THR 111 HG1 THR 111 -13.536 10.530 13.022 728 HG21 THR 111 HG21 THR 111 -14.971 13.545 10.763 729 HG22 THR 111 HG22 THR 111 -13.261 13.175 10.992 730 HG23 THR 111 HG23 THR 111 -14.163 13.999 12.263 731 H TYR 112 H TYR 112 -16.780 11.056 10.632 732 HA TYR 112 HA TYR 112 -18.404 13.415 9.994 733 HB2 TYR 112 HB2 TYR 112 -17.740 11.151 8.117 734 HB3 TYR 112 HB3 TYR 112 -18.277 12.777 7.711 735 HD1 TYR 112 HD1 TYR 112 -15.425 10.720 8.745 736 HD2 TYR 112 HD2 TYR 112 -16.722 14.637 7.707 737 HE1 TYR 112 HE1 TYR 112 -13.081 11.426 8.501 738 HE2 TYR 112 HE2 TYR 112 -14.383 15.353 7.459 739 HH TYR 112 HH TYR 112 -11.946 14.128 8.678 740 H GLY 113 H GLY 113 -18.563 9.880 10.191 741 HA2 GLY 113 HA2 GLY 113 -20.552 8.902 11.208 742 HA3 GLY 113 HA3 GLY 113 -21.499 10.131 10.382 743 H SER 114 H SER 114 -19.512 9.544 8.037 744 HA SER 114 HA SER 114 -21.223 7.493 6.857 745 HB2 SER 114 HB2 SER 114 -20.483 9.800 5.788 746 HB3 SER 114 HB3 SER 114 -19.066 8.868 5.310 747 HG SER 114 HG SER 114 -20.787 8.837 3.751 748 H THR 115 H THR 115 -19.745 6.278 5.018 749 HA THR 115 HA THR 115 -17.262 5.304 6.157 750 HB THR 115 HB THR 115 -17.959 2.933 6.104 751 HG1 THR 115 HG1 THR 115 -19.726 2.931 4.768 752 HG21 THR 115 HG21 THR 115 -19.031 2.914 8.209 753 HG22 THR 115 HG22 THR 115 -19.816 4.465 7.911 754 HG23 THR 115 HG23 THR 115 -18.075 4.395 8.185 755 H LEU 116 H LEU 116 -16.571 3.280 4.690 756 HA LEU 116 HA LEU 116 -16.528 4.338 1.990 757 HB2 LEU 116 HB2 LEU 116 -14.761 2.855 3.615 758 HB3 LEU 116 HB3 LEU 116 -15.171 1.831 2.240 759 HG LEU 116 HG LEU 116 -13.096 3.171 1.942 760 HD11 LEU 116 HD11 LEU 116 -15.189 4.032 -0.028 761 HD12 LEU 116 HD12 LEU 116 -14.634 2.361 0.077 762 HD13 LEU 116 HD13 LEU 116 -13.492 3.646 -0.315 763 HD21 LEU 116 HD21 LEU 116 -13.064 5.464 1.883 764 HD22 LEU 116 HD22 LEU 116 -14.268 5.188 3.143 765 HD23 LEU 116 HD23 LEU 116 -14.782 5.589 1.504 766 H LYS 117 H LYS 117 -16.964 3.033 0.119 767 HA LYS 117 HA LYS 117 -19.162 1.145 0.591 768 HB2 LYS 117 HB2 LYS 117 -19.745 3.021 -0.826 769 HB3 LYS 117 HB3 LYS 117 -18.369 2.705 -1.874 770 HG2 LYS 117 HG2 LYS 117 -20.215 0.448 -1.559 771 HG3 LYS 117 HG3 LYS 117 -20.898 1.868 -2.353 772 HD2 LYS 117 HD2 LYS 117 -19.842 1.343 -4.236 773 HD3 LYS 117 HD3 LYS 117 -18.287 1.406 -3.400 774 HE2 LYS 117 HE2 LYS 117 -18.144 -0.776 -3.871 775 HE3 LYS 117 HE3 LYS 117 -19.312 -0.996 -2.569 776 HZ1 LYS 117 HZ1 LYS 117 -19.642 -1.739 -5.175 777 HZ2 LYS 117 HZ2 LYS 117 -20.568 -0.330 -5.048 778 HZ3 LYS 117 HZ3 LYS 117 -20.863 -1.632 -4.008 779 H VAL 118 H VAL 118 -18.225 -0.818 0.883 780 HA VAL 118 HA VAL 118 -16.457 -1.784 -1.271 781 HB VAL 118 HB VAL 118 -15.662 -3.471 0.454 782 HG11 VAL 118 HG11 VAL 118 -13.866 -2.168 0.747 783 HG12 VAL 118 HG12 VAL 118 -14.752 -0.971 -0.200 784 HG13 VAL 118 HG13 VAL 118 -14.798 -0.913 1.563 785 HG21 VAL 118 HG21 VAL 118 -17.704 -2.414 1.969 786 HG22 VAL 118 HG22 VAL 118 -16.397 -3.439 2.564 787 HG23 VAL 118 HG23 VAL 118 -16.261 -1.684 2.672 788 H THR 119 H THR 119 -17.680 -2.960 -2.607 789 HA THR 119 HA THR 119 -19.615 -4.848 -1.438 790 HB THR 119 HB THR 119 -19.568 -3.531 -4.155 791 HG1 THR 119 HG1 THR 119 -21.711 -3.573 -2.311 792 HG21 THR 119 HG21 THR 119 -21.679 -4.810 -4.569 793 HG22 THR 119 HG22 THR 119 -21.310 -5.777 -3.140 794 HG23 THR 119 HG23 THR 119 -20.226 -5.808 -4.531 795 H LYS 207 H LYS 207 7.763 -8.288 16.005 796 HA LYS 207 HA LYS 207 9.791 -7.197 14.164 797 HB2 LYS 207 HB2 LYS 207 10.299 -9.519 14.705 798 HB3 LYS 207 HB3 LYS 207 8.667 -10.002 14.262 799 HG2 LYS 207 HG2 LYS 207 9.067 -9.798 12.013 800 HG3 LYS 207 HG3 LYS 207 10.366 -8.625 12.241 801 HD2 LYS 207 HD2 LYS 207 11.920 -10.264 12.788 802 HD3 LYS 207 HD3 LYS 207 10.675 -11.437 13.223 803 HE2 LYS 207 HE2 LYS 207 11.457 -12.223 11.180 804 HE3 LYS 207 HE3 LYS 207 10.008 -11.323 10.737 805 HZ1 LYS 207 HZ1 LYS 207 12.140 -9.535 10.702 806 HZ2 LYS 207 HZ2 LYS 207 11.251 -10.113 9.385 807 HZ3 LYS 207 HZ3 LYS 207 12.655 -10.919 9.876 808 H SER 208 H SER 208 9.176 -6.933 11.977 809 HA SER 208 HA SER 208 6.596 -7.520 10.987 810 HB2 SER 208 HB2 SER 208 5.377 -5.627 11.321 811 HB3 SER 208 HB3 SER 208 6.435 -5.448 12.721 812 HG SER 208 HG SER 208 6.438 -3.534 11.552 813 H PHE 209 H PHE 209 6.333 -6.914 8.804 814 HA PHE 209 HA PHE 209 8.751 -6.699 7.343 815 HB2 PHE 209 HB2 PHE 209 6.921 -7.885 6.352 816 HB3 PHE 209 HB3 PHE 209 5.857 -6.491 6.506 817 HD1 PHE 209 HD2 PHE 209 9.175 -7.290 4.989 818 HD2 PHE 209 HD1 PHE 209 5.410 -5.348 4.579 819 HE1 PHE 209 HE2 PHE 209 9.797 -6.570 2.721 820 HE2 PHE 209 HE1 PHE 209 6.026 -4.627 2.308 821 HZ PHE 209 HZ PHE 209 8.223 -5.237 1.377 822 H PHE 210 H PHE 210 6.235 -4.394 8.212 823 HA PHE 210 HA PHE 210 7.130 -2.269 6.580 824 HB2 PHE 210 HB2 PHE 210 5.441 -2.377 9.073 825 HB3 PHE 210 HB3 PHE 210 5.836 -0.852 8.287 826 HD1 PHE 210 HD1 PHE 210 5.611 -1.384 5.484 827 HD2 PHE 210 HD2 PHE 210 3.231 -2.861 8.688 828 HE1 PHE 210 HE1 PHE 210 3.723 -1.692 3.936 829 HE2 PHE 210 HE2 PHE 210 1.340 -3.173 7.146 830 HZ PHE 210 HZ PHE 210 1.585 -2.589 4.766 831 H ASP 211 H ASP 211 8.226 -3.533 9.600 832 HA ASP 211 HA ASP 211 9.621 -1.186 10.460 833 HB2 ASP 211 HB2 ASP 211 9.466 -4.030 11.350 834 HB3 ASP 211 HB3 ASP 211 10.835 -3.063 11.890 835 H LYS 212 H LYS 212 10.499 -4.148 8.746 836 HA LYS 212 HA LYS 212 13.287 -3.467 8.599 837 HB2 LYS 212 HB2 LYS 212 13.395 -5.416 7.030 838 HB3 LYS 212 HB3 LYS 212 12.716 -5.794 8.608 839 HG2 LYS 212 HG2 LYS 212 10.495 -5.818 7.718 840 HG3 LYS 212 HG3 LYS 212 11.065 -5.220 6.158 841 HD2 LYS 212 HD2 LYS 212 12.263 -7.730 7.204 842 HD3 LYS 212 HD3 LYS 212 10.606 -7.798 6.599 843 HE2 LYS 212 HE2 LYS 212 11.273 -7.022 4.453 844 HE3 LYS 212 HE3 LYS 212 12.885 -6.606 5.033 845 HZ1 LYS 212 HZ1 LYS 212 13.344 -8.942 5.370 846 HZ2 LYS 212 HZ2 LYS 212 12.873 -8.675 3.768 847 HZ3 LYS 212 HZ3 LYS 212 11.783 -9.361 4.867 848 H LYS 213 H LYS 213 10.483 -2.665 6.824 849 HA LYS 213 HA LYS 213 11.919 -2.039 4.378 850 HB2 LYS 213 HB2 LYS 213 9.270 -2.687 4.978 851 HB3 LYS 213 HB3 LYS 213 9.218 -0.986 4.536 852 HG2 LYS 213 HG2 LYS 213 10.576 -3.055 2.835 853 HG3 LYS 213 HG3 LYS 213 8.864 -2.656 2.672 854 HD2 LYS 213 HD2 LYS 213 9.390 -0.373 2.136 855 HD3 LYS 213 HD3 LYS 213 11.101 -0.641 2.479 856 HE2 LYS 213 HE2 LYS 213 11.457 -1.765 0.522 857 HE3 LYS 213 HE3 LYS 213 9.802 -2.371 0.443 858 HZ1 LYS 213 HZ1 LYS 213 10.141 0.507 0.175 859 HZ2 LYS 213 HZ2 LYS 213 9.088 -0.540 -0.635 860 HZ3 LYS 213 HZ3 LYS 213 10.708 -0.433 -1.113 861 H ARG 214 H ARG 214 10.326 -0.341 7.039 862 HA ARG 214 HA ARG 214 10.634 2.267 6.025 863 HB2 ARG 214 HB2 ARG 214 9.884 3.013 8.087 864 HB3 ARG 214 HB3 ARG 214 9.226 1.383 8.031 865 HG2 ARG 214 HG2 ARG 214 11.217 0.627 9.346 866 HG3 ARG 214 HG3 ARG 214 11.650 2.327 9.538 867 HD2 ARG 214 HD2 ARG 214 8.962 2.201 10.238 868 HD3 ARG 214 HD3 ARG 214 9.673 0.749 10.943 869 HE ARG 214 HE ARG 214 10.129 3.468 11.748 870 HH11 ARG 214 HH11 ARG 214 11.433 0.240 11.705 871 HH12 ARG 214 HH12 ARG 214 12.456 0.496 13.079 872 HH21 ARG 214 HH21 ARG 214 11.473 3.816 13.558 873 HH22 ARG 214 HH22 ARG 214 12.478 2.529 14.133 874 H SER 215 H SER 215 12.800 0.128 7.723 875 HA SER 215 HA SER 215 14.686 1.993 8.630 876 HB2 SER 215 HB2 SER 215 15.249 -0.832 7.700 877 HB3 SER 215 HB3 SER 215 16.216 0.127 8.821 878 HG SER 215 HG SER 215 14.998 -1.067 10.144 879 H GLU 216 H GLU 216 14.927 -0.092 5.741 880 HA GLU 216 HA GLU 216 17.160 1.108 4.621 881 HB2 GLU 216 HB2 GLU 216 16.212 0.241 2.417 882 HB3 GLU 216 HB3 GLU 216 16.472 -0.943 3.691 883 HG2 GLU 216 HG2 GLU 216 14.139 -0.999 4.209 884 HG3 GLU 216 HG3 GLU 216 13.816 0.344 3.113 885 H ARG 217 H ARG 217 13.771 2.022 4.405 886 HA ARG 217 HA ARG 217 13.979 3.916 2.348 887 HB2 ARG 217 HB2 ARG 217 11.814 3.151 3.041 888 HB3 ARG 217 HB3 ARG 217 12.080 3.717 4.685 889 HG2 ARG 217 HG2 ARG 217 11.877 5.974 4.052 890 HG3 ARG 217 HG3 ARG 217 12.018 5.585 2.336 891 HD2 ARG 217 HD2 ARG 217 9.739 4.781 4.141 892 HD3 ARG 217 HD3 ARG 217 9.706 6.105 2.976 893 HE ARG 217 HE ARG 217 9.322 3.342 2.427 894 HH11 ARG 217 HH11 ARG 217 10.650 6.278 1.108 895 HH12 ARG 217 HH12 ARG 217 10.443 5.785 -0.539 896 HH21 ARG 217 HH21 ARG 217 9.043 2.683 0.261 897 HH22 ARG 217 HH22 ARG 217 9.528 3.742 -1.020 898 H ILE 218 H ILE 218 14.590 4.137 5.800 899 HA ILE 218 HA ILE 218 14.835 6.975 5.879 900 HB ILE 218 HB ILE 218 15.913 4.891 7.781 901 HG12 ILE 218 HG12 ILE 218 13.604 6.628 8.461 902 HG13 ILE 218 HG13 ILE 218 13.314 5.363 7.272 903 HG21 ILE 218 HG21 ILE 218 15.813 6.919 9.371 904 HG22 ILE 218 HG22 ILE 218 17.169 6.786 8.252 905 HG23 ILE 218 HG23 ILE 218 15.833 7.880 7.893 906 HD11 ILE 218 HD11 ILE 218 14.583 3.936 9.151 907 HD12 ILE 218 HD12 ILE 218 13.829 5.170 10.162 908 HD13 ILE 218 HD13 ILE 218 12.835 4.162 9.109 909 H SER 219 H SER 219 16.942 4.395 4.974 910 HA SER 219 HA SER 219 19.315 6.090 5.136 911 HB2 SER 219 HB2 SER 219 19.324 3.654 5.861 912 HB3 SER 219 HB3 SER 219 19.183 3.237 4.153 913 HG SER 219 HG SER 219 21.228 3.631 3.933 914 H ASN 220 H ASN 220 20.844 5.379 3.078 915 HA ASN 220 HA ASN 220 19.830 6.878 0.925 916 HB2 ASN 220 HB2 ASN 220 22.214 6.721 1.290 917 HB3 ASN 220 HB3 ASN 220 22.176 4.974 1.066 918 HD21 ASN 220 HD21 ASN 220 23.787 5.303 -0.555 919 HD22 ASN 220 HD22 ASN 220 23.331 5.804 -2.144 Start of MODEL 4 1 H ALA 23 H ALA 23 4.538 13.673 12.776 2 HA ALA 23 HA ALA 23 2.548 12.863 13.534 3 HB1 ALA 23 HB1 ALA 23 1.199 15.473 13.542 4 HB2 ALA 23 HB2 ALA 23 1.451 14.316 14.851 5 HB3 ALA 23 HB3 ALA 23 2.744 15.424 14.392 6 H ALA 24 H ALA 24 2.938 13.182 10.620 7 HA ALA 24 HA ALA 24 0.169 13.562 9.721 8 HB1 ALA 24 HB1 ALA 24 2.767 14.075 8.536 9 HB2 ALA 24 HB2 ALA 24 1.709 13.158 7.463 10 HB3 ALA 24 HB3 ALA 24 1.181 14.714 8.105 11 HA PRO 25 HA PRO 25 -0.522 9.299 8.945 12 HB2 PRO 25 HB2 PRO 25 -1.882 9.346 6.597 13 HB3 PRO 25 HB3 PRO 25 -2.588 9.882 8.126 14 HG2 PRO 25 HG2 PRO 25 -1.398 11.511 5.916 15 HG3 PRO 25 HG3 PRO 25 -2.875 11.806 6.852 16 HD2 PRO 25 HD2 PRO 25 -0.545 13.083 7.370 17 HD3 PRO 25 HD3 PRO 25 -1.718 12.683 8.642 18 H ASN 26 H ASN 26 1.553 8.469 8.621 19 HA ASN 26 HA ASN 26 2.324 8.146 5.795 20 HB2 ASN 26 HB2 ASN 26 4.375 8.124 7.983 21 HB3 ASN 26 HB3 ASN 26 4.580 8.478 6.270 22 HD21 ASN 26 HD21 ASN 26 2.650 10.351 5.840 23 HD22 ASN 26 HD22 ASN 26 3.000 11.775 6.755 24 H LEU 27 H LEU 27 2.900 6.125 5.135 25 HA LEU 27 HA LEU 27 2.552 3.975 7.109 26 HB2 LEU 27 HB2 LEU 27 1.102 4.199 4.984 27 HB3 LEU 27 HB3 LEU 27 2.524 3.596 4.137 28 HG LEU 27 HG LEU 27 2.409 1.599 5.728 29 HD11 LEU 27 HD11 LEU 27 -0.458 2.419 6.038 30 HD12 LEU 27 HD12 LEU 27 0.762 2.835 7.240 31 HD13 LEU 27 HD13 LEU 27 0.426 1.143 6.875 32 HD21 LEU 27 HD21 LEU 27 1.016 0.420 4.254 33 HD22 LEU 27 HD22 LEU 27 1.701 1.723 3.283 34 HD23 LEU 27 HD23 LEU 27 0.048 1.848 3.888 35 H ALA 28 H ALA 28 4.387 3.152 7.848 36 HA ALA 28 HA ALA 28 6.535 2.405 7.978 37 HB1 ALA 28 HB1 ALA 28 7.131 0.839 6.425 38 HB2 ALA 28 HB2 ALA 28 5.408 0.982 6.066 39 HB3 ALA 28 HB3 ALA 28 6.591 1.822 5.063 40 H GLY 29 H GLY 29 6.034 5.230 7.229 41 HA2 GLY 29 HA2 GLY 29 7.664 6.939 7.120 42 HA3 GLY 29 HA3 GLY 29 8.756 5.813 6.329 43 H ALA 30 H ALA 30 5.619 5.735 5.054 44 HA ALA 30 HA ALA 30 6.523 7.295 2.731 45 HB1 ALA 30 HB1 ALA 30 6.024 5.027 2.154 46 HB2 ALA 30 HB2 ALA 30 4.456 5.114 2.958 47 HB3 ALA 30 HB3 ALA 30 4.750 6.053 1.494 48 H VAL 31 H VAL 31 5.781 9.311 2.717 49 HA VAL 31 HA VAL 31 3.251 9.960 4.006 50 HB VAL 31 HB VAL 31 5.208 11.830 2.666 51 HG11 VAL 31 HG11 VAL 31 3.289 13.072 2.840 52 HG12 VAL 31 HG12 VAL 31 2.719 12.195 4.261 53 HG13 VAL 31 HG13 VAL 31 4.013 13.383 4.418 54 HG21 VAL 31 HG21 VAL 31 5.374 12.185 5.412 55 HG22 VAL 31 HG22 VAL 31 5.347 10.434 5.200 56 HG23 VAL 31 HG23 VAL 31 6.570 11.403 4.378 57 H GLU 32 H GLU 32 4.674 9.771 0.814 58 HA GLU 32 HA GLU 32 2.453 11.063 -0.491 59 HB2 GLU 32 HB2 GLU 32 4.603 9.383 -1.780 60 HB3 GLU 32 HB3 GLU 32 3.600 10.610 -2.542 61 HG2 GLU 32 HG2 GLU 32 4.714 12.197 -0.802 62 HG3 GLU 32 HG3 GLU 32 5.943 10.936 -0.733 63 H PHE 33 H PHE 33 0.747 10.135 -1.504 64 HA PHE 33 HA PHE 33 -0.233 7.683 -0.681 65 HB2 PHE 33 HB2 PHE 33 -1.792 9.197 -1.596 66 HB3 PHE 33 HB3 PHE 33 -0.860 9.393 -3.077 67 HD1 PHE 33 HD1 PHE 33 -2.851 6.916 -1.158 68 HD2 PHE 33 HD2 PHE 33 -1.353 8.121 -4.957 69 HE1 PHE 33 HE1 PHE 33 -4.222 5.186 -2.244 70 HE2 PHE 33 HE2 PHE 33 -2.725 6.393 -6.048 71 HZ PHE 33 HZ PHE 33 -4.161 4.922 -4.692 72 H SER 34 H SER 34 1.355 8.464 -3.769 73 HA SER 34 HA SER 34 1.253 5.980 -4.966 74 HB2 SER 34 HB2 SER 34 2.170 7.395 -6.476 75 HB3 SER 34 HB3 SER 34 2.935 8.379 -5.229 76 HG SER 34 HG SER 34 4.010 6.446 -6.771 77 H ASP 35 H ASP 35 3.483 7.169 -2.520 78 HA ASP 35 HA ASP 35 5.207 4.887 -2.616 79 HB2 ASP 35 HB2 ASP 35 4.886 7.201 -0.724 80 HB3 ASP 35 HB3 ASP 35 5.949 5.853 -0.328 81 H VAL 36 H VAL 36 2.309 5.747 -0.882 82 HA VAL 36 HA VAL 36 2.512 3.746 1.136 83 HB VAL 36 HB VAL 36 0.068 5.193 0.104 84 HG11 VAL 36 HG11 VAL 36 -1.116 3.817 1.385 85 HG12 VAL 36 HG12 VAL 36 0.350 3.016 1.953 86 HG13 VAL 36 HG13 VAL 36 -0.255 4.446 2.790 87 HG21 VAL 36 HG21 VAL 36 0.616 6.941 1.382 88 HG22 VAL 36 HG22 VAL 36 1.101 5.915 2.732 89 HG23 VAL 36 HG23 VAL 36 2.237 6.248 1.425 90 H LYS 37 H LYS 37 0.464 3.980 -1.777 91 HA LYS 37 HA LYS 37 -0.651 1.431 -1.630 92 HB2 LYS 37 HB2 LYS 37 -1.053 1.687 -4.081 93 HB3 LYS 37 HB3 LYS 37 -1.574 3.069 -3.126 94 HG2 LYS 37 HG2 LYS 37 0.204 4.397 -3.865 95 HG3 LYS 37 HG3 LYS 37 1.106 3.004 -4.468 96 HD2 LYS 37 HD2 LYS 37 -1.405 3.031 -5.780 97 HD3 LYS 37 HD3 LYS 37 -0.749 4.668 -5.852 98 HE2 LYS 37 HE2 LYS 37 1.382 3.706 -6.702 99 HE3 LYS 37 HE3 LYS 37 0.602 2.126 -6.753 100 HZ1 LYS 37 HZ1 LYS 37 -0.307 2.626 -8.695 101 HZ2 LYS 37 HZ2 LYS 37 0.585 4.063 -8.722 102 HZ3 LYS 37 HZ3 LYS 37 -0.983 4.054 -8.089 103 H THR 38 H THR 38 2.462 2.483 -2.798 104 HA THR 38 HA THR 38 3.127 0.125 -4.235 105 HB THR 38 HB THR 38 4.901 2.245 -3.013 106 HG1 THR 38 HG1 THR 38 3.932 1.786 -5.654 107 HG21 THR 38 HG21 THR 38 5.590 0.010 -4.924 108 HG22 THR 38 HG22 THR 38 6.170 0.192 -3.268 109 HG23 THR 38 HG23 THR 38 6.656 1.351 -4.505 110 H LEU 39 H LEU 39 3.579 1.159 -0.896 111 HA LEU 39 HA LEU 39 5.253 -1.010 -0.140 112 HB2 LEU 39 HB2 LEU 39 3.534 0.864 1.473 113 HB3 LEU 39 HB3 LEU 39 4.613 -0.333 2.187 114 HG LEU 39 HG LEU 39 5.682 1.736 0.303 115 HD11 LEU 39 HD11 LEU 39 6.252 2.964 2.518 116 HD12 LEU 39 HD12 LEU 39 4.845 2.106 3.147 117 HD13 LEU 39 HD13 LEU 39 4.670 3.198 1.773 118 HD21 LEU 39 HD21 LEU 39 7.230 0.032 0.824 119 HD22 LEU 39 HD22 LEU 39 6.792 0.049 2.532 120 HD23 LEU 39 HD23 LEU 39 7.670 1.410 1.833 121 H LEU 40 H LEU 40 1.778 -0.476 -0.142 122 HA LEU 40 HA LEU 40 1.130 -2.818 1.349 123 HB2 LEU 40 HB2 LEU 40 -0.645 -1.348 -0.587 124 HB3 LEU 40 HB3 LEU 40 -1.141 -2.373 0.758 125 HG LEU 40 HG LEU 40 0.436 0.099 1.320 126 HD11 LEU 40 HD11 LEU 40 -1.784 0.304 -0.239 127 HD12 LEU 40 HD12 LEU 40 -1.207 1.551 0.867 128 HD13 LEU 40 HD13 LEU 40 -2.472 0.434 1.380 129 HD21 LEU 40 HD21 LEU 40 -1.696 -1.471 2.760 130 HD22 LEU 40 HD22 LEU 40 -1.024 0.052 3.343 131 HD23 LEU 40 HD23 LEU 40 0.017 -1.362 3.167 132 H LYS 41 H LYS 41 1.153 -2.033 -2.112 133 HA LYS 41 HA LYS 41 0.142 -4.399 -3.130 134 HB2 LYS 41 HB2 LYS 41 1.042 -2.142 -4.253 135 HB3 LYS 41 HB3 LYS 41 2.436 -3.167 -4.567 136 HG2 LYS 41 HG2 LYS 41 0.644 -4.832 -5.476 137 HG3 LYS 41 HG3 LYS 41 -0.347 -3.378 -5.611 138 HD2 LYS 41 HD2 LYS 41 0.692 -3.553 -7.698 139 HD3 LYS 41 HD3 LYS 41 1.665 -2.358 -6.835 140 HE2 LYS 41 HE2 LYS 41 3.343 -3.997 -6.340 141 HE3 LYS 41 HE3 LYS 41 2.335 -5.294 -6.981 142 HZ1 LYS 41 HZ1 LYS 41 4.232 -3.942 -8.366 143 HZ2 LYS 41 HZ2 LYS 41 2.807 -3.186 -8.872 144 HZ3 LYS 41 HZ3 LYS 41 2.986 -4.858 -9.052 145 H GLU 42 H GLU 42 3.471 -3.624 -2.202 146 HA GLU 42 HA GLU 42 4.484 -6.193 -2.986 147 HB2 GLU 42 HB2 GLU 42 6.568 -5.452 -1.899 148 HB3 GLU 42 HB3 GLU 42 5.948 -4.255 -3.028 149 HG2 GLU 42 HG2 GLU 42 4.963 -3.033 -1.109 150 HG3 GLU 42 HG3 GLU 42 5.745 -4.184 -0.028 151 H TRP 43 H TRP 43 3.592 -4.644 0.066 152 HA TRP 43 HA TRP 43 4.423 -6.727 1.769 153 HB2 TRP 43 HB2 TRP 43 3.975 -4.552 2.691 154 HB3 TRP 43 HB3 TRP 43 2.311 -4.592 2.114 155 HD1 TRP 43 HD1 TRP 43 4.472 -6.810 4.476 156 HE1 TRP 43 HE1 TRP 43 3.013 -7.449 6.499 157 HE3 TRP 43 HE3 TRP 43 0.133 -4.472 3.118 158 HZ2 TRP 43 HZ2 TRP 43 0.373 -7.018 7.398 159 HZ3 TRP 43 HZ3 TRP 43 -1.813 -4.633 4.616 160 HH2 TRP 43 HH2 TRP 43 -1.693 -5.882 6.711 161 H ILE 44 H ILE 44 1.866 -6.561 -0.444 162 HA ILE 44 HA ILE 44 0.342 -8.651 0.943 163 HB ILE 44 HB ILE 44 -0.400 -6.973 -1.456 164 HG12 ILE 44 HG12 ILE 44 -1.788 -6.968 1.206 165 HG13 ILE 44 HG13 ILE 44 -0.338 -5.999 0.963 166 HG21 ILE 44 HG21 ILE 44 -1.873 -9.175 -0.034 167 HG22 ILE 44 HG22 ILE 44 -2.677 -7.994 -1.066 168 HG23 ILE 44 HG23 ILE 44 -1.456 -9.070 -1.744 169 HD11 ILE 44 HD11 ILE 44 -2.387 -5.692 -1.110 170 HD12 ILE 44 HD12 ILE 44 -2.853 -5.140 0.499 171 HD13 ILE 44 HD13 ILE 44 -1.415 -4.480 -0.277 172 H THR 45 H THR 45 2.591 -8.191 -1.553 173 HA THR 45 HA THR 45 1.828 -10.683 -2.902 174 HB THR 45 HB THR 45 3.480 -10.037 -4.628 175 HG1 THR 45 HG1 THR 45 4.938 -8.668 -3.903 176 HG21 THR 45 HG21 THR 45 1.583 -9.217 -5.497 177 HG22 THR 45 HG22 THR 45 2.174 -7.640 -4.977 178 HG23 THR 45 HG23 THR 45 1.065 -8.548 -3.951 179 H THR 46 H THR 46 4.781 -9.083 -1.697 180 HA THR 46 HA THR 46 6.376 -11.415 -1.790 181 HB THR 46 HB THR 46 7.265 -9.071 -1.715 182 HG1 THR 46 HG1 THR 46 8.321 -10.645 0.401 183 HG21 THR 46 HG21 THR 46 7.439 -8.858 1.140 184 HG22 THR 46 HG22 THR 46 5.746 -8.954 0.655 185 HG23 THR 46 HG23 THR 46 6.788 -7.703 -0.024 186 H ILE 47 H ILE 47 3.957 -10.405 0.378 187 HA ILE 47 HA ILE 47 4.771 -12.505 2.275 188 HB ILE 47 HB ILE 47 3.582 -9.815 2.955 189 HG12 ILE 47 HG12 ILE 47 5.908 -10.590 4.463 190 HG13 ILE 47 HG13 ILE 47 6.250 -10.715 2.742 191 HG21 ILE 47 HG21 ILE 47 3.890 -10.743 5.345 192 HG22 ILE 47 HG22 ILE 47 2.477 -11.240 4.416 193 HG23 ILE 47 HG23 ILE 47 3.860 -12.323 4.564 194 HD11 ILE 47 HD11 ILE 47 5.063 -8.317 2.785 195 HD12 ILE 47 HD12 ILE 47 5.752 -8.343 4.408 196 HD13 ILE 47 HD13 ILE 47 6.796 -8.551 3.003 197 H SER 48 H SER 48 3.282 -14.022 2.592 198 HA SER 48 HA SER 48 0.541 -13.491 1.668 199 HB2 SER 48 HB2 SER 48 2.173 -15.482 0.862 200 HB3 SER 48 HB3 SER 48 1.394 -16.277 2.229 201 HG SER 48 HG SER 48 0.418 -16.120 -0.128 202 H ASP 49 H ASP 49 2.466 -14.369 4.405 203 HA ASP 49 HA ASP 49 0.024 -14.791 5.999 204 HB2 ASP 49 HB2 ASP 49 2.850 -15.759 6.468 205 HB3 ASP 49 HB3 ASP 49 1.546 -15.922 7.641 206 HA PRO 50 HA PRO 50 1.722 -10.696 7.310 207 HB2 PRO 50 HB2 PRO 50 -0.714 -9.524 7.571 208 HB3 PRO 50 HB3 PRO 50 0.158 -9.596 6.036 209 HG2 PRO 50 HG2 PRO 50 -2.069 -11.331 7.033 210 HG3 PRO 50 HG3 PRO 50 -1.832 -10.630 5.421 211 HD2 PRO 50 HD2 PRO 50 -1.236 -13.209 5.991 212 HD3 PRO 50 HD3 PRO 50 -0.327 -12.260 4.795 213 H MET 51 H MET 51 1.789 -9.846 9.377 214 HA MET 51 HA MET 51 0.596 -11.523 11.451 215 HB2 MET 51 HB2 MET 51 2.840 -9.518 11.439 216 HB3 MET 51 HB3 MET 51 2.142 -10.105 12.943 217 HG2 MET 51 HG2 MET 51 2.615 -12.443 11.707 218 HG3 MET 51 HG3 MET 51 3.899 -11.458 11.010 219 HE1 MET 51 HE1 MET 51 5.429 -10.175 12.088 220 HE2 MET 51 HE2 MET 51 5.333 -9.730 13.792 221 HE3 MET 51 HE3 MET 51 6.449 -10.994 13.271 222 H GLU 52 H GLU 52 -0.422 -10.565 13.315 223 HA GLU 52 HA GLU 52 -2.445 -8.763 12.713 224 HB2 GLU 52 HB2 GLU 52 -2.665 -10.217 14.605 225 HB3 GLU 52 HB3 GLU 52 -1.237 -9.532 15.370 226 HG2 GLU 52 HG2 GLU 52 -2.409 -7.400 15.632 227 HG3 GLU 52 HG3 GLU 52 -3.843 -8.105 14.889 228 H GLU 53 H GLU 53 0.728 -8.189 14.157 229 HA GLU 53 HA GLU 53 0.331 -5.469 14.792 230 HB2 GLU 53 HB2 GLU 53 2.240 -7.154 15.456 231 HB3 GLU 53 HB3 GLU 53 3.027 -6.513 14.021 232 HG2 GLU 53 HG2 GLU 53 3.296 -4.425 14.927 233 HG3 GLU 53 HG3 GLU 53 1.943 -4.615 16.040 234 H ASP 54 H ASP 54 1.840 -7.024 11.972 235 HA ASP 54 HA ASP 54 2.561 -4.735 10.575 236 HB2 ASP 54 HB2 ASP 54 2.060 -7.562 9.895 237 HB3 ASP 54 HB3 ASP 54 1.907 -6.432 8.551 238 H ILE 55 H ILE 55 -0.511 -6.501 10.563 239 HA ILE 55 HA ILE 55 -1.756 -4.869 8.600 240 HB ILE 55 HB ILE 55 -3.047 -6.579 10.729 241 HG12 ILE 55 HG12 ILE 55 -2.572 -7.288 7.835 242 HG13 ILE 55 HG13 ILE 55 -1.426 -7.699 9.106 243 HG21 ILE 55 HG21 ILE 55 -4.587 -4.946 9.790 244 HG22 ILE 55 HG22 ILE 55 -4.161 -5.463 8.160 245 HG23 ILE 55 HG23 ILE 55 -4.997 -6.572 9.247 246 HD11 ILE 55 HD11 ILE 55 -2.828 -9.589 8.635 247 HD12 ILE 55 HD12 ILE 55 -3.207 -8.971 10.243 248 HD13 ILE 55 HD13 ILE 55 -4.280 -8.621 8.889 249 H LEU 56 H LEU 56 -1.413 -4.658 12.069 250 HA LEU 56 HA LEU 56 -3.449 -2.778 12.576 251 HB2 LEU 56 HB2 LEU 56 -1.060 -3.784 13.986 252 HB3 LEU 56 HB3 LEU 56 -1.647 -2.201 14.491 253 HG LEU 56 HG LEU 56 -3.502 -4.553 14.363 254 HD11 LEU 56 HD11 LEU 56 -2.403 -3.950 16.997 255 HD12 LEU 56 HD12 LEU 56 -1.224 -4.634 15.879 256 HD13 LEU 56 HD13 LEU 56 -2.718 -5.505 16.224 257 HD21 LEU 56 HD21 LEU 56 -4.873 -3.295 15.740 258 HD22 LEU 56 HD22 LEU 56 -4.175 -2.071 14.679 259 HD23 LEU 56 HD23 LEU 56 -3.546 -2.285 16.313 260 H GLN 57 H GLN 57 -0.103 -2.441 11.552 261 HA GLN 57 HA GLN 57 0.281 0.273 11.967 262 HB2 GLN 57 HB2 GLN 57 1.439 -1.782 10.200 263 HB3 GLN 57 HB3 GLN 57 1.629 -0.127 9.636 264 HG2 GLN 57 HG2 GLN 57 2.342 -0.872 12.441 265 HG3 GLN 57 HG3 GLN 57 3.461 -1.173 11.113 266 HE21 GLN 57 HE21 GLN 57 3.627 0.833 9.604 267 HE22 GLN 57 HE22 GLN 57 3.906 2.330 10.419 268 H VAL 58 H VAL 58 -1.542 -1.376 9.489 269 HA VAL 58 HA VAL 58 -1.830 0.863 7.749 270 HB VAL 58 HB VAL 58 -3.705 -1.492 7.938 271 HG11 VAL 58 HG11 VAL 58 -3.503 0.792 6.217 272 HG12 VAL 58 HG12 VAL 58 -3.247 -0.685 5.286 273 HG13 VAL 58 HG13 VAL 58 -4.718 -0.486 6.237 274 HG21 VAL 58 HG21 VAL 58 -0.914 -1.334 6.988 275 HG22 VAL 58 HG22 VAL 58 -1.829 -2.711 7.601 276 HG23 VAL 58 HG23 VAL 58 -2.050 -2.176 5.934 277 H VAL 59 H VAL 59 -3.649 -0.402 10.472 278 HA VAL 59 HA VAL 59 -5.999 1.108 10.135 279 HB VAL 59 HB VAL 59 -4.753 0.073 12.685 280 HG11 VAL 59 HG11 VAL 59 -7.532 1.106 12.132 281 HG12 VAL 59 HG12 VAL 59 -7.050 0.254 13.601 282 HG13 VAL 59 HG13 VAL 59 -6.330 1.817 13.209 283 HG21 VAL 59 HG21 VAL 59 -7.076 -1.352 11.871 284 HG22 VAL 59 HG22 VAL 59 -5.967 -1.266 10.502 285 HG23 VAL 59 HG23 VAL 59 -5.422 -1.942 12.037 286 H ARG 60 H ARG 60 -3.140 1.730 12.171 287 HA ARG 60 HA ARG 60 -3.967 4.209 13.168 288 HB2 ARG 60 HB2 ARG 60 -1.140 3.274 12.643 289 HB3 ARG 60 HB3 ARG 60 -1.612 4.585 13.716 290 HG2 ARG 60 HG2 ARG 60 -2.738 1.868 14.177 291 HG3 ARG 60 HG3 ARG 60 -1.074 2.207 14.657 292 HD2 ARG 60 HD2 ARG 60 -1.784 3.999 16.080 293 HD3 ARG 60 HD3 ARG 60 -3.438 3.883 15.481 294 HE ARG 60 HE ARG 60 -2.861 1.411 16.534 295 HH11 ARG 60 HH11 ARG 60 -2.934 4.689 17.705 296 HH12 ARG 60 HH12 ARG 60 -3.349 4.238 19.325 297 HH21 ARG 60 HH21 ARG 60 -3.408 0.805 18.664 298 HH22 ARG 60 HH22 ARG 60 -3.617 2.030 19.870 299 H TYR 61 H TYR 61 -2.661 3.312 10.090 300 HA TYR 61 HA TYR 61 -1.812 5.937 9.322 301 HB2 TYR 61 HB2 TYR 61 -0.762 4.078 8.243 302 HB3 TYR 61 HB3 TYR 61 -2.312 3.407 7.751 303 HD1 TYR 61 HD2 TYR 61 0.049 6.199 7.174 304 HD2 TYR 61 HD1 TYR 61 -3.348 4.082 5.731 305 HE1 TYR 61 HE2 TYR 61 0.219 7.398 5.033 306 HE2 TYR 61 HE1 TYR 61 -3.186 5.273 3.586 307 HH TYR 61 HH TYR 61 -1.341 6.440 2.261 308 H CYS 62 H CYS 62 -4.585 3.888 8.422 309 HA CYS 62 HA CYS 62 -5.865 5.873 6.864 310 HB2 CYS 62 HB2 CYS 62 -6.782 3.293 8.109 311 HB3 CYS 62 HB3 CYS 62 -7.915 4.349 7.276 312 HG CYS 62 HG CYS 62 -7.459 3.356 4.964 313 H THR 63 H THR 63 -6.341 4.775 10.206 314 HA THR 63 HA THR 63 -8.536 6.305 10.895 315 HB THR 63 HB THR 63 -7.628 6.258 13.239 316 HG1 THR 63 HG1 THR 63 -5.563 5.901 13.466 317 HG21 THR 63 HG21 THR 63 -8.525 4.147 11.608 318 HG22 THR 63 HG22 THR 63 -8.599 4.257 13.367 319 HG23 THR 63 HG23 THR 63 -7.213 3.494 12.588 320 H ASP 64 H ASP 64 -5.232 7.283 10.427 321 HA ASP 64 HA ASP 64 -5.448 9.798 11.767 322 HB2 ASP 64 HB2 ASP 64 -3.443 8.518 9.951 323 HB3 ASP 64 HB3 ASP 64 -3.349 10.253 10.243 324 H LEU 65 H LEU 65 -5.822 8.699 8.438 325 HA LEU 65 HA LEU 65 -5.929 11.133 7.122 326 HB2 LEU 65 HB2 LEU 65 -6.774 8.409 6.612 327 HB3 LEU 65 HB3 LEU 65 -7.870 9.580 5.885 328 HG LEU 65 HG LEU 65 -6.158 10.478 4.521 329 HD11 LEU 65 HD11 LEU 65 -3.802 9.451 4.729 330 HD12 LEU 65 HD12 LEU 65 -4.310 9.003 6.357 331 HD13 LEU 65 HD13 LEU 65 -4.289 10.700 5.878 332 HD21 LEU 65 HD21 LEU 65 -6.678 7.639 4.555 333 HD22 LEU 65 HD22 LEU 65 -5.085 7.988 3.880 334 HD23 LEU 65 HD23 LEU 65 -6.522 8.739 3.185 335 H ILE 66 H ILE 66 -8.331 9.565 9.117 336 HA ILE 66 HA ILE 66 -10.555 11.137 8.348 337 HB ILE 66 HB ILE 66 -9.956 9.523 10.814 338 HG12 ILE 66 HG12 ILE 66 -12.313 8.982 9.126 339 HG13 ILE 66 HG13 ILE 66 -10.762 8.773 8.319 340 HG21 ILE 66 HG21 ILE 66 -12.441 9.898 11.315 341 HG22 ILE 66 HG22 ILE 66 -11.314 11.189 11.724 342 HG23 ILE 66 HG23 ILE 66 -12.301 11.311 10.268 343 HD11 ILE 66 HD11 ILE 66 -11.643 7.420 10.857 344 HD12 ILE 66 HD12 ILE 66 -11.522 6.684 9.259 345 HD13 ILE 66 HD13 ILE 66 -10.067 7.231 10.090 346 H GLU 67 H GLU 67 -8.306 11.402 11.096 347 HA GLU 67 HA GLU 67 -9.458 13.833 12.053 348 HB2 GLU 67 HB2 GLU 67 -6.708 12.750 12.668 349 HB3 GLU 67 HB3 GLU 67 -7.651 13.875 13.634 350 HG2 GLU 67 HG2 GLU 67 -8.326 10.989 13.111 351 HG3 GLU 67 HG3 GLU 67 -7.671 11.654 14.607 352 H GLU 68 H GLU 68 -7.071 13.028 9.692 353 HA GLU 68 HA GLU 68 -5.986 15.730 9.619 354 HB2 GLU 68 HB2 GLU 68 -5.333 13.206 8.106 355 HB3 GLU 68 HB3 GLU 68 -4.610 14.759 7.712 356 HG2 GLU 68 HG2 GLU 68 -4.447 13.981 10.539 357 HG3 GLU 68 HG3 GLU 68 -3.541 12.967 9.417 358 H LYS 69 H LYS 69 -8.564 14.045 8.289 359 HA LYS 69 HA LYS 69 -10.107 14.558 6.698 360 HB2 LYS 69 HB2 LYS 69 -8.708 17.211 6.379 361 HB3 LYS 69 HB3 LYS 69 -10.390 16.831 6.033 362 HG2 LYS 69 HG2 LYS 69 -9.149 16.817 8.776 363 HG3 LYS 69 HG3 LYS 69 -10.101 18.138 8.097 364 HD2 LYS 69 HD2 LYS 69 -11.915 16.331 7.735 365 HD3 LYS 69 HD3 LYS 69 -10.983 15.388 8.901 366 HE2 LYS 69 HE2 LYS 69 -11.174 17.238 10.513 367 HE3 LYS 69 HE3 LYS 69 -12.146 18.137 9.349 368 HZ1 LYS 69 HZ1 LYS 69 -13.734 17.151 10.662 369 HZ2 LYS 69 HZ2 LYS 69 -12.850 15.726 10.881 370 HZ3 LYS 69 HZ3 LYS 69 -13.615 16.028 9.402 371 H ASP 70 H ASP 70 -7.888 13.094 5.900 372 HA ASP 70 HA ASP 70 -7.385 14.108 3.180 373 HB2 ASP 70 HB2 ASP 70 -5.687 12.549 5.086 374 HB3 ASP 70 HB3 ASP 70 -5.459 12.317 3.355 375 H LEU 71 H LEU 71 -9.765 12.737 3.871 376 HA LEU 71 HA LEU 71 -9.737 9.990 3.400 377 HB2 LEU 71 HB2 LEU 71 -11.926 11.839 2.493 378 HB3 LEU 71 HB3 LEU 71 -12.065 10.153 2.991 379 HG LEU 71 HG LEU 71 -11.464 12.503 4.788 380 HD11 LEU 71 HD11 LEU 71 -13.827 10.825 5.244 381 HD12 LEU 71 HD12 LEU 71 -13.873 11.787 3.767 382 HD13 LEU 71 HD13 LEU 71 -13.639 12.578 5.326 383 HD21 LEU 71 HD21 LEU 71 -11.818 9.581 5.451 384 HD22 LEU 71 HD22 LEU 71 -11.628 10.892 6.616 385 HD23 LEU 71 HD23 LEU 71 -10.304 10.482 5.523 386 H GLU 72 H GLU 72 -9.127 12.579 1.265 387 HA GLU 72 HA GLU 72 -10.018 11.704 -1.187 388 HB2 GLU 72 HB2 GLU 72 -8.754 13.847 -0.622 389 HB3 GLU 72 HB3 GLU 72 -7.281 12.901 -0.784 390 HG2 GLU 72 HG2 GLU 72 -7.700 14.078 -2.828 391 HG3 GLU 72 HG3 GLU 72 -7.920 12.350 -3.097 392 H LYS 73 H LYS 73 -6.840 10.973 0.260 393 HA LYS 73 HA LYS 73 -6.258 8.993 -1.742 394 HB2 LYS 73 HB2 LYS 73 -4.226 8.575 -0.382 395 HB3 LYS 73 HB3 LYS 73 -4.432 10.270 -0.805 396 HG2 LYS 73 HG2 LYS 73 -5.714 10.070 1.621 397 HG3 LYS 73 HG3 LYS 73 -4.324 8.999 1.803 398 HD2 LYS 73 HD2 LYS 73 -3.293 11.240 0.535 399 HD3 LYS 73 HD3 LYS 73 -4.435 11.896 1.710 400 HE2 LYS 73 HE2 LYS 73 -3.305 10.952 3.516 401 HE3 LYS 73 HE3 LYS 73 -2.462 9.784 2.499 402 HZ1 LYS 73 HZ1 LYS 73 -1.584 12.306 3.328 403 HZ2 LYS 73 HZ2 LYS 73 -1.767 12.358 1.648 404 HZ3 LYS 73 HZ3 LYS 73 -0.774 11.185 2.354 405 H LEU 74 H LEU 74 -7.791 9.040 1.338 406 HA LEU 74 HA LEU 74 -7.342 6.476 2.290 407 HB2 LEU 74 HB2 LEU 74 -8.550 8.267 3.493 408 HB3 LEU 74 HB3 LEU 74 -9.926 8.025 2.418 409 HG LEU 74 HG LEU 74 -10.165 5.726 3.302 410 HD11 LEU 74 HD11 LEU 74 -8.932 4.983 5.196 411 HD12 LEU 74 HD12 LEU 74 -8.133 6.545 5.367 412 HD13 LEU 74 HD13 LEU 74 -7.765 5.513 3.985 413 HD21 LEU 74 HD21 LEU 74 -11.089 8.015 4.348 414 HD22 LEU 74 HD22 LEU 74 -10.192 7.400 5.736 415 HD23 LEU 74 HD23 LEU 74 -11.471 6.426 5.010 416 H ASP 75 H ASP 75 -10.083 7.548 0.271 417 HA ASP 75 HA ASP 75 -11.173 5.013 -0.168 418 HB2 ASP 75 HB2 ASP 75 -11.484 7.693 -1.302 419 HB3 ASP 75 HB3 ASP 75 -11.791 6.407 -2.466 420 H LEU 76 H LEU 76 -8.447 6.597 -1.610 421 HA LEU 76 HA LEU 76 -8.299 4.897 -3.916 422 HB2 LEU 76 HB2 LEU 76 -6.175 6.644 -2.684 423 HB3 LEU 76 HB3 LEU 76 -6.137 5.937 -4.298 424 HG LEU 76 HG LEU 76 -8.161 7.977 -3.385 425 HD11 LEU 76 HD11 LEU 76 -6.365 8.958 -5.365 426 HD12 LEU 76 HD12 LEU 76 -5.429 8.346 -4.002 427 HD13 LEU 76 HD13 LEU 76 -6.668 9.573 -3.740 428 HD21 LEU 76 HD21 LEU 76 -7.543 7.574 -6.233 429 HD22 LEU 76 HD22 LEU 76 -9.091 7.846 -5.431 430 HD23 LEU 76 HD23 LEU 76 -8.374 6.234 -5.440 431 H VAL 77 H VAL 77 -6.655 5.054 -0.782 432 HA VAL 77 HA VAL 77 -4.899 2.879 -1.277 433 HB VAL 77 HB VAL 77 -5.847 4.033 1.349 434 HG11 VAL 77 HG11 VAL 77 -3.332 2.907 1.694 435 HG12 VAL 77 HG12 VAL 77 -4.867 2.268 2.287 436 HG13 VAL 77 HG13 VAL 77 -4.221 1.720 0.740 437 HG21 VAL 77 HG21 VAL 77 -3.190 4.485 0.026 438 HG22 VAL 77 HG22 VAL 77 -4.582 5.514 -0.310 439 HG23 VAL 77 HG23 VAL 77 -3.944 5.402 1.330 440 H ILE 78 H ILE 78 -8.086 3.147 0.218 441 HA ILE 78 HA ILE 78 -8.259 0.518 1.203 442 HB ILE 78 HB ILE 78 -10.424 2.439 0.352 443 HG12 ILE 78 HG12 ILE 78 -9.065 3.142 2.278 444 HG13 ILE 78 HG13 ILE 78 -10.714 2.766 2.762 445 HG21 ILE 78 HG21 ILE 78 -11.801 0.684 0.366 446 HG22 ILE 78 HG22 ILE 78 -10.581 -0.372 1.077 447 HG23 ILE 78 HG23 ILE 78 -11.567 0.658 2.114 448 HD11 ILE 78 HD11 ILE 78 -9.330 0.380 3.065 449 HD12 ILE 78 HD12 ILE 78 -8.231 1.626 3.658 450 HD13 ILE 78 HD13 ILE 78 -9.851 1.481 4.340 451 H LYS 79 H LYS 79 -9.703 1.905 -1.752 452 HA LYS 79 HA LYS 79 -10.608 -0.530 -2.809 453 HB2 LYS 79 HB2 LYS 79 -11.025 0.647 -4.820 454 HB3 LYS 79 HB3 LYS 79 -11.269 1.813 -3.526 455 HG2 LYS 79 HG2 LYS 79 -10.017 3.103 -4.891 456 HG3 LYS 79 HG3 LYS 79 -8.698 2.300 -4.035 457 HD2 LYS 79 HD2 LYS 79 -8.014 1.936 -6.180 458 HD3 LYS 79 HD3 LYS 79 -9.036 0.513 -5.968 459 HE2 LYS 79 HE2 LYS 79 -10.780 1.435 -7.214 460 HE3 LYS 79 HE3 LYS 79 -10.159 3.076 -7.041 461 HZ1 LYS 79 HZ1 LYS 79 -9.528 1.079 -9.007 462 HZ2 LYS 79 HZ2 LYS 79 -8.153 1.788 -8.325 463 HZ3 LYS 79 HZ3 LYS 79 -9.323 2.757 -9.068 464 H TYR 80 H TYR 80 -7.501 1.068 -2.971 465 HA TYR 80 HA TYR 80 -6.405 -0.465 -5.083 466 HB2 TYR 80 HB2 TYR 80 -5.416 1.658 -4.390 467 HB3 TYR 80 HB3 TYR 80 -5.025 0.983 -2.813 468 HD1 TYR 80 HD1 TYR 80 -3.199 -0.618 -2.562 469 HD2 TYR 80 HD2 TYR 80 -4.101 1.108 -6.344 470 HE1 TYR 80 HE1 TYR 80 -1.019 -1.371 -3.418 471 HE2 TYR 80 HE2 TYR 80 -1.924 0.360 -7.211 472 HH TYR 80 HH TYR 80 -0.183 -1.107 -6.796 473 H MET 81 H MET 81 -5.906 -0.695 -1.557 474 HA MET 81 HA MET 81 -4.428 -3.086 -1.640 475 HB2 MET 81 HB2 MET 81 -4.722 -3.183 0.732 476 HB3 MET 81 HB3 MET 81 -4.546 -1.489 0.292 477 HG2 MET 81 HG2 MET 81 -6.903 -1.125 0.513 478 HG3 MET 81 HG3 MET 81 -7.187 -2.846 0.764 479 HE1 MET 81 HE1 MET 81 -6.676 0.365 3.597 480 HE2 MET 81 HE2 MET 81 -5.029 0.194 2.992 481 HE3 MET 81 HE3 MET 81 -6.365 0.416 1.862 482 H LYS 82 H LYS 82 -7.840 -2.451 -1.733 483 HA LYS 82 HA LYS 82 -8.829 -4.936 -0.899 484 HB2 LYS 82 HB2 LYS 82 -9.865 -2.555 -2.110 485 HB3 LYS 82 HB3 LYS 82 -10.513 -3.953 -2.957 486 HG2 LYS 82 HG2 LYS 82 -10.578 -4.212 -0.050 487 HG3 LYS 82 HG3 LYS 82 -11.533 -2.865 -0.672 488 HD2 LYS 82 HD2 LYS 82 -11.860 -5.322 -2.212 489 HD3 LYS 82 HD3 LYS 82 -12.350 -5.487 -0.524 490 HE2 LYS 82 HE2 LYS 82 -13.859 -3.626 -0.726 491 HE3 LYS 82 HE3 LYS 82 -13.279 -3.279 -2.354 492 HZ1 LYS 82 HZ1 LYS 82 -15.016 -4.514 -2.978 493 HZ2 LYS 82 HZ2 LYS 82 -15.192 -5.245 -1.464 494 HZ3 LYS 82 HZ3 LYS 82 -14.055 -5.843 -2.565 495 H ARG 83 H ARG 83 -8.332 -3.762 -4.233 496 HA ARG 83 HA ARG 83 -8.914 -6.127 -5.556 497 HB2 ARG 83 HB2 ARG 83 -8.033 -5.145 -7.456 498 HB3 ARG 83 HB3 ARG 83 -8.377 -3.736 -6.460 499 HG2 ARG 83 HG2 ARG 83 -5.880 -4.137 -5.677 500 HG3 ARG 83 HG3 ARG 83 -5.776 -4.908 -7.262 501 HD2 ARG 83 HD2 ARG 83 -7.005 -2.195 -6.974 502 HD3 ARG 83 HD3 ARG 83 -5.252 -2.374 -7.027 503 HE ARG 83 HE ARG 83 -6.345 -3.789 -9.177 504 HH11 ARG 83 HH11 ARG 83 -5.987 -0.506 -8.071 505 HH12 ARG 83 HH12 ARG 83 -5.970 0.167 -9.667 506 HH21 ARG 83 HH21 ARG 83 -6.324 -2.913 -11.284 507 HH22 ARG 83 HH22 ARG 83 -6.162 -1.202 -11.494 508 H LEU 84 H LEU 84 -6.101 -5.245 -3.743 509 HA LEU 84 HA LEU 84 -4.429 -7.323 -4.842 510 HB2 LEU 84 HB2 LEU 84 -4.063 -5.574 -2.414 511 HB3 LEU 84 HB3 LEU 84 -2.842 -6.652 -3.088 512 HG LEU 84 HG LEU 84 -4.022 -4.360 -4.643 513 HD11 LEU 84 HD11 LEU 84 -1.590 -3.457 -4.006 514 HD12 LEU 84 HD12 LEU 84 -1.945 -4.370 -2.539 515 HD13 LEU 84 HD13 LEU 84 -3.031 -3.082 -3.060 516 HD21 LEU 84 HD21 LEU 84 -2.957 -6.012 -6.014 517 HD22 LEU 84 HD22 LEU 84 -1.551 -6.058 -4.952 518 HD23 LEU 84 HD23 LEU 84 -1.890 -4.612 -5.903 519 H MET 85 H MET 85 -5.924 -6.711 -1.662 520 HA MET 85 HA MET 85 -5.236 -9.198 -0.541 521 HB2 MET 85 HB2 MET 85 -7.499 -7.312 0.135 522 HB3 MET 85 HB3 MET 85 -7.022 -8.688 1.122 523 HG2 MET 85 HG2 MET 85 -4.670 -7.523 1.026 524 HG3 MET 85 HG3 MET 85 -5.643 -6.094 0.684 525 HE1 MET 85 HE1 MET 85 -4.607 -5.028 2.376 526 HE2 MET 85 HE2 MET 85 -5.702 -4.673 3.713 527 HE3 MET 85 HE3 MET 85 -4.267 -5.663 3.986 528 H GLN 86 H GLN 86 -7.782 -8.236 -2.683 529 HA GLN 86 HA GLN 86 -9.404 -10.573 -2.201 530 HB2 GLN 86 HB2 GLN 86 -9.542 -8.366 -4.253 531 HB3 GLN 86 HB3 GLN 86 -10.670 -9.716 -4.221 532 HG2 GLN 86 HG2 GLN 86 -10.332 -8.257 -1.684 533 HG3 GLN 86 HG3 GLN 86 -11.105 -7.370 -2.997 534 HE21 GLN 86 HE21 GLN 86 -12.727 -7.624 -1.059 535 HE22 GLN 86 HE22 GLN 86 -13.859 -8.914 -1.249 536 H GLN 87 H GLN 87 -7.177 -9.438 -4.704 537 HA GLN 87 HA GLN 87 -7.517 -11.813 -6.300 538 HB2 GLN 87 HB2 GLN 87 -6.062 -10.820 -7.848 539 HB3 GLN 87 HB3 GLN 87 -6.936 -9.463 -7.149 540 HG2 GLN 87 HG2 GLN 87 -5.031 -9.043 -5.649 541 HG3 GLN 87 HG3 GLN 87 -4.154 -10.358 -6.429 542 HE21 GLN 87 HE21 GLN 87 -6.187 -7.759 -7.720 543 HE22 GLN 87 HE22 GLN 87 -4.984 -7.107 -8.774 544 H SER 88 H SER 88 -5.900 -11.172 -3.485 545 HA SER 88 HA SER 88 -3.396 -12.352 -3.796 546 HB2 SER 88 HB2 SER 88 -3.405 -12.665 -1.384 547 HB3 SER 88 HB3 SER 88 -4.136 -11.108 -1.774 548 HG SER 88 HG SER 88 -5.222 -13.270 -0.535 549 H VAL 89 H VAL 89 -2.940 -14.469 -2.356 550 HA VAL 89 HA VAL 89 -4.531 -16.586 -3.630 551 HB VAL 89 HB VAL 89 -2.230 -16.767 -4.226 552 HG11 VAL 89 HG11 VAL 89 -0.447 -16.978 -2.521 553 HG12 VAL 89 HG12 VAL 89 -1.232 -15.399 -2.510 554 HG13 VAL 89 HG13 VAL 89 -1.633 -16.593 -1.275 555 HG21 VAL 89 HG21 VAL 89 -3.393 -18.869 -3.680 556 HG22 VAL 89 HG22 VAL 89 -1.658 -18.967 -3.380 557 HG23 VAL 89 HG23 VAL 89 -2.776 -18.764 -2.030 558 H GLU 90 H GLU 90 -3.372 -15.400 -0.546 559 HA GLU 90 HA GLU 90 -4.525 -17.668 0.876 560 HB2 GLU 90 HB2 GLU 90 -2.884 -15.294 1.737 561 HB3 GLU 90 HB3 GLU 90 -3.660 -16.355 2.904 562 HG2 GLU 90 HG2 GLU 90 -1.629 -17.181 0.842 563 HG3 GLU 90 HG3 GLU 90 -1.333 -16.962 2.566 564 H SER 91 H SER 91 -6.572 -17.660 1.494 565 HA SER 91 HA SER 91 -8.342 -15.540 1.159 566 HB2 SER 91 HB2 SER 91 -8.961 -17.506 3.301 567 HB3 SER 91 HB3 SER 91 -9.953 -16.963 1.947 568 HG SER 91 HG SER 91 -8.869 -19.221 2.028 569 H VAL 92 H VAL 92 -6.177 -16.254 3.759 570 HA VAL 92 HA VAL 92 -7.358 -14.944 5.899 571 HB VAL 92 HB VAL 92 -5.274 -16.275 6.052 572 HG11 VAL 92 HG11 VAL 92 -3.563 -13.987 5.353 573 HG12 VAL 92 HG12 VAL 92 -3.329 -15.712 5.067 574 HG13 VAL 92 HG13 VAL 92 -4.366 -14.772 3.994 575 HG21 VAL 92 HG21 VAL 92 -4.907 -15.288 8.011 576 HG22 VAL 92 HG22 VAL 92 -4.260 -13.843 7.232 577 HG23 VAL 92 HG23 VAL 92 -5.996 -14.002 7.495 578 H TRP 93 H TRP 93 -5.697 -13.638 3.111 579 HA TRP 93 HA TRP 93 -5.230 -11.036 4.048 580 HB2 TRP 93 HB2 TRP 93 -5.410 -12.341 1.388 581 HB3 TRP 93 HB3 TRP 93 -5.594 -10.589 1.421 582 HD1 TRP 93 HD1 TRP 93 -3.005 -12.912 0.762 583 HE1 TRP 93 HE1 TRP 93 -0.671 -12.013 1.366 584 HE3 TRP 93 HE3 TRP 93 -4.389 -9.013 3.764 585 HZ2 TRP 93 HZ2 TRP 93 0.438 -9.927 2.911 586 HZ3 TRP 93 HZ3 TRP 93 -2.630 -7.615 4.766 587 HH2 TRP 93 HH2 TRP 93 -0.267 -8.064 4.348 588 H ASN 94 H ASN 94 -8.071 -12.521 2.587 589 HA ASN 94 HA ASN 94 -9.578 -10.228 2.095 590 HB2 ASN 94 HB2 ASN 94 -10.728 -12.858 3.032 591 HB3 ASN 94 HB3 ASN 94 -11.487 -11.658 1.989 592 HD21 ASN 94 HD21 ASN 94 -9.411 -11.117 0.254 593 HD22 ASN 94 HD22 ASN 94 -9.084 -12.524 -0.693 594 H MET 95 H MET 95 -9.151 -12.102 5.050 595 HA MET 95 HA MET 95 -11.124 -10.688 6.548 596 HB2 MET 95 HB2 MET 95 -8.778 -12.229 7.655 597 HB3 MET 95 HB3 MET 95 -10.306 -11.886 8.453 598 HG2 MET 95 HG2 MET 95 -11.350 -13.231 6.510 599 HG3 MET 95 HG3 MET 95 -9.713 -13.839 6.275 600 HE1 MET 95 HE1 MET 95 -8.807 -16.113 8.393 601 HE2 MET 95 HE2 MET 95 -8.297 -14.443 8.147 602 HE3 MET 95 HE3 MET 95 -8.800 -14.984 9.748 603 H ALA 96 H ALA 96 -7.643 -10.374 6.102 604 HA ALA 96 HA ALA 96 -7.022 -8.579 8.113 605 HB1 ALA 96 HB1 ALA 96 -5.547 -9.727 6.276 606 HB2 ALA 96 HB2 ALA 96 -5.799 -8.203 5.422 607 HB3 ALA 96 HB3 ALA 96 -5.043 -8.207 7.015 608 H PHE 97 H PHE 97 -8.332 -7.924 4.886 609 HA PHE 97 HA PHE 97 -8.232 -5.140 4.955 610 HB2 PHE 97 HB2 PHE 97 -8.743 -6.385 2.915 611 HB3 PHE 97 HB3 PHE 97 -10.268 -6.927 3.609 612 HD1 PHE 97 HD2 PHE 97 -8.526 -3.642 3.247 613 HD2 PHE 97 HD1 PHE 97 -12.087 -5.903 2.677 614 HE1 PHE 97 HE2 PHE 97 -9.642 -1.648 2.333 615 HE2 PHE 97 HE1 PHE 97 -13.208 -3.913 1.762 616 HZ PHE 97 HZ PHE 97 -11.986 -1.783 1.587 617 H ASP 98 H ASP 98 -10.812 -7.339 6.006 618 HA ASP 98 HA ASP 98 -12.618 -5.325 6.813 619 HB2 ASP 98 HB2 ASP 98 -12.905 -7.939 6.461 620 HB3 ASP 98 HB3 ASP 98 -12.602 -7.969 8.196 621 H PHE 99 H PHE 99 -10.008 -7.000 8.466 622 HA PHE 99 HA PHE 99 -10.572 -6.225 11.090 623 HB2 PHE 99 HB2 PHE 99 -8.917 -7.878 10.830 624 HB3 PHE 99 HB3 PHE 99 -8.013 -6.915 9.667 625 HD1 PHE 99 HD2 PHE 99 -8.751 -7.441 13.211 626 HD2 PHE 99 HD1 PHE 99 -6.494 -5.195 10.389 627 HE1 PHE 99 HE2 PHE 99 -7.310 -6.615 15.027 628 HE2 PHE 99 HE1 PHE 99 -5.048 -4.365 12.198 629 HZ PHE 99 HZ PHE 99 -5.456 -5.075 14.522 630 H ILE 100 H ILE 100 -8.706 -4.593 8.562 631 HA ILE 100 HA ILE 100 -7.903 -2.406 10.191 632 HB ILE 100 HB ILE 100 -8.092 -2.591 7.183 633 HG12 ILE 100 HG12 ILE 100 -5.509 -2.666 8.662 634 HG13 ILE 100 HG13 ILE 100 -6.512 -4.112 8.713 635 HG21 ILE 100 HG21 ILE 100 -6.099 -0.770 8.029 636 HG22 ILE 100 HG22 ILE 100 -7.571 -0.437 7.118 637 HG23 ILE 100 HG23 ILE 100 -7.590 -0.361 8.879 638 HD11 ILE 100 HD11 ILE 100 -6.319 -4.475 6.436 639 HD12 ILE 100 HD12 ILE 100 -5.857 -2.805 6.107 640 HD13 ILE 100 HD13 ILE 100 -4.716 -3.898 6.888 641 H LEU 101 H LEU 101 -10.612 -2.970 8.004 642 HA LEU 101 HA LEU 101 -11.609 -0.311 8.067 643 HB2 LEU 101 HB2 LEU 101 -12.725 -2.965 7.261 644 HB3 LEU 101 HB3 LEU 101 -13.783 -1.559 7.367 645 HG LEU 101 HG LEU 101 -11.305 -1.606 5.658 646 HD11 LEU 101 HD11 LEU 101 -13.160 -1.851 3.823 647 HD12 LEU 101 HD12 LEU 101 -14.040 -2.654 5.124 648 HD13 LEU 101 HD13 LEU 101 -12.472 -3.272 4.607 649 HD21 LEU 101 HD21 LEU 101 -13.779 0.075 5.375 650 HD22 LEU 101 HD22 LEU 101 -12.195 0.318 4.639 651 HD23 LEU 101 HD23 LEU 101 -12.410 0.570 6.373 652 H ASP 102 H ASP 102 -12.120 -3.157 10.050 653 HA ASP 102 HA ASP 102 -14.404 -2.325 11.442 654 HB2 ASP 102 HB2 ASP 102 -13.083 -4.607 11.439 655 HB3 ASP 102 HB3 ASP 102 -12.276 -3.899 12.835 656 H ASN 103 H ASN 103 -11.073 -1.394 11.726 657 HA ASN 103 HA ASN 103 -11.586 0.008 14.244 658 HB2 ASN 103 HB2 ASN 103 -9.062 -0.638 12.726 659 HB3 ASN 103 HB3 ASN 103 -9.077 0.490 14.079 660 HD21 ASN 103 HD21 ASN 103 -9.876 -2.815 13.151 661 HD22 ASN 103 HD22 ASN 103 -9.601 -3.510 14.710 662 H VAL 104 H VAL 104 -10.677 0.593 10.888 663 HA VAL 104 HA VAL 104 -10.334 3.411 11.197 664 HB VAL 104 HB VAL 104 -10.770 1.740 8.719 665 HG11 VAL 104 HG11 VAL 104 -10.007 4.645 8.990 666 HG12 VAL 104 HG12 VAL 104 -9.932 3.717 7.490 667 HG13 VAL 104 HG13 VAL 104 -11.486 4.002 8.277 668 HG21 VAL 104 HG21 VAL 104 -8.442 1.769 8.428 669 HG22 VAL 104 HG22 VAL 104 -8.220 3.049 9.621 670 HG23 VAL 104 HG23 VAL 104 -8.671 1.425 10.143 671 H GLN 105 H GLN 105 -12.847 1.511 9.517 672 HA GLN 105 HA GLN 105 -14.593 3.537 8.905 673 HB2 GLN 105 HB2 GLN 105 -15.351 0.757 9.816 674 HB3 GLN 105 HB3 GLN 105 -16.366 1.850 8.886 675 HG2 GLN 105 HG2 GLN 105 -13.694 1.000 7.852 676 HG3 GLN 105 HG3 GLN 105 -15.109 -0.036 7.669 677 HE21 GLN 105 HE21 GLN 105 -13.671 3.029 6.822 678 HE22 GLN 105 HE22 GLN 105 -14.694 3.359 5.470 679 H VAL 106 H VAL 106 -13.989 2.068 12.002 680 HA VAL 106 HA VAL 106 -16.325 3.027 13.314 681 HB VAL 106 HB VAL 106 -13.700 1.939 14.268 682 HG11 VAL 106 HG11 VAL 106 -14.042 3.574 15.912 683 HG12 VAL 106 HG12 VAL 106 -15.790 3.331 15.915 684 HG13 VAL 106 HG13 VAL 106 -14.726 2.102 16.601 685 HG21 VAL 106 HG21 VAL 106 -15.648 0.521 13.439 686 HG22 VAL 106 HG22 VAL 106 -14.976 0.110 15.017 687 HG23 VAL 106 HG23 VAL 106 -16.486 1.013 14.910 688 H VAL 107 H VAL 107 -12.925 4.098 13.490 689 HA VAL 107 HA VAL 107 -13.465 6.433 14.978 690 HB VAL 107 HB VAL 107 -11.229 5.531 14.933 691 HG11 VAL 107 HG11 VAL 107 -9.920 6.010 12.706 692 HG12 VAL 107 HG12 VAL 107 -10.851 4.525 12.907 693 HG13 VAL 107 HG13 VAL 107 -11.524 5.873 11.988 694 HG21 VAL 107 HG21 VAL 107 -11.433 7.925 15.313 695 HG22 VAL 107 HG22 VAL 107 -9.947 7.566 14.434 696 HG23 VAL 107 HG23 VAL 107 -11.341 8.225 13.578 697 H LEU 108 H LEU 108 -13.684 5.712 11.600 698 HA LEU 108 HA LEU 108 -13.592 8.415 10.672 699 HB2 LEU 108 HB2 LEU 108 -13.408 7.403 8.712 700 HB3 LEU 108 HB3 LEU 108 -13.617 5.853 9.524 701 HG LEU 108 HG LEU 108 -16.115 6.196 9.216 702 HD11 LEU 108 HD11 LEU 108 -15.101 8.637 8.023 703 HD12 LEU 108 HD12 LEU 108 -16.741 8.213 8.512 704 HD13 LEU 108 HD13 LEU 108 -16.143 7.733 6.924 705 HD21 LEU 108 HD21 LEU 108 -14.158 5.107 7.566 706 HD22 LEU 108 HD22 LEU 108 -15.195 6.035 6.483 707 HD23 LEU 108 HD23 LEU 108 -15.891 4.783 7.513 708 H GLN 109 H GLN 109 -16.152 6.152 11.546 709 HA GLN 109 HA GLN 109 -18.316 7.753 10.674 710 HB2 GLN 109 HB2 GLN 109 -18.055 5.447 12.577 711 HB3 GLN 109 HB3 GLN 109 -19.582 6.304 12.422 712 HG2 GLN 109 HG2 GLN 109 -19.696 5.767 10.075 713 HG3 GLN 109 HG3 GLN 109 -18.104 5.011 10.143 714 HE21 GLN 109 HE21 GLN 109 -18.142 3.454 12.275 715 HE22 GLN 109 HE22 GLN 109 -19.391 2.264 12.178 716 H GLN 110 H GLN 110 -16.647 7.442 13.775 717 HA GLN 110 HA GLN 110 -18.368 9.089 15.272 718 HB2 GLN 110 HB2 GLN 110 -15.442 8.431 15.622 719 HB3 GLN 110 HB3 GLN 110 -16.379 9.342 16.799 720 HG2 GLN 110 HG2 GLN 110 -17.959 7.344 16.835 721 HG3 GLN 110 HG3 GLN 110 -16.679 6.473 15.990 722 HE21 GLN 110 HE21 GLN 110 -15.044 5.648 17.132 723 HE22 GLN 110 HE22 GLN 110 -14.794 5.892 18.825 724 H THR 111 H THR 111 -16.169 9.837 12.803 725 HA THR 111 HA THR 111 -15.805 12.597 13.693 726 HB THR 111 HB THR 111 -14.651 11.106 11.331 727 HG1 THR 111 HG1 THR 111 -13.231 12.221 13.512 728 HG21 THR 111 HG21 THR 111 -14.948 13.446 10.741 729 HG22 THR 111 HG22 THR 111 -13.238 13.106 11.009 730 HG23 THR 111 HG23 THR 111 -14.175 13.945 12.245 731 H TYR 112 H TYR 112 -16.750 10.982 10.651 732 HA TYR 112 HA TYR 112 -18.374 13.335 9.989 733 HB2 TYR 112 HB2 TYR 112 -17.716 11.064 8.122 734 HB3 TYR 112 HB3 TYR 112 -18.224 12.698 7.714 735 HD1 TYR 112 HD2 TYR 112 -16.640 14.561 7.834 736 HD2 TYR 112 HD1 TYR 112 -15.415 10.569 8.651 737 HE1 TYR 112 HE2 TYR 112 -14.287 15.242 7.603 738 HE2 TYR 112 HE1 TYR 112 -13.060 11.239 8.423 739 HH TYR 112 HH TYR 112 -11.657 12.876 7.872 740 H GLY 113 H GLY 113 -18.530 9.800 10.195 741 HA2 GLY 113 HA2 GLY 113 -20.517 8.815 11.205 742 HA3 GLY 113 HA3 GLY 113 -21.466 10.049 10.390 743 H SER 114 H SER 114 -19.484 9.474 8.036 744 HA SER 114 HA SER 114 -21.205 7.442 6.843 745 HB2 SER 114 HB2 SER 114 -20.438 9.745 5.786 746 HB3 SER 114 HB3 SER 114 -19.024 8.803 5.313 747 HG SER 114 HG SER 114 -21.672 8.596 4.471 748 H THR 115 H THR 115 -19.772 6.179 5.030 749 HA THR 115 HA THR 115 -17.281 5.196 6.142 750 HB THR 115 HB THR 115 -17.995 2.838 6.156 751 HG1 THR 115 HG1 THR 115 -20.221 2.370 5.998 752 HG21 THR 115 HG21 THR 115 -19.867 4.383 7.932 753 HG22 THR 115 HG22 THR 115 -18.122 4.380 8.197 754 HG23 THR 115 HG23 THR 115 -19.028 2.869 8.267 755 H LEU 116 H LEU 116 -16.681 3.106 4.694 756 HA LEU 116 HA LEU 116 -16.807 4.096 1.944 757 HB2 LEU 116 HB2 LEU 116 -14.803 2.865 3.554 758 HB3 LEU 116 HB3 LEU 116 -15.117 1.833 2.160 759 HG LEU 116 HG LEU 116 -14.874 4.262 0.967 760 HD11 LEU 116 HD11 LEU 116 -12.985 4.234 3.317 761 HD12 LEU 116 HD12 LEU 116 -14.269 5.403 3.010 762 HD13 LEU 116 HD13 LEU 116 -12.874 5.324 1.935 763 HD21 LEU 116 HD21 LEU 116 -12.338 2.833 1.458 764 HD22 LEU 116 HD22 LEU 116 -13.102 3.306 -0.059 765 HD23 LEU 116 HD23 LEU 116 -13.662 1.872 0.801 766 H LYS 117 H LYS 117 -17.335 2.749 0.192 767 HA LYS 117 HA LYS 117 -19.232 0.644 0.877 768 HB2 LYS 117 HB2 LYS 117 -20.096 2.199 -0.690 769 HB3 LYS 117 HB3 LYS 117 -18.631 2.149 -1.662 770 HG2 LYS 117 HG2 LYS 117 -20.457 0.962 -2.743 771 HG3 LYS 117 HG3 LYS 117 -19.136 -0.135 -2.336 772 HD2 LYS 117 HD2 LYS 117 -21.139 0.111 -0.224 773 HD3 LYS 117 HD3 LYS 117 -21.790 -0.524 -1.737 774 HE2 LYS 117 HE2 LYS 117 -19.475 -1.929 -1.522 775 HE3 LYS 117 HE3 LYS 117 -19.911 -1.731 0.174 776 HZ1 LYS 117 HZ1 LYS 117 -21.104 -3.578 -0.260 777 HZ2 LYS 117 HZ2 LYS 117 -21.237 -3.261 -1.916 778 HZ3 LYS 117 HZ3 LYS 117 -22.249 -2.465 -0.818 779 H VAL 118 H VAL 118 -18.059 -1.160 1.375 780 HA VAL 118 HA VAL 118 -16.287 -2.201 -0.740 781 HB VAL 118 HB VAL 118 -15.275 -3.589 1.151 782 HG11 VAL 118 HG11 VAL 118 -14.208 -1.212 2.021 783 HG12 VAL 118 HG12 VAL 118 -13.688 -2.115 0.597 784 HG13 VAL 118 HG13 VAL 118 -14.848 -0.797 0.431 785 HG21 VAL 118 HG21 VAL 118 -15.920 -1.528 3.110 786 HG22 VAL 118 HG22 VAL 118 -17.316 -2.492 2.626 787 HG23 VAL 118 HG23 VAL 118 -15.882 -3.283 3.283 788 H THR 119 H THR 119 -17.918 -3.316 -1.826 789 HA THR 119 HA THR 119 -19.824 -4.994 -0.635 790 HB THR 119 HB THR 119 -19.908 -4.180 -2.999 791 HG1 THR 119 HG1 THR 119 -21.294 -5.846 -2.469 792 HG21 THR 119 HG21 THR 119 -18.164 -6.491 -3.756 793 HG22 THR 119 HG22 THR 119 -17.432 -4.939 -3.349 794 HG23 THR 119 HG23 THR 119 -18.579 -5.049 -4.683 795 H LYS 207 H LYS 207 7.667 -6.380 15.972 796 HA LYS 207 HA LYS 207 9.456 -7.549 13.963 797 HB2 LYS 207 HB2 LYS 207 7.689 -8.995 15.877 798 HB3 LYS 207 HB3 LYS 207 7.806 -9.619 14.237 799 HG2 LYS 207 HG2 LYS 207 10.398 -9.350 14.720 800 HG3 LYS 207 HG3 LYS 207 9.844 -9.529 16.386 801 HD2 LYS 207 HD2 LYS 207 9.073 -11.678 16.039 802 HD3 LYS 207 HD3 LYS 207 8.873 -11.436 14.302 803 HE2 LYS 207 HE2 LYS 207 10.745 -12.762 14.335 804 HE3 LYS 207 HE3 LYS 207 11.481 -11.161 14.358 805 HZ1 LYS 207 HZ1 LYS 207 11.004 -11.855 16.997 806 HZ2 LYS 207 HZ2 LYS 207 12.501 -11.747 16.216 807 HZ3 LYS 207 HZ3 LYS 207 11.680 -13.225 16.272 808 H SER 208 H SER 208 8.755 -6.799 12.078 809 HA SER 208 HA SER 208 6.237 -7.378 11.018 810 HB2 SER 208 HB2 SER 208 4.906 -5.605 11.448 811 HB3 SER 208 HB3 SER 208 6.014 -5.279 12.781 812 HG SER 208 HG SER 208 5.619 -3.893 10.466 813 H PHE 209 H PHE 209 6.187 -7.027 8.837 814 HA PHE 209 HA PHE 209 8.572 -6.618 7.469 815 HB2 PHE 209 HB2 PHE 209 6.794 -7.788 6.382 816 HB3 PHE 209 HB3 PHE 209 5.706 -6.414 6.543 817 HD1 PHE 209 HD2 PHE 209 8.723 -7.650 4.812 818 HD2 PHE 209 HD1 PHE 209 5.661 -4.694 4.931 819 HE1 PHE 209 HE2 PHE 209 9.406 -6.858 2.584 820 HE2 PHE 209 HE1 PHE 209 6.338 -3.898 2.705 821 HZ PHE 209 HZ PHE 209 8.212 -4.980 1.527 822 H PHE 210 H PHE 210 5.880 -4.361 7.994 823 HA PHE 210 HA PHE 210 6.924 -2.204 6.551 824 HB2 PHE 210 HB2 PHE 210 5.036 -2.322 8.901 825 HB3 PHE 210 HB3 PHE 210 5.446 -0.813 8.092 826 HD1 PHE 210 HD1 PHE 210 5.315 -1.153 5.365 827 HD2 PHE 210 HD2 PHE 210 3.005 -3.179 8.311 828 HE1 PHE 210 HE1 PHE 210 3.557 -1.570 3.695 829 HE2 PHE 210 HE2 PHE 210 1.244 -3.601 6.645 830 HZ PHE 210 HZ PHE 210 1.519 -2.796 4.334 831 H ASP 211 H ASP 211 7.759 -3.477 9.647 832 HA ASP 211 HA ASP 211 9.046 -1.107 10.628 833 HB2 ASP 211 HB2 ASP 211 8.114 -2.922 12.093 834 HB3 ASP 211 HB3 ASP 211 9.438 -3.956 11.562 835 H LYS 212 H LYS 212 10.129 -4.137 9.141 836 HA LYS 212 HA LYS 212 12.901 -3.388 9.214 837 HB2 LYS 212 HB2 LYS 212 13.318 -5.443 8.060 838 HB3 LYS 212 HB3 LYS 212 12.075 -5.755 9.264 839 HG2 LYS 212 HG2 LYS 212 10.362 -5.740 7.584 840 HG3 LYS 212 HG3 LYS 212 11.519 -5.233 6.351 841 HD2 LYS 212 HD2 LYS 212 12.749 -7.450 7.200 842 HD3 LYS 212 HD3 LYS 212 11.083 -7.895 7.580 843 HE2 LYS 212 HE2 LYS 212 10.713 -6.948 5.111 844 HE3 LYS 212 HE3 LYS 212 12.393 -7.462 4.957 845 HZ1 LYS 212 HZ1 LYS 212 10.947 -9.246 4.315 846 HZ2 LYS 212 HZ2 LYS 212 10.095 -9.155 5.773 847 HZ3 LYS 212 HZ3 LYS 212 11.707 -9.667 5.768 848 H LYS 213 H LYS 213 10.262 -2.767 7.136 849 HA LYS 213 HA LYS 213 11.899 -2.251 4.797 850 HB2 LYS 213 HB2 LYS 213 9.351 -3.066 5.018 851 HB3 LYS 213 HB3 LYS 213 9.077 -1.332 4.911 852 HG2 LYS 213 HG2 LYS 213 10.824 -2.721 2.920 853 HG3 LYS 213 HG3 LYS 213 9.066 -2.743 2.754 854 HD2 LYS 213 HD2 LYS 213 9.084 -0.258 2.865 855 HD3 LYS 213 HD3 LYS 213 10.849 -0.311 2.866 856 HE2 LYS 213 HE2 LYS 213 10.883 -1.305 0.690 857 HE3 LYS 213 HE3 LYS 213 9.135 -1.527 0.706 858 HZ1 LYS 213 HZ1 LYS 213 9.595 1.169 1.141 859 HZ2 LYS 213 HZ2 LYS 213 8.961 0.448 -0.250 860 HZ3 LYS 213 HZ3 LYS 213 10.626 0.724 -0.125 861 H ARG 214 H ARG 214 9.982 -0.395 7.135 862 HA ARG 214 HA ARG 214 10.330 2.141 6.048 863 HB2 ARG 214 HB2 ARG 214 9.789 3.008 8.243 864 HB3 ARG 214 HB3 ARG 214 8.785 1.604 7.906 865 HG2 ARG 214 HG2 ARG 214 9.960 0.256 9.410 866 HG3 ARG 214 HG3 ARG 214 11.327 1.370 9.476 867 HD2 ARG 214 HD2 ARG 214 9.760 3.048 10.515 868 HD3 ARG 214 HD3 ARG 214 8.578 1.747 10.646 869 HE ARG 214 HE ARG 214 9.732 0.948 12.444 870 HH11 ARG 214 HH11 ARG 214 11.815 3.067 10.631 871 HH12 ARG 214 HH12 ARG 214 13.097 3.017 11.795 872 HH21 ARG 214 HH21 ARG 214 11.413 0.874 13.986 873 HH22 ARG 214 HH22 ARG 214 12.867 1.770 13.702 874 H SER 215 H SER 215 12.550 0.122 7.774 875 HA SER 215 HA SER 215 14.379 2.230 8.464 876 HB2 SER 215 HB2 SER 215 15.896 0.364 9.098 877 HB3 SER 215 HB3 SER 215 14.304 0.226 9.841 878 HG SER 215 HG SER 215 14.206 -1.661 8.948 879 H GLU 216 H GLU 216 13.849 0.150 5.747 880 HA GLU 216 HA GLU 216 16.355 0.114 4.552 881 HB2 GLU 216 HB2 GLU 216 13.643 0.269 3.225 882 HB3 GLU 216 HB3 GLU 216 15.138 -0.169 2.411 883 HG2 GLU 216 HG2 GLU 216 15.350 -2.154 3.732 884 HG3 GLU 216 HG3 GLU 216 13.976 -1.686 4.733 885 H ARG 217 H ARG 217 13.715 2.442 3.975 886 HA ARG 217 HA ARG 217 15.220 4.139 2.299 887 HB2 ARG 217 HB2 ARG 217 13.412 5.672 2.461 888 HB3 ARG 217 HB3 ARG 217 12.703 4.064 2.517 889 HG2 ARG 217 HG2 ARG 217 12.730 4.308 5.046 890 HG3 ARG 217 HG3 ARG 217 13.072 6.016 4.764 891 HD2 ARG 217 HD2 ARG 217 10.917 5.282 3.080 892 HD3 ARG 217 HD3 ARG 217 10.570 4.654 4.690 893 HE ARG 217 HE ARG 217 10.288 6.802 5.434 894 HH11 ARG 217 HH11 ARG 217 11.868 6.856 2.332 895 HH12 ARG 217 HH12 ARG 217 11.742 8.575 2.151 896 HH21 ARG 217 HH21 ARG 217 10.117 9.066 5.209 897 HH22 ARG 217 HH22 ARG 217 10.746 9.831 3.789 898 H ILE 218 H ILE 218 14.842 3.960 5.771 899 HA ILE 218 HA ILE 218 16.001 6.505 6.338 900 HB ILE 218 HB ILE 218 15.715 4.088 8.128 901 HG12 ILE 218 HG12 ILE 218 13.990 6.559 8.108 902 HG13 ILE 218 HG13 ILE 218 13.613 5.157 7.113 903 HG21 ILE 218 HG21 ILE 218 16.862 6.756 8.532 904 HG22 ILE 218 HG22 ILE 218 15.697 6.261 9.759 905 HG23 ILE 218 HG23 ILE 218 17.114 5.262 9.434 906 HD11 ILE 218 HD11 ILE 218 12.414 4.510 8.880 907 HD12 ILE 218 HD12 ILE 218 13.969 4.011 9.547 908 HD13 ILE 218 HD13 ILE 218 13.283 5.575 9.985 909 H SER 219 H SER 219 17.257 3.370 5.625 910 HA SER 219 HA SER 219 19.976 4.405 5.998 911 HB2 SER 219 HB2 SER 219 19.747 3.049 7.925 912 HB3 SER 219 HB3 SER 219 18.884 1.793 7.037 913 HG SER 219 HG SER 219 21.622 2.370 7.109 914 H ASN 220 H ASN 220 20.027 4.716 3.738 915 HA ASN 220 HA ASN 220 19.380 2.860 1.782 916 HB2 ASN 220 HB2 ASN 220 21.693 4.800 1.625 917 HB3 ASN 220 HB3 ASN 220 20.762 4.139 0.284 918 HD21 ASN 220 HD21 ASN 220 18.927 5.122 -0.334 919 HD22 ASN 220 HD22 ASN 220 18.268 6.527 0.426 Start of MODEL 5 1 H ALA 23 H ALA 23 4.264 14.349 12.155 2 HA ALA 23 HA ALA 23 2.137 13.102 13.772 3 HB1 ALA 23 HB1 ALA 23 1.371 15.176 14.444 4 HB2 ALA 23 HB2 ALA 23 3.118 15.414 14.429 5 HB3 ALA 23 HB3 ALA 23 2.135 16.013 13.093 6 H ALA 24 H ALA 24 2.877 12.731 10.889 7 HA ALA 24 HA ALA 24 0.296 13.546 9.718 8 HB1 ALA 24 HB1 ALA 24 1.840 13.108 7.536 9 HB2 ALA 24 HB2 ALA 24 1.599 14.687 8.285 10 HB3 ALA 24 HB3 ALA 24 3.034 13.739 8.672 11 HA PRO 25 HA PRO 25 -0.636 9.340 8.882 12 HB2 PRO 25 HB2 PRO 25 -1.855 9.492 6.460 13 HB3 PRO 25 HB3 PRO 25 -2.609 10.066 7.954 14 HG2 PRO 25 HG2 PRO 25 -1.186 11.624 5.829 15 HG3 PRO 25 HG3 PRO 25 -2.692 12.012 6.683 16 HD2 PRO 25 HD2 PRO 25 -0.314 13.126 7.344 17 HD3 PRO 25 HD3 PRO 25 -1.581 12.799 8.543 18 H ASN 26 H ASN 26 1.594 8.652 8.691 19 HA ASN 26 HA ASN 26 2.409 8.162 5.902 20 HB2 ASN 26 HB2 ASN 26 4.346 8.166 8.200 21 HB3 ASN 26 HB3 ASN 26 4.667 8.396 6.484 22 HD21 ASN 26 HD21 ASN 26 2.788 10.299 5.850 23 HD22 ASN 26 HD22 ASN 26 3.162 11.769 6.677 24 H LEU 27 H LEU 27 2.847 6.110 5.292 25 HA LEU 27 HA LEU 27 2.468 4.018 7.324 26 HB2 LEU 27 HB2 LEU 27 0.985 4.291 5.190 27 HB3 LEU 27 HB3 LEU 27 2.341 3.504 4.384 28 HG LEU 27 HG LEU 27 1.460 2.074 6.765 29 HD11 LEU 27 HD11 LEU 27 -0.529 1.280 5.059 30 HD12 LEU 27 HD12 LEU 27 -0.548 3.034 4.882 31 HD13 LEU 27 HD13 LEU 27 -0.740 2.308 6.477 32 HD21 LEU 27 HD21 LEU 27 1.407 1.015 3.979 33 HD22 LEU 27 HD22 LEU 27 1.901 0.225 5.475 34 HD23 LEU 27 HD23 LEU 27 2.956 1.419 4.719 35 H ALA 28 H ALA 28 4.279 3.098 8.003 36 HA ALA 28 HA ALA 28 6.388 2.242 8.068 37 HB1 ALA 28 HB1 ALA 28 7.145 1.172 5.847 38 HB2 ALA 28 HB2 ALA 28 5.718 0.522 6.656 39 HB3 ALA 28 HB3 ALA 28 5.533 1.597 5.270 40 H GLY 29 H GLY 29 6.021 5.094 7.425 41 HA2 GLY 29 HA2 GLY 29 7.679 6.751 7.272 42 HA3 GLY 29 HA3 GLY 29 8.743 5.585 6.499 43 H ALA 30 H ALA 30 5.618 5.602 5.191 44 HA ALA 30 HA ALA 30 6.588 7.154 2.886 45 HB1 ALA 30 HB1 ALA 30 6.079 4.829 2.379 46 HB2 ALA 30 HB2 ALA 30 4.440 5.037 3.000 47 HB3 ALA 30 HB3 ALA 30 4.954 5.907 1.553 48 H VAL 31 H VAL 31 5.780 9.128 2.695 49 HA VAL 31 HA VAL 31 3.266 9.805 4.017 50 HB VAL 31 HB VAL 31 5.165 11.666 2.590 51 HG11 VAL 31 HG11 VAL 31 4.021 13.239 4.344 52 HG12 VAL 31 HG12 VAL 31 3.214 12.861 2.821 53 HG13 VAL 31 HG13 VAL 31 2.747 12.019 4.300 54 HG21 VAL 31 HG21 VAL 31 5.279 10.445 5.276 55 HG22 VAL 31 HG22 VAL 31 6.579 11.044 4.245 56 HG23 VAL 31 HG23 VAL 31 5.608 12.175 5.187 57 H GLU 32 H GLU 32 4.760 9.971 0.801 58 HA GLU 32 HA GLU 32 2.497 11.057 -0.508 59 HB2 GLU 32 HB2 GLU 32 4.776 9.427 -1.647 60 HB3 GLU 32 HB3 GLU 32 3.628 10.370 -2.587 61 HG2 GLU 32 HG2 GLU 32 4.478 12.321 -1.037 62 HG3 GLU 32 HG3 GLU 32 5.890 11.274 -0.891 63 H PHE 33 H PHE 33 0.773 10.121 -1.472 64 HA PHE 33 HA PHE 33 -0.204 7.683 -0.620 65 HB2 PHE 33 HB2 PHE 33 -1.781 9.159 -1.540 66 HB3 PHE 33 HB3 PHE 33 -0.843 9.387 -3.012 67 HD1 PHE 33 HD1 PHE 33 -2.918 6.951 -1.157 68 HD2 PHE 33 HD2 PHE 33 -1.200 8.040 -4.896 69 HE1 PHE 33 HE1 PHE 33 -4.262 5.219 -2.274 70 HE2 PHE 33 HE2 PHE 33 -2.541 6.310 -6.019 71 HZ PHE 33 HZ PHE 33 -4.072 4.895 -4.709 72 H SER 34 H SER 34 1.350 8.415 -3.738 73 HA SER 34 HA SER 34 1.240 5.912 -4.892 74 HB2 SER 34 HB2 SER 34 3.062 6.600 -6.302 75 HB3 SER 34 HB3 SER 34 2.081 8.027 -5.969 76 HG SER 34 HG SER 34 4.673 7.447 -5.227 77 H ASP 35 H ASP 35 3.498 7.141 -2.490 78 HA ASP 35 HA ASP 35 5.217 4.855 -2.566 79 HB2 ASP 35 HB2 ASP 35 4.934 7.237 -0.766 80 HB3 ASP 35 HB3 ASP 35 5.939 5.878 -0.268 81 H VAL 36 H VAL 36 2.335 5.746 -0.825 82 HA VAL 36 HA VAL 36 2.556 3.793 1.237 83 HB VAL 36 HB VAL 36 0.044 5.107 0.195 84 HG11 VAL 36 HG11 VAL 36 0.216 4.456 3.029 85 HG12 VAL 36 HG12 VAL 36 -1.071 4.128 1.867 86 HG13 VAL 36 HG13 VAL 36 0.311 3.038 1.987 87 HG21 VAL 36 HG21 VAL 36 2.296 6.229 1.569 88 HG22 VAL 36 HG22 VAL 36 0.828 7.025 0.998 89 HG23 VAL 36 HG23 VAL 36 0.870 6.296 2.603 90 H LYS 37 H LYS 37 0.467 3.944 -1.652 91 HA LYS 37 HA LYS 37 -0.619 1.392 -1.442 92 HB2 LYS 37 HB2 LYS 37 -0.939 1.594 -3.956 93 HB3 LYS 37 HB3 LYS 37 -1.624 2.885 -2.976 94 HG2 LYS 37 HG2 LYS 37 -0.078 4.432 -3.688 95 HG3 LYS 37 HG3 LYS 37 1.116 3.202 -4.107 96 HD2 LYS 37 HD2 LYS 37 -1.311 2.906 -5.658 97 HD3 LYS 37 HD3 LYS 37 -0.610 4.515 -5.848 98 HE2 LYS 37 HE2 LYS 37 1.571 3.444 -6.356 99 HE3 LYS 37 HE3 LYS 37 0.775 1.872 -6.290 100 HZ1 LYS 37 HZ1 LYS 37 1.082 3.156 -8.542 101 HZ2 LYS 37 HZ2 LYS 37 -0.353 3.910 -8.061 102 HZ3 LYS 37 HZ3 LYS 37 -0.302 2.229 -8.245 103 H THR 38 H THR 38 2.438 2.454 -2.796 104 HA THR 38 HA THR 38 3.128 0.092 -4.158 105 HB THR 38 HB THR 38 4.898 2.196 -2.901 106 HG1 THR 38 HG1 THR 38 3.362 2.502 -4.860 107 HG21 THR 38 HG21 THR 38 5.600 -0.051 -4.795 108 HG22 THR 38 HG22 THR 38 6.177 0.156 -3.141 109 HG23 THR 38 HG23 THR 38 6.664 1.297 -4.395 110 H LEU 39 H LEU 39 3.631 1.117 -0.814 111 HA LEU 39 HA LEU 39 5.271 -1.057 -0.051 112 HB2 LEU 39 HB2 LEU 39 3.492 0.765 1.555 113 HB3 LEU 39 HB3 LEU 39 4.576 -0.426 2.271 114 HG LEU 39 HG LEU 39 5.589 1.753 0.467 115 HD11 LEU 39 HD11 LEU 39 4.594 3.054 2.106 116 HD12 LEU 39 HD12 LEU 39 6.229 2.830 2.725 117 HD13 LEU 39 HD13 LEU 39 4.900 1.870 3.376 118 HD21 LEU 39 HD21 LEU 39 6.861 -0.420 1.279 119 HD22 LEU 39 HD22 LEU 39 7.102 0.559 2.727 120 HD23 LEU 39 HD23 LEU 39 7.672 1.142 1.163 121 H LEU 40 H LEU 40 1.788 -0.568 -0.092 122 HA LEU 40 HA LEU 40 1.152 -2.951 1.337 123 HB2 LEU 40 HB2 LEU 40 -0.617 -1.461 -0.587 124 HB3 LEU 40 HB3 LEU 40 -1.117 -2.524 0.726 125 HG LEU 40 HG LEU 40 0.419 -0.045 1.367 126 HD11 LEU 40 HD11 LEU 40 -2.513 0.205 1.352 127 HD12 LEU 40 HD12 LEU 40 -1.739 0.210 -0.231 128 HD13 LEU 40 HD13 LEU 40 -1.265 1.396 0.985 129 HD21 LEU 40 HD21 LEU 40 -0.312 -0.406 3.464 130 HD22 LEU 40 HD22 LEU 40 -0.553 -2.056 2.888 131 HD23 LEU 40 HD23 LEU 40 -1.910 -0.930 2.932 132 H LYS 41 H LYS 41 1.205 -2.090 -2.106 133 HA LYS 41 HA LYS 41 0.237 -4.438 -3.192 134 HB2 LYS 41 HB2 LYS 41 1.135 -2.153 -4.252 135 HB3 LYS 41 HB3 LYS 41 2.547 -3.156 -4.558 136 HG2 LYS 41 HG2 LYS 41 0.827 -4.823 -5.557 137 HG3 LYS 41 HG3 LYS 41 -0.224 -3.407 -5.642 138 HD2 LYS 41 HD2 LYS 41 0.844 -3.486 -7.731 139 HD3 LYS 41 HD3 LYS 41 1.721 -2.251 -6.826 140 HE2 LYS 41 HE2 LYS 41 3.532 -3.715 -6.405 141 HE3 LYS 41 HE3 LYS 41 2.612 -5.122 -6.940 142 HZ1 LYS 41 HZ1 LYS 41 4.362 -3.884 -8.480 143 HZ2 LYS 41 HZ2 LYS 41 2.987 -2.986 -8.885 144 HZ3 LYS 41 HZ3 LYS 41 2.997 -4.663 -9.104 145 H GLU 42 H GLU 42 3.550 -3.660 -2.205 146 HA GLU 42 HA GLU 42 4.583 -6.212 -3.018 147 HB2 GLU 42 HB2 GLU 42 6.654 -5.476 -1.900 148 HB3 GLU 42 HB3 GLU 42 6.037 -4.265 -3.017 149 HG2 GLU 42 HG2 GLU 42 5.019 -3.089 -1.079 150 HG3 GLU 42 HG3 GLU 42 5.823 -4.243 -0.017 151 H TRP 43 H TRP 43 3.670 -4.708 0.053 152 HA TRP 43 HA TRP 43 4.488 -6.820 1.726 153 HB2 TRP 43 HB2 TRP 43 4.041 -4.660 2.682 154 HB3 TRP 43 HB3 TRP 43 2.380 -4.685 2.094 155 HD1 TRP 43 HD1 TRP 43 4.534 -6.900 4.462 156 HE1 TRP 43 HE1 TRP 43 3.054 -7.586 6.453 157 HE3 TRP 43 HE3 TRP 43 0.172 -4.641 3.046 158 HZ2 TRP 43 HZ2 TRP 43 0.390 -7.217 7.309 159 HZ3 TRP 43 HZ3 TRP 43 -1.796 -4.856 4.507 160 HH2 TRP 43 HH2 TRP 43 -1.687 -6.119 6.594 161 H ILE 44 H ILE 44 1.936 -6.606 -0.492 162 HA ILE 44 HA ILE 44 0.399 -8.714 0.853 163 HB ILE 44 HB ILE 44 -0.315 -6.988 -1.519 164 HG12 ILE 44 HG12 ILE 44 -1.729 -7.062 1.130 165 HG13 ILE 44 HG13 ILE 44 -0.293 -6.068 0.914 166 HG21 ILE 44 HG21 ILE 44 -1.366 -9.070 -1.889 167 HG22 ILE 44 HG22 ILE 44 -1.793 -9.242 -0.187 168 HG23 ILE 44 HG23 ILE 44 -2.598 -8.026 -1.180 169 HD11 ILE 44 HD11 ILE 44 -2.557 -4.962 0.590 170 HD12 ILE 44 HD12 ILE 44 -1.342 -4.702 -0.663 171 HD13 ILE 44 HD13 ILE 44 -2.647 -5.859 -0.926 172 H THR 45 H THR 45 2.682 -8.241 -1.603 173 HA THR 45 HA THR 45 1.918 -10.713 -2.990 174 HB THR 45 HB THR 45 3.581 -10.046 -4.704 175 HG1 THR 45 HG1 THR 45 4.248 -7.732 -4.481 176 HG21 THR 45 HG21 THR 45 1.491 -9.367 -5.375 177 HG22 THR 45 HG22 THR 45 2.315 -7.809 -5.302 178 HG23 THR 45 HG23 THR 45 1.265 -8.315 -3.978 179 H THR 46 H THR 46 4.866 -9.115 -1.767 180 HA THR 46 HA THR 46 6.475 -11.433 -1.883 181 HB THR 46 HB THR 46 7.344 -9.083 -1.758 182 HG1 THR 46 HG1 THR 46 8.273 -11.033 0.096 183 HG21 THR 46 HG21 THR 46 6.850 -7.751 -0.041 184 HG22 THR 46 HG22 THR 46 7.497 -8.929 1.103 185 HG23 THR 46 HG23 THR 46 5.809 -9.021 0.601 186 H ILE 47 H ILE 47 4.038 -10.475 0.292 187 HA ILE 47 HA ILE 47 4.860 -12.601 2.158 188 HB ILE 47 HB ILE 47 3.621 -9.941 2.867 189 HG12 ILE 47 HG12 ILE 47 5.945 -10.705 4.386 190 HG13 ILE 47 HG13 ILE 47 6.304 -10.791 2.664 191 HG21 ILE 47 HG21 ILE 47 3.698 -10.768 5.204 192 HG22 ILE 47 HG22 ILE 47 2.555 -11.643 4.186 193 HG23 ILE 47 HG23 ILE 47 4.114 -12.366 4.587 194 HD11 ILE 47 HD11 ILE 47 5.781 -8.463 4.376 195 HD12 ILE 47 HD12 ILE 47 6.796 -8.622 2.943 196 HD13 ILE 47 HD13 ILE 47 5.054 -8.413 2.771 197 H SER 48 H SER 48 3.340 -14.068 2.661 198 HA SER 48 HA SER 48 0.648 -13.648 1.551 199 HB2 SER 48 HB2 SER 48 0.678 -16.292 2.022 200 HB3 SER 48 HB3 SER 48 1.288 -15.589 0.525 201 HG SER 48 HG SER 48 3.294 -16.003 1.125 202 H ASP 49 H ASP 49 2.437 -14.530 4.427 203 HA ASP 49 HA ASP 49 -0.089 -14.652 5.938 204 HB2 ASP 49 HB2 ASP 49 1.301 -16.696 6.049 205 HB3 ASP 49 HB3 ASP 49 2.625 -15.742 6.715 206 HA PRO 50 HA PRO 50 1.803 -10.638 7.163 207 HB2 PRO 50 HB2 PRO 50 -0.576 -9.362 7.445 208 HB3 PRO 50 HB3 PRO 50 0.256 -9.510 5.892 209 HG2 PRO 50 HG2 PRO 50 -2.014 -11.127 6.986 210 HG3 PRO 50 HG3 PRO 50 -1.787 -10.480 5.351 211 HD2 PRO 50 HD2 PRO 50 -1.280 -13.064 5.978 212 HD3 PRO 50 HD3 PRO 50 -0.364 -12.185 4.738 213 H MET 51 H MET 51 2.054 -9.851 9.211 214 HA MET 51 HA MET 51 0.843 -11.398 11.354 215 HB2 MET 51 HB2 MET 51 3.345 -10.704 11.133 216 HB3 MET 51 HB3 MET 51 2.797 -9.161 11.773 217 HG2 MET 51 HG2 MET 51 1.982 -10.229 13.773 218 HG3 MET 51 HG3 MET 51 2.386 -11.817 13.124 219 HE1 MET 51 HE1 MET 51 3.135 -9.261 15.382 220 HE2 MET 51 HE2 MET 51 4.868 -9.260 15.710 221 HE3 MET 51 HE3 MET 51 4.224 -8.318 14.364 222 H GLU 52 H GLU 52 -0.017 -10.319 13.278 223 HA GLU 52 HA GLU 52 -2.100 -8.571 12.690 224 HB2 GLU 52 HB2 GLU 52 -2.103 -9.977 14.679 225 HB3 GLU 52 HB3 GLU 52 -0.740 -9.085 15.340 226 HG2 GLU 52 HG2 GLU 52 -2.093 -7.094 15.537 227 HG3 GLU 52 HG3 GLU 52 -3.454 -7.914 14.775 228 H GLU 53 H GLU 53 1.009 -7.859 14.276 229 HA GLU 53 HA GLU 53 0.679 -5.148 14.689 230 HB2 GLU 53 HB2 GLU 53 3.207 -6.623 13.931 231 HB3 GLU 53 HB3 GLU 53 3.154 -4.994 14.590 232 HG2 GLU 53 HG2 GLU 53 2.025 -7.376 16.028 233 HG3 GLU 53 HG3 GLU 53 3.692 -6.835 16.216 234 H ASP 54 H ASP 54 2.070 -6.745 11.828 235 HA ASP 54 HA ASP 54 2.618 -4.476 10.324 236 HB2 ASP 54 HB2 ASP 54 2.114 -7.337 9.712 237 HB3 ASP 54 HB3 ASP 54 1.989 -6.206 8.368 238 H ILE 55 H ILE 55 -0.360 -6.409 10.436 239 HA ILE 55 HA ILE 55 -1.777 -4.876 8.533 240 HB ILE 55 HB ILE 55 -2.878 -6.561 10.785 241 HG12 ILE 55 HG12 ILE 55 -2.583 -7.354 7.891 242 HG13 ILE 55 HG13 ILE 55 -1.307 -7.647 9.069 243 HG21 ILE 55 HG21 ILE 55 -4.533 -5.012 9.891 244 HG22 ILE 55 HG22 ILE 55 -4.190 -5.574 8.255 245 HG23 ILE 55 HG23 ILE 55 -4.914 -6.671 9.431 246 HD11 ILE 55 HD11 ILE 55 -2.306 -9.562 9.540 247 HD12 ILE 55 HD12 ILE 55 -3.629 -8.634 10.248 248 HD13 ILE 55 HD13 ILE 55 -3.708 -9.135 8.559 249 H LEU 56 H LEU 56 -1.259 -4.520 11.967 250 HA LEU 56 HA LEU 56 -3.342 -2.679 12.486 251 HB2 LEU 56 HB2 LEU 56 -0.946 -3.666 13.868 252 HB3 LEU 56 HB3 LEU 56 -1.439 -2.035 14.318 253 HG LEU 56 HG LEU 56 -3.150 -4.514 14.507 254 HD11 LEU 56 HD11 LEU 56 -1.708 -4.762 16.269 255 HD12 LEU 56 HD12 LEU 56 -2.953 -3.756 17.010 256 HD13 LEU 56 HD13 LEU 56 -1.449 -3.027 16.447 257 HD21 LEU 56 HD21 LEU 56 -3.689 -1.611 14.915 258 HD22 LEU 56 HD22 LEU 56 -4.494 -2.788 15.952 259 HD23 LEU 56 HD23 LEU 56 -4.711 -2.859 14.203 260 H GLN 57 H GLN 57 -0.037 -2.320 11.352 261 HA GLN 57 HA GLN 57 0.336 0.404 11.697 262 HB2 GLN 57 HB2 GLN 57 1.327 -1.529 9.621 263 HB3 GLN 57 HB3 GLN 57 1.758 0.174 9.546 264 HG2 GLN 57 HG2 GLN 57 2.180 -1.233 12.117 265 HG3 GLN 57 HG3 GLN 57 3.261 -1.621 10.780 266 HE21 GLN 57 HE21 GLN 57 1.924 1.100 12.598 267 HE22 GLN 57 HE22 GLN 57 3.319 2.108 12.457 268 H VAL 58 H VAL 58 -1.565 -1.307 9.315 269 HA VAL 58 HA VAL 58 -1.951 0.903 7.559 270 HB VAL 58 HB VAL 58 -3.791 -1.468 7.854 271 HG11 VAL 58 HG11 VAL 58 -3.678 0.789 6.094 272 HG12 VAL 58 HG12 VAL 58 -3.432 -0.697 5.174 273 HG13 VAL 58 HG13 VAL 58 -4.874 -0.505 6.172 274 HG21 VAL 58 HG21 VAL 58 -2.186 -2.142 5.791 275 HG22 VAL 58 HG22 VAL 58 -1.032 -1.310 6.833 276 HG23 VAL 58 HG23 VAL 58 -1.940 -2.692 7.448 277 H VAL 59 H VAL 59 -3.644 -0.341 10.371 278 HA VAL 59 HA VAL 59 -6.021 1.145 10.101 279 HB VAL 59 HB VAL 59 -4.679 0.130 12.610 280 HG11 VAL 59 HG11 VAL 59 -6.242 1.875 13.180 281 HG12 VAL 59 HG12 VAL 59 -7.483 1.145 12.159 282 HG13 VAL 59 HG13 VAL 59 -6.934 0.312 13.615 283 HG21 VAL 59 HG21 VAL 59 -5.533 -1.889 12.175 284 HG22 VAL 59 HG22 VAL 59 -7.084 -1.219 11.670 285 HG23 VAL 59 HG23 VAL 59 -5.748 -1.309 10.522 286 H ARG 60 H ARG 60 -3.110 1.794 12.055 287 HA ARG 60 HA ARG 60 -3.918 4.278 13.051 288 HB2 ARG 60 HB2 ARG 60 -1.107 3.327 12.468 289 HB3 ARG 60 HB3 ARG 60 -1.540 4.670 13.516 290 HG2 ARG 60 HG2 ARG 60 -2.620 1.939 14.059 291 HG3 ARG 60 HG3 ARG 60 -0.982 2.368 14.552 292 HD2 ARG 60 HD2 ARG 60 -3.161 4.260 15.237 293 HD3 ARG 60 HD3 ARG 60 -3.097 2.739 16.126 294 HE ARG 60 HE ARG 60 -0.553 3.650 16.270 295 HH11 ARG 60 HH11 ARG 60 -3.651 5.064 16.994 296 HH12 ARG 60 HH12 ARG 60 -3.036 6.089 18.248 297 HH21 ARG 60 HH21 ARG 60 0.268 4.994 17.919 298 HH22 ARG 60 HH22 ARG 60 -0.807 6.049 18.773 299 H TYR 61 H TYR 61 -2.658 3.362 9.954 300 HA TYR 61 HA TYR 61 -1.860 5.991 9.147 301 HB2 TYR 61 HB2 TYR 61 -0.795 4.139 8.071 302 HB3 TYR 61 HB3 TYR 61 -2.342 3.435 7.611 303 HD1 TYR 61 HD2 TYR 61 -0.008 6.224 6.947 304 HD2 TYR 61 HD1 TYR 61 -3.450 4.106 5.619 305 HE1 TYR 61 HE2 TYR 61 0.109 7.400 4.790 306 HE2 TYR 61 HE1 TYR 61 -3.343 5.275 3.457 307 HH TYR 61 HH TYR 61 -2.364 7.552 2.644 308 H CYS 62 H CYS 62 -4.595 3.884 8.256 309 HA CYS 62 HA CYS 62 -5.933 5.831 6.713 310 HB2 CYS 62 HB2 CYS 62 -6.738 3.229 7.967 311 HB3 CYS 62 HB3 CYS 62 -7.961 4.266 7.242 312 HG CYS 62 HG CYS 62 -5.244 3.006 5.584 313 H THR 63 H THR 63 -6.268 4.824 10.090 314 HA THR 63 HA THR 63 -8.503 6.336 10.774 315 HB THR 63 HB THR 63 -7.597 6.290 13.112 316 HG1 THR 63 HG1 THR 63 -5.374 6.351 12.644 317 HG21 THR 63 HG21 THR 63 -7.158 3.536 12.562 318 HG22 THR 63 HG22 THR 63 -8.393 4.125 11.449 319 HG23 THR 63 HG23 THR 63 -8.613 4.311 13.189 320 H ASP 64 H ASP 64 -5.209 7.303 10.252 321 HA ASP 64 HA ASP 64 -5.396 9.822 11.592 322 HB2 ASP 64 HB2 ASP 64 -3.423 8.548 9.731 323 HB3 ASP 64 HB3 ASP 64 -3.313 10.274 10.065 324 H LEU 65 H LEU 65 -5.863 8.702 8.288 325 HA LEU 65 HA LEU 65 -5.959 11.125 6.946 326 HB2 LEU 65 HB2 LEU 65 -6.928 8.411 6.503 327 HB3 LEU 65 HB3 LEU 65 -7.929 9.638 5.728 328 HG LEU 65 HG LEU 65 -6.137 10.382 4.378 329 HD11 LEU 65 HD11 LEU 65 -4.367 8.690 6.131 330 HD12 LEU 65 HD12 LEU 65 -4.350 10.445 5.960 331 HD13 LEU 65 HD13 LEU 65 -3.848 9.425 4.613 332 HD21 LEU 65 HD21 LEU 65 -6.246 8.646 2.990 333 HD22 LEU 65 HD22 LEU 65 -7.079 7.777 4.279 334 HD23 LEU 65 HD23 LEU 65 -5.332 7.616 4.093 335 H ILE 66 H ILE 66 -8.373 9.580 8.965 336 HA ILE 66 HA ILE 66 -10.580 11.177 8.250 337 HB ILE 66 HB ILE 66 -9.933 9.622 10.743 338 HG12 ILE 66 HG12 ILE 66 -12.326 9.024 9.136 339 HG13 ILE 66 HG13 ILE 66 -10.805 8.820 8.275 340 HG21 ILE 66 HG21 ILE 66 -11.286 11.213 11.703 341 HG22 ILE 66 HG22 ILE 66 -12.199 11.488 10.221 342 HG23 ILE 66 HG23 ILE 66 -12.479 10.030 11.171 343 HD11 ILE 66 HD11 ILE 66 -11.480 6.736 9.267 344 HD12 ILE 66 HD12 ILE 66 -10.026 7.329 10.070 345 HD13 ILE 66 HD13 ILE 66 -11.597 7.493 10.856 346 H GLU 67 H GLU 67 -8.215 11.496 10.887 347 HA GLU 67 HA GLU 67 -9.330 13.943 11.854 348 HB2 GLU 67 HB2 GLU 67 -6.568 12.825 12.358 349 HB3 GLU 67 HB3 GLU 67 -7.409 14.031 13.324 350 HG2 GLU 67 HG2 GLU 67 -8.390 11.215 12.943 351 HG3 GLU 67 HG3 GLU 67 -7.380 11.733 14.291 352 H GLU 68 H GLU 68 -6.808 13.078 9.586 353 HA GLU 68 HA GLU 68 -5.830 15.787 9.354 354 HB2 GLU 68 HB2 GLU 68 -5.227 13.306 7.734 355 HB3 GLU 68 HB3 GLU 68 -4.408 14.851 7.545 356 HG2 GLU 68 HG2 GLU 68 -4.433 13.750 10.273 357 HG3 GLU 68 HG3 GLU 68 -3.503 12.841 9.083 358 H LYS 69 H LYS 69 -8.472 14.128 8.181 359 HA LYS 69 HA LYS 69 -10.054 14.596 6.615 360 HB2 LYS 69 HB2 LYS 69 -8.615 17.223 6.218 361 HB3 LYS 69 HB3 LYS 69 -10.296 16.862 5.847 362 HG2 LYS 69 HG2 LYS 69 -9.177 16.761 8.635 363 HG3 LYS 69 HG3 LYS 69 -9.892 18.212 7.928 364 HD2 LYS 69 HD2 LYS 69 -11.563 15.849 7.603 365 HD3 LYS 69 HD3 LYS 69 -11.245 16.236 9.294 366 HE2 LYS 69 HE2 LYS 69 -11.804 18.691 8.364 367 HE3 LYS 69 HE3 LYS 69 -12.777 17.728 7.253 368 HZ1 LYS 69 HZ1 LYS 69 -14.299 17.643 8.843 369 HZ2 LYS 69 HZ2 LYS 69 -13.265 18.352 9.979 370 HZ3 LYS 69 HZ3 LYS 69 -13.250 16.676 9.752 371 H ASP 70 H ASP 70 -7.781 13.134 5.818 372 HA ASP 70 HA ASP 70 -7.373 14.048 3.049 373 HB2 ASP 70 HB2 ASP 70 -5.679 12.440 4.929 374 HB3 ASP 70 HB3 ASP 70 -5.483 12.241 3.190 375 H LEU 71 H LEU 71 -9.764 12.727 3.882 376 HA LEU 71 HA LEU 71 -9.855 9.991 3.484 377 HB2 LEU 71 HB2 LEU 71 -11.957 11.886 2.470 378 HB3 LEU 71 HB3 LEU 71 -12.171 10.232 3.041 379 HG LEU 71 HG LEU 71 -11.548 12.666 4.708 380 HD11 LEU 71 HD11 LEU 71 -13.878 10.892 5.165 381 HD12 LEU 71 HD12 LEU 71 -13.937 11.980 3.779 382 HD13 LEU 71 HD13 LEU 71 -13.711 12.632 5.403 383 HD21 LEU 71 HD21 LEU 71 -12.174 10.508 6.362 384 HD22 LEU 71 HD22 LEU 71 -10.607 11.294 6.179 385 HD23 LEU 71 HD23 LEU 71 -11.003 9.881 5.202 386 H GLU 72 H GLU 72 -9.344 12.523 1.187 387 HA GLU 72 HA GLU 72 -10.176 11.420 -1.193 388 HB2 GLU 72 HB2 GLU 72 -9.271 13.656 -1.099 389 HB3 GLU 72 HB3 GLU 72 -7.695 13.044 -0.621 390 HG2 GLU 72 HG2 GLU 72 -7.216 12.246 -2.740 391 HG3 GLU 72 HG3 GLU 72 -8.912 12.209 -3.218 392 H LYS 73 H LYS 73 -7.076 10.893 0.462 393 HA LYS 73 HA LYS 73 -6.196 8.967 -1.485 394 HB2 LYS 73 HB2 LYS 73 -5.053 9.542 1.254 395 HB3 LYS 73 HB3 LYS 73 -4.250 8.700 -0.063 396 HG2 LYS 73 HG2 LYS 73 -3.570 10.600 -0.995 397 HG3 LYS 73 HG3 LYS 73 -5.167 11.338 -0.844 398 HD2 LYS 73 HD2 LYS 73 -4.171 12.688 0.650 399 HD3 LYS 73 HD3 LYS 73 -4.325 11.315 1.748 400 HE2 LYS 73 HE2 LYS 73 -2.087 10.585 1.216 401 HE3 LYS 73 HE3 LYS 73 -1.931 11.845 -0.010 402 HZ1 LYS 73 HZ1 LYS 73 -1.235 12.025 2.646 403 HZ2 LYS 73 HZ2 LYS 73 -2.640 12.956 2.505 404 HZ3 LYS 73 HZ3 LYS 73 -1.302 13.292 1.527 405 H LEU 74 H LEU 74 -8.026 8.908 1.430 406 HA LEU 74 HA LEU 74 -7.541 6.320 2.351 407 HB2 LEU 74 HB2 LEU 74 -8.872 8.121 3.487 408 HB3 LEU 74 HB3 LEU 74 -10.202 7.730 2.398 409 HG LEU 74 HG LEU 74 -10.189 5.414 3.345 410 HD11 LEU 74 HD11 LEU 74 -9.035 4.988 5.413 411 HD12 LEU 74 HD12 LEU 74 -8.380 6.625 5.429 412 HD13 LEU 74 HD13 LEU 74 -7.865 5.483 4.188 413 HD21 LEU 74 HD21 LEU 74 -11.573 7.492 4.135 414 HD22 LEU 74 HD22 LEU 74 -10.597 7.329 5.595 415 HD23 LEU 74 HD23 LEU 74 -11.609 5.989 5.057 416 H ASP 75 H ASP 75 -10.299 7.375 0.346 417 HA ASP 75 HA ASP 75 -11.284 4.857 -0.265 418 HB2 ASP 75 HB2 ASP 75 -11.394 7.484 -1.726 419 HB3 ASP 75 HB3 ASP 75 -12.145 6.040 -2.400 420 H LEU 76 H LEU 76 -8.528 6.529 -1.545 421 HA LEU 76 HA LEU 76 -8.251 4.898 -3.887 422 HB2 LEU 76 HB2 LEU 76 -6.255 6.684 -2.506 423 HB3 LEU 76 HB3 LEU 76 -6.058 5.970 -4.105 424 HG LEU 76 HG LEU 76 -8.272 7.895 -3.427 425 HD11 LEU 76 HD11 LEU 76 -6.914 9.640 -3.650 426 HD12 LEU 76 HD12 LEU 76 -6.149 8.953 -5.082 427 HD13 LEU 76 HD13 LEU 76 -5.570 8.511 -3.476 428 HD21 LEU 76 HD21 LEU 76 -7.121 6.853 -6.009 429 HD22 LEU 76 HD22 LEU 76 -8.269 8.187 -5.902 430 HD23 LEU 76 HD23 LEU 76 -8.740 6.573 -5.367 431 H VAL 77 H VAL 77 -6.616 5.056 -0.736 432 HA VAL 77 HA VAL 77 -4.881 2.867 -1.226 433 HB VAL 77 HB VAL 77 -5.812 4.024 1.406 434 HG11 VAL 77 HG11 VAL 77 -4.189 1.717 0.784 435 HG12 VAL 77 HG12 VAL 77 -3.280 2.911 1.711 436 HG13 VAL 77 HG13 VAL 77 -4.800 2.276 2.340 437 HG21 VAL 77 HG21 VAL 77 -4.543 5.478 -0.314 438 HG22 VAL 77 HG22 VAL 77 -3.976 5.449 1.355 439 HG23 VAL 77 HG23 VAL 77 -3.145 4.497 0.126 440 H ILE 78 H ILE 78 -8.078 3.153 0.226 441 HA ILE 78 HA ILE 78 -8.249 0.524 1.240 442 HB ILE 78 HB ILE 78 -10.408 2.459 0.404 443 HG12 ILE 78 HG12 ILE 78 -9.042 3.156 2.323 444 HG13 ILE 78 HG13 ILE 78 -10.687 2.772 2.821 445 HG21 ILE 78 HG21 ILE 78 -11.739 0.652 0.367 446 HG22 ILE 78 HG22 ILE 78 -10.569 -0.352 1.221 447 HG23 ILE 78 HG23 ILE 78 -11.620 0.739 2.124 448 HD11 ILE 78 HD11 ILE 78 -9.303 0.388 3.106 449 HD12 ILE 78 HD12 ILE 78 -8.186 1.628 3.677 450 HD13 ILE 78 HD13 ILE 78 -9.794 1.493 4.390 451 H LYS 79 H LYS 79 -9.693 1.922 -1.710 452 HA LYS 79 HA LYS 79 -10.617 -0.513 -2.760 453 HB2 LYS 79 HB2 LYS 79 -11.060 0.669 -4.760 454 HB3 LYS 79 HB3 LYS 79 -11.275 1.840 -3.466 455 HG2 LYS 79 HG2 LYS 79 -10.029 3.122 -4.838 456 HG3 LYS 79 HG3 LYS 79 -8.700 2.292 -4.023 457 HD2 LYS 79 HD2 LYS 79 -8.060 1.892 -6.163 458 HD3 LYS 79 HD3 LYS 79 -9.165 0.529 -5.979 459 HE2 LYS 79 HE2 LYS 79 -10.967 2.141 -6.854 460 HE3 LYS 79 HE3 LYS 79 -9.616 3.144 -7.379 461 HZ1 LYS 79 HZ1 LYS 79 -10.375 0.446 -8.299 462 HZ2 LYS 79 HZ2 LYS 79 -8.794 1.011 -8.499 463 HZ3 LYS 79 HZ3 LYS 79 -10.083 1.837 -9.217 464 H TYR 80 H TYR 80 -7.501 1.051 -2.891 465 HA TYR 80 HA TYR 80 -6.422 -0.459 -5.036 466 HB2 TYR 80 HB2 TYR 80 -5.415 1.649 -4.331 467 HB3 TYR 80 HB3 TYR 80 -5.034 0.964 -2.754 468 HD1 TYR 80 HD1 TYR 80 -3.234 -0.682 -2.517 469 HD2 TYR 80 HD2 TYR 80 -4.084 1.128 -6.272 470 HE1 TYR 80 HE1 TYR 80 -1.057 -1.443 -3.370 471 HE2 TYR 80 HE2 TYR 80 -1.909 0.370 -7.137 472 HH TYR 80 HH TYR 80 -0.072 -0.806 -6.722 473 H MET 81 H MET 81 -5.909 -0.724 -1.513 474 HA MET 81 HA MET 81 -4.446 -3.120 -1.620 475 HB2 MET 81 HB2 MET 81 -4.749 -3.245 0.752 476 HB3 MET 81 HB3 MET 81 -4.553 -1.549 0.329 477 HG2 MET 81 HG2 MET 81 -6.901 -1.155 0.557 478 HG3 MET 81 HG3 MET 81 -7.215 -2.877 0.771 479 HE1 MET 81 HE1 MET 81 -5.588 0.095 3.835 480 HE2 MET 81 HE2 MET 81 -5.292 0.164 2.098 481 HE3 MET 81 HE3 MET 81 -6.923 0.406 2.727 482 H LYS 82 H LYS 82 -7.854 -2.473 -1.715 483 HA LYS 82 HA LYS 82 -8.860 -4.955 -0.901 484 HB2 LYS 82 HB2 LYS 82 -9.873 -2.568 -2.134 485 HB3 LYS 82 HB3 LYS 82 -10.532 -3.973 -2.960 486 HG2 LYS 82 HG2 LYS 82 -10.595 -4.197 -0.051 487 HG3 LYS 82 HG3 LYS 82 -11.540 -2.846 -0.686 488 HD2 LYS 82 HD2 LYS 82 -11.898 -5.309 -2.206 489 HD3 LYS 82 HD3 LYS 82 -12.375 -5.466 -0.514 490 HE2 LYS 82 HE2 LYS 82 -13.777 -3.446 -0.762 491 HE3 LYS 82 HE3 LYS 82 -13.345 -3.382 -2.470 492 HZ1 LYS 82 HZ1 LYS 82 -14.716 -5.073 -2.970 493 HZ2 LYS 82 HZ2 LYS 82 -15.507 -4.621 -1.545 494 HZ3 LYS 82 HZ3 LYS 82 -14.415 -5.912 -1.532 495 H ARG 83 H ARG 83 -8.321 -3.775 -4.226 496 HA ARG 83 HA ARG 83 -8.908 -6.133 -5.562 497 HB2 ARG 83 HB2 ARG 83 -8.025 -5.142 -7.449 498 HB3 ARG 83 HB3 ARG 83 -8.336 -3.734 -6.443 499 HG2 ARG 83 HG2 ARG 83 -5.858 -4.143 -5.671 500 HG3 ARG 83 HG3 ARG 83 -5.752 -4.978 -7.221 501 HD2 ARG 83 HD2 ARG 83 -6.955 -2.247 -7.080 502 HD3 ARG 83 HD3 ARG 83 -5.202 -2.432 -7.061 503 HE ARG 83 HE ARG 83 -6.939 -2.757 -9.305 504 HH11 ARG 83 HH11 ARG 83 -3.940 -3.814 -7.889 505 HH12 ARG 83 HH12 ARG 83 -3.226 -4.251 -9.406 506 HH21 ARG 83 HH21 ARG 83 -6.012 -3.331 -11.309 507 HH22 ARG 83 HH22 ARG 83 -4.406 -3.975 -11.351 508 H LEU 84 H LEU 84 -6.094 -5.258 -3.739 509 HA LEU 84 HA LEU 84 -4.424 -7.340 -4.826 510 HB2 LEU 84 HB2 LEU 84 -4.082 -5.594 -2.393 511 HB3 LEU 84 HB3 LEU 84 -2.859 -6.687 -3.037 512 HG LEU 84 HG LEU 84 -3.985 -4.358 -4.582 513 HD11 LEU 84 HD11 LEU 84 -2.924 -3.216 -2.904 514 HD12 LEU 84 HD12 LEU 84 -1.582 -3.474 -4.018 515 HD13 LEU 84 HD13 LEU 84 -1.764 -4.511 -2.604 516 HD21 LEU 84 HD21 LEU 84 -2.428 -6.567 -5.332 517 HD22 LEU 84 HD22 LEU 84 -1.324 -5.194 -5.256 518 HD23 LEU 84 HD23 LEU 84 -2.762 -5.114 -6.274 519 H MET 85 H MET 85 -5.919 -6.741 -1.643 520 HA MET 85 HA MET 85 -5.256 -9.233 -0.531 521 HB2 MET 85 HB2 MET 85 -7.533 -7.356 0.123 522 HB3 MET 85 HB3 MET 85 -7.063 -8.732 1.112 523 HG2 MET 85 HG2 MET 85 -4.722 -7.579 1.083 524 HG3 MET 85 HG3 MET 85 -5.659 -6.145 0.673 525 HE1 MET 85 HE1 MET 85 -4.660 -5.053 2.402 526 HE2 MET 85 HE2 MET 85 -5.612 -4.762 3.857 527 HE3 MET 85 HE3 MET 85 -4.219 -5.842 3.916 528 H GLN 86 H GLN 86 -7.835 -8.240 -2.643 529 HA GLN 86 HA GLN 86 -9.444 -10.584 -2.207 530 HB2 GLN 86 HB2 GLN 86 -9.545 -8.420 -4.311 531 HB3 GLN 86 HB3 GLN 86 -10.707 -9.736 -4.205 532 HG2 GLN 86 HG2 GLN 86 -10.529 -8.539 -1.647 533 HG3 GLN 86 HG3 GLN 86 -10.700 -7.251 -2.838 534 HE21 GLN 86 HE21 GLN 86 -12.571 -8.229 -0.807 535 HE22 GLN 86 HE22 GLN 86 -14.006 -8.670 -1.662 536 H GLN 87 H GLN 87 -7.337 -9.417 -4.822 537 HA GLN 87 HA GLN 87 -7.629 -11.744 -6.423 538 HB2 GLN 87 HB2 GLN 87 -5.983 -10.809 -7.833 539 HB3 GLN 87 HB3 GLN 87 -6.863 -9.435 -7.177 540 HG2 GLN 87 HG2 GLN 87 -5.079 -9.098 -5.528 541 HG3 GLN 87 HG3 GLN 87 -4.191 -10.447 -6.234 542 HE21 GLN 87 HE21 GLN 87 -5.960 -7.692 -7.604 543 HE22 GLN 87 HE22 GLN 87 -4.652 -7.116 -8.574 544 H SER 88 H SER 88 -5.762 -11.022 -3.646 545 HA SER 88 HA SER 88 -3.492 -12.562 -3.938 546 HB2 SER 88 HB2 SER 88 -5.199 -11.969 -1.526 547 HB3 SER 88 HB3 SER 88 -3.723 -12.926 -1.401 548 HG SER 88 HG SER 88 -2.779 -11.015 -2.601 549 H VAL 89 H VAL 89 -2.951 -14.703 -3.295 550 HA VAL 89 HA VAL 89 -4.926 -16.640 -4.062 551 HB VAL 89 HB VAL 89 -2.666 -17.044 -4.748 552 HG11 VAL 89 HG11 VAL 89 -0.914 -16.509 -3.494 553 HG12 VAL 89 HG12 VAL 89 -2.012 -16.054 -2.189 554 HG13 VAL 89 HG13 VAL 89 -1.383 -17.700 -2.280 555 HG21 VAL 89 HG21 VAL 89 -3.402 -18.985 -2.558 556 HG22 VAL 89 HG22 VAL 89 -4.025 -19.013 -4.208 557 HG23 VAL 89 HG23 VAL 89 -2.312 -19.304 -3.908 558 H GLU 90 H GLU 90 -3.495 -15.533 -1.062 559 HA GLU 90 HA GLU 90 -4.696 -17.662 0.490 560 HB2 GLU 90 HB2 GLU 90 -3.191 -15.180 1.334 561 HB3 GLU 90 HB3 GLU 90 -3.744 -16.435 2.433 562 HG2 GLU 90 HG2 GLU 90 -1.580 -17.075 2.124 563 HG3 GLU 90 HG3 GLU 90 -2.369 -18.000 0.847 564 H SER 91 H SER 91 -6.625 -17.606 1.445 565 HA SER 91 HA SER 91 -8.409 -15.435 0.976 566 HB2 SER 91 HB2 SER 91 -10.073 -16.820 1.785 567 HB3 SER 91 HB3 SER 91 -8.868 -18.016 1.310 568 HG SER 91 HG SER 91 -9.758 -17.300 3.819 569 H VAL 92 H VAL 92 -6.271 -16.298 3.545 570 HA VAL 92 HA VAL 92 -7.434 -15.062 5.739 571 HB VAL 92 HB VAL 92 -5.354 -16.440 5.797 572 HG11 VAL 92 HG11 VAL 92 -3.694 -14.049 5.253 573 HG12 VAL 92 HG12 VAL 92 -3.356 -15.756 4.966 574 HG13 VAL 92 HG13 VAL 92 -4.404 -14.868 3.861 575 HG21 VAL 92 HG21 VAL 92 -6.156 -14.837 7.626 576 HG22 VAL 92 HG22 VAL 92 -4.485 -15.396 7.705 577 HG23 VAL 92 HG23 VAL 92 -4.847 -13.780 7.095 578 H TRP 93 H TRP 93 -5.932 -13.665 2.945 579 HA TRP 93 HA TRP 93 -5.344 -11.112 4.002 580 HB2 TRP 93 HB2 TRP 93 -5.682 -12.250 1.261 581 HB3 TRP 93 HB3 TRP 93 -5.680 -10.498 1.445 582 HD1 TRP 93 HD1 TRP 93 -3.374 -13.254 0.841 583 HE1 TRP 93 HE1 TRP 93 -0.940 -12.559 1.309 584 HE3 TRP 93 HE3 TRP 93 -4.248 -8.920 3.408 585 HZ2 TRP 93 HZ2 TRP 93 0.427 -10.452 2.597 586 HZ3 TRP 93 HZ3 TRP 93 -2.322 -7.624 4.225 587 HH2 TRP 93 HH2 TRP 93 -0.034 -8.376 3.826 588 H ASN 94 H ASN 94 -8.258 -12.540 2.681 589 HA ASN 94 HA ASN 94 -9.745 -10.202 2.259 590 HB2 ASN 94 HB2 ASN 94 -10.531 -13.044 2.876 591 HB3 ASN 94 HB3 ASN 94 -11.740 -11.782 2.661 592 HD21 ASN 94 HD21 ASN 94 -8.977 -13.319 1.095 593 HD22 ASN 94 HD22 ASN 94 -9.544 -13.097 -0.522 594 H MET 95 H MET 95 -9.168 -12.110 5.154 595 HA MET 95 HA MET 95 -11.099 -10.765 6.766 596 HB2 MET 95 HB2 MET 95 -8.664 -12.281 7.709 597 HB3 MET 95 HB3 MET 95 -10.131 -11.951 8.621 598 HG2 MET 95 HG2 MET 95 -11.267 -13.276 6.666 599 HG3 MET 95 HG3 MET 95 -9.644 -13.931 6.459 600 HE1 MET 95 HE1 MET 95 -9.244 -16.558 8.256 601 HE2 MET 95 HE2 MET 95 -8.384 -15.075 7.842 602 HE3 MET 95 HE3 MET 95 -8.655 -15.495 9.533 603 H ALA 96 H ALA 96 -7.635 -10.385 6.201 604 HA ALA 96 HA ALA 96 -6.998 -8.574 8.195 605 HB1 ALA 96 HB1 ALA 96 -5.161 -9.317 7.033 606 HB2 ALA 96 HB2 ALA 96 -5.922 -9.081 5.459 607 HB3 ALA 96 HB3 ALA 96 -5.341 -7.690 6.375 608 H PHE 97 H PHE 97 -8.362 -7.950 4.980 609 HA PHE 97 HA PHE 97 -8.305 -5.169 5.027 610 HB2 PHE 97 HB2 PHE 97 -8.865 -6.505 3.028 611 HB3 PHE 97 HB3 PHE 97 -10.403 -6.945 3.763 612 HD1 PHE 97 HD2 PHE 97 -8.539 -3.735 3.358 613 HD2 PHE 97 HD1 PHE 97 -12.153 -5.896 2.728 614 HE1 PHE 97 HE2 PHE 97 -9.571 -1.722 2.390 615 HE2 PHE 97 HE1 PHE 97 -13.189 -3.886 1.759 616 HZ PHE 97 HZ PHE 97 -11.898 -1.795 1.588 617 H ASP 98 H ASP 98 -10.894 -7.366 6.087 618 HA ASP 98 HA ASP 98 -12.672 -5.363 6.947 619 HB2 ASP 98 HB2 ASP 98 -12.478 -8.263 7.115 620 HB3 ASP 98 HB3 ASP 98 -13.179 -7.563 8.571 621 H PHE 99 H PHE 99 -10.017 -7.013 8.552 622 HA PHE 99 HA PHE 99 -10.544 -6.211 11.184 623 HB2 PHE 99 HB2 PHE 99 -8.918 -7.891 10.930 624 HB3 PHE 99 HB3 PHE 99 -8.022 -6.965 9.729 625 HD1 PHE 99 HD2 PHE 99 -8.674 -7.439 13.294 626 HD2 PHE 99 HD1 PHE 99 -6.485 -5.225 10.391 627 HE1 PHE 99 HE2 PHE 99 -7.184 -6.600 15.063 628 HE2 PHE 99 HE1 PHE 99 -4.991 -4.383 12.155 629 HZ PHE 99 HZ PHE 99 -5.339 -5.070 14.494 630 H ILE 100 H ILE 100 -8.646 -4.654 8.627 631 HA ILE 100 HA ILE 100 -7.805 -2.455 10.211 632 HB ILE 100 HB ILE 100 -8.035 -2.662 7.207 633 HG12 ILE 100 HG12 ILE 100 -5.461 -2.830 8.719 634 HG13 ILE 100 HG13 ILE 100 -6.498 -4.252 8.654 635 HG21 ILE 100 HG21 ILE 100 -5.987 -0.894 7.953 636 HG22 ILE 100 HG22 ILE 100 -7.510 -0.508 7.155 637 HG23 ILE 100 HG23 ILE 100 -7.399 -0.452 8.914 638 HD11 ILE 100 HD11 ILE 100 -5.781 -2.830 6.135 639 HD12 ILE 100 HD12 ILE 100 -4.628 -3.930 6.893 640 HD13 ILE 100 HD13 ILE 100 -6.211 -4.521 6.389 641 H LEU 101 H LEU 101 -10.554 -3.007 8.073 642 HA LEU 101 HA LEU 101 -11.503 -0.326 8.124 643 HB2 LEU 101 HB2 LEU 101 -12.664 -2.963 7.328 644 HB3 LEU 101 HB3 LEU 101 -13.698 -1.540 7.435 645 HG LEU 101 HG LEU 101 -11.222 -1.587 5.731 646 HD11 LEU 101 HD11 LEU 101 -13.887 -2.781 5.224 647 HD12 LEU 101 HD12 LEU 101 -12.298 -3.263 4.635 648 HD13 LEU 101 HD13 LEU 101 -13.126 -1.887 3.908 649 HD21 LEU 101 HD21 LEU 101 -12.179 0.286 4.659 650 HD22 LEU 101 HD22 LEU 101 -12.365 0.571 6.390 651 HD23 LEU 101 HD23 LEU 101 -13.743 0.026 5.432 652 H ASP 102 H ASP 102 -12.039 -3.157 10.119 653 HA ASP 102 HA ASP 102 -14.309 -2.303 11.517 654 HB2 ASP 102 HB2 ASP 102 -12.963 -4.585 11.528 655 HB3 ASP 102 HB3 ASP 102 -12.193 -3.862 12.938 656 H ASN 103 H ASN 103 -10.989 -1.346 11.751 657 HA ASN 103 HA ASN 103 -11.467 0.053 14.276 658 HB2 ASN 103 HB2 ASN 103 -8.968 -0.562 12.705 659 HB3 ASN 103 HB3 ASN 103 -8.968 0.569 14.054 660 HD21 ASN 103 HD21 ASN 103 -9.425 -2.755 13.100 661 HD22 ASN 103 HD22 ASN 103 -9.230 -3.438 14.675 662 H VAL 104 H VAL 104 -10.548 0.660 10.917 663 HA VAL 104 HA VAL 104 -10.277 3.479 11.220 664 HB VAL 104 HB VAL 104 -10.698 1.798 8.747 665 HG11 VAL 104 HG11 VAL 104 -11.467 4.038 8.299 666 HG12 VAL 104 HG12 VAL 104 -10.002 4.721 9.008 667 HG13 VAL 104 HG13 VAL 104 -9.909 3.793 7.511 668 HG21 VAL 104 HG21 VAL 104 -8.592 1.479 10.101 669 HG22 VAL 104 HG22 VAL 104 -8.354 1.949 8.417 670 HG23 VAL 104 HG23 VAL 104 -8.181 3.146 9.701 671 H GLN 105 H GLN 105 -12.774 1.529 9.574 672 HA GLN 105 HA GLN 105 -14.558 3.522 8.961 673 HB2 GLN 105 HB2 GLN 105 -15.259 0.737 9.908 674 HB3 GLN 105 HB3 GLN 105 -16.306 1.805 8.982 675 HG2 GLN 105 HG2 GLN 105 -13.633 0.986 7.921 676 HG3 GLN 105 HG3 GLN 105 -15.038 -0.067 7.761 677 HE21 GLN 105 HE21 GLN 105 -13.649 3.013 6.884 678 HE22 GLN 105 HE22 GLN 105 -14.690 3.321 5.540 679 H VAL 106 H VAL 106 -13.901 2.090 12.067 680 HA VAL 106 HA VAL 106 -16.239 3.044 13.388 681 HB VAL 106 HB VAL 106 -13.605 1.970 14.337 682 HG11 VAL 106 HG11 VAL 106 -13.921 3.553 16.008 683 HG12 VAL 106 HG12 VAL 106 -15.678 3.404 15.955 684 HG13 VAL 106 HG13 VAL 106 -14.704 2.118 16.668 685 HG21 VAL 106 HG21 VAL 106 -14.885 0.144 15.120 686 HG22 VAL 106 HG22 VAL 106 -16.400 1.031 14.939 687 HG23 VAL 106 HG23 VAL 106 -15.504 0.515 13.510 688 H VAL 107 H VAL 107 -12.842 4.132 13.484 689 HA VAL 107 HA VAL 107 -13.367 6.468 14.985 690 HB VAL 107 HB VAL 107 -11.130 5.570 14.918 691 HG11 VAL 107 HG11 VAL 107 -11.443 5.927 11.971 692 HG12 VAL 107 HG12 VAL 107 -9.834 6.011 12.692 693 HG13 VAL 107 HG13 VAL 107 -10.811 4.553 12.876 694 HG21 VAL 107 HG21 VAL 107 -9.859 7.605 14.386 695 HG22 VAL 107 HG22 VAL 107 -11.269 8.259 13.554 696 HG23 VAL 107 HG23 VAL 107 -11.328 7.964 15.292 697 H LEU 108 H LEU 108 -13.619 5.732 11.612 698 HA LEU 108 HA LEU 108 -13.548 8.431 10.673 699 HB2 LEU 108 HB2 LEU 108 -13.382 7.414 8.715 700 HB3 LEU 108 HB3 LEU 108 -13.571 5.866 9.534 701 HG LEU 108 HG LEU 108 -16.079 6.202 9.257 702 HD11 LEU 108 HD11 LEU 108 -16.120 7.712 6.942 703 HD12 LEU 108 HD12 LEU 108 -15.082 8.632 8.032 704 HD13 LEU 108 HD13 LEU 108 -16.719 8.203 8.527 705 HD21 LEU 108 HD21 LEU 108 -14.141 5.085 7.608 706 HD22 LEU 108 HD22 LEU 108 -15.177 6.007 6.518 707 HD23 LEU 108 HD23 LEU 108 -15.876 4.772 7.566 708 H GLN 109 H GLN 109 -16.087 6.165 11.592 709 HA GLN 109 HA GLN 109 -18.269 7.748 10.731 710 HB2 GLN 109 HB2 GLN 109 -17.956 5.443 12.621 711 HB3 GLN 109 HB3 GLN 109 -19.486 6.308 12.546 712 HG2 GLN 109 HG2 GLN 109 -19.759 5.766 10.237 713 HG3 GLN 109 HG3 GLN 109 -18.135 5.088 10.154 714 HE21 GLN 109 HE21 GLN 109 -17.734 3.251 11.685 715 HE22 GLN 109 HE22 GLN 109 -19.001 2.093 11.871 716 H GLN 110 H GLN 110 -16.555 7.481 13.811 717 HA GLN 110 HA GLN 110 -18.267 9.130 15.317 718 HB2 GLN 110 HB2 GLN 110 -15.337 8.479 15.625 719 HB3 GLN 110 HB3 GLN 110 -16.242 9.424 16.801 720 HG2 GLN 110 HG2 GLN 110 -17.821 7.461 16.968 721 HG3 GLN 110 HG3 GLN 110 -16.632 6.547 16.042 722 HE21 GLN 110 HE21 GLN 110 -14.857 5.771 17.042 723 HE22 GLN 110 HE22 GLN 110 -14.516 5.977 18.722 724 H THR 111 H THR 111 -16.104 9.868 12.811 725 HA THR 111 HA THR 111 -15.758 12.643 13.665 726 HB THR 111 HB THR 111 -14.604 11.125 11.319 727 HG1 THR 111 HG1 THR 111 -13.439 12.179 13.700 728 HG21 THR 111 HG21 THR 111 -14.931 13.433 10.662 729 HG22 THR 111 HG22 THR 111 -13.217 13.146 10.959 730 HG23 THR 111 HG23 THR 111 -14.190 13.996 12.159 731 H TYR 112 H TYR 112 -16.723 10.973 10.658 732 HA TYR 112 HA TYR 112 -18.372 13.304 9.979 733 HB2 TYR 112 HB2 TYR 112 -17.709 11.013 8.137 734 HB3 TYR 112 HB3 TYR 112 -18.239 12.636 7.711 735 HD1 TYR 112 HD2 TYR 112 -16.672 14.513 7.768 736 HD2 TYR 112 HD1 TYR 112 -15.398 10.554 8.670 737 HE1 TYR 112 HE2 TYR 112 -14.328 15.213 7.505 738 HE2 TYR 112 HE1 TYR 112 -13.052 11.243 8.410 739 HH TYR 112 HH TYR 112 -11.660 12.984 8.161 740 H GLY 113 H GLY 113 -18.492 9.770 10.230 741 HA2 GLY 113 HA2 GLY 113 -20.457 8.774 11.270 742 HA3 GLY 113 HA3 GLY 113 -21.427 9.995 10.460 743 H SER 114 H SER 114 -19.472 9.418 8.083 744 HA SER 114 HA SER 114 -21.192 7.365 6.926 745 HB2 SER 114 HB2 SER 114 -20.241 8.052 4.776 746 HB3 SER 114 HB3 SER 114 -20.826 9.458 5.667 747 HG SER 114 HG SER 114 -18.249 8.749 4.961 748 H THR 115 H THR 115 -19.803 6.074 5.123 749 HA THR 115 HA THR 115 -17.272 5.134 6.183 750 HB THR 115 HB THR 115 -17.959 2.777 6.284 751 HG1 THR 115 HG1 THR 115 -20.610 3.782 5.976 752 HG21 THR 115 HG21 THR 115 -18.070 4.355 8.288 753 HG22 THR 115 HG22 THR 115 -18.983 2.851 8.406 754 HG23 THR 115 HG23 THR 115 -19.816 4.361 8.042 755 H LEU 116 H LEU 116 -16.419 3.292 4.758 756 HA LEU 116 HA LEU 116 -16.742 4.128 1.998 757 HB2 LEU 116 HB2 LEU 116 -14.600 3.278 3.495 758 HB3 LEU 116 HB3 LEU 116 -14.974 1.863 2.514 759 HG LEU 116 HG LEU 116 -14.909 4.262 0.902 760 HD11 LEU 116 HD11 LEU 116 -12.186 3.626 1.834 761 HD12 LEU 116 HD12 LEU 116 -13.190 4.555 2.948 762 HD13 LEU 116 HD13 LEU 116 -12.885 5.162 1.320 763 HD21 LEU 116 HD21 LEU 116 -14.210 2.759 -0.578 764 HD22 LEU 116 HD22 LEU 116 -14.376 1.535 0.681 765 HD23 LEU 116 HD23 LEU 116 -12.823 2.330 0.422 766 H LYS 117 H LYS 117 -17.459 2.858 0.323 767 HA LYS 117 HA LYS 117 -19.188 0.653 1.075 768 HB2 LYS 117 HB2 LYS 117 -20.166 2.180 -0.455 769 HB3 LYS 117 HB3 LYS 117 -18.745 2.166 -1.492 770 HG2 LYS 117 HG2 LYS 117 -20.499 0.919 -2.545 771 HG3 LYS 117 HG3 LYS 117 -19.223 -0.195 -2.048 772 HD2 LYS 117 HD2 LYS 117 -21.458 0.298 -0.152 773 HD3 LYS 117 HD3 LYS 117 -21.786 -0.692 -1.575 774 HE2 LYS 117 HE2 LYS 117 -19.583 -1.911 -0.856 775 HE3 LYS 117 HE3 LYS 117 -19.945 -1.204 0.719 776 HZ1 LYS 117 HZ1 LYS 117 -21.879 -2.421 0.915 777 HZ2 LYS 117 HZ2 LYS 117 -20.854 -3.528 0.150 778 HZ3 LYS 117 HZ3 LYS 117 -22.019 -2.696 -0.749 779 H VAL 118 H VAL 118 -17.967 -1.127 1.508 780 HA VAL 118 HA VAL 118 -16.231 -2.101 -0.668 781 HB VAL 118 HB VAL 118 -15.126 -3.479 1.180 782 HG11 VAL 118 HG11 VAL 118 -14.081 -1.098 2.039 783 HG12 VAL 118 HG12 VAL 118 -13.605 -1.953 0.571 784 HG13 VAL 118 HG13 VAL 118 -14.802 -0.659 0.492 785 HG21 VAL 118 HG21 VAL 118 -15.817 -1.426 3.154 786 HG22 VAL 118 HG22 VAL 118 -17.145 -2.507 2.730 787 HG23 VAL 118 HG23 VAL 118 -15.632 -3.170 3.345 788 H THR 119 H THR 119 -17.927 -3.210 -1.695 789 HA THR 119 HA THR 119 -19.382 -5.243 -0.216 790 HB THR 119 HB THR 119 -20.528 -3.881 -1.953 791 HG1 THR 119 HG1 THR 119 -21.366 -5.860 -3.092 792 HG21 THR 119 HG21 THR 119 -19.392 -5.480 -4.151 793 HG22 THR 119 HG22 THR 119 -18.316 -4.259 -3.470 794 HG23 THR 119 HG23 THR 119 -19.887 -3.789 -4.117 795 H LYS 207 H LYS 207 8.217 -6.018 16.062 796 HA LYS 207 HA LYS 207 9.542 -7.665 14.025 797 HB2 LYS 207 HB2 LYS 207 7.724 -8.249 16.313 798 HB3 LYS 207 HB3 LYS 207 7.638 -9.303 14.908 799 HG2 LYS 207 HG2 LYS 207 9.165 -10.372 16.275 800 HG3 LYS 207 HG3 LYS 207 10.197 -9.477 15.156 801 HD2 LYS 207 HD2 LYS 207 11.193 -8.916 17.136 802 HD3 LYS 207 HD3 LYS 207 10.004 -7.617 17.025 803 HE2 LYS 207 HE2 LYS 207 8.492 -9.354 18.306 804 HE3 LYS 207 HE3 LYS 207 10.052 -10.012 18.796 805 HZ1 LYS 207 HZ1 LYS 207 9.397 -8.457 20.433 806 HZ2 LYS 207 HZ2 LYS 207 9.017 -7.277 19.282 807 HZ3 LYS 207 HZ3 LYS 207 10.630 -7.715 19.543 808 H SER 208 H SER 208 8.853 -6.661 12.150 809 HA SER 208 HA SER 208 6.410 -7.475 11.063 810 HB2 SER 208 HB2 SER 208 4.932 -5.810 11.434 811 HB3 SER 208 HB3 SER 208 5.993 -5.350 12.765 812 HG SER 208 HG SER 208 5.773 -3.539 11.555 813 H PHE 209 H PHE 209 6.258 -7.025 8.866 814 HA PHE 209 HA PHE 209 8.669 -6.501 7.523 815 HB2 PHE 209 HB2 PHE 209 7.014 -7.851 6.443 816 HB3 PHE 209 HB3 PHE 209 5.811 -6.571 6.552 817 HD1 PHE 209 HD2 PHE 209 8.877 -7.672 4.847 818 HD2 PHE 209 HD1 PHE 209 5.722 -4.817 4.949 819 HE1 PHE 209 HE2 PHE 209 9.527 -6.879 2.610 820 HE2 PHE 209 HE1 PHE 209 6.366 -4.019 2.712 821 HZ PHE 209 HZ PHE 209 8.273 -5.050 1.541 822 H PHE 210 H PHE 210 5.924 -4.447 8.307 823 HA PHE 210 HA PHE 210 6.694 -2.236 6.711 824 HB2 PHE 210 HB2 PHE 210 4.854 -2.570 9.065 825 HB3 PHE 210 HB3 PHE 210 5.189 -0.974 8.402 826 HD1 PHE 210 HD1 PHE 210 5.189 -1.264 5.586 827 HD2 PHE 210 HD2 PHE 210 2.762 -3.269 8.450 828 HE1 PHE 210 HE1 PHE 210 3.458 -1.613 3.871 829 HE2 PHE 210 HE2 PHE 210 1.029 -3.621 6.740 830 HZ PHE 210 HZ PHE 210 1.376 -2.794 4.447 831 H ASP 211 H ASP 211 7.694 -3.396 9.814 832 HA ASP 211 HA ASP 211 8.833 -0.928 10.723 833 HB2 ASP 211 HB2 ASP 211 8.151 -2.575 12.357 834 HB3 ASP 211 HB3 ASP 211 9.218 -3.782 11.646 835 H LYS 212 H LYS 212 10.078 -3.862 9.184 836 HA LYS 212 HA LYS 212 12.799 -2.944 9.201 837 HB2 LYS 212 HB2 LYS 212 13.183 -4.924 7.715 838 HB3 LYS 212 HB3 LYS 212 12.427 -5.311 9.254 839 HG2 LYS 212 HG2 LYS 212 10.309 -5.615 8.241 840 HG3 LYS 212 HG3 LYS 212 10.865 -4.922 6.716 841 HD2 LYS 212 HD2 LYS 212 10.810 -7.277 6.418 842 HD3 LYS 212 HD3 LYS 212 12.510 -6.825 6.578 843 HE2 LYS 212 HE2 LYS 212 12.080 -7.330 9.115 844 HE3 LYS 212 HE3 LYS 212 10.739 -8.286 8.486 845 HZ1 LYS 212 HZ1 LYS 212 13.600 -8.755 8.299 846 HZ2 LYS 212 HZ2 LYS 212 12.705 -9.117 6.910 847 HZ3 LYS 212 HZ3 LYS 212 12.323 -9.863 8.380 848 H LYS 213 H LYS 213 10.075 -2.638 7.093 849 HA LYS 213 HA LYS 213 11.588 -1.955 4.748 850 HB2 LYS 213 HB2 LYS 213 9.451 -2.898 4.352 851 HB3 LYS 213 HB3 LYS 213 8.668 -1.783 5.465 852 HG2 LYS 213 HG2 LYS 213 8.151 -1.178 3.191 853 HG3 LYS 213 HG3 LYS 213 9.160 0.070 3.926 854 HD2 LYS 213 HD2 LYS 213 10.155 -0.195 1.856 855 HD3 LYS 213 HD3 LYS 213 11.122 -1.273 2.865 856 HE2 LYS 213 HE2 LYS 213 8.727 -2.455 1.602 857 HE3 LYS 213 HE3 LYS 213 10.041 -2.005 0.515 858 HZ1 LYS 213 HZ1 LYS 213 10.117 -3.916 2.775 859 HZ2 LYS 213 HZ2 LYS 213 11.526 -3.292 2.076 860 HZ3 LYS 213 HZ3 LYS 213 10.454 -4.210 1.143 861 H ARG 214 H ARG 214 10.047 -0.222 7.380 862 HA ARG 214 HA ARG 214 10.304 2.365 6.193 863 HB2 ARG 214 HB2 ARG 214 9.631 3.223 8.356 864 HB3 ARG 214 HB3 ARG 214 8.623 1.847 7.930 865 HG2 ARG 214 HG2 ARG 214 9.545 0.496 9.547 866 HG3 ARG 214 HG3 ARG 214 11.045 1.423 9.615 867 HD2 ARG 214 HD2 ARG 214 8.576 2.852 10.382 868 HD3 ARG 214 HD3 ARG 214 9.116 1.581 11.478 869 HE ARG 214 HE ARG 214 10.348 4.134 11.051 870 HH11 ARG 214 HH11 ARG 214 10.899 0.835 12.017 871 HH12 ARG 214 HH12 ARG 214 12.303 1.209 12.961 872 HH21 ARG 214 HH21 ARG 214 12.197 4.639 12.289 873 HH22 ARG 214 HH22 ARG 214 13.040 3.372 13.115 874 H SER 215 H SER 215 12.376 0.285 8.013 875 HA SER 215 HA SER 215 14.180 2.346 8.884 876 HB2 SER 215 HB2 SER 215 14.317 0.530 10.303 877 HB3 SER 215 HB3 SER 215 14.127 -0.640 8.998 878 HG SER 215 HG SER 215 16.220 -0.814 9.272 879 H GLU 216 H GLU 216 14.311 -0.222 6.421 880 HA GLU 216 HA GLU 216 16.814 0.319 5.372 881 HB2 GLU 216 HB2 GLU 216 15.887 -0.645 3.228 882 HB3 GLU 216 HB3 GLU 216 15.691 -1.647 4.658 883 HG2 GLU 216 HG2 GLU 216 13.374 -0.908 4.863 884 HG3 GLU 216 HG3 GLU 216 13.570 0.102 3.432 885 H ARG 217 H ARG 217 13.705 1.816 4.606 886 HA ARG 217 HA ARG 217 14.668 3.423 2.476 887 HB2 ARG 217 HB2 ARG 217 12.559 4.595 2.633 888 HB3 ARG 217 HB3 ARG 217 12.277 2.869 2.817 889 HG2 ARG 217 HG2 ARG 217 11.884 3.072 5.126 890 HG3 ARG 217 HG3 ARG 217 12.555 4.703 5.176 891 HD2 ARG 217 HD2 ARG 217 10.010 3.856 3.796 892 HD3 ARG 217 HD3 ARG 217 10.126 4.767 5.301 893 HE ARG 217 HE ARG 217 10.356 5.797 2.651 894 HH11 ARG 217 HH11 ARG 217 11.435 6.227 5.932 895 HH12 ARG 217 HH12 ARG 217 11.753 7.920 5.744 896 HH21 ARG 217 HH21 ARG 217 10.772 8.025 2.389 897 HH22 ARG 217 HH22 ARG 217 11.375 8.941 3.728 898 H ILE 218 H ILE 218 14.676 3.757 5.930 899 HA ILE 218 HA ILE 218 15.213 6.589 5.909 900 HB ILE 218 HB ILE 218 15.253 4.518 8.095 901 HG12 ILE 218 HG12 ILE 218 13.540 6.986 7.874 902 HG13 ILE 218 HG13 ILE 218 13.086 5.476 7.092 903 HG21 ILE 218 HG21 ILE 218 16.096 7.397 8.177 904 HG22 ILE 218 HG22 ILE 218 15.502 6.561 9.612 905 HG23 ILE 218 HG23 ILE 218 16.947 5.978 8.786 906 HD11 ILE 218 HD11 ILE 218 13.697 4.772 9.711 907 HD12 ILE 218 HD12 ILE 218 12.794 6.282 9.833 908 HD13 ILE 218 HD13 ILE 218 12.096 4.905 8.983 909 H SER 219 H SER 219 17.066 3.611 6.253 910 HA SER 219 HA SER 219 19.520 5.171 5.848 911 HB2 SER 219 HB2 SER 219 19.406 4.667 8.240 912 HB3 SER 219 HB3 SER 219 19.178 2.955 7.884 913 HG SER 219 HG SER 219 21.458 4.288 8.137 914 H ASN 220 H ASN 220 20.390 4.507 4.008 915 HA ASN 220 HA ASN 220 20.647 1.643 3.501 916 HB2 ASN 220 HB2 ASN 220 18.621 2.215 2.302 917 HB3 ASN 220 HB3 ASN 220 19.414 3.595 1.547 918 HD21 ASN 220 HD21 ASN 220 18.824 2.712 -0.481 919 HD22 ASN 220 HD22 ASN 220 19.731 1.417 -1.177 Start of MODEL 6 1 H ALA 23 H ALA 23 4.626 12.766 13.188 2 HA ALA 23 HA ALA 23 2.524 12.159 13.825 3 HB1 ALA 23 HB1 ALA 23 1.799 15.066 13.867 4 HB2 ALA 23 HB2 ALA 23 1.279 13.774 14.949 5 HB3 ALA 23 HB3 ALA 23 2.930 14.388 15.039 6 H ALA 24 H ALA 24 3.071 12.538 10.946 7 HA ALA 24 HA ALA 24 0.378 13.221 9.978 8 HB1 ALA 24 HB1 ALA 24 1.760 13.016 7.706 9 HB2 ALA 24 HB2 ALA 24 1.698 14.503 8.653 10 HB3 ALA 24 HB3 ALA 24 3.085 13.422 8.797 11 HA PRO 25 HA PRO 25 -0.556 9.082 8.860 12 HB2 PRO 25 HB2 PRO 25 -1.827 9.393 6.482 13 HB3 PRO 25 HB3 PRO 25 -2.551 9.858 8.026 14 HG2 PRO 25 HG2 PRO 25 -1.182 11.567 5.985 15 HG3 PRO 25 HG3 PRO 25 -2.669 11.887 6.895 16 HD2 PRO 25 HD2 PRO 25 -0.281 12.965 7.580 17 HD3 PRO 25 HD3 PRO 25 -1.522 12.550 8.781 18 H ASN 26 H ASN 26 1.733 8.521 8.580 19 HA ASN 26 HA ASN 26 2.436 8.142 5.743 20 HB2 ASN 26 HB2 ASN 26 4.491 8.152 7.931 21 HB3 ASN 26 HB3 ASN 26 4.699 8.484 6.214 22 HD21 ASN 26 HD21 ASN 26 2.724 10.326 5.773 23 HD22 ASN 26 HD22 ASN 26 3.065 11.766 6.662 24 H LEU 27 H LEU 27 2.895 6.125 5.054 25 HA LEU 27 HA LEU 27 2.588 3.956 6.998 26 HB2 LEU 27 HB2 LEU 27 1.316 4.268 4.699 27 HB3 LEU 27 HB3 LEU 27 2.752 3.462 4.070 28 HG LEU 27 HG LEU 27 2.283 1.597 5.697 29 HD11 LEU 27 HD11 LEU 27 0.239 1.442 6.811 30 HD12 LEU 27 HD12 LEU 27 -0.479 2.751 5.875 31 HD13 LEU 27 HD13 LEU 27 0.751 3.106 7.088 32 HD21 LEU 27 HD21 LEU 27 1.614 1.755 3.207 33 HD22 LEU 27 HD22 LEU 27 -0.024 1.969 3.824 34 HD23 LEU 27 HD23 LEU 27 0.879 0.503 4.209 35 H ALA 28 H ALA 28 4.517 3.495 7.892 36 HA ALA 28 HA ALA 28 6.671 2.790 8.105 37 HB1 ALA 28 HB1 ALA 28 7.563 1.499 6.054 38 HB2 ALA 28 HB2 ALA 28 6.178 0.850 6.932 39 HB3 ALA 28 HB3 ALA 28 5.933 1.710 5.413 40 H GLY 29 H GLY 29 6.245 5.496 7.286 41 HA2 GLY 29 HA2 GLY 29 7.897 7.160 6.975 42 HA3 GLY 29 HA3 GLY 29 8.872 5.993 6.093 43 H ALA 30 H ALA 30 5.990 5.473 4.803 44 HA ALA 30 HA ALA 30 6.544 7.189 2.524 45 HB1 ALA 30 HB1 ALA 30 6.089 4.861 2.074 46 HB2 ALA 30 HB2 ALA 30 4.532 4.975 2.897 47 HB3 ALA 30 HB3 ALA 30 4.801 5.856 1.395 48 H VAL 31 H VAL 31 5.738 9.182 2.550 49 HA VAL 31 HA VAL 31 3.233 9.731 3.945 50 HB VAL 31 HB VAL 31 5.078 11.701 2.591 51 HG11 VAL 31 HG11 VAL 31 2.607 11.910 4.207 52 HG12 VAL 31 HG12 VAL 31 3.874 13.097 4.522 53 HG13 VAL 31 HG13 VAL 31 3.200 12.935 2.900 54 HG21 VAL 31 HG21 VAL 31 5.311 11.938 5.368 55 HG22 VAL 31 HG22 VAL 31 5.423 10.210 5.031 56 HG23 VAL 31 HG23 VAL 31 6.527 11.337 4.241 57 H GLU 32 H GLU 32 4.627 9.837 0.710 58 HA GLU 32 HA GLU 32 2.346 11.039 -0.516 59 HB2 GLU 32 HB2 GLU 32 4.571 9.434 -1.788 60 HB3 GLU 32 HB3 GLU 32 3.435 10.478 -2.631 61 HG2 GLU 32 HG2 GLU 32 4.353 12.426 -1.619 62 HG3 GLU 32 HG3 GLU 32 5.342 11.460 -0.525 63 H PHE 33 H PHE 33 0.676 10.109 -1.636 64 HA PHE 33 HA PHE 33 -0.337 7.673 -0.783 65 HB2 PHE 33 HB2 PHE 33 -1.881 9.172 -1.736 66 HB3 PHE 33 HB3 PHE 33 -0.919 9.371 -3.197 67 HD1 PHE 33 HD1 PHE 33 -2.966 6.907 -1.325 68 HD2 PHE 33 HD2 PHE 33 -1.348 8.079 -5.084 69 HE1 PHE 33 HE1 PHE 33 -4.311 5.175 -2.440 70 HE2 PHE 33 HE2 PHE 33 -2.693 6.350 -6.205 71 HZ PHE 33 HZ PHE 33 -4.175 4.895 -4.883 72 H SER 34 H SER 34 1.284 8.412 -3.865 73 HA SER 34 HA SER 34 1.195 5.909 -5.024 74 HB2 SER 34 HB2 SER 34 3.450 6.645 -6.087 75 HB3 SER 34 HB3 SER 34 2.012 7.617 -6.403 76 HG SER 34 HG SER 34 3.361 9.136 -5.753 77 H ASP 35 H ASP 35 3.408 7.141 -2.583 78 HA ASP 35 HA ASP 35 5.146 4.874 -2.630 79 HB2 ASP 35 HB2 ASP 35 4.771 7.194 -0.755 80 HB3 ASP 35 HB3 ASP 35 5.844 5.860 -0.338 81 H VAL 36 H VAL 36 2.212 5.711 -0.948 82 HA VAL 36 HA VAL 36 2.407 3.717 1.080 83 HB VAL 36 HB VAL 36 -0.034 5.147 0.019 84 HG11 VAL 36 HG11 VAL 36 0.209 2.953 1.821 85 HG12 VAL 36 HG12 VAL 36 -0.329 4.371 2.722 86 HG13 VAL 36 HG13 VAL 36 -1.244 3.816 1.320 87 HG21 VAL 36 HG21 VAL 36 1.000 5.864 2.657 88 HG22 VAL 36 HG22 VAL 36 2.105 6.238 1.335 89 HG23 VAL 36 HG23 VAL 36 0.467 6.895 1.330 90 H LYS 37 H LYS 37 0.370 3.936 -1.842 91 HA LYS 37 HA LYS 37 -0.724 1.381 -1.708 92 HB2 LYS 37 HB2 LYS 37 -1.047 1.636 -4.195 93 HB3 LYS 37 HB3 LYS 37 -1.675 2.957 -3.219 94 HG2 LYS 37 HG2 LYS 37 -0.028 4.426 -3.910 95 HG3 LYS 37 HG3 LYS 37 1.068 3.129 -4.393 96 HD2 LYS 37 HD2 LYS 37 -1.386 2.974 -5.887 97 HD3 LYS 37 HD3 LYS 37 -0.685 4.588 -6.027 98 HE2 LYS 37 HE2 LYS 37 1.484 3.518 -6.629 99 HE3 LYS 37 HE3 LYS 37 0.661 1.959 -6.638 100 HZ1 LYS 37 HZ1 LYS 37 -0.175 2.357 -8.644 101 HZ2 LYS 37 HZ2 LYS 37 0.897 3.661 -8.752 102 HZ3 LYS 37 HZ3 LYS 37 -0.691 3.914 -8.229 103 H THR 38 H THR 38 2.381 2.458 -2.896 104 HA THR 38 HA THR 38 3.077 0.101 -4.307 105 HB THR 38 HB THR 38 4.825 2.233 -3.069 106 HG1 THR 38 HG1 THR 38 4.313 1.793 -5.822 107 HG21 THR 38 HG21 THR 38 5.556 -0.007 -4.959 108 HG22 THR 38 HG22 THR 38 6.112 0.189 -3.298 109 HG23 THR 38 HG23 THR 38 6.606 1.344 -4.535 110 H LEU 39 H LEU 39 3.519 1.142 -0.966 111 HA LEU 39 HA LEU 39 5.181 -1.037 -0.203 112 HB2 LEU 39 HB2 LEU 39 3.496 0.890 1.379 113 HB3 LEU 39 HB3 LEU 39 4.507 -0.345 2.128 114 HG LEU 39 HG LEU 39 5.614 1.772 0.298 115 HD11 LEU 39 HD11 LEU 39 4.616 2.981 2.086 116 HD12 LEU 39 HD12 LEU 39 6.346 2.890 2.416 117 HD13 LEU 39 HD13 LEU 39 5.227 1.838 3.282 118 HD21 LEU 39 HD21 LEU 39 7.451 0.934 2.241 119 HD22 LEU 39 HD22 LEU 39 7.468 0.571 0.515 120 HD23 LEU 39 HD23 LEU 39 6.676 -0.532 1.641 121 H LEU 40 H LEU 40 1.713 -0.482 -0.226 122 HA LEU 40 HA LEU 40 1.037 -2.800 1.290 123 HB2 LEU 40 HB2 LEU 40 -0.702 -1.329 -0.678 124 HB3 LEU 40 HB3 LEU 40 -1.229 -2.358 0.652 125 HG LEU 40 HG LEU 40 0.347 0.110 1.244 126 HD11 LEU 40 HD11 LEU 40 -2.555 0.451 1.298 127 HD12 LEU 40 HD12 LEU 40 -1.878 0.302 -0.323 128 HD13 LEU 40 HD13 LEU 40 -1.289 1.558 0.765 129 HD21 LEU 40 HD21 LEU 40 -0.105 -1.414 3.059 130 HD22 LEU 40 HD22 LEU 40 -1.826 -1.420 2.671 131 HD23 LEU 40 HD23 LEU 40 -1.063 0.052 3.272 132 H LYS 41 H LYS 41 1.069 -2.063 -2.183 133 HA LYS 41 HA LYS 41 0.067 -4.444 -3.168 134 HB2 LYS 41 HB2 LYS 41 0.962 -2.202 -4.323 135 HB3 LYS 41 HB3 LYS 41 2.359 -3.228 -4.621 136 HG2 LYS 41 HG2 LYS 41 0.582 -4.912 -5.513 137 HG3 LYS 41 HG3 LYS 41 -0.426 -3.471 -5.657 138 HD2 LYS 41 HD2 LYS 41 0.643 -3.741 -7.752 139 HD3 LYS 41 HD3 LYS 41 1.483 -2.418 -6.939 140 HE2 LYS 41 HE2 LYS 41 3.013 -4.410 -6.093 141 HE3 LYS 41 HE3 LYS 41 2.413 -5.171 -7.565 142 HZ1 LYS 41 HZ1 LYS 41 4.450 -4.024 -8.030 143 HZ2 LYS 41 HZ2 LYS 41 3.854 -2.582 -7.376 144 HZ3 LYS 41 HZ3 LYS 41 3.186 -3.205 -8.801 145 H GLU 42 H GLU 42 3.395 -3.649 -2.255 146 HA GLU 42 HA GLU 42 4.414 -6.225 -3.001 147 HB2 GLU 42 HB2 GLU 42 6.495 -5.465 -1.923 148 HB3 GLU 42 HB3 GLU 42 5.872 -4.283 -3.064 149 HG2 GLU 42 HG2 GLU 42 4.878 -3.049 -1.151 150 HG3 GLU 42 HG3 GLU 42 5.680 -4.182 -0.064 151 H TRP 43 H TRP 43 3.516 -4.639 0.031 152 HA TRP 43 HA TRP 43 4.350 -6.696 1.762 153 HB2 TRP 43 HB2 TRP 43 3.889 -4.510 2.652 154 HB3 TRP 43 HB3 TRP 43 2.226 -4.569 2.075 155 HD1 TRP 43 HD1 TRP 43 4.403 -6.725 4.477 156 HE1 TRP 43 HE1 TRP 43 2.945 -7.350 6.504 157 HE3 TRP 43 HE3 TRP 43 0.039 -4.467 3.065 158 HZ2 TRP 43 HZ2 TRP 43 0.295 -6.941 7.387 159 HZ3 TRP 43 HZ3 TRP 43 -1.910 -4.632 4.557 160 HH2 TRP 43 HH2 TRP 43 -1.783 -5.844 6.673 161 H ILE 44 H ILE 44 1.793 -6.566 -0.454 162 HA ILE 44 HA ILE 44 0.273 -8.643 0.956 163 HB ILE 44 HB ILE 44 -0.461 -7.009 -1.476 164 HG12 ILE 44 HG12 ILE 44 -1.869 -6.961 1.174 165 HG13 ILE 44 HG13 ILE 44 -0.416 -5.998 0.932 166 HG21 ILE 44 HG21 ILE 44 -1.504 -9.120 -1.727 167 HG22 ILE 44 HG22 ILE 44 -1.941 -9.186 -0.020 168 HG23 ILE 44 HG23 ILE 44 -2.735 -8.030 -1.091 169 HD11 ILE 44 HD11 ILE 44 -2.410 -5.704 -1.184 170 HD12 ILE 44 HD12 ILE 44 -2.945 -5.170 0.410 171 HD13 ILE 44 HD13 ILE 44 -1.488 -4.484 -0.307 172 H THR 45 H THR 45 2.516 -8.204 -1.561 173 HA THR 45 HA THR 45 1.772 -10.721 -2.867 174 HB THR 45 HB THR 45 3.433 -10.102 -4.592 175 HG1 THR 45 HG1 THR 45 4.892 -8.796 -3.644 176 HG21 THR 45 HG21 THR 45 1.510 -9.308 -5.448 177 HG22 THR 45 HG22 THR 45 2.155 -7.723 -5.022 178 HG23 THR 45 HG23 THR 45 1.039 -8.544 -3.930 179 H THR 46 H THR 46 4.713 -9.105 -1.653 180 HA THR 46 HA THR 46 6.311 -11.437 -1.704 181 HB THR 46 HB THR 46 7.199 -9.094 -1.651 182 HG1 THR 46 HG1 THR 46 8.674 -10.689 -1.209 183 HG21 THR 46 HG21 THR 46 5.658 -8.948 0.706 184 HG22 THR 46 HG22 THR 46 6.695 -7.702 0.014 185 HG23 THR 46 HG23 THR 46 7.346 -8.834 1.198 186 H ILE 47 H ILE 47 3.871 -10.402 0.429 187 HA ILE 47 HA ILE 47 4.660 -12.488 2.351 188 HB ILE 47 HB ILE 47 3.481 -9.788 3.016 189 HG12 ILE 47 HG12 ILE 47 5.833 -10.547 4.497 190 HG13 ILE 47 HG13 ILE 47 6.149 -10.666 2.769 191 HG21 ILE 47 HG21 ILE 47 3.683 -10.604 5.387 192 HG22 ILE 47 HG22 ILE 47 2.413 -11.366 4.431 193 HG23 ILE 47 HG23 ILE 47 3.926 -12.222 4.728 194 HD11 ILE 47 HD11 ILE 47 4.963 -8.282 2.813 195 HD12 ILE 47 HD12 ILE 47 5.629 -8.297 4.446 196 HD13 ILE 47 HD13 ILE 47 6.696 -8.499 3.057 197 H SER 48 H SER 48 3.158 -13.992 2.648 198 HA SER 48 HA SER 48 0.419 -13.427 1.733 199 HB2 SER 48 HB2 SER 48 1.496 -16.189 2.237 200 HB3 SER 48 HB3 SER 48 0.183 -15.690 1.171 201 HG SER 48 HG SER 48 1.701 -15.826 -0.290 202 H ASP 49 H ASP 49 2.341 -14.339 4.460 203 HA ASP 49 HA ASP 49 -0.102 -14.737 6.058 204 HB2 ASP 49 HB2 ASP 49 1.347 -16.706 6.044 205 HB3 ASP 49 HB3 ASP 49 2.708 -15.727 6.586 206 HA PRO 50 HA PRO 50 1.673 -10.688 7.403 207 HB2 PRO 50 HB2 PRO 50 -0.740 -9.481 7.700 208 HB3 PRO 50 HB3 PRO 50 0.116 -9.549 6.155 209 HG2 PRO 50 HG2 PRO 50 -2.128 -11.259 7.156 210 HG3 PRO 50 HG3 PRO 50 -1.896 -10.545 5.549 211 HD2 PRO 50 HD2 PRO 50 -1.335 -13.139 6.085 212 HD3 PRO 50 HD3 PRO 50 -0.424 -12.191 4.891 213 H MET 51 H MET 51 1.668 -9.765 9.470 214 HA MET 51 HA MET 51 0.487 -11.470 11.542 215 HB2 MET 51 HB2 MET 51 2.843 -9.623 11.459 216 HB3 MET 51 HB3 MET 51 2.090 -10.000 13.004 217 HG2 MET 51 HG2 MET 51 2.524 -12.339 12.710 218 HG3 MET 51 HG3 MET 51 3.120 -12.064 11.076 219 HE1 MET 51 HE1 MET 51 4.980 -10.572 10.503 220 HE2 MET 51 HE2 MET 51 5.197 -9.304 11.710 221 HE3 MET 51 HE3 MET 51 6.482 -10.477 11.423 222 H GLU 52 H GLU 52 -0.353 -10.410 13.500 223 HA GLU 52 HA GLU 52 -2.390 -8.597 12.925 224 HB2 GLU 52 HB2 GLU 52 -2.266 -10.145 14.904 225 HB3 GLU 52 HB3 GLU 52 -1.131 -9.022 15.637 226 HG2 GLU 52 HG2 GLU 52 -2.737 -7.413 15.989 227 HG3 GLU 52 HG3 GLU 52 -3.788 -8.033 14.717 228 H GLU 53 H GLU 53 0.885 -8.067 14.095 229 HA GLU 53 HA GLU 53 0.573 -5.328 14.743 230 HB2 GLU 53 HB2 GLU 53 2.941 -7.086 14.179 231 HB3 GLU 53 HB3 GLU 53 3.147 -5.353 14.393 232 HG2 GLU 53 HG2 GLU 53 1.681 -6.971 16.434 233 HG3 GLU 53 HG3 GLU 53 3.443 -6.922 16.417 234 H ASP 54 H ASP 54 1.911 -6.949 11.871 235 HA ASP 54 HA ASP 54 2.560 -4.688 10.395 236 HB2 ASP 54 HB2 ASP 54 1.825 -7.496 9.668 237 HB3 ASP 54 HB3 ASP 54 1.988 -6.295 8.391 238 H ILE 55 H ILE 55 -0.472 -6.555 10.341 239 HA ILE 55 HA ILE 55 -1.812 -4.900 8.502 240 HB ILE 55 HB ILE 55 -3.057 -6.582 10.679 241 HG12 ILE 55 HG12 ILE 55 -2.458 -7.363 7.821 242 HG13 ILE 55 HG13 ILE 55 -1.438 -7.800 9.187 243 HG21 ILE 55 HG21 ILE 55 -4.181 -5.654 8.040 244 HG22 ILE 55 HG22 ILE 55 -5.011 -6.635 9.248 245 HG23 ILE 55 HG23 ILE 55 -4.576 -4.965 9.615 246 HD11 ILE 55 HD11 ILE 55 -4.313 -8.599 8.807 247 HD12 ILE 55 HD12 ILE 55 -2.902 -9.628 8.560 248 HD13 ILE 55 HD13 ILE 55 -3.291 -9.037 10.175 249 H LEU 56 H LEU 56 -1.349 -4.682 11.956 250 HA LEU 56 HA LEU 56 -3.387 -2.802 12.507 251 HB2 LEU 56 HB2 LEU 56 -0.985 -3.832 13.884 252 HB3 LEU 56 HB3 LEU 56 -1.571 -2.257 14.412 253 HG LEU 56 HG LEU 56 -3.413 -4.619 14.274 254 HD11 LEU 56 HD11 LEU 56 -1.391 -5.211 15.616 255 HD12 LEU 56 HD12 LEU 56 -2.899 -5.200 16.529 256 HD13 LEU 56 HD13 LEU 56 -1.770 -3.855 16.679 257 HD21 LEU 56 HD21 LEU 56 -3.520 -2.437 16.296 258 HD22 LEU 56 HD22 LEU 56 -4.829 -3.360 15.556 259 HD23 LEU 56 HD23 LEU 56 -4.024 -2.082 14.643 260 H GLN 57 H GLN 57 -0.027 -2.480 11.501 261 HA GLN 57 HA GLN 57 0.364 0.230 11.916 262 HB2 GLN 57 HB2 GLN 57 1.422 -1.658 9.829 263 HB3 GLN 57 HB3 GLN 57 1.898 0.034 9.854 264 HG2 GLN 57 HG2 GLN 57 2.339 -2.005 12.021 265 HG3 GLN 57 HG3 GLN 57 3.558 -1.269 10.982 266 HE21 GLN 57 HE21 GLN 57 2.837 1.358 11.040 267 HE22 GLN 57 HE22 GLN 57 3.012 1.982 12.642 268 H VAL 58 H VAL 58 -1.498 -1.400 9.465 269 HA VAL 58 HA VAL 58 -1.753 0.838 7.710 270 HB VAL 58 HB VAL 58 -3.642 -1.505 7.900 271 HG11 VAL 58 HG11 VAL 58 -4.653 -0.497 6.198 272 HG12 VAL 58 HG12 VAL 58 -3.432 0.778 6.181 273 HG13 VAL 58 HG13 VAL 58 -3.180 -0.698 5.248 274 HG21 VAL 58 HG21 VAL 58 -1.783 -2.739 7.551 275 HG22 VAL 58 HG22 VAL 58 -1.988 -2.188 5.889 276 HG23 VAL 58 HG23 VAL 58 -0.851 -1.365 6.957 277 H VAL 59 H VAL 59 -3.584 -0.413 10.432 278 HA VAL 59 HA VAL 59 -5.928 1.097 10.098 279 HB VAL 59 HB VAL 59 -4.660 0.089 12.648 280 HG11 VAL 59 HG11 VAL 59 -6.938 0.301 13.595 281 HG12 VAL 59 HG12 VAL 59 -6.217 1.854 13.169 282 HG13 VAL 59 HG13 VAL 59 -7.440 1.131 12.124 283 HG21 VAL 59 HG21 VAL 59 -5.793 -1.308 10.515 284 HG22 VAL 59 HG22 VAL 59 -5.441 -1.929 12.128 285 HG23 VAL 59 HG23 VAL 59 -7.040 -1.278 11.763 286 H ARG 60 H ARG 60 -3.057 1.750 12.107 287 HA ARG 60 HA ARG 60 -3.880 4.241 13.076 288 HB2 ARG 60 HB2 ARG 60 -1.054 3.307 12.542 289 HB3 ARG 60 HB3 ARG 60 -1.523 4.629 13.602 290 HG2 ARG 60 HG2 ARG 60 -2.586 1.880 14.080 291 HG3 ARG 60 HG3 ARG 60 -0.959 2.314 14.609 292 HD2 ARG 60 HD2 ARG 60 -1.981 4.283 15.789 293 HD3 ARG 60 HD3 ARG 60 -3.561 3.596 15.415 294 HE ARG 60 HE ARG 60 -2.116 1.596 16.660 295 HH11 ARG 60 HH11 ARG 60 -3.264 4.789 17.441 296 HH12 ARG 60 HH12 ARG 60 -3.420 4.461 19.135 297 HH21 ARG 60 HH21 ARG 60 -2.317 1.151 18.888 298 HH22 ARG 60 HH22 ARG 60 -2.880 2.392 19.956 299 H TYR 61 H TYR 61 -2.613 3.306 9.997 300 HA TYR 61 HA TYR 61 -1.767 5.920 9.187 301 HB2 TYR 61 HB2 TYR 61 -0.730 4.051 8.114 302 HB3 TYR 61 HB3 TYR 61 -2.286 3.367 7.659 303 HD1 TYR 61 HD2 TYR 61 0.104 6.096 6.967 304 HD2 TYR 61 HD1 TYR 61 -3.407 4.068 5.677 305 HE1 TYR 61 HE2 TYR 61 0.234 7.259 4.804 306 HE2 TYR 61 HE1 TYR 61 -3.286 5.223 3.509 307 HH TYR 61 HH TYR 61 -1.468 6.315 2.105 308 H CYS 62 H CYS 62 -4.554 3.866 8.346 309 HA CYS 62 HA CYS 62 -5.849 5.836 6.780 310 HB2 CYS 62 HB2 CYS 62 -6.757 3.274 8.066 311 HB3 CYS 62 HB3 CYS 62 -7.896 4.322 7.231 312 HG CYS 62 HG CYS 62 -5.246 2.641 5.887 313 H THR 63 H THR 63 -6.276 4.784 10.141 314 HA THR 63 HA THR 63 -8.462 6.337 10.832 315 HB THR 63 HB THR 63 -7.552 6.288 13.170 316 HG1 THR 63 HG1 THR 63 -5.506 5.844 13.446 317 HG21 THR 63 HG21 THR 63 -8.562 4.306 13.276 318 HG22 THR 63 HG22 THR 63 -7.142 3.524 12.582 319 HG23 THR 63 HG23 THR 63 -8.409 4.147 11.526 320 H ASP 64 H ASP 64 -5.152 7.272 10.330 321 HA ASP 64 HA ASP 64 -5.328 9.798 11.659 322 HB2 ASP 64 HB2 ASP 64 -3.355 8.524 9.790 323 HB3 ASP 64 HB3 ASP 64 -3.227 10.239 10.173 324 H LEU 65 H LEU 65 -5.769 8.677 8.350 325 HA LEU 65 HA LEU 65 -5.844 11.099 7.007 326 HB2 LEU 65 HB2 LEU 65 -6.739 8.387 6.538 327 HB3 LEU 65 HB3 LEU 65 -7.839 9.565 5.824 328 HG LEU 65 HG LEU 65 -6.146 10.430 4.415 329 HD11 LEU 65 HD11 LEU 65 -4.235 8.852 6.118 330 HD12 LEU 65 HD12 LEU 65 -4.286 10.597 5.865 331 HD13 LEU 65 HD13 LEU 65 -3.798 9.528 4.549 332 HD21 LEU 65 HD21 LEU 65 -6.656 8.658 3.153 333 HD22 LEU 65 HD22 LEU 65 -6.601 7.551 4.527 334 HD23 LEU 65 HD23 LEU 65 -5.113 7.992 3.687 335 H ILE 66 H ILE 66 -8.317 9.534 8.951 336 HA ILE 66 HA ILE 66 -10.499 11.145 8.232 337 HB ILE 66 HB ILE 66 -9.876 9.593 10.731 338 HG12 ILE 66 HG12 ILE 66 -12.269 9.014 9.120 339 HG13 ILE 66 HG13 ILE 66 -10.748 8.799 8.261 340 HG21 ILE 66 HG21 ILE 66 -12.123 11.482 10.205 341 HG22 ILE 66 HG22 ILE 66 -12.424 10.021 11.146 342 HG23 ILE 66 HG23 ILE 66 -11.221 11.190 11.693 343 HD11 ILE 66 HD11 ILE 66 -11.446 6.720 9.253 344 HD12 ILE 66 HD12 ILE 66 -9.983 7.299 10.051 345 HD13 ILE 66 HD13 ILE 66 -11.549 7.479 10.842 346 H GLU 67 H GLU 67 -8.194 11.462 10.926 347 HA GLU 67 HA GLU 67 -9.308 13.926 11.843 348 HB2 GLU 67 HB2 GLU 67 -6.533 12.898 12.426 349 HB3 GLU 67 HB3 GLU 67 -7.512 13.979 13.409 350 HG2 GLU 67 HG2 GLU 67 -9.135 12.077 13.685 351 HG3 GLU 67 HG3 GLU 67 -7.920 11.041 12.937 352 H GLU 68 H GLU 68 -6.808 13.029 9.581 353 HA GLU 68 HA GLU 68 -5.792 15.735 9.367 354 HB2 GLU 68 HB2 GLU 68 -5.130 13.169 7.926 355 HB3 GLU 68 HB3 GLU 68 -4.401 14.714 7.507 356 HG2 GLU 68 HG2 GLU 68 -4.248 14.074 10.351 357 HG3 GLU 68 HG3 GLU 68 -3.410 12.924 9.311 358 H LYS 69 H LYS 69 -8.474 14.200 8.256 359 HA LYS 69 HA LYS 69 -9.983 14.583 6.597 360 HB2 LYS 69 HB2 LYS 69 -8.562 17.230 6.287 361 HB3 LYS 69 HB3 LYS 69 -10.213 16.856 5.812 362 HG2 LYS 69 HG2 LYS 69 -9.308 16.663 8.664 363 HG3 LYS 69 HG3 LYS 69 -9.875 18.178 7.959 364 HD2 LYS 69 HD2 LYS 69 -11.627 15.891 7.440 365 HD3 LYS 69 HD3 LYS 69 -11.463 16.295 9.151 366 HE2 LYS 69 HE2 LYS 69 -12.805 18.049 8.906 367 HE3 LYS 69 HE3 LYS 69 -11.783 18.696 7.623 368 HZ1 LYS 69 HZ1 LYS 69 -13.397 18.237 6.203 369 HZ2 LYS 69 HZ2 LYS 69 -14.330 17.513 7.414 370 HZ3 LYS 69 HZ3 LYS 69 -13.223 16.586 6.533 371 H ASP 70 H ASP 70 -7.801 13.084 5.809 372 HA ASP 70 HA ASP 70 -7.298 14.042 3.067 373 HB2 ASP 70 HB2 ASP 70 -5.611 12.493 4.992 374 HB3 ASP 70 HB3 ASP 70 -5.395 12.227 3.264 375 H LEU 71 H LEU 71 -9.675 12.653 3.916 376 HA LEU 71 HA LEU 71 -9.652 9.914 3.417 377 HB2 LEU 71 HB2 LEU 71 -11.901 11.745 2.630 378 HB3 LEU 71 HB3 LEU 71 -11.997 10.060 3.136 379 HG LEU 71 HG LEU 71 -11.348 12.429 4.887 380 HD11 LEU 71 HD11 LEU 71 -13.804 11.259 4.072 381 HD12 LEU 71 HD12 LEU 71 -13.532 12.574 5.215 382 HD13 LEU 71 HD13 LEU 71 -13.559 10.905 5.783 383 HD21 LEU 71 HD21 LEU 71 -11.720 10.490 6.641 384 HD22 LEU 71 HD22 LEU 71 -10.133 10.803 5.935 385 HD23 LEU 71 HD23 LEU 71 -11.136 9.493 5.309 386 H GLU 72 H GLU 72 -9.180 12.523 1.269 387 HA GLU 72 HA GLU 72 -10.186 11.657 -1.138 388 HB2 GLU 72 HB2 GLU 72 -8.996 13.813 -0.740 389 HB3 GLU 72 HB3 GLU 72 -7.474 12.932 -0.745 390 HG2 GLU 72 HG2 GLU 72 -7.945 14.042 -2.884 391 HG3 GLU 72 HG3 GLU 72 -7.793 12.292 -3.040 392 H LYS 73 H LYS 73 -6.951 10.913 0.165 393 HA LYS 73 HA LYS 73 -6.442 8.966 -1.888 394 HB2 LYS 73 HB2 LYS 73 -4.338 8.583 -0.732 395 HB3 LYS 73 HB3 LYS 73 -4.628 10.310 -0.896 396 HG2 LYS 73 HG2 LYS 73 -5.714 9.900 1.523 397 HG3 LYS 73 HG3 LYS 73 -4.489 8.630 1.521 398 HD2 LYS 73 HD2 LYS 73 -3.264 10.950 0.483 399 HD3 LYS 73 HD3 LYS 73 -4.166 11.445 1.917 400 HE2 LYS 73 HE2 LYS 73 -2.994 9.137 2.768 401 HE3 LYS 73 HE3 LYS 73 -1.769 9.772 1.672 402 HZ1 LYS 73 HZ1 LYS 73 -2.036 10.495 4.242 403 HZ2 LYS 73 HZ2 LYS 73 -2.901 11.727 3.472 404 HZ3 LYS 73 HZ3 LYS 73 -1.286 11.444 3.059 405 H LEU 74 H LEU 74 -7.853 8.962 1.253 406 HA LEU 74 HA LEU 74 -7.375 6.393 2.155 407 HB2 LEU 74 HB2 LEU 74 -8.574 8.174 3.394 408 HB3 LEU 74 HB3 LEU 74 -9.977 7.902 2.363 409 HG LEU 74 HG LEU 74 -10.116 5.587 3.253 410 HD11 LEU 74 HD11 LEU 74 -8.825 4.894 5.115 411 HD12 LEU 74 HD12 LEU 74 -8.106 6.493 5.300 412 HD13 LEU 74 HD13 LEU 74 -7.689 5.495 3.907 413 HD21 LEU 74 HD21 LEU 74 -11.353 7.594 4.191 414 HD22 LEU 74 HD22 LEU 74 -10.157 7.598 5.487 415 HD23 LEU 74 HD23 LEU 74 -11.200 6.195 5.253 416 H ASP 75 H ASP 75 -10.063 7.491 0.091 417 HA ASP 75 HA ASP 75 -11.188 4.945 -0.311 418 HB2 ASP 75 HB2 ASP 75 -11.538 7.634 -1.398 419 HB3 ASP 75 HB3 ASP 75 -11.826 6.373 -2.593 420 H LEU 76 H LEU 76 -8.512 6.579 -1.806 421 HA LEU 76 HA LEU 76 -8.380 4.881 -4.113 422 HB2 LEU 76 HB2 LEU 76 -6.331 6.726 -2.894 423 HB3 LEU 76 HB3 LEU 76 -6.168 5.926 -4.456 424 HG LEU 76 HG LEU 76 -8.423 7.826 -3.860 425 HD11 LEU 76 HD11 LEU 76 -6.198 8.839 -5.468 426 HD12 LEU 76 HD12 LEU 76 -5.810 8.597 -3.765 427 HD13 LEU 76 HD13 LEU 76 -7.159 9.636 -4.223 428 HD21 LEU 76 HD21 LEU 76 -7.150 7.154 -6.497 429 HD22 LEU 76 HD22 LEU 76 -8.720 7.896 -6.187 430 HD23 LEU 76 HD23 LEU 76 -8.461 6.190 -5.815 431 H VAL 77 H VAL 77 -6.786 4.999 -0.964 432 HA VAL 77 HA VAL 77 -4.979 2.855 -1.514 433 HB VAL 77 HB VAL 77 -5.871 4.017 1.129 434 HG11 VAL 77 HG11 VAL 77 -3.463 2.965 1.649 435 HG12 VAL 77 HG12 VAL 77 -4.971 2.080 1.885 436 HG13 VAL 77 HG13 VAL 77 -4.016 1.825 0.424 437 HG21 VAL 77 HG21 VAL 77 -4.681 5.532 -0.510 438 HG22 VAL 77 HG22 VAL 77 -3.919 5.354 1.071 439 HG23 VAL 77 HG23 VAL 77 -3.276 4.482 -0.322 440 H ILE 78 H ILE 78 -8.045 3.114 0.260 441 HA ILE 78 HA ILE 78 -8.213 0.506 1.203 442 HB ILE 78 HB ILE 78 -10.396 2.412 0.372 443 HG12 ILE 78 HG12 ILE 78 -8.998 3.074 2.300 444 HG13 ILE 78 HG13 ILE 78 -10.661 2.747 2.774 445 HG21 ILE 78 HG21 ILE 78 -10.551 -0.406 1.121 446 HG22 ILE 78 HG22 ILE 78 -11.562 0.647 2.109 447 HG23 ILE 78 HG23 ILE 78 -11.752 0.633 0.356 448 HD11 ILE 78 HD11 ILE 78 -9.273 0.325 3.046 449 HD12 ILE 78 HD12 ILE 78 -8.245 1.580 3.740 450 HD13 ILE 78 HD13 ILE 78 -9.898 1.371 4.320 451 H LYS 79 H LYS 79 -9.646 1.829 -1.783 452 HA LYS 79 HA LYS 79 -10.576 -0.641 -2.764 453 HB2 LYS 79 HB2 LYS 79 -10.926 0.498 -4.858 454 HB3 LYS 79 HB3 LYS 79 -11.354 1.591 -3.549 455 HG2 LYS 79 HG2 LYS 79 -10.148 3.028 -4.808 456 HG3 LYS 79 HG3 LYS 79 -8.822 2.337 -3.869 457 HD2 LYS 79 HD2 LYS 79 -7.922 2.030 -5.924 458 HD3 LYS 79 HD3 LYS 79 -8.912 0.569 -5.889 459 HE2 LYS 79 HE2 LYS 79 -10.737 2.206 -6.868 460 HE3 LYS 79 HE3 LYS 79 -9.316 3.111 -7.385 461 HZ1 LYS 79 HZ1 LYS 79 -8.551 0.834 -8.286 462 HZ2 LYS 79 HZ2 LYS 79 -9.700 1.716 -9.158 463 HZ3 LYS 79 HZ3 LYS 79 -10.187 0.417 -8.191 464 H TYR 80 H TYR 80 -7.510 1.041 -3.105 465 HA TYR 80 HA TYR 80 -6.428 -0.547 -5.167 466 HB2 TYR 80 HB2 TYR 80 -5.444 1.597 -4.558 467 HB3 TYR 80 HB3 TYR 80 -5.035 0.983 -2.960 468 HD1 TYR 80 HD1 TYR 80 -3.222 -0.659 -2.688 469 HD2 TYR 80 HD2 TYR 80 -4.104 1.061 -6.477 470 HE1 TYR 80 HE1 TYR 80 -1.040 -1.415 -3.532 471 HE2 TYR 80 HE2 TYR 80 -1.925 0.308 -7.334 472 HH TYR 80 HH TYR 80 -0.006 -0.699 -6.855 473 H MET 81 H MET 81 -6.059 -0.753 -1.631 474 HA MET 81 HA MET 81 -4.473 -3.100 -1.681 475 HB2 MET 81 HB2 MET 81 -4.810 -3.184 0.701 476 HB3 MET 81 HB3 MET 81 -4.580 -1.506 0.230 477 HG2 MET 81 HG2 MET 81 -6.884 -1.025 0.471 478 HG3 MET 81 HG3 MET 81 -7.290 -2.733 0.624 479 HE1 MET 81 HE1 MET 81 -5.035 0.054 3.080 480 HE2 MET 81 HE2 MET 81 -6.309 0.407 1.914 481 HE3 MET 81 HE3 MET 81 -6.694 0.287 3.632 482 H LYS 82 H LYS 82 -7.895 -2.520 -1.784 483 HA LYS 82 HA LYS 82 -8.834 -5.019 -0.920 484 HB2 LYS 82 HB2 LYS 82 -9.917 -2.668 -2.191 485 HB3 LYS 82 HB3 LYS 82 -10.585 -4.118 -2.931 486 HG2 LYS 82 HG2 LYS 82 -10.533 -4.217 -0.015 487 HG3 LYS 82 HG3 LYS 82 -11.519 -2.907 -0.667 488 HD2 LYS 82 HD2 LYS 82 -11.889 -5.454 -2.051 489 HD3 LYS 82 HD3 LYS 82 -12.332 -5.506 -0.343 490 HE2 LYS 82 HE2 LYS 82 -13.815 -3.611 -0.643 491 HE3 LYS 82 HE3 LYS 82 -13.322 -3.462 -2.329 492 HZ1 LYS 82 HZ1 LYS 82 -14.650 -5.862 -1.197 493 HZ2 LYS 82 HZ2 LYS 82 -14.323 -5.553 -2.827 494 HZ3 LYS 82 HZ3 LYS 82 -15.469 -4.620 -2.004 495 H ARG 83 H ARG 83 -8.375 -3.845 -4.260 496 HA ARG 83 HA ARG 83 -8.943 -6.209 -5.583 497 HB2 ARG 83 HB2 ARG 83 -8.057 -5.225 -7.481 498 HB3 ARG 83 HB3 ARG 83 -8.404 -3.818 -6.484 499 HG2 ARG 83 HG2 ARG 83 -5.923 -4.169 -5.694 500 HG3 ARG 83 HG3 ARG 83 -5.790 -5.012 -7.239 501 HD2 ARG 83 HD2 ARG 83 -7.009 -2.279 -7.067 502 HD3 ARG 83 HD3 ARG 83 -5.260 -2.489 -7.151 503 HE ARG 83 HE ARG 83 -7.162 -2.875 -9.277 504 HH11 ARG 83 HH11 ARG 83 -3.986 -3.652 -8.080 505 HH12 ARG 83 HH12 ARG 83 -3.345 -4.023 -9.646 506 HH21 ARG 83 HH21 ARG 83 -6.328 -3.360 -11.344 507 HH22 ARG 83 HH22 ARG 83 -4.677 -3.856 -11.502 508 H LEU 84 H LEU 84 -6.107 -5.301 -3.802 509 HA LEU 84 HA LEU 84 -4.452 -7.400 -4.885 510 HB2 LEU 84 HB2 LEU 84 -4.047 -5.644 -2.469 511 HB3 LEU 84 HB3 LEU 84 -2.834 -6.702 -3.188 512 HG LEU 84 HG LEU 84 -4.083 -4.429 -4.711 513 HD11 LEU 84 HD11 LEU 84 -3.116 -3.115 -3.148 514 HD12 LEU 84 HD12 LEU 84 -1.664 -3.466 -4.085 515 HD13 LEU 84 HD13 LEU 84 -2.005 -4.374 -2.612 516 HD21 LEU 84 HD21 LEU 84 -2.057 -4.627 -6.058 517 HD22 LEU 84 HD22 LEU 84 -2.944 -6.151 -6.016 518 HD23 LEU 84 HD23 LEU 84 -1.494 -5.946 -5.031 519 H MET 85 H MET 85 -5.898 -6.738 -1.691 520 HA MET 85 HA MET 85 -5.199 -9.184 -0.517 521 HB2 MET 85 HB2 MET 85 -7.491 -7.307 0.072 522 HB3 MET 85 HB3 MET 85 -7.064 -8.678 1.087 523 HG2 MET 85 HG2 MET 85 -4.701 -7.545 1.078 524 HG3 MET 85 HG3 MET 85 -5.634 -6.107 0.670 525 HE1 MET 85 HE1 MET 85 -4.333 -5.661 3.943 526 HE2 MET 85 HE2 MET 85 -4.738 -4.970 2.371 527 HE3 MET 85 HE3 MET 85 -5.781 -4.670 3.763 528 H GLN 86 H GLN 86 -7.816 -8.304 -2.639 529 HA GLN 86 HA GLN 86 -9.361 -10.676 -2.145 530 HB2 GLN 86 HB2 GLN 86 -9.515 -8.574 -4.309 531 HB3 GLN 86 HB3 GLN 86 -10.646 -9.913 -4.165 532 HG2 GLN 86 HG2 GLN 86 -10.466 -8.609 -1.645 533 HG3 GLN 86 HG3 GLN 86 -10.729 -7.393 -2.894 534 HE21 GLN 86 HE21 GLN 86 -12.513 -8.318 -0.783 535 HE22 GLN 86 HE22 GLN 86 -13.938 -8.889 -1.576 536 H GLN 87 H GLN 87 -7.327 -9.523 -4.829 537 HA GLN 87 HA GLN 87 -7.546 -11.924 -6.330 538 HB2 GLN 87 HB2 GLN 87 -5.972 -10.977 -7.811 539 HB3 GLN 87 HB3 GLN 87 -6.905 -9.618 -7.196 540 HG2 GLN 87 HG2 GLN 87 -5.101 -9.154 -5.580 541 HG3 GLN 87 HG3 GLN 87 -4.159 -10.461 -6.297 542 HE21 GLN 87 HE21 GLN 87 -6.152 -7.892 -7.708 543 HE22 GLN 87 HE22 GLN 87 -4.904 -7.232 -8.704 544 H SER 88 H SER 88 -5.694 -11.032 -3.606 545 HA SER 88 HA SER 88 -3.344 -12.449 -3.875 546 HB2 SER 88 HB2 SER 88 -5.067 -11.825 -1.492 547 HB3 SER 88 HB3 SER 88 -3.606 -12.794 -1.309 548 HG SER 88 HG SER 88 -3.498 -10.351 -2.692 549 H VAL 89 H VAL 89 -2.678 -14.541 -3.240 550 HA VAL 89 HA VAL 89 -4.528 -16.605 -3.948 551 HB VAL 89 HB VAL 89 -2.238 -16.901 -4.583 552 HG11 VAL 89 HG11 VAL 89 -1.079 -15.588 -2.976 553 HG12 VAL 89 HG12 VAL 89 -1.632 -16.610 -1.648 554 HG13 VAL 89 HG13 VAL 89 -0.475 -17.237 -2.823 555 HG21 VAL 89 HG21 VAL 89 -3.491 -18.928 -4.003 556 HG22 VAL 89 HG22 VAL 89 -1.768 -19.111 -3.672 557 HG23 VAL 89 HG23 VAL 89 -2.895 -18.818 -2.346 558 H GLU 90 H GLU 90 -3.244 -15.325 -0.955 559 HA GLU 90 HA GLU 90 -4.325 -17.487 0.637 560 HB2 GLU 90 HB2 GLU 90 -2.679 -15.068 1.148 561 HB3 GLU 90 HB3 GLU 90 -3.653 -15.666 2.483 562 HG2 GLU 90 HG2 GLU 90 -1.814 -17.457 0.937 563 HG3 GLU 90 HG3 GLU 90 -1.257 -16.496 2.305 564 H SER 91 H SER 91 -6.301 -17.561 1.476 565 HA SER 91 HA SER 91 -8.203 -15.511 0.932 566 HB2 SER 91 HB2 SER 91 -9.198 -17.602 0.955 567 HB3 SER 91 HB3 SER 91 -8.260 -18.150 2.344 568 HG SER 91 HG SER 91 -9.900 -17.591 3.512 569 H VAL 92 H VAL 92 -6.148 -16.270 3.613 570 HA VAL 92 HA VAL 92 -7.483 -15.080 5.734 571 HB VAL 92 HB VAL 92 -5.357 -16.372 5.914 572 HG11 VAL 92 HG11 VAL 92 -3.393 -15.666 5.085 573 HG12 VAL 92 HG12 VAL 92 -4.390 -14.636 4.055 574 HG13 VAL 92 HG13 VAL 92 -3.690 -13.988 5.538 575 HG21 VAL 92 HG21 VAL 92 -4.825 -13.776 7.257 576 HG22 VAL 92 HG22 VAL 92 -6.350 -14.590 7.607 577 HG23 VAL 92 HG23 VAL 92 -4.819 -15.412 7.914 578 H TRP 93 H TRP 93 -5.869 -13.627 3.028 579 HA TRP 93 HA TRP 93 -5.403 -11.063 4.074 580 HB2 TRP 93 HB2 TRP 93 -5.664 -12.230 1.347 581 HB3 TRP 93 HB3 TRP 93 -5.791 -10.479 1.496 582 HD1 TRP 93 HD1 TRP 93 -3.289 -12.915 0.728 583 HE1 TRP 93 HE1 TRP 93 -0.916 -12.094 1.287 584 HE3 TRP 93 HE3 TRP 93 -4.487 -8.977 3.759 585 HZ2 TRP 93 HZ2 TRP 93 0.290 -10.047 2.813 586 HZ3 TRP 93 HZ3 TRP 93 -2.665 -7.638 4.729 587 HH2 TRP 93 HH2 TRP 93 -0.326 -8.164 4.265 588 H ASN 94 H ASN 94 -8.269 -12.551 2.698 589 HA ASN 94 HA ASN 94 -9.826 -10.282 2.263 590 HB2 ASN 94 HB2 ASN 94 -10.517 -13.125 2.967 591 HB3 ASN 94 HB3 ASN 94 -11.774 -11.908 2.764 592 HD21 ASN 94 HD21 ASN 94 -8.995 -13.368 1.147 593 HD22 ASN 94 HD22 ASN 94 -9.618 -13.202 -0.456 594 H MET 95 H MET 95 -9.253 -12.129 5.212 595 HA MET 95 HA MET 95 -11.166 -10.712 6.785 596 HB2 MET 95 HB2 MET 95 -8.763 -12.257 7.767 597 HB3 MET 95 HB3 MET 95 -10.221 -11.872 8.673 598 HG2 MET 95 HG2 MET 95 -11.403 -13.219 6.774 599 HG3 MET 95 HG3 MET 95 -9.796 -13.901 6.537 600 HE1 MET 95 HE1 MET 95 -8.439 -14.884 8.092 601 HE2 MET 95 HE2 MET 95 -8.834 -15.503 9.695 602 HE3 MET 95 HE3 MET 95 -9.291 -16.420 8.259 603 H ALA 96 H ALA 96 -7.703 -10.394 6.206 604 HA ALA 96 HA ALA 96 -7.019 -8.569 8.166 605 HB1 ALA 96 HB1 ALA 96 -5.175 -7.915 6.751 606 HB2 ALA 96 HB2 ALA 96 -5.421 -9.658 6.633 607 HB3 ALA 96 HB3 ALA 96 -5.978 -8.599 5.338 608 H PHE 97 H PHE 97 -8.382 -7.943 4.949 609 HA PHE 97 HA PHE 97 -8.310 -5.161 5.001 610 HB2 PHE 97 HB2 PHE 97 -8.859 -6.464 2.989 611 HB3 PHE 97 HB3 PHE 97 -10.389 -6.945 3.715 612 HD1 PHE 97 HD2 PHE 97 -8.557 -3.722 3.248 613 HD2 PHE 97 HD1 PHE 97 -12.194 -5.888 2.797 614 HE1 PHE 97 HE2 PHE 97 -9.628 -1.719 2.304 615 HE2 PHE 97 HE1 PHE 97 -13.271 -3.887 1.852 616 HZ PHE 97 HZ PHE 97 -11.989 -1.799 1.606 617 H ASP 98 H ASP 98 -10.856 -7.367 6.117 618 HA ASP 98 HA ASP 98 -12.657 -5.355 6.945 619 HB2 ASP 98 HB2 ASP 98 -13.199 -7.792 6.550 620 HB3 ASP 98 HB3 ASP 98 -12.443 -8.137 8.103 621 H PHE 99 H PHE 99 -9.995 -6.990 8.549 622 HA PHE 99 HA PHE 99 -10.517 -6.199 11.182 623 HB2 PHE 99 HB2 PHE 99 -8.868 -7.857 10.901 624 HB3 PHE 99 HB3 PHE 99 -7.982 -6.898 9.719 625 HD1 PHE 99 HD2 PHE 99 -8.694 -7.370 13.284 626 HD2 PHE 99 HD1 PHE 99 -6.425 -5.211 10.403 627 HE1 PHE 99 HE2 PHE 99 -7.226 -6.534 15.073 628 HE2 PHE 99 HE1 PHE 99 -4.952 -4.371 12.186 629 HZ PHE 99 HZ PHE 99 -5.353 -5.032 14.525 630 H ILE 100 H ILE 100 -8.642 -4.609 8.627 631 HA ILE 100 HA ILE 100 -7.832 -2.401 10.215 632 HB ILE 100 HB ILE 100 -8.063 -2.615 7.210 633 HG12 ILE 100 HG12 ILE 100 -5.460 -2.683 8.654 634 HG13 ILE 100 HG13 ILE 100 -6.466 -4.126 8.732 635 HG21 ILE 100 HG21 ILE 100 -7.491 -0.380 8.901 636 HG22 ILE 100 HG22 ILE 100 -6.057 -0.794 7.963 637 HG23 ILE 100 HG23 ILE 100 -7.580 -0.452 7.141 638 HD11 ILE 100 HD11 ILE 100 -5.880 -2.858 6.097 639 HD12 ILE 100 HD12 ILE 100 -4.687 -3.900 6.872 640 HD13 ILE 100 HD13 ILE 100 -6.283 -4.533 6.473 641 H LEU 101 H LEU 101 -10.574 -2.982 8.075 642 HA LEU 101 HA LEU 101 -11.563 -0.319 8.126 643 HB2 LEU 101 HB2 LEU 101 -12.695 -2.977 7.357 644 HB3 LEU 101 HB3 LEU 101 -13.749 -1.569 7.467 645 HG LEU 101 HG LEU 101 -11.296 -1.639 5.722 646 HD11 LEU 101 HD11 LEU 101 -13.156 -1.895 3.909 647 HD12 LEU 101 HD12 LEU 101 -14.056 -2.651 5.223 648 HD13 LEU 101 HD13 LEU 101 -12.503 -3.318 4.721 649 HD21 LEU 101 HD21 LEU 101 -13.761 0.054 5.441 650 HD22 LEU 101 HD22 LEU 101 -12.171 0.290 4.716 651 HD23 LEU 101 HD23 LEU 101 -12.398 0.546 6.447 652 H ASP 102 H ASP 102 -12.053 -3.147 10.141 653 HA ASP 102 HA ASP 102 -14.317 -2.303 11.556 654 HB2 ASP 102 HB2 ASP 102 -12.959 -4.577 11.560 655 HB3 ASP 102 HB3 ASP 102 -12.181 -3.845 12.962 656 H ASN 103 H ASN 103 -10.983 -1.364 11.789 657 HA ASN 103 HA ASN 103 -11.470 0.069 14.294 658 HB2 ASN 103 HB2 ASN 103 -8.955 -0.562 12.750 659 HB3 ASN 103 HB3 ASN 103 -8.972 0.547 14.118 660 HD21 ASN 103 HD21 ASN 103 -9.713 -2.754 13.143 661 HD22 ASN 103 HD22 ASN 103 -9.437 -3.466 14.692 662 H VAL 104 H VAL 104 -10.585 0.618 10.924 663 HA VAL 104 HA VAL 104 -10.249 3.438 11.192 664 HB VAL 104 HB VAL 104 -10.719 1.737 8.741 665 HG11 VAL 104 HG11 VAL 104 -9.949 4.645 8.964 666 HG12 VAL 104 HG12 VAL 104 -9.902 3.699 7.476 667 HG13 VAL 104 HG13 VAL 104 -11.442 3.996 8.285 668 HG21 VAL 104 HG21 VAL 104 -8.393 1.770 8.415 669 HG22 VAL 104 HG22 VAL 104 -8.158 3.055 9.600 670 HG23 VAL 104 HG23 VAL 104 -8.602 1.434 10.134 671 H GLN 105 H GLN 105 -12.785 1.516 9.572 672 HA GLN 105 HA GLN 105 -14.540 3.533 8.958 673 HB2 GLN 105 HB2 GLN 105 -15.286 0.767 9.922 674 HB3 GLN 105 HB3 GLN 105 -16.313 1.847 8.988 675 HG2 GLN 105 HG2 GLN 105 -13.654 0.970 7.937 676 HG3 GLN 105 HG3 GLN 105 -15.079 -0.057 7.781 677 HE21 GLN 105 HE21 GLN 105 -13.640 3.000 6.896 678 HE22 GLN 105 HE22 GLN 105 -14.668 3.315 5.544 679 H VAL 106 H VAL 106 -13.893 2.107 12.067 680 HA VAL 106 HA VAL 106 -16.209 3.088 13.398 681 HB VAL 106 HB VAL 106 -13.571 2.013 14.334 682 HG11 VAL 106 HG11 VAL 106 -15.580 3.540 15.927 683 HG12 VAL 106 HG12 VAL 106 -14.721 2.190 16.673 684 HG13 VAL 106 HG13 VAL 106 -13.819 3.559 16.022 685 HG21 VAL 106 HG21 VAL 106 -16.336 1.083 15.041 686 HG22 VAL 106 HG22 VAL 106 -15.549 0.595 13.539 687 HG23 VAL 106 HG23 VAL 106 -14.821 0.182 15.091 688 H VAL 107 H VAL 107 -12.804 4.154 13.515 689 HA VAL 107 HA VAL 107 -13.316 6.509 14.978 690 HB VAL 107 HB VAL 107 -11.083 5.607 14.909 691 HG11 VAL 107 HG11 VAL 107 -9.802 6.030 12.664 692 HG12 VAL 107 HG12 VAL 107 -10.761 4.565 12.885 693 HG13 VAL 107 HG13 VAL 107 -11.416 5.918 11.962 694 HG21 VAL 107 HG21 VAL 107 -10.114 7.619 15.071 695 HG22 VAL 107 HG22 VAL 107 -10.482 8.034 13.397 696 HG23 VAL 107 HG23 VAL 107 -11.701 8.262 14.650 697 H LEU 108 H LEU 108 -13.578 5.749 11.609 698 HA LEU 108 HA LEU 108 -13.509 8.443 10.654 699 HB2 LEU 108 HB2 LEU 108 -13.343 7.414 8.702 700 HB3 LEU 108 HB3 LEU 108 -13.532 5.870 9.531 701 HG LEU 108 HG LEU 108 -16.036 6.194 9.251 702 HD11 LEU 108 HD11 LEU 108 -15.062 8.637 8.045 703 HD12 LEU 108 HD12 LEU 108 -16.699 8.184 8.516 704 HD13 LEU 108 HD13 LEU 108 -16.074 7.715 6.935 705 HD21 LEU 108 HD21 LEU 108 -15.828 4.768 7.557 706 HD22 LEU 108 HD22 LEU 108 -14.094 5.093 7.593 707 HD23 LEU 108 HD23 LEU 108 -15.142 6.010 6.509 708 H GLN 109 H GLN 109 -16.046 6.180 11.587 709 HA GLN 109 HA GLN 109 -18.228 7.759 10.721 710 HB2 GLN 109 HB2 GLN 109 -17.886 5.420 12.541 711 HB3 GLN 109 HB3 GLN 109 -19.398 6.316 12.610 712 HG2 GLN 109 HG2 GLN 109 -19.826 5.885 10.292 713 HG3 GLN 109 HG3 GLN 109 -18.239 5.143 10.094 714 HE21 GLN 109 HE21 GLN 109 -17.906 3.377 11.919 715 HE22 GLN 109 HE22 GLN 109 -19.182 2.215 11.998 716 H GLN 110 H GLN 110 -16.519 7.495 13.804 717 HA GLN 110 HA GLN 110 -18.233 9.158 15.295 718 HB2 GLN 110 HB2 GLN 110 -15.297 8.539 15.648 719 HB3 GLN 110 HB3 GLN 110 -16.272 9.401 16.830 720 HG2 GLN 110 HG2 GLN 110 -17.799 7.325 16.748 721 HG3 GLN 110 HG3 GLN 110 -16.411 6.533 16.006 722 HE21 GLN 110 HE21 GLN 110 -15.170 5.488 17.371 723 HE22 GLN 110 HE22 GLN 110 -14.923 5.877 19.035 724 H THR 111 H THR 111 -16.067 9.873 12.795 725 HA THR 111 HA THR 111 -15.675 12.639 13.655 726 HB THR 111 HB THR 111 -14.543 11.101 11.315 727 HG1 THR 111 HG1 THR 111 -13.750 10.856 13.608 728 HG21 THR 111 HG21 THR 111 -13.065 13.191 11.133 729 HG22 THR 111 HG22 THR 111 -14.323 14.002 12.065 730 HG23 THR 111 HG23 THR 111 -14.706 13.293 10.496 731 H TYR 112 H TYR 112 -16.674 10.987 10.651 732 HA TYR 112 HA TYR 112 -18.287 13.344 9.976 733 HB2 TYR 112 HB2 TYR 112 -17.653 11.045 8.134 734 HB3 TYR 112 HB3 TYR 112 -18.175 12.670 7.706 735 HD1 TYR 112 HD2 TYR 112 -16.597 14.530 7.728 736 HD2 TYR 112 HD1 TYR 112 -15.343 10.581 8.692 737 HE1 TYR 112 HE2 TYR 112 -14.252 15.215 7.454 738 HE2 TYR 112 HE1 TYR 112 -12.992 11.256 8.422 739 HH TYR 112 HH TYR 112 -11.935 13.646 6.839 740 H GLY 113 H GLY 113 -18.459 9.813 10.232 741 HA2 GLY 113 HA2 GLY 113 -20.442 8.853 11.278 742 HA3 GLY 113 HA3 GLY 113 -21.392 10.081 10.453 743 H SER 114 H SER 114 -19.442 9.464 8.086 744 HA SER 114 HA SER 114 -21.176 7.409 6.950 745 HB2 SER 114 HB2 SER 114 -20.423 9.713 5.857 746 HB3 SER 114 HB3 SER 114 -19.044 8.742 5.341 747 HG SER 114 HG SER 114 -21.043 8.848 3.954 748 H THR 115 H THR 115 -19.743 6.161 5.108 749 HA THR 115 HA THR 115 -17.238 5.198 6.207 750 HB THR 115 HB THR 115 -17.935 2.831 6.213 751 HG1 THR 115 HG1 THR 115 -20.133 2.331 6.038 752 HG21 THR 115 HG21 THR 115 -18.056 4.374 8.259 753 HG22 THR 115 HG22 THR 115 -18.935 2.847 8.336 754 HG23 THR 115 HG23 THR 115 -19.800 4.349 8.014 755 H LEU 116 H LEU 116 -16.479 3.247 4.758 756 HA LEU 116 HA LEU 116 -16.701 4.191 2.008 757 HB2 LEU 116 HB2 LEU 116 -14.613 3.170 3.583 758 HB3 LEU 116 HB3 LEU 116 -14.926 1.957 2.343 759 HG LEU 116 HG LEU 116 -14.834 4.229 0.850 760 HD11 LEU 116 HD11 LEU 116 -13.338 4.707 3.347 761 HD12 LEU 116 HD12 LEU 116 -14.066 5.849 2.219 762 HD13 LEU 116 HD13 LEU 116 -12.508 5.114 1.845 763 HD21 LEU 116 HD21 LEU 116 -13.616 1.928 0.748 764 HD22 LEU 116 HD22 LEU 116 -12.292 2.808 1.512 765 HD23 LEU 116 HD23 LEU 116 -12.913 3.332 -0.054 766 H LYS 117 H LYS 117 -17.565 3.042 0.360 767 HA LYS 117 HA LYS 117 -19.260 0.817 1.022 768 HB2 LYS 117 HB2 LYS 117 -20.161 2.322 -0.559 769 HB3 LYS 117 HB3 LYS 117 -18.686 2.327 -1.518 770 HG2 LYS 117 HG2 LYS 117 -20.495 1.084 -2.599 771 HG3 LYS 117 HG3 LYS 117 -19.103 0.057 -2.239 772 HD2 LYS 117 HD2 LYS 117 -20.814 -0.025 0.011 773 HD3 LYS 117 HD3 LYS 117 -21.823 -0.248 -1.419 774 HE2 LYS 117 HE2 LYS 117 -19.779 -1.872 -2.047 775 HE3 LYS 117 HE3 LYS 117 -19.707 -1.977 -0.288 776 HZ1 LYS 117 HZ1 LYS 117 -21.445 -3.304 -2.005 777 HZ2 LYS 117 HZ2 LYS 117 -22.384 -2.202 -1.132 778 HZ3 LYS 117 HZ3 LYS 117 -21.436 -3.339 -0.313 779 H VAL 118 H VAL 118 -18.121 -0.998 1.503 780 HA VAL 118 HA VAL 118 -16.288 -2.011 -0.573 781 HB VAL 118 HB VAL 118 -15.330 -3.424 1.328 782 HG11 VAL 118 HG11 VAL 118 -14.204 -1.163 2.269 783 HG12 VAL 118 HG12 VAL 118 -13.783 -1.897 0.722 784 HG13 VAL 118 HG13 VAL 118 -14.928 -0.557 0.780 785 HG21 VAL 118 HG21 VAL 118 -17.410 -2.449 2.764 786 HG22 VAL 118 HG22 VAL 118 -15.929 -3.094 3.473 787 HG23 VAL 118 HG23 VAL 118 -16.120 -1.353 3.259 788 H THR 119 H THR 119 -17.805 -3.164 -1.739 789 HA THR 119 HA THR 119 -19.825 -4.787 -0.718 790 HB THR 119 HB THR 119 -19.634 -4.120 -3.104 791 HG1 THR 119 HG1 THR 119 -20.965 -5.736 -3.346 792 HG21 THR 119 HG21 THR 119 -17.630 -6.357 -3.356 793 HG22 THR 119 HG22 THR 119 -17.172 -4.657 -3.256 794 HG23 THR 119 HG23 THR 119 -18.157 -5.228 -4.604 795 H LYS 207 H LYS 207 7.283 -9.820 15.325 796 HA LYS 207 HA LYS 207 9.359 -8.077 14.166 797 HB2 LYS 207 HB2 LYS 207 8.315 -10.612 12.912 798 HB3 LYS 207 HB3 LYS 207 9.755 -9.702 12.475 799 HG2 LYS 207 HG2 LYS 207 10.451 -10.279 14.953 800 HG3 LYS 207 HG3 LYS 207 9.316 -11.609 14.708 801 HD2 LYS 207 HD2 LYS 207 11.317 -11.082 12.577 802 HD3 LYS 207 HD3 LYS 207 11.888 -11.813 14.079 803 HE2 LYS 207 HE2 LYS 207 9.942 -13.462 13.772 804 HE3 LYS 207 HE3 LYS 207 9.881 -12.869 12.114 805 HZ1 LYS 207 HZ1 LYS 207 12.293 -14.028 13.400 806 HZ2 LYS 207 HZ2 LYS 207 12.143 -13.559 11.783 807 HZ3 LYS 207 HZ3 LYS 207 11.254 -14.874 12.367 808 H SER 208 H SER 208 8.889 -7.739 11.708 809 HA SER 208 HA SER 208 6.264 -7.709 10.736 810 HB2 SER 208 HB2 SER 208 5.386 -6.019 11.950 811 HB3 SER 208 HB3 SER 208 6.969 -5.478 12.505 812 HG SER 208 HG SER 208 5.538 -4.181 10.886 813 H PHE 209 H PHE 209 6.115 -6.843 8.643 814 HA PHE 209 HA PHE 209 8.630 -6.668 7.269 815 HB2 PHE 209 HB2 PHE 209 6.862 -7.826 6.149 816 HB3 PHE 209 HB3 PHE 209 5.765 -6.462 6.339 817 HD1 PHE 209 HD2 PHE 209 8.857 -7.571 4.632 818 HD2 PHE 209 HD1 PHE 209 5.651 -4.772 4.725 819 HE1 PHE 209 HE2 PHE 209 9.541 -6.721 2.427 820 HE2 PHE 209 HE1 PHE 209 6.329 -3.918 2.519 821 HZ PHE 209 HZ PHE 209 8.277 -4.892 1.368 822 H PHE 210 H PHE 210 6.005 -4.441 8.062 823 HA PHE 210 HA PHE 210 6.945 -2.232 6.598 824 HB2 PHE 210 HB2 PHE 210 5.154 -2.493 9.003 825 HB3 PHE 210 HB3 PHE 210 5.573 -0.917 8.340 826 HD1 PHE 210 HD1 PHE 210 5.383 -1.022 5.577 827 HD2 PHE 210 HD2 PHE 210 3.069 -3.203 8.407 828 HE1 PHE 210 HE1 PHE 210 3.573 -1.237 3.925 829 HE2 PHE 210 HE2 PHE 210 1.256 -3.423 6.758 830 HZ PHE 210 HZ PHE 210 1.505 -2.439 4.514 831 H ASP 211 H ASP 211 7.929 -3.600 9.615 832 HA ASP 211 HA ASP 211 9.263 -1.274 10.618 833 HB2 ASP 211 HB2 ASP 211 8.427 -3.452 11.856 834 HB3 ASP 211 HB3 ASP 211 10.044 -4.032 11.466 835 H LYS 212 H LYS 212 10.334 -4.253 9.006 836 HA LYS 212 HA LYS 212 13.083 -3.519 8.953 837 HB2 LYS 212 HB2 LYS 212 13.267 -5.382 7.280 838 HB3 LYS 212 HB3 LYS 212 12.534 -5.841 8.811 839 HG2 LYS 212 HG2 LYS 212 10.343 -5.816 7.839 840 HG3 LYS 212 HG3 LYS 212 10.976 -5.159 6.327 841 HD2 LYS 212 HD2 LYS 212 10.846 -7.375 5.771 842 HD3 LYS 212 HD3 LYS 212 12.484 -7.325 6.425 843 HE2 LYS 212 HE2 LYS 212 10.077 -8.006 8.098 844 HE3 LYS 212 HE3 LYS 212 11.006 -9.222 7.223 845 HZ1 LYS 212 HZ1 LYS 212 11.821 -7.566 9.515 846 HZ2 LYS 212 HZ2 LYS 212 12.994 -8.172 8.458 847 HZ3 LYS 212 HZ3 LYS 212 11.979 -9.236 9.294 848 H LYS 213 H LYS 213 10.358 -2.819 6.940 849 HA LYS 213 HA LYS 213 11.943 -1.992 4.668 850 HB2 LYS 213 HB2 LYS 213 9.800 -2.901 4.160 851 HB3 LYS 213 HB3 LYS 213 8.999 -1.834 5.306 852 HG2 LYS 213 HG2 LYS 213 8.570 -1.078 3.068 853 HG3 LYS 213 HG3 LYS 213 9.605 0.092 3.891 854 HD2 LYS 213 HD2 LYS 213 10.778 -0.056 1.956 855 HD3 LYS 213 HD3 LYS 213 11.494 -1.445 2.778 856 HE2 LYS 213 HE2 LYS 213 9.728 -2.864 1.691 857 HE3 LYS 213 HE3 LYS 213 9.277 -1.452 0.737 858 HZ1 LYS 213 HZ1 LYS 213 11.070 -1.659 -0.566 859 HZ2 LYS 213 HZ2 LYS 213 11.101 -3.258 -0.015 860 HZ3 LYS 213 HZ3 LYS 213 12.097 -2.096 0.706 861 H ARG 214 H ARG 214 9.815 -0.349 7.010 862 HA ARG 214 HA ARG 214 10.243 2.261 6.199 863 HB2 ARG 214 HB2 ARG 214 9.433 2.946 8.327 864 HB3 ARG 214 HB3 ARG 214 8.605 1.444 7.938 865 HG2 ARG 214 HG2 ARG 214 10.073 0.211 9.410 866 HG3 ARG 214 HG3 ARG 214 11.000 1.674 9.748 867 HD2 ARG 214 HD2 ARG 214 9.306 1.013 11.498 868 HD3 ARG 214 HD3 ARG 214 9.188 2.668 10.898 869 HE ARG 214 HE ARG 214 7.497 0.788 9.518 870 HH11 ARG 214 HH11 ARG 214 7.776 2.971 12.217 871 HH12 ARG 214 HH12 ARG 214 6.066 3.190 12.384 872 HH21 ARG 214 HH21 ARG 214 5.243 1.069 9.728 873 HH22 ARG 214 HH22 ARG 214 4.626 2.107 10.969 874 H SER 215 H SER 215 12.324 0.135 8.003 875 HA SER 215 HA SER 215 14.048 2.064 9.124 876 HB2 SER 215 HB2 SER 215 14.375 -0.004 10.089 877 HB3 SER 215 HB3 SER 215 14.218 -0.863 8.556 878 HG SER 215 HG SER 215 16.302 -0.818 8.426 879 H GLU 216 H GLU 216 14.212 0.234 6.085 880 HA GLU 216 HA GLU 216 16.676 1.231 5.198 881 HB2 GLU 216 HB2 GLU 216 14.292 0.057 3.806 882 HB3 GLU 216 HB3 GLU 216 15.634 0.701 2.870 883 HG2 GLU 216 HG2 GLU 216 17.161 -0.832 4.005 884 HG3 GLU 216 HG3 GLU 216 15.811 -1.485 4.932 885 H ARG 217 H ARG 217 13.447 2.560 5.057 886 HA ARG 217 HA ARG 217 14.022 4.605 3.159 887 HB2 ARG 217 HB2 ARG 217 11.728 3.658 3.892 888 HB3 ARG 217 HB3 ARG 217 11.854 4.788 5.233 889 HG2 ARG 217 HG2 ARG 217 12.198 6.597 3.494 890 HG3 ARG 217 HG3 ARG 217 11.696 5.399 2.299 891 HD2 ARG 217 HD2 ARG 217 9.662 5.076 3.904 892 HD3 ARG 217 HD3 ARG 217 10.119 6.674 4.493 893 HE ARG 217 HE ARG 217 8.836 6.058 2.017 894 HH11 ARG 217 HH11 ARG 217 11.002 8.287 3.585 895 HH12 ARG 217 HH12 ARG 217 10.634 9.599 2.514 896 HH21 ARG 217 HH21 ARG 217 8.344 7.777 0.601 897 HH22 ARG 217 HH22 ARG 217 9.122 9.308 0.818 898 H ILE 218 H ILE 218 14.295 4.326 6.631 899 HA ILE 218 HA ILE 218 14.698 7.135 7.079 900 HB ILE 218 HB ILE 218 15.264 4.779 8.884 901 HG12 ILE 218 HG12 ILE 218 13.005 6.703 9.263 902 HG13 ILE 218 HG13 ILE 218 12.839 5.429 8.060 903 HG21 ILE 218 HG21 ILE 218 15.321 7.746 9.366 904 HG22 ILE 218 HG22 ILE 218 15.146 6.575 10.673 905 HG23 ILE 218 HG23 ILE 218 16.593 6.562 9.665 906 HD11 ILE 218 HD11 ILE 218 13.764 4.086 10.272 907 HD12 ILE 218 HD12 ILE 218 12.674 5.296 10.950 908 HD13 ILE 218 HD13 ILE 218 12.090 4.169 9.725 909 H SER 219 H SER 219 16.837 4.290 7.344 910 HA SER 219 HA SER 219 19.191 5.934 7.480 911 HB2 SER 219 HB2 SER 219 20.256 3.534 7.109 912 HB3 SER 219 HB3 SER 219 19.542 3.984 8.657 913 HG SER 219 HG SER 219 17.764 2.795 8.196 914 H ASN 220 H ASN 220 20.700 6.320 5.914 915 HA ASN 220 HA ASN 220 21.490 6.711 3.816 916 HB2 ASN 220 HB2 ASN 220 20.339 4.027 3.063 917 HB3 ASN 220 HB3 ASN 220 21.761 4.825 2.397 918 HD21 ASN 220 HD21 ASN 220 20.534 2.775 4.830 919 HD22 ASN 220 HD22 ASN 220 22.022 2.484 5.658 Start of MODEL 7 1 H ALA 23 H ALA 23 2.838 14.555 13.313 2 HA ALA 23 HA ALA 23 2.192 11.764 14.020 3 HB1 ALA 23 HB1 ALA 23 0.061 12.772 14.980 4 HB2 ALA 23 HB2 ALA 23 1.555 13.055 15.876 5 HB3 ALA 23 HB3 ALA 23 0.878 14.331 14.863 6 H ALA 24 H ALA 24 2.557 12.745 11.350 7 HA ALA 24 HA ALA 24 -0.127 13.024 10.254 8 HB1 ALA 24 HB1 ALA 24 1.609 12.834 8.117 9 HB2 ALA 24 HB2 ALA 24 1.021 14.324 8.854 10 HB3 ALA 24 HB3 ALA 24 2.566 13.639 9.361 11 HA PRO 25 HA PRO 25 -0.709 8.850 9.034 12 HB2 PRO 25 HB2 PRO 25 -1.862 9.115 6.591 13 HB3 PRO 25 HB3 PRO 25 -2.702 9.503 8.096 14 HG2 PRO 25 HG2 PRO 25 -1.342 11.336 6.159 15 HG3 PRO 25 HG3 PRO 25 -2.897 11.538 6.988 16 HD2 PRO 25 HD2 PRO 25 -0.632 12.764 7.822 17 HD3 PRO 25 HD3 PRO 25 -1.906 12.245 8.944 18 H ASN 26 H ASN 26 1.405 8.073 8.817 19 HA ASN 26 HA ASN 26 2.387 7.961 6.044 20 HB2 ASN 26 HB2 ASN 26 4.310 7.881 8.339 21 HB3 ASN 26 HB3 ASN 26 4.584 8.373 6.670 22 HD21 ASN 26 HD21 ASN 26 2.697 10.221 6.218 23 HD22 ASN 26 HD22 ASN 26 2.895 11.572 7.277 24 H LEU 27 H LEU 27 2.940 5.988 5.299 25 HA LEU 27 HA LEU 27 2.620 3.732 7.150 26 HB2 LEU 27 HB2 LEU 27 1.380 4.150 4.813 27 HB3 LEU 27 HB3 LEU 27 2.802 3.285 4.230 28 HG LEU 27 HG LEU 27 2.193 1.471 5.912 29 HD11 LEU 27 HD11 LEU 27 0.629 2.931 7.199 30 HD12 LEU 27 HD12 LEU 27 -0.049 1.377 6.716 31 HD13 LEU 27 HD13 LEU 27 -0.487 2.841 5.836 32 HD21 LEU 27 HD21 LEU 27 -0.012 1.669 3.948 33 HD22 LEU 27 HD22 LEU 27 1.109 0.346 4.269 34 HD23 LEU 27 HD23 LEU 27 1.633 1.734 3.315 35 H ALA 28 H ALA 28 4.478 3.015 7.953 36 HA ALA 28 HA ALA 28 6.648 2.346 8.137 37 HB1 ALA 28 HB1 ALA 28 5.583 1.169 5.816 38 HB2 ALA 28 HB2 ALA 28 7.222 1.679 5.413 39 HB3 ALA 28 HB3 ALA 28 6.944 0.610 6.788 40 H GLY 29 H GLY 29 6.074 5.151 7.391 41 HA2 GLY 29 HA2 GLY 29 7.658 6.908 7.329 42 HA3 GLY 29 HA3 GLY 29 8.791 5.825 6.535 43 H ALA 30 H ALA 30 5.669 5.672 5.227 44 HA ALA 30 HA ALA 30 6.539 7.326 2.953 45 HB1 ALA 30 HB1 ALA 30 4.630 4.998 3.078 46 HB2 ALA 30 HB2 ALA 30 4.868 6.003 1.647 47 HB3 ALA 30 HB3 ALA 30 6.208 5.055 2.292 48 H VAL 31 H VAL 31 5.679 9.296 3.020 49 HA VAL 31 HA VAL 31 3.076 9.737 4.246 50 HB VAL 31 HB VAL 31 4.903 11.786 2.992 51 HG11 VAL 31 HG11 VAL 31 3.461 13.355 3.682 52 HG12 VAL 31 HG12 VAL 31 2.297 12.032 3.778 53 HG13 VAL 31 HG13 VAL 31 3.170 12.545 5.221 54 HG21 VAL 31 HG21 VAL 31 5.106 12.060 5.727 55 HG22 VAL 31 HG22 VAL 31 5.140 10.314 5.491 56 HG23 VAL 31 HG23 VAL 31 6.314 11.338 4.666 57 H GLU 32 H GLU 32 4.594 9.799 1.083 58 HA GLU 32 HA GLU 32 2.389 11.012 -0.266 59 HB2 GLU 32 HB2 GLU 32 4.543 9.290 -1.493 60 HB3 GLU 32 HB3 GLU 32 3.559 10.506 -2.296 61 HG2 GLU 32 HG2 GLU 32 4.629 12.251 -0.953 62 HG3 GLU 32 HG3 GLU 32 5.629 11.026 -0.172 63 H PHE 33 H PHE 33 0.793 10.069 -1.514 64 HA PHE 33 HA PHE 33 -0.282 7.645 -0.620 65 HB2 PHE 33 HB2 PHE 33 -1.809 9.160 -1.576 66 HB3 PHE 33 HB3 PHE 33 -0.828 9.369 -3.024 67 HD1 PHE 33 HD1 PHE 33 -2.960 6.943 -1.211 68 HD2 PHE 33 HD2 PHE 33 -1.192 8.053 -4.920 69 HE1 PHE 33 HE1 PHE 33 -4.302 5.230 -2.360 70 HE2 PHE 33 HE2 PHE 33 -2.532 6.344 -6.075 71 HZ PHE 33 HZ PHE 33 -4.089 4.929 -4.795 72 H SER 34 H SER 34 1.337 8.392 -3.704 73 HA SER 34 HA SER 34 1.255 5.885 -4.856 74 HB2 SER 34 HB2 SER 34 3.407 6.599 -6.019 75 HB3 SER 34 HB3 SER 34 2.041 7.702 -6.176 76 HG SER 34 HG SER 34 3.269 9.158 -5.319 77 H ASP 35 H ASP 35 3.461 7.131 -2.418 78 HA ASP 35 HA ASP 35 5.219 4.878 -2.475 79 HB2 ASP 35 HB2 ASP 35 5.773 7.221 -1.640 80 HB3 ASP 35 HB3 ASP 35 4.878 6.807 -0.181 81 H VAL 36 H VAL 36 2.281 5.692 -0.789 82 HA VAL 36 HA VAL 36 2.499 3.703 1.244 83 HB VAL 36 HB VAL 36 0.048 5.119 0.188 84 HG11 VAL 36 HG11 VAL 36 -0.284 4.355 2.872 85 HG12 VAL 36 HG12 VAL 36 -1.139 3.736 1.458 86 HG13 VAL 36 HG13 VAL 36 0.328 2.937 2.024 87 HG21 VAL 36 HG21 VAL 36 1.064 5.836 2.830 88 HG22 VAL 36 HG22 VAL 36 2.185 6.208 1.521 89 HG23 VAL 36 HG23 VAL 36 0.550 6.868 1.494 90 H LYS 37 H LYS 37 0.464 3.902 -1.680 91 HA LYS 37 HA LYS 37 -0.611 1.337 -1.536 92 HB2 LYS 37 HB2 LYS 37 -0.931 1.592 -4.033 93 HB3 LYS 37 HB3 LYS 37 -1.599 2.882 -3.042 94 HG2 LYS 37 HG2 LYS 37 -0.015 4.411 -3.724 95 HG3 LYS 37 HG3 LYS 37 1.143 3.162 -4.187 96 HD2 LYS 37 HD2 LYS 37 -1.314 2.960 -5.707 97 HD3 LYS 37 HD3 LYS 37 -0.573 4.554 -5.875 98 HE2 LYS 37 HE2 LYS 37 1.567 3.449 -6.450 99 HE3 LYS 37 HE3 LYS 37 0.748 1.889 -6.379 100 HZ1 LYS 37 HZ1 LYS 37 0.583 3.985 -8.400 101 HZ2 LYS 37 HZ2 LYS 37 -0.843 3.138 -8.065 102 HZ3 LYS 37 HZ3 LYS 37 0.536 2.303 -8.578 103 H THR 38 H THR 38 2.461 2.454 -2.794 104 HA THR 38 HA THR 38 3.179 0.113 -4.200 105 HB THR 38 HB THR 38 4.908 2.252 -2.949 106 HG1 THR 38 HG1 THR 38 4.572 3.270 -4.779 107 HG21 THR 38 HG21 THR 38 6.696 1.383 -4.432 108 HG22 THR 38 HG22 THR 38 5.661 0.011 -4.828 109 HG23 THR 38 HG23 THR 38 6.230 0.238 -3.174 110 H LEU 39 H LEU 39 3.619 1.122 -0.850 111 HA LEU 39 HA LEU 39 5.301 -1.051 -0.113 112 HB2 LEU 39 HB2 LEU 39 3.583 0.804 1.524 113 HB3 LEU 39 HB3 LEU 39 4.682 -0.387 2.218 114 HG LEU 39 HG LEU 39 5.714 1.701 0.337 115 HD11 LEU 39 HD11 LEU 39 5.011 2.042 3.235 116 HD12 LEU 39 HD12 LEU 39 4.607 3.083 1.872 117 HD13 LEU 39 HD13 LEU 39 6.269 3.001 2.456 118 HD21 LEU 39 HD21 LEU 39 7.666 0.785 0.856 119 HD22 LEU 39 HD22 LEU 39 6.819 -0.432 1.811 120 HD23 LEU 39 HD23 LEU 39 7.372 1.059 2.574 121 H LEU 40 H LEU 40 1.826 -0.514 -0.090 122 HA LEU 40 HA LEU 40 1.183 -2.866 1.386 123 HB2 LEU 40 HB2 LEU 40 -0.578 -1.341 -0.522 124 HB3 LEU 40 HB3 LEU 40 -1.098 -2.429 0.763 125 HG LEU 40 HG LEU 40 0.433 0.075 1.385 126 HD11 LEU 40 HD11 LEU 40 -1.358 1.426 1.185 127 HD12 LEU 40 HD12 LEU 40 -2.502 0.154 1.611 128 HD13 LEU 40 HD13 LEU 40 -1.853 0.243 -0.026 129 HD21 LEU 40 HD21 LEU 40 -1.414 -1.763 2.887 130 HD22 LEU 40 HD22 LEU 40 -0.966 -0.165 3.484 131 HD23 LEU 40 HD23 LEU 40 0.277 -1.391 3.226 132 H LYS 41 H LYS 41 1.255 -2.064 -2.065 133 HA LYS 41 HA LYS 41 0.203 -4.383 -3.129 134 HB2 LYS 41 HB2 LYS 41 1.146 -2.176 -4.239 135 HB3 LYS 41 HB3 LYS 41 2.590 -3.159 -4.444 136 HG2 LYS 41 HG2 LYS 41 0.966 -4.889 -5.481 137 HG3 LYS 41 HG3 LYS 41 -0.118 -3.506 -5.652 138 HD2 LYS 41 HD2 LYS 41 1.011 -3.519 -7.678 139 HD3 LYS 41 HD3 LYS 41 1.931 -2.345 -6.733 140 HE2 LYS 41 HE2 LYS 41 3.633 -3.954 -6.263 141 HE3 LYS 41 HE3 LYS 41 2.666 -5.258 -6.952 142 HZ1 LYS 41 HZ1 LYS 41 3.023 -3.197 -8.854 143 HZ2 LYS 41 HZ2 LYS 41 3.485 -4.822 -8.947 144 HZ3 LYS 41 HZ3 LYS 41 4.529 -3.683 -8.255 145 H GLU 42 H GLU 42 3.570 -3.728 -2.207 146 HA GLU 42 HA GLU 42 4.449 -6.369 -2.915 147 HB2 GLU 42 HB2 GLU 42 6.582 -5.689 -1.885 148 HB3 GLU 42 HB3 GLU 42 6.001 -4.506 -3.049 149 HG2 GLU 42 HG2 GLU 42 5.128 -3.149 -1.187 150 HG3 GLU 42 HG3 GLU 42 5.811 -4.311 -0.052 151 H TRP 43 H TRP 43 3.627 -4.680 0.077 152 HA TRP 43 HA TRP 43 4.415 -6.701 1.866 153 HB2 TRP 43 HB2 TRP 43 4.009 -4.510 2.728 154 HB3 TRP 43 HB3 TRP 43 2.365 -4.498 2.094 155 HD1 TRP 43 HD1 TRP 43 4.342 -6.734 4.596 156 HE1 TRP 43 HE1 TRP 43 2.790 -7.242 6.586 157 HE3 TRP 43 HE3 TRP 43 0.163 -4.245 3.021 158 HZ2 TRP 43 HZ2 TRP 43 0.144 -6.664 7.381 159 HZ3 TRP 43 HZ3 TRP 43 -1.836 -4.272 4.455 160 HH2 TRP 43 HH2 TRP 43 -1.844 -5.457 6.590 161 H ILE 44 H ILE 44 1.850 -6.577 -0.348 162 HA ILE 44 HA ILE 44 0.303 -8.595 1.117 163 HB ILE 44 HB ILE 44 -0.417 -6.992 -1.341 164 HG12 ILE 44 HG12 ILE 44 -1.813 -6.885 1.314 165 HG13 ILE 44 HG13 ILE 44 -0.348 -5.945 1.050 166 HG21 ILE 44 HG21 ILE 44 -1.920 -9.129 0.149 167 HG22 ILE 44 HG22 ILE 44 -2.706 -7.973 -0.924 168 HG23 ILE 44 HG23 ILE 44 -1.496 -9.086 -1.562 169 HD11 ILE 44 HD11 ILE 44 -1.381 -4.733 -0.734 170 HD12 ILE 44 HD12 ILE 44 -2.807 -5.769 -0.672 171 HD13 ILE 44 HD13 ILE 44 -2.444 -4.686 0.672 172 H THR 45 H THR 45 2.547 -8.258 -1.408 173 HA THR 45 HA THR 45 1.745 -10.785 -2.662 174 HB THR 45 HB THR 45 3.377 -10.238 -4.420 175 HG1 THR 45 HG1 THR 45 4.277 -8.048 -4.319 176 HG21 THR 45 HG21 THR 45 1.142 -8.427 -3.706 177 HG22 THR 45 HG22 THR 45 1.383 -9.416 -5.146 178 HG23 THR 45 HG23 THR 45 2.235 -7.881 -4.978 179 H THR 46 H THR 46 4.727 -9.200 -1.508 180 HA THR 46 HA THR 46 6.281 -11.559 -1.515 181 HB THR 46 HB THR 46 7.213 -9.233 -1.511 182 HG1 THR 46 HG1 THR 46 8.962 -9.824 -0.089 183 HG21 THR 46 HG21 THR 46 6.713 -7.799 0.118 184 HG22 THR 46 HG22 THR 46 7.386 -8.899 1.322 185 HG23 THR 46 HG23 THR 46 5.689 -9.027 0.862 186 H ILE 47 H ILE 47 3.837 -10.495 0.573 187 HA ILE 47 HA ILE 47 4.622 -12.526 2.553 188 HB ILE 47 HB ILE 47 3.429 -9.817 3.150 189 HG12 ILE 47 HG12 ILE 47 5.784 -10.535 4.652 190 HG13 ILE 47 HG13 ILE 47 6.103 -10.678 2.927 191 HG21 ILE 47 HG21 ILE 47 3.856 -12.225 4.899 192 HG22 ILE 47 HG22 ILE 47 3.663 -10.598 5.546 193 HG23 ILE 47 HG23 ILE 47 2.361 -11.334 4.612 194 HD11 ILE 47 HD11 ILE 47 5.634 -8.296 4.575 195 HD12 ILE 47 HD12 ILE 47 6.602 -8.502 3.115 196 HD13 ILE 47 HD13 ILE 47 4.855 -8.293 2.993 197 H SER 48 H SER 48 3.109 -14.005 2.936 198 HA SER 48 HA SER 48 0.388 -13.490 1.946 199 HB2 SER 48 HB2 SER 48 0.320 -15.612 1.173 200 HB3 SER 48 HB3 SER 48 2.073 -15.577 1.358 201 HG SER 48 HG SER 48 1.885 -16.608 3.302 202 H ASP 49 H ASP 49 2.263 -14.298 4.743 203 HA ASP 49 HA ASP 49 -0.211 -14.559 6.323 204 HB2 ASP 49 HB2 ASP 49 1.197 -15.755 8.001 205 HB3 ASP 49 HB3 ASP 49 1.086 -16.590 6.454 206 HA PRO 50 HA PRO 50 1.671 -10.535 7.555 207 HB2 PRO 50 HB2 PRO 50 -0.712 -9.272 7.867 208 HB3 PRO 50 HB3 PRO 50 0.110 -9.399 6.307 209 HG2 PRO 50 HG2 PRO 50 -2.146 -11.037 7.398 210 HG3 PRO 50 HG3 PRO 50 -1.932 -10.371 5.769 211 HD2 PRO 50 HD2 PRO 50 -1.410 -12.961 6.364 212 HD3 PRO 50 HD3 PRO 50 -0.506 -12.065 5.127 213 H MET 51 H MET 51 1.804 -9.630 9.601 214 HA MET 51 HA MET 51 0.592 -11.225 11.737 215 HB2 MET 51 HB2 MET 51 3.015 -9.480 11.545 216 HB3 MET 51 HB3 MET 51 2.284 -9.764 13.120 217 HG2 MET 51 HG2 MET 51 3.009 -11.882 13.225 218 HG3 MET 51 HG3 MET 51 2.729 -12.173 11.509 219 HE1 MET 51 HE1 MET 51 4.926 -9.638 13.597 220 HE2 MET 51 HE2 MET 51 5.270 -11.233 14.266 221 HE3 MET 51 HE3 MET 51 6.522 -10.358 13.382 222 H GLU 52 H GLU 52 -0.403 -10.229 13.551 223 HA GLU 52 HA GLU 52 -2.252 -8.246 12.969 224 HB2 GLU 52 HB2 GLU 52 -2.350 -9.871 14.881 225 HB3 GLU 52 HB3 GLU 52 -1.172 -8.872 15.720 226 HG2 GLU 52 HG2 GLU 52 -2.667 -7.138 16.035 227 HG3 GLU 52 HG3 GLU 52 -3.719 -7.673 14.724 228 H GLU 53 H GLU 53 1.036 -7.976 14.078 229 HA GLU 53 HA GLU 53 0.886 -5.274 14.962 230 HB2 GLU 53 HB2 GLU 53 2.701 -7.150 15.372 231 HB3 GLU 53 HB3 GLU 53 3.437 -6.445 13.940 232 HG2 GLU 53 HG2 GLU 53 2.772 -4.995 16.491 233 HG3 GLU 53 HG3 GLU 53 4.376 -5.492 15.958 234 H ASP 54 H ASP 54 1.824 -6.818 11.921 235 HA ASP 54 HA ASP 54 2.612 -4.417 10.621 236 HB2 ASP 54 HB2 ASP 54 2.168 -7.238 9.846 237 HB3 ASP 54 HB3 ASP 54 1.980 -6.053 8.556 238 H ILE 55 H ILE 55 -0.378 -6.329 10.585 239 HA ILE 55 HA ILE 55 -1.760 -4.726 8.724 240 HB ILE 55 HB ILE 55 -2.969 -6.383 10.940 241 HG12 ILE 55 HG12 ILE 55 -2.320 -7.217 8.106 242 HG13 ILE 55 HG13 ILE 55 -1.342 -7.635 9.508 243 HG21 ILE 55 HG21 ILE 55 -4.130 -5.640 8.262 244 HG22 ILE 55 HG22 ILE 55 -4.941 -6.456 9.597 245 HG23 ILE 55 HG23 ILE 55 -4.464 -4.766 9.758 246 HD11 ILE 55 HD11 ILE 55 -2.573 -9.469 9.659 247 HD12 ILE 55 HD12 ILE 55 -3.892 -8.435 10.209 248 HD13 ILE 55 HD13 ILE 55 -3.755 -8.858 8.503 249 H LEU 56 H LEU 56 -1.314 -4.488 12.189 250 HA LEU 56 HA LEU 56 -3.355 -2.636 12.749 251 HB2 LEU 56 HB2 LEU 56 -0.913 -3.604 14.077 252 HB3 LEU 56 HB3 LEU 56 -1.459 -2.003 14.573 253 HG LEU 56 HG LEU 56 -3.083 -4.543 14.712 254 HD11 LEU 56 HD11 LEU 56 -1.735 -2.914 16.860 255 HD12 LEU 56 HD12 LEU 56 -1.308 -4.547 16.351 256 HD13 LEU 56 HD13 LEU 56 -2.853 -4.248 17.147 257 HD21 LEU 56 HD21 LEU 56 -3.693 -1.685 15.413 258 HD22 LEU 56 HD22 LEU 56 -4.572 -3.040 16.121 259 HD23 LEU 56 HD23 LEU 56 -4.605 -2.782 14.377 260 H GLN 57 H GLN 57 -0.015 -2.218 11.692 261 HA GLN 57 HA GLN 57 0.266 0.517 12.026 262 HB2 GLN 57 HB2 GLN 57 1.441 -1.478 10.144 263 HB3 GLN 57 HB3 GLN 57 1.718 0.230 9.829 264 HG2 GLN 57 HG2 GLN 57 2.303 -1.029 12.489 265 HG3 GLN 57 HG3 GLN 57 3.477 -0.995 11.174 266 HE21 GLN 57 HE21 GLN 57 4.912 0.539 11.460 267 HE22 GLN 57 HE22 GLN 57 4.610 2.118 12.093 268 H VAL 58 H VAL 58 -1.499 -1.265 9.599 269 HA VAL 58 HA VAL 58 -1.861 0.910 7.791 270 HB VAL 58 HB VAL 58 -3.655 -1.500 8.055 271 HG11 VAL 58 HG11 VAL 58 -3.248 -0.780 5.381 272 HG12 VAL 58 HG12 VAL 58 -4.710 -0.556 6.343 273 HG13 VAL 58 HG13 VAL 58 -3.509 0.732 6.250 274 HG21 VAL 58 HG21 VAL 58 -0.871 -1.278 7.106 275 HG22 VAL 58 HG22 VAL 58 -1.747 -2.671 7.740 276 HG23 VAL 58 HG23 VAL 58 -1.973 -2.176 6.063 277 H VAL 59 H VAL 59 -3.634 -0.328 10.556 278 HA VAL 59 HA VAL 59 -6.022 1.126 10.162 279 HB VAL 59 HB VAL 59 -4.806 0.130 12.743 280 HG11 VAL 59 HG11 VAL 59 -6.436 1.807 13.251 281 HG12 VAL 59 HG12 VAL 59 -7.582 1.114 12.102 282 HG13 VAL 59 HG13 VAL 59 -7.159 0.230 13.568 283 HG21 VAL 59 HG21 VAL 59 -5.810 -1.296 10.560 284 HG22 VAL 59 HG22 VAL 59 -5.479 -1.914 12.179 285 HG23 VAL 59 HG23 VAL 59 -7.092 -1.328 11.772 286 H ARG 60 H ARG 60 -3.203 1.793 12.240 287 HA ARG 60 HA ARG 60 -4.081 4.258 13.223 288 HB2 ARG 60 HB2 ARG 60 -1.248 3.311 12.751 289 HB3 ARG 60 HB3 ARG 60 -1.707 4.682 13.752 290 HG2 ARG 60 HG2 ARG 60 -2.891 2.019 14.349 291 HG3 ARG 60 HG3 ARG 60 -1.215 2.333 14.805 292 HD2 ARG 60 HD2 ARG 60 -3.613 3.979 15.605 293 HD3 ARG 60 HD3 ARG 60 -2.744 2.845 16.638 294 HE ARG 60 HE ARG 60 -0.885 4.677 15.706 295 HH11 ARG 60 HH11 ARG 60 -3.764 4.684 17.663 296 HH12 ARG 60 HH12 ARG 60 -3.268 6.040 18.621 297 HH21 ARG 60 HH21 ARG 60 -0.220 6.464 16.959 298 HH22 ARG 60 HH22 ARG 60 -1.252 7.052 18.218 299 H TYR 61 H TYR 61 -2.725 3.382 10.163 300 HA TYR 61 HA TYR 61 -1.902 6.016 9.404 301 HB2 TYR 61 HB2 TYR 61 -0.807 4.203 8.317 302 HB3 TYR 61 HB3 TYR 61 -2.336 3.464 7.854 303 HD1 TYR 61 HD2 TYR 61 -0.039 6.274 7.172 304 HD2 TYR 61 HD1 TYR 61 -3.470 4.123 5.865 305 HE1 TYR 61 HE2 TYR 61 0.062 7.438 5.008 306 HE2 TYR 61 HE1 TYR 61 -3.378 5.281 3.698 307 HH TYR 61 HH TYR 61 -1.392 6.449 2.318 308 H CYS 62 H CYS 62 -4.637 3.935 8.463 309 HA CYS 62 HA CYS 62 -5.926 5.908 6.898 310 HB2 CYS 62 HB2 CYS 62 -6.815 3.311 8.125 311 HB3 CYS 62 HB3 CYS 62 -7.964 4.357 7.298 312 HG CYS 62 HG CYS 62 -5.314 2.678 5.968 313 H THR 63 H THR 63 -6.411 4.808 10.236 314 HA THR 63 HA THR 63 -8.635 6.315 10.900 315 HB THR 63 HB THR 63 -7.762 6.263 13.256 316 HG1 THR 63 HG1 THR 63 -5.703 5.899 13.527 317 HG21 THR 63 HG21 THR 63 -8.471 4.075 11.541 318 HG22 THR 63 HG22 THR 63 -8.833 4.309 13.251 319 HG23 THR 63 HG23 THR 63 -7.332 3.522 12.767 320 H ASP 64 H ASP 64 -5.329 7.314 10.486 321 HA ASP 64 HA ASP 64 -5.585 9.824 11.829 322 HB2 ASP 64 HB2 ASP 64 -3.539 8.568 10.040 323 HB3 ASP 64 HB3 ASP 64 -3.457 10.299 10.358 324 H LEU 65 H LEU 65 -5.903 8.727 8.497 325 HA LEU 65 HA LEU 65 -5.988 11.157 7.173 326 HB2 LEU 65 HB2 LEU 65 -6.797 8.434 6.652 327 HB3 LEU 65 HB3 LEU 65 -7.930 9.580 5.938 328 HG LEU 65 HG LEU 65 -6.246 10.531 4.569 329 HD11 LEU 65 HD11 LEU 65 -4.429 9.292 6.528 330 HD12 LEU 65 HD12 LEU 65 -4.281 10.805 5.634 331 HD13 LEU 65 HD13 LEU 65 -3.884 9.275 4.851 332 HD21 LEU 65 HD21 LEU 65 -6.667 8.783 3.251 333 HD22 LEU 65 HD22 LEU 65 -6.656 7.653 4.606 334 HD23 LEU 65 HD23 LEU 65 -5.140 8.116 3.829 335 H ILE 66 H ILE 66 -8.402 9.621 9.169 336 HA ILE 66 HA ILE 66 -10.618 11.191 8.359 337 HB ILE 66 HB ILE 66 -10.057 9.589 10.843 338 HG12 ILE 66 HG12 ILE 66 -12.378 9.027 9.112 339 HG13 ILE 66 HG13 ILE 66 -10.810 8.815 8.341 340 HG21 ILE 66 HG21 ILE 66 -11.444 11.211 11.748 341 HG22 ILE 66 HG22 ILE 66 -12.356 11.409 10.253 342 HG23 ILE 66 HG23 ILE 66 -12.585 9.967 11.241 343 HD11 ILE 66 HD11 ILE 66 -10.152 7.294 10.149 344 HD12 ILE 66 HD12 ILE 66 -11.753 7.479 10.866 345 HD13 ILE 66 HD13 ILE 66 -11.578 6.732 9.278 346 H GLU 67 H GLU 67 -8.338 11.479 11.072 347 HA GLU 67 HA GLU 67 -9.510 13.885 12.069 348 HB2 GLU 67 HB2 GLU 67 -6.713 12.889 12.605 349 HB3 GLU 67 HB3 GLU 67 -7.688 13.946 13.617 350 HG2 GLU 67 HG2 GLU 67 -8.235 11.042 13.040 351 HG3 GLU 67 HG3 GLU 67 -7.583 11.706 14.537 352 H GLU 68 H GLU 68 -7.064 13.124 9.720 353 HA GLU 68 HA GLU 68 -6.104 15.866 9.594 354 HB2 GLU 68 HB2 GLU 68 -5.365 13.358 8.089 355 HB3 GLU 68 HB3 GLU 68 -4.687 14.934 7.707 356 HG2 GLU 68 HG2 GLU 68 -4.374 13.357 10.242 357 HG3 GLU 68 HG3 GLU 68 -3.125 13.818 9.085 358 H LYS 69 H LYS 69 -8.617 14.065 8.285 359 HA LYS 69 HA LYS 69 -10.183 14.503 6.693 360 HB2 LYS 69 HB2 LYS 69 -8.888 17.204 6.343 361 HB3 LYS 69 HB3 LYS 69 -10.555 16.756 6.007 362 HG2 LYS 69 HG2 LYS 69 -9.322 16.784 8.753 363 HG3 LYS 69 HG3 LYS 69 -10.273 18.102 8.064 364 HD2 LYS 69 HD2 LYS 69 -12.039 16.203 7.668 365 HD3 LYS 69 HD3 LYS 69 -11.143 15.389 8.952 366 HE2 LYS 69 HE2 LYS 69 -11.486 17.324 10.411 367 HE3 LYS 69 HE3 LYS 69 -12.376 18.138 9.126 368 HZ1 LYS 69 HZ1 LYS 69 -14.214 17.045 9.661 369 HZ2 LYS 69 HZ2 LYS 69 -13.422 16.486 11.047 370 HZ3 LYS 69 HZ3 LYS 69 -13.431 15.545 9.642 371 H ASP 70 H ASP 70 -7.930 13.106 5.900 372 HA ASP 70 HA ASP 70 -7.441 14.125 3.180 373 HB2 ASP 70 HB2 ASP 70 -5.730 12.570 5.082 374 HB3 ASP 70 HB3 ASP 70 -5.485 12.376 3.349 375 H LEU 71 H LEU 71 -9.799 12.701 3.887 376 HA LEU 71 HA LEU 71 -9.725 9.960 3.399 377 HB2 LEU 71 HB2 LEU 71 -11.948 11.773 2.503 378 HB3 LEU 71 HB3 LEU 71 -12.055 10.084 2.994 379 HG LEU 71 HG LEU 71 -11.512 12.446 4.790 380 HD11 LEU 71 HD11 LEU 71 -13.894 11.720 3.797 381 HD12 LEU 71 HD12 LEU 71 -13.680 12.393 5.413 382 HD13 LEU 71 HD13 LEU 71 -13.816 10.649 5.196 383 HD21 LEU 71 HD21 LEU 71 -11.714 10.754 6.610 384 HD22 LEU 71 HD22 LEU 71 -10.268 10.576 5.615 385 HD23 LEU 71 HD23 LEU 71 -11.641 9.493 5.379 386 H GLU 72 H GLU 72 -9.185 12.574 1.269 387 HA GLU 72 HA GLU 72 -10.056 11.683 -1.182 388 HB2 GLU 72 HB2 GLU 72 -9.043 13.848 -0.974 389 HB3 GLU 72 HB3 GLU 72 -7.514 13.144 -0.466 390 HG2 GLU 72 HG2 GLU 72 -6.997 12.407 -2.606 391 HG3 GLU 72 HG3 GLU 72 -8.669 12.514 -3.151 392 H LYS 73 H LYS 73 -6.881 10.998 0.287 393 HA LYS 73 HA LYS 73 -6.237 9.054 -1.734 394 HB2 LYS 73 HB2 LYS 73 -4.183 8.716 -0.480 395 HB3 LYS 73 HB3 LYS 73 -4.498 10.436 -0.659 396 HG2 LYS 73 HG2 LYS 73 -5.683 10.028 1.703 397 HG3 LYS 73 HG3 LYS 73 -4.462 8.754 1.765 398 HD2 LYS 73 HD2 LYS 73 -3.117 10.998 0.798 399 HD3 LYS 73 HD3 LYS 73 -4.162 11.610 2.082 400 HE2 LYS 73 HE2 LYS 73 -2.960 10.610 3.687 401 HE3 LYS 73 HE3 LYS 73 -2.799 9.117 2.764 402 HZ1 LYS 73 HZ1 LYS 73 -1.223 10.882 1.424 403 HZ2 LYS 73 HZ2 LYS 73 -0.683 9.709 2.516 404 HZ3 LYS 73 HZ3 LYS 73 -0.956 11.293 3.043 405 H LEU 74 H LEU 74 -7.811 9.038 1.324 406 HA LEU 74 HA LEU 74 -7.326 6.470 2.252 407 HB2 LEU 74 HB2 LEU 74 -8.583 8.240 3.450 408 HB3 LEU 74 HB3 LEU 74 -9.947 7.954 2.371 409 HG LEU 74 HG LEU 74 -10.086 5.633 3.254 410 HD11 LEU 74 HD11 LEU 74 -8.861 4.964 5.170 411 HD12 LEU 74 HD12 LEU 74 -8.170 6.573 5.374 412 HD13 LEU 74 HD13 LEU 74 -7.688 5.575 4.003 413 HD21 LEU 74 HD21 LEU 74 -11.615 7.180 4.160 414 HD22 LEU 74 HD22 LEU 74 -10.368 7.972 5.123 415 HD23 LEU 74 HD23 LEU 74 -10.909 6.346 5.545 416 H ASP 75 H ASP 75 -10.080 7.514 0.236 417 HA ASP 75 HA ASP 75 -11.129 4.979 -0.250 418 HB2 ASP 75 HB2 ASP 75 -11.465 7.662 -1.337 419 HB3 ASP 75 HB3 ASP 75 -11.677 6.415 -2.562 420 H LEU 76 H LEU 76 -8.407 6.606 -1.665 421 HA LEU 76 HA LEU 76 -8.202 4.895 -3.957 422 HB2 LEU 76 HB2 LEU 76 -6.100 6.663 -2.717 423 HB3 LEU 76 HB3 LEU 76 -6.071 5.978 -4.341 424 HG LEU 76 HG LEU 76 -8.108 7.987 -3.384 425 HD11 LEU 76 HD11 LEU 76 -6.173 8.865 -5.371 426 HD12 LEU 76 HD12 LEU 76 -5.437 8.478 -3.817 427 HD13 LEU 76 HD13 LEU 76 -6.737 9.665 -3.903 428 HD21 LEU 76 HD21 LEU 76 -8.844 6.555 -5.231 429 HD22 LEU 76 HD22 LEU 76 -7.404 7.000 -6.147 430 HD23 LEU 76 HD23 LEU 76 -8.612 8.224 -5.754 431 H VAL 77 H VAL 77 -6.585 5.102 -0.810 432 HA VAL 77 HA VAL 77 -4.809 2.930 -1.284 433 HB VAL 77 HB VAL 77 -5.734 4.123 1.334 434 HG11 VAL 77 HG11 VAL 77 -3.157 3.002 1.546 435 HG12 VAL 77 HG12 VAL 77 -4.641 2.474 2.341 436 HG13 VAL 77 HG13 VAL 77 -4.182 1.788 0.782 437 HG21 VAL 77 HG21 VAL 77 -3.091 4.599 0.002 438 HG22 VAL 77 HG22 VAL 77 -4.502 5.576 -0.401 439 HG23 VAL 77 HG23 VAL 77 -3.891 5.549 1.254 440 H ILE 78 H ILE 78 -7.973 3.221 0.262 441 HA ILE 78 HA ILE 78 -8.120 0.602 1.283 442 HB ILE 78 HB ILE 78 -10.302 2.522 0.474 443 HG12 ILE 78 HG12 ILE 78 -8.909 3.246 2.358 444 HG13 ILE 78 HG13 ILE 78 -10.536 2.845 2.899 445 HG21 ILE 78 HG21 ILE 78 -11.243 0.330 0.330 446 HG22 ILE 78 HG22 ILE 78 -10.503 -0.145 1.857 447 HG23 ILE 78 HG23 ILE 78 -11.794 1.056 1.840 448 HD11 ILE 78 HD11 ILE 78 -8.948 0.508 3.096 449 HD12 ILE 78 HD12 ILE 78 -8.064 1.844 3.834 450 HD13 ILE 78 HD13 ILE 78 -9.692 1.452 4.386 451 H LYS 79 H LYS 79 -9.559 1.976 -1.678 452 HA LYS 79 HA LYS 79 -10.527 -0.469 -2.680 453 HB2 LYS 79 HB2 LYS 79 -10.975 0.690 -4.697 454 HB3 LYS 79 HB3 LYS 79 -11.192 1.868 -3.408 455 HG2 LYS 79 HG2 LYS 79 -9.913 3.180 -4.685 456 HG3 LYS 79 HG3 LYS 79 -8.573 2.235 -4.031 457 HD2 LYS 79 HD2 LYS 79 -8.108 1.961 -6.235 458 HD3 LYS 79 HD3 LYS 79 -9.266 0.639 -6.063 459 HE2 LYS 79 HE2 LYS 79 -10.953 1.807 -7.125 460 HE3 LYS 79 HE3 LYS 79 -10.238 3.376 -6.761 461 HZ1 LYS 79 HZ1 LYS 79 -9.993 2.882 -9.088 462 HZ2 LYS 79 HZ2 LYS 79 -9.235 1.409 -8.746 463 HZ3 LYS 79 HZ3 LYS 79 -8.467 2.865 -8.358 464 H TYR 80 H TYR 80 -7.385 0.980 -2.727 465 HA TYR 80 HA TYR 80 -6.367 -0.627 -4.886 466 HB2 TYR 80 HB2 TYR 80 -5.401 1.569 -4.440 467 HB3 TYR 80 HB3 TYR 80 -4.936 1.060 -2.821 468 HD1 TYR 80 HD1 TYR 80 -3.150 -0.658 -2.539 469 HD2 TYR 80 HD2 TYR 80 -4.059 1.043 -6.332 470 HE1 TYR 80 HE1 TYR 80 -0.985 -1.443 -3.404 471 HE2 TYR 80 HE2 TYR 80 -1.898 0.261 -7.207 472 HH TYR 80 HH TYR 80 0.054 -0.693 -6.711 473 H MET 81 H MET 81 -6.142 -0.660 -1.349 474 HA MET 81 HA MET 81 -4.461 -2.976 -1.271 475 HB2 MET 81 HB2 MET 81 -4.642 -2.846 1.088 476 HB3 MET 81 HB3 MET 81 -4.618 -1.183 0.515 477 HG2 MET 81 HG2 MET 81 -6.973 -0.967 0.830 478 HG3 MET 81 HG3 MET 81 -7.135 -2.686 1.178 479 HE1 MET 81 HE1 MET 81 -6.296 0.689 2.077 480 HE2 MET 81 HE2 MET 81 -6.406 0.742 3.837 481 HE3 MET 81 HE3 MET 81 -4.851 0.444 3.059 482 H LYS 82 H LYS 82 -7.904 -2.375 -1.188 483 HA LYS 82 HA LYS 82 -8.672 -4.964 -0.290 484 HB2 LYS 82 HB2 LYS 82 -10.861 -4.272 -0.607 485 HB3 LYS 82 HB3 LYS 82 -10.032 -2.743 -0.351 486 HG2 LYS 82 HG2 LYS 82 -11.245 -2.180 -2.176 487 HG3 LYS 82 HG3 LYS 82 -9.832 -2.848 -2.995 488 HD2 LYS 82 HD2 LYS 82 -11.513 -3.955 -4.097 489 HD3 LYS 82 HD3 LYS 82 -11.183 -5.096 -2.792 490 HE2 LYS 82 HE2 LYS 82 -13.130 -4.607 -1.691 491 HE3 LYS 82 HE3 LYS 82 -13.201 -2.963 -2.321 492 HZ1 LYS 82 HZ1 LYS 82 -14.138 -3.661 -4.285 493 HZ2 LYS 82 HZ2 LYS 82 -14.848 -4.734 -3.189 494 HZ3 LYS 82 HZ3 LYS 82 -13.552 -5.241 -4.150 495 H ARG 83 H ARG 83 -7.974 -3.561 -3.415 496 HA ARG 83 HA ARG 83 -9.099 -5.672 -4.965 497 HB2 ARG 83 HB2 ARG 83 -8.456 -4.461 -6.778 498 HB3 ARG 83 HB3 ARG 83 -8.303 -3.187 -5.575 499 HG2 ARG 83 HG2 ARG 83 -5.869 -3.958 -5.353 500 HG3 ARG 83 HG3 ARG 83 -6.149 -4.812 -6.872 501 HD2 ARG 83 HD2 ARG 83 -6.710 -2.757 -7.986 502 HD3 ARG 83 HD3 ARG 83 -6.639 -1.866 -6.465 503 HE ARG 83 HE ARG 83 -4.375 -1.725 -6.710 504 HH11 ARG 83 HH11 ARG 83 -5.562 -4.289 -8.744 505 HH12 ARG 83 HH12 ARG 83 -4.030 -4.574 -9.501 506 HH21 ARG 83 HH21 ARG 83 -2.353 -2.091 -7.700 507 HH22 ARG 83 HH22 ARG 83 -2.206 -3.324 -8.906 508 H LEU 84 H LEU 84 -6.023 -5.124 -3.426 509 HA LEU 84 HA LEU 84 -4.688 -7.256 -4.845 510 HB2 LEU 84 HB2 LEU 84 -3.823 -5.740 -2.388 511 HB3 LEU 84 HB3 LEU 84 -2.808 -6.785 -3.380 512 HG LEU 84 HG LEU 84 -4.110 -4.330 -4.517 513 HD11 LEU 84 HD11 LEU 84 -1.814 -4.517 -2.672 514 HD12 LEU 84 HD12 LEU 84 -2.920 -3.179 -2.982 515 HD13 LEU 84 HD13 LEU 84 -1.595 -3.505 -4.100 516 HD21 LEU 84 HD21 LEU 84 -1.532 -4.929 -5.544 517 HD22 LEU 84 HD22 LEU 84 -3.089 -4.992 -6.370 518 HD23 LEU 84 HD23 LEU 84 -2.477 -6.418 -5.529 519 H MET 85 H MET 85 -5.627 -6.702 -1.448 520 HA MET 85 HA MET 85 -4.983 -9.216 -0.462 521 HB2 MET 85 HB2 MET 85 -7.174 -7.317 0.386 522 HB3 MET 85 HB3 MET 85 -6.696 -8.737 1.306 523 HG2 MET 85 HG2 MET 85 -4.380 -7.773 1.395 524 HG3 MET 85 HG3 MET 85 -5.051 -6.296 0.708 525 HE1 MET 85 HE1 MET 85 -4.665 -4.641 2.211 526 HE2 MET 85 HE2 MET 85 -5.156 -4.519 3.901 527 HE3 MET 85 HE3 MET 85 -3.735 -5.468 3.462 528 H GLN 86 H GLN 86 -7.669 -8.210 -2.409 529 HA GLN 86 HA GLN 86 -9.269 -10.542 -1.869 530 HB2 GLN 86 HB2 GLN 86 -9.487 -8.194 -3.711 531 HB3 GLN 86 HB3 GLN 86 -10.488 -9.610 -3.997 532 HG2 GLN 86 HG2 GLN 86 -11.392 -9.415 -1.725 533 HG3 GLN 86 HG3 GLN 86 -10.417 -7.966 -1.477 534 HE21 GLN 86 HE21 GLN 86 -12.606 -7.104 -1.009 535 HE22 GLN 86 HE22 GLN 86 -13.522 -6.473 -2.332 536 H GLN 87 H GLN 87 -7.411 -9.348 -4.662 537 HA GLN 87 HA GLN 87 -7.782 -11.722 -6.188 538 HB2 GLN 87 HB2 GLN 87 -6.341 -10.748 -7.788 539 HB3 GLN 87 HB3 GLN 87 -7.225 -9.405 -7.075 540 HG2 GLN 87 HG2 GLN 87 -5.266 -9.023 -5.574 541 HG3 GLN 87 HG3 GLN 87 -4.391 -10.232 -6.513 542 HE21 GLN 87 HE21 GLN 87 -6.585 -7.589 -7.398 543 HE22 GLN 87 HE22 GLN 87 -5.493 -6.820 -8.493 544 H SER 88 H SER 88 -5.886 -11.053 -3.511 545 HA SER 88 HA SER 88 -3.479 -12.349 -4.002 546 HB2 SER 88 HB2 SER 88 -5.074 -11.699 -1.590 547 HB3 SER 88 HB3 SER 88 -3.864 -12.967 -1.400 548 HG SER 88 HG SER 88 -3.501 -10.328 -1.500 549 H VAL 89 H VAL 89 -2.916 -14.461 -2.680 550 HA VAL 89 HA VAL 89 -4.660 -16.543 -3.772 551 HB VAL 89 HB VAL 89 -2.371 -16.795 -4.419 552 HG11 VAL 89 HG11 VAL 89 -0.582 -17.105 -2.707 553 HG12 VAL 89 HG12 VAL 89 -1.259 -15.477 -2.760 554 HG13 VAL 89 HG13 VAL 89 -1.739 -16.592 -1.480 555 HG21 VAL 89 HG21 VAL 89 -2.970 -18.763 -2.212 556 HG22 VAL 89 HG22 VAL 89 -3.597 -18.853 -3.859 557 HG23 VAL 89 HG23 VAL 89 -1.866 -19.013 -3.564 558 H GLU 90 H GLU 90 -3.375 -15.337 -0.745 559 HA GLU 90 HA GLU 90 -4.458 -17.550 0.780 560 HB2 GLU 90 HB2 GLU 90 -3.050 -15.003 1.584 561 HB3 GLU 90 HB3 GLU 90 -3.659 -16.175 2.745 562 HG2 GLU 90 HG2 GLU 90 -1.594 -16.715 0.624 563 HG3 GLU 90 HG3 GLU 90 -1.274 -16.457 2.339 564 H SER 91 H SER 91 -6.437 -17.634 1.604 565 HA SER 91 HA SER 91 -8.345 -15.599 1.126 566 HB2 SER 91 HB2 SER 91 -9.762 -17.043 2.729 567 HB3 SER 91 HB3 SER 91 -9.217 -17.782 1.224 568 HG SER 91 HG SER 91 -8.824 -19.177 2.952 569 H VAL 92 H VAL 92 -6.241 -16.311 3.794 570 HA VAL 92 HA VAL 92 -7.525 -15.040 5.898 571 HB VAL 92 HB VAL 92 -5.506 -16.322 6.264 572 HG11 VAL 92 HG11 VAL 92 -4.514 -14.845 4.091 573 HG12 VAL 92 HG12 VAL 92 -3.509 -14.421 5.478 574 HG13 VAL 92 HG13 VAL 92 -3.691 -16.110 5.003 575 HG21 VAL 92 HG21 VAL 92 -4.537 -13.645 7.058 576 HG22 VAL 92 HG22 VAL 92 -6.162 -14.082 7.587 577 HG23 VAL 92 HG23 VAL 92 -4.788 -15.096 8.029 578 H TRP 93 H TRP 93 -5.905 -13.690 3.137 579 HA TRP 93 HA TRP 93 -5.419 -11.097 4.119 580 HB2 TRP 93 HB2 TRP 93 -5.609 -12.363 1.438 581 HB3 TRP 93 HB3 TRP 93 -5.781 -10.610 1.504 582 HD1 TRP 93 HD1 TRP 93 -3.208 -12.988 0.861 583 HE1 TRP 93 HE1 TRP 93 -0.866 -12.097 1.449 584 HE3 TRP 93 HE3 TRP 93 -4.562 -9.015 3.780 585 HZ2 TRP 93 HZ2 TRP 93 0.258 -9.988 2.952 586 HZ3 TRP 93 HZ3 TRP 93 -2.792 -7.612 4.755 587 HH2 TRP 93 HH2 TRP 93 -0.433 -8.090 4.350 588 H ASN 94 H ASN 94 -8.275 -12.609 2.754 589 HA ASN 94 HA ASN 94 -9.805 -10.341 2.215 590 HB2 ASN 94 HB2 ASN 94 -10.561 -13.143 3.029 591 HB3 ASN 94 HB3 ASN 94 -11.777 -11.915 2.688 592 HD21 ASN 94 HD21 ASN 94 -9.027 -13.635 1.325 593 HD22 ASN 94 HD22 ASN 94 -9.535 -13.514 -0.322 594 H MET 95 H MET 95 -9.401 -12.162 5.222 595 HA MET 95 HA MET 95 -11.279 -10.603 6.700 596 HB2 MET 95 HB2 MET 95 -9.025 -12.221 7.873 597 HB3 MET 95 HB3 MET 95 -10.576 -11.833 8.606 598 HG2 MET 95 HG2 MET 95 -11.584 -13.184 6.662 599 HG3 MET 95 HG3 MET 95 -9.951 -13.815 6.458 600 HE1 MET 95 HE1 MET 95 -9.047 -15.754 7.657 601 HE2 MET 95 HE2 MET 95 -8.611 -14.609 8.925 602 HE3 MET 95 HE3 MET 95 -9.375 -16.143 9.345 603 H ALA 96 H ALA 96 -7.789 -10.505 6.232 604 HA ALA 96 HA ALA 96 -7.052 -8.710 8.203 605 HB1 ALA 96 HB1 ALA 96 -5.231 -8.027 6.570 606 HB2 ALA 96 HB2 ALA 96 -5.335 -9.743 6.968 607 HB3 ALA 96 HB3 ALA 96 -5.973 -9.153 5.434 608 H PHE 97 H PHE 97 -8.343 -8.048 4.969 609 HA PHE 97 HA PHE 97 -8.090 -5.256 5.036 610 HB2 PHE 97 HB2 PHE 97 -8.548 -6.456 2.964 611 HB3 PHE 97 HB3 PHE 97 -10.114 -6.971 3.583 612 HD1 PHE 97 HD2 PHE 97 -8.394 -3.663 3.573 613 HD2 PHE 97 HD1 PHE 97 -11.764 -5.957 2.348 614 HE1 PHE 97 HE2 PHE 97 -9.427 -1.638 2.632 615 HE2 PHE 97 HE1 PHE 97 -12.802 -3.936 1.404 616 HZ PHE 97 HZ PHE 97 -11.634 -1.772 1.547 617 H ASP 98 H ASP 98 -10.709 -7.386 6.084 618 HA ASP 98 HA ASP 98 -12.526 -5.319 6.760 619 HB2 ASP 98 HB2 ASP 98 -12.843 -7.938 6.458 620 HB3 ASP 98 HB3 ASP 98 -12.601 -7.928 8.202 621 H PHE 99 H PHE 99 -9.948 -6.936 8.493 622 HA PHE 99 HA PHE 99 -10.579 -6.155 11.101 623 HB2 PHE 99 HB2 PHE 99 -8.881 -7.773 10.876 624 HB3 PHE 99 HB3 PHE 99 -7.974 -6.788 9.733 625 HD1 PHE 99 HD2 PHE 99 -8.854 -7.243 13.271 626 HD2 PHE 99 HD1 PHE 99 -6.446 -5.118 10.478 627 HE1 PHE 99 HE2 PHE 99 -7.478 -6.380 15.119 628 HE2 PHE 99 HE1 PHE 99 -5.066 -4.253 12.321 629 HZ PHE 99 HZ PHE 99 -5.580 -4.885 14.645 630 H ILE 100 H ILE 100 -8.645 -4.514 8.622 631 HA ILE 100 HA ILE 100 -7.934 -2.297 10.237 632 HB ILE 100 HB ILE 100 -8.098 -2.482 7.226 633 HG12 ILE 100 HG12 ILE 100 -5.478 -2.485 8.566 634 HG13 ILE 100 HG13 ILE 100 -6.462 -3.907 8.894 635 HG21 ILE 100 HG21 ILE 100 -7.552 -0.273 8.980 636 HG22 ILE 100 HG22 ILE 100 -6.133 -0.648 8.004 637 HG23 ILE 100 HG23 ILE 100 -7.674 -0.301 7.222 638 HD11 ILE 100 HD11 ILE 100 -4.843 -3.976 6.919 639 HD12 ILE 100 HD12 ILE 100 -6.493 -4.544 6.659 640 HD13 ILE 100 HD13 ILE 100 -6.013 -2.943 6.098 641 H LEU 101 H LEU 101 -10.557 -2.855 7.925 642 HA LEU 101 HA LEU 101 -11.621 -0.239 8.018 643 HB2 LEU 101 HB2 LEU 101 -12.828 -2.894 7.282 644 HB3 LEU 101 HB3 LEU 101 -13.713 -1.375 7.162 645 HG LEU 101 HG LEU 101 -11.102 -1.555 5.759 646 HD11 LEU 101 HD11 LEU 101 -13.119 -2.449 3.975 647 HD12 LEU 101 HD12 LEU 101 -13.112 -3.517 5.378 648 HD13 LEU 101 HD13 LEU 101 -11.630 -3.264 4.456 649 HD21 LEU 101 HD21 LEU 101 -12.063 0.494 5.414 650 HD22 LEU 101 HD22 LEU 101 -13.707 -0.139 5.482 651 HD23 LEU 101 HD23 LEU 101 -12.722 -0.396 4.041 652 H ASP 102 H ASP 102 -12.141 -3.112 9.963 653 HA ASP 102 HA ASP 102 -14.457 -2.313 11.320 654 HB2 ASP 102 HB2 ASP 102 -13.073 -4.578 11.320 655 HB3 ASP 102 HB3 ASP 102 -12.368 -3.873 12.772 656 H ASN 103 H ASN 103 -11.135 -1.370 11.691 657 HA ASN 103 HA ASN 103 -11.721 0.015 14.202 658 HB2 ASN 103 HB2 ASN 103 -9.155 -0.633 12.759 659 HB3 ASN 103 HB3 ASN 103 -9.206 0.497 14.109 660 HD21 ASN 103 HD21 ASN 103 -9.889 -2.814 13.149 661 HD22 ASN 103 HD22 ASN 103 -9.699 -3.503 14.722 662 H VAL 104 H VAL 104 -10.736 0.613 10.873 663 HA VAL 104 HA VAL 104 -10.398 3.434 11.211 664 HB VAL 104 HB VAL 104 -10.738 1.778 8.708 665 HG11 VAL 104 HG11 VAL 104 -9.968 4.676 9.029 666 HG12 VAL 104 HG12 VAL 104 -9.857 3.759 7.525 667 HG13 VAL 104 HG13 VAL 104 -11.430 4.052 8.266 668 HG21 VAL 104 HG21 VAL 104 -8.696 1.468 10.230 669 HG22 VAL 104 HG22 VAL 104 -8.409 1.770 8.517 670 HG23 VAL 104 HG23 VAL 104 -8.216 3.076 9.686 671 H GLN 105 H GLN 105 -12.830 1.544 9.404 672 HA GLN 105 HA GLN 105 -14.562 3.569 8.753 673 HB2 GLN 105 HB2 GLN 105 -15.366 0.782 9.601 674 HB3 GLN 105 HB3 GLN 105 -16.314 1.881 8.609 675 HG2 GLN 105 HG2 GLN 105 -13.602 0.872 7.803 676 HG3 GLN 105 HG3 GLN 105 -15.104 0.048 7.388 677 HE21 GLN 105 HE21 GLN 105 -13.358 3.089 7.068 678 HE22 GLN 105 HE22 GLN 105 -14.091 3.564 5.578 679 H VAL 106 H VAL 106 -14.070 2.065 11.852 680 HA VAL 106 HA VAL 106 -16.467 2.989 13.080 681 HB VAL 106 HB VAL 106 -13.881 1.885 14.114 682 HG11 VAL 106 HG11 VAL 106 -15.979 3.333 15.690 683 HG12 VAL 106 HG12 VAL 106 -15.026 2.038 16.417 684 HG13 VAL 106 HG13 VAL 106 -14.223 3.474 15.781 685 HG21 VAL 106 HG21 VAL 106 -15.625 0.373 13.264 686 HG22 VAL 106 HG22 VAL 106 -15.326 0.139 14.986 687 HG23 VAL 106 HG23 VAL 106 -16.754 1.026 14.452 688 H VAL 107 H VAL 107 -13.083 4.077 13.410 689 HA VAL 107 HA VAL 107 -13.688 6.383 14.911 690 HB VAL 107 HB VAL 107 -11.445 5.495 14.916 691 HG11 VAL 107 HG11 VAL 107 -11.649 5.911 11.973 692 HG12 VAL 107 HG12 VAL 107 -10.067 6.030 12.748 693 HG13 VAL 107 HG13 VAL 107 -11.004 4.541 12.876 694 HG21 VAL 107 HG21 VAL 107 -10.167 7.551 14.505 695 HG22 VAL 107 HG22 VAL 107 -11.539 8.220 13.623 696 HG23 VAL 107 HG23 VAL 107 -11.681 7.878 15.347 697 H LEU 108 H LEU 108 -13.800 5.720 11.517 698 HA LEU 108 HA LEU 108 -13.698 8.439 10.637 699 HB2 LEU 108 HB2 LEU 108 -13.464 7.467 8.662 700 HB3 LEU 108 HB3 LEU 108 -13.663 5.901 9.446 701 HG LEU 108 HG LEU 108 -16.158 6.197 9.086 702 HD11 LEU 108 HD11 LEU 108 -15.147 8.666 7.897 703 HD12 LEU 108 HD12 LEU 108 -16.766 8.255 8.463 704 HD13 LEU 108 HD13 LEU 108 -16.245 7.765 6.851 705 HD21 LEU 108 HD21 LEU 108 -15.427 6.041 6.379 706 HD22 LEU 108 HD22 LEU 108 -15.691 4.710 7.506 707 HD23 LEU 108 HD23 LEU 108 -14.073 5.380 7.296 708 H GLN 109 H GLN 109 -16.270 6.147 11.398 709 HA GLN 109 HA GLN 109 -18.418 7.745 10.489 710 HB2 GLN 109 HB2 GLN 109 -18.154 5.384 12.302 711 HB3 GLN 109 HB3 GLN 109 -19.675 6.265 12.276 712 HG2 GLN 109 HG2 GLN 109 -19.875 5.882 9.883 713 HG3 GLN 109 HG3 GLN 109 -18.330 5.033 9.882 714 HE21 GLN 109 HE21 GLN 109 -18.399 3.382 11.927 715 HE22 GLN 109 HE22 GLN 109 -19.722 2.276 11.823 716 H GLN 110 H GLN 110 -16.823 7.426 13.627 717 HA GLN 110 HA GLN 110 -18.599 9.054 15.087 718 HB2 GLN 110 HB2 GLN 110 -15.674 8.447 15.539 719 HB3 GLN 110 HB3 GLN 110 -16.706 9.267 16.702 720 HG2 GLN 110 HG2 GLN 110 -18.205 7.167 16.476 721 HG3 GLN 110 HG3 GLN 110 -16.753 6.418 15.816 722 HE21 GLN 110 HE21 GLN 110 -15.569 5.387 17.239 723 HE22 GLN 110 HE22 GLN 110 -15.447 5.746 18.925 724 H THR 111 H THR 111 -16.340 9.822 12.685 725 HA THR 111 HA THR 111 -15.988 12.572 13.613 726 HB THR 111 HB THR 111 -14.779 11.100 11.265 727 HG1 THR 111 HG1 THR 111 -13.695 12.047 13.729 728 HG21 THR 111 HG21 THR 111 -14.995 13.391 10.613 729 HG22 THR 111 HG22 THR 111 -13.316 13.132 11.090 730 HG23 THR 111 HG23 THR 111 -14.429 13.950 12.187 731 H TYR 112 H TYR 112 -16.862 10.993 10.531 732 HA TYR 112 HA TYR 112 -18.454 13.361 9.848 733 HB2 TYR 112 HB2 TYR 112 -17.776 11.084 7.994 734 HB3 TYR 112 HB3 TYR 112 -18.272 12.719 7.574 735 HD1 TYR 112 HD2 TYR 112 -16.682 14.570 7.689 736 HD2 TYR 112 HD1 TYR 112 -15.488 10.589 8.602 737 HE1 TYR 112 HE2 TYR 112 -14.324 15.241 7.501 738 HE2 TYR 112 HE1 TYR 112 -13.125 11.249 8.417 739 HH TYR 112 HH TYR 112 -11.744 12.915 7.525 740 H GLY 113 H GLY 113 -18.656 9.826 10.036 741 HA2 GLY 113 HA2 GLY 113 -20.624 8.778 10.941 742 HA3 GLY 113 HA3 GLY 113 -21.576 10.106 10.293 743 H SER 114 H SER 114 -19.091 8.155 8.685 744 HA SER 114 HA SER 114 -21.083 6.748 7.121 745 HB2 SER 114 HB2 SER 114 -19.412 8.965 6.016 746 HB3 SER 114 HB3 SER 114 -19.720 7.561 4.995 747 HG SER 114 HG SER 114 -21.748 8.133 4.810 748 H THR 115 H THR 115 -19.802 5.475 5.294 749 HA THR 115 HA THR 115 -17.153 4.656 6.153 750 HB THR 115 HB THR 115 -17.721 2.284 6.350 751 HG1 THR 115 HG1 THR 115 -19.802 1.582 6.177 752 HG21 THR 115 HG21 THR 115 -18.636 2.343 8.524 753 HG22 THR 115 HG22 THR 115 -19.561 3.806 8.180 754 HG23 THR 115 HG23 THR 115 -17.806 3.887 8.331 755 H LEU 116 H LEU 116 -15.970 3.634 4.552 756 HA LEU 116 HA LEU 116 -16.525 4.225 1.910 757 HB2 LEU 116 HB2 LEU 116 -14.488 2.900 3.353 758 HB3 LEU 116 HB3 LEU 116 -14.944 1.847 2.015 759 HG LEU 116 HG LEU 116 -14.667 4.395 0.892 760 HD11 LEU 116 HD11 LEU 116 -13.426 5.415 2.518 761 HD12 LEU 116 HD12 LEU 116 -12.143 4.636 1.593 762 HD13 LEU 116 HD13 LEU 116 -12.721 3.902 3.088 763 HD21 LEU 116 HD21 LEU 116 -13.943 2.798 -0.517 764 HD22 LEU 116 HD22 LEU 116 -13.349 1.768 0.786 765 HD23 LEU 116 HD23 LEU 116 -12.375 3.125 0.221 766 H LYS 117 H LYS 117 -17.050 2.872 0.099 767 HA LYS 117 HA LYS 117 -18.889 0.688 0.822 768 HB2 LYS 117 HB2 LYS 117 -20.042 2.550 -0.223 769 HB3 LYS 117 HB3 LYS 117 -18.909 2.539 -1.568 770 HG2 LYS 117 HG2 LYS 117 -20.286 -0.008 -1.112 771 HG3 LYS 117 HG3 LYS 117 -21.336 1.333 -1.575 772 HD2 LYS 117 HD2 LYS 117 -20.660 1.185 -3.688 773 HD3 LYS 117 HD3 LYS 117 -18.974 1.355 -3.198 774 HE2 LYS 117 HE2 LYS 117 -18.664 -0.947 -3.028 775 HE3 LYS 117 HE3 LYS 117 -20.394 -1.267 -2.911 776 HZ1 LYS 117 HZ1 LYS 117 -18.751 -1.142 -5.222 777 HZ2 LYS 117 HZ2 LYS 117 -20.027 -0.040 -5.349 778 HZ3 LYS 117 HZ3 LYS 117 -20.348 -1.679 -5.075 779 H VAL 118 H VAL 118 -17.628 -1.103 0.685 780 HA VAL 118 HA VAL 118 -16.152 -1.536 -1.827 781 HB VAL 118 HB VAL 118 -14.963 -3.352 -0.504 782 HG11 VAL 118 HG11 VAL 118 -13.283 -1.903 -0.051 783 HG12 VAL 118 HG12 VAL 118 -14.325 -0.784 -0.933 784 HG13 VAL 118 HG13 VAL 118 -14.331 -0.792 0.832 785 HG21 VAL 118 HG21 VAL 118 -15.450 -1.998 2.027 786 HG22 VAL 118 HG22 VAL 118 -16.886 -2.798 1.388 787 HG23 VAL 118 HG23 VAL 118 -15.408 -3.721 1.655 788 H THR 119 H THR 119 -17.297 -2.718 -3.207 789 HA THR 119 HA THR 119 -19.441 -4.412 -2.479 790 HB THR 119 HB THR 119 -19.327 -3.390 -4.696 791 HG1 THR 119 HG1 THR 119 -19.112 -6.183 -5.107 792 HG21 THR 119 HG21 THR 119 -16.717 -4.708 -4.734 793 HG22 THR 119 HG22 THR 119 -17.298 -3.320 -5.654 794 HG23 THR 119 HG23 THR 119 -17.653 -4.958 -6.206 795 H LYS 207 H LYS 207 7.473 -8.818 15.520 796 HA LYS 207 HA LYS 207 9.503 -7.141 14.462 797 HB2 LYS 207 HB2 LYS 207 10.227 -8.627 12.609 798 HB3 LYS 207 HB3 LYS 207 10.748 -9.193 14.191 799 HG2 LYS 207 HG2 LYS 207 10.001 -11.158 13.373 800 HG3 LYS 207 HG3 LYS 207 8.466 -10.556 14.002 801 HD2 LYS 207 HD2 LYS 207 7.788 -11.096 11.899 802 HD3 LYS 207 HD3 LYS 207 8.360 -9.456 11.581 803 HE2 LYS 207 HE2 LYS 207 9.372 -10.661 9.888 804 HE3 LYS 207 HE3 LYS 207 10.635 -10.618 11.117 805 HZ1 LYS 207 HZ1 LYS 207 8.729 -12.870 10.821 806 HZ2 LYS 207 HZ2 LYS 207 10.133 -12.826 11.762 807 HZ3 LYS 207 HZ3 LYS 207 10.248 -12.834 10.075 808 H SER 208 H SER 208 9.122 -6.909 11.958 809 HA SER 208 HA SER 208 6.538 -7.525 10.950 810 HB2 SER 208 HB2 SER 208 5.314 -5.664 11.380 811 HB3 SER 208 HB3 SER 208 6.427 -5.471 12.735 812 HG SER 208 HG SER 208 6.049 -3.676 11.049 813 H PHE 209 H PHE 209 6.246 -6.843 8.789 814 HA PHE 209 HA PHE 209 8.649 -6.608 7.306 815 HB2 PHE 209 HB2 PHE 209 6.775 -7.748 6.322 816 HB3 PHE 209 HB3 PHE 209 5.753 -6.326 6.495 817 HD1 PHE 209 HD2 PHE 209 8.767 -7.603 4.756 818 HD2 PHE 209 HD1 PHE 209 5.615 -4.744 4.789 819 HE1 PHE 209 HE2 PHE 209 9.409 -6.875 2.495 820 HE2 PHE 209 HE1 PHE 209 6.251 -4.012 2.527 821 HZ PHE 209 HZ PHE 209 8.149 -5.079 1.378 822 H PHE 210 H PHE 210 6.075 -4.313 8.111 823 HA PHE 210 HA PHE 210 6.995 -2.154 6.585 824 HB2 PHE 210 HB2 PHE 210 5.329 -2.335 9.083 825 HB3 PHE 210 HB3 PHE 210 5.749 -0.777 8.378 826 HD1 PHE 210 HD1 PHE 210 5.508 -1.154 5.552 827 HD2 PHE 210 HD2 PHE 210 3.109 -2.757 8.681 828 HE1 PHE 210 HE1 PHE 210 3.612 -1.346 3.996 829 HE2 PHE 210 HE2 PHE 210 1.209 -2.953 7.130 830 HZ PHE 210 HZ PHE 210 1.459 -2.247 4.784 831 H ASP 211 H ASP 211 8.138 -3.493 9.552 832 HA ASP 211 HA ASP 211 9.573 -1.164 10.419 833 HB2 ASP 211 HB2 ASP 211 9.267 -3.967 11.332 834 HB3 ASP 211 HB3 ASP 211 10.772 -3.166 11.772 835 H LYS 212 H LYS 212 10.421 -4.190 8.781 836 HA LYS 212 HA LYS 212 13.200 -3.502 8.561 837 HB2 LYS 212 HB2 LYS 212 13.445 -5.545 7.343 838 HB3 LYS 212 HB3 LYS 212 12.326 -5.851 8.664 839 HG2 LYS 212 HG2 LYS 212 10.449 -5.758 7.168 840 HG3 LYS 212 HG3 LYS 212 11.492 -5.272 5.831 841 HD2 LYS 212 HD2 LYS 212 12.690 -7.577 6.689 842 HD3 LYS 212 HD3 LYS 212 10.980 -7.927 6.955 843 HE2 LYS 212 HE2 LYS 212 11.043 -8.550 4.791 844 HE3 LYS 212 HE3 LYS 212 10.870 -6.820 4.498 845 HZ1 LYS 212 HZ1 LYS 212 12.857 -6.763 3.551 846 HZ2 LYS 212 HZ2 LYS 212 12.918 -8.450 3.641 847 HZ3 LYS 212 HZ3 LYS 212 13.595 -7.513 4.875 848 H LYS 213 H LYS 213 10.365 -2.798 6.787 849 HA LYS 213 HA LYS 213 11.734 -2.289 4.286 850 HB2 LYS 213 HB2 LYS 213 9.509 -3.089 4.060 851 HB3 LYS 213 HB3 LYS 213 8.891 -1.915 5.214 852 HG2 LYS 213 HG2 LYS 213 8.271 -1.313 2.950 853 HG3 LYS 213 HG3 LYS 213 9.364 -0.110 3.638 854 HD2 LYS 213 HD2 LYS 213 10.092 -0.504 1.412 855 HD3 LYS 213 HD3 LYS 213 11.245 -1.316 2.474 856 HE2 LYS 213 HE2 LYS 213 9.381 -3.270 2.033 857 HE3 LYS 213 HE3 LYS 213 9.404 -2.424 0.487 858 HZ1 LYS 213 HZ1 LYS 213 11.787 -3.520 1.879 859 HZ2 LYS 213 HZ2 LYS 213 11.791 -2.736 0.382 860 HZ3 LYS 213 HZ3 LYS 213 11.015 -4.230 0.551 861 H ARG 214 H ARG 214 10.218 -0.400 6.874 862 HA ARG 214 HA ARG 214 10.518 2.141 5.789 863 HB2 ARG 214 HB2 ARG 214 10.382 2.975 8.081 864 HB3 ARG 214 HB3 ARG 214 9.219 1.682 7.819 865 HG2 ARG 214 HG2 ARG 214 10.366 0.195 9.157 866 HG3 ARG 214 HG3 ARG 214 11.895 1.058 8.982 867 HD2 ARG 214 HD2 ARG 214 9.665 2.515 10.274 868 HD3 ARG 214 HD3 ARG 214 10.391 1.193 11.187 869 HE ARG 214 HE ARG 214 12.450 2.798 10.191 870 HH11 ARG 214 HH11 ARG 214 9.822 2.981 12.467 871 HH12 ARG 214 HH12 ARG 214 10.613 4.136 13.488 872 HH21 ARG 214 HH21 ARG 214 13.502 4.318 11.527 873 HH22 ARG 214 HH22 ARG 214 12.706 4.897 12.951 874 H SER 215 H SER 215 12.877 -0.001 7.135 875 HA SER 215 HA SER 215 14.870 1.977 7.671 876 HB2 SER 215 HB2 SER 215 14.841 -0.242 8.782 877 HB3 SER 215 HB3 SER 215 15.212 -1.000 7.233 878 HG SER 215 HG SER 215 16.846 0.999 8.395 879 H GLU 216 H GLU 216 13.852 0.207 4.875 880 HA GLU 216 HA GLU 216 16.128 0.222 3.297 881 HB2 GLU 216 HB2 GLU 216 13.255 0.641 2.456 882 HB3 GLU 216 HB3 GLU 216 14.574 0.266 1.357 883 HG2 GLU 216 HG2 GLU 216 13.661 -1.494 3.621 884 HG3 GLU 216 HG3 GLU 216 13.207 -1.694 1.930 885 H ARG 217 H ARG 217 13.560 2.701 3.337 886 HA ARG 217 HA ARG 217 14.821 4.519 1.641 887 HB2 ARG 217 HB2 ARG 217 13.225 6.109 2.352 888 HB3 ARG 217 HB3 ARG 217 12.418 4.551 2.474 889 HG2 ARG 217 HG2 ARG 217 13.344 4.699 4.957 890 HG3 ARG 217 HG3 ARG 217 13.264 6.427 4.602 891 HD2 ARG 217 HD2 ARG 217 10.869 5.662 3.664 892 HD3 ARG 217 HD3 ARG 217 11.094 4.444 4.919 893 HE ARG 217 HE ARG 217 10.739 6.062 6.490 894 HH11 ARG 217 HH11 ARG 217 11.522 7.589 3.461 895 HH12 ARG 217 HH12 ARG 217 11.199 9.191 4.036 896 HH21 ARG 217 HH21 ARG 217 10.310 8.167 7.258 897 HH22 ARG 217 HH22 ARG 217 10.511 9.519 6.196 898 H ILE 218 H ILE 218 15.234 3.922 5.060 899 HA ILE 218 HA ILE 218 16.640 6.297 5.691 900 HB ILE 218 HB ILE 218 16.812 3.599 7.039 901 HG12 ILE 218 HG12 ILE 218 15.100 5.989 7.748 902 HG13 ILE 218 HG13 ILE 218 14.511 4.570 6.889 903 HG21 ILE 218 HG21 ILE 218 18.059 6.192 7.565 904 HG22 ILE 218 HG22 ILE 218 17.237 5.492 8.958 905 HG23 ILE 218 HG23 ILE 218 18.502 4.582 8.133 906 HD11 ILE 218 HD11 ILE 218 15.767 3.592 9.183 907 HD12 ILE 218 HD12 ILE 218 14.834 4.996 9.703 908 HD13 ILE 218 HD13 ILE 218 14.037 3.673 8.851 909 H SER 219 H SER 219 17.555 3.359 4.123 910 HA SER 219 HA SER 219 20.375 4.216 4.178 911 HB2 SER 219 HB2 SER 219 19.743 1.980 5.298 912 HB3 SER 219 HB3 SER 219 19.494 1.381 3.658 913 HG SER 219 HG SER 219 21.576 0.952 3.973 914 H ASN 220 H ASN 220 21.430 2.716 2.200 915 HA ASN 220 HA ASN 220 20.699 4.111 -0.129 916 HB2 ASN 220 HB2 ASN 220 22.954 3.219 0.209 917 HB3 ASN 220 HB3 ASN 220 22.326 1.575 0.156 918 HD21 ASN 220 HD21 ASN 220 23.525 4.179 -1.629 919 HD22 ASN 220 HD22 ASN 220 23.251 3.540 -3.210 Start of MODEL 8 1 H ALA 23 H ALA 23 4.682 15.062 11.584 2 HA ALA 23 HA ALA 23 3.227 13.042 13.157 3 HB1 ALA 23 HB1 ALA 23 2.062 14.757 14.249 4 HB2 ALA 23 HB2 ALA 23 3.728 15.330 14.167 5 HB3 ALA 23 HB3 ALA 23 2.524 15.958 13.042 6 H ALA 24 H ALA 24 3.380 12.950 10.297 7 HA ALA 24 HA ALA 24 0.597 13.598 9.571 8 HB1 ALA 24 HB1 ALA 24 3.125 13.914 8.129 9 HB2 ALA 24 HB2 ALA 24 1.834 13.175 7.181 10 HB3 ALA 24 HB3 ALA 24 1.588 14.755 7.927 11 HA PRO 25 HA PRO 25 -0.308 9.359 8.885 12 HB2 PRO 25 HB2 PRO 25 -1.856 9.446 6.657 13 HB3 PRO 25 HB3 PRO 25 -2.413 10.013 8.236 14 HG2 PRO 25 HG2 PRO 25 -1.352 11.591 5.923 15 HG3 PRO 25 HG3 PRO 25 -2.735 11.941 6.977 16 HD2 PRO 25 HD2 PRO 25 -0.326 13.135 7.291 17 HD3 PRO 25 HD3 PRO 25 -1.402 12.783 8.658 18 H ASN 26 H ASN 26 1.802 8.593 8.398 19 HA ASN 26 HA ASN 26 2.260 8.134 5.524 20 HB2 ASN 26 HB2 ASN 26 4.518 8.236 7.502 21 HB3 ASN 26 HB3 ASN 26 4.564 8.463 5.756 22 HD21 ASN 26 HD21 ASN 26 2.560 10.300 5.401 23 HD22 ASN 26 HD22 ASN 26 3.000 11.787 6.161 24 H LEU 27 H LEU 27 3.001 6.107 4.908 25 HA LEU 27 HA LEU 27 2.646 4.015 6.935 26 HB2 LEU 27 HB2 LEU 27 1.337 4.142 4.698 27 HB3 LEU 27 HB3 LEU 27 2.823 3.513 3.990 28 HG LEU 27 HG LEU 27 2.643 1.542 5.489 29 HD11 LEU 27 HD11 LEU 27 0.374 1.161 6.514 30 HD12 LEU 27 HD12 LEU 27 0.059 2.877 6.259 31 HD13 LEU 27 HD13 LEU 27 1.381 2.371 7.311 32 HD21 LEU 27 HD21 LEU 27 1.145 0.408 4.124 33 HD22 LEU 27 HD22 LEU 27 1.645 1.767 3.118 34 HD23 LEU 27 HD23 LEU 27 0.090 1.809 3.947 35 H ALA 28 H ALA 28 4.457 3.272 7.807 36 HA ALA 28 HA ALA 28 6.614 2.595 8.089 37 HB1 ALA 28 HB1 ALA 28 6.936 0.817 6.806 38 HB2 ALA 28 HB2 ALA 28 5.634 1.367 5.750 39 HB3 ALA 28 HB3 ALA 28 7.299 1.845 5.419 40 H GLY 29 H GLY 29 6.071 5.381 7.222 41 HA2 GLY 29 HA2 GLY 29 7.658 7.135 7.169 42 HA3 GLY 29 HA3 GLY 29 8.827 6.025 6.470 43 H ALA 30 H ALA 30 5.770 5.822 5.023 44 HA ALA 30 HA ALA 30 6.764 7.338 2.710 45 HB1 ALA 30 HB1 ALA 30 5.239 6.017 1.360 46 HB2 ALA 30 HB2 ALA 30 6.276 4.962 2.324 47 HB3 ALA 30 HB3 ALA 30 4.603 5.237 2.809 48 H VAL 31 H VAL 31 5.935 9.291 2.413 49 HA VAL 31 HA VAL 31 3.373 9.980 3.636 50 HB VAL 31 HB VAL 31 5.323 11.807 2.230 51 HG11 VAL 31 HG11 VAL 31 4.039 13.404 3.913 52 HG12 VAL 31 HG12 VAL 31 3.417 13.053 2.298 53 HG13 VAL 31 HG13 VAL 31 2.773 12.194 3.698 54 HG21 VAL 31 HG21 VAL 31 5.404 10.591 4.871 55 HG22 VAL 31 HG22 VAL 31 6.659 11.458 3.987 56 HG23 VAL 31 HG23 VAL 31 5.465 12.353 4.926 57 H GLU 32 H GLU 32 4.956 9.906 0.475 58 HA GLU 32 HA GLU 32 2.760 10.993 -0.964 59 HB2 GLU 32 HB2 GLU 32 5.030 9.261 -1.957 60 HB3 GLU 32 HB3 GLU 32 3.945 10.208 -2.965 61 HG2 GLU 32 HG2 GLU 32 4.770 12.254 -1.817 62 HG3 GLU 32 HG3 GLU 32 5.953 11.250 -0.982 63 H PHE 33 H PHE 33 1.044 10.035 -1.916 64 HA PHE 33 HA PHE 33 0.049 7.622 -0.977 65 HB2 PHE 33 HB2 PHE 33 -1.502 9.135 -1.922 66 HB3 PHE 33 HB3 PHE 33 -0.599 9.244 -3.430 67 HD1 PHE 33 HD1 PHE 33 -2.644 6.948 -1.362 68 HD2 PHE 33 HD2 PHE 33 -1.097 7.838 -5.226 69 HE1 PHE 33 HE1 PHE 33 -4.068 5.192 -2.334 70 HE2 PHE 33 HE2 PHE 33 -2.518 6.085 -6.204 71 HZ PHE 33 HZ PHE 33 -4.008 4.759 -4.757 72 H SER 34 H SER 34 1.631 8.295 -4.091 73 HA SER 34 HA SER 34 1.481 5.789 -5.231 74 HB2 SER 34 HB2 SER 34 2.442 7.130 -6.777 75 HB3 SER 34 HB3 SER 34 3.194 8.151 -5.552 76 HG SER 34 HG SER 34 4.684 6.926 -6.882 77 H ASP 35 H ASP 35 3.753 6.989 -2.825 78 HA ASP 35 HA ASP 35 5.413 4.661 -2.861 79 HB2 ASP 35 HB2 ASP 35 5.227 7.145 -1.246 80 HB3 ASP 35 HB3 ASP 35 5.996 5.759 -0.477 81 H VAL 36 H VAL 36 2.540 5.637 -1.152 82 HA VAL 36 HA VAL 36 2.700 3.694 0.927 83 HB VAL 36 HB VAL 36 0.288 5.164 -0.147 84 HG11 VAL 36 HG11 VAL 36 0.514 3.031 1.748 85 HG12 VAL 36 HG12 VAL 36 -0.027 4.497 2.569 86 HG13 VAL 36 HG13 VAL 36 -0.930 3.874 1.188 87 HG21 VAL 36 HG21 VAL 36 0.862 6.936 1.094 88 HG22 VAL 36 HG22 VAL 36 1.365 5.934 2.456 89 HG23 VAL 36 HG23 VAL 36 2.476 6.226 1.118 90 H LYS 37 H LYS 37 0.620 3.891 -1.967 91 HA LYS 37 HA LYS 37 -0.533 1.368 -1.746 92 HB2 LYS 37 HB2 LYS 37 -0.966 1.565 -4.192 93 HB3 LYS 37 HB3 LYS 37 -1.434 2.993 -3.277 94 HG2 LYS 37 HG2 LYS 37 0.398 4.232 -4.070 95 HG3 LYS 37 HG3 LYS 37 1.213 2.789 -4.678 96 HD2 LYS 37 HD2 LYS 37 -1.333 2.911 -5.910 97 HD3 LYS 37 HD3 LYS 37 -0.614 4.518 -6.026 98 HE2 LYS 37 HE2 LYS 37 1.437 3.486 -6.950 99 HE3 LYS 37 HE3 LYS 37 0.631 1.918 -6.915 100 HZ1 LYS 37 HZ1 LYS 37 0.415 2.759 -9.095 101 HZ2 LYS 37 HZ2 LYS 37 -0.082 4.282 -8.554 102 HZ3 LYS 37 HZ3 LYS 37 -1.104 2.946 -8.375 103 H THR 38 H THR 38 2.573 2.336 -3.019 104 HA THR 38 HA THR 38 3.184 -0.070 -4.385 105 HB THR 38 HB THR 38 5.002 2.051 -3.232 106 HG1 THR 38 HG1 THR 38 3.835 1.568 -5.766 107 HG21 THR 38 HG21 THR 38 6.267 0.005 -3.408 108 HG22 THR 38 HG22 THR 38 6.727 1.071 -4.735 109 HG23 THR 38 HG23 THR 38 5.643 -0.287 -5.031 110 H LEU 39 H LEU 39 3.722 1.039 -1.078 111 HA LEU 39 HA LEU 39 5.344 -1.157 -0.291 112 HB2 LEU 39 HB2 LEU 39 3.693 0.787 1.312 113 HB3 LEU 39 HB3 LEU 39 4.780 -0.404 2.023 114 HG LEU 39 HG LEU 39 5.881 1.532 0.043 115 HD11 LEU 39 HD11 LEU 39 4.471 2.379 2.334 116 HD12 LEU 39 HD12 LEU 39 5.481 3.341 1.256 117 HD13 LEU 39 HD13 LEU 39 6.189 2.574 2.677 118 HD21 LEU 39 HD21 LEU 39 7.839 1.332 1.554 119 HD22 LEU 39 HD22 LEU 39 7.331 -0.205 0.851 120 HD23 LEU 39 HD23 LEU 39 6.925 0.177 2.525 121 H LEU 40 H LEU 40 1.884 -0.530 -0.256 122 HA LEU 40 HA LEU 40 1.195 -2.814 1.306 123 HB2 LEU 40 HB2 LEU 40 -0.542 -1.304 -0.637 124 HB3 LEU 40 HB3 LEU 40 -1.079 -2.340 0.684 125 HG LEU 40 HG LEU 40 0.537 0.114 1.255 126 HD11 LEU 40 HD11 LEU 40 -1.914 0.175 -0.106 127 HD12 LEU 40 HD12 LEU 40 -1.072 1.518 0.666 128 HD13 LEU 40 HD13 LEU 40 -2.269 0.592 1.570 129 HD21 LEU 40 HD21 LEU 40 -0.933 0.010 3.316 130 HD22 LEU 40 HD22 LEU 40 0.249 -1.286 3.130 131 HD23 LEU 40 HD23 LEU 40 -1.448 -1.579 2.749 132 H LYS 41 H LYS 41 1.189 -2.123 -2.177 133 HA LYS 41 HA LYS 41 0.101 -4.484 -3.117 134 HB2 LYS 41 HB2 LYS 41 1.025 -2.292 -4.320 135 HB3 LYS 41 HB3 LYS 41 2.414 -3.335 -4.600 136 HG2 LYS 41 HG2 LYS 41 0.589 -5.015 -5.445 137 HG3 LYS 41 HG3 LYS 41 -0.360 -3.542 -5.656 138 HD2 LYS 41 HD2 LYS 41 0.704 -3.861 -7.721 139 HD3 LYS 41 HD3 LYS 41 1.671 -2.626 -6.910 140 HE2 LYS 41 HE2 LYS 41 3.347 -4.216 -6.327 141 HE3 LYS 41 HE3 LYS 41 2.332 -5.564 -6.836 142 HZ1 LYS 41 HZ1 LYS 41 2.534 -4.888 -9.099 143 HZ2 LYS 41 HZ2 LYS 41 4.092 -4.962 -8.446 144 HZ3 LYS 41 HZ3 LYS 41 3.342 -3.463 -8.672 145 H GLU 42 H GLU 42 3.464 -3.782 -2.253 146 HA GLU 42 HA GLU 42 4.389 -6.401 -2.976 147 HB2 GLU 42 HB2 GLU 42 6.510 -5.690 -1.942 148 HB3 GLU 42 HB3 GLU 42 5.909 -4.510 -3.097 149 HG2 GLU 42 HG2 GLU 42 4.992 -3.199 -1.205 150 HG3 GLU 42 HG3 GLU 42 5.746 -4.344 -0.097 151 H TRP 43 H TRP 43 3.576 -4.740 0.037 152 HA TRP 43 HA TRP 43 4.381 -6.783 1.797 153 HB2 TRP 43 HB2 TRP 43 3.988 -4.593 2.678 154 HB3 TRP 43 HB3 TRP 43 2.332 -4.582 2.078 155 HD1 TRP 43 HD1 TRP 43 4.386 -6.787 4.544 156 HE1 TRP 43 HE1 TRP 43 2.870 -7.334 6.552 157 HE3 TRP 43 HE3 TRP 43 0.127 -4.406 3.018 158 HZ2 TRP 43 HZ2 TRP 43 0.219 -6.824 7.378 159 HZ3 TRP 43 HZ3 TRP 43 -1.855 -4.484 4.475 160 HH2 TRP 43 HH2 TRP 43 -1.808 -5.668 6.609 161 H ILE 44 H ILE 44 1.791 -6.624 -0.387 162 HA ILE 44 HA ILE 44 0.251 -8.651 1.074 163 HB ILE 44 HB ILE 44 -0.494 -7.046 -1.373 164 HG12 ILE 44 HG12 ILE 44 -1.830 -6.888 1.310 165 HG13 ILE 44 HG13 ILE 44 -0.358 -5.973 1.004 166 HG21 ILE 44 HG21 ILE 44 -1.622 -9.104 -1.567 167 HG22 ILE 44 HG22 ILE 44 -1.967 -9.168 0.161 168 HG23 ILE 44 HG23 ILE 44 -2.794 -7.991 -0.860 169 HD11 ILE 44 HD11 ILE 44 -1.420 -4.466 -0.258 170 HD12 ILE 44 HD12 ILE 44 -2.412 -5.685 -1.058 171 HD13 ILE 44 HD13 ILE 44 -2.871 -5.081 0.534 172 H THR 45 H THR 45 2.509 -8.328 -1.420 173 HA THR 45 HA THR 45 1.678 -10.841 -2.694 174 HB THR 45 HB THR 45 3.291 -10.276 -4.475 175 HG1 THR 45 HG1 THR 45 4.804 -8.939 -3.783 176 HG21 THR 45 HG21 THR 45 0.975 -8.603 -3.759 177 HG22 THR 45 HG22 THR 45 1.323 -9.481 -5.248 178 HG23 THR 45 HG23 THR 45 2.063 -7.907 -4.959 179 H THR 46 H THR 46 4.673 -9.235 -1.603 180 HA THR 46 HA THR 46 6.252 -11.572 -1.650 181 HB THR 46 HB THR 46 7.150 -9.233 -1.627 182 HG1 THR 46 HG1 THR 46 8.859 -10.368 -1.128 183 HG21 THR 46 HG21 THR 46 5.647 -9.058 0.748 184 HG22 THR 46 HG22 THR 46 6.696 -7.829 0.042 185 HG23 THR 46 HG23 THR 46 7.343 -8.967 1.223 186 H ILE 47 H ILE 47 3.850 -10.524 0.515 187 HA ILE 47 HA ILE 47 4.696 -12.568 2.460 188 HB ILE 47 HB ILE 47 3.448 -9.886 3.059 189 HG12 ILE 47 HG12 ILE 47 5.768 -10.573 4.614 190 HG13 ILE 47 HG13 ILE 47 6.133 -10.754 2.901 191 HG21 ILE 47 HG21 ILE 47 2.359 -11.406 4.497 192 HG22 ILE 47 HG22 ILE 47 3.847 -12.300 4.805 193 HG23 ILE 47 HG23 ILE 47 3.644 -10.675 5.458 194 HD11 ILE 47 HD11 ILE 47 5.638 -8.339 4.486 195 HD12 ILE 47 HD12 ILE 47 6.617 -8.574 3.037 196 HD13 ILE 47 HD13 ILE 47 4.871 -8.367 2.898 197 H SER 48 H SER 48 3.218 -14.073 2.920 198 HA SER 48 HA SER 48 0.489 -13.671 1.898 199 HB2 SER 48 HB2 SER 48 2.095 -16.186 2.377 200 HB3 SER 48 HB3 SER 48 0.369 -16.200 2.015 201 HG SER 48 HG SER 48 1.038 -14.880 0.106 202 H ASP 49 H ASP 49 2.377 -14.430 4.719 203 HA ASP 49 HA ASP 49 -0.094 -14.717 6.295 204 HB2 ASP 49 HB2 ASP 49 1.312 -16.676 6.483 205 HB3 ASP 49 HB3 ASP 49 2.712 -15.682 6.874 206 HA PRO 50 HA PRO 50 1.566 -10.569 7.424 207 HB2 PRO 50 HB2 PRO 50 -0.883 -9.431 7.707 208 HB3 PRO 50 HB3 PRO 50 -0.054 -9.555 6.149 209 HG2 PRO 50 HG2 PRO 50 -2.217 -11.284 7.287 210 HG3 PRO 50 HG3 PRO 50 -2.041 -10.650 5.640 211 HD2 PRO 50 HD2 PRO 50 -1.378 -13.191 6.302 212 HD3 PRO 50 HD3 PRO 50 -0.524 -12.279 5.041 213 H MET 51 H MET 51 1.922 -9.897 9.467 214 HA MET 51 HA MET 51 0.729 -11.411 11.632 215 HB2 MET 51 HB2 MET 51 2.988 -9.447 11.425 216 HB3 MET 51 HB3 MET 51 2.326 -9.877 12.996 217 HG2 MET 51 HG2 MET 51 2.826 -12.227 12.565 218 HG3 MET 51 HG3 MET 51 3.491 -11.794 10.992 219 HE1 MET 51 HE1 MET 51 5.346 -10.050 10.704 220 HE2 MET 51 HE2 MET 51 5.106 -8.909 12.027 221 HE3 MET 51 HE3 MET 51 6.642 -9.762 11.865 222 H GLU 52 H GLU 52 -0.176 -10.373 13.530 223 HA GLU 52 HA GLU 52 -2.233 -8.584 12.938 224 HB2 GLU 52 HB2 GLU 52 -2.134 -10.148 14.900 225 HB3 GLU 52 HB3 GLU 52 -1.009 -9.034 15.662 226 HG2 GLU 52 HG2 GLU 52 -2.924 -7.297 15.199 227 HG3 GLU 52 HG3 GLU 52 -3.925 -8.748 15.170 228 H GLU 53 H GLU 53 0.979 -8.022 14.295 229 HA GLU 53 HA GLU 53 0.618 -5.289 14.902 230 HB2 GLU 53 HB2 GLU 53 2.469 -6.776 15.745 231 HB3 GLU 53 HB3 GLU 53 3.216 -6.637 14.161 232 HG2 GLU 53 HG2 GLU 53 4.212 -5.107 15.774 233 HG3 GLU 53 HG3 GLU 53 3.444 -4.245 14.442 234 H ASP 54 H ASP 54 1.981 -6.920 12.058 235 HA ASP 54 HA ASP 54 2.726 -4.654 10.617 236 HB2 ASP 54 HB2 ASP 54 2.093 -7.476 9.943 237 HB3 ASP 54 HB3 ASP 54 2.074 -6.322 8.613 238 H ILE 55 H ILE 55 -0.330 -6.478 10.497 239 HA ILE 55 HA ILE 55 -1.597 -4.801 8.619 240 HB ILE 55 HB ILE 55 -2.908 -6.503 10.742 241 HG12 ILE 55 HG12 ILE 55 -2.295 -7.242 7.877 242 HG13 ILE 55 HG13 ILE 55 -1.265 -7.690 9.232 243 HG21 ILE 55 HG21 ILE 55 -4.397 -4.854 9.692 244 HG22 ILE 55 HG22 ILE 55 -3.974 -5.500 8.106 245 HG23 ILE 55 HG23 ILE 55 -4.836 -6.508 9.269 246 HD11 ILE 55 HD11 ILE 55 -3.691 -8.573 10.077 247 HD12 ILE 55 HD12 ILE 55 -3.797 -8.830 8.335 248 HD13 ILE 55 HD13 ILE 55 -2.480 -9.558 9.256 249 H LEU 56 H LEU 56 -1.254 -4.631 12.093 250 HA LEU 56 HA LEU 56 -3.285 -2.761 12.632 251 HB2 LEU 56 HB2 LEU 56 -0.860 -3.741 14.007 252 HB3 LEU 56 HB3 LEU 56 -1.485 -2.182 14.536 253 HG LEU 56 HG LEU 56 -3.298 -4.560 14.385 254 HD11 LEU 56 HD11 LEU 56 -2.372 -5.602 16.113 255 HD12 LEU 56 HD12 LEU 56 -2.259 -4.103 17.035 256 HD13 LEU 56 HD13 LEU 56 -0.971 -4.549 15.917 257 HD21 LEU 56 HD21 LEU 56 -4.692 -3.338 15.721 258 HD22 LEU 56 HD22 LEU 56 -3.899 -2.033 14.837 259 HD23 LEU 56 HD23 LEU 56 -3.372 -2.440 16.471 260 H GLN 57 H GLN 57 0.087 -2.374 11.670 261 HA GLN 57 HA GLN 57 0.401 0.349 12.061 262 HB2 GLN 57 HB2 GLN 57 1.633 -1.684 10.305 263 HB3 GLN 57 HB3 GLN 57 1.834 -0.013 9.793 264 HG2 GLN 57 HG2 GLN 57 2.477 -0.901 12.583 265 HG3 GLN 57 HG3 GLN 57 3.642 -1.031 11.268 266 HE21 GLN 57 HE21 GLN 57 2.525 0.897 13.714 267 HE22 GLN 57 HE22 GLN 57 3.175 2.411 13.194 268 H VAL 58 H VAL 58 -1.300 -1.362 9.530 269 HA VAL 58 HA VAL 58 -1.597 0.858 7.771 270 HB VAL 58 HB VAL 58 -3.419 -1.541 7.932 271 HG11 VAL 58 HG11 VAL 58 -3.277 0.741 6.226 272 HG12 VAL 58 HG12 VAL 58 -2.898 -0.704 5.287 273 HG13 VAL 58 HG13 VAL 58 -4.413 -0.607 6.183 274 HG21 VAL 58 HG21 VAL 58 -1.513 -2.717 7.635 275 HG22 VAL 58 HG22 VAL 58 -1.698 -2.182 5.964 276 HG23 VAL 58 HG23 VAL 58 -0.612 -1.317 7.051 277 H VAL 59 H VAL 59 -3.458 -0.418 10.459 278 HA VAL 59 HA VAL 59 -5.837 1.021 10.047 279 HB VAL 59 HB VAL 59 -4.626 0.110 12.661 280 HG11 VAL 59 HG11 VAL 59 -6.969 0.180 13.475 281 HG12 VAL 59 HG12 VAL 59 -6.318 1.770 13.070 282 HG13 VAL 59 HG13 VAL 59 -7.432 0.964 11.964 283 HG21 VAL 59 HG21 VAL 59 -6.826 -1.475 11.809 284 HG22 VAL 59 HG22 VAL 59 -5.675 -1.365 10.477 285 HG23 VAL 59 HG23 VAL 59 -5.148 -1.960 12.051 286 H ARG 60 H ARG 60 -3.029 1.772 12.111 287 HA ARG 60 HA ARG 60 -3.941 4.237 13.059 288 HB2 ARG 60 HB2 ARG 60 -1.095 3.340 12.565 289 HB3 ARG 60 HB3 ARG 60 -1.570 4.717 13.551 290 HG2 ARG 60 HG2 ARG 60 -2.735 2.076 14.224 291 HG3 ARG 60 HG3 ARG 60 -1.032 2.348 14.595 292 HD2 ARG 60 HD2 ARG 60 -3.193 4.271 15.415 293 HD3 ARG 60 HD3 ARG 60 -2.711 2.906 16.421 294 HE ARG 60 HE ARG 60 -0.427 4.379 15.701 295 HH11 ARG 60 HH11 ARG 60 -3.273 4.628 17.692 296 HH12 ARG 60 HH12 ARG 60 -2.532 5.690 18.844 297 HH21 ARG 60 HH21 ARG 60 0.558 5.775 17.210 298 HH22 ARG 60 HH22 ARG 60 -0.354 6.342 18.569 299 H TYR 61 H TYR 61 -2.606 3.340 9.995 300 HA TYR 61 HA TYR 61 -1.841 5.974 9.183 301 HB2 TYR 61 HB2 TYR 61 -0.745 4.141 8.116 302 HB3 TYR 61 HB3 TYR 61 -2.277 3.404 7.660 303 HD1 TYR 61 HD2 TYR 61 -0.000 6.236 6.975 304 HD2 TYR 61 HD1 TYR 61 -3.391 4.029 5.658 305 HE1 TYR 61 HE2 TYR 61 0.094 7.394 4.808 306 HE2 TYR 61 HE1 TYR 61 -3.304 5.180 3.487 307 HH TYR 61 HH TYR 61 -1.052 6.469 2.178 308 H CYS 62 H CYS 62 -4.560 3.840 8.320 309 HA CYS 62 HA CYS 62 -5.904 5.784 6.757 310 HB2 CYS 62 HB2 CYS 62 -6.807 3.209 8.043 311 HB3 CYS 62 HB3 CYS 62 -7.890 4.213 7.086 312 HG CYS 62 HG CYS 62 -5.798 4.054 4.926 313 H THR 63 H THR 63 -6.331 4.672 10.100 314 HA THR 63 HA THR 63 -8.572 6.163 10.777 315 HB THR 63 HB THR 63 -7.786 6.030 13.120 316 HG1 THR 63 HG1 THR 63 -5.706 5.902 13.435 317 HG21 THR 63 HG21 THR 63 -7.389 3.455 13.067 318 HG22 THR 63 HG22 THR 63 -7.709 3.624 11.340 319 HG23 THR 63 HG23 THR 63 -8.933 4.107 12.515 320 H ASP 64 H ASP 64 -5.285 7.174 10.325 321 HA ASP 64 HA ASP 64 -5.503 9.653 11.731 322 HB2 ASP 64 HB2 ASP 64 -3.516 8.463 9.827 323 HB3 ASP 64 HB3 ASP 64 -3.423 10.175 10.230 324 H LEU 65 H LEU 65 -5.918 8.637 8.382 325 HA LEU 65 HA LEU 65 -6.059 11.107 7.132 326 HB2 LEU 65 HB2 LEU 65 -6.950 8.389 6.571 327 HB3 LEU 65 HB3 LEU 65 -7.975 9.617 5.833 328 HG LEU 65 HG LEU 65 -6.194 10.458 4.528 329 HD11 LEU 65 HD11 LEU 65 -4.387 8.768 6.245 330 HD12 LEU 65 HD12 LEU 65 -4.431 10.528 6.138 331 HD13 LEU 65 HD13 LEU 65 -3.877 9.575 4.761 332 HD21 LEU 65 HD21 LEU 65 -5.274 7.753 4.135 333 HD22 LEU 65 HD22 LEU 65 -6.264 8.768 3.086 334 HD23 LEU 65 HD23 LEU 65 -7.022 7.804 4.355 335 H ILE 66 H ILE 66 -8.423 9.458 9.108 336 HA ILE 66 HA ILE 66 -10.678 11.007 8.409 337 HB ILE 66 HB ILE 66 -9.995 9.341 10.809 338 HG12 ILE 66 HG12 ILE 66 -12.463 8.840 9.319 339 HG13 ILE 66 HG13 ILE 66 -11.022 8.754 8.313 340 HG21 ILE 66 HG21 ILE 66 -12.174 11.332 10.530 341 HG22 ILE 66 HG22 ILE 66 -12.573 9.783 11.271 342 HG23 ILE 66 HG23 ILE 66 -11.307 10.793 11.968 343 HD11 ILE 66 HD11 ILE 66 -11.884 7.017 10.552 344 HD12 ILE 66 HD12 ILE 66 -11.140 6.599 9.008 345 HD13 ILE 66 HD13 ILE 66 -10.154 7.265 10.310 346 H GLU 67 H GLU 67 -8.314 11.319 11.043 347 HA GLU 67 HA GLU 67 -9.509 13.689 12.104 348 HB2 GLU 67 HB2 GLU 67 -6.689 12.704 12.550 349 HB3 GLU 67 HB3 GLU 67 -7.617 13.782 13.584 350 HG2 GLU 67 HG2 GLU 67 -8.191 10.874 13.065 351 HG3 GLU 67 HG3 GLU 67 -7.515 11.565 14.539 352 H GLU 68 H GLU 68 -6.954 12.994 9.806 353 HA GLU 68 HA GLU 68 -6.089 15.744 9.651 354 HB2 GLU 68 HB2 GLU 68 -5.391 13.314 7.996 355 HB3 GLU 68 HB3 GLU 68 -4.669 14.901 7.770 356 HG2 GLU 68 HG2 GLU 68 -4.389 13.035 10.097 357 HG3 GLU 68 HG3 GLU 68 -3.132 13.699 9.056 358 H LYS 69 H LYS 69 -8.643 13.978 8.395 359 HA LYS 69 HA LYS 69 -10.258 14.446 6.862 360 HB2 LYS 69 HB2 LYS 69 -8.955 17.135 6.464 361 HB3 LYS 69 HB3 LYS 69 -10.643 16.703 6.223 362 HG2 LYS 69 HG2 LYS 69 -9.253 16.724 8.893 363 HG3 LYS 69 HG3 LYS 69 -10.238 18.044 8.261 364 HD2 LYS 69 HD2 LYS 69 -12.047 16.187 7.979 365 HD3 LYS 69 HD3 LYS 69 -11.070 15.316 9.164 366 HE2 LYS 69 HE2 LYS 69 -11.263 17.212 10.704 367 HE3 LYS 69 HE3 LYS 69 -12.243 18.074 9.518 368 HZ1 LYS 69 HZ1 LYS 69 -13.774 16.067 9.648 369 HZ2 LYS 69 HZ2 LYS 69 -13.772 17.121 10.971 370 HZ3 LYS 69 HZ3 LYS 69 -12.939 15.652 11.060 371 H ASP 70 H ASP 70 -7.966 13.078 6.010 372 HA ASP 70 HA ASP 70 -7.594 14.092 3.270 373 HB2 ASP 70 HB2 ASP 70 -5.821 12.516 5.101 374 HB3 ASP 70 HB3 ASP 70 -5.625 12.364 3.357 375 H LEU 71 H LEU 71 -9.927 12.665 4.043 376 HA LEU 71 HA LEU 71 -9.906 9.934 3.593 377 HB2 LEU 71 HB2 LEU 71 -12.073 11.779 2.623 378 HB3 LEU 71 HB3 LEU 71 -12.229 10.097 3.125 379 HG LEU 71 HG LEU 71 -11.656 12.456 4.917 380 HD11 LEU 71 HD11 LEU 71 -13.838 12.433 5.546 381 HD12 LEU 71 HD12 LEU 71 -14.032 10.711 5.218 382 HD13 LEU 71 HD13 LEU 71 -14.031 11.867 3.886 383 HD21 LEU 71 HD21 LEU 71 -12.111 10.643 6.693 384 HD22 LEU 71 HD22 LEU 71 -10.519 10.701 5.933 385 HD23 LEU 71 HD23 LEU 71 -11.703 9.501 5.411 386 H GLU 72 H GLU 72 -9.435 12.520 1.364 387 HA GLU 72 HA GLU 72 -10.233 11.473 -1.051 388 HB2 GLU 72 HB2 GLU 72 -9.371 13.702 -0.951 389 HB3 GLU 72 HB3 GLU 72 -7.809 13.136 -0.373 390 HG2 GLU 72 HG2 GLU 72 -7.191 12.319 -2.460 391 HG3 GLU 72 HG3 GLU 72 -8.853 12.297 -3.048 392 H LYS 73 H LYS 73 -7.114 10.960 0.580 393 HA LYS 73 HA LYS 73 -6.235 9.065 -1.398 394 HB2 LYS 73 HB2 LYS 73 -5.060 9.628 1.329 395 HB3 LYS 73 HB3 LYS 73 -4.264 8.814 -0.011 396 HG2 LYS 73 HG2 LYS 73 -3.615 10.736 -0.912 397 HG3 LYS 73 HG3 LYS 73 -5.228 11.438 -0.762 398 HD2 LYS 73 HD2 LYS 73 -4.233 12.809 0.721 399 HD3 LYS 73 HD3 LYS 73 -4.424 11.446 1.827 400 HE2 LYS 73 HE2 LYS 73 -2.167 10.673 1.237 401 HE3 LYS 73 HE3 LYS 73 -1.981 12.060 0.163 402 HZ1 LYS 73 HZ1 LYS 73 -0.926 12.588 2.199 403 HZ2 LYS 73 HZ2 LYS 73 -2.258 12.092 3.115 404 HZ3 LYS 73 HZ3 LYS 73 -2.361 13.484 2.160 405 H LEU 74 H LEU 74 -8.020 8.953 1.544 406 HA LEU 74 HA LEU 74 -7.486 6.369 2.442 407 HB2 LEU 74 HB2 LEU 74 -8.837 8.133 3.603 408 HB3 LEU 74 HB3 LEU 74 -10.168 7.738 2.517 409 HG LEU 74 HG LEU 74 -10.099 5.402 3.439 410 HD11 LEU 74 HD11 LEU 74 -8.844 4.852 5.308 411 HD12 LEU 74 HD12 LEU 74 -8.533 6.536 5.723 412 HD13 LEU 74 HD13 LEU 74 -7.713 5.803 4.345 413 HD21 LEU 74 HD21 LEU 74 -10.593 7.159 5.764 414 HD22 LEU 74 HD22 LEU 74 -11.634 5.954 5.007 415 HD23 LEU 74 HD23 LEU 74 -11.460 7.552 4.279 416 H ASP 75 H ASP 75 -10.138 7.441 0.311 417 HA ASP 75 HA ASP 75 -11.151 4.901 -0.260 418 HB2 ASP 75 HB2 ASP 75 -11.978 7.378 -0.841 419 HB3 ASP 75 HB3 ASP 75 -11.256 6.968 -2.396 420 H LEU 76 H LEU 76 -8.381 6.578 -1.498 421 HA LEU 76 HA LEU 76 -8.066 4.944 -3.836 422 HB2 LEU 76 HB2 LEU 76 -6.056 6.704 -2.441 423 HB3 LEU 76 HB3 LEU 76 -5.908 6.040 -4.067 424 HG LEU 76 HG LEU 76 -8.056 7.989 -3.244 425 HD11 LEU 76 HD11 LEU 76 -5.362 8.550 -3.424 426 HD12 LEU 76 HD12 LEU 76 -6.682 9.710 -3.565 427 HD13 LEU 76 HD13 LEU 76 -5.984 8.988 -5.015 428 HD21 LEU 76 HD21 LEU 76 -7.777 8.276 -5.886 429 HD22 LEU 76 HD22 LEU 76 -8.891 7.117 -5.160 430 HD23 LEU 76 HD23 LEU 76 -7.312 6.581 -5.737 431 H VAL 77 H VAL 77 -6.436 5.134 -0.680 432 HA VAL 77 HA VAL 77 -4.714 2.929 -1.146 433 HB VAL 77 HB VAL 77 -5.624 4.130 1.473 434 HG11 VAL 77 HG11 VAL 77 -3.053 2.954 1.648 435 HG12 VAL 77 HG12 VAL 77 -4.531 2.492 2.497 436 HG13 VAL 77 HG13 VAL 77 -4.141 1.761 0.939 437 HG21 VAL 77 HG21 VAL 77 -2.968 4.568 0.157 438 HG22 VAL 77 HG22 VAL 77 -4.364 5.560 -0.268 439 HG23 VAL 77 HG23 VAL 77 -3.771 5.537 1.392 440 H ILE 78 H ILE 78 -7.895 3.255 0.341 441 HA ILE 78 HA ILE 78 -8.062 0.619 1.355 442 HB ILE 78 HB ILE 78 -10.200 2.619 0.640 443 HG12 ILE 78 HG12 ILE 78 -8.746 3.185 2.551 444 HG13 ILE 78 HG13 ILE 78 -10.401 2.870 3.064 445 HG21 ILE 78 HG21 ILE 78 -11.385 0.841 2.347 446 HG22 ILE 78 HG22 ILE 78 -11.612 0.886 0.600 447 HG23 ILE 78 HG23 ILE 78 -10.428 -0.214 1.307 448 HD11 ILE 78 HD11 ILE 78 -9.706 1.309 4.462 449 HD12 ILE 78 HD12 ILE 78 -8.890 0.446 3.158 450 HD13 ILE 78 HD13 ILE 78 -8.044 1.719 4.039 451 H LYS 79 H LYS 79 -9.465 2.092 -1.572 452 HA LYS 79 HA LYS 79 -10.529 -0.306 -2.606 453 HB2 LYS 79 HB2 LYS 79 -11.035 0.910 -4.541 454 HB3 LYS 79 HB3 LYS 79 -11.057 2.124 -3.270 455 HG2 LYS 79 HG2 LYS 79 -9.808 3.264 -4.757 456 HG3 LYS 79 HG3 LYS 79 -8.499 2.337 -4.019 457 HD2 LYS 79 HD2 LYS 79 -8.065 1.867 -6.202 458 HD3 LYS 79 HD3 LYS 79 -9.229 0.579 -5.881 459 HE2 LYS 79 HE2 LYS 79 -11.021 1.997 -6.777 460 HE3 LYS 79 HE3 LYS 79 -9.843 3.265 -7.113 461 HZ1 LYS 79 HZ1 LYS 79 -8.679 1.572 -8.537 462 HZ2 LYS 79 HZ2 LYS 79 -10.170 2.116 -9.122 463 HZ3 LYS 79 HZ3 LYS 79 -10.054 0.599 -8.384 464 H TYR 80 H TYR 80 -7.344 1.041 -2.645 465 HA TYR 80 HA TYR 80 -6.402 -0.580 -4.835 466 HB2 TYR 80 HB2 TYR 80 -5.385 1.600 -4.420 467 HB3 TYR 80 HB3 TYR 80 -4.896 1.087 -2.809 468 HD1 TYR 80 HD1 TYR 80 -3.140 -0.666 -2.557 469 HD2 TYR 80 HD2 TYR 80 -4.091 1.045 -6.335 470 HE1 TYR 80 HE1 TYR 80 -1.010 -1.498 -3.463 471 HE2 TYR 80 HE2 TYR 80 -1.964 0.218 -7.251 472 HH TYR 80 HH TYR 80 -0.074 -0.860 -6.832 473 H MET 81 H MET 81 -6.115 -0.599 -1.304 474 HA MET 81 HA MET 81 -4.471 -2.938 -1.235 475 HB2 MET 81 HB2 MET 81 -4.588 -2.780 1.112 476 HB3 MET 81 HB3 MET 81 -4.623 -1.116 0.544 477 HG2 MET 81 HG2 MET 81 -6.982 -0.973 0.906 478 HG3 MET 81 HG3 MET 81 -7.075 -2.694 1.277 479 HE1 MET 81 HE1 MET 81 -6.293 0.800 3.865 480 HE2 MET 81 HE2 MET 81 -4.761 0.469 3.056 481 HE3 MET 81 HE3 MET 81 -6.226 0.716 2.103 482 H LYS 82 H LYS 82 -7.906 -2.291 -1.099 483 HA LYS 82 HA LYS 82 -8.691 -4.874 -0.198 484 HB2 LYS 82 HB2 LYS 82 -10.891 -4.169 -0.530 485 HB3 LYS 82 HB3 LYS 82 -10.038 -2.672 -0.179 486 HG2 LYS 82 HG2 LYS 82 -11.206 -1.973 -1.982 487 HG3 LYS 82 HG3 LYS 82 -9.813 -2.649 -2.831 488 HD2 LYS 82 HD2 LYS 82 -11.540 -3.629 -3.988 489 HD3 LYS 82 HD3 LYS 82 -11.233 -4.854 -2.757 490 HE2 LYS 82 HE2 LYS 82 -13.340 -4.679 -2.083 491 HE3 LYS 82 HE3 LYS 82 -13.051 -2.993 -1.653 492 HZ1 LYS 82 HZ1 LYS 82 -14.761 -2.808 -3.146 493 HZ2 LYS 82 HZ2 LYS 82 -14.241 -4.107 -4.097 494 HZ3 LYS 82 HZ3 LYS 82 -13.434 -2.622 -4.180 495 H ARG 83 H ARG 83 -8.044 -3.461 -3.332 496 HA ARG 83 HA ARG 83 -9.223 -5.544 -4.874 497 HB2 ARG 83 HB2 ARG 83 -8.574 -4.343 -6.693 498 HB3 ARG 83 HB3 ARG 83 -8.398 -3.075 -5.488 499 HG2 ARG 83 HG2 ARG 83 -5.967 -3.919 -5.289 500 HG3 ARG 83 HG3 ARG 83 -6.284 -4.697 -6.841 501 HD2 ARG 83 HD2 ARG 83 -6.995 -1.826 -6.520 502 HD3 ARG 83 HD3 ARG 83 -5.294 -2.253 -6.692 503 HE ARG 83 HE ARG 83 -6.707 -3.561 -8.706 504 HH11 ARG 83 HH11 ARG 83 -5.912 -0.312 -7.742 505 HH12 ARG 83 HH12 ARG 83 -5.947 0.315 -9.357 506 HH21 ARG 83 HH21 ARG 83 -6.756 -2.748 -10.837 507 HH22 ARG 83 HH22 ARG 83 -6.428 -1.072 -11.116 508 H LEU 84 H LEU 84 -6.128 -5.081 -3.356 509 HA LEU 84 HA LEU 84 -4.845 -7.219 -4.815 510 HB2 LEU 84 HB2 LEU 84 -3.935 -5.747 -2.348 511 HB3 LEU 84 HB3 LEU 84 -2.947 -6.806 -3.351 512 HG LEU 84 HG LEU 84 -4.198 -4.323 -4.478 513 HD11 LEU 84 HD11 LEU 84 -3.002 -3.201 -2.923 514 HD12 LEU 84 HD12 LEU 84 -1.680 -3.531 -4.042 515 HD13 LEU 84 HD13 LEU 84 -1.911 -4.554 -2.624 516 HD21 LEU 84 HD21 LEU 84 -1.920 -6.133 -5.225 517 HD22 LEU 84 HD22 LEU 84 -2.105 -4.520 -5.913 518 HD23 LEU 84 HD23 LEU 84 -3.361 -5.733 -6.160 519 H MET 85 H MET 85 -5.815 -6.690 -1.425 520 HA MET 85 HA MET 85 -5.195 -9.235 -0.473 521 HB2 MET 85 HB2 MET 85 -7.327 -7.291 0.421 522 HB3 MET 85 HB3 MET 85 -6.884 -8.739 1.317 523 HG2 MET 85 HG2 MET 85 -4.512 -7.803 1.313 524 HG3 MET 85 HG3 MET 85 -5.247 -6.285 0.803 525 HE1 MET 85 HE1 MET 85 -3.947 -5.412 3.511 526 HE2 MET 85 HE2 MET 85 -5.029 -4.700 2.315 527 HE3 MET 85 HE3 MET 85 -5.466 -4.678 4.024 528 H GLN 86 H GLN 86 -7.926 -8.102 -2.311 529 HA GLN 86 HA GLN 86 -9.552 -10.419 -1.817 530 HB2 GLN 86 HB2 GLN 86 -9.749 -8.023 -3.599 531 HB3 GLN 86 HB3 GLN 86 -10.788 -9.410 -3.901 532 HG2 GLN 86 HG2 GLN 86 -11.521 -9.238 -1.499 533 HG3 GLN 86 HG3 GLN 86 -10.670 -7.696 -1.439 534 HE21 GLN 86 HE21 GLN 86 -12.993 -7.145 -0.854 535 HE22 GLN 86 HE22 GLN 86 -14.010 -6.651 -2.160 536 H GLN 87 H GLN 87 -7.700 -9.207 -4.604 537 HA GLN 87 HA GLN 87 -8.163 -11.520 -6.193 538 HB2 GLN 87 HB2 GLN 87 -6.720 -10.547 -7.782 539 HB3 GLN 87 HB3 GLN 87 -7.517 -9.188 -6.999 540 HG2 GLN 87 HG2 GLN 87 -5.517 -8.939 -5.541 541 HG3 GLN 87 HG3 GLN 87 -4.725 -10.188 -6.502 542 HE21 GLN 87 HE21 GLN 87 -6.773 -7.423 -7.357 543 HE22 GLN 87 HE22 GLN 87 -5.643 -6.702 -8.446 544 H SER 88 H SER 88 -6.214 -10.992 -3.518 545 HA SER 88 HA SER 88 -3.864 -12.362 -4.065 546 HB2 SER 88 HB2 SER 88 -5.462 -11.951 -1.556 547 HB3 SER 88 HB3 SER 88 -4.030 -12.980 -1.534 548 HG SER 88 HG SER 88 -2.920 -11.123 -2.497 549 H VAL 89 H VAL 89 -3.367 -14.533 -2.814 550 HA VAL 89 HA VAL 89 -5.227 -16.511 -3.918 551 HB VAL 89 HB VAL 89 -3.003 -16.839 -4.705 552 HG11 VAL 89 HG11 VAL 89 -2.283 -15.964 -2.063 553 HG12 VAL 89 HG12 VAL 89 -1.453 -17.470 -2.460 554 HG13 VAL 89 HG13 VAL 89 -1.290 -16.067 -3.517 555 HG21 VAL 89 HG21 VAL 89 -2.539 -19.083 -3.984 556 HG22 VAL 89 HG22 VAL 89 -3.435 -18.835 -2.486 557 HG23 VAL 89 HG23 VAL 89 -4.287 -18.859 -4.030 558 H GLU 90 H GLU 90 -3.769 -15.440 -0.924 559 HA GLU 90 HA GLU 90 -4.783 -17.683 0.592 560 HB2 GLU 90 HB2 GLU 90 -3.434 -15.119 1.450 561 HB3 GLU 90 HB3 GLU 90 -3.900 -16.408 2.550 562 HG2 GLU 90 HG2 GLU 90 -1.715 -16.939 2.215 563 HG3 GLU 90 HG3 GLU 90 -2.459 -17.879 0.924 564 H SER 91 H SER 91 -6.641 -17.779 1.701 565 HA SER 91 HA SER 91 -8.645 -15.800 1.264 566 HB2 SER 91 HB2 SER 91 -8.911 -17.931 3.358 567 HB3 SER 91 HB3 SER 91 -10.131 -17.291 2.259 568 HG SER 91 HG SER 91 -9.606 -19.235 1.422 569 H VAL 92 H VAL 92 -6.335 -16.405 3.769 570 HA VAL 92 HA VAL 92 -7.570 -15.103 5.924 571 HB VAL 92 HB VAL 92 -5.507 -16.507 6.079 572 HG11 VAL 92 HG11 VAL 92 -4.513 -14.937 4.117 573 HG12 VAL 92 HG12 VAL 92 -3.760 -14.203 5.535 574 HG13 VAL 92 HG13 VAL 92 -3.522 -15.918 5.195 575 HG21 VAL 92 HG21 VAL 92 -5.253 -13.749 7.272 576 HG22 VAL 92 HG22 VAL 92 -6.255 -15.047 7.918 577 HG23 VAL 92 HG23 VAL 92 -4.501 -15.225 7.875 578 H TRP 93 H TRP 93 -6.039 -13.872 3.077 579 HA TRP 93 HA TRP 93 -5.410 -11.278 4.012 580 HB2 TRP 93 HB2 TRP 93 -5.652 -12.603 1.369 581 HB3 TRP 93 HB3 TRP 93 -5.796 -10.847 1.382 582 HD1 TRP 93 HD1 TRP 93 -3.267 -13.256 0.750 583 HE1 TRP 93 HE1 TRP 93 -0.907 -12.396 1.307 584 HE3 TRP 93 HE3 TRP 93 -4.531 -9.243 3.654 585 HZ2 TRP 93 HZ2 TRP 93 0.265 -10.294 2.782 586 HZ3 TRP 93 HZ3 TRP 93 -2.730 -7.859 4.600 587 HH2 TRP 93 HH2 TRP 93 -0.383 -8.375 4.172 588 H ASN 94 H ASN 94 -8.329 -12.721 2.710 589 HA ASN 94 HA ASN 94 -9.784 -10.410 2.139 590 HB2 ASN 94 HB2 ASN 94 -10.546 -13.209 2.901 591 HB3 ASN 94 HB3 ASN 94 -11.792 -11.970 2.776 592 HD21 ASN 94 HD21 ASN 94 -8.857 -12.491 0.872 593 HD22 ASN 94 HD22 ASN 94 -9.664 -12.672 -0.645 594 H MET 95 H MET 95 -9.393 -12.182 5.174 595 HA MET 95 HA MET 95 -11.218 -10.551 6.644 596 HB2 MET 95 HB2 MET 95 -8.986 -12.195 7.825 597 HB3 MET 95 HB3 MET 95 -10.522 -11.761 8.563 598 HG2 MET 95 HG2 MET 95 -11.575 -13.128 6.654 599 HG3 MET 95 HG3 MET 95 -9.957 -13.799 6.452 600 HE1 MET 95 HE1 MET 95 -8.973 -15.499 7.632 601 HE2 MET 95 HE2 MET 95 -8.679 -14.679 9.166 602 HE3 MET 95 HE3 MET 95 -9.478 -16.251 9.145 603 H ALA 96 H ALA 96 -7.769 -10.476 6.017 604 HA ALA 96 HA ALA 96 -6.901 -8.719 7.971 605 HB1 ALA 96 HB1 ALA 96 -5.957 -8.799 5.108 606 HB2 ALA 96 HB2 ALA 96 -5.064 -8.176 6.497 607 HB3 ALA 96 HB3 ALA 96 -5.429 -9.898 6.381 608 H PHE 97 H PHE 97 -8.299 -7.970 4.793 609 HA PHE 97 HA PHE 97 -8.066 -5.180 4.957 610 HB2 PHE 97 HB2 PHE 97 -8.547 -6.286 2.847 611 HB3 PHE 97 HB3 PHE 97 -10.084 -6.874 3.472 612 HD1 PHE 97 HD2 PHE 97 -8.451 -3.522 3.551 613 HD2 PHE 97 HD1 PHE 97 -11.800 -5.853 2.339 614 HE1 PHE 97 HE2 PHE 97 -9.560 -1.489 2.720 615 HE2 PHE 97 HE1 PHE 97 -12.914 -3.824 1.506 616 HZ PHE 97 HZ PHE 97 -11.794 -1.639 1.695 617 H ASP 98 H ASP 98 -10.584 -7.385 6.059 618 HA ASP 98 HA ASP 98 -12.451 -5.375 6.794 619 HB2 ASP 98 HB2 ASP 98 -13.285 -7.582 6.450 620 HB3 ASP 98 HB3 ASP 98 -12.140 -8.267 7.601 621 H PHE 99 H PHE 99 -9.783 -6.942 8.441 622 HA PHE 99 HA PHE 99 -10.360 -6.198 11.071 623 HB2 PHE 99 HB2 PHE 99 -8.627 -7.773 10.765 624 HB3 PHE 99 HB3 PHE 99 -7.770 -6.734 9.631 625 HD1 PHE 99 HD2 PHE 99 -8.582 -7.288 13.174 626 HD2 PHE 99 HD1 PHE 99 -6.268 -5.050 10.389 627 HE1 PHE 99 HE2 PHE 99 -7.198 -6.430 15.019 628 HE2 PHE 99 HE1 PHE 99 -4.880 -4.189 12.229 629 HZ PHE 99 HZ PHE 99 -5.343 -4.880 14.547 630 H ILE 100 H ILE 100 -8.437 -4.509 8.604 631 HA ILE 100 HA ILE 100 -7.768 -2.285 10.198 632 HB ILE 100 HB ILE 100 -8.033 -2.428 7.193 633 HG12 ILE 100 HG12 ILE 100 -5.359 -2.410 8.396 634 HG13 ILE 100 HG13 ILE 100 -6.304 -3.836 8.808 635 HG21 ILE 100 HG21 ILE 100 -7.744 -0.217 7.304 636 HG22 ILE 100 HG22 ILE 100 -7.324 -0.272 9.016 637 HG23 ILE 100 HG23 ILE 100 -6.089 -0.579 7.796 638 HD11 ILE 100 HD11 ILE 100 -4.819 -3.966 6.756 639 HD12 ILE 100 HD12 ILE 100 -6.494 -4.486 6.569 640 HD13 ILE 100 HD13 ILE 100 -5.989 -2.903 5.978 641 H LEU 101 H LEU 101 -10.469 -2.892 7.996 642 HA LEU 101 HA LEU 101 -11.580 -0.291 8.157 643 HB2 LEU 101 HB2 LEU 101 -12.753 -2.958 7.410 644 HB3 LEU 101 HB3 LEU 101 -13.669 -1.455 7.341 645 HG LEU 101 HG LEU 101 -11.098 -1.739 5.830 646 HD11 LEU 101 HD11 LEU 101 -11.940 -3.304 4.507 647 HD12 LEU 101 HD12 LEU 101 -13.233 -2.191 4.062 648 HD13 LEU 101 HD13 LEU 101 -13.455 -3.307 5.409 649 HD21 LEU 101 HD21 LEU 101 -13.574 -0.048 5.600 650 HD22 LEU 101 HD22 LEU 101 -12.375 -0.165 4.312 651 HD23 LEU 101 HD23 LEU 101 -11.915 0.474 5.892 652 H ASP 102 H ASP 102 -11.922 -3.187 10.092 653 HA ASP 102 HA ASP 102 -14.232 -2.498 11.524 654 HB2 ASP 102 HB2 ASP 102 -12.784 -4.707 11.460 655 HB3 ASP 102 HB3 ASP 102 -12.020 -3.985 12.875 656 H ASN 103 H ASN 103 -10.918 -1.469 11.837 657 HA ASN 103 HA ASN 103 -11.509 -0.088 14.350 658 HB2 ASN 103 HB2 ASN 103 -8.919 -0.595 12.879 659 HB3 ASN 103 HB3 ASN 103 -9.034 0.407 14.323 660 HD21 ASN 103 HD21 ASN 103 -9.510 -2.830 13.055 661 HD22 ASN 103 HD22 ASN 103 -9.332 -3.650 14.566 662 H VAL 104 H VAL 104 -10.666 0.505 10.995 663 HA VAL 104 HA VAL 104 -10.326 3.334 11.316 664 HB VAL 104 HB VAL 104 -10.725 1.663 8.831 665 HG11 VAL 104 HG11 VAL 104 -9.904 3.650 7.613 666 HG12 VAL 104 HG12 VAL 104 -11.462 3.922 8.397 667 HG13 VAL 104 HG13 VAL 104 -9.987 4.573 9.114 668 HG21 VAL 104 HG21 VAL 104 -8.169 3.014 9.495 669 HG22 VAL 104 HG22 VAL 104 -8.596 1.575 10.421 670 HG23 VAL 104 HG23 VAL 104 -8.460 1.485 8.665 671 H GLN 105 H GLN 105 -12.784 1.425 9.564 672 HA GLN 105 HA GLN 105 -14.558 3.438 8.988 673 HB2 GLN 105 HB2 GLN 105 -15.298 0.625 9.805 674 HB3 GLN 105 HB3 GLN 105 -16.291 1.728 8.861 675 HG2 GLN 105 HG2 GLN 105 -13.584 0.807 7.952 676 HG3 GLN 105 HG3 GLN 105 -15.066 -0.075 7.588 677 HE21 GLN 105 HE21 GLN 105 -13.309 2.903 7.091 678 HE22 GLN 105 HE22 GLN 105 -14.176 3.409 5.686 679 H VAL 106 H VAL 106 -13.977 1.879 12.045 680 HA VAL 106 HA VAL 106 -16.350 2.729 13.355 681 HB VAL 106 HB VAL 106 -13.708 1.680 14.283 682 HG11 VAL 106 HG11 VAL 106 -13.975 3.252 15.972 683 HG12 VAL 106 HG12 VAL 106 -15.734 3.118 15.954 684 HG13 VAL 106 HG13 VAL 106 -14.758 1.818 16.638 685 HG21 VAL 106 HG21 VAL 106 -16.524 0.774 14.858 686 HG22 VAL 106 HG22 VAL 106 -15.559 0.197 13.499 687 HG23 VAL 106 HG23 VAL 106 -15.030 -0.117 15.151 688 H VAL 107 H VAL 107 -13.000 3.942 13.549 689 HA VAL 107 HA VAL 107 -13.652 6.218 15.097 690 HB VAL 107 HB VAL 107 -11.380 5.382 15.059 691 HG11 VAL 107 HG11 VAL 107 -10.968 4.480 12.980 692 HG12 VAL 107 HG12 VAL 107 -11.619 5.879 12.125 693 HG13 VAL 107 HG13 VAL 107 -10.038 5.975 12.901 694 HG21 VAL 107 HG21 VAL 107 -10.172 7.487 14.656 695 HG22 VAL 107 HG22 VAL 107 -11.592 8.130 13.830 696 HG23 VAL 107 HG23 VAL 107 -11.672 7.741 15.548 697 H LEU 108 H LEU 108 -13.788 5.554 11.703 698 HA LEU 108 HA LEU 108 -13.781 8.276 10.827 699 HB2 LEU 108 HB2 LEU 108 -13.528 7.311 8.853 700 HB3 LEU 108 HB3 LEU 108 -13.688 5.739 9.632 701 HG LEU 108 HG LEU 108 -16.191 5.983 9.286 702 HD11 LEU 108 HD11 LEU 108 -16.164 7.607 7.015 703 HD12 LEU 108 HD12 LEU 108 -15.304 8.517 8.257 704 HD13 LEU 108 HD13 LEU 108 -16.942 7.939 8.563 705 HD21 LEU 108 HD21 LEU 108 -15.154 5.948 6.571 706 HD22 LEU 108 HD22 LEU 108 -15.924 4.666 7.506 707 HD23 LEU 108 HD23 LEU 108 -14.194 4.967 7.679 708 H GLN 109 H GLN 109 -16.271 5.901 11.604 709 HA GLN 109 HA GLN 109 -18.477 7.438 10.728 710 HB2 GLN 109 HB2 GLN 109 -18.149 5.097 12.573 711 HB3 GLN 109 HB3 GLN 109 -19.705 5.909 12.452 712 HG2 GLN 109 HG2 GLN 109 -19.899 5.384 10.149 713 HG3 GLN 109 HG3 GLN 109 -18.227 4.833 10.069 714 HE21 GLN 109 HE21 GLN 109 -17.771 3.053 11.773 715 HE22 GLN 109 HE22 GLN 109 -18.926 1.768 11.812 716 H GLN 110 H GLN 110 -16.836 7.145 13.844 717 HA GLN 110 HA GLN 110 -18.650 8.702 15.336 718 HB2 GLN 110 HB2 GLN 110 -15.705 8.175 15.756 719 HB3 GLN 110 HB3 GLN 110 -16.747 8.960 16.936 720 HG2 GLN 110 HG2 GLN 110 -18.187 6.852 16.788 721 HG3 GLN 110 HG3 GLN 110 -16.798 6.120 15.989 722 HE21 GLN 110 HE21 GLN 110 -15.237 5.295 17.207 723 HE22 GLN 110 HE22 GLN 110 -15.079 5.508 18.914 724 H THR 111 H THR 111 -16.441 9.561 12.921 725 HA THR 111 HA THR 111 -16.158 12.310 13.873 726 HB THR 111 HB THR 111 -14.945 10.909 11.484 727 HG1 THR 111 HG1 THR 111 -13.039 11.661 12.976 728 HG21 THR 111 HG21 THR 111 -13.558 12.954 11.267 729 HG22 THR 111 HG22 THR 111 -14.566 13.731 12.487 730 HG23 THR 111 HG23 THR 111 -15.267 13.245 10.944 731 H TYR 112 H TYR 112 -17.059 10.718 10.805 732 HA TYR 112 HA TYR 112 -18.743 13.043 10.184 733 HB2 TYR 112 HB2 TYR 112 -17.956 10.864 8.257 734 HB3 TYR 112 HB3 TYR 112 -18.543 12.482 7.889 735 HD1 TYR 112 HD1 TYR 112 -15.641 10.525 9.025 736 HD2 TYR 112 HD2 TYR 112 -17.056 14.367 7.864 737 HE1 TYR 112 HE1 TYR 112 -13.321 11.321 8.850 738 HE2 TYR 112 HE2 TYR 112 -14.739 15.174 7.686 739 HH TYR 112 HH TYR 112 -11.989 13.019 8.344 740 H GLY 113 H GLY 113 -18.759 9.501 10.279 741 HA2 GLY 113 HA2 GLY 113 -20.718 8.402 11.219 742 HA3 GLY 113 HA3 GLY 113 -21.705 9.627 10.436 743 H SER 114 H SER 114 -19.673 9.216 8.091 744 HA SER 114 HA SER 114 -21.290 7.148 6.810 745 HB2 SER 114 HB2 SER 114 -19.247 9.020 5.590 746 HB3 SER 114 HB3 SER 114 -20.363 7.978 4.710 747 HG SER 114 HG SER 114 -20.885 10.354 5.170 748 H THR 115 H THR 115 -19.704 6.123 4.909 749 HA THR 115 HA THR 115 -17.219 5.177 6.066 750 HB THR 115 HB THR 115 -17.806 2.791 5.837 751 HG1 THR 115 HG1 THR 115 -20.523 3.580 5.672 752 HG21 THR 115 HG21 THR 115 -18.095 4.147 7.995 753 HG22 THR 115 HG22 THR 115 -18.910 2.586 7.898 754 HG23 THR 115 HG23 THR 115 -19.824 4.075 7.656 755 H LEU 116 H LEU 116 -16.437 3.250 4.482 756 HA LEU 116 HA LEU 116 -16.375 4.496 1.853 757 HB2 LEU 116 HB2 LEU 116 -14.593 2.890 3.437 758 HB3 LEU 116 HB3 LEU 116 -14.808 2.170 1.843 759 HG LEU 116 HG LEU 116 -14.331 4.751 1.170 760 HD11 LEU 116 HD11 LEU 116 -13.144 4.273 3.848 761 HD12 LEU 116 HD12 LEU 116 -13.752 5.762 3.126 762 HD13 LEU 116 HD13 LEU 116 -12.174 5.134 2.653 763 HD21 LEU 116 HD21 LEU 116 -12.988 2.247 1.071 764 HD22 LEU 116 HD22 LEU 116 -11.804 3.498 1.448 765 HD23 LEU 116 HD23 LEU 116 -12.806 3.640 0.005 766 H LYS 117 H LYS 117 -16.664 3.263 -0.098 767 HA LYS 117 HA LYS 117 -18.726 1.198 0.215 768 HB2 LYS 117 HB2 LYS 117 -19.515 2.987 -1.128 769 HB3 LYS 117 HB3 LYS 117 -18.018 3.056 -2.049 770 HG2 LYS 117 HG2 LYS 117 -19.873 2.073 -3.321 771 HG3 LYS 117 HG3 LYS 117 -18.525 0.953 -3.114 772 HD2 LYS 117 HD2 LYS 117 -20.336 0.653 -0.924 773 HD3 LYS 117 HD3 LYS 117 -21.240 0.563 -2.438 774 HE2 LYS 117 HE2 LYS 117 -20.152 -1.328 -3.132 775 HE3 LYS 117 HE3 LYS 117 -18.688 -0.949 -2.227 776 HZ1 LYS 117 HZ1 LYS 117 -20.856 -1.366 -0.458 777 HZ2 LYS 117 HZ2 LYS 117 -19.387 -2.199 -0.556 778 HZ3 LYS 117 HZ3 LYS 117 -20.703 -2.693 -1.496 779 H VAL 118 H VAL 118 -17.561 -0.666 0.494 780 HA VAL 118 HA VAL 118 -15.762 -1.421 -1.717 781 HB VAL 118 HB VAL 118 -14.773 -3.054 -0.021 782 HG11 VAL 118 HG11 VAL 118 -13.869 -0.651 1.159 783 HG12 VAL 118 HG12 VAL 118 -13.115 -1.583 -0.136 784 HG13 VAL 118 HG13 VAL 118 -14.257 -0.294 -0.523 785 HG21 VAL 118 HG21 VAL 118 -16.834 -2.191 1.561 786 HG22 VAL 118 HG22 VAL 118 -15.394 -3.036 2.131 787 HG23 VAL 118 HG23 VAL 118 -15.464 -1.274 2.191 788 H THR 119 H THR 119 -17.323 -2.408 -2.981 789 HA THR 119 HA THR 119 -19.312 -4.160 -2.103 790 HB THR 119 HB THR 119 -18.390 -4.999 -4.683 791 HG1 THR 119 HG1 THR 119 -17.775 -3.184 -5.578 792 HG21 THR 119 HG21 THR 119 -20.729 -4.957 -3.792 793 HG22 THR 119 HG22 THR 119 -20.552 -4.240 -5.394 794 HG23 THR 119 HG23 THR 119 -20.709 -3.204 -3.975 795 H LYS 207 H LYS 207 8.605 -7.065 16.324 796 HA LYS 207 HA LYS 207 9.970 -7.636 13.817 797 HB2 LYS 207 HB2 LYS 207 9.364 -9.290 15.793 798 HB3 LYS 207 HB3 LYS 207 7.836 -9.404 14.930 799 HG2 LYS 207 HG2 LYS 207 9.179 -11.186 14.166 800 HG3 LYS 207 HG3 LYS 207 9.163 -9.983 12.874 801 HD2 LYS 207 HD2 LYS 207 11.336 -9.112 13.873 802 HD3 LYS 207 HD3 LYS 207 11.367 -10.596 14.827 803 HE2 LYS 207 HE2 LYS 207 11.039 -10.680 11.850 804 HE3 LYS 207 HE3 LYS 207 12.636 -10.531 12.579 805 HZ1 LYS 207 HZ1 LYS 207 11.881 -12.560 13.954 806 HZ2 LYS 207 HZ2 LYS 207 12.385 -12.797 12.357 807 HZ3 LYS 207 HZ3 LYS 207 10.735 -12.776 12.729 808 H SER 208 H SER 208 9.167 -6.910 11.969 809 HA SER 208 HA SER 208 6.571 -7.416 11.067 810 HB2 SER 208 HB2 SER 208 5.432 -5.800 12.167 811 HB3 SER 208 HB3 SER 208 6.901 -4.915 12.579 812 HG SER 208 HG SER 208 6.037 -3.584 11.150 813 H PHE 209 H PHE 209 6.398 -7.057 8.895 814 HA PHE 209 HA PHE 209 8.703 -6.703 7.382 815 HB2 PHE 209 HB2 PHE 209 6.791 -7.821 6.438 816 HB3 PHE 209 HB3 PHE 209 5.800 -6.377 6.610 817 HD1 PHE 209 HD2 PHE 209 8.709 -7.787 4.812 818 HD2 PHE 209 HD1 PHE 209 5.727 -4.753 4.925 819 HE1 PHE 209 HE2 PHE 209 9.335 -7.091 2.536 820 HE2 PHE 209 HE1 PHE 209 6.347 -4.053 2.649 821 HZ PHE 209 HZ PHE 209 8.154 -5.221 1.452 822 H PHE 210 H PHE 210 6.112 -4.377 8.089 823 HA PHE 210 HA PHE 210 7.151 -2.243 6.593 824 HB2 PHE 210 HB2 PHE 210 5.312 -2.359 8.976 825 HB3 PHE 210 HB3 PHE 210 5.769 -0.831 8.233 826 HD1 PHE 210 HD1 PHE 210 5.570 -0.991 5.510 827 HD2 PHE 210 HD2 PHE 210 3.266 -3.159 8.357 828 HE1 PHE 210 HE1 PHE 210 3.778 -1.264 3.846 829 HE2 PHE 210 HE2 PHE 210 1.471 -3.438 6.698 830 HZ PHE 210 HZ PHE 210 1.725 -2.488 4.439 831 H ASP 211 H ASP 211 7.961 -3.482 9.736 832 HA ASP 211 HA ASP 211 9.362 -1.171 10.655 833 HB2 ASP 211 HB2 ASP 211 8.411 -3.276 11.955 834 HB3 ASP 211 HB3 ASP 211 10.035 -3.896 11.669 835 H LYS 212 H LYS 212 10.325 -4.204 9.103 836 HA LYS 212 HA LYS 212 13.120 -3.542 9.125 837 HB2 LYS 212 HB2 LYS 212 13.327 -5.550 7.648 838 HB3 LYS 212 HB3 LYS 212 12.525 -5.865 9.181 839 HG2 LYS 212 HG2 LYS 212 10.393 -5.959 8.145 840 HG3 LYS 212 HG3 LYS 212 11.036 -5.339 6.621 841 HD2 LYS 212 HD2 LYS 212 10.737 -7.691 6.366 842 HD3 LYS 212 HD3 LYS 212 12.472 -7.393 6.502 843 HE2 LYS 212 HE2 LYS 212 11.774 -9.331 7.830 844 HE3 LYS 212 HE3 LYS 212 12.419 -8.041 8.844 845 HZ1 LYS 212 HZ1 LYS 212 10.226 -7.417 9.484 846 HZ2 LYS 212 HZ2 LYS 212 10.365 -9.087 9.715 847 HZ3 LYS 212 HZ3 LYS 212 9.522 -8.486 8.377 848 H LYS 213 H LYS 213 10.446 -2.886 7.072 849 HA LYS 213 HA LYS 213 12.085 -2.305 4.747 850 HB2 LYS 213 HB2 LYS 213 9.942 -3.258 4.282 851 HB3 LYS 213 HB3 LYS 213 9.126 -2.073 5.292 852 HG2 LYS 213 HG2 LYS 213 8.793 -1.585 2.941 853 HG3 LYS 213 HG3 LYS 213 9.733 -0.307 3.718 854 HD2 LYS 213 HD2 LYS 213 11.292 -0.570 2.155 855 HD3 LYS 213 HD3 LYS 213 11.593 -2.193 2.779 856 HE2 LYS 213 HE2 LYS 213 9.886 -3.093 1.291 857 HE3 LYS 213 HE3 LYS 213 9.537 -1.471 0.692 858 HZ1 LYS 213 HZ1 LYS 213 11.460 -1.399 -0.507 859 HZ2 LYS 213 HZ2 LYS 213 11.146 -3.059 -0.591 860 HZ3 LYS 213 HZ3 LYS 213 12.287 -2.468 0.509 861 H ARG 214 H ARG 214 9.989 -0.497 6.985 862 HA ARG 214 HA ARG 214 10.357 2.047 5.964 863 HB2 ARG 214 HB2 ARG 214 9.653 2.886 8.092 864 HB3 ARG 214 HB3 ARG 214 8.778 1.389 7.796 865 HG2 ARG 214 HG2 ARG 214 10.387 0.201 9.243 866 HG3 ARG 214 HG3 ARG 214 11.165 1.745 9.593 867 HD2 ARG 214 HD2 ARG 214 8.228 1.437 10.031 868 HD3 ARG 214 HD3 ARG 214 9.358 0.777 11.214 869 HE ARG 214 HE ARG 214 8.712 3.529 10.803 870 HH11 ARG 214 HH11 ARG 214 11.235 1.351 11.808 871 HH12 ARG 214 HH12 ARG 214 12.035 2.526 12.798 872 HH21 ARG 214 HH21 ARG 214 9.756 5.086 12.103 873 HH22 ARG 214 HH22 ARG 214 11.192 4.650 12.966 874 H SER 215 H SER 215 12.469 0.139 8.011 875 HA SER 215 HA SER 215 14.214 2.097 8.918 876 HB2 SER 215 HB2 SER 215 15.906 0.006 8.545 877 HB3 SER 215 HB3 SER 215 14.792 0.135 9.906 878 HG SER 215 HG SER 215 14.735 -1.552 7.727 879 H GLU 216 H GLU 216 14.573 0.072 6.004 880 HA GLU 216 HA GLU 216 16.854 1.389 5.022 881 HB2 GLU 216 HB2 GLU 216 14.731 -0.140 3.506 882 HB3 GLU 216 HB3 GLU 216 16.307 0.309 2.868 883 HG2 GLU 216 HG2 GLU 216 17.413 -1.093 4.480 884 HG3 GLU 216 HG3 GLU 216 15.877 -1.466 5.259 885 H ARG 217 H ARG 217 13.445 2.087 4.748 886 HA ARG 217 HA ARG 217 13.610 3.915 2.590 887 HB2 ARG 217 HB2 ARG 217 11.527 2.761 3.540 888 HB3 ARG 217 HB3 ARG 217 11.541 4.013 4.775 889 HG2 ARG 217 HG2 ARG 217 11.764 5.134 2.120 890 HG3 ARG 217 HG3 ARG 217 10.318 4.138 2.298 891 HD2 ARG 217 HD2 ARG 217 9.452 6.063 3.108 892 HD3 ARG 217 HD3 ARG 217 10.204 5.502 4.601 893 HE ARG 217 HE ARG 217 11.677 7.245 4.467 894 HH11 ARG 217 HH11 ARG 217 10.159 6.802 1.365 895 HH12 ARG 217 HH12 ARG 217 10.845 8.236 0.679 896 HH21 ARG 217 HH21 ARG 217 12.587 9.136 3.573 897 HH22 ARG 217 HH22 ARG 217 12.227 9.564 1.935 898 H ILE 218 H ILE 218 13.719 4.306 6.105 899 HA ILE 218 HA ILE 218 13.683 7.085 6.241 900 HB ILE 218 HB ILE 218 15.179 5.168 8.034 901 HG12 ILE 218 HG12 ILE 218 12.641 6.404 8.900 902 HG13 ILE 218 HG13 ILE 218 12.497 5.231 7.597 903 HG21 ILE 218 HG21 ILE 218 14.396 8.051 8.419 904 HG22 ILE 218 HG22 ILE 218 14.951 6.995 9.716 905 HG23 ILE 218 HG23 ILE 218 16.026 7.380 8.372 906 HD11 ILE 218 HD11 ILE 218 12.845 4.792 10.396 907 HD12 ILE 218 HD12 ILE 218 12.531 3.625 9.110 908 HD13 ILE 218 HD13 ILE 218 14.190 4.075 9.509 909 H SER 219 H SER 219 16.300 4.882 5.483 910 HA SER 219 HA SER 219 18.323 6.937 5.590 911 HB2 SER 219 HB2 SER 219 18.919 4.632 6.149 912 HB3 SER 219 HB3 SER 219 18.438 4.099 4.537 913 HG SER 219 HG SER 219 20.711 4.436 4.740 914 H ASN 220 H ASN 220 19.360 7.903 3.866 915 HA ASN 220 HA ASN 220 17.794 8.314 1.525 916 HB2 ASN 220 HB2 ASN 220 20.684 9.104 1.907 917 HB3 ASN 220 HB3 ASN 220 19.494 9.856 0.848 918 HD21 ASN 220 HD21 ASN 220 21.188 10.700 3.260 919 HD22 ASN 220 HD22 ASN 220 20.061 11.546 4.260 Start of MODEL 9 1 H ALA 23 H ALA 23 4.671 14.259 12.481 2 HA ALA 23 HA ALA 23 2.769 12.627 14.031 3 HB1 ALA 23 HB1 ALA 23 3.269 15.573 13.934 4 HB2 ALA 23 HB2 ALA 23 1.689 14.955 14.416 5 HB3 ALA 23 HB3 ALA 23 3.128 14.505 15.331 6 H ALA 24 H ALA 24 3.209 12.551 11.117 7 HA ALA 24 HA ALA 24 0.532 13.422 10.240 8 HB1 ALA 24 HB1 ALA 24 3.162 13.758 9.009 9 HB2 ALA 24 HB2 ALA 24 1.931 13.125 7.916 10 HB3 ALA 24 HB3 ALA 24 1.664 14.654 8.753 11 HA PRO 25 HA PRO 25 -0.475 9.291 9.159 12 HB2 PRO 25 HB2 PRO 25 -1.855 9.612 6.843 13 HB3 PRO 25 HB3 PRO 25 -2.503 10.078 8.420 14 HG2 PRO 25 HG2 PRO 25 -1.222 11.783 6.318 15 HG3 PRO 25 HG3 PRO 25 -2.664 12.109 7.299 16 HD2 PRO 25 HD2 PRO 25 -0.241 13.174 7.871 17 HD3 PRO 25 HD3 PRO 25 -1.426 12.764 9.128 18 H ASN 26 H ASN 26 1.788 8.705 8.770 19 HA ASN 26 HA ASN 26 2.343 8.306 5.904 20 HB2 ASN 26 HB2 ASN 26 4.525 8.377 7.964 21 HB3 ASN 26 HB3 ASN 26 4.623 8.684 6.232 22 HD21 ASN 26 HD21 ASN 26 2.592 10.493 5.892 23 HD22 ASN 26 HD22 ASN 26 2.973 11.953 6.733 24 H LEU 27 H LEU 27 2.799 6.282 5.226 25 HA LEU 27 HA LEU 27 2.703 4.155 7.248 26 HB2 LEU 27 HB2 LEU 27 1.064 4.326 5.260 27 HB3 LEU 27 HB3 LEU 27 2.415 3.735 4.296 28 HG LEU 27 HG LEU 27 2.482 1.694 5.648 29 HD11 LEU 27 HD11 LEU 27 0.920 3.230 7.437 30 HD12 LEU 27 HD12 LEU 27 1.537 1.593 7.649 31 HD13 LEU 27 HD13 LEU 27 -0.052 1.849 6.928 32 HD21 LEU 27 HD21 LEU 27 0.011 0.983 5.037 33 HD22 LEU 27 HD22 LEU 27 1.225 1.273 3.791 34 HD23 LEU 27 HD23 LEU 27 0.038 2.520 4.174 35 H ALA 28 H ALA 28 4.567 3.259 7.794 36 HA ALA 28 HA ALA 28 6.732 2.551 7.743 37 HB1 ALA 28 HB1 ALA 28 5.402 1.328 5.680 38 HB2 ALA 28 HB2 ALA 28 6.830 1.990 4.883 39 HB3 ALA 28 HB3 ALA 28 7.014 0.904 6.260 40 H GLY 29 H GLY 29 6.315 5.355 7.336 41 HA2 GLY 29 HA2 GLY 29 7.801 7.117 7.031 42 HA3 GLY 29 HA3 GLY 29 8.906 6.010 6.230 43 H ALA 30 H ALA 30 5.751 5.842 5.012 44 HA ALA 30 HA ALA 30 6.560 7.447 2.682 45 HB1 ALA 30 HB1 ALA 30 5.676 5.896 1.324 46 HB2 ALA 30 HB2 ALA 30 5.798 4.839 2.730 47 HB3 ALA 30 HB3 ALA 30 4.273 5.641 2.362 48 H VAL 31 H VAL 31 5.661 9.395 2.634 49 HA VAL 31 HA VAL 31 3.100 9.862 3.950 50 HB VAL 31 HB VAL 31 4.869 11.895 2.592 51 HG11 VAL 31 HG11 VAL 31 3.364 13.416 3.206 52 HG12 VAL 31 HG12 VAL 31 2.283 12.079 3.600 53 HG13 VAL 31 HG13 VAL 31 3.305 12.786 4.851 54 HG21 VAL 31 HG21 VAL 31 5.238 12.275 5.262 55 HG22 VAL 31 HG22 VAL 31 5.160 10.517 5.164 56 HG23 VAL 31 HG23 VAL 31 6.350 11.401 4.207 57 H GLU 32 H GLU 32 4.576 10.067 0.744 58 HA GLU 32 HA GLU 32 2.280 11.131 -0.552 59 HB2 GLU 32 HB2 GLU 32 4.629 9.609 -1.695 60 HB3 GLU 32 HB3 GLU 32 3.437 10.490 -2.641 61 HG2 GLU 32 HG2 GLU 32 4.930 11.933 -0.513 62 HG3 GLU 32 HG3 GLU 32 5.746 11.559 -2.029 63 H PHE 33 H PHE 33 0.563 10.151 -1.461 64 HA PHE 33 HA PHE 33 -0.289 7.649 -0.664 65 HB2 PHE 33 HB2 PHE 33 -1.953 9.080 -1.492 66 HB3 PHE 33 HB3 PHE 33 -1.064 9.405 -2.977 67 HD1 PHE 33 HD1 PHE 33 -2.966 6.798 -1.165 68 HD2 PHE 33 HD2 PHE 33 -1.427 8.128 -4.904 69 HE1 PHE 33 HE1 PHE 33 -4.260 5.050 -2.315 70 HE2 PHE 33 HE2 PHE 33 -2.720 6.383 -6.060 71 HZ PHE 33 HZ PHE 33 -4.138 4.841 -4.766 72 H SER 34 H SER 34 1.095 8.535 -3.826 73 HA SER 34 HA SER 34 1.070 6.069 -5.044 74 HB2 SER 34 HB2 SER 34 2.817 6.875 -6.487 75 HB3 SER 34 HB3 SER 34 1.788 8.248 -6.081 76 HG SER 34 HG SER 34 3.390 9.145 -5.039 77 H ASP 35 H ASP 35 3.239 7.264 -2.575 78 HA ASP 35 HA ASP 35 5.072 5.053 -2.805 79 HB2 ASP 35 HB2 ASP 35 5.415 7.528 -1.867 80 HB3 ASP 35 HB3 ASP 35 4.994 6.738 -0.350 81 H VAL 36 H VAL 36 2.332 5.931 -0.792 82 HA VAL 36 HA VAL 36 2.650 3.941 1.182 83 HB VAL 36 HB VAL 36 0.118 5.281 0.222 84 HG11 VAL 36 HG11 VAL 36 -0.028 4.523 2.943 85 HG12 VAL 36 HG12 VAL 36 -0.996 3.934 1.590 86 HG13 VAL 36 HG13 VAL 36 0.501 3.112 2.028 87 HG21 VAL 36 HG21 VAL 36 0.685 6.374 2.631 88 HG22 VAL 36 HG22 VAL 36 2.311 6.099 2.006 89 HG23 VAL 36 HG23 VAL 36 1.167 7.078 1.087 90 H LYS 37 H LYS 37 0.438 4.031 -1.618 91 HA LYS 37 HA LYS 37 -0.588 1.472 -1.393 92 HB2 LYS 37 HB2 LYS 37 -1.039 1.624 -3.835 93 HB3 LYS 37 HB3 LYS 37 -1.538 3.055 -2.943 94 HG2 LYS 37 HG2 LYS 37 0.223 4.339 -3.786 95 HG3 LYS 37 HG3 LYS 37 1.120 2.915 -4.321 96 HD2 LYS 37 HD2 LYS 37 -1.334 2.769 -5.641 97 HD3 LYS 37 HD3 LYS 37 -0.872 4.471 -5.720 98 HE2 LYS 37 HE2 LYS 37 1.370 3.735 -6.550 99 HE3 LYS 37 HE3 LYS 37 0.738 2.091 -6.634 100 HZ1 LYS 37 HZ1 LYS 37 0.635 3.883 -8.638 101 HZ2 LYS 37 HZ2 LYS 37 -0.903 4.058 -7.958 102 HZ3 LYS 37 HZ3 LYS 37 -0.385 2.541 -8.497 103 H THR 38 H THR 38 2.496 2.524 -2.633 104 HA THR 38 HA THR 38 3.220 0.211 -4.056 105 HB THR 38 HB THR 38 4.981 2.204 -2.617 106 HG1 THR 38 HG1 THR 38 5.255 2.871 -4.914 107 HG21 THR 38 HG21 THR 38 6.191 0.122 -2.992 108 HG22 THR 38 HG22 THR 38 6.776 1.376 -4.086 109 HG23 THR 38 HG23 THR 38 5.693 0.119 -4.684 110 H LEU 39 H LEU 39 3.563 1.083 -0.651 111 HA LEU 39 HA LEU 39 5.132 -1.164 0.083 112 HB2 LEU 39 HB2 LEU 39 3.276 0.309 1.925 113 HB3 LEU 39 HB3 LEU 39 4.790 -0.503 2.315 114 HG LEU 39 HG LEU 39 4.430 2.123 0.881 115 HD11 LEU 39 HD11 LEU 39 6.169 2.544 2.899 116 HD12 LEU 39 HD12 LEU 39 5.161 1.279 3.603 117 HD13 LEU 39 HD13 LEU 39 4.426 2.778 3.033 118 HD21 LEU 39 HD21 LEU 39 6.326 1.691 -0.200 119 HD22 LEU 39 HD22 LEU 39 6.576 0.192 0.698 120 HD23 LEU 39 HD23 LEU 39 7.136 1.726 1.367 121 H LEU 40 H LEU 40 1.662 -0.538 0.014 122 HA LEU 40 HA LEU 40 0.886 -2.927 1.329 123 HB2 LEU 40 HB2 LEU 40 -0.727 -1.354 -0.668 124 HB3 LEU 40 HB3 LEU 40 -1.335 -2.428 0.590 125 HG LEU 40 HG LEU 40 0.220 0.021 1.330 126 HD11 LEU 40 HD11 LEU 40 -1.502 1.459 1.016 127 HD12 LEU 40 HD12 LEU 40 -2.731 0.210 1.218 128 HD13 LEU 40 HD13 LEU 40 -1.859 0.350 -0.308 129 HD21 LEU 40 HD21 LEU 40 -1.211 -0.128 3.329 130 HD22 LEU 40 HD22 LEU 40 -0.257 -1.589 3.073 131 HD23 LEU 40 HD23 LEU 40 -1.971 -1.571 2.658 132 H LYS 41 H LYS 41 1.129 -2.037 -2.101 133 HA LYS 41 HA LYS 41 0.158 -4.357 -3.249 134 HB2 LYS 41 HB2 LYS 41 1.102 -2.091 -4.267 135 HB3 LYS 41 HB3 LYS 41 2.549 -3.068 -4.481 136 HG2 LYS 41 HG2 LYS 41 0.975 -4.764 -5.610 137 HG3 LYS 41 HG3 LYS 41 -0.155 -3.411 -5.715 138 HD2 LYS 41 HD2 LYS 41 0.998 -3.363 -7.752 139 HD3 LYS 41 HD3 LYS 41 1.784 -2.118 -6.778 140 HE2 LYS 41 HE2 LYS 41 3.543 -3.741 -6.181 141 HE3 LYS 41 HE3 LYS 41 2.771 -4.935 -7.223 142 HZ1 LYS 41 HZ1 LYS 41 4.538 -3.928 -8.428 143 HZ2 LYS 41 HZ2 LYS 41 4.003 -2.368 -8.054 144 HZ3 LYS 41 HZ3 LYS 41 3.090 -3.349 -9.087 145 H GLU 42 H GLU 42 3.465 -3.638 -2.178 146 HA GLU 42 HA GLU 42 4.454 -6.225 -2.936 147 HB2 GLU 42 HB2 GLU 42 6.524 -5.523 -1.816 148 HB3 GLU 42 HB3 GLU 42 5.941 -4.292 -2.928 149 HG2 GLU 42 HG2 GLU 42 4.945 -3.095 -0.999 150 HG3 GLU 42 HG3 GLU 42 5.690 -4.283 0.070 151 H TRP 43 H TRP 43 3.425 -4.676 0.064 152 HA TRP 43 HA TRP 43 4.206 -6.737 1.818 153 HB2 TRP 43 HB2 TRP 43 3.666 -4.522 2.652 154 HB3 TRP 43 HB3 TRP 43 2.008 -4.675 2.076 155 HD1 TRP 43 HD1 TRP 43 4.283 -6.738 4.473 156 HE1 TRP 43 HE1 TRP 43 2.865 -7.398 6.518 157 HE3 TRP 43 HE3 TRP 43 -0.159 -4.609 3.104 158 HZ2 TRP 43 HZ2 TRP 43 0.215 -7.062 7.430 159 HZ3 TRP 43 HZ3 TRP 43 -2.087 -4.824 4.619 160 HH2 TRP 43 HH2 TRP 43 -1.902 -6.025 6.736 161 H ILE 44 H ILE 44 1.769 -6.629 -0.522 162 HA ILE 44 HA ILE 44 0.217 -8.743 0.804 163 HB ILE 44 HB ILE 44 -0.472 -7.072 -1.617 164 HG12 ILE 44 HG12 ILE 44 -1.958 -7.061 0.987 165 HG13 ILE 44 HG13 ILE 44 -0.489 -6.105 0.819 166 HG21 ILE 44 HG21 ILE 44 -2.757 -8.117 -1.251 167 HG22 ILE 44 HG22 ILE 44 -1.513 -9.158 -1.942 168 HG23 ILE 44 HG23 ILE 44 -1.937 -9.303 -0.236 169 HD11 ILE 44 HD11 ILE 44 -2.271 -5.689 -1.409 170 HD12 ILE 44 HD12 ILE 44 -3.060 -5.348 0.131 171 HD13 ILE 44 HD13 ILE 44 -1.561 -4.522 -0.294 172 H THR 45 H THR 45 2.579 -8.251 -1.560 173 HA THR 45 HA THR 45 1.894 -10.731 -2.976 174 HB THR 45 HB THR 45 3.572 -10.054 -4.645 175 HG1 THR 45 HG1 THR 45 5.040 -8.753 -3.796 176 HG21 THR 45 HG21 THR 45 1.192 -8.474 -3.972 177 HG22 THR 45 HG22 THR 45 1.669 -9.212 -5.502 178 HG23 THR 45 HG23 THR 45 2.338 -7.650 -5.030 179 H THR 46 H THR 46 4.768 -9.101 -1.626 180 HA THR 46 HA THR 46 6.367 -11.450 -1.652 181 HB THR 46 HB THR 46 7.274 -9.111 -1.645 182 HG1 THR 46 HG1 THR 46 9.053 -9.706 -0.375 183 HG21 THR 46 HG21 THR 46 7.343 -8.860 1.236 184 HG22 THR 46 HG22 THR 46 5.687 -8.839 0.629 185 HG23 THR 46 HG23 THR 46 6.866 -7.679 0.017 186 H ILE 47 H ILE 47 3.963 -10.275 0.479 187 HA ILE 47 HA ILE 47 4.700 -12.343 2.443 188 HB ILE 47 HB ILE 47 3.580 -9.598 3.009 189 HG12 ILE 47 HG12 ILE 47 5.857 -10.440 4.579 190 HG13 ILE 47 HG13 ILE 47 6.213 -10.564 2.860 191 HG21 ILE 47 HG21 ILE 47 4.005 -10.665 5.449 192 HG22 ILE 47 HG22 ILE 47 2.444 -10.671 4.631 193 HG23 ILE 47 HG23 ILE 47 3.481 -12.096 4.562 194 HD11 ILE 47 HD11 ILE 47 5.792 -8.193 4.542 195 HD12 ILE 47 HD12 ILE 47 6.805 -8.417 3.115 196 HD13 ILE 47 HD13 ILE 47 5.075 -8.131 2.932 197 H SER 48 H SER 48 3.182 -13.826 2.762 198 HA SER 48 HA SER 48 0.453 -13.253 1.827 199 HB2 SER 48 HB2 SER 48 0.283 -15.406 1.089 200 HB3 SER 48 HB3 SER 48 2.041 -15.283 1.037 201 HG SER 48 HG SER 48 1.132 -17.160 2.167 202 H ASP 49 H ASP 49 2.359 -14.098 4.577 203 HA ASP 49 HA ASP 49 -0.097 -14.377 6.183 204 HB2 ASP 49 HB2 ASP 49 2.574 -15.736 6.430 205 HB3 ASP 49 HB3 ASP 49 1.500 -15.590 7.819 206 HA PRO 50 HA PRO 50 1.957 -10.487 7.546 207 HB2 PRO 50 HB2 PRO 50 -0.371 -9.163 7.991 208 HB3 PRO 50 HB3 PRO 50 0.399 -9.246 6.402 209 HG2 PRO 50 HG2 PRO 50 -1.877 -10.858 7.491 210 HG3 PRO 50 HG3 PRO 50 -1.692 -10.126 5.887 211 HD2 PRO 50 HD2 PRO 50 -1.240 -12.755 6.350 212 HD3 PRO 50 HD3 PRO 50 -0.344 -11.833 5.125 213 H MET 51 H MET 51 2.078 -9.575 9.625 214 HA MET 51 HA MET 51 1.082 -11.325 11.736 215 HB2 MET 51 HB2 MET 51 3.473 -10.693 11.697 216 HB3 MET 51 HB3 MET 51 3.016 -9.006 11.891 217 HG2 MET 51 HG2 MET 51 2.539 -9.238 14.087 218 HG3 MET 51 HG3 MET 51 1.978 -10.898 13.904 219 HE1 MET 51 HE1 MET 51 6.333 -9.522 14.447 220 HE2 MET 51 HE2 MET 51 5.470 -9.156 12.953 221 HE3 MET 51 HE3 MET 51 4.899 -8.496 14.486 222 H GLU 52 H GLU 52 0.068 -10.475 13.644 223 HA GLU 52 HA GLU 52 -2.118 -8.857 13.189 224 HB2 GLU 52 HB2 GLU 52 -1.837 -10.362 15.141 225 HB3 GLU 52 HB3 GLU 52 -0.690 -9.221 15.829 226 HG2 GLU 52 HG2 GLU 52 -2.496 -7.509 15.830 227 HG3 GLU 52 HG3 GLU 52 -3.620 -8.768 15.321 228 H GLU 53 H GLU 53 1.091 -7.955 14.350 229 HA GLU 53 HA GLU 53 0.454 -5.250 14.925 230 HB2 GLU 53 HB2 GLU 53 2.985 -6.802 14.563 231 HB3 GLU 53 HB3 GLU 53 3.058 -5.046 14.588 232 HG2 GLU 53 HG2 GLU 53 1.721 -6.619 16.763 233 HG3 GLU 53 HG3 GLU 53 3.445 -6.255 16.781 234 H ASP 54 H ASP 54 1.875 -6.858 12.104 235 HA ASP 54 HA ASP 54 2.468 -4.617 10.572 236 HB2 ASP 54 HB2 ASP 54 2.089 -7.475 10.095 237 HB3 ASP 54 HB3 ASP 54 1.636 -6.485 8.709 238 H ILE 55 H ILE 55 -0.528 -6.544 10.593 239 HA ILE 55 HA ILE 55 -1.919 -4.961 8.730 240 HB ILE 55 HB ILE 55 -3.117 -6.602 10.963 241 HG12 ILE 55 HG12 ILE 55 -2.463 -7.450 8.135 242 HG13 ILE 55 HG13 ILE 55 -1.495 -7.864 9.545 243 HG21 ILE 55 HG21 ILE 55 -4.276 -5.829 8.290 244 HG22 ILE 55 HG22 ILE 55 -5.083 -6.720 9.580 245 HG23 ILE 55 HG23 ILE 55 -4.649 -5.027 9.816 246 HD11 ILE 55 HD11 ILE 55 -4.337 -8.690 9.005 247 HD12 ILE 55 HD12 ILE 55 -2.902 -9.715 8.960 248 HD13 ILE 55 HD13 ILE 55 -3.451 -9.033 10.491 249 H LEU 56 H LEU 56 -1.427 -4.648 12.172 250 HA LEU 56 HA LEU 56 -3.491 -2.778 12.682 251 HB2 LEU 56 HB2 LEU 56 -1.107 -3.788 14.091 252 HB3 LEU 56 HB3 LEU 56 -1.662 -2.187 14.575 253 HG LEU 56 HG LEU 56 -3.527 -4.539 14.514 254 HD11 LEU 56 HD11 LEU 56 -2.911 -5.260 16.588 255 HD12 LEU 56 HD12 LEU 56 -2.230 -3.702 17.053 256 HD13 LEU 56 HD13 LEU 56 -1.337 -4.764 15.966 257 HD21 LEU 56 HD21 LEU 56 -4.878 -3.235 15.925 258 HD22 LEU 56 HD22 LEU 56 -4.313 -2.125 14.677 259 HD23 LEU 56 HD23 LEU 56 -3.569 -2.107 16.277 260 H GLN 57 H GLN 57 -0.138 -2.459 11.663 261 HA GLN 57 HA GLN 57 0.248 0.258 12.033 262 HB2 GLN 57 HB2 GLN 57 1.289 -1.630 9.930 263 HB3 GLN 57 HB3 GLN 57 1.793 0.054 10.006 264 HG2 GLN 57 HG2 GLN 57 2.021 -1.719 12.403 265 HG3 GLN 57 HG3 GLN 57 3.247 -1.745 11.135 266 HE21 GLN 57 HE21 GLN 57 2.283 -0.310 13.978 267 HE22 GLN 57 HE22 GLN 57 3.293 1.090 13.931 268 H VAL 58 H VAL 58 -1.520 -1.430 9.523 269 HA VAL 58 HA VAL 58 -1.828 0.802 7.785 270 HB VAL 58 HB VAL 58 -3.702 -1.552 7.956 271 HG11 VAL 58 HG11 VAL 58 -4.618 -0.702 6.122 272 HG12 VAL 58 HG12 VAL 58 -3.576 0.713 6.291 273 HG13 VAL 58 HG13 VAL 58 -3.050 -0.660 5.316 274 HG21 VAL 58 HG21 VAL 58 -1.979 -2.255 6.004 275 HG22 VAL 58 HG22 VAL 58 -0.880 -1.438 7.116 276 HG23 VAL 58 HG23 VAL 58 -1.845 -2.803 7.674 277 H VAL 59 H VAL 59 -3.660 -0.468 10.497 278 HA VAL 59 HA VAL 59 -6.018 1.027 10.127 279 HB VAL 59 HB VAL 59 -4.798 -0.034 12.678 280 HG11 VAL 59 HG11 VAL 59 -7.099 0.165 13.587 281 HG12 VAL 59 HG12 VAL 59 -6.351 1.721 13.225 282 HG13 VAL 59 HG13 VAL 59 -7.559 1.048 12.131 283 HG21 VAL 59 HG21 VAL 59 -7.187 -1.321 11.607 284 HG22 VAL 59 HG22 VAL 59 -5.791 -1.430 10.533 285 HG23 VAL 59 HG23 VAL 59 -5.681 -2.031 12.188 286 H ARG 60 H ARG 60 -3.118 1.676 12.079 287 HA ARG 60 HA ARG 60 -3.977 4.129 13.143 288 HB2 ARG 60 HB2 ARG 60 -1.115 3.383 12.544 289 HB3 ARG 60 HB3 ARG 60 -1.697 4.491 13.780 290 HG2 ARG 60 HG2 ARG 60 -2.108 1.509 13.723 291 HG3 ARG 60 HG3 ARG 60 -1.004 2.400 14.774 292 HD2 ARG 60 HD2 ARG 60 -3.421 3.642 15.207 293 HD3 ARG 60 HD3 ARG 60 -3.874 1.949 15.018 294 HE ARG 60 HE ARG 60 -2.940 1.530 17.055 295 HH11 ARG 60 HH11 ARG 60 -1.639 4.516 15.828 296 HH12 ARG 60 HH12 ARG 60 -0.761 4.881 17.277 297 HH21 ARG 60 HH21 ARG 60 -1.789 1.997 18.968 298 HH22 ARG 60 HH22 ARG 60 -0.846 3.446 19.061 299 H TYR 61 H TYR 61 -2.557 3.287 10.073 300 HA TYR 61 HA TYR 61 -1.826 5.937 9.315 301 HB2 TYR 61 HB2 TYR 61 -0.710 4.135 8.219 302 HB3 TYR 61 HB3 TYR 61 -2.232 3.394 7.740 303 HD1 TYR 61 HD2 TYR 61 0.017 6.266 7.127 304 HD2 TYR 61 HD1 TYR 61 -3.328 4.035 5.736 305 HE1 TYR 61 HE2 TYR 61 0.119 7.462 4.980 306 HE2 TYR 61 HE1 TYR 61 -3.235 5.224 3.585 307 HH TYR 61 HH TYR 61 -1.422 6.448 2.235 308 H CYS 62 H CYS 62 -4.555 3.821 8.449 309 HA CYS 62 HA CYS 62 -5.882 5.755 6.862 310 HB2 CYS 62 HB2 CYS 62 -6.747 3.182 8.160 311 HB3 CYS 62 HB3 CYS 62 -7.898 4.200 7.302 312 HG CYS 62 HG CYS 62 -5.262 2.458 6.034 313 H THR 63 H THR 63 -6.331 4.693 10.220 314 HA THR 63 HA THR 63 -8.545 6.224 10.880 315 HB THR 63 HB THR 63 -7.669 6.170 13.234 316 HG1 THR 63 HG1 THR 63 -5.388 6.144 12.422 317 HG21 THR 63 HG21 THR 63 -7.256 3.416 12.695 318 HG22 THR 63 HG22 THR 63 -8.455 4.012 11.547 319 HG23 THR 63 HG23 THR 63 -8.718 4.207 13.280 320 H ASP 64 H ASP 64 -5.227 7.181 10.461 321 HA ASP 64 HA ASP 64 -5.451 9.701 11.793 322 HB2 ASP 64 HB2 ASP 64 -3.424 8.421 9.995 323 HB3 ASP 64 HB3 ASP 64 -3.321 10.148 10.326 324 H LEU 65 H LEU 65 -5.808 8.589 8.471 325 HA LEU 65 HA LEU 65 -5.861 11.014 7.132 326 HB2 LEU 65 HB2 LEU 65 -6.736 8.300 6.638 327 HB3 LEU 65 HB3 LEU 65 -7.829 9.474 5.907 328 HG LEU 65 HG LEU 65 -6.112 10.356 4.535 329 HD11 LEU 65 HD11 LEU 65 -4.230 8.764 6.259 330 HD12 LEU 65 HD12 LEU 65 -4.276 10.511 6.020 331 HD13 LEU 65 HD13 LEU 65 -3.766 9.455 4.704 332 HD21 LEU 65 HD21 LEU 65 -5.066 7.912 3.823 333 HD22 LEU 65 HD22 LEU 65 -6.581 8.600 3.241 334 HD23 LEU 65 HD23 LEU 65 -6.586 7.486 4.610 335 H ILE 66 H ILE 66 -8.292 9.521 9.143 336 HA ILE 66 HA ILE 66 -10.489 11.117 8.341 337 HB ILE 66 HB ILE 66 -9.926 9.530 10.832 338 HG12 ILE 66 HG12 ILE 66 -12.289 8.986 9.165 339 HG13 ILE 66 HG13 ILE 66 -10.751 8.770 8.336 340 HG21 ILE 66 HG21 ILE 66 -12.166 11.422 10.276 341 HG22 ILE 66 HG22 ILE 66 -12.467 9.965 11.222 342 HG23 ILE 66 HG23 ILE 66 -11.277 11.143 11.773 343 HD11 ILE 66 HD11 ILE 66 -11.486 6.685 9.291 344 HD12 ILE 66 HD12 ILE 66 -10.034 7.245 10.122 345 HD13 ILE 66 HD13 ILE 66 -11.613 7.426 10.886 346 H GLU 67 H GLU 67 -8.240 11.384 11.088 347 HA GLU 67 HA GLU 67 -9.355 13.845 12.010 348 HB2 GLU 67 HB2 GLU 67 -6.606 12.780 12.644 349 HB3 GLU 67 HB3 GLU 67 -7.589 13.867 13.614 350 HG2 GLU 67 HG2 GLU 67 -9.243 11.993 13.851 351 HG3 GLU 67 HG3 GLU 67 -8.041 10.941 13.104 352 H GLU 68 H GLU 68 -6.909 12.963 9.714 353 HA GLU 68 HA GLU 68 -5.812 15.650 9.587 354 HB2 GLU 68 HB2 GLU 68 -5.191 13.095 8.110 355 HB3 GLU 68 HB3 GLU 68 -4.442 14.632 7.699 356 HG2 GLU 68 HG2 GLU 68 -4.307 13.877 10.537 357 HG3 GLU 68 HG3 GLU 68 -3.401 12.851 9.427 358 H LYS 69 H LYS 69 -8.411 13.988 8.270 359 HA LYS 69 HA LYS 69 -9.935 14.495 6.658 360 HB2 LYS 69 HB2 LYS 69 -8.500 17.134 6.361 361 HB3 LYS 69 HB3 LYS 69 -10.173 16.772 5.949 362 HG2 LYS 69 HG2 LYS 69 -9.092 16.651 8.753 363 HG3 LYS 69 HG3 LYS 69 -9.846 18.085 8.053 364 HD2 LYS 69 HD2 LYS 69 -11.526 15.828 7.576 365 HD3 LYS 69 HD3 LYS 69 -11.101 15.873 9.288 366 HE2 LYS 69 HE2 LYS 69 -11.656 18.474 8.869 367 HE3 LYS 69 HE3 LYS 69 -12.730 17.737 7.681 368 HZ1 LYS 69 HZ1 LYS 69 -12.945 16.304 10.077 369 HZ2 LYS 69 HZ2 LYS 69 -14.126 17.235 9.303 370 HZ3 LYS 69 HZ3 LYS 69 -13.101 17.950 10.442 371 H ASP 70 H ASP 70 -7.757 12.988 5.876 372 HA ASP 70 HA ASP 70 -7.209 13.986 3.158 373 HB2 ASP 70 HB2 ASP 70 -5.552 12.396 5.079 374 HB3 ASP 70 HB3 ASP 70 -5.311 12.173 3.348 375 H LEU 71 H LEU 71 -9.609 12.627 3.892 376 HA LEU 71 HA LEU 71 -9.605 9.885 3.397 377 HB2 LEU 71 HB2 LEU 71 -11.796 11.753 2.534 378 HB3 LEU 71 HB3 LEU 71 -11.937 10.066 3.023 379 HG LEU 71 HG LEU 71 -11.305 12.403 4.823 380 HD11 LEU 71 HD11 LEU 71 -13.742 11.548 3.843 381 HD12 LEU 71 HD12 LEU 71 -13.478 12.536 5.280 382 HD13 LEU 71 HD13 LEU 71 -13.634 10.785 5.430 383 HD21 LEU 71 HD21 LEU 71 -10.122 10.532 5.671 384 HD22 LEU 71 HD22 LEU 71 -11.476 9.446 5.359 385 HD23 LEU 71 HD23 LEU 71 -11.600 10.668 6.624 386 H GLU 72 H GLU 72 -9.018 12.488 1.271 387 HA GLU 72 HA GLU 72 -9.945 11.637 -1.172 388 HB2 GLU 72 HB2 GLU 72 -8.852 13.771 -0.941 389 HB3 GLU 72 HB3 GLU 72 -7.336 12.999 -0.499 390 HG2 GLU 72 HG2 GLU 72 -6.968 12.223 -2.681 391 HG3 GLU 72 HG3 GLU 72 -8.634 12.536 -3.161 392 H LYS 73 H LYS 73 -6.772 10.849 0.250 393 HA LYS 73 HA LYS 73 -6.215 8.895 -1.786 394 HB2 LYS 73 HB2 LYS 73 -4.157 8.485 -0.555 395 HB3 LYS 73 HB3 LYS 73 -4.419 10.215 -0.733 396 HG2 LYS 73 HG2 LYS 73 -5.589 9.840 1.645 397 HG3 LYS 73 HG3 LYS 73 -4.398 8.538 1.693 398 HD2 LYS 73 HD2 LYS 73 -3.101 10.847 0.689 399 HD3 LYS 73 HD3 LYS 73 -4.014 11.332 2.119 400 HE2 LYS 73 HE2 LYS 73 -2.273 10.566 3.291 401 HE3 LYS 73 HE3 LYS 73 -2.879 8.958 2.901 402 HZ1 LYS 73 HZ1 LYS 73 -1.391 8.778 1.101 403 HZ2 LYS 73 HZ2 LYS 73 -0.474 9.366 2.395 404 HZ3 LYS 73 HZ3 LYS 73 -0.972 10.416 1.165 405 H LEU 74 H LEU 74 -7.734 8.913 1.305 406 HA LEU 74 HA LEU 74 -7.320 6.330 2.214 407 HB2 LEU 74 HB2 LEU 74 -8.511 8.131 3.433 408 HB3 LEU 74 HB3 LEU 74 -9.895 7.890 2.368 409 HG LEU 74 HG LEU 74 -10.096 5.573 3.246 410 HD11 LEU 74 HD11 LEU 74 -7.688 5.441 3.961 411 HD12 LEU 74 HD12 LEU 74 -8.864 4.849 5.133 412 HD13 LEU 74 HD13 LEU 74 -8.127 6.436 5.349 413 HD21 LEU 74 HD21 LEU 74 -10.990 6.238 5.448 414 HD22 LEU 74 HD22 LEU 74 -11.494 7.322 4.151 415 HD23 LEU 74 HD23 LEU 74 -10.215 7.811 5.264 416 H ASP 75 H ASP 75 -10.074 7.456 0.243 417 HA ASP 75 HA ASP 75 -11.183 4.942 -0.241 418 HB2 ASP 75 HB2 ASP 75 -11.446 7.641 -1.377 419 HB3 ASP 75 HB3 ASP 75 -11.833 6.343 -2.503 420 H LEU 76 H LEU 76 -8.452 6.525 -1.676 421 HA LEU 76 HA LEU 76 -8.331 4.860 -4.008 422 HB2 LEU 76 HB2 LEU 76 -6.186 6.568 -2.755 423 HB3 LEU 76 HB3 LEU 76 -6.154 5.881 -4.378 424 HG LEU 76 HG LEU 76 -8.152 7.934 -3.435 425 HD11 LEU 76 HD11 LEU 76 -6.119 8.670 -5.422 426 HD12 LEU 76 HD12 LEU 76 -5.514 8.421 -3.786 427 HD13 LEU 76 HD13 LEU 76 -6.792 9.599 -4.083 428 HD21 LEU 76 HD21 LEU 76 -9.017 7.942 -5.546 429 HD22 LEU 76 HD22 LEU 76 -8.546 6.247 -5.428 430 HD23 LEU 76 HD23 LEU 76 -7.514 7.392 -6.287 431 H VAL 77 H VAL 77 -6.692 4.937 -0.870 432 HA VAL 77 HA VAL 77 -4.966 2.743 -1.418 433 HB VAL 77 HB VAL 77 -5.846 3.917 1.222 434 HG11 VAL 77 HG11 VAL 77 -4.929 2.114 2.152 435 HG12 VAL 77 HG12 VAL 77 -4.306 1.544 0.601 436 HG13 VAL 77 HG13 VAL 77 -3.376 2.700 1.556 437 HG21 VAL 77 HG21 VAL 77 -3.819 5.151 1.196 438 HG22 VAL 77 HG22 VAL 77 -3.222 4.275 -0.213 439 HG23 VAL 77 HG23 VAL 77 -4.575 5.394 -0.379 440 H ILE 78 H ILE 78 -8.075 3.060 0.250 441 HA ILE 78 HA ILE 78 -8.317 0.464 1.222 442 HB ILE 78 HB ILE 78 -10.445 2.381 0.277 443 HG12 ILE 78 HG12 ILE 78 -9.139 3.113 2.221 444 HG13 ILE 78 HG13 ILE 78 -10.797 2.740 2.681 445 HG21 ILE 78 HG21 ILE 78 -10.653 -0.415 1.055 446 HG22 ILE 78 HG22 ILE 78 -11.658 0.650 2.037 447 HG23 ILE 78 HG23 ILE 78 -11.840 0.638 0.283 448 HD11 ILE 78 HD11 ILE 78 -9.925 1.514 4.309 449 HD12 ILE 78 HD12 ILE 78 -9.453 0.359 3.062 450 HD13 ILE 78 HD13 ILE 78 -8.311 1.590 3.602 451 H LYS 79 H LYS 79 -9.694 1.764 -1.804 452 HA LYS 79 HA LYS 79 -10.571 -0.719 -2.794 453 HB2 LYS 79 HB2 LYS 79 -10.812 0.418 -4.939 454 HB3 LYS 79 HB3 LYS 79 -11.411 1.431 -3.633 455 HG2 LYS 79 HG2 LYS 79 -10.216 3.009 -4.699 456 HG3 LYS 79 HG3 LYS 79 -8.888 2.323 -3.761 457 HD2 LYS 79 HD2 LYS 79 -8.010 2.385 -5.906 458 HD3 LYS 79 HD3 LYS 79 -8.608 0.729 -5.786 459 HE2 LYS 79 HE2 LYS 79 -10.517 2.746 -6.791 460 HE3 LYS 79 HE3 LYS 79 -9.158 2.364 -7.846 461 HZ1 LYS 79 HZ1 LYS 79 -10.410 0.660 -8.505 462 HZ2 LYS 79 HZ2 LYS 79 -11.462 0.782 -7.187 463 HZ3 LYS 79 HZ3 LYS 79 -10.010 -0.073 -7.033 464 H TYR 80 H TYR 80 -7.522 1.002 -3.105 465 HA TYR 80 HA TYR 80 -6.379 -0.570 -5.135 466 HB2 TYR 80 HB2 TYR 80 -5.431 1.580 -4.468 467 HB3 TYR 80 HB3 TYR 80 -5.033 0.933 -2.880 468 HD1 TYR 80 HD1 TYR 80 -3.197 -0.672 -2.616 469 HD2 TYR 80 HD2 TYR 80 -4.080 1.069 -6.396 470 HE1 TYR 80 HE1 TYR 80 -1.001 -1.394 -3.454 471 HE2 TYR 80 HE2 TYR 80 -1.887 0.349 -7.246 472 HH TYR 80 HH TYR 80 0.242 -0.326 -6.508 473 H MET 81 H MET 81 -6.075 -0.801 -1.594 474 HA MET 81 HA MET 81 -4.485 -3.146 -1.634 475 HB2 MET 81 HB2 MET 81 -4.831 -3.234 0.735 476 HB3 MET 81 HB3 MET 81 -4.647 -1.545 0.281 477 HG2 MET 81 HG2 MET 81 -6.949 -1.120 0.537 478 HG3 MET 81 HG3 MET 81 -7.333 -2.838 0.617 479 HE1 MET 81 HE1 MET 81 -5.241 -0.079 3.270 480 HE2 MET 81 HE2 MET 81 -6.454 0.259 2.036 481 HE3 MET 81 HE3 MET 81 -6.942 0.060 3.720 482 H LYS 82 H LYS 82 -7.898 -2.571 -1.818 483 HA LYS 82 HA LYS 82 -8.838 -5.090 -0.982 484 HB2 LYS 82 HB2 LYS 82 -9.928 -2.713 -2.191 485 HB3 LYS 82 HB3 LYS 82 -10.583 -4.141 -2.980 486 HG2 LYS 82 HG2 LYS 82 -10.549 -4.324 -0.066 487 HG3 LYS 82 HG3 LYS 82 -11.546 -3.009 -0.692 488 HD2 LYS 82 HD2 LYS 82 -11.889 -5.501 -2.165 489 HD3 LYS 82 HD3 LYS 82 -12.306 -5.647 -0.455 490 HE2 LYS 82 HE2 LYS 82 -13.818 -3.751 -0.645 491 HE3 LYS 82 HE3 LYS 82 -13.369 -3.542 -2.338 492 HZ1 LYS 82 HZ1 LYS 82 -14.591 -6.029 -1.283 493 HZ2 LYS 82 HZ2 LYS 82 -14.382 -5.586 -2.902 494 HZ3 LYS 82 HZ3 LYS 82 -15.498 -4.759 -1.937 495 H ARG 83 H ARG 83 -8.424 -3.841 -4.302 496 HA ARG 83 HA ARG 83 -8.966 -6.171 -5.678 497 HB2 ARG 83 HB2 ARG 83 -8.066 -5.148 -7.551 498 HB3 ARG 83 HB3 ARG 83 -8.436 -3.766 -6.527 499 HG2 ARG 83 HG2 ARG 83 -5.959 -4.109 -5.722 500 HG3 ARG 83 HG3 ARG 83 -5.803 -4.919 -7.282 501 HD2 ARG 83 HD2 ARG 83 -7.114 -2.244 -7.159 502 HD3 ARG 83 HD3 ARG 83 -5.358 -2.341 -7.044 503 HE ARG 83 HE ARG 83 -6.386 -3.834 -9.251 504 HH11 ARG 83 HH11 ARG 83 -5.515 -0.640 -8.174 505 HH12 ARG 83 HH12 ARG 83 -5.197 -0.047 -9.770 506 HH21 ARG 83 HH21 ARG 83 -5.971 -3.065 -11.358 507 HH22 ARG 83 HH22 ARG 83 -5.457 -1.426 -11.581 508 H LEU 84 H LEU 84 -6.113 -5.286 -3.900 509 HA LEU 84 HA LEU 84 -4.479 -7.385 -5.017 510 HB2 LEU 84 HB2 LEU 84 -4.048 -5.616 -2.614 511 HB3 LEU 84 HB3 LEU 84 -2.848 -6.706 -3.306 512 HG LEU 84 HG LEU 84 -4.051 -4.417 -4.849 513 HD11 LEU 84 HD11 LEU 84 -3.017 -3.216 -3.189 514 HD12 LEU 84 HD12 LEU 84 -1.683 -3.435 -4.322 515 HD13 LEU 84 HD13 LEU 84 -1.803 -4.461 -2.891 516 HD21 LEU 84 HD21 LEU 84 -3.019 -5.560 -6.481 517 HD22 LEU 84 HD22 LEU 84 -2.049 -6.502 -5.347 518 HD23 LEU 84 HD23 LEU 84 -1.545 -4.873 -5.798 519 H MET 85 H MET 85 -5.867 -6.732 -1.795 520 HA MET 85 HA MET 85 -5.162 -9.168 -0.625 521 HB2 MET 85 HB2 MET 85 -7.422 -7.254 -0.059 522 HB3 MET 85 HB3 MET 85 -7.124 -8.680 0.926 523 HG2 MET 85 HG2 MET 85 -4.716 -7.714 1.108 524 HG3 MET 85 HG3 MET 85 -5.492 -6.204 0.636 525 HE1 MET 85 HE1 MET 85 -4.763 -5.044 2.365 526 HE2 MET 85 HE2 MET 85 -5.803 -4.761 3.761 527 HE3 MET 85 HE3 MET 85 -4.385 -5.800 3.913 528 H GLN 86 H GLN 86 -7.797 -8.327 -2.747 529 HA GLN 86 HA GLN 86 -9.286 -10.738 -2.262 530 HB2 GLN 86 HB2 GLN 86 -9.513 -8.607 -4.389 531 HB3 GLN 86 HB3 GLN 86 -10.606 -9.979 -4.262 532 HG2 GLN 86 HG2 GLN 86 -10.247 -8.377 -1.815 533 HG3 GLN 86 HG3 GLN 86 -11.078 -7.586 -3.154 534 HE21 GLN 86 HE21 GLN 86 -12.664 -7.757 -1.196 535 HE22 GLN 86 HE22 GLN 86 -13.755 -9.093 -1.273 536 H GLN 87 H GLN 87 -7.415 -9.488 -5.027 537 HA GLN 87 HA GLN 87 -7.559 -11.879 -6.528 538 HB2 GLN 87 HB2 GLN 87 -6.070 -10.864 -8.035 539 HB3 GLN 87 HB3 GLN 87 -6.977 -9.524 -7.346 540 HG2 GLN 87 HG2 GLN 87 -5.110 -9.106 -5.789 541 HG3 GLN 87 HG3 GLN 87 -4.198 -10.390 -6.581 542 HE21 GLN 87 HE21 GLN 87 -6.247 -7.787 -7.840 543 HE22 GLN 87 HE22 GLN 87 -5.039 -7.096 -8.864 544 H SER 88 H SER 88 -5.752 -11.041 -3.783 545 HA SER 88 HA SER 88 -3.343 -12.360 -4.112 546 HB2 SER 88 HB2 SER 88 -5.025 -11.593 -1.804 547 HB3 SER 88 HB3 SER 88 -3.854 -12.875 -1.498 548 HG SER 88 HG SER 88 -3.362 -10.250 -2.445 549 H VAL 89 H VAL 89 -2.758 -14.422 -2.818 550 HA VAL 89 HA VAL 89 -4.514 -16.547 -3.798 551 HB VAL 89 HB VAL 89 -2.238 -16.797 -4.493 552 HG11 VAL 89 HG11 VAL 89 -0.407 -17.048 -2.819 553 HG12 VAL 89 HG12 VAL 89 -1.099 -15.427 -2.894 554 HG13 VAL 89 HG13 VAL 89 -1.538 -16.516 -1.576 555 HG21 VAL 89 HG21 VAL 89 -3.433 -18.846 -3.852 556 HG22 VAL 89 HG22 VAL 89 -1.694 -18.989 -3.594 557 HG23 VAL 89 HG23 VAL 89 -2.770 -18.712 -2.224 558 H GLU 90 H GLU 90 -3.160 -15.246 -0.839 559 HA GLU 90 HA GLU 90 -4.193 -17.420 0.774 560 HB2 GLU 90 HB2 GLU 90 -2.625 -14.927 1.340 561 HB3 GLU 90 HB3 GLU 90 -3.404 -15.795 2.656 562 HG2 GLU 90 HG2 GLU 90 -1.412 -16.981 0.738 563 HG3 GLU 90 HG3 GLU 90 -1.051 -16.420 2.369 564 H SER 91 H SER 91 -6.286 -17.503 1.227 565 HA SER 91 HA SER 91 -8.121 -15.430 0.903 566 HB2 SER 91 HB2 SER 91 -8.426 -18.038 1.254 567 HB3 SER 91 HB3 SER 91 -8.666 -17.556 2.932 568 HG SER 91 HG SER 91 -10.053 -16.273 0.840 569 H VAL 92 H VAL 92 -6.016 -16.176 3.543 570 HA VAL 92 HA VAL 92 -7.302 -14.989 5.693 571 HB VAL 92 HB VAL 92 -5.148 -16.255 5.804 572 HG11 VAL 92 HG11 VAL 92 -3.212 -15.498 4.949 573 HG12 VAL 92 HG12 VAL 92 -4.255 -14.501 3.935 574 HG13 VAL 92 HG13 VAL 92 -3.545 -13.827 5.404 575 HG21 VAL 92 HG21 VAL 92 -6.134 -14.441 7.509 576 HG22 VAL 92 HG22 VAL 92 -4.647 -15.339 7.817 577 HG23 VAL 92 HG23 VAL 92 -4.570 -13.698 7.173 578 H TRP 93 H TRP 93 -5.774 -13.526 2.942 579 HA TRP 93 HA TRP 93 -5.350 -10.944 3.991 580 HB2 TRP 93 HB2 TRP 93 -5.547 -12.128 1.265 581 HB3 TRP 93 HB3 TRP 93 -5.703 -10.379 1.408 582 HD1 TRP 93 HD1 TRP 93 -3.155 -12.744 0.639 583 HE1 TRP 93 HE1 TRP 93 -0.802 -11.898 1.250 584 HE3 TRP 93 HE3 TRP 93 -4.456 -8.899 3.749 585 HZ2 TRP 93 HZ2 TRP 93 0.350 -9.871 2.840 586 HZ3 TRP 93 HZ3 TRP 93 -2.668 -7.557 4.775 587 HH2 TRP 93 HH2 TRP 93 -0.315 -8.034 4.329 588 H ASN 94 H ASN 94 -8.144 -12.470 2.483 589 HA ASN 94 HA ASN 94 -9.741 -10.235 2.061 590 HB2 ASN 94 HB2 ASN 94 -10.370 -13.110 2.675 591 HB3 ASN 94 HB3 ASN 94 -11.662 -11.927 2.503 592 HD21 ASN 94 HD21 ASN 94 -8.808 -13.203 0.858 593 HD22 ASN 94 HD22 ASN 94 -9.430 -13.015 -0.743 594 H MET 95 H MET 95 -9.223 -12.128 4.994 595 HA MET 95 HA MET 95 -11.207 -10.772 6.531 596 HB2 MET 95 HB2 MET 95 -8.812 -12.274 7.589 597 HB3 MET 95 HB3 MET 95 -10.336 -11.969 8.414 598 HG2 MET 95 HG2 MET 95 -11.354 -13.310 6.426 599 HG3 MET 95 HG3 MET 95 -9.710 -13.916 6.250 600 HE1 MET 95 HE1 MET 95 -8.541 -15.253 7.501 601 HE2 MET 95 HE2 MET 95 -8.593 -15.059 9.253 602 HE3 MET 95 HE3 MET 95 -9.233 -16.524 8.508 603 H ALA 96 H ALA 96 -7.732 -10.390 6.068 604 HA ALA 96 HA ALA 96 -7.142 -8.590 8.084 605 HB1 ALA 96 HB1 ALA 96 -5.215 -7.996 6.857 606 HB2 ALA 96 HB2 ALA 96 -5.546 -9.681 6.452 607 HB3 ALA 96 HB3 ALA 96 -5.977 -8.400 5.318 608 H PHE 97 H PHE 97 -8.461 -7.952 4.856 609 HA PHE 97 HA PHE 97 -8.405 -5.171 4.913 610 HB2 PHE 97 HB2 PHE 97 -8.936 -6.476 2.897 611 HB3 PHE 97 HB3 PHE 97 -10.469 -6.962 3.613 612 HD1 PHE 97 HD2 PHE 97 -8.653 -3.726 3.189 613 HD2 PHE 97 HD1 PHE 97 -12.262 -5.917 2.654 614 HE1 PHE 97 HE2 PHE 97 -9.724 -1.724 2.240 615 HE2 PHE 97 HE1 PHE 97 -13.338 -3.919 1.704 616 HZ PHE 97 HZ PHE 97 -12.069 -1.819 1.496 617 H ASP 98 H ASP 98 -11.007 -7.372 5.929 618 HA ASP 98 HA ASP 98 -12.793 -5.370 6.781 619 HB2 ASP 98 HB2 ASP 98 -13.108 -7.964 6.406 620 HB3 ASP 98 HB3 ASP 98 -12.744 -8.039 8.128 621 H PHE 99 H PHE 99 -10.170 -7.047 8.410 622 HA PHE 99 HA PHE 99 -10.725 -6.272 11.041 623 HB2 PHE 99 HB2 PHE 99 -9.091 -7.946 10.772 624 HB3 PHE 99 HB3 PHE 99 -8.175 -6.987 9.613 625 HD1 PHE 99 HD2 PHE 99 -8.908 -7.537 13.153 626 HD2 PHE 99 HD1 PHE 99 -6.653 -5.270 10.344 627 HE1 PHE 99 HE2 PHE 99 -7.460 -6.733 14.971 628 HE2 PHE 99 HE1 PHE 99 -5.200 -4.462 12.158 629 HZ PHE 99 HZ PHE 99 -5.603 -5.192 14.476 630 H ILE 100 H ILE 100 -8.762 -4.691 8.544 631 HA ILE 100 HA ILE 100 -7.961 -2.505 10.158 632 HB ILE 100 HB ILE 100 -8.153 -2.679 7.148 633 HG12 ILE 100 HG12 ILE 100 -5.590 -2.845 8.674 634 HG13 ILE 100 HG13 ILE 100 -6.623 -4.269 8.618 635 HG21 ILE 100 HG21 ILE 100 -6.863 -0.670 8.974 636 HG22 ILE 100 HG22 ILE 100 -6.392 -0.859 7.286 637 HG23 ILE 100 HG23 ILE 100 -8.042 -0.389 7.695 638 HD11 ILE 100 HD11 ILE 100 -4.748 -3.937 6.853 639 HD12 ILE 100 HD12 ILE 100 -6.324 -4.559 6.361 640 HD13 ILE 100 HD13 ILE 100 -5.920 -2.865 6.087 641 H LEU 101 H LEU 101 -10.681 -3.032 7.976 642 HA LEU 101 HA LEU 101 -11.635 -0.356 8.040 643 HB2 LEU 101 HB2 LEU 101 -12.779 -2.989 7.213 644 HB3 LEU 101 HB3 LEU 101 -13.825 -1.576 7.332 645 HG LEU 101 HG LEU 101 -11.346 -1.616 5.627 646 HD11 LEU 101 HD11 LEU 101 -14.078 -2.666 5.076 647 HD12 LEU 101 HD12 LEU 101 -12.506 -3.278 4.560 648 HD13 LEU 101 HD13 LEU 101 -13.196 -1.851 3.783 649 HD21 LEU 101 HD21 LEU 101 -12.241 0.311 4.614 650 HD22 LEU 101 HD22 LEU 101 -12.451 0.553 6.349 651 HD23 LEU 101 HD23 LEU 101 -13.823 0.064 5.354 652 H ASP 102 H ASP 102 -12.195 -3.203 10.009 653 HA ASP 102 HA ASP 102 -14.472 -2.348 11.396 654 HB2 ASP 102 HB2 ASP 102 -13.173 -4.641 11.395 655 HB3 ASP 102 HB3 ASP 102 -12.362 -3.944 12.793 656 H ASN 103 H ASN 103 -11.140 -1.434 11.682 657 HA ASN 103 HA ASN 103 -11.642 -0.041 14.207 658 HB2 ASN 103 HB2 ASN 103 -9.121 -0.668 12.672 659 HB3 ASN 103 HB3 ASN 103 -9.137 0.434 14.046 660 HD21 ASN 103 HD21 ASN 103 -9.514 -2.859 13.004 661 HD22 ASN 103 HD22 ASN 103 -9.397 -3.579 14.570 662 H VAL 104 H VAL 104 -10.683 0.568 10.862 663 HA VAL 104 HA VAL 104 -10.359 3.380 11.182 664 HB VAL 104 HB VAL 104 -10.795 1.723 8.696 665 HG11 VAL 104 HG11 VAL 104 -9.963 3.702 7.474 666 HG12 VAL 104 HG12 VAL 104 -11.510 3.993 8.273 667 HG13 VAL 104 HG13 VAL 104 -10.020 4.624 8.976 668 HG21 VAL 104 HG21 VAL 104 -8.256 3.010 9.670 669 HG22 VAL 104 HG22 VAL 104 -8.706 1.353 10.072 670 HG23 VAL 104 HG23 VAL 104 -8.449 1.812 8.389 671 H GLN 105 H GLN 105 -12.875 1.491 9.494 672 HA GLN 105 HA GLN 105 -14.618 3.522 8.888 673 HB2 GLN 105 HB2 GLN 105 -15.378 0.741 9.796 674 HB3 GLN 105 HB3 GLN 105 -16.396 1.838 8.872 675 HG2 GLN 105 HG2 GLN 105 -13.727 0.986 7.828 676 HG3 GLN 105 HG3 GLN 105 -15.145 -0.047 7.646 677 HE21 GLN 105 HE21 GLN 105 -13.712 3.026 6.813 678 HE22 GLN 105 HE22 GLN 105 -14.734 3.358 5.460 679 H VAL 106 H VAL 106 -14.018 2.045 11.982 680 HA VAL 106 HA VAL 106 -16.350 3.021 13.294 681 HB VAL 106 HB VAL 106 -13.738 1.904 14.255 682 HG11 VAL 106 HG11 VAL 106 -14.040 3.466 15.943 683 HG12 VAL 106 HG12 VAL 106 -15.800 3.361 15.863 684 HG13 VAL 106 HG13 VAL 106 -14.868 2.044 16.577 685 HG21 VAL 106 HG21 VAL 106 -15.017 0.070 14.956 686 HG22 VAL 106 HG22 VAL 106 -16.525 0.980 14.885 687 HG23 VAL 106 HG23 VAL 106 -15.706 0.515 13.394 688 H VAL 107 H VAL 107 -12.937 4.053 13.466 689 HA VAL 107 HA VAL 107 -13.446 6.383 14.972 690 HB VAL 107 HB VAL 107 -11.221 5.454 14.915 691 HG11 VAL 107 HG11 VAL 107 -9.906 5.925 12.696 692 HG12 VAL 107 HG12 VAL 107 -10.873 4.460 12.872 693 HG13 VAL 107 HG13 VAL 107 -11.512 5.837 11.972 694 HG21 VAL 107 HG21 VAL 107 -9.916 7.479 14.416 695 HG22 VAL 107 HG22 VAL 107 -11.315 8.164 13.587 696 HG23 VAL 107 HG23 VAL 107 -11.386 7.843 15.321 697 H LEU 108 H LEU 108 -13.666 5.689 11.586 698 HA LEU 108 HA LEU 108 -13.556 8.400 10.683 699 HB2 LEU 108 HB2 LEU 108 -13.371 7.409 8.713 700 HB3 LEU 108 HB3 LEU 108 -13.581 5.851 9.511 701 HG LEU 108 HG LEU 108 -16.080 6.196 9.202 702 HD11 LEU 108 HD11 LEU 108 -16.708 8.213 8.501 703 HD12 LEU 108 HD12 LEU 108 -16.091 7.750 6.916 704 HD13 LEU 108 HD13 LEU 108 -15.063 8.647 8.034 705 HD21 LEU 108 HD21 LEU 108 -15.149 6.052 6.470 706 HD22 LEU 108 HD22 LEU 108 -15.856 4.796 7.488 707 HD23 LEU 108 HD23 LEU 108 -14.122 5.111 7.553 708 H GLN 109 H GLN 109 -16.127 6.142 11.537 709 HA GLN 109 HA GLN 109 -18.282 7.758 10.666 710 HB2 GLN 109 HB2 GLN 109 -18.034 5.434 12.549 711 HB3 GLN 109 HB3 GLN 109 -19.557 6.300 12.403 712 HG2 GLN 109 HG2 GLN 109 -19.726 5.756 10.086 713 HG3 GLN 109 HG3 GLN 109 -18.099 5.081 10.074 714 HE21 GLN 109 HE21 GLN 109 -17.816 3.313 11.812 715 HE22 GLN 109 HE22 GLN 109 -19.070 2.126 11.867 716 H GLN 110 H GLN 110 -16.613 7.427 13.763 717 HA GLN 110 HA GLN 110 -18.338 9.069 15.267 718 HB2 GLN 110 HB2 GLN 110 -15.423 8.377 15.625 719 HB3 GLN 110 HB3 GLN 110 -16.347 9.303 16.801 720 HG2 GLN 110 HG2 GLN 110 -17.951 7.343 16.869 721 HG3 GLN 110 HG3 GLN 110 -16.726 6.444 15.975 722 HE21 GLN 110 HE21 GLN 110 -15.175 5.468 17.087 723 HE22 GLN 110 HE22 GLN 110 -14.830 5.716 18.762 724 H THR 111 H THR 111 -16.137 9.820 12.807 725 HA THR 111 HA THR 111 -15.747 12.571 13.722 726 HB THR 111 HB THR 111 -14.602 11.089 11.349 727 HG1 THR 111 HG1 THR 111 -13.862 10.794 13.686 728 HG21 THR 111 HG21 THR 111 -14.146 13.926 12.278 729 HG22 THR 111 HG22 THR 111 -14.856 13.414 10.746 730 HG23 THR 111 HG23 THR 111 -13.155 13.092 11.082 731 H TYR 112 H TYR 112 -16.703 10.987 10.666 732 HA TYR 112 HA TYR 112 -18.303 13.360 10.018 733 HB2 TYR 112 HB2 TYR 112 -17.668 11.088 8.142 734 HB3 TYR 112 HB3 TYR 112 -18.165 12.728 7.740 735 HD1 TYR 112 HD2 TYR 112 -16.566 14.573 7.838 736 HD2 TYR 112 HD1 TYR 112 -15.371 10.580 8.692 737 HE1 TYR 112 HE2 TYR 112 -14.209 15.236 7.606 738 HE2 TYR 112 HE1 TYR 112 -13.010 11.232 8.463 739 HH TYR 112 HH TYR 112 -11.820 13.962 8.735 740 H GLY 113 H GLY 113 -18.500 9.826 10.215 741 HA2 GLY 113 HA2 GLY 113 -20.501 8.865 11.223 742 HA3 GLY 113 HA3 GLY 113 -21.433 10.109 10.404 743 H SER 114 H SER 114 -19.455 9.513 8.055 744 HA SER 114 HA SER 114 -21.189 7.486 6.867 745 HB2 SER 114 HB2 SER 114 -20.423 9.792 5.809 746 HB3 SER 114 HB3 SER 114 -19.019 8.844 5.321 747 HG SER 114 HG SER 114 -21.719 8.143 4.790 748 H THR 115 H THR 115 -19.755 6.235 5.039 749 HA THR 115 HA THR 115 -17.264 5.247 6.148 750 HB THR 115 HB THR 115 -17.977 2.888 6.139 751 HG1 THR 115 HG1 THR 115 -20.298 2.518 6.100 752 HG21 THR 115 HG21 THR 115 -19.849 4.423 7.924 753 HG22 THR 115 HG22 THR 115 -18.106 4.407 8.194 754 HG23 THR 115 HG23 THR 115 -19.021 2.900 8.248 755 H LEU 116 H LEU 116 -16.663 3.165 4.684 756 HA LEU 116 HA LEU 116 -16.792 4.175 1.940 757 HB2 LEU 116 HB2 LEU 116 -14.751 3.042 3.529 758 HB3 LEU 116 HB3 LEU 116 -15.079 1.904 2.224 759 HG LEU 116 HG LEU 116 -14.900 4.263 0.865 760 HD11 LEU 116 HD11 LEU 116 -12.819 4.365 3.044 761 HD12 LEU 116 HD12 LEU 116 -14.219 5.431 2.933 762 HD13 LEU 116 HD13 LEU 116 -12.980 5.470 1.678 763 HD21 LEU 116 HD21 LEU 116 -13.716 1.875 0.761 764 HD22 LEU 116 HD22 LEU 116 -12.361 2.827 1.371 765 HD23 LEU 116 HD23 LEU 116 -13.135 3.268 -0.152 766 H LYS 117 H LYS 117 -17.455 2.927 0.211 767 HA LYS 117 HA LYS 117 -19.287 0.779 0.875 768 HB2 LYS 117 HB2 LYS 117 -20.006 2.472 -0.721 769 HB3 LYS 117 HB3 LYS 117 -18.633 2.112 -1.760 770 HG2 LYS 117 HG2 LYS 117 -20.337 -0.192 -1.135 771 HG3 LYS 117 HG3 LYS 117 -21.117 1.084 -2.073 772 HD2 LYS 117 HD2 LYS 117 -20.065 0.402 -3.908 773 HD3 LYS 117 HD3 LYS 117 -18.502 0.643 -3.122 774 HE2 LYS 117 HE2 LYS 117 -18.321 -1.582 -3.507 775 HE3 LYS 117 HE3 LYS 117 -19.198 -1.670 -1.980 776 HZ1 LYS 117 HZ1 LYS 117 -21.182 -1.460 -3.800 777 HZ2 LYS 117 HZ2 LYS 117 -20.635 -2.911 -3.126 778 HZ3 LYS 117 HZ3 LYS 117 -20.049 -2.404 -4.629 779 H VAL 118 H VAL 118 -18.148 -1.039 1.372 780 HA VAL 118 HA VAL 118 -16.329 -2.073 -0.706 781 HB VAL 118 HB VAL 118 -15.365 -3.487 1.171 782 HG11 VAL 118 HG11 VAL 118 -13.858 -1.903 0.580 783 HG12 VAL 118 HG12 VAL 118 -15.013 -0.580 0.753 784 HG13 VAL 118 HG13 VAL 118 -14.247 -1.275 2.182 785 HG21 VAL 118 HG21 VAL 118 -16.122 -3.322 3.260 786 HG22 VAL 118 HG22 VAL 118 -16.059 -1.560 3.220 787 HG23 VAL 118 HG23 VAL 118 -17.480 -2.406 2.607 788 H THR 119 H THR 119 -17.430 -3.506 -1.882 789 HA THR 119 HA THR 119 -19.668 -4.970 -0.990 790 HB THR 119 HB THR 119 -19.199 -4.494 -3.380 791 HG1 THR 119 HG1 THR 119 -20.528 -6.116 -3.609 792 HG21 THR 119 HG21 THR 119 -16.800 -4.925 -3.401 793 HG22 THR 119 HG22 THR 119 -17.616 -5.942 -4.589 794 HG23 THR 119 HG23 THR 119 -17.087 -6.630 -3.054 795 H LYS 207 H LYS 207 8.329 -10.462 12.429 796 HA LYS 207 HA LYS 207 8.044 -8.366 14.328 797 HB2 LYS 207 HB2 LYS 207 10.628 -8.631 13.515 798 HB3 LYS 207 HB3 LYS 207 10.015 -7.506 12.310 799 HG2 LYS 207 HG2 LYS 207 10.691 -6.014 13.872 800 HG3 LYS 207 HG3 LYS 207 9.055 -6.304 14.470 801 HD2 LYS 207 HD2 LYS 207 11.056 -8.198 15.470 802 HD3 LYS 207 HD3 LYS 207 11.338 -6.524 15.956 803 HE2 LYS 207 HE2 LYS 207 8.677 -6.737 16.397 804 HE3 LYS 207 HE3 LYS 207 9.193 -8.391 16.724 805 HZ1 LYS 207 HZ1 LYS 207 9.217 -6.957 18.705 806 HZ2 LYS 207 HZ2 LYS 207 10.387 -5.977 17.976 807 HZ3 LYS 207 HZ3 LYS 207 10.745 -7.589 18.348 808 H SER 208 H SER 208 7.754 -6.176 13.022 809 HA SER 208 HA SER 208 5.718 -6.756 11.047 810 HB2 SER 208 HB2 SER 208 4.799 -4.905 11.910 811 HB3 SER 208 HB3 SER 208 6.228 -4.662 12.915 812 HG SER 208 HG SER 208 5.657 -2.920 11.398 813 H PHE 209 H PHE 209 6.065 -6.810 8.937 814 HA PHE 209 HA PHE 209 8.502 -6.457 7.694 815 HB2 PHE 209 HB2 PHE 209 6.861 -7.652 6.495 816 HB3 PHE 209 HB3 PHE 209 5.685 -6.349 6.640 817 HD1 PHE 209 HD2 PHE 209 8.926 -7.232 5.061 818 HD2 PHE 209 HD1 PHE 209 5.451 -4.777 4.944 819 HE1 PHE 209 HE2 PHE 209 9.604 -6.383 2.855 820 HE2 PHE 209 HE1 PHE 209 6.124 -3.924 2.736 821 HZ PHE 209 HZ PHE 209 8.204 -4.727 1.689 822 H PHE 210 H PHE 210 5.842 -4.130 8.000 823 HA PHE 210 HA PHE 210 6.970 -2.066 6.485 824 HB2 PHE 210 HB2 PHE 210 5.069 -1.947 8.834 825 HB3 PHE 210 HB3 PHE 210 5.456 -0.569 7.809 826 HD1 PHE 210 HD1 PHE 210 5.160 -1.073 5.208 827 HD2 PHE 210 HD2 PHE 210 3.159 -3.115 8.361 828 HE1 PHE 210 HE1 PHE 210 3.379 -1.735 3.644 829 HE2 PHE 210 HE2 PHE 210 1.376 -3.780 6.803 830 HZ PHE 210 HZ PHE 210 1.485 -3.091 4.440 831 H ASP 211 H ASP 211 7.619 -3.150 9.716 832 HA ASP 211 HA ASP 211 8.946 -0.783 10.606 833 HB2 ASP 211 HB2 ASP 211 7.950 -2.522 12.119 834 HB3 ASP 211 HB3 ASP 211 9.274 -3.593 11.667 835 H LYS 212 H LYS 212 10.034 -3.884 9.281 836 HA LYS 212 HA LYS 212 12.811 -3.153 9.393 837 HB2 LYS 212 HB2 LYS 212 13.240 -5.268 8.347 838 HB3 LYS 212 HB3 LYS 212 11.984 -5.507 9.554 839 HG2 LYS 212 HG2 LYS 212 10.288 -5.588 7.867 840 HG3 LYS 212 HG3 LYS 212 11.450 -5.141 6.616 841 HD2 LYS 212 HD2 LYS 212 12.594 -7.359 7.793 842 HD3 LYS 212 HD3 LYS 212 10.871 -7.743 7.786 843 HE2 LYS 212 HE2 LYS 212 11.141 -6.763 5.296 844 HE3 LYS 212 HE3 LYS 212 12.760 -7.416 5.538 845 HZ1 LYS 212 HZ1 LYS 212 10.216 -8.805 5.288 846 HZ2 LYS 212 HZ2 LYS 212 11.306 -9.447 6.411 847 HZ3 LYS 212 HZ3 LYS 212 11.762 -9.280 4.791 848 H LYS 213 H LYS 213 10.232 -2.610 7.227 849 HA LYS 213 HA LYS 213 11.967 -2.190 4.926 850 HB2 LYS 213 HB2 LYS 213 9.456 -3.120 5.051 851 HB3 LYS 213 HB3 LYS 213 9.101 -1.409 4.852 852 HG2 LYS 213 HG2 LYS 213 11.012 -2.795 3.015 853 HG3 LYS 213 HG3 LYS 213 9.268 -2.900 2.762 854 HD2 LYS 213 HD2 LYS 213 10.376 -0.198 3.230 855 HD3 LYS 213 HD3 LYS 213 10.796 -0.968 1.698 856 HE2 LYS 213 HE2 LYS 213 8.730 0.449 1.638 857 HE3 LYS 213 HE3 LYS 213 8.506 -1.216 1.103 858 HZ1 LYS 213 HZ1 LYS 213 7.598 -1.757 3.272 859 HZ2 LYS 213 HZ2 LYS 213 6.717 -0.501 2.561 860 HZ3 LYS 213 HZ3 LYS 213 7.824 -0.165 3.795 861 H ARG 214 H ARG 214 9.930 -0.325 7.135 862 HA ARG 214 HA ARG 214 10.239 2.176 5.895 863 HB2 ARG 214 HB2 ARG 214 9.425 3.130 7.947 864 HB3 ARG 214 HB3 ARG 214 8.550 1.635 7.647 865 HG2 ARG 214 HG2 ARG 214 9.071 0.990 9.697 866 HG3 ARG 214 HG3 ARG 214 10.761 0.912 9.197 867 HD2 ARG 214 HD2 ARG 214 10.647 3.511 9.648 868 HD3 ARG 214 HD3 ARG 214 9.311 3.035 10.697 869 HE ARG 214 HE ARG 214 11.364 1.353 11.364 870 HH11 ARG 214 HH11 ARG 214 10.919 4.804 11.247 871 HH12 ARG 214 HH12 ARG 214 12.028 5.122 12.538 872 HH21 ARG 214 HH21 ARG 214 12.828 1.760 13.066 873 HH22 ARG 214 HH22 ARG 214 13.114 3.390 13.571 874 H SER 215 H SER 215 12.357 0.315 7.891 875 HA SER 215 HA SER 215 14.040 2.520 8.658 876 HB2 SER 215 HB2 SER 215 15.605 0.422 9.179 877 HB3 SER 215 HB3 SER 215 14.257 0.858 10.228 878 HG SER 215 HG SER 215 14.588 -1.331 8.598 879 H GLU 216 H GLU 216 14.484 -0.300 6.517 880 HA GLU 216 HA GLU 216 16.952 0.385 5.465 881 HB2 GLU 216 HB2 GLU 216 16.238 -0.963 3.458 882 HB3 GLU 216 HB3 GLU 216 16.071 -1.778 5.008 883 HG2 GLU 216 HG2 GLU 216 13.667 -1.174 5.007 884 HG3 GLU 216 HG3 GLU 216 13.876 -0.513 3.386 885 H ARG 217 H ARG 217 13.723 1.284 4.295 886 HA ARG 217 HA ARG 217 14.407 2.622 1.983 887 HB2 ARG 217 HB2 ARG 217 12.258 3.354 1.960 888 HB3 ARG 217 HB3 ARG 217 12.088 2.196 3.273 889 HG2 ARG 217 HG2 ARG 217 12.478 4.036 4.885 890 HG3 ARG 217 HG3 ARG 217 12.500 5.166 3.529 891 HD2 ARG 217 HD2 ARG 217 10.195 3.350 4.223 892 HD3 ARG 217 HD3 ARG 217 10.308 5.048 4.679 893 HE ARG 217 HE ARG 217 9.561 4.003 2.132 894 HH11 ARG 217 HH11 ARG 217 11.115 6.684 3.717 895 HH12 ARG 217 HH12 ARG 217 10.758 7.810 2.450 896 HH21 ARG 217 HH21 ARG 217 9.084 5.475 0.456 897 HH22 ARG 217 HH22 ARG 217 9.602 7.121 0.596 898 H ILE 218 H ILE 218 14.784 3.630 5.297 899 HA ILE 218 HA ILE 218 15.302 6.387 4.683 900 HB ILE 218 HB ILE 218 15.872 4.819 7.201 901 HG12 ILE 218 HG12 ILE 218 13.675 6.834 6.821 902 HG13 ILE 218 HG13 ILE 218 13.442 5.156 6.341 903 HG21 ILE 218 HG21 ILE 218 15.948 7.782 6.653 904 HG22 ILE 218 HG22 ILE 218 15.992 7.064 8.263 905 HG23 ILE 218 HG23 ILE 218 17.298 6.747 7.120 906 HD11 ILE 218 HD11 ILE 218 13.776 6.322 9.058 907 HD12 ILE 218 HD12 ILE 218 12.589 5.159 8.466 908 HD13 ILE 218 HD13 ILE 218 14.250 4.650 8.763 909 H SER 219 H SER 219 17.227 3.494 5.201 910 HA SER 219 HA SER 219 19.707 5.017 4.978 911 HB2 SER 219 HB2 SER 219 20.826 2.906 5.522 912 HB3 SER 219 HB3 SER 219 19.555 3.249 6.696 913 HG SER 219 HG SER 219 19.842 1.077 5.257 914 H ASN 220 H ASN 220 18.368 5.273 2.678 915 HA ASN 220 HA ASN 220 19.052 3.217 0.785 916 HB2 ASN 220 HB2 ASN 220 17.969 4.572 -0.847 917 HB3 ASN 220 HB3 ASN 220 17.022 4.727 0.629 918 HD21 ASN 220 HD21 ASN 220 17.893 6.432 -1.873 919 HD22 ASN 220 HD22 ASN 220 18.144 7.990 -1.170 Start of MODEL 10 1 H ALA 23 H ALA 23 4.989 13.681 12.478 2 HA ALA 23 HA ALA 23 3.068 12.747 13.278 3 HB1 ALA 23 HB1 ALA 23 1.796 14.134 14.596 4 HB2 ALA 23 HB2 ALA 23 3.258 15.101 14.399 5 HB3 ALA 23 HB3 ALA 23 1.830 15.456 13.429 6 H ALA 24 H ALA 24 3.259 13.048 10.396 7 HA ALA 24 HA ALA 24 0.450 13.471 9.643 8 HB1 ALA 24 HB1 ALA 24 2.965 14.020 8.347 9 HB2 ALA 24 HB2 ALA 24 1.930 13.025 7.322 10 HB3 ALA 24 HB3 ALA 24 1.343 14.572 7.931 11 HA PRO 25 HA PRO 25 -0.326 9.215 8.913 12 HB2 PRO 25 HB2 PRO 25 -1.819 9.277 6.646 13 HB3 PRO 25 HB3 PRO 25 -2.430 9.818 8.214 14 HG2 PRO 25 HG2 PRO 25 -1.352 11.438 5.939 15 HG3 PRO 25 HG3 PRO 25 -2.770 11.746 6.957 16 HD2 PRO 25 HD2 PRO 25 -0.401 13.000 7.341 17 HD3 PRO 25 HD3 PRO 25 -1.503 12.611 8.678 18 H ASN 26 H ASN 26 1.760 8.422 8.473 19 HA ASN 26 HA ASN 26 2.338 8.053 5.608 20 HB2 ASN 26 HB2 ASN 26 4.524 8.090 7.665 21 HB3 ASN 26 HB3 ASN 26 4.624 8.392 5.932 22 HD21 ASN 26 HD21 ASN 26 2.647 10.242 5.575 23 HD22 ASN 26 HD22 ASN 26 3.050 11.694 6.419 24 H LEU 27 H LEU 27 2.978 6.032 4.949 25 HA LEU 27 HA LEU 27 2.641 3.897 6.933 26 HB2 LEU 27 HB2 LEU 27 1.374 4.161 4.617 27 HB3 LEU 27 HB3 LEU 27 2.809 3.329 4.022 28 HG LEU 27 HG LEU 27 2.210 1.642 5.964 29 HD11 LEU 27 HD11 LEU 27 -0.401 3.008 5.352 30 HD12 LEU 27 HD12 LEU 27 0.372 2.807 6.924 31 HD13 LEU 27 HD13 LEU 27 -0.280 1.404 6.076 32 HD21 LEU 27 HD21 LEU 27 1.327 0.230 4.351 33 HD22 LEU 27 HD22 LEU 27 2.251 1.387 3.394 34 HD23 LEU 27 HD23 LEU 27 0.498 1.541 3.510 35 H ALA 28 H ALA 28 4.462 3.126 7.759 36 HA ALA 28 HA ALA 28 6.614 2.414 7.985 37 HB1 ALA 28 HB1 ALA 28 7.588 1.308 5.907 38 HB2 ALA 28 HB2 ALA 28 6.081 0.645 6.540 39 HB3 ALA 28 HB3 ALA 28 6.056 1.695 5.124 40 H GLY 29 H GLY 29 6.077 5.228 7.177 41 HA2 GLY 29 HA2 GLY 29 7.676 6.970 7.143 42 HA3 GLY 29 HA3 GLY 29 8.830 5.864 6.410 43 H ALA 30 H ALA 30 5.757 5.712 4.991 44 HA ALA 30 HA ALA 30 6.739 7.269 2.699 45 HB1 ALA 30 HB1 ALA 30 4.650 5.099 2.836 46 HB2 ALA 30 HB2 ALA 30 5.083 5.993 1.379 47 HB3 ALA 30 HB3 ALA 30 6.277 4.963 2.168 48 H VAL 31 H VAL 31 5.903 9.221 2.423 49 HA VAL 31 HA VAL 31 3.369 9.906 3.704 50 HB VAL 31 HB VAL 31 5.264 11.753 2.251 51 HG11 VAL 31 HG11 VAL 31 3.617 12.783 4.435 52 HG12 VAL 31 HG12 VAL 31 3.903 13.439 2.821 53 HG13 VAL 31 HG13 VAL 31 2.687 12.184 3.063 54 HG21 VAL 31 HG21 VAL 31 6.685 11.351 3.931 55 HG22 VAL 31 HG22 VAL 31 5.557 12.263 4.933 56 HG23 VAL 31 HG23 VAL 31 5.463 10.503 4.879 57 H GLU 32 H GLU 32 4.897 9.975 0.504 58 HA GLU 32 HA GLU 32 2.661 11.029 -0.870 59 HB2 GLU 32 HB2 GLU 32 4.845 9.273 -2.002 60 HB3 GLU 32 HB3 GLU 32 3.806 10.373 -2.898 61 HG2 GLU 32 HG2 GLU 32 5.749 11.249 -0.777 62 HG3 GLU 32 HG3 GLU 32 6.113 11.210 -2.502 63 H PHE 33 H PHE 33 0.977 10.064 -1.914 64 HA PHE 33 HA PHE 33 -0.031 7.652 -0.948 65 HB2 PHE 33 HB2 PHE 33 -1.585 9.171 -1.880 66 HB3 PHE 33 HB3 PHE 33 -0.688 9.286 -3.391 67 HD1 PHE 33 HD1 PHE 33 -2.579 6.853 -1.308 68 HD2 PHE 33 HD2 PHE 33 -1.339 8.017 -5.209 69 HE1 PHE 33 HE1 PHE 33 -4.007 5.101 -2.280 70 HE2 PHE 33 HE2 PHE 33 -2.766 6.269 -6.188 71 HZ PHE 33 HZ PHE 33 -4.103 4.808 -4.724 72 H SER 34 H SER 34 1.518 8.339 -4.077 73 HA SER 34 HA SER 34 1.372 5.830 -5.215 74 HB2 SER 34 HB2 SER 34 2.303 7.172 -6.774 75 HB3 SER 34 HB3 SER 34 3.059 8.206 -5.561 76 HG SER 34 HG SER 34 4.850 7.130 -5.784 77 H ASP 35 H ASP 35 3.657 7.046 -2.831 78 HA ASP 35 HA ASP 35 5.339 4.734 -2.890 79 HB2 ASP 35 HB2 ASP 35 5.142 7.207 -1.253 80 HB3 ASP 35 HB3 ASP 35 5.954 5.826 -0.521 81 H VAL 36 H VAL 36 2.475 5.681 -1.151 82 HA VAL 36 HA VAL 36 2.676 3.739 0.925 83 HB VAL 36 HB VAL 36 0.238 5.185 -0.123 84 HG11 VAL 36 HG11 VAL 36 -0.951 3.876 1.219 85 HG12 VAL 36 HG12 VAL 36 0.509 3.058 1.778 86 HG13 VAL 36 HG13 VAL 36 -0.050 4.519 2.592 87 HG21 VAL 36 HG21 VAL 36 2.432 6.260 1.128 88 HG22 VAL 36 HG22 VAL 36 0.816 6.965 1.103 89 HG23 VAL 36 HG23 VAL 36 1.323 5.969 2.468 90 H LYS 37 H LYS 37 0.574 3.914 -1.954 91 HA LYS 37 HA LYS 37 -0.555 1.381 -1.720 92 HB2 LYS 37 HB2 LYS 37 -1.005 1.575 -4.167 93 HB3 LYS 37 HB3 LYS 37 -1.493 2.987 -3.241 94 HG2 LYS 37 HG2 LYS 37 0.308 4.267 -4.039 95 HG3 LYS 37 HG3 LYS 37 1.149 2.843 -4.658 96 HD2 LYS 37 HD2 LYS 37 -1.412 2.930 -5.872 97 HD3 LYS 37 HD3 LYS 37 -0.705 4.544 -5.995 98 HE2 LYS 37 HE2 LYS 37 1.348 3.523 -6.931 99 HE3 LYS 37 HE3 LYS 37 0.552 1.950 -6.888 100 HZ1 LYS 37 HZ1 LYS 37 0.530 3.339 -9.052 101 HZ2 LYS 37 HZ2 LYS 37 -0.727 4.189 -8.304 102 HZ3 LYS 37 HZ3 LYS 37 -0.875 2.526 -8.576 103 H THR 38 H THR 38 2.531 2.380 -3.015 104 HA THR 38 HA THR 38 3.157 -0.006 -4.402 105 HB THR 38 HB THR 38 4.961 2.112 -3.222 106 HG1 THR 38 HG1 THR 38 4.516 3.118 -5.024 107 HG21 THR 38 HG21 THR 38 6.616 0.625 -3.514 108 HG22 THR 38 HG22 THR 38 6.365 0.879 -5.241 109 HG23 THR 38 HG23 THR 38 5.582 -0.474 -4.427 110 H LEU 39 H LEU 39 3.744 1.079 -1.089 111 HA LEU 39 HA LEU 39 5.347 -1.141 -0.338 112 HB2 LEU 39 HB2 LEU 39 3.721 0.772 1.329 113 HB3 LEU 39 HB3 LEU 39 4.868 -0.397 1.979 114 HG LEU 39 HG LEU 39 5.793 1.641 -0.003 115 HD11 LEU 39 HD11 LEU 39 6.428 2.964 2.140 116 HD12 LEU 39 HD12 LEU 39 5.063 2.108 2.854 117 HD13 LEU 39 HD13 LEU 39 4.816 3.143 1.448 118 HD21 LEU 39 HD21 LEU 39 7.037 -0.430 1.212 119 HD22 LEU 39 HD22 LEU 39 7.385 0.873 2.347 120 HD23 LEU 39 HD23 LEU 39 7.856 1.029 0.654 121 H LEU 40 H LEU 40 1.899 -0.498 -0.300 122 HA LEU 40 HA LEU 40 1.193 -2.764 1.280 123 HB2 LEU 40 HB2 LEU 40 -0.515 -1.234 -0.674 124 HB3 LEU 40 HB3 LEU 40 -1.082 -2.293 0.615 125 HG LEU 40 HG LEU 40 0.513 0.176 1.219 126 HD11 LEU 40 HD11 LEU 40 -2.115 0.071 0.066 127 HD12 LEU 40 HD12 LEU 40 -1.136 1.472 0.498 128 HD13 LEU 40 HD13 LEU 40 -2.185 0.725 1.702 129 HD21 LEU 40 HD21 LEU 40 -1.401 -1.572 2.749 130 HD22 LEU 40 HD22 LEU 40 -0.844 -0.002 3.331 131 HD23 LEU 40 HD23 LEU 40 0.314 -1.305 3.061 132 H LYS 41 H LYS 41 1.153 -2.098 -2.210 133 HA LYS 41 HA LYS 41 0.078 -4.475 -3.120 134 HB2 LYS 41 HB2 LYS 41 0.971 -2.287 -4.351 135 HB3 LYS 41 HB3 LYS 41 2.367 -3.319 -4.635 136 HG2 LYS 41 HG2 LYS 41 0.600 -5.028 -5.477 137 HG3 LYS 41 HG3 LYS 41 -0.432 -3.604 -5.630 138 HD2 LYS 41 HD2 LYS 41 0.575 -3.819 -7.733 139 HD3 LYS 41 HD3 LYS 41 1.517 -2.562 -6.926 140 HE2 LYS 41 HE2 LYS 41 3.223 -4.202 -6.342 141 HE3 LYS 41 HE3 LYS 41 2.272 -5.479 -7.099 142 HZ1 LYS 41 HZ1 LYS 41 3.279 -5.007 -8.996 143 HZ2 LYS 41 HZ2 LYS 41 4.107 -3.710 -8.295 144 HZ3 LYS 41 HZ3 LYS 41 2.583 -3.465 -8.987 145 H GLU 42 H GLU 42 3.439 -3.743 -2.282 146 HA GLU 42 HA GLU 42 4.382 -6.358 -3.002 147 HB2 GLU 42 HB2 GLU 42 6.504 -5.626 -1.987 148 HB3 GLU 42 HB3 GLU 42 5.884 -4.453 -3.140 149 HG2 GLU 42 HG2 GLU 42 4.965 -3.153 -1.236 150 HG3 GLU 42 HG3 GLU 42 5.757 -4.283 -0.140 151 H TRP 43 H TRP 43 3.579 -4.689 0.011 152 HA TRP 43 HA TRP 43 4.409 -6.721 1.772 153 HB2 TRP 43 HB2 TRP 43 4.010 -4.520 2.636 154 HB3 TRP 43 HB3 TRP 43 2.343 -4.538 2.067 155 HD1 TRP 43 HD1 TRP 43 4.484 -6.661 4.528 156 HE1 TRP 43 HE1 TRP 43 3.010 -7.228 6.560 157 HE3 TRP 43 HE3 TRP 43 0.137 -4.429 3.024 158 HZ2 TRP 43 HZ2 TRP 43 0.356 -6.786 7.412 159 HZ3 TRP 43 HZ3 TRP 43 -1.823 -4.548 4.507 160 HH2 TRP 43 HH2 TRP 43 -1.714 -5.703 6.655 161 H ILE 44 H ILE 44 1.795 -6.577 -0.387 162 HA ILE 44 HA ILE 44 0.276 -8.604 1.094 163 HB ILE 44 HB ILE 44 -0.491 -7.024 -1.363 164 HG12 ILE 44 HG12 ILE 44 -1.810 -6.835 1.325 165 HG13 ILE 44 HG13 ILE 44 -0.337 -5.926 1.004 166 HG21 ILE 44 HG21 ILE 44 -1.944 -9.134 0.206 167 HG22 ILE 44 HG22 ILE 44 -2.786 -7.966 -0.811 168 HG23 ILE 44 HG23 ILE 44 -1.621 -9.081 -1.527 169 HD11 ILE 44 HD11 ILE 44 -1.394 -4.437 -0.287 170 HD12 ILE 44 HD12 ILE 44 -2.414 -5.660 -1.043 171 HD13 ILE 44 HD13 ILE 44 -2.837 -5.017 0.543 172 H THR 45 H THR 45 2.527 -8.298 -1.403 173 HA THR 45 HA THR 45 1.694 -10.820 -2.658 174 HB THR 45 HB THR 45 3.302 -10.263 -4.450 175 HG1 THR 45 HG1 THR 45 4.156 -8.072 -4.401 176 HG21 THR 45 HG21 THR 45 1.363 -9.466 -5.266 177 HG22 THR 45 HG22 THR 45 2.041 -7.879 -4.901 178 HG23 THR 45 HG23 THR 45 0.951 -8.658 -3.754 179 H THR 46 H THR 46 4.685 -9.196 -1.584 180 HA THR 46 HA THR 46 6.265 -11.538 -1.617 181 HB THR 46 HB THR 46 7.169 -9.201 -1.648 182 HG1 THR 46 HG1 THR 46 8.261 -10.671 0.521 183 HG21 THR 46 HG21 THR 46 6.727 -7.762 -0.005 184 HG22 THR 46 HG22 THR 46 7.388 -8.876 1.194 185 HG23 THR 46 HG23 THR 46 5.687 -8.978 0.737 186 H ILE 47 H ILE 47 3.901 -10.424 0.566 187 HA ILE 47 HA ILE 47 4.742 -12.457 2.522 188 HB ILE 47 HB ILE 47 3.557 -9.745 3.121 189 HG12 ILE 47 HG12 ILE 47 5.923 -10.460 4.603 190 HG13 ILE 47 HG13 ILE 47 6.223 -10.632 2.876 191 HG21 ILE 47 HG21 ILE 47 3.991 -12.139 4.888 192 HG22 ILE 47 HG22 ILE 47 3.812 -10.503 5.520 193 HG23 ILE 47 HG23 ILE 47 2.498 -11.244 4.607 194 HD11 ILE 47 HD11 ILE 47 6.750 -8.457 3.043 195 HD12 ILE 47 HD12 ILE 47 5.004 -8.237 2.908 196 HD13 ILE 47 HD13 ILE 47 5.775 -8.221 4.494 197 H SER 48 H SER 48 3.256 -13.953 2.943 198 HA SER 48 HA SER 48 0.502 -13.465 2.035 199 HB2 SER 48 HB2 SER 48 2.096 -16.007 2.359 200 HB3 SER 48 HB3 SER 48 0.347 -16.011 2.130 201 HG SER 48 HG SER 48 0.613 -15.090 0.133 202 H ASP 49 H ASP 49 2.466 -14.181 4.781 203 HA ASP 49 HA ASP 49 0.045 -14.502 6.431 204 HB2 ASP 49 HB2 ASP 49 1.610 -15.602 8.093 205 HB3 ASP 49 HB3 ASP 49 1.316 -16.507 6.610 206 HA PRO 50 HA PRO 50 1.872 -10.430 7.583 207 HB2 PRO 50 HB2 PRO 50 -0.528 -9.220 7.965 208 HB3 PRO 50 HB3 PRO 50 0.247 -9.338 6.381 209 HG2 PRO 50 HG2 PRO 50 -1.934 -11.021 7.553 210 HG3 PRO 50 HG3 PRO 50 -1.789 -10.361 5.913 211 HD2 PRO 50 HD2 PRO 50 -1.189 -12.933 6.506 212 HD3 PRO 50 HD3 PRO 50 -0.345 -12.024 5.236 213 H MET 51 H MET 51 2.116 -9.574 9.622 214 HA MET 51 HA MET 51 1.053 -11.186 11.804 215 HB2 MET 51 HB2 MET 51 3.475 -10.681 11.712 216 HB3 MET 51 HB3 MET 51 3.106 -8.967 11.860 217 HG2 MET 51 HG2 MET 51 2.649 -9.110 14.068 218 HG3 MET 51 HG3 MET 51 2.004 -10.745 13.943 219 HE1 MET 51 HE1 MET 51 5.199 -8.590 13.700 220 HE2 MET 51 HE2 MET 51 6.503 -9.747 13.970 221 HE3 MET 51 HE3 MET 51 5.591 -9.782 12.460 222 H GLU 52 H GLU 52 0.113 -10.215 13.694 223 HA GLU 52 HA GLU 52 -1.986 -8.490 13.198 224 HB2 GLU 52 HB2 GLU 52 -1.678 -9.987 15.206 225 HB3 GLU 52 HB3 GLU 52 -0.601 -8.765 15.867 226 HG2 GLU 52 HG2 GLU 52 -2.458 -7.135 15.766 227 HG3 GLU 52 HG3 GLU 52 -3.522 -8.433 15.225 228 H GLU 53 H GLU 53 1.274 -7.749 14.330 229 HA GLU 53 HA GLU 53 0.822 -5.010 14.866 230 HB2 GLU 53 HB2 GLU 53 2.828 -6.598 15.485 231 HB3 GLU 53 HB3 GLU 53 3.496 -6.007 13.971 232 HG2 GLU 53 HG2 GLU 53 2.616 -4.270 16.264 233 HG3 GLU 53 HG3 GLU 53 4.280 -4.743 15.926 234 H ASP 54 H ASP 54 2.057 -6.715 12.012 235 HA ASP 54 HA ASP 54 2.678 -4.497 10.444 236 HB2 ASP 54 HB2 ASP 54 2.061 -7.350 9.926 237 HB3 ASP 54 HB3 ASP 54 1.905 -6.257 8.554 238 H ILE 55 H ILE 55 -0.361 -6.335 10.626 239 HA ILE 55 HA ILE 55 -1.763 -4.743 8.760 240 HB ILE 55 HB ILE 55 -2.953 -6.357 11.017 241 HG12 ILE 55 HG12 ILE 55 -2.317 -7.243 8.195 242 HG13 ILE 55 HG13 ILE 55 -1.361 -7.664 9.612 243 HG21 ILE 55 HG21 ILE 55 -4.507 -4.817 9.919 244 HG22 ILE 55 HG22 ILE 55 -4.097 -5.522 8.355 245 HG23 ILE 55 HG23 ILE 55 -4.911 -6.498 9.577 246 HD11 ILE 55 HD11 ILE 55 -4.239 -8.407 9.149 247 HD12 ILE 55 HD12 ILE 55 -2.847 -9.473 8.964 248 HD13 ILE 55 HD13 ILE 55 -3.269 -8.842 10.556 249 H LEU 56 H LEU 56 -1.189 -4.450 12.192 250 HA LEU 56 HA LEU 56 -3.213 -2.594 12.809 251 HB2 LEU 56 HB2 LEU 56 -0.708 -3.529 14.050 252 HB3 LEU 56 HB3 LEU 56 -1.260 -1.931 14.551 253 HG LEU 56 HG LEU 56 -2.839 -4.493 14.775 254 HD11 LEU 56 HD11 LEU 56 -2.546 -3.743 17.283 255 HD12 LEU 56 HD12 LEU 56 -1.089 -2.983 16.645 256 HD13 LEU 56 HD13 LEU 56 -1.325 -4.721 16.469 257 HD21 LEU 56 HD21 LEU 56 -4.338 -3.048 16.177 258 HD22 LEU 56 HD22 LEU 56 -4.362 -2.697 14.449 259 HD23 LEU 56 HD23 LEU 56 -3.463 -1.651 15.549 260 H GLN 57 H GLN 57 0.100 -2.182 11.652 261 HA GLN 57 HA GLN 57 0.362 0.564 11.915 262 HB2 GLN 57 HB2 GLN 57 1.584 -1.524 10.229 263 HB3 GLN 57 HB3 GLN 57 1.694 0.111 9.588 264 HG2 GLN 57 HG2 GLN 57 2.470 -0.453 12.416 265 HG3 GLN 57 HG3 GLN 57 3.583 -0.803 11.095 266 HE21 GLN 57 HE21 GLN 57 2.571 1.495 13.261 267 HE22 GLN 57 HE22 GLN 57 3.239 2.898 12.506 268 H VAL 58 H VAL 58 -1.386 -1.300 9.524 269 HA VAL 58 HA VAL 58 -1.817 0.838 7.693 270 HB VAL 58 HB VAL 58 -3.561 -1.600 8.017 271 HG11 VAL 58 HG11 VAL 58 -3.167 -0.878 5.325 272 HG12 VAL 58 HG12 VAL 58 -4.646 -0.749 6.277 273 HG13 VAL 58 HG13 VAL 58 -3.523 0.609 6.203 274 HG21 VAL 58 HG21 VAL 58 -1.658 -2.755 7.680 275 HG22 VAL 58 HG22 VAL 58 -1.876 -2.250 6.004 276 HG23 VAL 58 HG23 VAL 58 -0.789 -1.351 7.062 277 H VAL 59 H VAL 59 -3.542 -0.390 10.494 278 HA VAL 59 HA VAL 59 -5.958 1.021 10.101 279 HB VAL 59 HB VAL 59 -4.706 0.079 12.686 280 HG11 VAL 59 HG11 VAL 59 -7.081 0.129 13.499 281 HG12 VAL 59 HG12 VAL 59 -6.355 1.713 13.214 282 HG13 VAL 59 HG13 VAL 59 -7.487 1.037 12.042 283 HG21 VAL 59 HG21 VAL 59 -6.957 -1.454 11.805 284 HG22 VAL 59 HG22 VAL 59 -5.756 -1.378 10.517 285 HG23 VAL 59 HG23 VAL 59 -5.301 -1.983 12.109 286 H ARG 60 H ARG 60 -3.125 1.761 12.133 287 HA ARG 60 HA ARG 60 -4.043 4.232 13.085 288 HB2 ARG 60 HB2 ARG 60 -1.177 3.387 12.623 289 HB3 ARG 60 HB3 ARG 60 -1.723 4.676 13.686 290 HG2 ARG 60 HG2 ARG 60 -2.652 1.858 14.081 291 HG3 ARG 60 HG3 ARG 60 -1.099 2.408 14.714 292 HD2 ARG 60 HD2 ARG 60 -2.071 3.852 16.218 293 HD3 ARG 60 HD3 ARG 60 -3.543 4.025 15.262 294 HE ARG 60 HE ARG 60 -3.302 1.375 16.208 295 HH11 ARG 60 HH11 ARG 60 -4.031 4.602 17.290 296 HH12 ARG 60 HH12 ARG 60 -5.038 4.077 18.599 297 HH21 ARG 60 HH21 ARG 60 -4.626 0.670 17.927 298 HH22 ARG 60 HH22 ARG 60 -5.375 1.840 18.960 299 H TYR 61 H TYR 61 -2.676 3.314 10.043 300 HA TYR 61 HA TYR 61 -1.874 5.944 9.242 301 HB2 TYR 61 HB2 TYR 61 -0.761 4.104 8.203 302 HB3 TYR 61 HB3 TYR 61 -2.286 3.369 7.720 303 HD1 TYR 61 HD2 TYR 61 0.023 6.178 7.063 304 HD2 TYR 61 HD1 TYR 61 -3.370 4.002 5.700 305 HE1 TYR 61 HE2 TYR 61 0.164 7.328 4.892 306 HE2 TYR 61 HE1 TYR 61 -3.237 5.144 3.526 307 HH TYR 61 HH TYR 61 -1.356 6.295 2.163 308 H CYS 62 H CYS 62 -4.590 3.819 8.350 309 HA CYS 62 HA CYS 62 -5.892 5.765 6.749 310 HB2 CYS 62 HB2 CYS 62 -6.806 3.182 8.004 311 HB3 CYS 62 HB3 CYS 62 -7.892 4.194 7.060 312 HG CYS 62 HG CYS 62 -6.122 1.833 5.938 313 H THR 63 H THR 63 -6.381 4.661 10.083 314 HA THR 63 HA THR 63 -8.635 6.166 10.706 315 HB THR 63 HB THR 63 -7.882 6.027 13.076 316 HG1 THR 63 HG1 THR 63 -5.541 4.999 11.832 317 HG21 THR 63 HG21 THR 63 -7.310 3.315 12.505 318 HG22 THR 63 HG22 THR 63 -8.443 3.879 11.276 319 HG23 THR 63 HG23 THR 63 -8.851 4.025 12.985 320 H ASP 64 H ASP 64 -5.335 7.146 10.319 321 HA ASP 64 HA ASP 64 -5.539 9.609 11.753 322 HB2 ASP 64 HB2 ASP 64 -3.544 8.393 9.881 323 HB3 ASP 64 HB3 ASP 64 -3.442 10.115 10.244 324 H LEU 65 H LEU 65 -5.958 8.631 8.396 325 HA LEU 65 HA LEU 65 -6.045 11.113 7.163 326 HB2 LEU 65 HB2 LEU 65 -6.988 8.417 6.580 327 HB3 LEU 65 HB3 LEU 65 -7.985 9.671 5.846 328 HG LEU 65 HG LEU 65 -6.191 10.479 4.546 329 HD11 LEU 65 HD11 LEU 65 -4.418 8.786 6.294 330 HD12 LEU 65 HD12 LEU 65 -4.427 10.543 6.144 331 HD13 LEU 65 HD13 LEU 65 -3.884 9.547 4.795 332 HD21 LEU 65 HD21 LEU 65 -5.288 7.774 4.147 333 HD22 LEU 65 HD22 LEU 65 -6.291 8.787 3.110 334 HD23 LEU 65 HD23 LEU 65 -7.035 7.821 4.385 335 H ILE 66 H ILE 66 -8.466 9.477 9.091 336 HA ILE 66 HA ILE 66 -10.679 11.086 8.406 337 HB ILE 66 HB ILE 66 -10.048 9.386 10.800 338 HG12 ILE 66 HG12 ILE 66 -12.503 8.871 9.335 339 HG13 ILE 66 HG13 ILE 66 -11.105 8.880 8.265 340 HG21 ILE 66 HG21 ILE 66 -11.367 10.825 11.956 341 HG22 ILE 66 HG22 ILE 66 -12.179 11.419 10.508 342 HG23 ILE 66 HG23 ILE 66 -12.639 9.865 11.201 343 HD11 ILE 66 HD11 ILE 66 -10.151 7.361 10.262 344 HD12 ILE 66 HD12 ILE 66 -11.869 6.977 10.368 345 HD13 ILE 66 HD13 ILE 66 -11.000 6.719 8.856 346 H GLU 67 H GLU 67 -8.262 11.351 10.987 347 HA GLU 67 HA GLU 67 -9.432 13.696 12.131 348 HB2 GLU 67 HB2 GLU 67 -6.584 12.768 12.478 349 HB3 GLU 67 HB3 GLU 67 -7.542 13.745 13.582 350 HG2 GLU 67 HG2 GLU 67 -9.019 11.814 13.967 351 HG3 GLU 67 HG3 GLU 67 -7.986 10.843 12.920 352 H GLU 68 H GLU 68 -6.909 13.051 9.774 353 HA GLU 68 HA GLU 68 -6.105 15.822 9.623 354 HB2 GLU 68 HB2 GLU 68 -5.344 13.375 8.030 355 HB3 GLU 68 HB3 GLU 68 -4.717 14.979 7.680 356 HG2 GLU 68 HG2 GLU 68 -4.356 13.443 10.242 357 HG3 GLU 68 HG3 GLU 68 -3.135 13.715 8.999 358 H LYS 69 H LYS 69 -8.642 14.027 8.411 359 HA LYS 69 HA LYS 69 -10.278 14.462 6.890 360 HB2 LYS 69 HB2 LYS 69 -8.998 17.159 6.461 361 HB3 LYS 69 HB3 LYS 69 -10.682 16.713 6.218 362 HG2 LYS 69 HG2 LYS 69 -9.291 16.780 8.888 363 HG3 LYS 69 HG3 LYS 69 -10.313 18.067 8.244 364 HD2 LYS 69 HD2 LYS 69 -12.036 16.083 7.973 365 HD3 LYS 69 HD3 LYS 69 -11.059 15.369 9.259 366 HE2 LYS 69 HE2 LYS 69 -11.362 17.723 10.370 367 HE3 LYS 69 HE3 LYS 69 -12.756 17.825 9.296 368 HZ1 LYS 69 HZ1 LYS 69 -12.759 15.314 10.551 369 HZ2 LYS 69 HZ2 LYS 69 -13.893 16.562 10.691 370 HZ3 LYS 69 HZ3 LYS 69 -12.569 16.501 11.742 371 H ASP 70 H ASP 70 -7.976 13.110 6.028 372 HA ASP 70 HA ASP 70 -7.648 14.095 3.272 373 HB2 ASP 70 HB2 ASP 70 -5.843 12.548 5.099 374 HB3 ASP 70 HB3 ASP 70 -5.665 12.385 3.354 375 H LEU 71 H LEU 71 -9.961 12.662 4.083 376 HA LEU 71 HA LEU 71 -9.927 9.925 3.663 377 HB2 LEU 71 HB2 LEU 71 -12.116 11.743 2.689 378 HB3 LEU 71 HB3 LEU 71 -12.255 10.068 3.217 379 HG LEU 71 HG LEU 71 -11.683 12.458 4.969 380 HD11 LEU 71 HD11 LEU 71 -14.044 10.688 5.291 381 HD12 LEU 71 HD12 LEU 71 -14.060 11.864 3.977 382 HD13 LEU 71 HD13 LEU 71 -13.858 12.406 5.642 383 HD21 LEU 71 HD21 LEU 71 -10.547 10.788 6.067 384 HD22 LEU 71 HD22 LEU 71 -11.613 9.516 5.468 385 HD23 LEU 71 HD23 LEU 71 -12.164 10.601 6.746 386 H GLU 72 H GLU 72 -9.494 12.489 1.400 387 HA GLU 72 HA GLU 72 -10.307 11.406 -0.994 388 HB2 GLU 72 HB2 GLU 72 -9.460 13.647 -0.918 389 HB3 GLU 72 HB3 GLU 72 -7.885 13.094 -0.368 390 HG2 GLU 72 HG2 GLU 72 -7.309 12.256 -2.462 391 HG3 GLU 72 HG3 GLU 72 -8.982 12.240 -3.018 392 H LYS 73 H LYS 73 -7.178 10.931 0.627 393 HA LYS 73 HA LYS 73 -6.285 9.032 -1.340 394 HB2 LYS 73 HB2 LYS 73 -5.122 9.646 1.382 395 HB3 LYS 73 HB3 LYS 73 -4.319 8.788 0.072 396 HG2 LYS 73 HG2 LYS 73 -3.727 10.679 -0.960 397 HG3 LYS 73 HG3 LYS 73 -5.294 11.438 -0.675 398 HD2 LYS 73 HD2 LYS 73 -4.135 12.759 0.732 399 HD3 LYS 73 HD3 LYS 73 -4.275 11.392 1.839 400 HE2 LYS 73 HE2 LYS 73 -2.019 11.740 1.932 401 HE3 LYS 73 HE3 LYS 73 -2.092 10.599 0.590 402 HZ1 LYS 73 HZ1 LYS 73 -1.579 13.492 0.541 403 HZ2 LYS 73 HZ2 LYS 73 -2.285 12.761 -0.810 404 HZ3 LYS 73 HZ3 LYS 73 -0.769 12.244 -0.265 405 H LEU 74 H LEU 74 -8.071 8.921 1.601 406 HA LEU 74 HA LEU 74 -7.516 6.343 2.505 407 HB2 LEU 74 HB2 LEU 74 -8.871 8.105 3.668 408 HB3 LEU 74 HB3 LEU 74 -10.205 7.698 2.592 409 HG LEU 74 HG LEU 74 -10.287 5.447 3.532 410 HD11 LEU 74 HD11 LEU 74 -7.933 5.176 4.081 411 HD12 LEU 74 HD12 LEU 74 -8.944 4.872 5.493 412 HD13 LEU 74 HD13 LEU 74 -8.074 6.399 5.344 413 HD21 LEU 74 HD21 LEU 74 -11.321 7.629 4.619 414 HD22 LEU 74 HD22 LEU 74 -10.251 7.175 5.946 415 HD23 LEU 74 HD23 LEU 74 -11.481 6.045 5.377 416 H ASP 75 H ASP 75 -10.228 7.385 0.431 417 HA ASP 75 HA ASP 75 -11.216 4.843 -0.142 418 HB2 ASP 75 HB2 ASP 75 -12.058 7.316 -0.722 419 HB3 ASP 75 HB3 ASP 75 -11.352 6.903 -2.283 420 H LEU 76 H LEU 76 -8.469 6.534 -1.414 421 HA LEU 76 HA LEU 76 -8.167 4.893 -3.747 422 HB2 LEU 76 HB2 LEU 76 -6.166 6.684 -2.378 423 HB3 LEU 76 HB3 LEU 76 -6.009 5.998 -3.994 424 HG LEU 76 HG LEU 76 -8.192 7.923 -3.212 425 HD11 LEU 76 HD11 LEU 76 -6.123 8.965 -4.951 426 HD12 LEU 76 HD12 LEU 76 -5.497 8.524 -3.363 427 HD13 LEU 76 HD13 LEU 76 -6.837 9.663 -3.497 428 HD21 LEU 76 HD21 LEU 76 -8.933 6.909 -5.130 429 HD22 LEU 76 HD22 LEU 76 -7.304 6.604 -5.732 430 HD23 LEU 76 HD23 LEU 76 -7.983 8.230 -5.811 431 H VAL 77 H VAL 77 -6.495 5.112 -0.615 432 HA VAL 77 HA VAL 77 -4.765 2.918 -1.088 433 HB VAL 77 HB VAL 77 -5.663 4.114 1.537 434 HG11 VAL 77 HG11 VAL 77 -4.135 1.769 0.978 435 HG12 VAL 77 HG12 VAL 77 -3.085 2.979 1.717 436 HG13 VAL 77 HG13 VAL 77 -4.560 2.470 2.539 437 HG21 VAL 77 HG21 VAL 77 -3.823 5.537 1.441 438 HG22 VAL 77 HG22 VAL 77 -3.026 4.583 0.190 439 HG23 VAL 77 HG23 VAL 77 -4.438 5.560 -0.211 440 H ILE 78 H ILE 78 -7.961 3.215 0.350 441 HA ILE 78 HA ILE 78 -8.088 0.579 1.398 442 HB ILE 78 HB ILE 78 -10.251 2.557 0.691 443 HG12 ILE 78 HG12 ILE 78 -8.791 3.148 2.588 444 HG13 ILE 78 HG13 ILE 78 -10.437 2.817 3.115 445 HG21 ILE 78 HG21 ILE 78 -10.443 -0.276 1.365 446 HG22 ILE 78 HG22 ILE 78 -11.398 0.769 2.417 447 HG23 ILE 78 HG23 ILE 78 -11.647 0.810 0.672 448 HD11 ILE 78 HD11 ILE 78 -9.717 1.264 4.511 449 HD12 ILE 78 HD12 ILE 78 -8.890 0.413 3.206 450 HD13 ILE 78 HD13 ILE 78 -8.063 1.700 4.082 451 H LYS 79 H LYS 79 -9.535 2.037 -1.517 452 HA LYS 79 HA LYS 79 -10.578 -0.369 -2.545 453 HB2 LYS 79 HB2 LYS 79 -11.087 0.839 -4.494 454 HB3 LYS 79 HB3 LYS 79 -11.156 2.037 -3.210 455 HG2 LYS 79 HG2 LYS 79 -9.911 3.235 -4.648 456 HG3 LYS 79 HG3 LYS 79 -8.587 2.308 -3.939 457 HD2 LYS 79 HD2 LYS 79 -8.219 2.047 -6.212 458 HD3 LYS 79 HD3 LYS 79 -9.126 0.588 -5.806 459 HE2 LYS 79 HE2 LYS 79 -10.938 2.712 -6.454 460 HE3 LYS 79 HE3 LYS 79 -9.747 2.536 -7.742 461 HZ1 LYS 79 HZ1 LYS 79 -10.473 -0.026 -7.117 462 HZ2 LYS 79 HZ2 LYS 79 -10.988 0.860 -8.463 463 HZ3 LYS 79 HZ3 LYS 79 -11.929 0.833 -7.057 464 H TYR 80 H TYR 80 -7.407 1.012 -2.610 465 HA TYR 80 HA TYR 80 -6.464 -0.601 -4.805 466 HB2 TYR 80 HB2 TYR 80 -5.466 1.588 -4.397 467 HB3 TYR 80 HB3 TYR 80 -4.961 1.082 -2.789 468 HD1 TYR 80 HD1 TYR 80 -3.192 -0.665 -2.552 469 HD2 TYR 80 HD2 TYR 80 -4.175 1.054 -6.318 470 HE1 TYR 80 HE1 TYR 80 -1.059 -1.475 -3.472 471 HE2 TYR 80 HE2 TYR 80 -2.045 0.248 -7.249 472 HH TYR 80 HH TYR 80 -0.125 -0.784 -6.828 473 H MET 81 H MET 81 -6.151 -0.616 -1.277 474 HA MET 81 HA MET 81 -4.484 -2.940 -1.221 475 HB2 MET 81 HB2 MET 81 -4.584 -2.783 1.128 476 HB3 MET 81 HB3 MET 81 -4.644 -1.118 0.561 477 HG2 MET 81 HG2 MET 81 -6.998 -1.001 0.946 478 HG3 MET 81 HG3 MET 81 -7.073 -2.725 1.305 479 HE1 MET 81 HE1 MET 81 -6.256 0.687 2.150 480 HE2 MET 81 HE2 MET 81 -6.323 0.756 3.911 481 HE3 MET 81 HE3 MET 81 -4.787 0.455 3.098 482 H LYS 82 H LYS 82 -7.924 -2.328 -1.071 483 HA LYS 82 HA LYS 82 -8.675 -4.921 -0.162 484 HB2 LYS 82 HB2 LYS 82 -10.883 -4.234 -0.463 485 HB3 LYS 82 HB3 LYS 82 -10.041 -2.726 -0.135 486 HG2 LYS 82 HG2 LYS 82 -11.235 -2.048 -1.927 487 HG3 LYS 82 HG3 LYS 82 -9.853 -2.724 -2.793 488 HD2 LYS 82 HD2 LYS 82 -11.645 -3.681 -3.903 489 HD3 LYS 82 HD3 LYS 82 -11.223 -4.932 -2.731 490 HE2 LYS 82 HE2 LYS 82 -13.129 -4.647 -1.544 491 HE3 LYS 82 HE3 LYS 82 -13.171 -2.908 -1.825 492 HZ1 LYS 82 HZ1 LYS 82 -13.711 -4.751 -4.052 493 HZ2 LYS 82 HZ2 LYS 82 -14.252 -3.167 -3.821 494 HZ3 LYS 82 HZ3 LYS 82 -14.931 -4.430 -2.925 495 H ARG 83 H ARG 83 -8.061 -3.495 -3.296 496 HA ARG 83 HA ARG 83 -9.238 -5.580 -4.837 497 HB2 ARG 83 HB2 ARG 83 -8.611 -4.366 -6.654 498 HB3 ARG 83 HB3 ARG 83 -8.417 -3.103 -5.445 499 HG2 ARG 83 HG2 ARG 83 -5.989 -3.930 -5.276 500 HG3 ARG 83 HG3 ARG 83 -6.317 -4.737 -6.811 501 HD2 ARG 83 HD2 ARG 83 -7.064 -1.875 -6.565 502 HD3 ARG 83 HD3 ARG 83 -5.349 -2.266 -6.682 503 HE ARG 83 HE ARG 83 -6.822 -3.617 -8.689 504 HH11 ARG 83 HH11 ARG 83 -5.595 -0.476 -7.822 505 HH12 ARG 83 HH12 ARG 83 -5.477 0.074 -9.461 506 HH21 ARG 83 HH21 ARG 83 -6.670 -2.904 -10.851 507 HH22 ARG 83 HH22 ARG 83 -6.089 -1.307 -11.183 508 H LEU 84 H LEU 84 -6.129 -5.100 -3.347 509 HA LEU 84 HA LEU 84 -4.849 -7.233 -4.814 510 HB2 LEU 84 HB2 LEU 84 -3.921 -5.767 -2.349 511 HB3 LEU 84 HB3 LEU 84 -2.938 -6.807 -3.378 512 HG LEU 84 HG LEU 84 -4.228 -4.329 -4.469 513 HD11 LEU 84 HD11 LEU 84 -1.713 -3.512 -4.040 514 HD12 LEU 84 HD12 LEU 84 -1.934 -4.539 -2.625 515 HD13 LEU 84 HD13 LEU 84 -3.040 -3.197 -2.920 516 HD21 LEU 84 HD21 LEU 84 -2.250 -4.464 -5.984 517 HD22 LEU 84 HD22 LEU 84 -3.360 -5.828 -6.116 518 HD23 LEU 84 HD23 LEU 84 -1.843 -6.006 -5.232 519 H MET 85 H MET 85 -5.739 -6.709 -1.399 520 HA MET 85 HA MET 85 -5.115 -9.247 -0.457 521 HB2 MET 85 HB2 MET 85 -7.245 -7.307 0.450 522 HB3 MET 85 HB3 MET 85 -6.811 -8.761 1.338 523 HG2 MET 85 HG2 MET 85 -4.454 -7.871 1.404 524 HG3 MET 85 HG3 MET 85 -5.107 -6.352 0.792 525 HE1 MET 85 HE1 MET 85 -5.497 -4.460 3.616 526 HE2 MET 85 HE2 MET 85 -4.007 -5.375 3.854 527 HE3 MET 85 HE3 MET 85 -4.506 -4.909 2.228 528 H GLN 86 H GLN 86 -7.883 -8.134 -2.258 529 HA GLN 86 HA GLN 86 -9.485 -10.462 -1.752 530 HB2 GLN 86 HB2 GLN 86 -9.707 -8.084 -3.558 531 HB3 GLN 86 HB3 GLN 86 -10.748 -9.476 -3.825 532 HG2 GLN 86 HG2 GLN 86 -11.518 -9.279 -1.474 533 HG3 GLN 86 HG3 GLN 86 -10.574 -7.796 -1.335 534 HE21 GLN 86 HE21 GLN 86 -12.931 -7.216 -0.759 535 HE22 GLN 86 HE22 GLN 86 -13.869 -6.571 -2.057 536 H GLN 87 H GLN 87 -7.793 -9.228 -4.639 537 HA GLN 87 HA GLN 87 -8.216 -11.543 -6.195 538 HB2 GLN 87 HB2 GLN 87 -6.731 -10.590 -7.772 539 HB3 GLN 87 HB3 GLN 87 -7.561 -9.235 -7.019 540 HG2 GLN 87 HG2 GLN 87 -5.596 -8.944 -5.523 541 HG3 GLN 87 HG3 GLN 87 -4.767 -10.192 -6.452 542 HE21 GLN 87 HE21 GLN 87 -6.832 -7.464 -7.382 543 HE22 GLN 87 HE22 GLN 87 -5.688 -6.741 -8.455 544 H SER 88 H SER 88 -6.137 -10.947 -3.583 545 HA SER 88 HA SER 88 -3.855 -12.392 -4.143 546 HB2 SER 88 HB2 SER 88 -3.490 -12.521 -1.817 547 HB3 SER 88 HB3 SER 88 -4.470 -11.069 -2.021 548 HG SER 88 HG SER 88 -5.230 -13.603 -1.044 549 H VAL 89 H VAL 89 -3.230 -14.563 -3.385 550 HA VAL 89 HA VAL 89 -5.178 -16.514 -4.260 551 HB VAL 89 HB VAL 89 -3.437 -18.064 -4.380 552 HG11 VAL 89 HG11 VAL 89 -3.205 -15.805 -5.733 553 HG12 VAL 89 HG12 VAL 89 -1.721 -15.671 -4.786 554 HG13 VAL 89 HG13 VAL 89 -1.981 -17.070 -5.830 555 HG21 VAL 89 HG21 VAL 89 -1.991 -16.341 -2.379 556 HG22 VAL 89 HG22 VAL 89 -2.575 -17.991 -2.165 557 HG23 VAL 89 HG23 VAL 89 -1.222 -17.668 -3.249 558 H GLU 90 H GLU 90 -3.848 -15.359 -1.275 559 HA GLU 90 HA GLU 90 -4.909 -17.631 0.222 560 HB2 GLU 90 HB2 GLU 90 -3.533 -15.213 1.377 561 HB3 GLU 90 HB3 GLU 90 -3.713 -16.806 2.097 562 HG2 GLU 90 HG2 GLU 90 -2.106 -16.281 -0.387 563 HG3 GLU 90 HG3 GLU 90 -1.429 -16.267 1.240 564 H SER 91 H SER 91 -6.841 -17.601 1.154 565 HA SER 91 HA SER 91 -8.588 -15.382 0.902 566 HB2 SER 91 HB2 SER 91 -10.127 -16.768 2.327 567 HB3 SER 91 HB3 SER 91 -9.515 -17.604 0.899 568 HG SER 91 HG SER 91 -9.299 -18.325 3.445 569 H VAL 92 H VAL 92 -6.362 -16.388 3.342 570 HA VAL 92 HA VAL 92 -7.441 -15.197 5.620 571 HB VAL 92 HB VAL 92 -5.156 -15.106 6.498 572 HG11 VAL 92 HG11 VAL 92 -5.132 -17.320 6.829 573 HG12 VAL 92 HG12 VAL 92 -6.569 -17.346 5.804 574 HG13 VAL 92 HG13 VAL 92 -4.980 -17.670 5.108 575 HG21 VAL 92 HG21 VAL 92 -3.551 -14.563 5.039 576 HG22 VAL 92 HG22 VAL 92 -3.547 -16.272 4.600 577 HG23 VAL 92 HG23 VAL 92 -4.495 -15.121 3.659 578 H TRP 93 H TRP 93 -6.032 -13.773 2.817 579 HA TRP 93 HA TRP 93 -5.293 -11.281 3.991 580 HB2 TRP 93 HB2 TRP 93 -5.451 -12.414 1.264 581 HB3 TRP 93 HB3 TRP 93 -5.637 -10.664 1.374 582 HD1 TRP 93 HD1 TRP 93 -3.034 -12.996 0.706 583 HE1 TRP 93 HE1 TRP 93 -0.711 -12.110 1.372 584 HE3 TRP 93 HE3 TRP 93 -4.477 -9.139 3.736 585 HZ2 TRP 93 HZ2 TRP 93 0.367 -10.047 2.970 586 HZ3 TRP 93 HZ3 TRP 93 -2.737 -7.758 4.795 587 HH2 TRP 93 HH2 TRP 93 -0.367 -8.205 4.419 588 H ASN 94 H ASN 94 -8.202 -12.553 2.500 589 HA ASN 94 HA ASN 94 -9.598 -10.176 2.077 590 HB2 ASN 94 HB2 ASN 94 -10.446 -13.004 2.619 591 HB3 ASN 94 HB3 ASN 94 -11.653 -11.726 2.524 592 HD21 ASN 94 HD21 ASN 94 -8.833 -12.943 0.751 593 HD22 ASN 94 HD22 ASN 94 -9.515 -12.724 -0.822 594 H MET 95 H MET 95 -9.219 -12.125 4.988 595 HA MET 95 HA MET 95 -11.102 -10.651 6.542 596 HB2 MET 95 HB2 MET 95 -8.813 -12.310 7.596 597 HB3 MET 95 HB3 MET 95 -10.326 -11.927 8.408 598 HG2 MET 95 HG2 MET 95 -11.409 -13.189 6.414 599 HG3 MET 95 HG3 MET 95 -9.798 -13.871 6.209 600 HE1 MET 95 HE1 MET 95 -9.220 -16.121 9.144 601 HE2 MET 95 HE2 MET 95 -9.311 -16.268 7.389 602 HE3 MET 95 HE3 MET 95 -8.464 -14.902 8.118 603 H ALA 96 H ALA 96 -7.611 -10.502 6.069 604 HA ALA 96 HA ALA 96 -6.893 -8.763 8.098 605 HB1 ALA 96 HB1 ALA 96 -4.894 -8.555 7.035 606 HB2 ALA 96 HB2 ALA 96 -5.520 -9.957 6.165 607 HB3 ALA 96 HB3 ALA 96 -5.632 -8.350 5.446 608 H PHE 97 H PHE 97 -8.323 -8.049 4.952 609 HA PHE 97 HA PHE 97 -8.048 -5.246 5.065 610 HB2 PHE 97 HB2 PHE 97 -8.537 -6.384 2.971 611 HB3 PHE 97 HB3 PHE 97 -10.079 -6.950 3.607 612 HD1 PHE 97 HD2 PHE 97 -8.414 -3.613 3.631 613 HD2 PHE 97 HD1 PHE 97 -11.788 -5.931 2.465 614 HE1 PHE 97 HE2 PHE 97 -9.509 -1.582 2.775 615 HE2 PHE 97 HE1 PHE 97 -12.887 -3.905 1.606 616 HZ PHE 97 HZ PHE 97 -11.748 -1.726 1.760 617 H ASP 98 H ASP 98 -10.707 -7.398 6.004 618 HA ASP 98 HA ASP 98 -12.517 -5.396 6.781 619 HB2 ASP 98 HB2 ASP 98 -12.917 -7.924 6.434 620 HB3 ASP 98 HB3 ASP 98 -12.382 -8.097 8.103 621 H PHE 99 H PHE 99 -9.912 -7.007 8.507 622 HA PHE 99 HA PHE 99 -10.496 -6.214 11.108 623 HB2 PHE 99 HB2 PHE 99 -8.759 -7.792 10.833 624 HB3 PHE 99 HB3 PHE 99 -7.890 -6.761 9.701 625 HD1 PHE 99 HD2 PHE 99 -8.685 -7.351 13.230 626 HD2 PHE 99 HD1 PHE 99 -6.449 -5.007 10.468 627 HE1 PHE 99 HE2 PHE 99 -7.320 -6.478 15.081 628 HE2 PHE 99 HE1 PHE 99 -5.081 -4.131 12.315 629 HZ PHE 99 HZ PHE 99 -5.514 -4.866 14.625 630 H ILE 100 H ILE 100 -8.530 -4.549 8.655 631 HA ILE 100 HA ILE 100 -7.873 -2.315 10.231 632 HB ILE 100 HB ILE 100 -8.138 -2.478 7.226 633 HG12 ILE 100 HG12 ILE 100 -5.474 -2.453 8.478 634 HG13 ILE 100 HG13 ILE 100 -6.424 -3.896 8.817 635 HG21 ILE 100 HG21 ILE 100 -6.268 -0.609 7.618 636 HG22 ILE 100 HG22 ILE 100 -7.984 -0.231 7.476 637 HG23 ILE 100 HG23 ILE 100 -7.237 -0.349 9.069 638 HD11 ILE 100 HD11 ILE 100 -6.580 -4.445 6.534 639 HD12 ILE 100 HD12 ILE 100 -5.990 -2.858 6.036 640 HD13 ILE 100 HD13 ILE 100 -4.897 -3.999 6.819 641 H LEU 101 H LEU 101 -10.556 -2.902 7.994 642 HA LEU 101 HA LEU 101 -11.669 -0.308 8.160 643 HB2 LEU 101 HB2 LEU 101 -12.833 -2.974 7.402 644 HB3 LEU 101 HB3 LEU 101 -13.761 -1.477 7.344 645 HG LEU 101 HG LEU 101 -11.195 -1.780 5.819 646 HD11 LEU 101 HD11 LEU 101 -13.730 -3.123 5.331 647 HD12 LEU 101 HD12 LEU 101 -12.147 -3.387 4.602 648 HD13 LEU 101 HD13 LEU 101 -13.205 -2.121 3.978 649 HD21 LEU 101 HD21 LEU 101 -13.626 -0.017 5.577 650 HD22 LEU 101 HD22 LEU 101 -12.343 -0.099 4.369 651 HD23 LEU 101 HD23 LEU 101 -11.983 0.466 6.002 652 H ASP 102 H ASP 102 -11.981 -3.179 10.123 653 HA ASP 102 HA ASP 102 -14.314 -2.517 11.533 654 HB2 ASP 102 HB2 ASP 102 -12.829 -4.699 11.508 655 HB3 ASP 102 HB3 ASP 102 -12.073 -3.943 12.908 656 H ASN 103 H ASN 103 -11.005 -1.457 11.883 657 HA ASN 103 HA ASN 103 -11.658 -0.024 14.351 658 HB2 ASN 103 HB2 ASN 103 -9.033 -0.547 12.946 659 HB3 ASN 103 HB3 ASN 103 -9.184 0.481 14.368 660 HD21 ASN 103 HD21 ASN 103 -9.804 -2.780 13.176 661 HD22 ASN 103 HD22 ASN 103 -9.581 -3.570 14.696 662 H VAL 104 H VAL 104 -10.819 0.496 10.994 663 HA VAL 104 HA VAL 104 -10.457 3.332 11.254 664 HB VAL 104 HB VAL 104 -10.857 1.609 8.806 665 HG11 VAL 104 HG11 VAL 104 -11.575 3.818 8.255 666 HG12 VAL 104 HG12 VAL 104 -10.178 4.533 9.061 667 HG13 VAL 104 HG13 VAL 104 -9.960 3.598 7.582 668 HG21 VAL 104 HG21 VAL 104 -8.737 1.530 10.393 669 HG22 VAL 104 HG22 VAL 104 -8.588 1.432 8.638 670 HG23 VAL 104 HG23 VAL 104 -8.296 2.962 9.464 671 H GLN 105 H GLN 105 -12.910 1.402 9.518 672 HA GLN 105 HA GLN 105 -14.679 3.414 8.913 673 HB2 GLN 105 HB2 GLN 105 -15.410 0.599 9.737 674 HB3 GLN 105 HB3 GLN 105 -16.416 1.697 8.802 675 HG2 GLN 105 HG2 GLN 105 -13.705 0.828 7.860 676 HG3 GLN 105 HG3 GLN 105 -15.164 -0.107 7.532 677 HE21 GLN 105 HE21 GLN 105 -13.492 2.898 6.950 678 HE22 GLN 105 HE22 GLN 105 -14.411 3.369 5.565 679 H VAL 106 H VAL 106 -14.134 1.857 11.983 680 HA VAL 106 HA VAL 106 -16.515 2.765 13.257 681 HB VAL 106 HB VAL 106 -13.924 1.625 14.236 682 HG11 VAL 106 HG11 VAL 106 -16.000 3.039 15.874 683 HG12 VAL 106 HG12 VAL 106 -15.025 1.736 16.557 684 HG13 VAL 106 HG13 VAL 106 -14.244 3.191 15.935 685 HG21 VAL 106 HG21 VAL 106 -15.302 -0.168 15.009 686 HG22 VAL 106 HG22 VAL 106 -16.773 0.756 14.702 687 HG23 VAL 106 HG23 VAL 106 -15.784 0.200 13.351 688 H VAL 107 H VAL 107 -13.128 3.868 13.436 689 HA VAL 107 HA VAL 107 -13.704 6.139 15.035 690 HB VAL 107 HB VAL 107 -11.458 5.163 14.938 691 HG11 VAL 107 HG11 VAL 107 -10.033 5.692 12.936 692 HG12 VAL 107 HG12 VAL 107 -11.287 4.479 12.666 693 HG13 VAL 107 HG13 VAL 107 -11.515 6.129 12.086 694 HG21 VAL 107 HG21 VAL 107 -11.632 8.023 13.997 695 HG22 VAL 107 HG22 VAL 107 -11.641 7.452 15.666 696 HG23 VAL 107 HG23 VAL 107 -10.187 7.279 14.682 697 H LEU 108 H LEU 108 -13.819 5.526 11.625 698 HA LEU 108 HA LEU 108 -13.723 8.255 10.787 699 HB2 LEU 108 HB2 LEU 108 -13.507 7.318 8.794 700 HB3 LEU 108 HB3 LEU 108 -13.690 5.740 9.558 701 HG LEU 108 HG LEU 108 -16.196 6.047 9.227 702 HD11 LEU 108 HD11 LEU 108 -15.220 8.536 8.134 703 HD12 LEU 108 HD12 LEU 108 -16.868 8.042 8.521 704 HD13 LEU 108 HD13 LEU 108 -16.172 7.636 6.953 705 HD21 LEU 108 HD21 LEU 108 -15.946 4.692 7.478 706 HD22 LEU 108 HD22 LEU 108 -14.212 4.988 7.613 707 HD23 LEU 108 HD23 LEU 108 -15.190 5.957 6.510 708 H GLN 109 H GLN 109 -16.293 5.965 11.545 709 HA GLN 109 HA GLN 109 -18.446 7.568 10.659 710 HB2 GLN 109 HB2 GLN 109 -18.200 5.233 12.524 711 HB3 GLN 109 HB3 GLN 109 -19.728 6.090 12.384 712 HG2 GLN 109 HG2 GLN 109 -19.884 5.575 10.057 713 HG3 GLN 109 HG3 GLN 109 -18.254 4.903 10.047 714 HE21 GLN 109 HE21 GLN 109 -17.950 3.087 11.683 715 HE22 GLN 109 HE22 GLN 109 -19.211 1.908 11.752 716 H GLN 110 H GLN 110 -16.829 7.235 13.784 717 HA GLN 110 HA GLN 110 -18.594 8.865 15.259 718 HB2 GLN 110 HB2 GLN 110 -15.674 8.223 15.693 719 HB3 GLN 110 HB3 GLN 110 -16.680 9.070 16.861 720 HG2 GLN 110 HG2 GLN 110 -18.218 7.010 16.697 721 HG3 GLN 110 HG3 GLN 110 -16.819 6.219 15.972 722 HE21 GLN 110 HE21 GLN 110 -15.532 5.200 17.319 723 HE22 GLN 110 HE22 GLN 110 -15.357 5.524 19.007 724 H THR 111 H THR 111 -16.341 9.630 12.852 725 HA THR 111 HA THR 111 -15.968 12.374 13.789 726 HB THR 111 HB THR 111 -14.788 10.916 11.417 727 HG1 THR 111 HG1 THR 111 -13.405 11.951 13.663 728 HG21 THR 111 HG21 THR 111 -13.333 12.907 11.189 729 HG22 THR 111 HG22 THR 111 -14.307 13.728 12.409 730 HG23 THR 111 HG23 THR 111 -15.030 13.264 10.870 731 H TYR 112 H TYR 112 -16.907 10.792 10.728 732 HA TYR 112 HA TYR 112 -18.495 13.174 10.074 733 HB2 TYR 112 HB2 TYR 112 -17.781 10.938 8.182 734 HB3 TYR 112 HB3 TYR 112 -18.319 12.566 7.784 735 HD1 TYR 112 HD1 TYR 112 -15.480 10.531 8.920 736 HD2 TYR 112 HD2 TYR 112 -16.776 14.418 7.775 737 HE1 TYR 112 HE1 TYR 112 -13.136 11.253 8.739 738 HE2 TYR 112 HE2 TYR 112 -14.435 15.151 7.590 739 HH TYR 112 HH TYR 112 -11.823 12.974 7.602 740 H GLY 113 H GLY 113 -18.659 9.636 10.206 741 HA2 GLY 113 HA2 GLY 113 -20.668 8.635 11.158 742 HA3 GLY 113 HA3 GLY 113 -21.598 9.885 10.346 743 H SER 114 H SER 114 -19.570 9.353 8.022 744 HA SER 114 HA SER 114 -21.259 7.328 6.767 745 HB2 SER 114 HB2 SER 114 -20.175 8.067 4.659 746 HB3 SER 114 HB3 SER 114 -20.940 9.401 5.525 747 HG SER 114 HG SER 114 -18.996 10.212 5.105 748 H THR 115 H THR 115 -19.741 6.175 4.913 749 HA THR 115 HA THR 115 -17.274 5.180 6.069 750 HB THR 115 HB THR 115 -17.950 2.811 5.943 751 HG1 THR 115 HG1 THR 115 -20.581 3.853 5.578 752 HG21 THR 115 HG21 THR 115 -18.160 4.245 8.052 753 HG22 THR 115 HG22 THR 115 -19.057 2.727 8.018 754 HG23 THR 115 HG23 THR 115 -19.894 4.251 7.729 755 H LEU 116 H LEU 116 -16.586 3.168 4.549 756 HA LEU 116 HA LEU 116 -16.616 4.289 1.849 757 HB2 LEU 116 HB2 LEU 116 -14.649 3.075 3.461 758 HB3 LEU 116 HB3 LEU 116 -14.940 1.982 2.110 759 HG LEU 116 HG LEU 116 -14.685 4.355 0.814 760 HD11 LEU 116 HD11 LEU 116 -13.891 5.027 3.341 761 HD12 LEU 116 HD12 LEU 116 -13.405 5.857 1.863 762 HD13 LEU 116 HD13 LEU 116 -12.361 4.620 2.562 763 HD21 LEU 116 HD21 LEU 116 -12.146 2.976 1.401 764 HD22 LEU 116 HD22 LEU 116 -12.906 3.353 -0.146 765 HD23 LEU 116 HD23 LEU 116 -13.455 1.963 0.791 766 H LYS 117 H LYS 117 -16.970 2.963 0.000 767 HA LYS 117 HA LYS 117 -18.800 0.728 0.542 768 HB2 LYS 117 HB2 LYS 117 -19.942 2.350 -0.723 769 HB3 LYS 117 HB3 LYS 117 -18.549 2.656 -1.752 770 HG2 LYS 117 HG2 LYS 117 -20.313 1.433 -2.923 771 HG3 LYS 117 HG3 LYS 117 -18.820 0.498 -2.816 772 HD2 LYS 117 HD2 LYS 117 -20.288 -0.151 -0.520 773 HD3 LYS 117 HD3 LYS 117 -21.454 -0.143 -1.846 774 HE2 LYS 117 HE2 LYS 117 -18.933 -1.449 -2.522 775 HE3 LYS 117 HE3 LYS 117 -19.782 -2.221 -1.184 776 HZ1 LYS 117 HZ1 LYS 117 -21.652 -2.611 -2.511 777 HZ2 LYS 117 HZ2 LYS 117 -20.343 -3.013 -3.502 778 HZ3 LYS 117 HZ3 LYS 117 -21.146 -1.541 -3.719 779 H VAL 118 H VAL 118 -17.561 -1.072 0.625 780 HA VAL 118 HA VAL 118 -15.813 -1.609 -1.689 781 HB VAL 118 HB VAL 118 -14.643 -3.238 -0.112 782 HG11 VAL 118 HG11 VAL 118 -14.323 -0.449 -0.534 783 HG12 VAL 118 HG12 VAL 118 -13.884 -0.805 1.138 784 HG13 VAL 118 HG13 VAL 118 -13.087 -1.657 -0.186 785 HG21 VAL 118 HG21 VAL 118 -15.422 -1.583 2.187 786 HG22 VAL 118 HG22 VAL 118 -16.679 -2.665 1.586 787 HG23 VAL 118 HG23 VAL 118 -15.119 -3.318 2.086 788 H THR 119 H THR 119 -17.265 -2.701 -2.960 789 HA THR 119 HA THR 119 -19.207 -4.505 -2.212 790 HB THR 119 HB THR 119 -17.668 -5.145 -4.680 791 HG1 THR 119 HG1 THR 119 -18.587 -3.277 -5.693 792 HG21 THR 119 HG21 THR 119 -19.680 -6.332 -4.472 793 HG22 THR 119 HG22 THR 119 -20.074 -5.010 -5.571 794 HG23 THR 119 HG23 THR 119 -20.555 -4.921 -3.877 795 H LYS 207 H LYS 207 8.368 -11.099 11.514 796 HA LYS 207 HA LYS 207 8.405 -9.015 13.584 797 HB2 LYS 207 HB2 LYS 207 10.717 -9.790 12.505 798 HB3 LYS 207 HB3 LYS 207 10.208 -8.682 11.238 799 HG2 LYS 207 HG2 LYS 207 11.228 -7.129 12.476 800 HG3 LYS 207 HG3 LYS 207 9.771 -7.190 13.471 801 HD2 LYS 207 HD2 LYS 207 11.907 -9.170 14.042 802 HD3 LYS 207 HD3 LYS 207 12.212 -7.491 14.492 803 HE2 LYS 207 HE2 LYS 207 9.787 -7.685 15.510 804 HE3 LYS 207 HE3 LYS 207 10.178 -9.403 15.528 805 HZ1 LYS 207 HZ1 LYS 207 12.317 -7.822 16.554 806 HZ2 LYS 207 HZ2 LYS 207 11.504 -9.122 17.269 807 HZ3 LYS 207 HZ3 LYS 207 10.887 -7.555 17.417 808 H SER 208 H SER 208 8.031 -6.826 12.685 809 HA SER 208 HA SER 208 5.851 -6.914 10.804 810 HB2 SER 208 HB2 SER 208 5.332 -5.335 12.374 811 HB3 SER 208 HB3 SER 208 7.019 -4.898 12.647 812 HG SER 208 HG SER 208 5.620 -3.315 11.522 813 H PHE 209 H PHE 209 6.189 -6.945 8.690 814 HA PHE 209 HA PHE 209 8.569 -6.447 7.374 815 HB2 PHE 209 HB2 PHE 209 6.826 -7.645 6.250 816 HB3 PHE 209 HB3 PHE 209 5.722 -6.279 6.380 817 HD1 PHE 209 HD2 PHE 209 8.845 -7.434 4.767 818 HD2 PHE 209 HD1 PHE 209 5.651 -4.621 4.728 819 HE1 PHE 209 HE2 PHE 209 9.578 -6.638 2.557 820 HE2 PHE 209 HE1 PHE 209 6.378 -3.821 2.518 821 HZ PHE 209 HZ PHE 209 8.344 -4.829 1.430 822 H PHE 210 H PHE 210 5.957 -4.224 8.170 823 HA PHE 210 HA PHE 210 6.914 -2.033 6.652 824 HB2 PHE 210 HB2 PHE 210 5.036 -2.251 8.999 825 HB3 PHE 210 HB3 PHE 210 5.450 -0.697 8.283 826 HD1 PHE 210 HD1 PHE 210 5.362 -0.936 5.518 827 HD2 PHE 210 HD2 PHE 210 2.975 -3.006 8.370 828 HE1 PHE 210 HE1 PHE 210 3.611 -1.251 3.819 829 HE2 PHE 210 HE2 PHE 210 1.220 -3.325 6.675 830 HZ PHE 210 HZ PHE 210 1.538 -2.448 4.396 831 H ASP 211 H ASP 211 7.686 -3.287 9.804 832 HA ASP 211 HA ASP 211 9.032 -0.934 10.733 833 HB2 ASP 211 HB2 ASP 211 8.716 -3.741 11.707 834 HB3 ASP 211 HB3 ASP 211 10.019 -2.762 12.374 835 H LYS 212 H LYS 212 10.042 -4.020 9.319 836 HA LYS 212 HA LYS 212 12.836 -3.365 9.430 837 HB2 LYS 212 HB2 LYS 212 13.172 -5.439 8.206 838 HB3 LYS 212 HB3 LYS 212 12.038 -5.697 9.525 839 HG2 LYS 212 HG2 LYS 212 10.197 -5.371 7.806 840 HG3 LYS 212 HG3 LYS 212 11.464 -5.517 6.586 841 HD2 LYS 212 HD2 LYS 212 12.019 -7.674 8.101 842 HD3 LYS 212 HD3 LYS 212 10.274 -7.565 8.350 843 HE2 LYS 212 HE2 LYS 212 9.838 -8.281 6.279 844 HE3 LYS 212 HE3 LYS 212 11.033 -7.198 5.568 845 HZ1 LYS 212 HZ1 LYS 212 11.215 -9.961 5.947 846 HZ2 LYS 212 HZ2 LYS 212 12.387 -9.235 6.927 847 HZ3 LYS 212 HZ3 LYS 212 12.362 -8.923 5.265 848 H LYS 213 H LYS 213 10.251 -2.724 7.277 849 HA LYS 213 HA LYS 213 11.956 -2.274 4.974 850 HB2 LYS 213 HB2 LYS 213 9.784 -3.154 4.499 851 HB3 LYS 213 HB3 LYS 213 9.000 -1.903 5.454 852 HG2 LYS 213 HG2 LYS 213 8.757 -1.518 3.053 853 HG3 LYS 213 HG3 LYS 213 9.657 -0.219 3.840 854 HD2 LYS 213 HD2 LYS 213 11.560 -0.688 2.720 855 HD3 LYS 213 HD3 LYS 213 11.292 -2.432 2.792 856 HE2 LYS 213 HE2 LYS 213 9.359 -1.859 1.096 857 HE3 LYS 213 HE3 LYS 213 10.356 -0.439 0.786 858 HZ1 LYS 213 HZ1 LYS 213 11.707 -3.021 0.808 859 HZ2 LYS 213 HZ2 LYS 213 11.974 -1.669 -0.172 860 HZ3 LYS 213 HZ3 LYS 213 10.684 -2.712 -0.504 861 H ARG 214 H ARG 214 9.977 -0.334 7.195 862 HA ARG 214 HA ARG 214 10.422 2.172 6.085 863 HB2 ARG 214 HB2 ARG 214 9.795 3.093 8.221 864 HB3 ARG 214 HB3 ARG 214 8.810 1.669 7.911 865 HG2 ARG 214 HG2 ARG 214 10.032 0.371 9.465 866 HG3 ARG 214 HG3 ARG 214 11.296 1.595 9.595 867 HD2 ARG 214 HD2 ARG 214 9.966 3.014 10.862 868 HD3 ARG 214 HD3 ARG 214 8.469 2.260 10.315 869 HE ARG 214 HE ARG 214 8.633 0.817 12.071 870 HH11 ARG 214 HH11 ARG 214 11.793 2.121 11.415 871 HH12 ARG 214 HH12 ARG 214 12.538 1.349 12.776 872 HH21 ARG 214 HH21 ARG 214 9.599 -0.205 13.866 873 HH22 ARG 214 HH22 ARG 214 11.288 0.026 14.168 874 H SER 215 H SER 215 12.523 0.161 7.982 875 HA SER 215 HA SER 215 14.371 2.243 8.678 876 HB2 SER 215 HB2 SER 215 14.346 0.385 10.148 877 HB3 SER 215 HB3 SER 215 14.480 -0.769 8.821 878 HG SER 215 HG SER 215 16.462 -0.380 10.010 879 H GLU 216 H GLU 216 13.913 0.107 5.988 880 HA GLU 216 HA GLU 216 16.529 0.188 4.922 881 HB2 GLU 216 HB2 GLU 216 13.859 -0.248 3.573 882 HB3 GLU 216 HB3 GLU 216 15.414 -0.471 2.781 883 HG2 GLU 216 HG2 GLU 216 14.748 -1.935 5.304 884 HG3 GLU 216 HG3 GLU 216 14.201 -2.524 3.734 885 H ARG 217 H ARG 217 13.603 1.991 3.959 886 HA ARG 217 HA ARG 217 14.776 3.655 2.081 887 HB2 ARG 217 HB2 ARG 217 12.897 5.266 2.704 888 HB3 ARG 217 HB3 ARG 217 12.422 3.654 2.187 889 HG2 ARG 217 HG2 ARG 217 11.804 3.011 4.330 890 HG3 ARG 217 HG3 ARG 217 12.750 4.292 5.091 891 HD2 ARG 217 HD2 ARG 217 10.247 4.618 5.085 892 HD3 ARG 217 HD3 ARG 217 11.202 5.953 4.441 893 HE ARG 217 HE ARG 217 10.174 5.643 2.430 894 HH11 ARG 217 HH11 ARG 217 9.840 2.731 4.310 895 HH12 ARG 217 HH12 ARG 217 8.805 1.953 3.159 896 HH21 ARG 217 HH21 ARG 217 8.812 4.628 0.907 897 HH22 ARG 217 HH22 ARG 217 8.222 3.032 1.224 898 H ILE 218 H ILE 218 14.651 3.963 5.582 899 HA ILE 218 HA ILE 218 15.681 6.612 5.693 900 HB ILE 218 HB ILE 218 15.722 4.457 7.809 901 HG12 ILE 218 HG12 ILE 218 13.824 6.789 7.632 902 HG13 ILE 218 HG13 ILE 218 13.473 5.255 6.841 903 HG21 ILE 218 HG21 ILE 218 17.186 5.913 8.734 904 HG22 ILE 218 HG22 ILE 218 16.612 7.272 7.770 905 HG23 ILE 218 HG23 ILE 218 15.704 6.753 9.190 906 HD11 ILE 218 HD11 ILE 218 13.591 5.912 9.741 907 HD12 ILE 218 HD12 ILE 218 12.378 5.005 8.834 908 HD13 ILE 218 HD13 ILE 218 13.934 4.265 9.209 909 H SER 219 H SER 219 17.114 3.484 5.339 910 HA SER 219 HA SER 219 19.792 4.636 5.755 911 HB2 SER 219 HB2 SER 219 20.568 2.565 6.440 912 HB3 SER 219 HB3 SER 219 18.908 2.508 7.031 913 HG SER 219 HG SER 219 20.092 1.150 4.898 914 H ASN 220 H ASN 220 21.418 3.075 4.381 915 HA ASN 220 HA ASN 220 20.969 3.852 1.676 916 HB2 ASN 220 HB2 ASN 220 23.223 3.764 2.693 917 HB3 ASN 220 HB3 ASN 220 23.088 2.011 2.809 918 HD21 ASN 220 HD21 ASN 220 24.244 1.046 1.321 919 HD22 ASN 220 HD22 ASN 220 24.451 1.568 -0.313 Start of MODEL 11 1 H ALA 23 H ALA 23 3.704 14.728 13.093 2 HA ALA 23 HA ALA 23 2.358 12.250 13.862 3 HB1 ALA 23 HB1 ALA 23 0.563 13.831 14.657 4 HB2 ALA 23 HB2 ALA 23 2.121 13.969 15.473 5 HB3 ALA 23 HB3 ALA 23 1.659 15.150 14.249 6 H ALA 24 H ALA 24 2.891 12.650 11.090 7 HA ALA 24 HA ALA 24 0.219 13.204 9.995 8 HB1 ALA 24 HB1 ALA 24 2.960 13.525 8.952 9 HB2 ALA 24 HB2 ALA 24 1.741 12.989 7.795 10 HB3 ALA 24 HB3 ALA 24 1.516 14.500 8.676 11 HA PRO 25 HA PRO 25 -0.509 9.013 8.917 12 HB2 PRO 25 HB2 PRO 25 -1.680 9.233 6.477 13 HB3 PRO 25 HB3 PRO 25 -2.491 9.698 7.978 14 HG2 PRO 25 HG2 PRO 25 -1.093 11.421 5.966 15 HG3 PRO 25 HG3 PRO 25 -2.632 11.700 6.802 16 HD2 PRO 25 HD2 PRO 25 -0.320 12.881 7.573 17 HD3 PRO 25 HD3 PRO 25 -1.598 12.440 8.725 18 H ASN 26 H ASN 26 1.619 8.220 8.719 19 HA ASN 26 HA ASN 26 2.567 7.988 5.939 20 HB2 ASN 26 HB2 ASN 26 4.460 7.888 8.267 21 HB3 ASN 26 HB3 ASN 26 4.794 8.271 6.581 22 HD21 ASN 26 HD21 ASN 26 2.922 10.172 6.043 23 HD22 ASN 26 HD22 ASN 26 3.213 11.574 7.010 24 H LEU 27 H LEU 27 3.030 5.983 5.220 25 HA LEU 27 HA LEU 27 2.657 3.771 7.117 26 HB2 LEU 27 HB2 LEU 27 1.142 3.991 5.118 27 HB3 LEU 27 HB3 LEU 27 2.547 3.645 4.112 28 HG LEU 27 HG LEU 27 2.736 1.431 5.080 29 HD11 LEU 27 HD11 LEU 27 0.414 0.979 6.479 30 HD12 LEU 27 HD12 LEU 27 0.929 2.562 7.060 31 HD13 LEU 27 HD13 LEU 27 2.020 1.183 7.176 32 HD21 LEU 27 HD21 LEU 27 0.351 0.613 4.431 33 HD22 LEU 27 HD22 LEU 27 1.399 1.327 3.205 34 HD23 LEU 27 HD23 LEU 27 0.114 2.289 3.935 35 H ALA 28 H ALA 28 4.538 3.042 7.868 36 HA ALA 28 HA ALA 28 6.663 2.233 7.960 37 HB1 ALA 28 HB1 ALA 28 5.469 1.104 5.696 38 HB2 ALA 28 HB2 ALA 28 7.087 1.592 5.189 39 HB3 ALA 28 HB3 ALA 28 6.882 0.514 6.571 40 H GLY 29 H GLY 29 6.200 5.067 7.290 41 HA2 GLY 29 HA2 GLY 29 7.858 6.750 7.194 42 HA3 GLY 29 HA3 GLY 29 8.906 5.635 6.331 43 H ALA 30 H ALA 30 5.866 5.442 5.012 44 HA ALA 30 HA ALA 30 6.667 7.183 2.792 45 HB1 ALA 30 HB1 ALA 30 4.941 5.933 1.504 46 HB2 ALA 30 HB2 ALA 30 6.247 4.922 2.124 47 HB3 ALA 30 HB3 ALA 30 4.677 4.926 2.928 48 H VAL 31 H VAL 31 5.806 9.145 2.741 49 HA VAL 31 HA VAL 31 3.289 9.669 4.123 50 HB VAL 31 HB VAL 31 5.106 11.664 2.770 51 HG11 VAL 31 HG11 VAL 31 3.319 12.967 3.140 52 HG12 VAL 31 HG12 VAL 31 2.598 11.824 4.276 53 HG13 VAL 31 HG13 VAL 31 3.849 12.941 4.822 54 HG21 VAL 31 HG21 VAL 31 5.591 12.062 5.368 55 HG22 VAL 31 HG22 VAL 31 5.283 10.325 5.405 56 HG23 VAL 31 HG23 VAL 31 6.558 10.974 4.372 57 H GLU 32 H GLU 32 4.700 9.801 0.894 58 HA GLU 32 HA GLU 32 2.425 10.985 -0.350 59 HB2 GLU 32 HB2 GLU 32 4.596 9.329 -1.644 60 HB3 GLU 32 HB3 GLU 32 3.519 10.465 -2.445 61 HG2 GLU 32 HG2 GLU 32 4.539 12.318 -1.310 62 HG3 GLU 32 HG3 GLU 32 5.529 11.228 -0.340 63 H PHE 33 H PHE 33 0.745 10.058 -1.450 64 HA PHE 33 HA PHE 33 -0.258 7.613 -0.584 65 HB2 PHE 33 HB2 PHE 33 -1.826 9.117 -1.484 66 HB3 PHE 33 HB3 PHE 33 -0.893 9.345 -2.960 67 HD1 PHE 33 HD1 PHE 33 -2.965 6.905 -1.104 68 HD2 PHE 33 HD2 PHE 33 -1.283 8.022 -4.851 69 HE1 PHE 33 HE1 PHE 33 -4.326 5.188 -2.223 70 HE2 PHE 33 HE2 PHE 33 -2.643 6.307 -5.976 71 HZ PHE 33 HZ PHE 33 -4.167 4.887 -4.662 72 H SER 34 H SER 34 1.298 8.389 -3.691 73 HA SER 34 HA SER 34 1.183 5.906 -4.884 74 HB2 SER 34 HB2 SER 34 3.355 6.622 -6.035 75 HB3 SER 34 HB3 SER 34 1.977 7.710 -6.197 76 HG SER 34 HG SER 34 3.951 8.011 -4.189 77 H ASP 35 H ASP 35 3.449 7.090 -2.466 78 HA ASP 35 HA ASP 35 5.160 4.803 -2.574 79 HB2 ASP 35 HB2 ASP 35 4.864 7.119 -0.681 80 HB3 ASP 35 HB3 ASP 35 5.925 5.767 -0.293 81 H VAL 36 H VAL 36 2.274 5.665 -0.825 82 HA VAL 36 HA VAL 36 2.493 3.661 1.194 83 HB VAL 36 HB VAL 36 0.048 5.127 0.191 84 HG11 VAL 36 HG11 VAL 36 -1.156 3.809 1.508 85 HG12 VAL 36 HG12 VAL 36 0.295 2.916 1.971 86 HG13 VAL 36 HG13 VAL 36 -0.201 4.336 2.894 87 HG21 VAL 36 HG21 VAL 36 1.146 5.810 2.812 88 HG22 VAL 36 HG22 VAL 36 2.224 6.185 1.467 89 HG23 VAL 36 HG23 VAL 36 0.594 6.858 1.506 90 H LYS 37 H LYS 37 0.406 3.914 -1.690 91 HA LYS 37 HA LYS 37 -0.714 1.367 -1.536 92 HB2 LYS 37 HB2 LYS 37 -1.059 1.643 -4.036 93 HB3 LYS 37 HB3 LYS 37 -1.713 2.919 -3.017 94 HG2 LYS 37 HG2 LYS 37 -0.184 4.465 -3.731 95 HG3 LYS 37 HG3 LYS 37 1.024 3.244 -4.140 96 HD2 LYS 37 HD2 LYS 37 -1.397 2.969 -5.721 97 HD3 LYS 37 HD3 LYS 37 -0.655 4.560 -5.907 98 HE2 LYS 37 HE2 LYS 37 1.507 3.431 -6.378 99 HE3 LYS 37 HE3 LYS 37 0.668 1.882 -6.324 100 HZ1 LYS 37 HZ1 LYS 37 -0.804 3.382 -8.061 101 HZ2 LYS 37 HZ2 LYS 37 0.313 2.185 -8.483 102 HZ3 LYS 37 HZ3 LYS 37 0.791 3.806 -8.434 103 H THR 38 H THR 38 2.346 2.438 -2.871 104 HA THR 38 HA THR 38 2.992 0.083 -4.289 105 HB THR 38 HB THR 38 4.788 2.194 -3.084 106 HG1 THR 38 HG1 THR 38 4.934 2.586 -5.507 107 HG21 THR 38 HG21 THR 38 5.454 -0.045 -4.999 108 HG22 THR 38 HG22 THR 38 6.059 0.145 -3.353 109 HG23 THR 38 HG23 THR 38 6.525 1.299 -4.602 110 H LEU 39 H LEU 39 3.512 1.081 -0.950 111 HA LEU 39 HA LEU 39 5.189 -1.107 -0.249 112 HB2 LEU 39 HB2 LEU 39 3.526 0.777 1.409 113 HB3 LEU 39 HB3 LEU 39 4.592 -0.445 2.099 114 HG LEU 39 HG LEU 39 5.647 1.647 0.227 115 HD11 LEU 39 HD11 LEU 39 6.285 2.914 2.295 116 HD12 LEU 39 HD12 LEU 39 5.149 1.900 3.183 117 HD13 LEU 39 HD13 LEU 39 4.569 2.951 1.892 118 HD21 LEU 39 HD21 LEU 39 7.398 0.269 0.535 119 HD22 LEU 39 HD22 LEU 39 6.727 -0.429 2.009 120 HD23 LEU 39 HD23 LEU 39 7.556 1.127 2.068 121 H LEU 40 H LEU 40 1.721 -0.551 -0.189 122 HA LEU 40 HA LEU 40 1.078 -2.891 1.307 123 HB2 LEU 40 HB2 LEU 40 -0.709 -1.395 -0.600 124 HB3 LEU 40 HB3 LEU 40 -1.200 -2.435 0.735 125 HG LEU 40 HG LEU 40 0.403 0.007 1.334 126 HD11 LEU 40 HD11 LEU 40 -1.206 1.495 0.880 127 HD12 LEU 40 HD12 LEU 40 -2.496 0.401 1.379 128 HD13 LEU 40 HD13 LEU 40 -1.806 0.270 -0.238 129 HD21 LEU 40 HD21 LEU 40 -1.699 -1.633 2.723 130 HD22 LEU 40 HD22 LEU 40 -1.186 -0.053 3.315 131 HD23 LEU 40 HD23 LEU 40 -0.020 -1.372 3.195 132 H LYS 41 H LYS 41 1.027 -2.101 -2.155 133 HA LYS 41 HA LYS 41 0.001 -4.467 -3.151 134 HB2 LYS 41 HB2 LYS 41 0.908 -2.196 -4.280 135 HB3 LYS 41 HB3 LYS 41 2.252 -3.265 -4.662 136 HG2 LYS 41 HG2 LYS 41 0.301 -4.853 -5.464 137 HG3 LYS 41 HG3 LYS 41 -0.552 -3.316 -5.629 138 HD2 LYS 41 HD2 LYS 41 0.429 -3.636 -7.722 139 HD3 LYS 41 HD3 LYS 41 1.535 -2.529 -6.906 140 HE2 LYS 41 HE2 LYS 41 3.092 -4.249 -6.475 141 HE3 LYS 41 HE3 LYS 41 1.928 -5.510 -6.877 142 HZ1 LYS 41 HZ1 LYS 41 1.981 -4.242 -9.175 143 HZ2 LYS 41 HZ2 LYS 41 3.096 -5.457 -8.801 144 HZ3 LYS 41 HZ3 LYS 41 3.534 -3.831 -8.645 145 H GLU 42 H GLU 42 3.349 -3.685 -2.300 146 HA GLU 42 HA GLU 42 4.352 -6.247 -3.113 147 HB2 GLU 42 HB2 GLU 42 6.457 -5.504 -2.069 148 HB3 GLU 42 HB3 GLU 42 5.807 -4.300 -3.173 149 HG2 GLU 42 HG2 GLU 42 4.859 -3.101 -1.219 150 HG3 GLU 42 HG3 GLU 42 5.677 -4.256 -0.169 151 H TRP 43 H TRP 43 3.519 -4.714 -0.035 152 HA TRP 43 HA TRP 43 4.392 -6.800 1.642 153 HB2 TRP 43 HB2 TRP 43 3.962 -4.654 2.607 154 HB3 TRP 43 HB3 TRP 43 2.300 -4.656 2.023 155 HD1 TRP 43 HD1 TRP 43 4.419 -6.916 4.381 156 HE1 TRP 43 HE1 TRP 43 2.936 -7.564 6.383 157 HE3 TRP 43 HE3 TRP 43 0.106 -4.545 2.997 158 HZ2 TRP 43 HZ2 TRP 43 0.287 -7.128 7.259 159 HZ3 TRP 43 HZ3 TRP 43 -1.856 -4.711 4.472 160 HH2 TRP 43 HH2 TRP 43 -1.765 -5.976 6.558 161 H ILE 44 H ILE 44 1.784 -6.631 -0.514 162 HA ILE 44 HA ILE 44 0.301 -8.739 0.892 163 HB ILE 44 HB ILE 44 -0.499 -7.061 -1.489 164 HG12 ILE 44 HG12 ILE 44 -1.830 -7.049 1.201 165 HG13 ILE 44 HG13 ILE 44 -0.380 -6.087 0.932 166 HG21 ILE 44 HG21 ILE 44 -2.765 -8.084 -1.037 167 HG22 ILE 44 HG22 ILE 44 -1.560 -9.155 -1.749 168 HG23 ILE 44 HG23 ILE 44 -1.930 -9.265 -0.029 169 HD11 ILE 44 HD11 ILE 44 -2.927 -5.250 0.491 170 HD12 ILE 44 HD12 ILE 44 -1.485 -4.549 -0.246 171 HD13 ILE 44 HD13 ILE 44 -2.427 -5.753 -1.124 172 H THR 45 H THR 45 2.510 -8.266 -1.633 173 HA THR 45 HA THR 45 1.729 -10.755 -2.977 174 HB THR 45 HB THR 45 3.330 -10.093 -4.743 175 HG1 THR 45 HG1 THR 45 4.573 -8.361 -4.518 176 HG21 THR 45 HG21 THR 45 2.056 -7.841 -5.296 177 HG22 THR 45 HG22 THR 45 1.040 -8.361 -3.951 178 HG23 THR 45 HG23 THR 45 1.234 -9.399 -5.363 179 H THR 46 H THR 46 4.700 -9.130 -1.852 180 HA THR 46 HA THR 46 6.317 -11.442 -1.986 181 HB THR 46 HB THR 46 7.179 -9.088 -1.915 182 HG1 THR 46 HG1 THR 46 8.979 -9.687 -0.540 183 HG21 THR 46 HG21 THR 46 5.709 -9.002 0.485 184 HG22 THR 46 HG22 THR 46 6.728 -7.737 -0.202 185 HG23 THR 46 HG23 THR 46 7.410 -8.896 0.938 186 H ILE 47 H ILE 47 3.936 -10.472 0.243 187 HA ILE 47 HA ILE 47 4.821 -12.569 2.111 188 HB ILE 47 HB ILE 47 3.590 -9.907 2.825 189 HG12 ILE 47 HG12 ILE 47 5.967 -10.652 4.277 190 HG13 ILE 47 HG13 ILE 47 6.268 -10.735 2.544 191 HG21 ILE 47 HG21 ILE 47 2.550 -11.464 4.253 192 HG22 ILE 47 HG22 ILE 47 4.041 -12.376 4.475 193 HG23 ILE 47 HG23 ILE 47 3.873 -10.776 5.193 194 HD11 ILE 47 HD11 ILE 47 4.995 -8.364 2.711 195 HD12 ILE 47 HD12 ILE 47 5.810 -8.415 4.275 196 HD13 ILE 47 HD13 ILE 47 6.746 -8.562 2.787 197 H SER 48 H SER 48 3.347 -14.082 2.558 198 HA SER 48 HA SER 48 0.601 -13.643 1.600 199 HB2 SER 48 HB2 SER 48 1.908 -16.300 2.210 200 HB3 SER 48 HB3 SER 48 0.407 -16.017 1.327 201 HG SER 48 HG SER 48 2.818 -16.214 0.326 202 H ASP 49 H ASP 49 2.525 -14.311 4.387 203 HA ASP 49 HA ASP 49 0.081 -14.668 5.993 204 HB2 ASP 49 HB2 ASP 49 1.791 -15.628 7.704 205 HB3 ASP 49 HB3 ASP 49 1.281 -16.632 6.349 206 HA PRO 50 HA PRO 50 1.801 -10.545 7.139 207 HB2 PRO 50 HB2 PRO 50 -0.630 -9.373 7.435 208 HB3 PRO 50 HB3 PRO 50 0.194 -9.496 5.875 209 HG2 PRO 50 HG2 PRO 50 -1.992 -11.203 7.003 210 HG3 PRO 50 HG3 PRO 50 -1.809 -10.559 5.360 211 HD2 PRO 50 HD2 PRO 50 -1.182 -13.115 6.002 212 HD3 PRO 50 HD3 PRO 50 -0.317 -12.205 4.746 213 H MET 51 H MET 51 2.140 -9.854 9.185 214 HA MET 51 HA MET 51 0.970 -11.393 11.344 215 HB2 MET 51 HB2 MET 51 3.200 -9.397 11.136 216 HB3 MET 51 HB3 MET 51 2.539 -9.821 12.709 217 HG2 MET 51 HG2 MET 51 3.022 -12.207 12.191 218 HG3 MET 51 HG3 MET 51 3.836 -11.668 10.724 219 HE1 MET 51 HE1 MET 51 5.482 -9.960 10.644 220 HE2 MET 51 HE2 MET 51 5.893 -8.983 12.053 221 HE3 MET 51 HE3 MET 51 6.981 -10.266 11.522 222 H GLU 52 H GLU 52 0.107 -10.337 13.279 223 HA GLU 52 HA GLU 52 -2.025 -8.636 12.713 224 HB2 GLU 52 HB2 GLU 52 -1.749 -10.144 14.726 225 HB3 GLU 52 HB3 GLU 52 -0.705 -8.907 15.413 226 HG2 GLU 52 HG2 GLU 52 -3.012 -8.800 16.256 227 HG3 GLU 52 HG3 GLU 52 -2.507 -7.322 15.440 228 H GLU 53 H GLU 53 0.929 -7.825 14.546 229 HA GLU 53 HA GLU 53 0.512 -5.109 14.794 230 HB2 GLU 53 HB2 GLU 53 3.155 -6.520 14.391 231 HB3 GLU 53 HB3 GLU 53 2.954 -4.898 15.039 232 HG2 GLU 53 HG2 GLU 53 3.125 -6.008 16.993 233 HG3 GLU 53 HG3 GLU 53 1.391 -6.203 16.746 234 H ASP 54 H ASP 54 2.124 -6.839 12.148 235 HA ASP 54 HA ASP 54 2.930 -4.658 10.631 236 HB2 ASP 54 HB2 ASP 54 2.276 -7.501 10.030 237 HB3 ASP 54 HB3 ASP 54 2.422 -6.391 8.670 238 H ILE 55 H ILE 55 -0.202 -6.269 10.780 239 HA ILE 55 HA ILE 55 -1.356 -4.796 8.624 240 HB ILE 55 HB ILE 55 -2.700 -6.320 10.860 241 HG12 ILE 55 HG12 ILE 55 -2.527 -7.282 8.038 242 HG13 ILE 55 HG13 ILE 55 -1.105 -7.440 9.064 243 HG21 ILE 55 HG21 ILE 55 -4.237 -4.727 9.911 244 HG22 ILE 55 HG22 ILE 55 -3.803 -5.225 8.277 245 HG23 ILE 55 HG23 ILE 55 -4.658 -6.342 9.341 246 HD11 ILE 55 HD11 ILE 55 -2.195 -9.471 9.299 247 HD12 ILE 55 HD12 ILE 55 -2.695 -8.571 10.730 248 HD13 ILE 55 HD13 ILE 55 -3.790 -8.722 9.355 249 H LEU 56 H LEU 56 -1.653 -4.582 12.166 250 HA LEU 56 HA LEU 56 -3.429 -2.495 12.374 251 HB2 LEU 56 HB2 LEU 56 -1.169 -3.461 14.041 252 HB3 LEU 56 HB3 LEU 56 -1.873 -1.895 14.438 253 HG LEU 56 HG LEU 56 -2.836 -3.643 15.816 254 HD11 LEU 56 HD11 LEU 56 -4.330 -1.916 14.069 255 HD12 LEU 56 HD12 LEU 56 -4.637 -2.348 15.751 256 HD13 LEU 56 HD13 LEU 56 -5.260 -3.365 14.451 257 HD21 LEU 56 HD21 LEU 56 -3.560 -4.906 13.179 258 HD22 LEU 56 HD22 LEU 56 -4.282 -5.373 14.719 259 HD23 LEU 56 HD23 LEU 56 -2.549 -5.578 14.458 260 H GLN 57 H GLN 57 -0.095 -2.409 11.393 261 HA GLN 57 HA GLN 57 0.531 0.265 11.814 262 HB2 GLN 57 HB2 GLN 57 1.381 -1.590 9.587 263 HB3 GLN 57 HB3 GLN 57 2.102 -0.013 9.878 264 HG2 GLN 57 HG2 GLN 57 2.374 -1.065 12.318 265 HG3 GLN 57 HG3 GLN 57 2.409 -2.544 11.360 266 HE21 GLN 57 HE21 GLN 57 4.578 -2.866 11.950 267 HE22 GLN 57 HE22 GLN 57 5.854 -1.957 11.220 268 H VAL 58 H VAL 58 -1.308 -1.250 9.225 269 HA VAL 58 HA VAL 58 -1.492 1.100 7.612 270 HB VAL 58 HB VAL 58 -2.883 -0.109 6.187 271 HG11 VAL 58 HG11 VAL 58 -0.566 -1.140 6.717 272 HG12 VAL 58 HG12 VAL 58 -1.502 -2.432 7.472 273 HG13 VAL 58 HG13 VAL 58 -1.721 -2.067 5.760 274 HG21 VAL 58 HG21 VAL 58 -3.941 -2.322 7.121 275 HG22 VAL 58 HG22 VAL 58 -3.768 -1.499 8.671 276 HG23 VAL 58 HG23 VAL 58 -4.729 -0.766 7.386 277 H VAL 59 H VAL 59 -3.365 -0.267 10.224 278 HA VAL 59 HA VAL 59 -5.765 1.128 9.888 279 HB VAL 59 HB VAL 59 -4.446 0.268 12.466 280 HG11 VAL 59 HG11 VAL 59 -6.094 1.842 13.059 281 HG12 VAL 59 HG12 VAL 59 -7.228 1.229 11.852 282 HG13 VAL 59 HG13 VAL 59 -6.850 0.264 13.280 283 HG21 VAL 59 HG21 VAL 59 -6.701 -1.177 11.152 284 HG22 VAL 59 HG22 VAL 59 -5.058 -1.422 10.560 285 HG23 VAL 59 HG23 VAL 59 -5.455 -1.789 12.239 286 H ARG 60 H ARG 60 -2.929 1.983 11.871 287 HA ARG 60 HA ARG 60 -3.878 4.434 12.807 288 HB2 ARG 60 HB2 ARG 60 -1.007 3.690 12.219 289 HB3 ARG 60 HB3 ARG 60 -1.549 4.973 13.291 290 HG2 ARG 60 HG2 ARG 60 -2.378 2.142 13.775 291 HG3 ARG 60 HG3 ARG 60 -0.796 2.724 14.300 292 HD2 ARG 60 HD2 ARG 60 -3.466 3.903 15.063 293 HD3 ARG 60 HD3 ARG 60 -2.448 2.895 16.092 294 HE ARG 60 HE ARG 60 -0.817 4.949 15.424 295 HH11 ARG 60 HH11 ARG 60 -4.026 4.775 16.764 296 HH12 ARG 60 HH12 ARG 60 -3.872 6.249 17.661 297 HH21 ARG 60 HH21 ARG 60 -0.603 6.892 16.601 298 HH22 ARG 60 HH22 ARG 60 -1.926 7.453 17.566 299 H TYR 61 H TYR 61 -2.488 3.548 9.742 300 HA TYR 61 HA TYR 61 -1.867 6.188 8.872 301 HB2 TYR 61 HB2 TYR 61 -0.739 4.376 7.802 302 HB3 TYR 61 HB3 TYR 61 -2.257 3.587 7.390 303 HD1 TYR 61 HD2 TYR 61 -0.427 6.786 6.777 304 HD2 TYR 61 HD1 TYR 61 -3.090 3.840 5.248 305 HE1 TYR 61 HE2 TYR 61 -0.417 7.918 4.594 306 HE2 TYR 61 HE1 TYR 61 -3.087 4.964 3.060 307 HH TYR 61 HH TYR 61 -2.498 7.736 2.417 308 H CYS 62 H CYS 62 -4.514 3.955 8.021 309 HA CYS 62 HA CYS 62 -5.954 5.830 6.482 310 HB2 CYS 62 HB2 CYS 62 -6.694 3.233 7.807 311 HB3 CYS 62 HB3 CYS 62 -7.901 4.201 6.971 312 HG CYS 62 HG CYS 62 -5.743 2.069 5.730 313 H THR 63 H THR 63 -6.319 4.763 9.850 314 HA THR 63 HA THR 63 -8.568 6.269 10.510 315 HB THR 63 HB THR 63 -7.767 6.132 12.866 316 HG1 THR 63 HG1 THR 63 -5.426 6.098 11.907 317 HG21 THR 63 HG21 THR 63 -8.480 4.032 11.122 318 HG22 THR 63 HG22 THR 63 -8.674 4.097 12.874 319 HG23 THR 63 HG23 THR 63 -7.209 3.409 12.174 320 H ASP 64 H ASP 64 -5.264 7.231 10.085 321 HA ASP 64 HA ASP 64 -5.447 9.702 11.507 322 HB2 ASP 64 HB2 ASP 64 -3.465 8.409 9.700 323 HB3 ASP 64 HB3 ASP 64 -3.370 10.157 9.892 324 H LEU 65 H LEU 65 -5.891 8.712 8.156 325 HA LEU 65 HA LEU 65 -5.978 11.186 6.912 326 HB2 LEU 65 HB2 LEU 65 -6.951 8.494 6.354 327 HB3 LEU 65 HB3 LEU 65 -7.935 9.756 5.617 328 HG LEU 65 HG LEU 65 -6.133 10.534 4.307 329 HD11 LEU 65 HD11 LEU 65 -4.378 8.813 6.044 330 HD12 LEU 65 HD12 LEU 65 -4.363 10.570 5.903 331 HD13 LEU 65 HD13 LEU 65 -3.841 9.572 4.546 332 HD21 LEU 65 HD21 LEU 65 -7.115 8.534 3.407 333 HD22 LEU 65 HD22 LEU 65 -6.083 7.522 4.417 334 HD23 LEU 65 HD23 LEU 65 -5.375 8.489 3.123 335 H ILE 66 H ILE 66 -8.420 9.551 8.828 336 HA ILE 66 HA ILE 66 -10.620 11.171 8.167 337 HB ILE 66 HB ILE 66 -9.969 9.501 10.576 338 HG12 ILE 66 HG12 ILE 66 -12.440 8.979 9.136 339 HG13 ILE 66 HG13 ILE 66 -11.047 8.959 8.060 340 HG21 ILE 66 HG21 ILE 66 -11.231 11.158 11.613 341 HG22 ILE 66 HG22 ILE 66 -12.264 11.389 10.203 342 HG23 ILE 66 HG23 ILE 66 -12.431 9.937 11.189 343 HD11 ILE 66 HD11 ILE 66 -10.074 7.458 10.038 344 HD12 ILE 66 HD12 ILE 66 -11.794 7.115 10.234 345 HD13 ILE 66 HD13 ILE 66 -11.002 6.798 8.691 346 H GLU 67 H GLU 67 -8.194 11.456 10.740 347 HA GLU 67 HA GLU 67 -9.343 13.825 11.851 348 HB2 GLU 67 HB2 GLU 67 -6.499 12.891 12.206 349 HB3 GLU 67 HB3 GLU 67 -7.456 13.879 13.301 350 HG2 GLU 67 HG2 GLU 67 -7.944 10.981 12.656 351 HG3 GLU 67 HG3 GLU 67 -7.213 11.609 14.131 352 H GLU 68 H GLU 68 -6.841 13.130 9.489 353 HA GLU 68 HA GLU 68 -6.006 15.890 9.302 354 HB2 GLU 68 HB2 GLU 68 -5.268 13.378 7.816 355 HB3 GLU 68 HB3 GLU 68 -4.701 14.959 7.292 356 HG2 GLU 68 HG2 GLU 68 -4.186 13.691 9.974 357 HG3 GLU 68 HG3 GLU 68 -3.034 13.831 8.647 358 H LYS 69 H LYS 69 -8.599 14.150 8.162 359 HA LYS 69 HA LYS 69 -10.238 14.585 6.647 360 HB2 LYS 69 HB2 LYS 69 -8.898 17.251 6.194 361 HB3 LYS 69 HB3 LYS 69 -10.586 16.839 5.920 362 HG2 LYS 69 HG2 LYS 69 -9.303 16.791 8.638 363 HG3 LYS 69 HG3 LYS 69 -10.114 18.209 7.969 364 HD2 LYS 69 HD2 LYS 69 -11.736 15.819 7.722 365 HD3 LYS 69 HD3 LYS 69 -11.294 16.142 9.400 366 HE2 LYS 69 HE2 LYS 69 -12.335 18.334 7.645 367 HE3 LYS 69 HE3 LYS 69 -13.444 17.210 8.429 368 HZ1 LYS 69 HZ1 LYS 69 -13.274 18.406 10.266 369 HZ2 LYS 69 HZ2 LYS 69 -12.167 19.452 9.531 370 HZ3 LYS 69 HZ3 LYS 69 -11.616 18.077 10.349 371 H ASP 70 H ASP 70 -7.939 13.196 5.785 372 HA ASP 70 HA ASP 70 -7.661 14.118 3.002 373 HB2 ASP 70 HB2 ASP 70 -5.820 12.618 4.832 374 HB3 ASP 70 HB3 ASP 70 -5.672 12.416 3.088 375 H LEU 71 H LEU 71 -9.958 12.704 3.879 376 HA LEU 71 HA LEU 71 -9.923 9.957 3.526 377 HB2 LEU 71 HB2 LEU 71 -12.137 11.736 2.538 378 HB3 LEU 71 HB3 LEU 71 -12.258 10.081 3.132 379 HG LEU 71 HG LEU 71 -11.681 12.547 4.772 380 HD11 LEU 71 HD11 LEU 71 -14.082 11.668 3.858 381 HD12 LEU 71 HD12 LEU 71 -13.846 12.580 5.349 382 HD13 LEU 71 HD13 LEU 71 -13.965 10.821 5.401 383 HD21 LEU 71 HD21 LEU 71 -11.415 9.653 5.346 384 HD22 LEU 71 HD22 LEU 71 -12.142 10.662 6.597 385 HD23 LEU 71 HD23 LEU 71 -10.523 11.029 5.998 386 H GLU 72 H GLU 72 -9.536 12.469 1.196 387 HA GLU 72 HA GLU 72 -10.386 11.328 -1.158 388 HB2 GLU 72 HB2 GLU 72 -9.549 13.566 -1.166 389 HB3 GLU 72 HB3 GLU 72 -7.968 13.044 -0.602 390 HG2 GLU 72 HG2 GLU 72 -7.370 12.185 -2.666 391 HG3 GLU 72 HG3 GLU 72 -9.041 12.064 -3.211 392 H LYS 73 H LYS 73 -7.274 10.847 0.477 393 HA LYS 73 HA LYS 73 -6.365 8.944 -1.481 394 HB2 LYS 73 HB2 LYS 73 -5.240 9.558 1.258 395 HB3 LYS 73 HB3 LYS 73 -4.424 8.679 -0.029 396 HG2 LYS 73 HG2 LYS 73 -3.821 10.553 -1.099 397 HG3 LYS 73 HG3 LYS 73 -5.362 11.353 -0.782 398 HD2 LYS 73 HD2 LYS 73 -3.908 12.631 0.474 399 HD3 LYS 73 HD3 LYS 73 -4.479 11.465 1.671 400 HE2 LYS 73 HE2 LYS 73 -2.488 10.282 1.654 401 HE3 LYS 73 HE3 LYS 73 -2.026 10.883 0.063 402 HZ1 LYS 73 HZ1 LYS 73 -1.816 12.213 2.678 403 HZ2 LYS 73 HZ2 LYS 73 -1.947 13.149 1.276 404 HZ3 LYS 73 HZ3 LYS 73 -0.657 12.070 1.455 405 H LEU 74 H LEU 74 -8.187 8.844 1.441 406 HA LEU 74 HA LEU 74 -7.667 6.264 2.353 407 HB2 LEU 74 HB2 LEU 74 -9.041 8.047 3.476 408 HB3 LEU 74 HB3 LEU 74 -10.358 7.613 2.389 409 HG LEU 74 HG LEU 74 -10.368 5.342 3.354 410 HD11 LEU 74 HD11 LEU 74 -9.128 4.938 5.441 411 HD12 LEU 74 HD12 LEU 74 -8.302 6.481 5.229 412 HD13 LEU 74 HD13 LEU 74 -8.061 5.184 4.058 413 HD21 LEU 74 HD21 LEU 74 -11.184 6.054 5.644 414 HD22 LEU 74 HD22 LEU 74 -11.955 6.831 4.261 415 HD23 LEU 74 HD23 LEU 74 -10.729 7.695 5.189 416 H ASP 75 H ASP 75 -10.438 7.271 0.339 417 HA ASP 75 HA ASP 75 -11.371 4.736 -0.283 418 HB2 ASP 75 HB2 ASP 75 -12.085 7.315 -0.947 419 HB3 ASP 75 HB3 ASP 75 -11.612 6.633 -2.501 420 H LEU 76 H LEU 76 -8.641 6.462 -1.543 421 HA LEU 76 HA LEU 76 -8.325 4.850 -3.893 422 HB2 LEU 76 HB2 LEU 76 -6.370 6.665 -2.489 423 HB3 LEU 76 HB3 LEU 76 -6.143 5.957 -4.087 424 HG LEU 76 HG LEU 76 -8.391 7.849 -3.421 425 HD11 LEU 76 HD11 LEU 76 -6.238 8.891 -5.075 426 HD12 LEU 76 HD12 LEU 76 -5.724 8.522 -3.428 427 HD13 LEU 76 HD13 LEU 76 -7.073 9.623 -3.704 428 HD21 LEU 76 HD21 LEU 76 -8.351 8.137 -5.914 429 HD22 LEU 76 HD22 LEU 76 -8.873 6.548 -5.353 430 HD23 LEU 76 HD23 LEU 76 -7.241 6.768 -5.985 431 H VAL 77 H VAL 77 -6.759 4.990 -0.709 432 HA VAL 77 HA VAL 77 -4.966 2.842 -1.209 433 HB VAL 77 HB VAL 77 -5.940 3.968 1.421 434 HG11 VAL 77 HG11 VAL 77 -4.309 1.672 0.814 435 HG12 VAL 77 HG12 VAL 77 -3.390 2.872 1.726 436 HG13 VAL 77 HG13 VAL 77 -4.907 2.243 2.371 437 HG21 VAL 77 HG21 VAL 77 -3.267 4.475 0.168 438 HG22 VAL 77 HG22 VAL 77 -4.670 5.449 -0.274 439 HG23 VAL 77 HG23 VAL 77 -4.115 5.409 1.401 440 H ILE 78 H ILE 78 -8.168 3.066 0.256 441 HA ILE 78 HA ILE 78 -8.311 0.427 1.231 442 HB ILE 78 HB ILE 78 -10.508 2.314 0.382 443 HG12 ILE 78 HG12 ILE 78 -9.109 3.037 2.297 444 HG13 ILE 78 HG13 ILE 78 -10.775 2.714 2.765 445 HG21 ILE 78 HG21 ILE 78 -11.882 0.565 0.468 446 HG22 ILE 78 HG22 ILE 78 -10.613 -0.488 1.089 447 HG23 ILE 78 HG23 ILE 78 -11.559 0.501 2.200 448 HD11 ILE 78 HD11 ILE 78 -8.386 1.622 3.825 449 HD12 ILE 78 HD12 ILE 78 -10.052 1.333 4.326 450 HD13 ILE 78 HD13 ILE 78 -9.314 0.316 3.090 451 H LYS 79 H LYS 79 -9.759 1.825 -1.717 452 HA LYS 79 HA LYS 79 -10.649 -0.604 -2.794 453 HB2 LYS 79 HB2 LYS 79 -11.047 0.583 -4.807 454 HB3 LYS 79 HB3 LYS 79 -11.314 1.736 -3.504 455 HG2 LYS 79 HG2 LYS 79 -10.056 3.045 -4.846 456 HG3 LYS 79 HG3 LYS 79 -8.743 2.247 -3.977 457 HD2 LYS 79 HD2 LYS 79 -8.006 1.856 -6.085 458 HD3 LYS 79 HD3 LYS 79 -9.094 0.472 -5.949 459 HE2 LYS 79 HE2 LYS 79 -10.817 1.614 -7.136 460 HE3 LYS 79 HE3 LYS 79 -9.934 3.139 -7.069 461 HZ1 LYS 79 HZ1 LYS 79 -9.700 2.186 -9.237 462 HZ2 LYS 79 HZ2 LYS 79 -9.166 0.713 -8.598 463 HZ3 LYS 79 HZ3 LYS 79 -8.201 2.095 -8.456 464 H TYR 80 H TYR 80 -7.543 0.995 -2.925 465 HA TYR 80 HA TYR 80 -6.437 -0.543 -5.035 466 HB2 TYR 80 HB2 TYR 80 -5.474 1.603 -4.350 467 HB3 TYR 80 HB3 TYR 80 -5.056 0.927 -2.780 468 HD1 TYR 80 HD1 TYR 80 -3.225 -0.690 -2.570 469 HD2 TYR 80 HD2 TYR 80 -4.166 1.103 -6.311 470 HE1 TYR 80 HE1 TYR 80 -1.050 -1.416 -3.457 471 HE2 TYR 80 HE2 TYR 80 -1.993 0.381 -7.211 472 HH TYR 80 HH TYR 80 0.503 -0.337 -5.632 473 H MET 81 H MET 81 -6.037 -0.756 -1.498 474 HA MET 81 HA MET 81 -4.508 -3.132 -1.556 475 HB2 MET 81 HB2 MET 81 -4.798 -3.200 0.816 476 HB3 MET 81 HB3 MET 81 -4.636 -1.511 0.357 477 HG2 MET 81 HG2 MET 81 -6.981 -1.147 0.597 478 HG3 MET 81 HG3 MET 81 -7.277 -2.869 0.821 479 HE1 MET 81 HE1 MET 81 -5.102 0.120 3.087 480 HE2 MET 81 HE2 MET 81 -6.449 0.373 1.977 481 HE3 MET 81 HE3 MET 81 -6.739 0.295 3.716 482 H LYS 82 H LYS 82 -7.920 -2.508 -1.665 483 HA LYS 82 HA LYS 82 -8.891 -4.999 -0.808 484 HB2 LYS 82 HB2 LYS 82 -9.950 -2.623 -2.026 485 HB3 LYS 82 HB3 LYS 82 -10.617 -4.038 -2.828 486 HG2 LYS 82 HG2 LYS 82 -10.611 -4.251 0.080 487 HG3 LYS 82 HG3 LYS 82 -11.572 -2.903 -0.533 488 HD2 LYS 82 HD2 LYS 82 -11.956 -5.381 -2.031 489 HD3 LYS 82 HD3 LYS 82 -12.412 -5.511 -0.330 490 HE2 LYS 82 HE2 LYS 82 -13.915 -3.651 -0.532 491 HE3 LYS 82 HE3 LYS 82 -13.352 -3.314 -2.168 492 HZ1 LYS 82 HZ1 LYS 82 -14.144 -5.778 -2.528 493 HZ2 LYS 82 HZ2 LYS 82 -15.229 -4.483 -2.627 494 HZ3 LYS 82 HZ3 LYS 82 -15.151 -5.415 -1.217 495 H ARG 83 H ARG 83 -8.433 -3.812 -4.143 496 HA ARG 83 HA ARG 83 -9.025 -6.167 -5.474 497 HB2 ARG 83 HB2 ARG 83 -8.160 -5.174 -7.372 498 HB3 ARG 83 HB3 ARG 83 -8.474 -3.770 -6.362 499 HG2 ARG 83 HG2 ARG 83 -5.987 -4.160 -5.610 500 HG3 ARG 83 HG3 ARG 83 -5.887 -4.993 -7.162 501 HD2 ARG 83 HD2 ARG 83 -7.273 -2.527 -7.524 502 HD3 ARG 83 HD3 ARG 83 -5.778 -2.213 -6.645 503 HE ARG 83 HE ARG 83 -4.595 -2.726 -8.538 504 HH11 ARG 83 HH11 ARG 83 -7.879 -3.819 -8.903 505 HH12 ARG 83 HH12 ARG 83 -7.698 -4.220 -10.579 506 HH21 ARG 83 HH21 ARG 83 -4.343 -3.250 -10.744 507 HH22 ARG 83 HH22 ARG 83 -5.685 -3.897 -11.625 508 H LEU 84 H LEU 84 -6.173 -5.282 -3.707 509 HA LEU 84 HA LEU 84 -4.534 -7.379 -4.813 510 HB2 LEU 84 HB2 LEU 84 -4.109 -5.648 -2.382 511 HB3 LEU 84 HB3 LEU 84 -2.904 -6.701 -3.120 512 HG LEU 84 HG LEU 84 -4.156 -4.411 -4.615 513 HD11 LEU 84 HD11 LEU 84 -3.182 -3.107 -3.049 514 HD12 LEU 84 HD12 LEU 84 -1.730 -3.461 -3.984 515 HD13 LEU 84 HD13 LEU 84 -2.079 -4.376 -2.518 516 HD21 LEU 84 HD21 LEU 84 -1.584 -5.949 -4.957 517 HD22 LEU 84 HD22 LEU 84 -2.111 -4.595 -5.955 518 HD23 LEU 84 HD23 LEU 84 -3.030 -6.101 -5.954 519 H MET 85 H MET 85 -5.941 -6.738 -1.598 520 HA MET 85 HA MET 85 -5.255 -9.205 -0.461 521 HB2 MET 85 HB2 MET 85 -7.507 -7.299 0.182 522 HB3 MET 85 HB3 MET 85 -7.098 -8.693 1.172 523 HG2 MET 85 HG2 MET 85 -4.729 -7.646 1.219 524 HG3 MET 85 HG3 MET 85 -5.565 -6.173 0.731 525 HE1 MET 85 HE1 MET 85 -4.710 -4.988 2.411 526 HE2 MET 85 HE2 MET 85 -5.717 -4.640 3.817 527 HE3 MET 85 HE3 MET 85 -4.308 -5.689 3.979 528 H GLN 86 H GLN 86 -7.884 -8.270 -2.544 529 HA GLN 86 HA GLN 86 -9.459 -10.622 -2.051 530 HB2 GLN 86 HB2 GLN 86 -9.603 -8.484 -4.178 531 HB3 GLN 86 HB3 GLN 86 -10.741 -9.820 -4.068 532 HG2 GLN 86 HG2 GLN 86 -10.348 -8.242 -1.609 533 HG3 GLN 86 HG3 GLN 86 -11.146 -7.421 -2.949 534 HE21 GLN 86 HE21 GLN 86 -12.753 -7.546 -1.011 535 HE22 GLN 86 HE22 GLN 86 -13.882 -8.850 -1.097 536 H GLN 87 H GLN 87 -7.452 -9.474 -4.759 537 HA GLN 87 HA GLN 87 -7.724 -11.840 -6.291 538 HB2 GLN 87 HB2 GLN 87 -6.114 -10.915 -7.749 539 HB3 GLN 87 HB3 GLN 87 -7.003 -9.541 -7.108 540 HG2 GLN 87 HG2 GLN 87 -5.201 -9.126 -5.507 541 HG3 GLN 87 HG3 GLN 87 -4.307 -10.493 -6.170 542 HE21 GLN 87 HE21 GLN 87 -6.117 -7.818 -7.636 543 HE22 GLN 87 HE22 GLN 87 -4.822 -7.263 -8.636 544 H SER 88 H SER 88 -5.938 -11.136 -3.500 545 HA SER 88 HA SER 88 -3.592 -12.562 -3.772 546 HB2 SER 88 HB2 SER 88 -3.491 -12.651 -1.406 547 HB3 SER 88 HB3 SER 88 -4.403 -11.187 -1.771 548 HG SER 88 HG SER 88 -5.164 -13.340 -0.361 549 H VAL 89 H VAL 89 -2.975 -14.698 -3.194 550 HA VAL 89 HA VAL 89 -4.835 -16.692 -4.088 551 HB VAL 89 HB VAL 89 -3.064 -18.221 -4.037 552 HG11 VAL 89 HG11 VAL 89 -1.561 -17.239 -5.436 553 HG12 VAL 89 HG12 VAL 89 -2.791 -15.973 -5.423 554 HG13 VAL 89 HG13 VAL 89 -1.358 -15.823 -4.404 555 HG21 VAL 89 HG21 VAL 89 -1.774 -16.406 -2.011 556 HG22 VAL 89 HG22 VAL 89 -2.356 -18.052 -1.769 557 HG23 VAL 89 HG23 VAL 89 -0.941 -17.758 -2.777 558 H GLU 90 H GLU 90 -3.749 -15.489 -1.024 559 HA GLU 90 HA GLU 90 -4.967 -17.745 0.392 560 HB2 GLU 90 HB2 GLU 90 -3.518 -15.431 1.661 561 HB3 GLU 90 HB3 GLU 90 -3.815 -17.029 2.332 562 HG2 GLU 90 HG2 GLU 90 -2.041 -16.496 -0.038 563 HG3 GLU 90 HG3 GLU 90 -1.468 -16.628 1.624 564 H SER 91 H SER 91 -6.859 -17.591 1.430 565 HA SER 91 HA SER 91 -8.506 -15.299 1.036 566 HB2 SER 91 HB2 SER 91 -9.764 -17.242 1.070 567 HB3 SER 91 HB3 SER 91 -8.830 -17.947 2.390 568 HG SER 91 HG SER 91 -9.918 -16.704 3.834 569 H VAL 92 H VAL 92 -6.285 -16.231 3.457 570 HA VAL 92 HA VAL 92 -7.336 -15.070 5.756 571 HB VAL 92 HB VAL 92 -5.283 -16.459 5.703 572 HG11 VAL 92 HG11 VAL 92 -3.756 -14.014 4.884 573 HG12 VAL 92 HG12 VAL 92 -3.232 -15.699 4.910 574 HG13 VAL 92 HG13 VAL 92 -4.371 -15.147 3.681 575 HG21 VAL 92 HG21 VAL 92 -5.850 -15.039 7.644 576 HG22 VAL 92 HG22 VAL 92 -4.113 -15.272 7.457 577 HG23 VAL 92 HG23 VAL 92 -4.856 -13.751 6.963 578 H TRP 93 H TRP 93 -6.032 -13.598 2.913 579 HA TRP 93 HA TRP 93 -5.411 -11.063 4.063 580 HB2 TRP 93 HB2 TRP 93 -5.696 -12.131 1.285 581 HB3 TRP 93 HB3 TRP 93 -5.683 -10.387 1.524 582 HD1 TRP 93 HD1 TRP 93 -3.392 -13.181 0.937 583 HE1 TRP 93 HE1 TRP 93 -0.961 -12.507 1.448 584 HE3 TRP 93 HE3 TRP 93 -4.270 -8.832 3.476 585 HZ2 TRP 93 HZ2 TRP 93 0.404 -10.411 2.754 586 HZ3 TRP 93 HZ3 TRP 93 -2.347 -7.552 4.325 587 HH2 TRP 93 HH2 TRP 93 -0.059 -8.327 3.970 588 H ASN 94 H ASN 94 -8.273 -12.489 2.620 589 HA ASN 94 HA ASN 94 -9.784 -10.171 2.222 590 HB2 ASN 94 HB2 ASN 94 -10.506 -13.042 2.735 591 HB3 ASN 94 HB3 ASN 94 -11.761 -11.812 2.612 592 HD21 ASN 94 HD21 ASN 94 -8.895 -12.998 0.903 593 HD22 ASN 94 HD22 ASN 94 -9.538 -12.776 -0.685 594 H MET 95 H MET 95 -9.272 -12.137 5.095 595 HA MET 95 HA MET 95 -11.238 -10.818 6.686 596 HB2 MET 95 HB2 MET 95 -8.831 -12.329 7.697 597 HB3 MET 95 HB3 MET 95 -10.359 -12.063 8.526 598 HG2 MET 95 HG2 MET 95 -11.355 -13.364 6.496 599 HG3 MET 95 HG3 MET 95 -9.704 -13.951 6.320 600 HE1 MET 95 HE1 MET 95 -8.458 -15.132 7.681 601 HE2 MET 95 HE2 MET 95 -8.784 -15.710 9.315 602 HE3 MET 95 HE3 MET 95 -9.317 -16.654 7.923 603 H ALA 96 H ALA 96 -7.759 -10.437 6.219 604 HA ALA 96 HA ALA 96 -7.177 -8.661 8.263 605 HB1 ALA 96 HB1 ALA 96 -5.964 -8.371 5.535 606 HB2 ALA 96 HB2 ALA 96 -5.213 -8.142 7.115 607 HB3 ALA 96 HB3 ALA 96 -5.611 -9.766 6.555 608 H PHE 97 H PHE 97 -8.433 -7.980 5.016 609 HA PHE 97 HA PHE 97 -8.365 -5.207 5.089 610 HB2 PHE 97 HB2 PHE 97 -8.899 -6.468 3.059 611 HB3 PHE 97 HB3 PHE 97 -10.421 -6.993 3.772 612 HD1 PHE 97 HD2 PHE 97 -8.636 -3.746 3.293 613 HD2 PHE 97 HD1 PHE 97 -12.265 -5.940 2.933 614 HE1 PHE 97 HE2 PHE 97 -9.748 -1.752 2.377 615 HE2 PHE 97 HE1 PHE 97 -13.382 -3.949 2.014 616 HZ PHE 97 HZ PHE 97 -12.124 -1.850 1.737 617 H ASP 98 H ASP 98 -11.101 -7.326 5.943 618 HA ASP 98 HA ASP 98 -12.832 -5.333 6.833 619 HB2 ASP 98 HB2 ASP 98 -13.219 -7.885 6.449 620 HB3 ASP 98 HB3 ASP 98 -12.772 -8.029 8.147 621 H PHE 99 H PHE 99 -10.343 -7.139 8.576 622 HA PHE 99 HA PHE 99 -10.886 -6.309 11.165 623 HB2 PHE 99 HB2 PHE 99 -9.246 -8.021 10.770 624 HB3 PHE 99 HB3 PHE 99 -8.244 -6.918 9.833 625 HD1 PHE 99 HD1 PHE 99 -6.880 -5.242 10.926 626 HD2 PHE 99 HD2 PHE 99 -9.280 -7.940 13.179 627 HE1 PHE 99 HE1 PHE 99 -5.637 -4.642 12.963 628 HE2 PHE 99 HE2 PHE 99 -8.041 -7.343 15.220 629 HZ PHE 99 HZ PHE 99 -6.218 -5.691 15.113 630 H ILE 100 H ILE 100 -8.822 -4.753 8.728 631 HA ILE 100 HA ILE 100 -8.010 -2.584 10.323 632 HB ILE 100 HB ILE 100 -8.295 -2.712 7.318 633 HG12 ILE 100 HG12 ILE 100 -5.663 -2.874 8.689 634 HG13 ILE 100 HG13 ILE 100 -6.703 -4.291 8.793 635 HG21 ILE 100 HG21 ILE 100 -8.190 -0.414 8.130 636 HG22 ILE 100 HG22 ILE 100 -6.729 -0.795 9.040 637 HG23 ILE 100 HG23 ILE 100 -6.710 -0.852 7.278 638 HD11 ILE 100 HD11 ILE 100 -6.156 -3.017 6.150 639 HD12 ILE 100 HD12 ILE 100 -4.986 -4.117 6.880 640 HD13 ILE 100 HD13 ILE 100 -6.618 -4.679 6.520 641 H LEU 101 H LEU 101 -10.688 -2.911 8.013 642 HA LEU 101 HA LEU 101 -11.640 -0.277 8.220 643 HB2 LEU 101 HB2 LEU 101 -12.904 -2.875 7.427 644 HB3 LEU 101 HB3 LEU 101 -13.854 -1.393 7.508 645 HG LEU 101 HG LEU 101 -11.384 -1.650 5.807 646 HD11 LEU 101 HD11 LEU 101 -14.191 -2.498 5.274 647 HD12 LEU 101 HD12 LEU 101 -12.673 -3.252 4.790 648 HD13 LEU 101 HD13 LEU 101 -13.237 -1.799 3.966 649 HD21 LEU 101 HD21 LEU 101 -12.048 0.340 4.820 650 HD22 LEU 101 HD22 LEU 101 -12.435 0.602 6.521 651 HD23 LEU 101 HD23 LEU 101 -13.713 0.182 5.379 652 H ASP 102 H ASP 102 -12.019 -3.052 10.271 653 HA ASP 102 HA ASP 102 -14.323 -2.281 11.683 654 HB2 ASP 102 HB2 ASP 102 -12.458 -4.385 11.798 655 HB3 ASP 102 HB3 ASP 102 -12.444 -3.641 13.396 656 H ASN 103 H ASN 103 -10.990 -1.290 11.930 657 HA ASN 103 HA ASN 103 -11.541 0.214 14.380 658 HB2 ASN 103 HB2 ASN 103 -8.993 -0.453 12.908 659 HB3 ASN 103 HB3 ASN 103 -9.039 0.711 14.229 660 HD21 ASN 103 HD21 ASN 103 -10.219 -2.561 13.511 661 HD22 ASN 103 HD22 ASN 103 -9.785 -3.235 15.042 662 H VAL 104 H VAL 104 -10.797 0.648 10.986 663 HA VAL 104 HA VAL 104 -10.399 3.484 11.172 664 HB VAL 104 HB VAL 104 -10.885 1.708 8.778 665 HG11 VAL 104 HG11 VAL 104 -10.124 4.622 8.910 666 HG12 VAL 104 HG12 VAL 104 -10.073 3.633 7.450 667 HG13 VAL 104 HG13 VAL 104 -11.613 3.946 8.252 668 HG21 VAL 104 HG21 VAL 104 -8.303 3.066 9.385 669 HG22 VAL 104 HG22 VAL 104 -8.728 1.603 10.273 670 HG23 VAL 104 HG23 VAL 104 -8.609 1.564 8.515 671 H GLN 105 H GLN 105 -12.931 1.531 9.581 672 HA GLN 105 HA GLN 105 -14.693 3.544 8.962 673 HB2 GLN 105 HB2 GLN 105 -15.429 0.771 9.914 674 HB3 GLN 105 HB3 GLN 105 -16.456 1.848 8.978 675 HG2 GLN 105 HG2 GLN 105 -13.791 0.920 7.966 676 HG3 GLN 105 HG3 GLN 105 -15.265 -0.021 7.735 677 HE21 GLN 105 HE21 GLN 105 -13.615 2.957 6.971 678 HE22 GLN 105 HE22 GLN 105 -14.585 3.374 5.604 679 H VAL 106 H VAL 106 -14.060 2.097 12.068 680 HA VAL 106 HA VAL 106 -16.384 3.081 13.389 681 HB VAL 106 HB VAL 106 -13.767 1.962 14.329 682 HG11 VAL 106 HG11 VAL 106 -15.801 3.432 15.969 683 HG12 VAL 106 HG12 VAL 106 -14.809 2.152 16.671 684 HG13 VAL 106 HG13 VAL 106 -14.045 3.585 15.982 685 HG21 VAL 106 HG21 VAL 106 -15.579 0.470 13.556 686 HG22 VAL 106 HG22 VAL 106 -15.166 0.223 15.252 687 HG23 VAL 106 HG23 VAL 106 -16.622 1.121 14.821 688 H VAL 107 H VAL 107 -12.977 4.140 13.452 689 HA VAL 107 HA VAL 107 -13.477 6.479 14.965 690 HB VAL 107 HB VAL 107 -11.247 5.498 14.853 691 HG11 VAL 107 HG11 VAL 107 -9.877 5.807 12.800 692 HG12 VAL 107 HG12 VAL 107 -11.216 4.675 12.597 693 HG13 VAL 107 HG13 VAL 107 -11.339 6.312 11.952 694 HG21 VAL 107 HG21 VAL 107 -11.394 7.841 15.419 695 HG22 VAL 107 HG22 VAL 107 -9.959 7.567 14.432 696 HG23 VAL 107 HG23 VAL 107 -11.399 8.286 13.712 697 H LEU 108 H LEU 108 -13.722 5.741 11.589 698 HA LEU 108 HA LEU 108 -13.621 8.438 10.647 699 HB2 LEU 108 HB2 LEU 108 -13.475 7.423 8.685 700 HB3 LEU 108 HB3 LEU 108 -13.658 5.877 9.511 701 HG LEU 108 HG LEU 108 -16.166 6.202 9.244 702 HD11 LEU 108 HD11 LEU 108 -16.171 7.731 6.915 703 HD12 LEU 108 HD12 LEU 108 -15.209 8.653 8.070 704 HD13 LEU 108 HD13 LEU 108 -16.854 8.170 8.481 705 HD21 LEU 108 HD21 LEU 108 -14.249 5.067 7.607 706 HD22 LEU 108 HD22 LEU 108 -15.238 6.021 6.500 707 HD23 LEU 108 HD23 LEU 108 -15.990 4.797 7.524 708 H GLN 109 H GLN 109 -16.192 6.198 11.553 709 HA GLN 109 HA GLN 109 -18.353 7.799 10.687 710 HB2 GLN 109 HB2 GLN 109 -18.045 5.479 12.543 711 HB3 GLN 109 HB3 GLN 109 -19.555 6.382 12.562 712 HG2 GLN 109 HG2 GLN 109 -19.753 5.987 10.120 713 HG3 GLN 109 HG3 GLN 109 -18.323 4.961 10.214 714 HE21 GLN 109 HE21 GLN 109 -18.637 3.465 12.355 715 HE22 GLN 109 HE22 GLN 109 -20.081 2.521 12.280 716 H GLN 110 H GLN 110 -16.649 7.538 13.772 717 HA GLN 110 HA GLN 110 -18.349 9.227 15.252 718 HB2 GLN 110 HB2 GLN 110 -15.432 8.530 15.598 719 HB3 GLN 110 HB3 GLN 110 -16.343 9.484 16.761 720 HG2 GLN 110 HG2 GLN 110 -17.931 7.563 16.961 721 HG3 GLN 110 HG3 GLN 110 -16.813 6.622 15.974 722 HE21 GLN 110 HE21 GLN 110 -14.907 5.907 16.850 723 HE22 GLN 110 HE22 GLN 110 -14.546 6.010 18.536 724 H THR 111 H THR 111 -16.167 9.903 12.752 725 HA THR 111 HA THR 111 -15.748 12.672 13.595 726 HB THR 111 HB THR 111 -14.650 11.129 11.238 727 HG1 THR 111 HG1 THR 111 -13.553 12.021 13.707 728 HG21 THR 111 HG21 THR 111 -13.203 13.104 10.883 729 HG22 THR 111 HG22 THR 111 -14.128 13.974 12.107 730 HG23 THR 111 HG23 THR 111 -14.909 13.458 10.614 731 H TYR 112 H TYR 112 -16.764 11.024 10.593 732 HA TYR 112 HA TYR 112 -18.359 13.392 9.917 733 HB2 TYR 112 HB2 TYR 112 -17.764 11.084 8.075 734 HB3 TYR 112 HB3 TYR 112 -18.250 12.721 7.650 735 HD1 TYR 112 HD2 TYR 112 -16.633 14.544 7.665 736 HD2 TYR 112 HD1 TYR 112 -15.463 10.570 8.637 737 HE1 TYR 112 HE2 TYR 112 -14.272 15.178 7.393 738 HE2 TYR 112 HE1 TYR 112 -13.099 11.194 8.368 739 HH TYR 112 HH TYR 112 -11.919 13.311 6.840 740 H GLY 113 H GLY 113 -18.566 9.864 10.183 741 HA2 GLY 113 HA2 GLY 113 -20.555 8.929 11.237 742 HA3 GLY 113 HA3 GLY 113 -21.495 10.162 10.409 743 H SER 114 H SER 114 -19.556 9.518 8.041 744 HA SER 114 HA SER 114 -21.308 7.466 6.921 745 HB2 SER 114 HB2 SER 114 -19.241 9.218 5.568 746 HB3 SER 114 HB3 SER 114 -20.360 8.128 4.750 747 HG SER 114 HG SER 114 -20.821 10.600 5.931 748 H THR 115 H THR 115 -19.856 6.245 5.049 749 HA THR 115 HA THR 115 -17.363 5.264 6.160 750 HB THR 115 HB THR 115 -18.063 2.898 6.123 751 HG1 THR 115 HG1 THR 115 -20.010 2.344 5.470 752 HG21 THR 115 HG21 THR 115 -19.934 4.415 7.926 753 HG22 THR 115 HG22 THR 115 -18.190 4.385 8.195 754 HG23 THR 115 HG23 THR 115 -19.114 2.883 8.231 755 H LEU 116 H LEU 116 -16.595 3.331 4.689 756 HA LEU 116 HA LEU 116 -16.729 4.336 1.963 757 HB2 LEU 116 HB2 LEU 116 -14.731 3.194 3.542 758 HB3 LEU 116 HB3 LEU 116 -15.097 1.981 2.317 759 HG LEU 116 HG LEU 116 -14.853 4.185 0.769 760 HD11 LEU 116 HD11 LEU 116 -14.236 5.680 2.528 761 HD12 LEU 116 HD12 LEU 116 -12.799 5.354 1.559 762 HD13 LEU 116 HD13 LEU 116 -13.008 4.560 3.120 763 HD21 LEU 116 HD21 LEU 116 -13.722 1.866 0.738 764 HD22 LEU 116 HD22 LEU 116 -12.409 2.668 1.601 765 HD23 LEU 116 HD23 LEU 116 -12.882 3.230 -0.003 766 H LYS 117 H LYS 117 -17.249 3.057 0.160 767 HA LYS 117 HA LYS 117 -19.222 0.997 0.728 768 HB2 LYS 117 HB2 LYS 117 -19.947 2.596 -0.867 769 HB3 LYS 117 HB3 LYS 117 -18.440 2.494 -1.767 770 HG2 LYS 117 HG2 LYS 117 -20.316 1.388 -2.906 771 HG3 LYS 117 HG3 LYS 117 -18.992 0.281 -2.536 772 HD2 LYS 117 HD2 LYS 117 -20.802 0.310 -0.334 773 HD3 LYS 117 HD3 LYS 117 -21.724 0.061 -1.817 774 HE2 LYS 117 HE2 LYS 117 -20.668 -1.925 -2.299 775 HE3 LYS 117 HE3 LYS 117 -19.215 -1.494 -1.398 776 HZ1 LYS 117 HZ1 LYS 117 -21.299 -3.085 -0.539 777 HZ2 LYS 117 HZ2 LYS 117 -21.454 -1.644 0.332 778 HZ3 LYS 117 HZ3 LYS 117 -20.004 -2.514 0.388 779 H VAL 118 H VAL 118 -18.123 -0.841 1.281 780 HA VAL 118 HA VAL 118 -16.315 -1.948 -0.771 781 HB VAL 118 HB VAL 118 -15.393 -3.348 1.155 782 HG11 VAL 118 HG11 VAL 118 -14.244 -1.051 2.052 783 HG12 VAL 118 HG12 VAL 118 -13.778 -1.898 0.576 784 HG13 VAL 118 HG13 VAL 118 -14.895 -0.535 0.496 785 HG21 VAL 118 HG21 VAL 118 -17.444 -2.238 2.570 786 HG22 VAL 118 HG22 VAL 118 -16.017 -2.993 3.280 787 HG23 VAL 118 HG23 VAL 118 -16.076 -1.242 3.070 788 H THR 119 H THR 119 -17.864 -3.082 -1.909 789 HA THR 119 HA THR 119 -19.934 -4.619 -0.848 790 HB THR 119 HB THR 119 -19.036 -5.932 -3.194 791 HG1 THR 119 HG1 THR 119 -18.019 -4.417 -4.248 792 HG21 THR 119 HG21 THR 119 -21.056 -5.044 -4.150 793 HG22 THR 119 HG22 THR 119 -21.121 -3.764 -2.938 794 HG23 THR 119 HG23 THR 119 -21.374 -5.444 -2.463 795 H LYS 207 H LYS 207 8.402 -7.637 15.927 796 HA LYS 207 HA LYS 207 10.398 -7.303 13.812 797 HB2 LYS 207 HB2 LYS 207 10.252 -9.702 14.961 798 HB3 LYS 207 HB3 LYS 207 8.895 -9.875 13.855 799 HG2 LYS 207 HG2 LYS 207 11.445 -8.861 12.738 800 HG3 LYS 207 HG3 LYS 207 11.365 -10.565 13.193 801 HD2 LYS 207 HD2 LYS 207 9.183 -9.360 11.542 802 HD3 LYS 207 HD3 LYS 207 10.705 -9.826 10.780 803 HE2 LYS 207 HE2 LYS 207 9.095 -11.691 12.509 804 HE3 LYS 207 HE3 LYS 207 8.869 -11.566 10.766 805 HZ1 LYS 207 HZ1 LYS 207 10.406 -13.188 10.757 806 HZ2 LYS 207 HZ2 LYS 207 11.038 -12.775 12.271 807 HZ3 LYS 207 HZ3 LYS 207 11.501 -11.906 10.895 808 H SER 208 H SER 208 9.556 -6.891 11.811 809 HA SER 208 HA SER 208 6.932 -7.458 10.985 810 HB2 SER 208 HB2 SER 208 5.806 -5.877 12.142 811 HB3 SER 208 HB3 SER 208 7.280 -4.997 12.548 812 HG SER 208 HG SER 208 5.480 -4.271 10.829 813 H PHE 209 H PHE 209 6.735 -7.160 8.826 814 HA PHE 209 HA PHE 209 8.969 -6.676 7.253 815 HB2 PHE 209 HB2 PHE 209 7.113 -7.890 6.340 816 HB3 PHE 209 HB3 PHE 209 6.030 -6.522 6.573 817 HD1 PHE 209 HD2 PHE 209 9.079 -7.561 4.719 818 HD2 PHE 209 HD1 PHE 209 5.668 -5.017 4.850 819 HE1 PHE 209 HE2 PHE 209 9.571 -6.788 2.436 820 HE2 PHE 209 HE1 PHE 209 6.155 -4.241 2.567 821 HZ PHE 209 HZ PHE 209 8.109 -5.125 1.357 822 H PHE 210 H PHE 210 6.315 -4.482 8.103 823 HA PHE 210 HA PHE 210 7.180 -2.295 6.558 824 HB2 PHE 210 HB2 PHE 210 5.414 -2.550 8.979 825 HB3 PHE 210 HB3 PHE 210 5.808 -0.970 8.311 826 HD1 PHE 210 HD1 PHE 210 5.652 -1.167 5.519 827 HD2 PHE 210 HD2 PHE 210 3.298 -3.208 8.421 828 HE1 PHE 210 HE1 PHE 210 3.839 -1.411 3.873 829 HE2 PHE 210 HE2 PHE 210 1.483 -3.456 6.778 830 HZ PHE 210 HZ PHE 210 1.753 -2.559 4.501 831 H ASP 211 H ASP 211 8.166 -3.501 9.665 832 HA ASP 211 HA ASP 211 9.477 -1.132 10.555 833 HB2 ASP 211 HB2 ASP 211 8.707 -3.278 11.878 834 HB3 ASP 211 HB3 ASP 211 10.324 -3.850 11.476 835 H LYS 212 H LYS 212 10.605 -4.126 9.014 836 HA LYS 212 HA LYS 212 13.334 -3.312 8.911 837 HB2 LYS 212 HB2 LYS 212 13.666 -5.265 7.497 838 HB3 LYS 212 HB3 LYS 212 12.649 -5.679 8.871 839 HG2 LYS 212 HG2 LYS 212 10.691 -5.695 7.521 840 HG3 LYS 212 HG3 LYS 212 11.564 -5.005 6.149 841 HD2 LYS 212 HD2 LYS 212 12.422 -7.615 7.343 842 HD3 LYS 212 HD3 LYS 212 11.086 -7.552 6.191 843 HE2 LYS 212 HE2 LYS 212 13.871 -6.503 5.702 844 HE3 LYS 212 HE3 LYS 212 13.240 -8.036 5.105 845 HZ1 LYS 212 HZ1 LYS 212 12.952 -5.448 4.004 846 HZ2 LYS 212 HZ2 LYS 212 11.427 -6.097 4.337 847 HZ3 LYS 212 HZ3 LYS 212 12.505 -6.940 3.344 848 H LYS 213 H LYS 213 10.567 -2.740 6.934 849 HA LYS 213 HA LYS 213 12.077 -1.998 4.585 850 HB2 LYS 213 HB2 LYS 213 9.914 -2.939 4.199 851 HB3 LYS 213 HB3 LYS 213 9.153 -1.802 5.304 852 HG2 LYS 213 HG2 LYS 213 8.682 -1.205 3.007 853 HG3 LYS 213 HG3 LYS 213 9.679 0.033 3.774 854 HD2 LYS 213 HD2 LYS 213 11.107 -0.167 2.079 855 HD3 LYS 213 HD3 LYS 213 11.479 -1.793 2.653 856 HE2 LYS 213 HE2 LYS 213 9.822 -2.752 1.229 857 HE3 LYS 213 HE3 LYS 213 9.184 -1.163 0.806 858 HZ1 LYS 213 HZ1 LYS 213 11.916 -2.114 0.134 859 HZ2 LYS 213 HZ2 LYS 213 11.205 -0.660 -0.358 860 HZ3 LYS 213 HZ3 LYS 213 10.603 -2.132 -0.934 861 H ARG 214 H ARG 214 10.225 -0.324 7.107 862 HA ARG 214 HA ARG 214 10.610 2.283 6.103 863 HB2 ARG 214 HB2 ARG 214 9.803 3.059 8.217 864 HB3 ARG 214 HB3 ARG 214 8.905 1.603 7.810 865 HG2 ARG 214 HG2 ARG 214 10.202 0.300 9.350 866 HG3 ARG 214 HG3 ARG 214 11.275 1.666 9.664 867 HD2 ARG 214 HD2 ARG 214 8.386 2.111 10.113 868 HD3 ARG 214 HD3 ARG 214 9.205 1.030 11.241 869 HE ARG 214 HE ARG 214 9.487 3.873 11.065 870 HH11 ARG 214 HH11 ARG 214 11.097 0.917 11.956 871 HH12 ARG 214 HH12 ARG 214 12.172 1.688 13.076 872 HH21 ARG 214 HH21 ARG 214 10.896 4.898 12.538 873 HH22 ARG 214 HH22 ARG 214 12.055 3.952 13.408 874 H SER 215 H SER 215 12.576 0.193 8.087 875 HA SER 215 HA SER 215 14.350 2.197 9.049 876 HB2 SER 215 HB2 SER 215 14.255 0.137 10.256 877 HB3 SER 215 HB3 SER 215 14.604 -0.803 8.805 878 HG SER 215 HG SER 215 16.360 0.981 10.144 879 H GLU 216 H GLU 216 14.097 0.419 6.092 880 HA GLU 216 HA GLU 216 16.713 0.523 5.148 881 HB2 GLU 216 HB2 GLU 216 14.118 0.735 3.611 882 HB3 GLU 216 HB3 GLU 216 15.690 0.456 2.876 883 HG2 GLU 216 HG2 GLU 216 15.713 -1.546 4.621 884 HG3 GLU 216 HG3 GLU 216 13.969 -1.375 4.432 885 H ARG 217 H ARG 217 14.080 2.834 4.469 886 HA ARG 217 HA ARG 217 15.770 4.718 3.195 887 HB2 ARG 217 HB2 ARG 217 13.852 6.243 3.348 888 HB3 ARG 217 HB3 ARG 217 13.369 4.655 2.767 889 HG2 ARG 217 HG2 ARG 217 12.705 4.133 5.153 890 HG3 ARG 217 HG3 ARG 217 12.912 5.854 5.480 891 HD2 ARG 217 HD2 ARG 217 11.320 5.350 3.101 892 HD3 ARG 217 HD3 ARG 217 10.620 4.623 4.548 893 HE ARG 217 HE ARG 217 10.203 6.731 5.380 894 HH11 ARG 217 HH11 ARG 217 12.222 6.946 2.553 895 HH12 ARG 217 HH12 ARG 217 12.057 8.665 2.406 896 HH21 ARG 217 HH21 ARG 217 9.978 8.993 5.198 897 HH22 ARG 217 HH22 ARG 217 10.782 9.829 3.911 898 H ILE 218 H ILE 218 14.563 4.387 6.496 899 HA ILE 218 HA ILE 218 15.490 6.858 7.475 900 HB ILE 218 HB ILE 218 15.064 4.261 8.956 901 HG12 ILE 218 HG12 ILE 218 13.243 6.657 8.927 902 HG13 ILE 218 HG13 ILE 218 13.118 5.401 7.702 903 HG21 ILE 218 HG21 ILE 218 16.459 5.600 10.316 904 HG22 ILE 218 HG22 ILE 218 15.549 7.062 9.937 905 HG23 ILE 218 HG23 ILE 218 14.823 5.806 10.940 906 HD11 ILE 218 HD11 ILE 218 12.975 3.805 9.749 907 HD12 ILE 218 HD12 ILE 218 12.515 5.274 10.613 908 HD13 ILE 218 HD13 ILE 218 11.559 4.723 9.237 909 H SER 219 H SER 219 17.115 3.901 6.750 910 HA SER 219 HA SER 219 19.471 4.630 8.308 911 HB2 SER 219 HB2 SER 219 18.822 2.288 8.352 912 HB3 SER 219 HB3 SER 219 18.879 2.206 6.591 913 HG SER 219 HG SER 219 20.915 2.080 8.426 914 H ASN 220 H ASN 220 21.385 5.300 7.456 915 HA ASN 220 HA ASN 220 21.336 6.514 4.878 916 HB2 ASN 220 HB2 ASN 220 23.737 6.052 6.659 917 HB3 ASN 220 HB3 ASN 220 23.586 7.245 5.371 918 HD21 ASN 220 HD21 ASN 220 23.310 6.690 8.644 919 HD22 ASN 220 HD22 ASN 220 22.442 8.119 9.084 Start of MODEL 12 1 H ALA 23 H ALA 23 4.802 14.648 11.471 2 HA ALA 23 HA ALA 23 3.030 13.292 13.398 3 HB1 ALA 23 HB1 ALA 23 3.779 15.489 14.184 4 HB2 ALA 23 HB2 ALA 23 3.109 16.231 12.730 5 HB3 ALA 23 HB3 ALA 23 2.039 15.454 13.896 6 H ALA 24 H ALA 24 3.348 12.926 10.446 7 HA ALA 24 HA ALA 24 0.581 13.580 9.664 8 HB1 ALA 24 HB1 ALA 24 1.743 13.231 7.274 9 HB2 ALA 24 HB2 ALA 24 1.650 14.795 8.085 10 HB3 ALA 24 HB3 ALA 24 3.126 13.836 8.188 11 HA PRO 25 HA PRO 25 -0.231 9.318 8.998 12 HB2 PRO 25 HB2 PRO 25 -1.780 9.366 6.768 13 HB3 PRO 25 HB3 PRO 25 -2.350 9.925 8.346 14 HG2 PRO 25 HG2 PRO 25 -1.323 11.519 6.029 15 HG3 PRO 25 HG3 PRO 25 -2.714 11.842 7.082 16 HD2 PRO 25 HD2 PRO 25 -0.330 13.089 7.394 17 HD3 PRO 25 HD3 PRO 25 -1.399 12.718 8.761 18 H ASN 26 H ASN 26 1.808 8.468 8.512 19 HA ASN 26 HA ASN 26 2.332 8.101 5.636 20 HB2 ASN 26 HB2 ASN 26 4.546 8.107 7.665 21 HB3 ASN 26 HB3 ASN 26 4.636 8.381 5.928 22 HD21 ASN 26 HD21 ASN 26 2.660 10.259 5.590 23 HD22 ASN 26 HD22 ASN 26 3.113 11.719 6.396 24 H LEU 27 H LEU 27 2.970 6.074 4.966 25 HA LEU 27 HA LEU 27 2.630 3.940 6.955 26 HB2 LEU 27 HB2 LEU 27 1.220 4.167 4.783 27 HB3 LEU 27 HB3 LEU 27 2.648 3.497 3.997 28 HG LEU 27 HG LEU 27 2.465 1.501 5.446 29 HD11 LEU 27 HD11 LEU 27 0.711 3.142 6.910 30 HD12 LEU 27 HD12 LEU 27 1.158 1.467 7.235 31 HD13 LEU 27 HD13 LEU 27 -0.260 1.825 6.249 32 HD21 LEU 27 HD21 LEU 27 -0.191 1.847 4.130 33 HD22 LEU 27 HD22 LEU 27 0.901 0.463 4.116 34 HD23 LEU 27 HD23 LEU 27 1.277 1.892 3.152 35 H ALA 28 H ALA 28 4.481 3.178 7.732 36 HA ALA 28 HA ALA 28 6.637 2.460 7.889 37 HB1 ALA 28 HB1 ALA 28 5.471 1.209 5.659 38 HB2 ALA 28 HB2 ALA 28 7.110 1.655 5.183 39 HB3 ALA 28 HB3 ALA 28 6.849 0.658 6.613 40 H GLY 29 H GLY 29 6.132 5.245 7.047 41 HA2 GLY 29 HA2 GLY 29 7.767 6.944 6.861 42 HA3 GLY 29 HA3 GLY 29 8.837 5.795 6.072 43 H ALA 30 H ALA 30 5.667 5.693 4.880 44 HA ALA 30 HA ALA 30 6.515 7.193 2.497 45 HB1 ALA 30 HB1 ALA 30 4.449 5.024 2.823 46 HB2 ALA 30 HB2 ALA 30 4.726 5.919 1.328 47 HB3 ALA 30 HB3 ALA 30 6.004 4.905 1.998 48 H VAL 31 H VAL 31 5.721 9.176 2.331 49 HA VAL 31 HA VAL 31 3.267 9.894 3.733 50 HB VAL 31 HB VAL 31 5.116 11.693 2.164 51 HG11 VAL 31 HG11 VAL 31 2.976 12.706 2.444 52 HG12 VAL 31 HG12 VAL 31 2.911 12.234 4.143 53 HG13 VAL 31 HG13 VAL 31 4.071 13.451 3.608 54 HG21 VAL 31 HG21 VAL 31 5.284 10.604 4.908 55 HG22 VAL 31 HG22 VAL 31 6.566 11.107 3.808 56 HG23 VAL 31 HG23 VAL 31 5.652 12.317 4.709 57 H GLU 32 H GLU 32 4.601 9.974 0.441 58 HA GLU 32 HA GLU 32 2.253 11.002 -0.771 59 HB2 GLU 32 HB2 GLU 32 4.524 9.418 -1.987 60 HB3 GLU 32 HB3 GLU 32 3.299 10.295 -2.894 61 HG2 GLU 32 HG2 GLU 32 4.930 11.756 -0.879 62 HG3 GLU 32 HG3 GLU 32 5.645 11.348 -2.437 63 H PHE 33 H PHE 33 0.635 9.965 -1.931 64 HA PHE 33 HA PHE 33 -0.318 7.546 -0.902 65 HB2 PHE 33 HB2 PHE 33 -1.931 8.968 -1.854 66 HB3 PHE 33 HB3 PHE 33 -1.018 9.149 -3.349 67 HD1 PHE 33 HD1 PHE 33 -2.969 6.715 -1.349 68 HD2 PHE 33 HD2 PHE 33 -1.435 7.762 -5.178 69 HE1 PHE 33 HE1 PHE 33 -4.298 4.914 -2.370 70 HE2 PHE 33 HE2 PHE 33 -2.762 5.964 -6.205 71 HZ PHE 33 HZ PHE 33 -4.196 4.537 -4.802 72 H SER 34 H SER 34 1.220 8.225 -4.039 73 HA SER 34 HA SER 34 1.149 5.695 -5.135 74 HB2 SER 34 HB2 SER 34 3.530 7.532 -5.406 75 HB3 SER 34 HB3 SER 34 2.903 6.385 -6.591 76 HG SER 34 HG SER 34 1.536 7.841 -7.240 77 H ASP 35 H ASP 35 3.399 7.016 -2.771 78 HA ASP 35 HA ASP 35 5.158 4.769 -2.787 79 HB2 ASP 35 HB2 ASP 35 4.811 7.198 -1.085 80 HB3 ASP 35 HB3 ASP 35 5.758 5.857 -0.447 81 H VAL 36 H VAL 36 2.235 5.602 -1.084 82 HA VAL 36 HA VAL 36 2.487 3.661 0.989 83 HB VAL 36 HB VAL 36 -0.032 4.956 -0.065 84 HG11 VAL 36 HG11 VAL 36 -0.368 2.935 1.325 85 HG12 VAL 36 HG12 VAL 36 0.528 3.718 2.628 86 HG13 VAL 36 HG13 VAL 36 -1.000 4.402 2.072 87 HG21 VAL 36 HG21 VAL 36 0.677 6.863 0.822 88 HG22 VAL 36 HG22 VAL 36 0.805 6.078 2.397 89 HG23 VAL 36 HG23 VAL 36 2.191 6.096 1.306 90 H LYS 37 H LYS 37 0.398 3.778 -1.903 91 HA LYS 37 HA LYS 37 -0.649 1.210 -1.694 92 HB2 LYS 37 HB2 LYS 37 -0.992 1.401 -4.193 93 HB3 LYS 37 HB3 LYS 37 -1.656 2.715 -3.230 94 HG2 LYS 37 HG2 LYS 37 -0.061 4.226 -3.951 95 HG3 LYS 37 HG3 LYS 37 1.070 2.958 -4.430 96 HD2 LYS 37 HD2 LYS 37 -1.434 2.775 -5.878 97 HD3 LYS 37 HD3 LYS 37 -0.667 4.351 -6.091 98 HE2 LYS 37 HE2 LYS 37 1.419 3.226 -6.741 99 HE3 LYS 37 HE3 LYS 37 0.624 1.663 -6.559 100 HZ1 LYS 37 HZ1 LYS 37 0.170 1.902 -8.719 101 HZ2 LYS 37 HZ2 LYS 37 0.462 3.568 -8.716 102 HZ3 LYS 37 HZ3 LYS 37 -1.043 2.971 -8.221 103 H THR 38 H THR 38 2.404 2.313 -3.012 104 HA THR 38 HA THR 38 3.132 -0.038 -4.381 105 HB THR 38 HB THR 38 4.859 2.099 -3.123 106 HG1 THR 38 HG1 THR 38 4.224 1.620 -5.858 107 HG21 THR 38 HG21 THR 38 6.649 1.217 -4.607 108 HG22 THR 38 HG22 THR 38 5.613 -0.162 -4.978 109 HG23 THR 38 HG23 THR 38 6.185 0.094 -3.330 110 H LEU 39 H LEU 39 3.636 1.007 -1.040 111 HA LEU 39 HA LEU 39 5.255 -1.212 -0.303 112 HB2 LEU 39 HB2 LEU 39 3.607 0.658 1.393 113 HB3 LEU 39 HB3 LEU 39 4.796 -0.487 2.010 114 HG LEU 39 HG LEU 39 5.623 1.615 0.047 115 HD11 LEU 39 HD11 LEU 39 4.662 3.064 1.552 116 HD12 LEU 39 HD12 LEU 39 6.282 2.888 2.224 117 HD13 LEU 39 HD13 LEU 39 4.934 1.992 2.926 118 HD21 LEU 39 HD21 LEU 39 6.988 -0.429 1.054 119 HD22 LEU 39 HD22 LEU 39 7.238 0.719 2.370 120 HD23 LEU 39 HD23 LEU 39 7.740 1.134 0.730 121 H LEU 40 H LEU 40 1.807 -0.582 -0.298 122 HA LEU 40 HA LEU 40 1.088 -2.852 1.271 123 HB2 LEU 40 HB2 LEU 40 -0.596 -1.322 -0.704 124 HB3 LEU 40 HB3 LEU 40 -1.180 -2.391 0.570 125 HG LEU 40 HG LEU 40 0.396 0.082 1.212 126 HD11 LEU 40 HD11 LEU 40 -2.263 -0.061 0.074 127 HD12 LEU 40 HD12 LEU 40 -1.244 1.342 0.395 128 HD13 LEU 40 HD13 LEU 40 -2.266 0.683 1.673 129 HD21 LEU 40 HD21 LEU 40 0.216 -1.233 3.108 130 HD22 LEU 40 HD22 LEU 40 -1.393 -1.814 2.679 131 HD23 LEU 40 HD23 LEU 40 -1.178 -0.162 3.258 132 H LYS 41 H LYS 41 1.110 -2.186 -2.218 133 HA LYS 41 HA LYS 41 0.050 -4.562 -3.149 134 HB2 LYS 41 HB2 LYS 41 0.975 -2.370 -4.359 135 HB3 LYS 41 HB3 LYS 41 2.365 -3.415 -4.628 136 HG2 LYS 41 HG2 LYS 41 0.486 -5.091 -5.440 137 HG3 LYS 41 HG3 LYS 41 -0.381 -3.581 -5.732 138 HD2 LYS 41 HD2 LYS 41 0.739 -4.071 -7.748 139 HD3 LYS 41 HD3 LYS 41 1.692 -2.802 -6.974 140 HE2 LYS 41 HE2 LYS 41 3.188 -4.571 -6.065 141 HE3 LYS 41 HE3 LYS 41 2.282 -5.760 -6.999 142 HZ1 LYS 41 HZ1 LYS 41 4.460 -4.563 -7.906 143 HZ2 LYS 41 HZ2 LYS 41 3.302 -3.464 -8.467 144 HZ3 LYS 41 HZ3 LYS 41 3.216 -5.090 -8.924 145 H GLU 42 H GLU 42 3.398 -3.829 -2.257 146 HA GLU 42 HA GLU 42 4.350 -6.446 -2.957 147 HB2 GLU 42 HB2 GLU 42 6.457 -5.711 -1.902 148 HB3 GLU 42 HB3 GLU 42 5.859 -4.548 -3.078 149 HG2 GLU 42 HG2 GLU 42 4.915 -3.220 -1.215 150 HG3 GLU 42 HG3 GLU 42 5.655 -4.349 -0.083 151 H TRP 43 H TRP 43 3.491 -4.772 0.036 152 HA TRP 43 HA TRP 43 4.296 -6.797 1.818 153 HB2 TRP 43 HB2 TRP 43 3.875 -4.600 2.674 154 HB3 TRP 43 HB3 TRP 43 2.221 -4.616 2.067 155 HD1 TRP 43 HD1 TRP 43 4.294 -6.768 4.563 156 HE1 TRP 43 HE1 TRP 43 2.776 -7.320 6.567 157 HE3 TRP 43 HE3 TRP 43 0.007 -4.468 2.992 158 HZ2 TRP 43 HZ2 TRP 43 0.113 -6.844 7.375 159 HZ3 TRP 43 HZ3 TRP 43 -1.981 -4.564 4.438 160 HH2 TRP 43 HH2 TRP 43 -1.927 -5.728 6.583 161 H ILE 44 H ILE 44 1.727 -6.675 -0.393 162 HA ILE 44 HA ILE 44 0.190 -8.705 1.067 163 HB ILE 44 HB ILE 44 -0.546 -7.131 -1.404 164 HG12 ILE 44 HG12 ILE 44 -1.908 -6.939 1.262 165 HG13 ILE 44 HG13 ILE 44 -0.430 -6.030 0.965 166 HG21 ILE 44 HG21 ILE 44 -2.844 -8.080 -0.889 167 HG22 ILE 44 HG22 ILE 44 -1.664 -9.194 -1.576 168 HG23 ILE 44 HG23 ILE 44 -2.017 -9.238 0.151 169 HD11 ILE 44 HD11 ILE 44 -2.960 -5.170 0.428 170 HD12 ILE 44 HD12 ILE 44 -1.484 -4.522 -0.290 171 HD13 ILE 44 HD13 ILE 44 -2.417 -5.748 -1.148 172 H THR 45 H THR 45 2.466 -8.376 -1.413 173 HA THR 45 HA THR 45 1.669 -10.903 -2.678 174 HB THR 45 HB THR 45 3.300 -10.339 -4.442 175 HG1 THR 45 HG1 THR 45 4.716 -8.818 -4.078 176 HG21 THR 45 HG21 THR 45 1.292 -9.585 -5.192 177 HG22 THR 45 HG22 THR 45 2.080 -8.017 -5.016 178 HG23 THR 45 HG23 THR 45 1.001 -8.609 -3.753 179 H THR 46 H THR 46 4.641 -9.274 -1.561 180 HA THR 46 HA THR 46 6.233 -11.604 -1.573 181 HB THR 46 HB THR 46 7.119 -9.260 -1.558 182 HG1 THR 46 HG1 THR 46 8.701 -10.660 -1.110 183 HG21 THR 46 HG21 THR 46 6.630 -7.845 0.092 184 HG22 THR 46 HG22 THR 46 7.283 -8.965 1.289 185 HG23 THR 46 HG23 THR 46 5.592 -9.080 0.804 186 H ILE 47 H ILE 47 3.805 -10.546 0.561 187 HA ILE 47 HA ILE 47 4.636 -12.575 2.527 188 HB ILE 47 HB ILE 47 3.373 -9.894 3.098 189 HG12 ILE 47 HG12 ILE 47 5.685 -10.558 4.672 190 HG13 ILE 47 HG13 ILE 47 6.063 -10.747 2.965 191 HG21 ILE 47 HG21 ILE 47 3.500 -10.632 5.491 192 HG22 ILE 47 HG22 ILE 47 2.293 -11.469 4.516 193 HG23 ILE 47 HG23 ILE 47 3.819 -12.262 4.900 194 HD11 ILE 47 HD11 ILE 47 6.538 -8.563 3.095 195 HD12 ILE 47 HD12 ILE 47 4.792 -8.366 2.935 196 HD13 ILE 47 HD13 ILE 47 5.541 -8.325 4.531 197 H SER 48 H SER 48 3.154 -14.075 2.994 198 HA SER 48 HA SER 48 0.437 -13.691 1.933 199 HB2 SER 48 HB2 SER 48 1.046 -15.629 0.900 200 HB3 SER 48 HB3 SER 48 2.253 -16.025 2.125 201 HG SER 48 HG SER 48 0.537 -17.477 2.253 202 H ASP 49 H ASP 49 2.290 -14.435 4.787 203 HA ASP 49 HA ASP 49 -0.208 -14.655 6.335 204 HB2 ASP 49 HB2 ASP 49 1.119 -16.663 6.545 205 HB3 ASP 49 HB3 ASP 49 2.556 -15.723 6.936 206 HA PRO 50 HA PRO 50 1.592 -10.568 7.479 207 HB2 PRO 50 HB2 PRO 50 -0.816 -9.340 7.731 208 HB3 PRO 50 HB3 PRO 50 0.025 -9.496 6.185 209 HG2 PRO 50 HG2 PRO 50 -2.214 -11.143 7.298 210 HG3 PRO 50 HG3 PRO 50 -1.994 -10.518 5.652 211 HD2 PRO 50 HD2 PRO 50 -1.434 -13.081 6.325 212 HD3 PRO 50 HD3 PRO 50 -0.532 -12.203 5.073 213 H MET 51 H MET 51 2.016 -10.010 9.531 214 HA MET 51 HA MET 51 0.726 -11.445 11.678 215 HB2 MET 51 HB2 MET 51 3.090 -9.639 11.432 216 HB3 MET 51 HB3 MET 51 2.363 -9.856 13.018 217 HG2 MET 51 HG2 MET 51 2.953 -12.071 13.140 218 HG3 MET 51 HG3 MET 51 3.032 -12.255 11.389 219 HE1 MET 51 HE1 MET 51 5.293 -9.083 12.945 220 HE2 MET 51 HE2 MET 51 4.266 -9.988 14.059 221 HE3 MET 51 HE3 MET 51 6.017 -10.190 14.112 222 H GLU 52 H GLU 52 -0.343 -10.493 13.457 223 HA GLU 52 HA GLU 52 -2.267 -8.600 12.878 224 HB2 GLU 52 HB2 GLU 52 -2.240 -10.197 14.827 225 HB3 GLU 52 HB3 GLU 52 -1.133 -9.093 15.632 226 HG2 GLU 52 HG2 GLU 52 -2.989 -8.216 16.507 227 HG3 GLU 52 HG3 GLU 52 -3.136 -7.404 14.950 228 H GLU 53 H GLU 53 0.978 -8.151 14.137 229 HA GLU 53 HA GLU 53 0.703 -5.438 14.887 230 HB2 GLU 53 HB2 GLU 53 2.580 -7.160 15.438 231 HB3 GLU 53 HB3 GLU 53 3.299 -6.601 13.934 232 HG2 GLU 53 HG2 GLU 53 4.316 -5.305 15.570 233 HG3 GLU 53 HG3 GLU 53 3.070 -4.251 14.903 234 H ASP 54 H ASP 54 2.017 -6.957 11.950 235 HA ASP 54 HA ASP 54 2.672 -4.616 10.580 236 HB2 ASP 54 HB2 ASP 54 2.073 -7.424 9.775 237 HB3 ASP 54 HB3 ASP 54 2.122 -6.194 8.515 238 H ILE 55 H ILE 55 -0.340 -6.495 10.552 239 HA ILE 55 HA ILE 55 -1.701 -4.889 8.680 240 HB ILE 55 HB ILE 55 -2.924 -6.518 10.908 241 HG12 ILE 55 HG12 ILE 55 -2.328 -7.371 8.069 242 HG13 ILE 55 HG13 ILE 55 -1.317 -7.782 9.451 243 HG21 ILE 55 HG21 ILE 55 -4.044 -5.568 8.275 244 HG22 ILE 55 HG22 ILE 55 -4.863 -6.652 9.399 245 HG23 ILE 55 HG23 ILE 55 -4.501 -4.994 9.878 246 HD11 ILE 55 HD11 ILE 55 -3.375 -8.852 10.457 247 HD12 ILE 55 HD12 ILE 55 -4.118 -8.674 8.867 248 HD13 ILE 55 HD13 ILE 55 -2.667 -9.656 9.057 249 H LEU 56 H LEU 56 -1.238 -4.611 12.135 250 HA LEU 56 HA LEU 56 -3.263 -2.739 12.686 251 HB2 LEU 56 HB2 LEU 56 -0.873 -3.773 14.018 252 HB3 LEU 56 HB3 LEU 56 -1.273 -2.114 14.458 253 HG LEU 56 HG LEU 56 -3.096 -4.504 14.736 254 HD11 LEU 56 HD11 LEU 56 -1.350 -4.629 16.361 255 HD12 LEU 56 HD12 LEU 56 -2.805 -4.045 17.169 256 HD13 LEU 56 HD13 LEU 56 -1.516 -2.916 16.750 257 HD21 LEU 56 HD21 LEU 56 -4.432 -2.582 14.309 258 HD22 LEU 56 HD22 LEU 56 -3.463 -1.588 15.398 259 HD23 LEU 56 HD23 LEU 56 -4.481 -2.875 16.048 260 H GLN 57 H GLN 57 0.061 -2.365 11.573 261 HA GLN 57 HA GLN 57 0.382 0.368 11.882 262 HB2 GLN 57 HB2 GLN 57 1.531 -1.696 10.092 263 HB3 GLN 57 HB3 GLN 57 1.733 -0.026 9.584 264 HG2 GLN 57 HG2 GLN 57 2.470 -0.948 12.340 265 HG3 GLN 57 HG3 GLN 57 3.584 -1.062 10.979 266 HE21 GLN 57 HE21 GLN 57 4.389 0.827 10.050 267 HE22 GLN 57 HE22 GLN 57 4.319 2.349 10.864 268 H VAL 58 H VAL 58 -1.439 -1.410 9.489 269 HA VAL 58 HA VAL 58 -1.818 0.767 7.687 270 HB VAL 58 HB VAL 58 -3.626 -1.628 7.973 271 HG11 VAL 58 HG11 VAL 58 -3.560 0.606 6.219 272 HG12 VAL 58 HG12 VAL 58 -3.157 -0.840 5.290 273 HG13 VAL 58 HG13 VAL 58 -4.662 -0.770 6.209 274 HG21 VAL 58 HG21 VAL 58 -1.768 -2.846 7.620 275 HG22 VAL 58 HG22 VAL 58 -1.940 -2.290 5.955 276 HG23 VAL 58 HG23 VAL 58 -0.840 -1.457 7.054 277 H VAL 59 H VAL 59 -3.569 -0.478 10.467 278 HA VAL 59 HA VAL 59 -5.946 1.006 10.108 279 HB VAL 59 HB VAL 59 -4.717 -0.051 12.659 280 HG11 VAL 59 HG11 VAL 59 -6.309 1.672 13.192 281 HG12 VAL 59 HG12 VAL 59 -7.494 0.975 12.087 282 HG13 VAL 59 HG13 VAL 59 -7.029 0.102 13.547 283 HG21 VAL 59 HG21 VAL 59 -5.385 -2.065 12.006 284 HG22 VAL 59 HG22 VAL 59 -7.031 -1.473 11.780 285 HG23 VAL 59 HG23 VAL 59 -5.872 -1.386 10.453 286 H ARG 60 H ARG 60 -3.112 1.610 12.186 287 HA ARG 60 HA ARG 60 -3.952 4.074 13.203 288 HB2 ARG 60 HB2 ARG 60 -1.115 3.167 12.683 289 HB3 ARG 60 HB3 ARG 60 -1.606 4.453 13.777 290 HG2 ARG 60 HG2 ARG 60 -2.678 1.695 14.161 291 HG3 ARG 60 HG3 ARG 60 -1.047 2.092 14.703 292 HD2 ARG 60 HD2 ARG 60 -1.842 3.757 16.181 293 HD3 ARG 60 HD3 ARG 60 -3.449 3.734 15.456 294 HE ARG 60 HE ARG 60 -3.980 1.921 16.757 295 HH11 ARG 60 HH11 ARG 60 -0.538 2.437 16.836 296 HH12 ARG 60 HH12 ARG 60 -0.262 1.284 18.099 297 HH21 ARG 60 HH21 ARG 60 -3.631 0.400 18.420 298 HH22 ARG 60 HH22 ARG 60 -2.022 0.125 18.999 299 H TYR 61 H TYR 61 -2.626 3.224 10.122 300 HA TYR 61 HA TYR 61 -1.786 5.863 9.394 301 HB2 TYR 61 HB2 TYR 61 -0.723 4.016 8.297 302 HB3 TYR 61 HB3 TYR 61 -2.269 3.355 7.781 303 HD1 TYR 61 HD2 TYR 61 0.121 6.126 7.257 304 HD2 TYR 61 HD1 TYR 61 -3.307 4.088 5.776 305 HE1 TYR 61 HE2 TYR 61 0.310 7.360 5.137 306 HE2 TYR 61 HE1 TYR 61 -3.127 5.314 3.652 307 HH TYR 61 HH TYR 61 -1.287 6.476 2.348 308 H CYS 62 H CYS 62 -4.543 3.813 8.452 309 HA CYS 62 HA CYS 62 -5.825 5.812 6.912 310 HB2 CYS 62 HB2 CYS 62 -6.795 3.244 8.157 311 HB3 CYS 62 HB3 CYS 62 -7.859 4.291 7.229 312 HG CYS 62 HG CYS 62 -5.081 2.674 6.062 313 H THR 63 H THR 63 -6.300 4.682 10.242 314 HA THR 63 HA THR 63 -8.507 6.197 10.935 315 HB THR 63 HB THR 63 -7.611 6.127 13.283 316 HG1 THR 63 HG1 THR 63 -5.407 6.157 12.952 317 HG21 THR 63 HG21 THR 63 -7.188 3.371 12.632 318 HG22 THR 63 HG22 THR 63 -8.474 4.020 11.614 319 HG23 THR 63 HG23 THR 63 -8.597 4.132 13.370 320 H ASP 64 H ASP 64 -5.201 7.185 10.498 321 HA ASP 64 HA ASP 64 -5.435 9.687 11.862 322 HB2 ASP 64 HB2 ASP 64 -3.409 8.436 10.046 323 HB3 ASP 64 HB3 ASP 64 -3.319 10.164 10.376 324 H LEU 65 H LEU 65 -5.785 8.615 8.524 325 HA LEU 65 HA LEU 65 -5.876 11.058 7.222 326 HB2 LEU 65 HB2 LEU 65 -6.708 8.340 6.686 327 HB3 LEU 65 HB3 LEU 65 -7.816 9.508 5.970 328 HG LEU 65 HG LEU 65 -6.108 10.438 4.618 329 HD11 LEU 65 HD11 LEU 65 -4.336 9.211 6.609 330 HD12 LEU 65 HD12 LEU 65 -4.130 10.678 5.652 331 HD13 LEU 65 HD13 LEU 65 -3.771 9.104 4.942 332 HD21 LEU 65 HD21 LEU 65 -6.583 8.689 3.310 333 HD22 LEU 65 HD22 LEU 65 -6.516 7.548 4.654 334 HD23 LEU 65 HD23 LEU 65 -5.030 8.042 3.840 335 H ILE 66 H ILE 66 -8.297 9.481 9.187 336 HA ILE 66 HA ILE 66 -10.513 11.056 8.415 337 HB ILE 66 HB ILE 66 -9.928 9.440 10.882 338 HG12 ILE 66 HG12 ILE 66 -12.271 8.898 9.173 339 HG13 ILE 66 HG13 ILE 66 -10.711 8.686 8.384 340 HG21 ILE 66 HG21 ILE 66 -12.282 11.212 10.317 341 HG22 ILE 66 HG22 ILE 66 -12.409 9.810 11.378 342 HG23 ILE 66 HG23 ILE 66 -11.294 11.117 11.774 343 HD11 ILE 66 HD11 ILE 66 -10.039 7.146 10.167 344 HD12 ILE 66 HD12 ILE 66 -11.625 7.336 10.913 345 HD13 ILE 66 HD13 ILE 66 -11.484 6.599 9.317 346 H GLU 67 H GLU 67 -8.237 11.334 11.133 347 HA GLU 67 HA GLU 67 -9.407 13.743 12.126 348 HB2 GLU 67 HB2 GLU 67 -6.614 12.754 12.687 349 HB3 GLU 67 HB3 GLU 67 -7.615 13.785 13.698 350 HG2 GLU 67 HG2 GLU 67 -9.190 11.868 13.959 351 HG3 GLU 67 HG3 GLU 67 -8.014 10.863 13.115 352 H GLU 68 H GLU 68 -6.920 12.973 9.816 353 HA GLU 68 HA GLU 68 -5.940 15.702 9.701 354 HB2 GLU 68 HB2 GLU 68 -5.242 13.201 8.165 355 HB3 GLU 68 HB3 GLU 68 -4.537 14.771 7.806 356 HG2 GLU 68 HG2 GLU 68 -4.400 13.669 10.575 357 HG3 GLU 68 HG3 GLU 68 -3.276 13.109 9.339 358 H LYS 69 H LYS 69 -8.493 13.971 8.391 359 HA LYS 69 HA LYS 69 -10.051 14.448 6.803 360 HB2 LYS 69 HB2 LYS 69 -8.703 17.128 6.489 361 HB3 LYS 69 HB3 LYS 69 -10.374 16.717 6.127 362 HG2 LYS 69 HG2 LYS 69 -9.193 16.648 8.894 363 HG3 LYS 69 HG3 LYS 69 -10.051 18.034 8.216 364 HD2 LYS 69 HD2 LYS 69 -11.724 15.856 7.745 365 HD3 LYS 69 HD3 LYS 69 -11.098 15.602 9.376 366 HE2 LYS 69 HE2 LYS 69 -11.909 18.359 8.820 367 HE3 LYS 69 HE3 LYS 69 -13.226 17.192 8.723 368 HZ1 LYS 69 HZ1 LYS 69 -13.282 17.055 10.919 369 HZ2 LYS 69 HZ2 LYS 69 -12.145 18.304 11.008 370 HZ3 LYS 69 HZ3 LYS 69 -11.631 16.693 11.008 371 H ASP 70 H ASP 70 -7.822 13.019 5.993 372 HA ASP 70 HA ASP 70 -7.342 14.045 3.273 373 HB2 ASP 70 HB2 ASP 70 -5.616 12.491 5.162 374 HB3 ASP 70 HB3 ASP 70 -5.386 12.295 3.427 375 H LEU 71 H LEU 71 -9.695 12.621 4.002 376 HA LEU 71 HA LEU 71 -9.623 9.881 3.510 377 HB2 LEU 71 HB2 LEU 71 -11.857 11.693 2.641 378 HB3 LEU 71 HB3 LEU 71 -11.957 10.003 3.130 379 HG LEU 71 HG LEU 71 -11.385 12.356 4.930 380 HD11 LEU 71 HD11 LEU 71 -13.794 11.530 3.941 381 HD12 LEU 71 HD12 LEU 71 -13.557 12.398 5.458 382 HD13 LEU 71 HD13 LEU 71 -13.689 10.639 5.461 383 HD21 LEU 71 HD21 LEU 71 -11.598 10.653 6.741 384 HD22 LEU 71 HD22 LEU 71 -10.157 10.471 5.740 385 HD23 LEU 71 HD23 LEU 71 -11.539 9.402 5.501 386 H GLU 72 H GLU 72 -9.100 12.495 1.380 387 HA GLU 72 HA GLU 72 -10.000 11.615 -1.063 388 HB2 GLU 72 HB2 GLU 72 -8.982 13.772 -0.881 389 HB3 GLU 72 HB3 GLU 72 -7.457 13.074 -0.356 390 HG2 GLU 72 HG2 GLU 72 -7.013 12.199 -2.513 391 HG3 GLU 72 HG3 GLU 72 -8.646 12.565 -3.067 392 H LYS 73 H LYS 73 -6.814 10.910 0.371 393 HA LYS 73 HA LYS 73 -6.198 8.970 -1.662 394 HB2 LYS 73 HB2 LYS 73 -4.133 8.621 -0.435 395 HB3 LYS 73 HB3 LYS 73 -4.446 10.343 -0.593 396 HG2 LYS 73 HG2 LYS 73 -5.604 9.918 1.777 397 HG3 LYS 73 HG3 LYS 73 -4.393 8.634 1.814 398 HD2 LYS 73 HD2 LYS 73 -3.081 10.923 0.847 399 HD3 LYS 73 HD3 LYS 73 -4.063 11.460 2.212 400 HE2 LYS 73 HE2 LYS 73 -2.809 10.344 3.710 401 HE3 LYS 73 HE3 LYS 73 -2.616 8.945 2.653 402 HZ1 LYS 73 HZ1 LYS 73 -0.784 11.008 3.171 403 HZ2 LYS 73 HZ2 LYS 73 -1.189 11.059 1.529 404 HZ3 LYS 73 HZ3 LYS 73 -0.576 9.635 2.205 405 H LEU 74 H LEU 74 -7.746 8.951 1.410 406 HA LEU 74 HA LEU 74 -7.263 6.374 2.319 407 HB2 LEU 74 HB2 LEU 74 -8.493 8.155 3.538 408 HB3 LEU 74 HB3 LEU 74 -9.876 7.867 2.484 409 HG LEU 74 HG LEU 74 -10.003 5.551 3.374 410 HD11 LEU 74 HD11 LEU 74 -8.032 6.484 5.447 411 HD12 LEU 74 HD12 LEU 74 -7.591 5.479 4.068 412 HD13 LEU 74 HD13 LEU 74 -8.739 4.878 5.265 413 HD21 LEU 74 HD21 LEU 74 -10.150 7.750 5.435 414 HD22 LEU 74 HD22 LEU 74 -10.947 6.180 5.539 415 HD23 LEU 74 HD23 LEU 74 -11.413 7.325 4.280 416 H ASP 75 H ASP 75 -10.059 7.444 0.375 417 HA ASP 75 HA ASP 75 -11.135 4.930 -0.116 418 HB2 ASP 75 HB2 ASP 75 -11.399 7.615 -1.272 419 HB3 ASP 75 HB3 ASP 75 -11.742 6.316 -2.410 420 H LEU 76 H LEU 76 -8.410 6.523 -1.571 421 HA LEU 76 HA LEU 76 -8.252 4.800 -3.858 422 HB2 LEU 76 HB2 LEU 76 -6.090 6.524 -2.663 423 HB3 LEU 76 HB3 LEU 76 -6.143 5.869 -4.298 424 HG LEU 76 HG LEU 76 -8.076 7.915 -3.213 425 HD11 LEU 76 HD11 LEU 76 -6.057 8.591 -5.273 426 HD12 LEU 76 HD12 LEU 76 -5.504 8.459 -3.604 427 HD13 LEU 76 HD13 LEU 76 -6.784 9.598 -4.021 428 HD21 LEU 76 HD21 LEU 76 -7.614 6.744 -5.949 429 HD22 LEU 76 HD22 LEU 76 -8.536 8.221 -5.665 430 HD23 LEU 76 HD23 LEU 76 -9.088 6.692 -4.980 431 H VAL 77 H VAL 77 -6.567 5.015 -0.744 432 HA VAL 77 HA VAL 77 -4.837 2.811 -1.231 433 HB VAL 77 HB VAL 77 -5.689 4.045 1.391 434 HG11 VAL 77 HG11 VAL 77 -4.619 2.374 2.385 435 HG12 VAL 77 HG12 VAL 77 -4.168 1.684 0.825 436 HG13 VAL 77 HG13 VAL 77 -3.134 2.894 1.588 437 HG21 VAL 77 HG21 VAL 77 -3.808 5.426 1.265 438 HG22 VAL 77 HG22 VAL 77 -3.073 4.464 -0.017 439 HG23 VAL 77 HG23 VAL 77 -4.478 5.471 -0.365 440 H ILE 78 H ILE 78 -8.033 3.151 0.174 441 HA ILE 78 HA ILE 78 -8.179 0.541 1.291 442 HB ILE 78 HB ILE 78 -10.332 2.505 0.515 443 HG12 ILE 78 HG12 ILE 78 -8.888 3.159 2.400 444 HG13 ILE 78 HG13 ILE 78 -10.534 2.829 2.933 445 HG21 ILE 78 HG21 ILE 78 -10.535 -0.306 1.250 446 HG22 ILE 78 HG22 ILE 78 -11.474 0.757 2.297 447 HG23 ILE 78 HG23 ILE 78 -11.743 0.774 0.554 448 HD11 ILE 78 HD11 ILE 78 -9.790 1.345 4.387 449 HD12 ILE 78 HD12 ILE 78 -8.996 0.434 3.103 450 HD13 ILE 78 HD13 ILE 78 -8.139 1.744 3.915 451 H LYS 79 H LYS 79 -9.617 1.933 -1.662 452 HA LYS 79 HA LYS 79 -10.643 -0.500 -2.642 453 HB2 LYS 79 HB2 LYS 79 -11.010 0.664 -4.713 454 HB3 LYS 79 HB3 LYS 79 -11.356 1.771 -3.391 455 HG2 LYS 79 HG2 LYS 79 -10.076 3.207 -4.517 456 HG3 LYS 79 HG3 LYS 79 -8.721 2.281 -3.868 457 HD2 LYS 79 HD2 LYS 79 -9.658 0.917 -6.164 458 HD3 LYS 79 HD3 LYS 79 -9.516 2.625 -6.586 459 HE2 LYS 79 HE2 LYS 79 -7.213 2.231 -5.206 460 HE3 LYS 79 HE3 LYS 79 -7.434 0.649 -5.951 461 HZ1 LYS 79 HZ1 LYS 79 -6.143 2.408 -7.240 462 HZ2 LYS 79 HZ2 LYS 79 -7.642 3.128 -7.540 463 HZ3 LYS 79 HZ3 LYS 79 -7.340 1.552 -8.075 464 H TYR 80 H TYR 80 -7.479 0.889 -2.718 465 HA TYR 80 HA TYR 80 -6.520 -0.752 -4.884 466 HB2 TYR 80 HB2 TYR 80 -5.525 1.443 -4.501 467 HB3 TYR 80 HB3 TYR 80 -5.035 0.960 -2.881 468 HD1 TYR 80 HD1 TYR 80 -3.263 -0.775 -2.600 469 HD2 TYR 80 HD2 TYR 80 -4.219 0.876 -6.403 470 HE1 TYR 80 HE1 TYR 80 -1.121 -1.596 -3.488 471 HE2 TYR 80 HE2 TYR 80 -2.080 0.058 -7.302 472 HH TYR 80 HH TYR 80 0.122 -0.600 -6.502 473 H MET 81 H MET 81 -6.225 -0.722 -1.353 474 HA MET 81 HA MET 81 -4.560 -3.046 -1.262 475 HB2 MET 81 HB2 MET 81 -4.678 -2.862 1.088 476 HB3 MET 81 HB3 MET 81 -4.704 -1.207 0.494 477 HG2 MET 81 HG2 MET 81 -7.052 -1.033 0.870 478 HG3 MET 81 HG3 MET 81 -7.174 -2.753 1.235 479 HE1 MET 81 HE1 MET 81 -6.441 0.712 3.843 480 HE2 MET 81 HE2 MET 81 -4.895 0.426 3.044 481 HE3 MET 81 HE3 MET 81 -6.359 0.643 2.083 482 H LYS 82 H LYS 82 -7.997 -2.426 -1.141 483 HA LYS 82 HA LYS 82 -8.758 -5.003 -0.191 484 HB2 LYS 82 HB2 LYS 82 -10.961 -4.315 -0.502 485 HB3 LYS 82 HB3 LYS 82 -10.117 -2.799 -0.209 486 HG2 LYS 82 HG2 LYS 82 -11.317 -2.166 -2.015 487 HG3 LYS 82 HG3 LYS 82 -9.930 -2.855 -2.863 488 HD2 LYS 82 HD2 LYS 82 -11.709 -3.847 -3.958 489 HD3 LYS 82 HD3 LYS 82 -11.296 -5.065 -2.750 490 HE2 LYS 82 HE2 LYS 82 -13.185 -4.690 -1.527 491 HE3 LYS 82 HE3 LYS 82 -13.280 -2.992 -1.993 492 HZ1 LYS 82 HZ1 LYS 82 -14.307 -3.507 -3.981 493 HZ2 LYS 82 HZ2 LYS 82 -15.002 -4.631 -2.927 494 HZ3 LYS 82 HZ3 LYS 82 -13.769 -5.112 -3.982 495 H ARG 83 H ARG 83 -8.134 -3.627 -3.344 496 HA ARG 83 HA ARG 83 -9.306 -5.736 -4.856 497 HB2 ARG 83 HB2 ARG 83 -8.682 -4.546 -6.689 498 HB3 ARG 83 HB3 ARG 83 -8.481 -3.267 -5.498 499 HG2 ARG 83 HG2 ARG 83 -6.057 -4.078 -5.321 500 HG3 ARG 83 HG3 ARG 83 -6.384 -4.937 -6.827 501 HD2 ARG 83 HD2 ARG 83 -7.099 -2.053 -6.640 502 HD3 ARG 83 HD3 ARG 83 -5.401 -2.493 -6.828 503 HE ARG 83 HE ARG 83 -7.431 -2.606 -8.827 504 HH11 ARG 83 HH11 ARG 83 -4.492 -4.115 -7.729 505 HH12 ARG 83 HH12 ARG 83 -4.059 -4.711 -9.297 506 HH21 ARG 83 HH21 ARG 83 -6.870 -3.385 -10.896 507 HH22 ARG 83 HH22 ARG 83 -5.412 -4.294 -11.098 508 H LEU 84 H LEU 84 -6.190 -5.218 -3.384 509 HA LEU 84 HA LEU 84 -4.915 -7.381 -4.808 510 HB2 LEU 84 HB2 LEU 84 -3.981 -5.854 -2.384 511 HB3 LEU 84 HB3 LEU 84 -3.001 -6.925 -3.381 512 HG LEU 84 HG LEU 84 -4.283 -4.460 -4.518 513 HD11 LEU 84 HD11 LEU 84 -1.913 -4.685 -2.759 514 HD12 LEU 84 HD12 LEU 84 -3.039 -3.346 -2.985 515 HD13 LEU 84 HD13 LEU 84 -1.774 -3.645 -4.177 516 HD21 LEU 84 HD21 LEU 84 -1.825 -4.972 -5.697 517 HD22 LEU 84 HD22 LEU 84 -3.414 -5.330 -6.373 518 HD23 LEU 84 HD23 LEU 84 -2.542 -6.567 -5.466 519 H MET 85 H MET 85 -5.901 -6.786 -1.436 520 HA MET 85 HA MET 85 -5.236 -9.306 -0.429 521 HB2 MET 85 HB2 MET 85 -7.359 -7.343 0.441 522 HB3 MET 85 HB3 MET 85 -6.927 -8.779 1.359 523 HG2 MET 85 HG2 MET 85 -4.575 -7.901 1.423 524 HG3 MET 85 HG3 MET 85 -5.201 -6.398 0.748 525 HE1 MET 85 HE1 MET 85 -4.137 -5.411 3.962 526 HE2 MET 85 HE2 MET 85 -4.330 -5.081 2.240 527 HE3 MET 85 HE3 MET 85 -5.468 -4.398 3.402 528 H GLN 86 H GLN 86 -7.950 -8.248 -2.315 529 HA GLN 86 HA GLN 86 -9.593 -10.535 -1.735 530 HB2 GLN 86 HB2 GLN 86 -9.767 -8.199 -3.589 531 HB3 GLN 86 HB3 GLN 86 -10.786 -9.600 -3.893 532 HG2 GLN 86 HG2 GLN 86 -11.671 -9.400 -1.592 533 HG3 GLN 86 HG3 GLN 86 -10.724 -7.926 -1.394 534 HE21 GLN 86 HE21 GLN 86 -13.012 -7.207 -0.926 535 HE22 GLN 86 HE22 GLN 86 -13.917 -6.591 -2.263 536 H GLN 87 H GLN 87 -7.649 -9.463 -4.512 537 HA GLN 87 HA GLN 87 -8.126 -11.845 -6.013 538 HB2 GLN 87 HB2 GLN 87 -6.639 -10.950 -7.628 539 HB3 GLN 87 HB3 GLN 87 -7.514 -9.578 -6.961 540 HG2 GLN 87 HG2 GLN 87 -5.578 -9.145 -5.468 541 HG3 GLN 87 HG3 GLN 87 -4.705 -10.428 -6.305 542 HE21 GLN 87 HE21 GLN 87 -6.797 -7.771 -7.382 543 HE22 GLN 87 HE22 GLN 87 -5.663 -7.104 -8.502 544 H SER 88 H SER 88 -6.121 -11.109 -3.399 545 HA SER 88 HA SER 88 -3.783 -12.502 -3.857 546 HB2 SER 88 HB2 SER 88 -5.398 -12.020 -1.368 547 HB3 SER 88 HB3 SER 88 -3.932 -12.998 -1.306 548 HG SER 88 HG SER 88 -2.802 -11.209 -2.180 549 H VAL 89 H VAL 89 -3.091 -14.629 -3.332 550 HA VAL 89 HA VAL 89 -4.917 -16.657 -4.142 551 HB VAL 89 HB VAL 89 -2.611 -16.926 -4.724 552 HG11 VAL 89 HG11 VAL 89 -0.965 -16.281 -3.383 553 HG12 VAL 89 HG12 VAL 89 -2.140 -15.961 -2.106 554 HG13 VAL 89 HG13 VAL 89 -1.385 -17.549 -2.231 555 HG21 VAL 89 HG21 VAL 89 -3.873 -18.977 -4.274 556 HG22 VAL 89 HG22 VAL 89 -2.162 -19.174 -3.894 557 HG23 VAL 89 HG23 VAL 89 -3.332 -18.940 -2.596 558 H GLU 90 H GLU 90 -3.703 -15.533 -1.055 559 HA GLU 90 HA GLU 90 -4.876 -17.758 0.389 560 HB2 GLU 90 HB2 GLU 90 -3.497 -15.248 1.359 561 HB3 GLU 90 HB3 GLU 90 -4.056 -16.546 2.403 562 HG2 GLU 90 HG2 GLU 90 -1.869 -17.122 2.182 563 HG3 GLU 90 HG3 GLU 90 -2.562 -18.023 0.835 564 H SER 91 H SER 91 -6.820 -17.784 1.332 565 HA SER 91 HA SER 91 -8.687 -15.699 0.799 566 HB2 SER 91 HB2 SER 91 -9.334 -18.087 0.908 567 HB3 SER 91 HB3 SER 91 -8.976 -18.090 2.634 568 HG SER 91 HG SER 91 -11.235 -17.413 1.463 569 H VAL 92 H VAL 92 -6.648 -16.523 3.485 570 HA VAL 92 HA VAL 92 -7.944 -15.234 5.583 571 HB VAL 92 HB VAL 92 -5.780 -15.069 6.675 572 HG11 VAL 92 HG11 VAL 92 -5.108 -17.417 6.569 573 HG12 VAL 92 HG12 VAL 92 -6.865 -17.254 6.598 574 HG13 VAL 92 HG13 VAL 92 -6.038 -17.618 5.084 575 HG21 VAL 92 HG21 VAL 92 -4.789 -15.300 3.891 576 HG22 VAL 92 HG22 VAL 92 -4.178 -14.335 5.235 577 HG23 VAL 92 HG23 VAL 92 -3.831 -16.063 5.162 578 H TRP 93 H TRP 93 -6.107 -13.930 2.924 579 HA TRP 93 HA TRP 93 -5.521 -11.390 3.944 580 HB2 TRP 93 HB2 TRP 93 -5.726 -12.607 1.251 581 HB3 TRP 93 HB3 TRP 93 -5.856 -10.852 1.319 582 HD1 TRP 93 HD1 TRP 93 -3.334 -13.341 0.776 583 HE1 TRP 93 HE1 TRP 93 -0.979 -12.488 1.366 584 HE3 TRP 93 HE3 TRP 93 -4.627 -9.222 3.513 585 HZ2 TRP 93 HZ2 TRP 93 0.178 -10.351 2.804 586 HZ3 TRP 93 HZ3 TRP 93 -2.837 -7.827 4.462 587 HH2 TRP 93 HH2 TRP 93 -0.485 -8.381 4.115 588 H ASN 94 H ASN 94 -8.452 -12.701 2.536 589 HA ASN 94 HA ASN 94 -9.833 -10.328 2.030 590 HB2 ASN 94 HB2 ASN 94 -10.778 -13.094 2.770 591 HB3 ASN 94 HB3 ASN 94 -11.902 -11.784 2.421 592 HD21 ASN 94 HD21 ASN 94 -9.250 -13.676 1.096 593 HD22 ASN 94 HD22 ASN 94 -9.705 -13.491 -0.560 594 H MET 95 H MET 95 -9.484 -12.202 5.000 595 HA MET 95 HA MET 95 -11.334 -10.642 6.511 596 HB2 MET 95 HB2 MET 95 -9.084 -12.352 7.574 597 HB3 MET 95 HB3 MET 95 -10.544 -11.864 8.425 598 HG2 MET 95 HG2 MET 95 -11.769 -13.133 6.526 599 HG3 MET 95 HG3 MET 95 -10.203 -13.899 6.270 600 HE1 MET 95 HE1 MET 95 -9.188 -15.321 9.404 601 HE2 MET 95 HE2 MET 95 -9.808 -16.496 8.244 602 HE3 MET 95 HE3 MET 95 -8.949 -15.065 7.675 603 H ALA 96 H ALA 96 -7.855 -10.551 5.984 604 HA ALA 96 HA ALA 96 -7.065 -8.805 7.977 605 HB1 ALA 96 HB1 ALA 96 -5.089 -8.691 6.886 606 HB2 ALA 96 HB2 ALA 96 -5.788 -10.018 5.957 607 HB3 ALA 96 HB3 ALA 96 -5.844 -8.373 5.324 608 H PHE 97 H PHE 97 -8.411 -8.054 4.784 609 HA PHE 97 HA PHE 97 -8.153 -5.269 4.912 610 HB2 PHE 97 HB2 PHE 97 -8.672 -6.394 2.824 611 HB3 PHE 97 HB3 PHE 97 -10.208 -6.958 3.473 612 HD1 PHE 97 HD2 PHE 97 -8.557 -3.617 3.529 613 HD2 PHE 97 HD1 PHE 97 -11.906 -5.941 2.306 614 HE1 PHE 97 HE2 PHE 97 -9.655 -1.583 2.685 615 HE2 PHE 97 HE1 PHE 97 -13.009 -3.912 1.458 616 HZ PHE 97 HZ PHE 97 -11.884 -1.729 1.649 617 H ASP 98 H ASP 98 -10.762 -7.408 5.976 618 HA ASP 98 HA ASP 98 -12.544 -5.346 6.752 619 HB2 ASP 98 HB2 ASP 98 -13.423 -7.544 6.360 620 HB3 ASP 98 HB3 ASP 98 -12.345 -8.249 7.562 621 H PHE 99 H PHE 99 -9.950 -7.047 8.390 622 HA PHE 99 HA PHE 99 -10.503 -6.317 11.026 623 HB2 PHE 99 HB2 PHE 99 -8.824 -7.947 10.700 624 HB3 PHE 99 HB3 PHE 99 -7.929 -6.922 9.583 625 HD1 PHE 99 HD2 PHE 99 -8.703 -7.578 13.103 626 HD2 PHE 99 HD1 PHE 99 -6.433 -5.224 10.379 627 HE1 PHE 99 HE2 PHE 99 -7.293 -6.797 14.960 628 HE2 PHE 99 HE1 PHE 99 -5.017 -4.438 12.233 629 HZ PHE 99 HZ PHE 99 -5.447 -5.224 14.527 630 H ILE 100 H ILE 100 -8.695 -4.608 8.508 631 HA ILE 100 HA ILE 100 -7.912 -2.438 10.176 632 HB ILE 100 HB ILE 100 -8.112 -2.562 7.165 633 HG12 ILE 100 HG12 ILE 100 -5.479 -2.608 8.483 634 HG13 ILE 100 HG13 ILE 100 -6.467 -4.035 8.777 635 HG21 ILE 100 HG21 ILE 100 -6.130 -0.753 7.935 636 HG22 ILE 100 HG22 ILE 100 -7.693 -0.381 7.210 637 HG23 ILE 100 HG23 ILE 100 -7.517 -0.396 8.964 638 HD11 ILE 100 HD11 ILE 100 -4.856 -4.034 6.782 639 HD12 ILE 100 HD12 ILE 100 -6.501 -4.621 6.534 640 HD13 ILE 100 HD13 ILE 100 -6.052 -3.000 6.002 641 H LEU 101 H LEU 101 -10.603 -2.989 7.956 642 HA LEU 101 HA LEU 101 -11.647 -0.358 8.063 643 HB2 LEU 101 HB2 LEU 101 -12.850 -3.015 7.342 644 HB3 LEU 101 HB3 LEU 101 -13.778 -1.517 7.295 645 HG LEU 101 HG LEU 101 -11.228 -1.782 5.743 646 HD11 LEU 101 HD11 LEU 101 -12.098 -3.380 4.473 647 HD12 LEU 101 HD12 LEU 101 -13.333 -2.225 3.973 648 HD13 LEU 101 HD13 LEU 101 -13.638 -3.308 5.331 649 HD21 LEU 101 HD21 LEU 101 -12.055 0.430 5.844 650 HD22 LEU 101 HD22 LEU 101 -13.713 -0.097 5.555 651 HD23 LEU 101 HD23 LEU 101 -12.518 -0.194 4.260 652 H ASP 102 H ASP 102 -12.141 -3.237 10.015 653 HA ASP 102 HA ASP 102 -14.405 -2.417 11.441 654 HB2 ASP 102 HB2 ASP 102 -13.083 -4.700 11.394 655 HB3 ASP 102 HB3 ASP 102 -12.272 -4.013 12.798 656 H ASN 103 H ASN 103 -11.069 -1.499 11.710 657 HA ASN 103 HA ASN 103 -11.564 -0.124 14.247 658 HB2 ASN 103 HB2 ASN 103 -9.030 -0.709 12.711 659 HB3 ASN 103 HB3 ASN 103 -9.070 0.317 14.142 660 HD21 ASN 103 HD21 ASN 103 -9.921 -2.910 12.986 661 HD22 ASN 103 HD22 ASN 103 -9.630 -3.716 14.486 662 H VAL 104 H VAL 104 -10.657 0.488 10.896 663 HA VAL 104 HA VAL 104 -10.301 3.303 11.237 664 HB VAL 104 HB VAL 104 -10.728 1.665 8.736 665 HG11 VAL 104 HG11 VAL 104 -9.824 3.665 7.561 666 HG12 VAL 104 HG12 VAL 104 -11.415 3.917 8.283 667 HG13 VAL 104 HG13 VAL 104 -9.975 4.564 9.070 668 HG21 VAL 104 HG21 VAL 104 -8.163 2.951 9.585 669 HG22 VAL 104 HG22 VAL 104 -8.631 1.381 10.235 670 HG23 VAL 104 HG23 VAL 104 -8.421 1.588 8.496 671 H GLN 105 H GLN 105 -12.802 1.433 9.507 672 HA GLN 105 HA GLN 105 -14.539 3.470 8.910 673 HB2 GLN 105 HB2 GLN 105 -15.326 0.685 9.782 674 HB3 GLN 105 HB3 GLN 105 -16.311 1.792 8.835 675 HG2 GLN 105 HG2 GLN 105 -13.628 0.845 7.889 676 HG3 GLN 105 HG3 GLN 105 -15.107 -0.068 7.593 677 HE21 GLN 105 HE21 GLN 105 -13.441 2.952 6.991 678 HE22 GLN 105 HE22 GLN 105 -14.341 3.390 5.582 679 H VAL 106 H VAL 106 -13.960 1.963 11.992 680 HA VAL 106 HA VAL 106 -16.307 2.898 13.299 681 HB VAL 106 HB VAL 106 -13.688 1.800 14.251 682 HG11 VAL 106 HG11 VAL 106 -14.810 1.947 16.584 683 HG12 VAL 106 HG12 VAL 106 -13.962 3.356 15.945 684 HG13 VAL 106 HG13 VAL 106 -15.722 3.278 15.872 685 HG21 VAL 106 HG21 VAL 106 -15.516 0.320 13.437 686 HG22 VAL 106 HG22 VAL 106 -15.053 0.023 15.112 687 HG23 VAL 106 HG23 VAL 106 -16.528 0.919 14.752 688 H VAL 107 H VAL 107 -12.914 3.985 13.508 689 HA VAL 107 HA VAL 107 -13.474 6.299 15.018 690 HB VAL 107 HB VAL 107 -11.234 5.417 14.982 691 HG11 VAL 107 HG11 VAL 107 -9.905 5.890 12.776 692 HG12 VAL 107 HG12 VAL 107 -10.859 4.415 12.947 693 HG13 VAL 107 HG13 VAL 107 -11.501 5.781 12.035 694 HG21 VAL 107 HG21 VAL 107 -11.451 7.808 15.367 695 HG22 VAL 107 HG22 VAL 107 -9.957 7.458 14.497 696 HG23 VAL 107 HG23 VAL 107 -11.348 8.113 13.632 697 H LEU 108 H LEU 108 -13.658 5.617 11.629 698 HA LEU 108 HA LEU 108 -13.578 8.330 10.733 699 HB2 LEU 108 HB2 LEU 108 -13.378 7.344 8.761 700 HB3 LEU 108 HB3 LEU 108 -13.578 5.783 9.555 701 HG LEU 108 HG LEU 108 -16.077 6.108 9.237 702 HD11 LEU 108 HD11 LEU 108 -15.084 8.577 8.094 703 HD12 LEU 108 HD12 LEU 108 -16.726 8.118 8.543 704 HD13 LEU 108 HD13 LEU 108 -16.090 7.676 6.958 705 HD21 LEU 108 HD21 LEU 108 -14.115 5.031 7.604 706 HD22 LEU 108 HD22 LEU 108 -15.110 5.993 6.510 707 HD23 LEU 108 HD23 LEU 108 -15.851 4.734 7.500 708 H GLN 109 H GLN 109 -16.132 6.044 11.561 709 HA GLN 109 HA GLN 109 -18.301 7.634 10.689 710 HB2 GLN 109 HB2 GLN 109 -17.994 5.285 12.510 711 HB3 GLN 109 HB3 GLN 109 -19.515 6.168 12.516 712 HG2 GLN 109 HG2 GLN 109 -19.860 5.722 10.194 713 HG3 GLN 109 HG3 GLN 109 -18.251 5.020 10.042 714 HE21 GLN 109 HE21 GLN 109 -17.861 3.160 11.613 715 HE22 GLN 109 HE22 GLN 109 -19.137 2.002 11.746 716 H GLN 110 H GLN 110 -16.640 7.337 13.795 717 HA GLN 110 HA GLN 110 -18.382 8.972 15.284 718 HB2 GLN 110 HB2 GLN 110 -15.448 8.361 15.663 719 HB3 GLN 110 HB3 GLN 110 -16.436 9.214 16.842 720 HG2 GLN 110 HG2 GLN 110 -17.961 7.124 16.697 721 HG3 GLN 110 HG3 GLN 110 -16.533 6.350 16.015 722 HE21 GLN 110 HE21 GLN 110 -15.523 5.204 17.487 723 HE22 GLN 110 HE22 GLN 110 -15.276 5.649 19.138 724 H THR 111 H THR 111 -16.171 9.729 12.829 725 HA THR 111 HA THR 111 -15.822 12.490 13.724 726 HB THR 111 HB THR 111 -14.647 11.011 11.364 727 HG1 THR 111 HG1 THR 111 -13.433 12.025 13.737 728 HG21 THR 111 HG21 THR 111 -14.946 13.361 10.800 729 HG22 THR 111 HG22 THR 111 -13.236 13.010 11.058 730 HG23 THR 111 HG23 THR 111 -14.165 13.840 12.305 731 H TYR 112 H TYR 112 -16.764 10.857 10.691 732 HA TYR 112 HA TYR 112 -18.387 13.210 10.016 733 HB2 TYR 112 HB2 TYR 112 -17.701 10.947 8.147 734 HB3 TYR 112 HB3 TYR 112 -18.217 12.581 7.740 735 HD1 TYR 112 HD2 TYR 112 -16.642 14.453 7.881 736 HD2 TYR 112 HD1 TYR 112 -15.403 10.463 8.686 737 HE1 TYR 112 HE2 TYR 112 -14.292 15.146 7.668 738 HE2 TYR 112 HE1 TYR 112 -13.049 11.146 8.477 739 HH TYR 112 HH TYR 112 -11.787 13.051 7.256 740 H GLY 113 H GLY 113 -18.520 9.672 10.210 741 HA2 GLY 113 HA2 GLY 113 -20.501 8.661 11.197 742 HA3 GLY 113 HA3 GLY 113 -21.457 9.901 10.400 743 H SER 114 H SER 114 -19.476 9.371 8.036 744 HA SER 114 HA SER 114 -21.171 7.316 6.835 745 HB2 SER 114 HB2 SER 114 -20.242 8.079 4.693 746 HB3 SER 114 HB3 SER 114 -20.888 9.438 5.614 747 HG SER 114 HG SER 114 -18.323 8.926 4.815 748 H THR 115 H THR 115 -19.657 6.219 4.921 749 HA THR 115 HA THR 115 -17.158 5.254 6.035 750 HB THR 115 HB THR 115 -17.789 2.877 5.876 751 HG1 THR 115 HG1 THR 115 -19.537 3.011 4.446 752 HG21 THR 115 HG21 THR 115 -18.025 4.280 8.007 753 HG22 THR 115 HG22 THR 115 -18.874 2.735 7.956 754 HG23 THR 115 HG23 THR 115 -19.760 4.236 7.694 755 H LEU 116 H LEU 116 -16.444 3.286 4.473 756 HA LEU 116 HA LEU 116 -16.472 4.468 1.806 757 HB2 LEU 116 HB2 LEU 116 -14.564 3.066 3.388 758 HB3 LEU 116 HB3 LEU 116 -14.847 2.145 1.911 759 HG LEU 116 HG LEU 116 -14.486 4.581 0.847 760 HD11 LEU 116 HD11 LEU 116 -13.833 5.028 3.505 761 HD12 LEU 116 HD12 LEU 116 -13.429 6.056 2.131 762 HD13 LEU 116 HD13 LEU 116 -12.278 4.844 2.694 763 HD21 LEU 116 HD21 LEU 116 -13.099 2.180 0.979 764 HD22 LEU 116 HD22 LEU 116 -11.906 3.403 1.418 765 HD23 LEU 116 HD23 LEU 116 -12.775 3.529 -0.111 766 H LYS 117 H LYS 117 -16.791 3.164 -0.089 767 HA LYS 117 HA LYS 117 -18.774 1.047 0.361 768 HB2 LYS 117 HB2 LYS 117 -19.659 2.765 -1.015 769 HB3 LYS 117 HB3 LYS 117 -18.196 2.844 -1.989 770 HG2 LYS 117 HG2 LYS 117 -20.065 1.762 -3.160 771 HG3 LYS 117 HG3 LYS 117 -18.676 0.692 -2.964 772 HD2 LYS 117 HD2 LYS 117 -20.385 0.404 -0.699 773 HD3 LYS 117 HD3 LYS 117 -21.356 0.256 -2.165 774 HE2 LYS 117 HE2 LYS 117 -20.243 -1.620 -2.876 775 HE3 LYS 117 HE3 LYS 117 -18.760 -1.194 -2.022 776 HZ1 LYS 117 HZ1 LYS 117 -20.739 -2.953 -1.199 777 HZ2 LYS 117 HZ2 LYS 117 -20.842 -1.617 -0.166 778 HZ3 LYS 117 HZ3 LYS 117 -19.379 -2.451 -0.325 779 H VAL 118 H VAL 118 -17.532 -0.763 0.672 780 HA VAL 118 HA VAL 118 -15.789 -1.545 -1.574 781 HB VAL 118 HB VAL 118 -14.692 -3.082 0.148 782 HG11 VAL 118 HG11 VAL 118 -14.275 -0.332 -0.487 783 HG12 VAL 118 HG12 VAL 118 -13.806 -0.613 1.191 784 HG13 VAL 118 HG13 VAL 118 -13.084 -1.574 -0.101 785 HG21 VAL 118 HG21 VAL 118 -15.368 -1.216 2.299 786 HG22 VAL 118 HG22 VAL 118 -16.715 -2.226 1.772 787 HG23 VAL 118 HG23 VAL 118 -15.218 -2.974 2.326 788 H THR 119 H THR 119 -17.363 -2.629 -2.740 789 HA THR 119 HA THR 119 -19.287 -4.377 -1.771 790 HB THR 119 HB THR 119 -18.105 -5.204 -4.334 791 HG1 THR 119 HG1 THR 119 -18.325 -3.303 -5.359 792 HG21 THR 119 HG21 THR 119 -20.851 -4.133 -3.699 793 HG22 THR 119 HG22 THR 119 -20.378 -5.812 -3.440 794 HG23 THR 119 HG23 THR 119 -20.373 -5.135 -5.069 795 H LYS 207 H LYS 207 9.541 -6.020 15.453 796 HA LYS 207 HA LYS 207 9.762 -8.449 13.863 797 HB2 LYS 207 HB2 LYS 207 8.240 -7.638 16.302 798 HB3 LYS 207 HB3 LYS 207 7.634 -8.979 15.338 799 HG2 LYS 207 HG2 LYS 207 10.493 -8.960 16.178 800 HG3 LYS 207 HG3 LYS 207 9.244 -9.408 17.341 801 HD2 LYS 207 HD2 LYS 207 9.696 -11.467 16.459 802 HD3 LYS 207 HD3 LYS 207 8.438 -10.940 15.338 803 HE2 LYS 207 HE2 LYS 207 9.947 -10.521 13.639 804 HE3 LYS 207 HE3 LYS 207 11.300 -10.315 14.751 805 HZ1 LYS 207 HZ1 LYS 207 9.970 -12.930 14.369 806 HZ2 LYS 207 HZ2 LYS 207 11.485 -12.615 15.053 807 HZ3 LYS 207 HZ3 LYS 207 11.253 -12.426 13.388 808 H SER 208 H SER 208 9.260 -7.059 11.912 809 HA SER 208 HA SER 208 6.693 -7.627 10.969 810 HB2 SER 208 HB2 SER 208 5.517 -5.968 11.966 811 HB3 SER 208 HB3 SER 208 6.968 -5.049 12.361 812 HG SER 208 HG SER 208 5.363 -4.229 10.687 813 H PHE 209 H PHE 209 6.313 -6.797 8.796 814 HA PHE 209 HA PHE 209 8.759 -6.646 7.311 815 HB2 PHE 209 HB2 PHE 209 6.957 -7.894 6.344 816 HB3 PHE 209 HB3 PHE 209 5.857 -6.527 6.487 817 HD1 PHE 209 HD2 PHE 209 8.842 -7.781 4.710 818 HD2 PHE 209 HD1 PHE 209 5.720 -4.888 4.803 819 HE1 PHE 209 HE2 PHE 209 9.436 -7.071 2.430 820 HE2 PHE 209 HE1 PHE 209 6.309 -4.175 2.523 821 HZ PHE 209 HZ PHE 209 8.168 -5.267 1.334 822 H PHE 210 H PHE 210 6.168 -4.408 8.147 823 HA PHE 210 HA PHE 210 7.021 -2.274 6.501 824 HB2 PHE 210 HB2 PHE 210 5.269 -2.450 8.937 825 HB3 PHE 210 HB3 PHE 210 5.674 -0.891 8.228 826 HD1 PHE 210 HD1 PHE 210 5.468 -1.090 5.465 827 HD2 PHE 210 HD2 PHE 210 3.173 -3.167 8.386 828 HE1 PHE 210 HE1 PHE 210 3.644 -1.358 3.836 829 HE2 PHE 210 HE2 PHE 210 1.345 -3.439 6.761 830 HZ PHE 210 HZ PHE 210 1.579 -2.533 4.484 831 H ASP 211 H ASP 211 8.076 -3.450 9.579 832 HA ASP 211 HA ASP 211 9.383 -1.065 10.442 833 HB2 ASP 211 HB2 ASP 211 9.461 -3.941 11.295 834 HB3 ASP 211 HB3 ASP 211 10.633 -2.794 11.938 835 H LYS 212 H LYS 212 10.465 -4.032 8.833 836 HA LYS 212 HA LYS 212 13.202 -3.247 8.704 837 HB2 LYS 212 HB2 LYS 212 13.470 -5.157 7.200 838 HB3 LYS 212 HB3 LYS 212 12.527 -5.601 8.616 839 HG2 LYS 212 HG2 LYS 212 10.505 -5.605 7.377 840 HG3 LYS 212 HG3 LYS 212 11.283 -4.848 5.985 841 HD2 LYS 212 HD2 LYS 212 10.956 -7.226 5.592 842 HD3 LYS 212 HD3 LYS 212 12.677 -6.847 5.689 843 HE2 LYS 212 HE2 LYS 212 12.211 -8.879 6.916 844 HE3 LYS 212 HE3 LYS 212 12.685 -7.600 8.033 845 HZ1 LYS 212 HZ1 LYS 212 10.365 -7.246 8.572 846 HZ2 LYS 212 HZ2 LYS 212 10.787 -8.859 8.853 847 HZ3 LYS 212 HZ3 LYS 212 9.892 -8.446 7.478 848 H LYS 213 H LYS 213 10.407 -2.625 6.769 849 HA LYS 213 HA LYS 213 11.866 -1.847 4.411 850 HB2 LYS 213 HB2 LYS 213 9.669 -2.695 4.056 851 HB3 LYS 213 HB3 LYS 213 8.976 -1.590 5.235 852 HG2 LYS 213 HG2 LYS 213 8.432 -0.867 3.001 853 HG3 LYS 213 HG3 LYS 213 9.517 0.298 3.762 854 HD2 LYS 213 HD2 LYS 213 10.351 0.029 1.582 855 HD3 LYS 213 HD3 LYS 213 11.409 -0.955 2.596 856 HE2 LYS 213 HE2 LYS 213 9.967 -2.927 2.008 857 HE3 LYS 213 HE3 LYS 213 9.152 -1.893 0.835 858 HZ1 LYS 213 HZ1 LYS 213 10.944 -3.250 -0.136 859 HZ2 LYS 213 HZ2 LYS 213 12.068 -2.447 0.840 860 HZ3 LYS 213 HZ3 LYS 213 11.205 -1.590 -0.336 861 H ARG 214 H ARG 214 10.019 -0.123 6.921 862 HA ARG 214 HA ARG 214 10.430 2.469 6.022 863 HB2 ARG 214 HB2 ARG 214 9.930 3.193 8.279 864 HB3 ARG 214 HB3 ARG 214 8.890 1.840 7.854 865 HG2 ARG 214 HG2 ARG 214 10.091 0.351 9.223 866 HG3 ARG 214 HG3 ARG 214 11.434 1.481 9.406 867 HD2 ARG 214 HD2 ARG 214 9.668 3.033 10.483 868 HD3 ARG 214 HD3 ARG 214 8.708 1.564 10.647 869 HE ARG 214 HE ARG 214 11.268 1.074 11.671 870 HH11 ARG 214 HH11 ARG 214 8.435 2.969 12.385 871 HH12 ARG 214 HH12 ARG 214 8.710 2.974 14.096 872 HH21 ARG 214 HH21 ARG 214 11.639 1.073 13.922 873 HH22 ARG 214 HH22 ARG 214 10.534 1.896 14.968 874 H SER 215 H SER 215 12.613 0.291 7.606 875 HA SER 215 HA SER 215 14.467 2.075 8.681 876 HB2 SER 215 HB2 SER 215 14.787 -0.704 7.546 877 HB3 SER 215 HB3 SER 215 16.125 0.173 8.289 878 HG SER 215 HG SER 215 14.017 -1.103 9.456 879 H GLU 216 H GLU 216 13.846 1.171 5.393 880 HA GLU 216 HA GLU 216 16.304 1.889 4.233 881 HB2 GLU 216 HB2 GLU 216 13.496 1.698 3.190 882 HB3 GLU 216 HB3 GLU 216 14.787 2.311 2.167 883 HG2 GLU 216 HG2 GLU 216 16.001 0.114 2.902 884 HG3 GLU 216 HG3 GLU 216 14.358 -0.429 3.240 885 H ARG 217 H ARG 217 13.436 3.772 5.036 886 HA ARG 217 HA ARG 217 14.404 6.175 3.799 887 HB2 ARG 217 HB2 ARG 217 12.109 5.591 5.666 888 HB3 ARG 217 HB3 ARG 217 12.485 7.217 5.112 889 HG2 ARG 217 HG2 ARG 217 10.990 6.701 3.512 890 HG3 ARG 217 HG3 ARG 217 12.399 5.957 2.750 891 HD2 ARG 217 HD2 ARG 217 11.683 3.866 4.140 892 HD3 ARG 217 HD3 ARG 217 10.118 4.676 4.194 893 HE ARG 217 HE ARG 217 11.289 3.348 1.952 894 HH11 ARG 217 HH11 ARG 217 9.157 5.933 2.896 895 HH12 ARG 217 HH12 ARG 217 8.263 5.913 1.412 896 HH21 ARG 217 HH21 ARG 217 10.120 3.313 -0.006 897 HH22 ARG 217 HH22 ARG 217 8.812 4.422 -0.238 898 H ILE 218 H ILE 218 14.633 4.695 6.935 899 HA ILE 218 HA ILE 218 15.438 7.062 8.332 900 HB ILE 218 HB ILE 218 15.802 4.163 9.103 901 HG12 ILE 218 HG12 ILE 218 13.714 6.082 10.127 902 HG13 ILE 218 HG13 ILE 218 13.428 5.050 8.730 903 HG21 ILE 218 HG21 ILE 218 17.278 5.256 10.488 904 HG22 ILE 218 HG22 ILE 218 16.324 6.737 10.514 905 HG23 ILE 218 HG23 ILE 218 15.798 5.333 11.441 906 HD11 ILE 218 HD11 ILE 218 13.079 4.430 11.440 907 HD12 ILE 218 HD12 ILE 218 12.899 3.361 10.049 908 HD13 ILE 218 HD13 ILE 218 14.451 3.475 10.880 909 H SER 219 H SER 219 17.210 4.119 7.360 910 HA SER 219 HA SER 219 19.671 5.742 7.316 911 HB2 SER 219 HB2 SER 219 20.870 3.565 7.754 912 HB3 SER 219 HB3 SER 219 19.862 4.131 9.085 913 HG SER 219 HG SER 219 18.985 2.230 8.952 914 H ASN 220 H ASN 220 20.146 6.197 5.268 915 HA ASN 220 HA ASN 220 19.685 4.149 3.213 916 HB2 ASN 220 HB2 ASN 220 19.904 6.029 1.594 917 HB3 ASN 220 HB3 ASN 220 18.577 6.247 2.732 918 HD21 ASN 220 HD21 ASN 220 18.670 8.487 2.213 919 HD22 ASN 220 HD22 ASN 220 19.856 9.504 2.951 Start of MODEL 13 1 H ALA 23 H ALA 23 4.806 14.291 12.426 2 HA ALA 23 HA ALA 23 3.022 13.143 13.263 3 HB1 ALA 23 HB1 ALA 23 1.775 14.351 14.719 4 HB2 ALA 23 HB2 ALA 23 2.979 15.585 14.339 5 HB3 ALA 23 HB3 ALA 23 1.409 15.607 13.536 6 H ALA 24 H ALA 24 3.085 13.532 10.381 7 HA ALA 24 HA ALA 24 0.247 13.745 9.687 8 HB1 ALA 24 HB1 ALA 24 1.555 13.328 7.325 9 HB2 ALA 24 HB2 ALA 24 1.165 14.907 8.009 10 HB3 ALA 24 HB3 ALA 24 2.761 14.202 8.269 11 HA PRO 25 HA PRO 25 -0.381 9.440 9.110 12 HB2 PRO 25 HB2 PRO 25 -1.906 9.368 6.866 13 HB3 PRO 25 HB3 PRO 25 -2.514 9.941 8.424 14 HG2 PRO 25 HG2 PRO 25 -1.531 11.520 6.080 15 HG3 PRO 25 HG3 PRO 25 -2.945 11.809 7.109 16 HD2 PRO 25 HD2 PRO 25 -0.619 13.163 7.413 17 HD3 PRO 25 HD3 PRO 25 -1.687 12.780 8.779 18 H ASN 26 H ASN 26 1.648 8.591 8.662 19 HA ASN 26 HA ASN 26 2.250 8.227 5.801 20 HB2 ASN 26 HB2 ASN 26 4.431 8.268 7.861 21 HB3 ASN 26 HB3 ASN 26 4.530 8.582 6.130 22 HD21 ASN 26 HD21 ASN 26 2.567 10.432 5.768 23 HD22 ASN 26 HD22 ASN 26 2.957 11.879 6.629 24 H LEU 27 H LEU 27 2.967 6.213 5.160 25 HA LEU 27 HA LEU 27 2.636 4.083 7.161 26 HB2 LEU 27 HB2 LEU 27 1.184 4.214 5.055 27 HB3 LEU 27 HB3 LEU 27 2.630 3.709 4.182 28 HG LEU 27 HG LEU 27 2.678 1.643 5.553 29 HD11 LEU 27 HD11 LEU 27 0.047 1.492 6.465 30 HD12 LEU 27 HD12 LEU 27 0.638 3.063 7.005 31 HD13 LEU 27 HD13 LEU 27 1.513 1.595 7.441 32 HD21 LEU 27 HD21 LEU 27 0.995 0.519 4.328 33 HD22 LEU 27 HD22 LEU 27 1.546 1.848 3.306 34 HD23 LEU 27 HD23 LEU 27 0.021 1.983 4.183 35 H ALA 28 H ALA 28 4.470 3.284 7.924 36 HA ALA 28 HA ALA 28 6.623 2.559 8.085 37 HB1 ALA 28 HB1 ALA 28 7.172 0.966 6.592 38 HB2 ALA 28 HB2 ALA 28 5.537 1.249 5.992 39 HB3 ALA 28 HB3 ALA 28 6.912 2.024 5.205 40 H GLY 29 H GLY 29 6.081 5.389 7.381 41 HA2 GLY 29 HA2 GLY 29 7.656 7.143 7.335 42 HA3 GLY 29 HA3 GLY 29 8.815 6.052 6.589 43 H ALA 30 H ALA 30 5.742 5.896 5.171 44 HA ALA 30 HA ALA 30 6.713 7.484 2.895 45 HB1 ALA 30 HB1 ALA 30 4.678 5.266 3.034 46 HB2 ALA 30 HB2 ALA 30 5.011 6.214 1.585 47 HB3 ALA 30 HB3 ALA 30 6.277 5.211 2.292 48 H VAL 31 H VAL 31 5.851 9.422 2.605 49 HA VAL 31 HA VAL 31 3.336 10.099 3.925 50 HB VAL 31 HB VAL 31 5.206 11.932 2.422 51 HG11 VAL 31 HG11 VAL 31 3.778 13.251 4.468 52 HG12 VAL 31 HG12 VAL 31 3.625 13.461 2.722 53 HG13 VAL 31 HG13 VAL 31 2.613 12.286 3.562 54 HG21 VAL 31 HG21 VAL 31 5.323 10.819 5.148 55 HG22 VAL 31 HG22 VAL 31 6.613 11.437 4.118 56 HG23 VAL 31 HG23 VAL 31 5.589 12.557 5.017 57 H GLU 32 H GLU 32 4.784 10.057 0.695 58 HA GLU 32 HA GLU 32 2.506 11.101 -0.643 59 HB2 GLU 32 HB2 GLU 32 4.756 9.411 -1.749 60 HB3 GLU 32 HB3 GLU 32 3.617 10.359 -2.696 61 HG2 GLU 32 HG2 GLU 32 5.352 11.652 -0.630 62 HG3 GLU 32 HG3 GLU 32 5.959 11.314 -2.250 63 H PHE 33 H PHE 33 0.906 10.057 -1.815 64 HA PHE 33 HA PHE 33 -0.099 7.668 -0.748 65 HB2 PHE 33 HB2 PHE 33 -1.672 9.118 -1.740 66 HB3 PHE 33 HB3 PHE 33 -0.750 9.233 -3.235 67 HD1 PHE 33 HD1 PHE 33 -2.819 6.954 -1.185 68 HD2 PHE 33 HD2 PHE 33 -1.139 7.755 -5.012 69 HE1 PHE 33 HE1 PHE 33 -4.186 5.155 -2.158 70 HE2 PHE 33 HE2 PHE 33 -2.504 5.958 -5.991 71 HZ PHE 33 HZ PHE 33 -4.029 4.654 -4.564 72 H SER 34 H SER 34 1.476 8.288 -3.878 73 HA SER 34 HA SER 34 1.387 5.745 -4.942 74 HB2 SER 34 HB2 SER 34 3.807 7.525 -5.225 75 HB3 SER 34 HB3 SER 34 3.130 6.405 -6.407 76 HG SER 34 HG SER 34 2.675 8.897 -6.383 77 H ASP 35 H ASP 35 3.624 7.073 -2.571 78 HA ASP 35 HA ASP 35 5.365 4.812 -2.544 79 HB2 ASP 35 HB2 ASP 35 5.014 7.255 -0.861 80 HB3 ASP 35 HB3 ASP 35 5.954 5.914 -0.212 81 H VAL 36 H VAL 36 2.426 5.681 -0.889 82 HA VAL 36 HA VAL 36 2.642 3.753 1.204 83 HB VAL 36 HB VAL 36 0.190 5.139 0.110 84 HG11 VAL 36 HG11 VAL 36 -1.010 3.850 1.459 85 HG12 VAL 36 HG12 VAL 36 0.448 3.003 1.977 86 HG13 VAL 36 HG13 VAL 36 -0.087 4.447 2.838 87 HG21 VAL 36 HG21 VAL 36 0.685 6.928 1.365 88 HG22 VAL 36 HG22 VAL 36 1.235 5.943 2.720 89 HG23 VAL 36 HG23 VAL 36 2.327 6.284 1.378 90 H LYS 37 H LYS 37 0.577 3.874 -1.705 91 HA LYS 37 HA LYS 37 -0.498 1.319 -1.488 92 HB2 LYS 37 HB2 LYS 37 -0.784 1.504 -4.011 93 HB3 LYS 37 HB3 LYS 37 -1.500 2.787 -3.043 94 HG2 LYS 37 HG2 LYS 37 0.034 4.353 -3.736 95 HG3 LYS 37 HG3 LYS 37 1.251 3.139 -4.140 96 HD2 LYS 37 HD2 LYS 37 -1.218 2.916 -5.698 97 HD3 LYS 37 HD3 LYS 37 -0.350 4.434 -5.942 98 HE2 LYS 37 HE2 LYS 37 1.691 3.179 -6.448 99 HE3 LYS 37 HE3 LYS 37 0.819 1.664 -6.208 100 HZ1 LYS 37 HZ1 LYS 37 0.259 3.699 -8.298 101 HZ2 LYS 37 HZ2 LYS 37 -0.651 2.296 -8.046 102 HZ3 LYS 37 HZ3 LYS 37 0.963 2.180 -8.543 103 H THR 38 H THR 38 2.559 2.389 -2.845 104 HA THR 38 HA THR 38 3.274 0.014 -4.171 105 HB THR 38 HB THR 38 5.014 2.159 -2.944 106 HG1 THR 38 HG1 THR 38 4.539 1.675 -5.695 107 HG21 THR 38 HG21 THR 38 6.797 1.241 -4.424 108 HG22 THR 38 HG22 THR 38 5.754 -0.144 -4.751 109 HG23 THR 38 HG23 THR 38 6.338 0.154 -3.114 110 H LEU 39 H LEU 39 3.727 1.077 -0.836 111 HA LEU 39 HA LEU 39 5.370 -1.111 -0.060 112 HB2 LEU 39 HB2 LEU 39 3.663 0.752 1.582 113 HB3 LEU 39 HB3 LEU 39 4.828 -0.391 2.246 114 HG LEU 39 HG LEU 39 5.805 1.614 0.279 115 HD11 LEU 39 HD11 LEU 39 4.263 2.506 2.358 116 HD12 LEU 39 HD12 LEU 39 5.529 3.429 1.550 117 HD13 LEU 39 HD13 LEU 39 5.890 2.555 3.039 118 HD21 LEU 39 HD21 LEU 39 7.112 -0.284 1.471 119 HD22 LEU 39 HD22 LEU 39 7.080 0.801 2.860 120 HD23 LEU 39 HD23 LEU 39 7.833 1.321 1.352 121 H LEU 40 H LEU 40 1.905 -0.520 -0.062 122 HA LEU 40 HA LEU 40 1.219 -2.828 1.464 123 HB2 LEU 40 HB2 LEU 40 -0.507 -1.310 -0.484 124 HB3 LEU 40 HB3 LEU 40 -1.053 -2.371 0.813 125 HG LEU 40 HG LEU 40 0.519 0.107 1.424 126 HD11 LEU 40 HD11 LEU 40 -1.802 0.245 -0.009 127 HD12 LEU 40 HD12 LEU 40 -1.190 1.502 1.068 128 HD13 LEU 40 HD13 LEU 40 -2.384 0.343 1.654 129 HD21 LEU 40 HD21 LEU 40 -0.910 -0.061 3.498 130 HD22 LEU 40 HD22 LEU 40 0.278 -1.346 3.274 131 HD23 LEU 40 HD23 LEU 40 -1.423 -1.643 2.912 132 H LYS 41 H LYS 41 1.251 -2.096 -2.009 133 HA LYS 41 HA LYS 41 0.201 -4.454 -2.995 134 HB2 LYS 41 HB2 LYS 41 1.117 -2.246 -4.162 135 HB3 LYS 41 HB3 LYS 41 2.531 -3.260 -4.420 136 HG2 LYS 41 HG2 LYS 41 0.759 -4.966 -5.323 137 HG3 LYS 41 HG3 LYS 41 -0.216 -3.511 -5.537 138 HD2 LYS 41 HD2 LYS 41 0.868 -3.690 -7.577 139 HD3 LYS 41 HD3 LYS 41 1.904 -2.565 -6.697 140 HE2 LYS 41 HE2 LYS 41 3.534 -3.966 -7.387 141 HE3 LYS 41 HE3 LYS 41 3.035 -4.892 -5.972 142 HZ1 LYS 41 HZ1 LYS 41 2.644 -5.466 -8.798 143 HZ2 LYS 41 HZ2 LYS 41 1.354 -5.855 -7.776 144 HZ3 LYS 41 HZ3 LYS 41 2.883 -6.524 -7.499 145 H GLU 42 H GLU 42 3.543 -3.738 -2.067 146 HA GLU 42 HA GLU 42 4.501 -6.342 -2.806 147 HB2 GLU 42 HB2 GLU 42 6.597 -5.628 -1.718 148 HB3 GLU 42 HB3 GLU 42 6.012 -4.445 -2.879 149 HG2 GLU 42 HG2 GLU 42 5.048 -3.149 -1.003 150 HG3 GLU 42 HG3 GLU 42 5.780 -4.296 0.116 151 H TRP 43 H TRP 43 3.629 -4.724 0.215 152 HA TRP 43 HA TRP 43 4.416 -6.784 1.962 153 HB2 TRP 43 HB2 TRP 43 3.994 -4.612 2.869 154 HB3 TRP 43 HB3 TRP 43 2.352 -4.596 2.230 155 HD1 TRP 43 HD1 TRP 43 4.354 -6.827 4.715 156 HE1 TRP 43 HE1 TRP 43 2.792 -7.408 6.677 157 HE3 TRP 43 HE3 TRP 43 0.122 -4.445 3.117 158 HZ2 TRP 43 HZ2 TRP 43 0.119 -6.922 7.445 159 HZ3 TRP 43 HZ3 TRP 43 -1.895 -4.551 4.524 160 HH2 TRP 43 HH2 TRP 43 -1.894 -5.766 6.642 161 H ILE 44 H ILE 44 1.856 -6.611 -0.259 162 HA ILE 44 HA ILE 44 0.308 -8.668 1.148 163 HB ILE 44 HB ILE 44 -0.402 -7.044 -1.298 164 HG12 ILE 44 HG12 ILE 44 -1.791 -6.916 1.359 165 HG13 ILE 44 HG13 ILE 44 -0.317 -5.993 1.093 166 HG21 ILE 44 HG21 ILE 44 -2.702 -8.007 -0.847 167 HG22 ILE 44 HG22 ILE 44 -1.508 -9.112 -1.524 168 HG23 ILE 44 HG23 ILE 44 -1.898 -9.181 0.194 169 HD11 ILE 44 HD11 ILE 44 -2.814 -5.094 0.585 170 HD12 ILE 44 HD12 ILE 44 -1.353 -4.485 -0.193 171 HD13 ILE 44 HD13 ILE 44 -2.342 -5.700 -1.003 172 H THR 45 H THR 45 2.601 -8.296 -1.312 173 HA THR 45 HA THR 45 1.814 -10.803 -2.624 174 HB THR 45 HB THR 45 3.459 -10.208 -4.366 175 HG1 THR 45 HG1 THR 45 4.943 -8.842 -3.706 176 HG21 THR 45 HG21 THR 45 1.550 -9.384 -5.217 177 HG22 THR 45 HG22 THR 45 2.210 -7.807 -4.783 178 HG23 THR 45 HG23 THR 45 1.091 -8.625 -3.693 179 H THR 46 H THR 46 4.775 -9.193 -1.450 180 HA THR 46 HA THR 46 6.373 -11.516 -1.495 181 HB THR 46 HB THR 46 7.252 -9.171 -1.413 182 HG1 THR 46 HG1 THR 46 8.893 -9.817 0.302 183 HG21 THR 46 HG21 THR 46 6.740 -7.797 0.264 184 HG22 THR 46 HG22 THR 46 7.376 -8.944 1.443 185 HG23 THR 46 HG23 THR 46 5.692 -9.049 0.930 186 H ILE 47 H ILE 47 3.927 -10.501 0.647 187 HA ILE 47 HA ILE 47 4.738 -12.580 2.569 188 HB ILE 47 HB ILE 47 3.466 -9.914 3.186 189 HG12 ILE 47 HG12 ILE 47 5.751 -10.614 4.783 190 HG13 ILE 47 HG13 ILE 47 6.158 -10.775 3.079 191 HG21 ILE 47 HG21 ILE 47 3.913 -12.304 4.965 192 HG22 ILE 47 HG22 ILE 47 3.516 -10.690 5.552 193 HG23 ILE 47 HG23 ILE 47 2.371 -11.563 4.535 194 HD11 ILE 47 HD11 ILE 47 6.641 -8.596 3.264 195 HD12 ILE 47 HD12 ILE 47 4.901 -8.392 3.060 196 HD13 ILE 47 HD13 ILE 47 5.606 -8.378 4.676 197 H SER 48 H SER 48 3.241 -14.074 3.041 198 HA SER 48 HA SER 48 0.549 -13.693 1.920 199 HB2 SER 48 HB2 SER 48 0.450 -16.242 2.126 200 HB3 SER 48 HB3 SER 48 1.544 -15.590 0.905 201 HG SER 48 HG SER 48 3.170 -16.410 1.952 202 H ASP 49 H ASP 49 2.339 -14.545 4.803 203 HA ASP 49 HA ASP 49 -0.191 -14.706 6.303 204 HB2 ASP 49 HB2 ASP 49 1.407 -15.735 8.090 205 HB3 ASP 49 HB3 ASP 49 0.884 -16.722 6.727 206 HA PRO 50 HA PRO 50 1.652 -10.665 7.529 207 HB2 PRO 50 HB2 PRO 50 -0.740 -9.403 7.761 208 HB3 PRO 50 HB3 PRO 50 0.122 -9.553 6.225 209 HG2 PRO 50 HG2 PRO 50 -2.158 -11.179 7.284 210 HG3 PRO 50 HG3 PRO 50 -1.905 -10.538 5.651 211 HD2 PRO 50 HD2 PRO 50 -1.393 -13.117 6.299 212 HD3 PRO 50 HD3 PRO 50 -0.460 -12.237 5.072 213 H MET 51 H MET 51 1.877 -9.886 9.578 214 HA MET 51 HA MET 51 0.573 -11.401 11.699 215 HB2 MET 51 HB2 MET 51 2.869 -9.440 11.732 216 HB3 MET 51 HB3 MET 51 2.220 -10.211 13.173 217 HG2 MET 51 HG2 MET 51 2.771 -12.412 12.192 218 HG3 MET 51 HG3 MET 51 3.515 -11.581 10.829 219 HE1 MET 51 HE1 MET 51 4.837 -9.028 12.534 220 HE2 MET 51 HE2 MET 51 6.473 -9.686 12.558 221 HE3 MET 51 HE3 MET 51 5.479 -9.849 11.111 222 H GLU 52 H GLU 52 -0.356 -10.338 13.555 223 HA GLU 52 HA GLU 52 -2.300 -8.470 12.961 224 HB2 GLU 52 HB2 GLU 52 -1.895 -9.992 15.075 225 HB3 GLU 52 HB3 GLU 52 -1.152 -8.535 15.720 226 HG2 GLU 52 HG2 GLU 52 -3.180 -7.926 16.369 227 HG3 GLU 52 HG3 GLU 52 -3.543 -7.640 14.669 228 H GLU 53 H GLU 53 0.977 -7.954 14.148 229 HA GLU 53 HA GLU 53 0.715 -5.183 14.659 230 HB2 GLU 53 HB2 GLU 53 3.169 -6.825 14.013 231 HB3 GLU 53 HB3 GLU 53 3.198 -5.169 14.603 232 HG2 GLU 53 HG2 GLU 53 2.161 -7.588 16.061 233 HG3 GLU 53 HG3 GLU 53 3.627 -6.676 16.419 234 H ASP 54 H ASP 54 1.904 -6.998 11.851 235 HA ASP 54 HA ASP 54 2.695 -4.836 10.278 236 HB2 ASP 54 HB2 ASP 54 1.584 -7.527 9.459 237 HB3 ASP 54 HB3 ASP 54 2.320 -6.382 8.342 238 H ILE 55 H ILE 55 -0.459 -6.452 10.487 239 HA ILE 55 HA ILE 55 -1.702 -4.763 8.553 240 HB ILE 55 HB ILE 55 -3.097 -6.375 10.686 241 HG12 ILE 55 HG12 ILE 55 -2.204 -7.273 7.938 242 HG13 ILE 55 HG13 ILE 55 -1.463 -7.769 9.456 243 HG21 ILE 55 HG21 ILE 55 -4.003 -5.602 7.919 244 HG22 ILE 55 HG22 ILE 55 -4.955 -6.398 9.171 245 HG23 ILE 55 HG23 ILE 55 -4.435 -4.728 9.389 246 HD11 ILE 55 HD11 ILE 55 -2.918 -9.504 8.676 247 HD12 ILE 55 HD12 ILE 55 -3.622 -8.776 10.120 248 HD13 ILE 55 HD13 ILE 55 -4.260 -8.370 8.526 249 H LEU 56 H LEU 56 -1.554 -4.797 12.084 250 HA LEU 56 HA LEU 56 -3.428 -2.835 12.656 251 HB2 LEU 56 HB2 LEU 56 -1.039 -3.931 13.991 252 HB3 LEU 56 HB3 LEU 56 -1.571 -2.346 14.550 253 HG LEU 56 HG LEU 56 -3.517 -4.615 14.392 254 HD11 LEU 56 HD11 LEU 56 -2.610 -4.435 17.037 255 HD12 LEU 56 HD12 LEU 56 -1.166 -4.562 16.033 256 HD13 LEU 56 HD13 LEU 56 -2.427 -5.791 15.922 257 HD21 LEU 56 HD21 LEU 56 -3.536 -2.678 16.599 258 HD22 LEU 56 HD22 LEU 56 -4.859 -3.276 15.596 259 HD23 LEU 56 HD23 LEU 56 -3.810 -1.989 14.998 260 H GLN 57 H GLN 57 -0.056 -2.506 11.674 261 HA GLN 57 HA GLN 57 0.327 0.199 12.128 262 HB2 GLN 57 HB2 GLN 57 1.498 -1.823 10.318 263 HB3 GLN 57 HB3 GLN 57 1.732 -0.147 9.839 264 HG2 GLN 57 HG2 GLN 57 2.380 -1.107 12.603 265 HG3 GLN 57 HG3 GLN 57 3.531 -1.233 11.274 266 HE21 GLN 57 HE21 GLN 57 4.406 0.641 10.389 267 HE22 GLN 57 HE22 GLN 57 4.335 2.160 11.206 268 H VAL 58 H VAL 58 -1.475 -1.406 9.608 269 HA VAL 58 HA VAL 58 -1.722 0.870 7.899 270 HB VAL 58 HB VAL 58 -3.606 -1.481 7.984 271 HG11 VAL 58 HG11 VAL 58 -3.220 0.805 6.251 272 HG12 VAL 58 HG12 VAL 58 -3.100 -0.717 5.365 273 HG13 VAL 58 HG13 VAL 58 -4.547 -0.356 6.308 274 HG21 VAL 58 HG21 VAL 58 -0.775 -1.347 7.162 275 HG22 VAL 58 HG22 VAL 58 -1.737 -2.721 7.706 276 HG23 VAL 58 HG23 VAL 58 -1.872 -2.155 6.042 277 H VAL 59 H VAL 59 -3.601 -0.474 10.546 278 HA VAL 59 HA VAL 59 -5.953 1.021 10.195 279 HB VAL 59 HB VAL 59 -4.740 -0.036 12.752 280 HG11 VAL 59 HG11 VAL 59 -7.086 0.088 13.598 281 HG12 VAL 59 HG12 VAL 59 -6.335 1.659 13.312 282 HG13 VAL 59 HG13 VAL 59 -7.502 1.013 12.156 283 HG21 VAL 59 HG21 VAL 59 -5.465 -2.053 12.160 284 HG22 VAL 59 HG22 VAL 59 -7.064 -1.427 11.760 285 HG23 VAL 59 HG23 VAL 59 -5.779 -1.402 10.552 286 H ARG 60 H ARG 60 -3.123 1.652 12.265 287 HA ARG 60 HA ARG 60 -3.990 4.093 13.311 288 HB2 ARG 60 HB2 ARG 60 -1.155 3.199 12.757 289 HB3 ARG 60 HB3 ARG 60 -1.623 4.514 13.827 290 HG2 ARG 60 HG2 ARG 60 -2.708 1.778 14.303 291 HG3 ARG 60 HG3 ARG 60 -1.059 2.168 14.796 292 HD2 ARG 60 HD2 ARG 60 -3.331 3.963 15.548 293 HD3 ARG 60 HD3 ARG 60 -3.012 2.498 16.474 294 HE ARG 60 HE ARG 60 -0.622 3.944 16.195 295 HH11 ARG 60 HH11 ARG 60 -3.701 4.139 17.807 296 HH12 ARG 60 HH12 ARG 60 -3.095 5.075 19.133 297 HH21 ARG 60 HH21 ARG 60 0.189 5.175 17.935 298 HH22 ARG 60 HH22 ARG 60 -0.882 5.664 19.205 299 H TYR 61 H TYR 61 -2.649 3.292 10.216 300 HA TYR 61 HA TYR 61 -1.888 5.959 9.502 301 HB2 TYR 61 HB2 TYR 61 -0.764 4.163 8.394 302 HB3 TYR 61 HB3 TYR 61 -2.285 3.440 7.884 303 HD1 TYR 61 HD2 TYR 61 0.071 6.208 7.297 304 HD2 TYR 61 HD1 TYR 61 -3.440 4.227 5.935 305 HE1 TYR 61 HE2 TYR 61 0.202 7.446 5.176 306 HE2 TYR 61 HE1 TYR 61 -3.318 5.458 3.810 307 HH TYR 61 HH TYR 61 -2.296 7.701 3.038 308 H CYS 62 H CYS 62 -4.563 3.826 8.500 309 HA CYS 62 HA CYS 62 -5.907 5.786 6.978 310 HB2 CYS 62 HB2 CYS 62 -6.773 3.178 8.208 311 HB3 CYS 62 HB3 CYS 62 -7.905 4.199 7.332 312 HG CYS 62 HG CYS 62 -5.119 2.676 6.066 313 H THR 63 H THR 63 -6.290 4.693 10.324 314 HA THR 63 HA THR 63 -8.563 6.156 10.996 315 HB THR 63 HB THR 63 -7.702 6.062 13.353 316 HG1 THR 63 HG1 THR 63 -5.485 6.132 13.006 317 HG21 THR 63 HG21 THR 63 -7.236 3.320 12.679 318 HG22 THR 63 HG22 THR 63 -8.509 3.963 11.643 319 HG23 THR 63 HG23 THR 63 -8.667 4.056 13.397 320 H ASP 64 H ASP 64 -5.256 7.167 10.614 321 HA ASP 64 HA ASP 64 -5.525 9.655 11.998 322 HB2 ASP 64 HB2 ASP 64 -3.462 8.448 10.186 323 HB3 ASP 64 HB3 ASP 64 -3.384 10.163 10.580 324 H LEU 65 H LEU 65 -5.865 8.595 8.661 325 HA LEU 65 HA LEU 65 -5.914 11.034 7.351 326 HB2 LEU 65 HB2 LEU 65 -6.833 8.329 6.833 327 HB3 LEU 65 HB3 LEU 65 -7.871 9.540 6.083 328 HG LEU 65 HG LEU 65 -6.095 10.375 4.759 329 HD11 LEU 65 HD11 LEU 65 -3.784 9.437 4.974 330 HD12 LEU 65 HD12 LEU 65 -4.295 8.691 6.486 331 HD13 LEU 65 HD13 LEU 65 -4.303 10.447 6.324 332 HD21 LEU 65 HD21 LEU 65 -5.176 7.701 4.311 333 HD22 LEU 65 HD22 LEU 65 -6.275 8.680 3.338 334 HD23 LEU 65 HD23 LEU 65 -6.907 7.686 4.652 335 H ILE 66 H ILE 66 -8.387 9.483 9.286 336 HA ILE 66 HA ILE 66 -10.566 11.102 8.520 337 HB ILE 66 HB ILE 66 -10.018 9.525 11.027 338 HG12 ILE 66 HG12 ILE 66 -12.311 8.897 9.293 339 HG13 ILE 66 HG13 ILE 66 -10.744 8.715 8.516 340 HG21 ILE 66 HG21 ILE 66 -12.116 11.510 10.490 341 HG22 ILE 66 HG22 ILE 66 -12.690 9.959 11.101 342 HG23 ILE 66 HG23 ILE 66 -11.506 10.886 12.022 343 HD11 ILE 66 HD11 ILE 66 -10.043 7.235 10.352 344 HD12 ILE 66 HD12 ILE 66 -11.659 7.371 11.045 345 HD13 ILE 66 HD13 ILE 66 -11.437 6.620 9.466 346 H GLU 67 H GLU 67 -8.241 11.380 11.190 347 HA GLU 67 HA GLU 67 -9.384 13.793 12.207 348 HB2 GLU 67 HB2 GLU 67 -6.595 12.750 12.701 349 HB3 GLU 67 HB3 GLU 67 -7.519 13.850 13.714 350 HG2 GLU 67 HG2 GLU 67 -8.173 10.959 13.193 351 HG3 GLU 67 HG3 GLU 67 -7.450 11.614 14.662 352 H GLU 68 H GLU 68 -6.813 13.004 9.957 353 HA GLU 68 HA GLU 68 -5.887 15.734 9.775 354 HB2 GLU 68 HB2 GLU 68 -5.190 13.215 8.271 355 HB3 GLU 68 HB3 GLU 68 -4.503 14.781 7.865 356 HG2 GLU 68 HG2 GLU 68 -4.279 14.147 10.694 357 HG3 GLU 68 HG3 GLU 68 -3.473 12.973 9.654 358 H LYS 69 H LYS 69 -8.464 14.018 8.519 359 HA LYS 69 HA LYS 69 -10.033 14.483 6.940 360 HB2 LYS 69 HB2 LYS 69 -8.666 17.140 6.536 361 HB3 LYS 69 HB3 LYS 69 -10.354 16.739 6.247 362 HG2 LYS 69 HG2 LYS 69 -9.027 16.811 8.950 363 HG3 LYS 69 HG3 LYS 69 -10.034 18.090 8.270 364 HD2 LYS 69 HD2 LYS 69 -11.803 16.206 8.009 365 HD3 LYS 69 HD3 LYS 69 -10.817 15.354 9.199 366 HE2 LYS 69 HE2 LYS 69 -11.053 17.230 10.744 367 HE3 LYS 69 HE3 LYS 69 -12.016 18.101 9.550 368 HZ1 LYS 69 HZ1 LYS 69 -13.560 16.113 9.641 369 HZ2 LYS 69 HZ2 LYS 69 -13.554 17.129 10.993 370 HZ3 LYS 69 HZ3 LYS 69 -12.733 15.651 11.043 371 H ASP 70 H ASP 70 -7.794 13.033 6.141 372 HA ASP 70 HA ASP 70 -7.339 14.002 3.396 373 HB2 ASP 70 HB2 ASP 70 -5.627 12.428 5.286 374 HB3 ASP 70 HB3 ASP 70 -5.408 12.235 3.549 375 H LEU 71 H LEU 71 -9.706 12.614 4.193 376 HA LEU 71 HA LEU 71 -9.712 9.878 3.757 377 HB2 LEU 71 HB2 LEU 71 -11.859 11.766 2.819 378 HB3 LEU 71 HB3 LEU 71 -12.042 10.072 3.267 379 HG LEU 71 HG LEU 71 -11.416 12.353 5.139 380 HD11 LEU 71 HD11 LEU 71 -13.840 10.704 5.441 381 HD12 LEU 71 HD12 LEU 71 -13.815 11.806 4.065 382 HD13 LEU 71 HD13 LEU 71 -13.598 12.432 5.699 383 HD21 LEU 71 HD21 LEU 71 -10.993 9.528 5.389 384 HD22 LEU 71 HD22 LEU 71 -12.221 10.058 6.539 385 HD23 LEU 71 HD23 LEU 71 -10.629 10.818 6.535 386 H GLU 72 H GLU 72 -9.222 12.449 1.517 387 HA GLU 72 HA GLU 72 -10.048 11.402 -0.890 388 HB2 GLU 72 HB2 GLU 72 -9.003 13.659 -0.494 389 HB3 GLU 72 HB3 GLU 72 -7.436 12.862 -0.482 390 HG2 GLU 72 HG2 GLU 72 -7.349 12.790 -2.699 391 HG3 GLU 72 HG3 GLU 72 -8.990 12.158 -2.821 392 H LYS 73 H LYS 73 -6.932 10.854 0.732 393 HA LYS 73 HA LYS 73 -6.076 8.950 -1.246 394 HB2 LYS 73 HB2 LYS 73 -4.890 9.468 1.485 395 HB3 LYS 73 HB3 LYS 73 -4.103 8.686 0.121 396 HG2 LYS 73 HG2 LYS 73 -3.422 10.630 -0.695 397 HG3 LYS 73 HG3 LYS 73 -5.048 11.309 -0.606 398 HD2 LYS 73 HD2 LYS 73 -4.137 12.681 0.928 399 HD3 LYS 73 HD3 LYS 73 -4.345 11.305 2.014 400 HE2 LYS 73 HE2 LYS 73 -2.092 10.655 1.784 401 HE3 LYS 73 HE3 LYS 73 -1.854 11.691 0.379 402 HZ1 LYS 73 HZ1 LYS 73 -1.451 13.464 1.657 403 HZ2 LYS 73 HZ2 LYS 73 -1.154 12.341 2.886 404 HZ3 LYS 73 HZ3 LYS 73 -2.668 13.088 2.771 405 H LEU 74 H LEU 74 -7.869 8.856 1.690 406 HA LEU 74 HA LEU 74 -7.366 6.254 2.569 407 HB2 LEU 74 HB2 LEU 74 -8.660 8.029 3.771 408 HB3 LEU 74 HB3 LEU 74 -10.012 7.688 2.692 409 HG LEU 74 HG LEU 74 -10.040 5.356 3.578 410 HD11 LEU 74 HD11 LEU 74 -8.813 4.771 5.522 411 HD12 LEU 74 HD12 LEU 74 -8.204 6.415 5.714 412 HD13 LEU 74 HD13 LEU 74 -7.656 5.424 4.361 413 HD21 LEU 74 HD21 LEU 74 -11.089 5.952 5.710 414 HD22 LEU 74 HD22 LEU 74 -11.588 7.039 4.413 415 HD23 LEU 74 HD23 LEU 74 -10.392 7.568 5.598 416 H ASP 75 H ASP 75 -10.043 7.396 0.505 417 HA ASP 75 HA ASP 75 -11.110 4.885 -0.081 418 HB2 ASP 75 HB2 ASP 75 -12.043 7.259 -0.566 419 HB3 ASP 75 HB3 ASP 75 -11.146 7.131 -2.077 420 H LEU 76 H LEU 76 -8.348 6.544 -1.387 421 HA LEU 76 HA LEU 76 -8.098 4.890 -3.718 422 HB2 LEU 76 HB2 LEU 76 -6.038 6.647 -2.394 423 HB3 LEU 76 HB3 LEU 76 -5.955 5.982 -4.025 424 HG LEU 76 HG LEU 76 -8.106 7.901 -3.162 425 HD11 LEU 76 HD11 LEU 76 -6.768 9.665 -3.412 426 HD12 LEU 76 HD12 LEU 76 -5.999 8.987 -4.847 427 HD13 LEU 76 HD13 LEU 76 -5.429 8.529 -3.243 428 HD21 LEU 76 HD21 LEU 76 -8.513 8.177 -5.471 429 HD22 LEU 76 HD22 LEU 76 -8.378 6.438 -5.209 430 HD23 LEU 76 HD23 LEU 76 -7.029 7.332 -5.912 431 H VAL 77 H VAL 77 -6.545 5.027 -0.536 432 HA VAL 77 HA VAL 77 -4.759 2.865 -1.031 433 HB VAL 77 HB VAL 77 -5.713 4.012 1.596 434 HG11 VAL 77 HG11 VAL 77 -4.192 1.672 1.039 435 HG12 VAL 77 HG12 VAL 77 -3.132 2.868 1.786 436 HG13 VAL 77 HG13 VAL 77 -4.613 2.369 2.603 437 HG21 VAL 77 HG21 VAL 77 -4.409 5.438 -0.165 438 HG22 VAL 77 HG22 VAL 77 -3.951 5.493 1.537 439 HG23 VAL 77 HG23 VAL 77 -3.022 4.509 0.405 440 H ILE 78 H ILE 78 -7.951 3.134 0.452 441 HA ILE 78 HA ILE 78 -8.101 0.480 1.413 442 HB ILE 78 HB ILE 78 -10.267 2.451 0.692 443 HG12 ILE 78 HG12 ILE 78 -8.847 3.065 2.603 444 HG13 ILE 78 HG13 ILE 78 -10.486 2.688 3.123 445 HG21 ILE 78 HG21 ILE 78 -11.662 0.706 0.672 446 HG22 ILE 78 HG22 ILE 78 -10.443 -0.383 1.333 447 HG23 ILE 78 HG23 ILE 78 -11.398 0.632 2.414 448 HD11 ILE 78 HD11 ILE 78 -8.061 1.601 4.051 449 HD12 ILE 78 HD12 ILE 78 -9.705 1.187 4.538 450 HD13 ILE 78 HD13 ILE 78 -8.928 0.311 3.219 451 H LYS 79 H LYS 79 -9.470 1.981 -1.516 452 HA LYS 79 HA LYS 79 -10.508 -0.408 -2.596 453 HB2 LYS 79 HB2 LYS 79 -10.918 0.825 -4.573 454 HB3 LYS 79 HB3 LYS 79 -11.101 1.973 -3.253 455 HG2 LYS 79 HG2 LYS 79 -9.776 3.281 -4.484 456 HG3 LYS 79 HG3 LYS 79 -8.468 2.271 -3.865 457 HD2 LYS 79 HD2 LYS 79 -8.051 2.149 -6.115 458 HD3 LYS 79 HD3 LYS 79 -9.115 0.754 -5.918 459 HE2 LYS 79 HE2 LYS 79 -10.987 2.539 -6.406 460 HE3 LYS 79 HE3 LYS 79 -9.655 3.402 -7.173 461 HZ1 LYS 79 HZ1 LYS 79 -9.549 1.927 -8.846 462 HZ2 LYS 79 HZ2 LYS 79 -11.148 1.584 -8.417 463 HZ3 LYS 79 HZ3 LYS 79 -9.893 0.595 -7.863 464 H TYR 80 H TYR 80 -7.330 0.960 -2.574 465 HA TYR 80 HA TYR 80 -6.345 -0.635 -4.765 466 HB2 TYR 80 HB2 TYR 80 -5.350 1.550 -4.313 467 HB3 TYR 80 HB3 TYR 80 -4.879 1.023 -2.702 468 HD1 TYR 80 HD1 TYR 80 -3.098 -0.690 -2.436 469 HD2 TYR 80 HD2 TYR 80 -4.044 0.993 -6.228 470 HE1 TYR 80 HE1 TYR 80 -0.951 -1.498 -3.324 471 HE2 TYR 80 HE2 TYR 80 -1.900 0.188 -7.126 472 HH TYR 80 HH TYR 80 0.069 -0.744 -6.631 473 H MET 81 H MET 81 -6.114 -0.687 -1.231 474 HA MET 81 HA MET 81 -4.451 -3.010 -1.157 475 HB2 MET 81 HB2 MET 81 -4.603 -2.874 1.186 476 HB3 MET 81 HB3 MET 81 -4.664 -1.205 0.639 477 HG2 MET 81 HG2 MET 81 -7.032 -1.117 0.965 478 HG3 MET 81 HG3 MET 81 -7.091 -2.843 1.316 479 HE1 MET 81 HE1 MET 81 -6.324 0.643 3.958 480 HE2 MET 81 HE2 MET 81 -4.807 0.301 3.126 481 HE3 MET 81 HE3 MET 81 -6.279 0.579 2.196 482 H LYS 82 H LYS 82 -7.895 -2.398 -1.070 483 HA LYS 82 HA LYS 82 -8.669 -5.000 -0.215 484 HB2 LYS 82 HB2 LYS 82 -10.870 -4.314 -0.577 485 HB3 LYS 82 HB3 LYS 82 -10.038 -2.812 -0.193 486 HG2 LYS 82 HG2 LYS 82 -11.175 -2.098 -2.007 487 HG3 LYS 82 HG3 LYS 82 -9.767 -2.759 -2.843 488 HD2 LYS 82 HD2 LYS 82 -11.515 -3.698 -4.029 489 HD3 LYS 82 HD3 LYS 82 -11.149 -4.966 -2.856 490 HE2 LYS 82 HE2 LYS 82 -13.049 -4.558 -1.622 491 HE3 LYS 82 HE3 LYS 82 -13.171 -2.886 -2.165 492 HZ1 LYS 82 HZ1 LYS 82 -13.487 -4.967 -4.185 493 HZ2 LYS 82 HZ2 LYS 82 -14.269 -3.475 -4.039 494 HZ3 LYS 82 HZ3 LYS 82 -14.750 -4.780 -3.075 495 H ARG 83 H ARG 83 -7.981 -3.544 -3.320 496 HA ARG 83 HA ARG 83 -9.114 -5.615 -4.909 497 HB2 ARG 83 HB2 ARG 83 -8.455 -4.376 -6.695 498 HB3 ARG 83 HB3 ARG 83 -8.273 -3.129 -5.468 499 HG2 ARG 83 HG2 ARG 83 -5.854 -3.956 -5.267 500 HG3 ARG 83 HG3 ARG 83 -6.156 -4.772 -6.802 501 HD2 ARG 83 HD2 ARG 83 -6.896 -1.905 -6.582 502 HD3 ARG 83 HD3 ARG 83 -5.182 -2.305 -6.674 503 HE ARG 83 HE ARG 83 -6.677 -3.639 -8.693 504 HH11 ARG 83 HH11 ARG 83 -5.288 -0.567 -7.829 505 HH12 ARG 83 HH12 ARG 83 -5.105 -0.040 -9.469 506 HH21 ARG 83 HH21 ARG 83 -6.441 -2.958 -10.857 507 HH22 ARG 83 HH22 ARG 83 -5.763 -1.400 -11.191 508 H LEU 84 H LEU 84 -6.037 -5.138 -3.348 509 HA LEU 84 HA LEU 84 -4.725 -7.261 -4.800 510 HB2 LEU 84 HB2 LEU 84 -3.852 -5.801 -2.312 511 HB3 LEU 84 HB3 LEU 84 -2.846 -6.843 -3.316 512 HG LEU 84 HG LEU 84 -4.107 -4.352 -4.421 513 HD11 LEU 84 HD11 LEU 84 -1.603 -3.545 -3.976 514 HD12 LEU 84 HD12 LEU 84 -1.806 -4.605 -2.581 515 HD13 LEU 84 HD13 LEU 84 -2.918 -3.260 -2.835 516 HD21 LEU 84 HD21 LEU 84 -2.690 -6.424 -5.567 517 HD22 LEU 84 HD22 LEU 84 -1.474 -5.166 -5.340 518 HD23 LEU 84 HD23 LEU 84 -2.939 -4.822 -6.261 519 H MET 85 H MET 85 -5.725 -6.756 -1.413 520 HA MET 85 HA MET 85 -5.105 -9.304 -0.472 521 HB2 MET 85 HB2 MET 85 -7.230 -7.350 0.411 522 HB3 MET 85 HB3 MET 85 -6.843 -8.821 1.293 523 HG2 MET 85 HG2 MET 85 -4.488 -7.988 1.461 524 HG3 MET 85 HG3 MET 85 -5.055 -6.459 0.792 525 HE1 MET 85 HE1 MET 85 -5.560 -4.546 3.764 526 HE2 MET 85 HE2 MET 85 -4.007 -5.347 3.528 527 HE3 MET 85 HE3 MET 85 -4.925 -4.775 2.135 528 H GLN 86 H GLN 86 -7.798 -8.185 -2.361 529 HA GLN 86 HA GLN 86 -9.438 -10.496 -1.880 530 HB2 GLN 86 HB2 GLN 86 -9.600 -8.116 -3.689 531 HB3 GLN 86 HB3 GLN 86 -10.641 -9.502 -3.985 532 HG2 GLN 86 HG2 GLN 86 -11.507 -9.304 -1.688 533 HG3 GLN 86 HG3 GLN 86 -10.514 -7.866 -1.462 534 HE21 GLN 86 HE21 GLN 86 -12.797 -7.115 -0.961 535 HE22 GLN 86 HE22 GLN 86 -13.682 -6.429 -2.277 536 H GLN 87 H GLN 87 -7.531 -9.301 -4.638 537 HA GLN 87 HA GLN 87 -7.966 -11.624 -6.222 538 HB2 GLN 87 HB2 GLN 87 -6.462 -10.669 -7.780 539 HB3 GLN 87 HB3 GLN 87 -7.324 -9.317 -7.058 540 HG2 GLN 87 HG2 GLN 87 -5.390 -8.996 -5.522 541 HG3 GLN 87 HG3 GLN 87 -4.528 -10.230 -6.439 542 HE21 GLN 87 HE21 GLN 87 -6.614 -7.518 -7.373 543 HE22 GLN 87 HE22 GLN 87 -5.470 -6.780 -8.438 544 H SER 88 H SER 88 -6.067 -11.078 -3.516 545 HA SER 88 HA SER 88 -3.706 -12.449 -4.012 546 HB2 SER 88 HB2 SER 88 -5.351 -12.030 -1.535 547 HB3 SER 88 HB3 SER 88 -3.917 -13.053 -1.481 548 HG SER 88 HG SER 88 -3.705 -10.530 -2.667 549 H VAL 89 H VAL 89 -3.214 -14.613 -2.776 550 HA VAL 89 HA VAL 89 -5.056 -16.600 -3.892 551 HB VAL 89 HB VAL 89 -2.807 -16.912 -4.632 552 HG11 VAL 89 HG11 VAL 89 -1.105 -16.197 -3.399 553 HG12 VAL 89 HG12 VAL 89 -2.151 -16.035 -1.987 554 HG13 VAL 89 HG13 VAL 89 -1.347 -17.569 -2.318 555 HG21 VAL 89 HG21 VAL 89 -3.375 -18.920 -2.453 556 HG22 VAL 89 HG22 VAL 89 -4.077 -18.944 -4.071 557 HG23 VAL 89 HG23 VAL 89 -2.340 -19.166 -3.859 558 H GLU 90 H GLU 90 -3.652 -15.519 -0.877 559 HA GLU 90 HA GLU 90 -4.726 -17.755 0.620 560 HB2 GLU 90 HB2 GLU 90 -3.318 -15.234 1.513 561 HB3 GLU 90 HB3 GLU 90 -3.817 -16.529 2.592 562 HG2 GLU 90 HG2 GLU 90 -1.649 -17.115 2.263 563 HG3 GLU 90 HG3 GLU 90 -2.398 -18.002 0.936 564 H SER 91 H SER 91 -6.614 -17.808 1.670 565 HA SER 91 HA SER 91 -8.544 -15.763 1.240 566 HB2 SER 91 HB2 SER 91 -9.806 -17.241 3.034 567 HB3 SER 91 HB3 SER 91 -9.554 -17.835 1.392 568 HG SER 91 HG SER 91 -8.451 -19.401 2.227 569 H VAL 92 H VAL 92 -6.290 -16.461 3.772 570 HA VAL 92 HA VAL 92 -7.485 -15.174 5.939 571 HB VAL 92 HB VAL 92 -5.411 -16.560 6.051 572 HG11 VAL 92 HG11 VAL 92 -3.640 -14.288 5.558 573 HG12 VAL 92 HG12 VAL 92 -3.481 -15.978 5.075 574 HG13 VAL 92 HG13 VAL 92 -4.465 -14.875 4.114 575 HG21 VAL 92 HG21 VAL 92 -6.224 -14.907 7.827 576 HG22 VAL 92 HG22 VAL 92 -4.552 -15.461 7.933 577 HG23 VAL 92 HG23 VAL 92 -4.912 -13.865 7.276 578 H TRP 93 H TRP 93 -6.042 -13.883 3.081 579 HA TRP 93 HA TRP 93 -5.429 -11.291 4.063 580 HB2 TRP 93 HB2 TRP 93 -5.665 -12.567 1.387 581 HB3 TRP 93 HB3 TRP 93 -5.773 -10.811 1.453 582 HD1 TRP 93 HD1 TRP 93 -3.289 -13.340 0.890 583 HE1 TRP 93 HE1 TRP 93 -0.915 -12.508 1.433 584 HE3 TRP 93 HE3 TRP 93 -4.490 -9.176 3.602 585 HZ2 TRP 93 HZ2 TRP 93 0.289 -10.371 2.829 586 HZ3 TRP 93 HZ3 TRP 93 -2.668 -7.792 4.506 587 HH2 TRP 93 HH2 TRP 93 -0.329 -8.379 4.128 588 H ASN 94 H ASN 94 -8.309 -12.758 2.689 589 HA ASN 94 HA ASN 94 -9.797 -10.462 2.155 590 HB2 ASN 94 HB2 ASN 94 -10.523 -13.288 2.850 591 HB3 ASN 94 HB3 ASN 94 -11.787 -12.068 2.726 592 HD21 ASN 94 HD21 ASN 94 -8.813 -12.521 0.864 593 HD22 ASN 94 HD22 ASN 94 -9.592 -12.682 -0.670 594 H MET 95 H MET 95 -9.410 -12.290 5.156 595 HA MET 95 HA MET 95 -11.284 -10.729 6.637 596 HB2 MET 95 HB2 MET 95 -9.031 -12.345 7.815 597 HB3 MET 95 HB3 MET 95 -10.589 -11.965 8.538 598 HG2 MET 95 HG2 MET 95 -11.566 -13.316 6.566 599 HG3 MET 95 HG3 MET 95 -9.931 -13.951 6.407 600 HE1 MET 95 HE1 MET 95 -8.627 -14.912 8.702 601 HE2 MET 95 HE2 MET 95 -9.481 -16.367 9.215 602 HE3 MET 95 HE3 MET 95 -9.237 -16.047 7.497 603 H ALA 96 H ALA 96 -7.808 -10.609 6.118 604 HA ALA 96 HA ALA 96 -7.039 -8.841 8.101 605 HB1 ALA 96 HB1 ALA 96 -5.976 -9.721 5.537 606 HB2 ALA 96 HB2 ALA 96 -5.499 -8.074 5.954 607 HB3 ALA 96 HB3 ALA 96 -5.145 -9.402 7.060 608 H PHE 97 H PHE 97 -8.352 -8.119 4.884 609 HA PHE 97 HA PHE 97 -8.133 -5.333 5.007 610 HB2 PHE 97 HB2 PHE 97 -8.613 -6.485 2.918 611 HB3 PHE 97 HB3 PHE 97 -10.159 -7.041 3.551 612 HD1 PHE 97 HD2 PHE 97 -8.510 -3.700 3.615 613 HD2 PHE 97 HD1 PHE 97 -11.832 -6.034 2.335 614 HE1 PHE 97 HE2 PHE 97 -9.591 -1.672 2.737 615 HE2 PHE 97 HE1 PHE 97 -12.918 -4.009 1.454 616 HZ PHE 97 HZ PHE 97 -11.798 -1.825 1.656 617 H ASP 98 H ASP 98 -10.715 -7.501 6.063 618 HA ASP 98 HA ASP 98 -12.538 -5.458 6.801 619 HB2 ASP 98 HB2 ASP 98 -13.132 -7.864 6.376 620 HB3 ASP 98 HB3 ASP 98 -12.393 -8.260 7.925 621 H PHE 99 H PHE 99 -9.941 -7.112 8.478 622 HA PHE 99 HA PHE 99 -10.534 -6.372 11.102 623 HB2 PHE 99 HB2 PHE 99 -8.837 -7.978 10.843 624 HB3 PHE 99 HB3 PHE 99 -7.954 -6.988 9.685 625 HD1 PHE 99 HD2 PHE 99 -8.837 -7.344 13.251 626 HD2 PHE 99 HD1 PHE 99 -6.327 -5.436 10.391 627 HE1 PHE 99 HE2 PHE 99 -7.418 -6.490 15.071 628 HE2 PHE 99 HE1 PHE 99 -4.905 -4.578 12.207 629 HZ PHE 99 HZ PHE 99 -5.450 -5.104 14.550 630 H ILE 100 H ILE 100 -8.601 -4.691 8.646 631 HA ILE 100 HA ILE 100 -7.897 -2.497 10.290 632 HB ILE 100 HB ILE 100 -8.062 -2.637 7.277 633 HG12 ILE 100 HG12 ILE 100 -5.441 -2.656 8.610 634 HG13 ILE 100 HG13 ILE 100 -6.422 -4.083 8.928 635 HG21 ILE 100 HG21 ILE 100 -7.453 -0.469 9.093 636 HG22 ILE 100 HG22 ILE 100 -6.107 -0.812 8.009 637 HG23 ILE 100 HG23 ILE 100 -7.699 -0.443 7.346 638 HD11 ILE 100 HD11 ILE 100 -6.057 -3.119 6.129 639 HD12 ILE 100 HD12 ILE 100 -4.793 -4.061 6.920 640 HD13 ILE 100 HD13 ILE 100 -6.408 -4.742 6.723 641 H LEU 101 H LEU 101 -10.543 -3.050 8.010 642 HA LEU 101 HA LEU 101 -11.604 -0.432 8.107 643 HB2 LEU 101 HB2 LEU 101 -12.808 -3.092 7.391 644 HB3 LEU 101 HB3 LEU 101 -13.714 -1.583 7.297 645 HG LEU 101 HG LEU 101 -11.130 -1.882 5.815 646 HD11 LEU 101 HD11 LEU 101 -13.276 -2.394 4.055 647 HD12 LEU 101 HD12 LEU 101 -13.429 -3.513 5.407 648 HD13 LEU 101 HD13 LEU 101 -11.932 -3.454 4.479 649 HD21 LEU 101 HD21 LEU 101 -12.403 -0.350 4.255 650 HD22 LEU 101 HD22 LEU 101 -11.975 0.322 5.829 651 HD23 LEU 101 HD23 LEU 101 -13.624 -0.227 5.522 652 H ASP 102 H ASP 102 -12.141 -3.317 10.044 653 HA ASP 102 HA ASP 102 -14.420 -2.495 11.440 654 HB2 ASP 102 HB2 ASP 102 -13.009 -4.764 11.419 655 HB3 ASP 102 HB3 ASP 102 -12.354 -4.066 12.897 656 H ASN 103 H ASN 103 -11.106 -1.536 11.729 657 HA ASN 103 HA ASN 103 -11.622 -0.184 14.274 658 HB2 ASN 103 HB2 ASN 103 -9.095 -0.792 12.746 659 HB3 ASN 103 HB3 ASN 103 -9.116 0.317 14.114 660 HD21 ASN 103 HD21 ASN 103 -10.204 -2.940 13.229 661 HD22 ASN 103 HD22 ASN 103 -9.803 -3.669 14.743 662 H VAL 104 H VAL 104 -10.629 0.470 10.945 663 HA VAL 104 HA VAL 104 -10.360 3.287 11.307 664 HB VAL 104 HB VAL 104 -10.693 1.654 8.789 665 HG11 VAL 104 HG11 VAL 104 -11.427 3.912 8.364 666 HG12 VAL 104 HG12 VAL 104 -9.981 4.563 9.138 667 HG13 VAL 104 HG13 VAL 104 -9.845 3.666 7.625 668 HG21 VAL 104 HG21 VAL 104 -8.363 1.703 8.575 669 HG22 VAL 104 HG22 VAL 104 -8.189 2.983 9.776 670 HG23 VAL 104 HG23 VAL 104 -8.634 1.353 10.282 671 H GLN 105 H GLN 105 -12.783 1.372 9.516 672 HA GLN 105 HA GLN 105 -14.549 3.373 8.884 673 HB2 GLN 105 HB2 GLN 105 -15.307 0.577 9.746 674 HB3 GLN 105 HB3 GLN 105 -16.281 1.663 8.763 675 HG2 GLN 105 HG2 GLN 105 -13.567 0.683 7.928 676 HG3 GLN 105 HG3 GLN 105 -15.067 -0.154 7.527 677 HE21 GLN 105 HE21 GLN 105 -13.218 2.782 7.082 678 HE22 GLN 105 HE22 GLN 105 -14.021 3.299 5.643 679 H VAL 106 H VAL 106 -14.003 1.880 11.979 680 HA VAL 106 HA VAL 106 -16.397 2.782 13.232 681 HB VAL 106 HB VAL 106 -13.793 1.698 14.243 682 HG11 VAL 106 HG11 VAL 106 -14.166 3.299 15.905 683 HG12 VAL 106 HG12 VAL 106 -15.917 3.082 15.849 684 HG13 VAL 106 HG13 VAL 106 -14.893 1.829 16.552 685 HG21 VAL 106 HG21 VAL 106 -16.601 0.767 14.782 686 HG22 VAL 106 HG22 VAL 106 -15.696 0.273 13.352 687 HG23 VAL 106 HG23 VAL 106 -15.095 -0.135 14.959 688 H VAL 107 H VAL 107 -13.017 3.904 13.475 689 HA VAL 107 HA VAL 107 -13.631 6.207 14.998 690 HB VAL 107 HB VAL 107 -11.386 5.333 15.021 691 HG11 VAL 107 HG11 VAL 107 -10.971 4.343 12.981 692 HG12 VAL 107 HG12 VAL 107 -11.560 5.732 12.067 693 HG13 VAL 107 HG13 VAL 107 -9.990 5.804 12.867 694 HG21 VAL 107 HG21 VAL 107 -11.482 8.035 13.682 695 HG22 VAL 107 HG22 VAL 107 -11.627 7.723 15.411 696 HG23 VAL 107 HG23 VAL 107 -10.110 7.384 14.579 697 H LEU 108 H LEU 108 -13.681 5.534 11.595 698 HA LEU 108 HA LEU 108 -13.620 8.258 10.724 699 HB2 LEU 108 HB2 LEU 108 -13.320 7.298 8.752 700 HB3 LEU 108 HB3 LEU 108 -13.501 5.726 9.527 701 HG LEU 108 HG LEU 108 -15.998 5.978 9.116 702 HD11 LEU 108 HD11 LEU 108 -15.935 7.563 6.836 703 HD12 LEU 108 HD12 LEU 108 -15.044 8.486 8.045 704 HD13 LEU 108 HD13 LEU 108 -16.692 7.956 8.380 705 HD21 LEU 108 HD21 LEU 108 -14.894 5.905 6.432 706 HD22 LEU 108 HD22 LEU 108 -15.678 4.632 7.369 707 HD23 LEU 108 HD23 LEU 108 -13.953 4.945 7.573 708 H GLN 109 H GLN 109 -16.154 5.907 11.427 709 HA GLN 109 HA GLN 109 -18.315 7.472 10.480 710 HB2 GLN 109 HB2 GLN 109 -18.068 5.105 12.299 711 HB3 GLN 109 HB3 GLN 109 -19.610 5.940 12.158 712 HG2 GLN 109 HG2 GLN 109 -19.720 5.484 9.816 713 HG3 GLN 109 HG3 GLN 109 -18.082 4.836 9.817 714 HE21 GLN 109 HE21 GLN 109 -17.763 2.966 11.360 715 HE22 GLN 109 HE22 GLN 109 -19.015 1.776 11.398 716 H GLN 110 H GLN 110 -16.788 7.130 13.648 717 HA GLN 110 HA GLN 110 -18.635 8.696 15.091 718 HB2 GLN 110 HB2 GLN 110 -15.721 8.088 15.601 719 HB3 GLN 110 HB3 GLN 110 -16.757 8.929 16.746 720 HG2 GLN 110 HG2 GLN 110 -18.269 6.916 16.679 721 HG3 GLN 110 HG3 GLN 110 -16.991 6.095 15.783 722 HE21 GLN 110 HE21 GLN 110 -15.257 5.313 16.852 723 HE22 GLN 110 HE22 GLN 110 -15.045 5.411 18.564 724 H THR 111 H THR 111 -16.335 9.550 12.762 725 HA THR 111 HA THR 111 -16.040 12.283 13.754 726 HB THR 111 HB THR 111 -14.780 10.898 11.380 727 HG1 THR 111 HG1 THR 111 -13.970 11.474 14.016 728 HG21 THR 111 HG21 THR 111 -14.336 13.685 12.462 729 HG22 THR 111 HG22 THR 111 -15.063 13.270 10.909 730 HG23 THR 111 HG23 THR 111 -13.364 12.909 11.212 731 H TYR 112 H TYR 112 -16.848 10.757 10.628 732 HA TYR 112 HA TYR 112 -18.482 13.111 9.987 733 HB2 TYR 112 HB2 TYR 112 -17.673 10.938 8.062 734 HB3 TYR 112 HB3 TYR 112 -18.224 12.568 7.693 735 HD1 TYR 112 HD1 TYR 112 -15.385 10.531 8.810 736 HD2 TYR 112 HD2 TYR 112 -16.710 14.452 7.820 737 HE1 TYR 112 HE1 TYR 112 -13.048 11.291 8.715 738 HE2 TYR 112 HE2 TYR 112 -14.376 15.223 7.721 739 HH TYR 112 HH TYR 112 -11.848 13.388 7.363 740 H GLY 113 H GLY 113 -18.565 9.570 10.052 741 HA2 GLY 113 HA2 GLY 113 -20.577 8.506 10.924 742 HA3 GLY 113 HA3 GLY 113 -21.512 9.747 10.102 743 H SER 114 H SER 114 -19.403 9.303 7.835 744 HA SER 114 HA SER 114 -21.008 7.274 6.485 745 HB2 SER 114 HB2 SER 114 -20.236 9.634 5.555 746 HB3 SER 114 HB3 SER 114 -18.790 8.728 5.110 747 HG SER 114 HG SER 114 -21.407 8.493 4.164 748 H THR 115 H THR 115 -19.369 6.196 4.664 749 HA THR 115 HA THR 115 -16.967 5.180 5.932 750 HB THR 115 HB THR 115 -17.625 2.807 5.667 751 HG1 THR 115 HG1 THR 115 -19.338 2.545 4.439 752 HG21 THR 115 HG21 THR 115 -18.758 2.639 7.708 753 HG22 THR 115 HG22 THR 115 -19.647 4.140 7.442 754 HG23 THR 115 HG23 THR 115 -17.924 4.189 7.817 755 H LEU 116 H LEU 116 -16.182 3.216 4.391 756 HA LEU 116 HA LEU 116 -15.883 4.460 1.792 757 HB2 LEU 116 HB2 LEU 116 -14.333 2.748 3.439 758 HB3 LEU 116 HB3 LEU 116 -14.622 1.911 1.914 759 HG LEU 116 HG LEU 116 -12.491 3.202 2.008 760 HD11 LEU 116 HD11 LEU 116 -12.583 3.541 -0.211 761 HD12 LEU 116 HD12 LEU 116 -14.012 4.569 -0.102 762 HD13 LEU 116 HD13 LEU 116 -14.183 2.814 -0.064 763 HD21 LEU 116 HD21 LEU 116 -13.655 5.102 3.316 764 HD22 LEU 116 HD22 LEU 116 -14.139 5.685 1.724 765 HD23 LEU 116 HD23 LEU 116 -12.427 5.518 2.120 766 H LYS 117 H LYS 117 -16.203 3.322 -0.206 767 HA LYS 117 HA LYS 117 -18.469 1.458 -0.059 768 HB2 LYS 117 HB2 LYS 117 -19.087 3.333 -1.344 769 HB3 LYS 117 HB3 LYS 117 -17.534 3.388 -2.168 770 HG2 LYS 117 HG2 LYS 117 -19.324 2.598 -3.631 771 HG3 LYS 117 HG3 LYS 117 -18.078 1.370 -3.393 772 HD2 LYS 117 HD2 LYS 117 -19.978 0.984 -1.353 773 HD3 LYS 117 HD3 LYS 117 -20.891 1.233 -2.843 774 HE2 LYS 117 HE2 LYS 117 -18.869 -0.446 -3.639 775 HE3 LYS 117 HE3 LYS 117 -19.228 -1.018 -2.011 776 HZ1 LYS 117 HZ1 LYS 117 -20.556 -1.831 -4.144 777 HZ2 LYS 117 HZ2 LYS 117 -21.510 -0.494 -3.742 778 HZ3 LYS 117 HZ3 LYS 117 -21.268 -1.730 -2.612 779 H VAL 118 H VAL 118 -17.608 -0.550 0.069 780 HA VAL 118 HA VAL 118 -15.695 -1.327 -2.037 781 HB VAL 118 HB VAL 118 -15.083 -3.217 -0.439 782 HG11 VAL 118 HG11 VAL 118 -13.271 -1.948 -0.261 783 HG12 VAL 118 HG12 VAL 118 -14.220 -0.492 -0.567 784 HG13 VAL 118 HG13 VAL 118 -14.029 -1.093 1.081 785 HG21 VAL 118 HG21 VAL 118 -15.894 -3.314 1.651 786 HG22 VAL 118 HG22 VAL 118 -15.828 -1.565 1.864 787 HG23 VAL 118 HG23 VAL 118 -17.193 -2.299 1.023 788 H THR 119 H THR 119 -17.167 -2.032 -3.548 789 HA THR 119 HA THR 119 -19.486 -3.471 -3.155 790 HB THR 119 HB THR 119 -18.753 -2.538 -5.342 791 HG1 THR 119 HG1 THR 119 -20.411 -4.206 -5.141 792 HG21 THR 119 HG21 THR 119 -16.463 -4.023 -4.918 793 HG22 THR 119 HG22 THR 119 -16.919 -3.230 -6.425 794 HG23 THR 119 HG23 THR 119 -17.313 -4.930 -6.168 795 H LYS 207 H LYS 207 6.939 -6.975 16.545 796 HA LYS 207 HA LYS 207 9.107 -6.052 14.793 797 HB2 LYS 207 HB2 LYS 207 9.549 -8.340 15.866 798 HB3 LYS 207 HB3 LYS 207 8.237 -8.934 14.855 799 HG2 LYS 207 HG2 LYS 207 9.435 -8.705 12.920 800 HG3 LYS 207 HG3 LYS 207 10.451 -7.416 13.573 801 HD2 LYS 207 HD2 LYS 207 11.802 -8.919 14.749 802 HD3 LYS 207 HD3 LYS 207 10.607 -10.215 14.647 803 HE2 LYS 207 HE2 LYS 207 12.200 -10.857 13.089 804 HE3 LYS 207 HE3 LYS 207 10.988 -10.047 12.098 805 HZ1 LYS 207 HZ1 LYS 207 12.806 -8.990 11.323 806 HZ2 LYS 207 HZ2 LYS 207 13.710 -9.238 12.729 807 HZ3 LYS 207 HZ3 LYS 207 12.561 -8.000 12.672 808 H SER 208 H SER 208 8.674 -6.324 12.514 809 HA SER 208 HA SER 208 6.244 -7.251 11.466 810 HB2 SER 208 HB2 SER 208 4.844 -5.441 11.366 811 HB3 SER 208 HB3 SER 208 5.691 -5.027 12.856 812 HG SER 208 HG SER 208 5.553 -3.602 10.660 813 H PHE 209 H PHE 209 5.861 -6.304 9.191 814 HA PHE 209 HA PHE 209 8.385 -6.408 7.812 815 HB2 PHE 209 HB2 PHE 209 6.572 -7.599 6.809 816 HB3 PHE 209 HB3 PHE 209 5.530 -6.181 6.859 817 HD1 PHE 209 HD2 PHE 209 8.523 -7.629 5.250 818 HD2 PHE 209 HD1 PHE 209 5.527 -4.609 5.111 819 HE1 PHE 209 HE2 PHE 209 9.234 -7.033 2.971 820 HE2 PHE 209 HE1 PHE 209 6.232 -4.008 2.832 821 HZ PHE 209 HZ PHE 209 8.089 -5.220 1.759 822 H PHE 210 H PHE 210 5.729 -4.045 8.018 823 HA PHE 210 HA PHE 210 6.871 -2.044 6.462 824 HB2 PHE 210 HB2 PHE 210 4.962 -1.893 8.795 825 HB3 PHE 210 HB3 PHE 210 5.415 -0.483 7.843 826 HD1 PHE 210 HD1 PHE 210 4.964 -0.551 5.336 827 HD2 PHE 210 HD2 PHE 210 3.236 -3.287 8.101 828 HE1 PHE 210 HE1 PHE 210 3.204 -1.085 3.702 829 HE2 PHE 210 HE2 PHE 210 1.473 -3.826 6.471 830 HZ PHE 210 HZ PHE 210 1.456 -2.726 4.268 831 H ASP 211 H ASP 211 7.612 -3.063 9.679 832 HA ASP 211 HA ASP 211 8.949 -0.669 10.494 833 HB2 ASP 211 HB2 ASP 211 8.683 -3.441 11.574 834 HB3 ASP 211 HB3 ASP 211 9.980 -2.420 12.190 835 H LYS 212 H LYS 212 10.024 -3.826 9.279 836 HA LYS 212 HA LYS 212 12.793 -3.065 9.276 837 HB2 LYS 212 HB2 LYS 212 13.213 -5.226 8.316 838 HB3 LYS 212 HB3 LYS 212 12.003 -5.414 9.579 839 HG2 LYS 212 HG2 LYS 212 10.246 -5.557 7.936 840 HG3 LYS 212 HG3 LYS 212 11.395 -5.235 6.635 841 HD2 LYS 212 HD2 LYS 212 10.940 -7.602 6.729 842 HD3 LYS 212 HD3 LYS 212 12.602 -7.309 7.246 843 HE2 LYS 212 HE2 LYS 212 12.108 -7.735 9.483 844 HE3 LYS 212 HE3 LYS 212 10.380 -7.480 9.249 845 HZ1 LYS 212 HZ1 LYS 212 12.011 -9.823 8.492 846 HZ2 LYS 212 HZ2 LYS 212 10.512 -9.531 7.766 847 HZ3 LYS 212 HZ3 LYS 212 10.609 -9.772 9.437 848 H LYS 213 H LYS 213 10.153 -2.662 7.151 849 HA LYS 213 HA LYS 213 11.752 -2.429 4.751 850 HB2 LYS 213 HB2 LYS 213 9.175 -3.097 5.118 851 HB3 LYS 213 HB3 LYS 213 8.978 -1.373 4.827 852 HG2 LYS 213 HG2 LYS 213 10.451 -3.241 2.983 853 HG3 LYS 213 HG3 LYS 213 8.757 -2.781 2.797 854 HD2 LYS 213 HD2 LYS 213 9.791 -0.345 2.967 855 HD3 LYS 213 HD3 LYS 213 11.226 -1.181 2.371 856 HE2 LYS 213 HE2 LYS 213 8.731 -1.840 0.967 857 HE3 LYS 213 HE3 LYS 213 9.255 -0.166 0.797 858 HZ1 LYS 213 HZ1 LYS 213 10.159 -2.267 -0.665 859 HZ2 LYS 213 HZ2 LYS 213 11.394 -2.045 0.468 860 HZ3 LYS 213 HZ3 LYS 213 10.922 -0.763 -0.529 861 H ARG 214 H ARG 214 10.135 -0.287 7.042 862 HA ARG 214 HA ARG 214 10.369 2.133 5.725 863 HB2 ARG 214 HB2 ARG 214 9.958 3.159 7.765 864 HB3 ARG 214 HB3 ARG 214 9.308 1.545 8.025 865 HG2 ARG 214 HG2 ARG 214 11.703 1.055 8.955 866 HG3 ARG 214 HG3 ARG 214 11.758 2.809 9.151 867 HD2 ARG 214 HD2 ARG 214 9.283 2.144 10.153 868 HD3 ARG 214 HD3 ARG 214 10.294 0.797 10.670 869 HE ARG 214 HE ARG 214 11.767 2.961 11.340 870 HH11 ARG 214 HH11 ARG 214 8.470 2.032 11.958 871 HH12 ARG 214 HH12 ARG 214 8.384 2.862 13.477 872 HH21 ARG 214 HH21 ARG 214 11.667 4.057 13.338 873 HH22 ARG 214 HH22 ARG 214 10.202 4.015 14.260 874 H SER 215 H SER 215 12.818 0.233 7.315 875 HA SER 215 HA SER 215 14.792 2.181 7.674 876 HB2 SER 215 HB2 SER 215 15.090 -0.771 7.075 877 HB3 SER 215 HB3 SER 215 16.395 0.275 7.633 878 HG SER 215 HG SER 215 15.468 0.424 9.581 879 H GLU 216 H GLU 216 14.562 -0.194 5.018 880 HA GLU 216 HA GLU 216 16.569 0.869 3.421 881 HB2 GLU 216 HB2 GLU 216 14.064 -0.638 2.670 882 HB3 GLU 216 HB3 GLU 216 15.332 -0.243 1.517 883 HG2 GLU 216 HG2 GLU 216 16.910 -1.597 2.661 884 HG3 GLU 216 HG3 GLU 216 15.823 -1.815 4.031 885 H ARG 217 H ARG 217 13.255 1.880 3.836 886 HA ARG 217 HA ARG 217 13.079 3.525 1.532 887 HB2 ARG 217 HB2 ARG 217 11.157 2.660 2.951 888 HB3 ARG 217 HB3 ARG 217 11.564 3.918 4.110 889 HG2 ARG 217 HG2 ARG 217 11.317 5.010 1.457 890 HG3 ARG 217 HG3 ARG 217 9.861 4.128 1.923 891 HD2 ARG 217 HD2 ARG 217 9.748 5.425 3.998 892 HD3 ARG 217 HD3 ARG 217 11.199 6.307 3.523 893 HE ARG 217 HE ARG 217 8.541 6.809 2.652 894 HH11 ARG 217 HH11 ARG 217 11.864 6.882 1.617 895 HH12 ARG 217 HH12 ARG 217 11.605 8.122 0.434 896 HH21 ARG 217 HH21 ARG 217 8.186 8.441 1.098 897 HH22 ARG 217 HH22 ARG 217 9.512 9.008 0.140 898 H ILE 218 H ILE 218 13.808 4.240 4.938 899 HA ILE 218 HA ILE 218 14.105 6.990 4.747 900 HB ILE 218 HB ILE 218 15.669 5.090 6.500 901 HG12 ILE 218 HG12 ILE 218 13.413 6.735 7.520 902 HG13 ILE 218 HG13 ILE 218 13.000 5.361 6.499 903 HG21 ILE 218 HG21 ILE 218 15.251 8.069 6.715 904 HG22 ILE 218 HG22 ILE 218 15.982 7.058 7.960 905 HG23 ILE 218 HG23 ILE 218 16.772 7.236 6.393 906 HD11 ILE 218 HD11 ILE 218 13.559 5.362 9.239 907 HD12 ILE 218 HD12 ILE 218 13.286 3.971 8.190 908 HD13 ILE 218 HD13 ILE 218 14.925 4.565 8.459 909 H SER 219 H SER 219 16.207 4.453 3.659 910 HA SER 219 HA SER 219 18.331 6.397 3.076 911 HB2 SER 219 HB2 SER 219 18.683 4.084 4.296 912 HB3 SER 219 HB3 SER 219 18.676 3.455 2.649 913 HG SER 219 HG SER 219 20.515 5.129 3.914 914 H ASN 220 H ASN 220 19.455 6.144 0.975 915 HA ASN 220 HA ASN 220 17.542 6.156 -1.158 916 HB2 ASN 220 HB2 ASN 220 19.586 6.590 -2.582 917 HB3 ASN 220 HB3 ASN 220 19.313 7.754 -1.288 918 HD21 ASN 220 HD21 ASN 220 21.555 5.823 -2.769 919 HD22 ASN 220 HD22 ASN 220 22.759 5.797 -1.529 Start of MODEL 14 1 H ALA 23 H ALA 23 5.398 14.081 12.132 2 HA ALA 23 HA ALA 23 3.770 12.708 12.949 3 HB1 ALA 23 HB1 ALA 23 3.687 14.967 14.359 4 HB2 ALA 23 HB2 ALA 23 2.053 15.001 13.694 5 HB3 ALA 23 HB3 ALA 23 2.586 13.621 14.654 6 H ALA 24 H ALA 24 3.546 13.442 10.158 7 HA ALA 24 HA ALA 24 0.689 13.712 9.672 8 HB1 ALA 24 HB1 ALA 24 3.118 14.129 8.141 9 HB2 ALA 24 HB2 ALA 24 1.894 13.242 7.231 10 HB3 ALA 24 HB3 ALA 24 1.509 14.818 7.922 11 HA PRO 25 HA PRO 25 -0.233 9.467 9.051 12 HB2 PRO 25 HB2 PRO 25 -1.907 9.542 6.913 13 HB3 PRO 25 HB3 PRO 25 -2.375 10.110 8.520 14 HG2 PRO 25 HG2 PRO 25 -1.454 11.688 6.149 15 HG3 PRO 25 HG3 PRO 25 -2.777 12.035 7.278 16 HD2 PRO 25 HD2 PRO 25 -0.358 13.239 7.453 17 HD3 PRO 25 HD3 PRO 25 -1.354 12.886 8.880 18 H ASN 26 H ASN 26 1.791 8.625 8.449 19 HA ASN 26 HA ASN 26 2.117 8.208 5.552 20 HB2 ASN 26 HB2 ASN 26 4.476 8.248 7.406 21 HB3 ASN 26 HB3 ASN 26 4.425 8.523 5.667 22 HD21 ASN 26 HD21 ASN 26 2.466 10.397 5.436 23 HD22 ASN 26 HD22 ASN 26 2.953 11.856 6.225 24 H LEU 27 H LEU 27 2.948 6.191 4.899 25 HA LEU 27 HA LEU 27 2.578 4.073 6.901 26 HB2 LEU 27 HB2 LEU 27 1.357 4.317 4.537 27 HB3 LEU 27 HB3 LEU 27 2.788 3.429 4.017 28 HG LEU 27 HG LEU 27 2.194 1.710 5.785 29 HD11 LEU 27 HD11 LEU 27 0.645 3.249 7.012 30 HD12 LEU 27 HD12 LEU 27 -0.021 1.657 6.649 31 HD13 LEU 27 HD13 LEU 27 -0.498 3.053 5.683 32 HD21 LEU 27 HD21 LEU 27 0.915 0.509 4.284 33 HD22 LEU 27 HD22 LEU 27 1.689 1.698 3.235 34 HD23 LEU 27 HD23 LEU 27 0.017 1.930 3.749 35 H ALA 28 H ALA 28 4.414 3.376 7.765 36 HA ALA 28 HA ALA 28 6.578 2.712 8.022 37 HB1 ALA 28 HB1 ALA 28 5.874 1.767 5.282 38 HB2 ALA 28 HB2 ALA 28 7.535 1.600 5.853 39 HB3 ALA 28 HB3 ALA 28 6.216 0.838 6.743 40 H GLY 29 H GLY 29 6.044 5.474 7.141 41 HA2 GLY 29 HA2 GLY 29 7.638 7.214 7.001 42 HA3 GLY 29 HA3 GLY 29 8.771 6.085 6.273 43 H ALA 30 H ALA 30 5.662 5.886 4.944 44 HA ALA 30 HA ALA 30 6.582 7.356 2.571 45 HB1 ALA 30 HB1 ALA 30 4.806 6.062 1.381 46 HB2 ALA 30 HB2 ALA 30 6.089 5.072 2.079 47 HB3 ALA 30 HB3 ALA 30 4.522 5.180 2.882 48 H VAL 31 H VAL 31 5.826 9.358 2.412 49 HA VAL 31 HA VAL 31 3.337 10.113 3.704 50 HB VAL 31 HB VAL 31 5.233 11.837 2.105 51 HG11 VAL 31 HG11 VAL 31 4.107 13.605 3.628 52 HG12 VAL 31 HG12 VAL 31 3.245 13.024 2.203 53 HG13 VAL 31 HG13 VAL 31 2.833 12.398 3.800 54 HG21 VAL 31 HG21 VAL 31 6.640 11.525 3.814 55 HG22 VAL 31 HG22 VAL 31 5.527 12.520 4.750 56 HG23 VAL 31 HG23 VAL 31 5.401 10.762 4.809 57 H GLU 32 H GLU 32 4.712 10.097 0.427 58 HA GLU 32 HA GLU 32 2.377 11.072 -0.848 59 HB2 GLU 32 HB2 GLU 32 4.646 9.438 -1.997 60 HB3 GLU 32 HB3 GLU 32 3.448 10.322 -2.932 61 HG2 GLU 32 HG2 GLU 32 4.302 12.366 -1.556 62 HG3 GLU 32 HG3 GLU 32 5.722 11.353 -1.308 63 H PHE 33 H PHE 33 0.806 9.980 -2.048 64 HA PHE 33 HA PHE 33 -0.157 7.588 -0.933 65 HB2 PHE 33 HB2 PHE 33 -1.757 9.014 -1.929 66 HB3 PHE 33 HB3 PHE 33 -0.857 9.105 -3.439 67 HD1 PHE 33 HD1 PHE 33 -2.919 6.890 -1.321 68 HD2 PHE 33 HD2 PHE 33 -1.208 7.543 -5.164 69 HE1 PHE 33 HE1 PHE 33 -4.279 5.055 -2.237 70 HE2 PHE 33 HE2 PHE 33 -2.565 5.710 -6.084 71 HZ PHE 33 HZ PHE 33 -4.103 4.462 -4.620 72 H SER 34 H SER 34 1.404 8.209 -4.068 73 HA SER 34 HA SER 34 1.341 5.667 -5.129 74 HB2 SER 34 HB2 SER 34 2.940 6.384 -6.652 75 HB3 SER 34 HB3 SER 34 2.297 7.922 -6.077 76 HG SER 34 HG SER 34 4.230 8.371 -5.422 77 H ASP 35 H ASP 35 3.570 7.009 -2.755 78 HA ASP 35 HA ASP 35 5.311 4.748 -2.711 79 HB2 ASP 35 HB2 ASP 35 4.990 7.244 -1.133 80 HB3 ASP 35 HB3 ASP 35 5.814 5.903 -0.341 81 H VAL 36 H VAL 36 2.379 5.638 -1.050 82 HA VAL 36 HA VAL 36 2.596 3.698 1.038 83 HB VAL 36 HB VAL 36 0.153 5.135 -0.011 84 HG11 VAL 36 HG11 VAL 36 -0.154 4.462 2.694 85 HG12 VAL 36 HG12 VAL 36 -1.027 3.796 1.313 86 HG13 VAL 36 HG13 VAL 36 0.440 3.007 1.893 87 HG21 VAL 36 HG21 VAL 36 1.215 5.917 2.587 88 HG22 VAL 36 HG22 VAL 36 2.340 6.212 1.263 89 HG23 VAL 36 HG23 VAL 36 0.723 6.915 1.219 90 H LYS 37 H LYS 37 0.514 3.878 -1.856 91 HA LYS 37 HA LYS 37 -0.612 1.340 -1.641 92 HB2 LYS 37 HB2 LYS 37 -0.930 1.548 -4.155 93 HB3 LYS 37 HB3 LYS 37 -1.602 2.843 -3.172 94 HG2 LYS 37 HG2 LYS 37 -0.131 4.390 -3.950 95 HG3 LYS 37 HG3 LYS 37 1.149 3.203 -4.213 96 HD2 LYS 37 HD2 LYS 37 -1.244 2.877 -5.898 97 HD3 LYS 37 HD3 LYS 37 -0.303 4.340 -6.195 98 HE2 LYS 37 HE2 LYS 37 1.710 2.987 -6.492 99 HE3 LYS 37 HE3 LYS 37 0.780 1.524 -6.175 100 HZ1 LYS 37 HZ1 LYS 37 0.773 1.567 -8.443 101 HZ2 LYS 37 HZ2 LYS 37 0.768 3.256 -8.540 102 HZ3 LYS 37 HZ3 LYS 37 -0.652 2.428 -8.139 103 H THR 38 H THR 38 2.462 2.361 -2.981 104 HA THR 38 HA THR 38 3.106 -0.036 -4.329 105 HB THR 38 HB THR 38 4.887 2.120 -3.186 106 HG1 THR 38 HG1 THR 38 3.457 2.607 -5.005 107 HG21 THR 38 HG21 THR 38 6.189 0.092 -3.321 108 HG22 THR 38 HG22 THR 38 6.647 1.155 -4.653 109 HG23 THR 38 HG23 THR 38 5.591 -0.227 -4.949 110 H LEU 39 H LEU 39 3.631 1.065 -1.019 111 HA LEU 39 HA LEU 39 5.286 -1.115 -0.247 112 HB2 LEU 39 HB2 LEU 39 3.621 0.804 1.371 113 HB3 LEU 39 HB3 LEU 39 4.728 -0.374 2.071 114 HG LEU 39 HG LEU 39 5.752 1.627 0.101 115 HD11 LEU 39 HD11 LEU 39 6.295 3.068 2.107 116 HD12 LEU 39 HD12 LEU 39 5.087 2.132 2.988 117 HD13 LEU 39 HD13 LEU 39 4.613 3.073 1.574 118 HD21 LEU 39 HD21 LEU 39 7.519 0.321 0.595 119 HD22 LEU 39 HD22 LEU 39 6.818 -0.237 2.115 120 HD23 LEU 39 HD23 LEU 39 7.611 1.337 2.034 121 H LEU 40 H LEU 40 1.822 -0.527 -0.197 122 HA LEU 40 HA LEU 40 1.164 -2.821 1.362 123 HB2 LEU 40 HB2 LEU 40 -0.616 -1.359 -0.575 124 HB3 LEU 40 HB3 LEU 40 -1.112 -2.360 0.789 125 HG LEU 40 HG LEU 40 0.509 0.092 1.303 126 HD11 LEU 40 HD11 LEU 40 -2.407 0.445 1.359 127 HD12 LEU 40 HD12 LEU 40 -1.690 0.344 -0.249 128 HD13 LEU 40 HD13 LEU 40 -1.131 1.570 0.890 129 HD21 LEU 40 HD21 LEU 40 -1.542 -1.536 2.773 130 HD22 LEU 40 HD22 LEU 40 -1.067 0.077 3.308 131 HD23 LEU 40 HD23 LEU 40 0.134 -1.211 3.216 132 H LYS 41 H LYS 41 1.140 -2.122 -2.117 133 HA LYS 41 HA LYS 41 0.070 -4.485 -3.066 134 HB2 LYS 41 HB2 LYS 41 0.970 -2.293 -4.269 135 HB3 LYS 41 HB3 LYS 41 2.385 -3.305 -4.529 136 HG2 LYS 41 HG2 LYS 41 0.541 -5.018 -5.361 137 HG3 LYS 41 HG3 LYS 41 -0.342 -3.520 -5.666 138 HD2 LYS 41 HD2 LYS 41 0.825 -4.027 -7.665 139 HD3 LYS 41 HD3 LYS 41 1.708 -2.706 -6.897 140 HE2 LYS 41 HE2 LYS 41 3.079 -4.664 -5.822 141 HE3 LYS 41 HE3 LYS 41 2.456 -5.581 -7.193 142 HZ1 LYS 41 HZ1 LYS 41 3.507 -4.142 -8.703 143 HZ2 LYS 41 HZ2 LYS 41 4.670 -4.461 -7.518 144 HZ3 LYS 41 HZ3 LYS 41 3.843 -2.984 -7.517 145 H GLU 42 H GLU 42 3.429 -3.773 -2.194 146 HA GLU 42 HA GLU 42 4.366 -6.386 -2.921 147 HB2 GLU 42 HB2 GLU 42 6.480 -5.671 -1.869 148 HB3 GLU 42 HB3 GLU 42 5.882 -4.494 -3.031 149 HG2 GLU 42 HG2 GLU 42 4.958 -3.173 -1.158 150 HG3 GLU 42 HG3 GLU 42 5.680 -4.321 -0.033 151 H TRP 43 H TRP 43 3.527 -4.741 0.094 152 HA TRP 43 HA TRP 43 4.335 -6.788 1.849 153 HB2 TRP 43 HB2 TRP 43 3.928 -4.593 2.725 154 HB3 TRP 43 HB3 TRP 43 2.268 -4.604 2.138 155 HD1 TRP 43 HD1 TRP 43 4.379 -6.755 4.602 156 HE1 TRP 43 HE1 TRP 43 2.883 -7.332 6.615 157 HE3 TRP 43 HE3 TRP 43 0.055 -4.494 3.076 158 HZ2 TRP 43 HZ2 TRP 43 0.223 -6.889 7.446 159 HZ3 TRP 43 HZ3 TRP 43 -1.920 -4.618 4.538 160 HH2 TRP 43 HH2 TRP 43 -1.836 -5.792 6.677 161 H ILE 44 H ILE 44 1.754 -6.629 -0.345 162 HA ILE 44 HA ILE 44 0.212 -8.663 1.103 163 HB ILE 44 HB ILE 44 -0.525 -7.061 -1.349 164 HG12 ILE 44 HG12 ILE 44 -1.875 -6.892 1.326 165 HG13 ILE 44 HG13 ILE 44 -0.396 -5.984 1.030 166 HG21 ILE 44 HG21 ILE 44 -1.650 -9.122 -1.536 167 HG22 ILE 44 HG22 ILE 44 -2.006 -9.175 0.190 168 HG23 ILE 44 HG23 ILE 44 -2.825 -8.005 -0.844 169 HD11 ILE 44 HD11 ILE 44 -1.438 -4.479 -0.253 170 HD12 ILE 44 HD12 ILE 44 -2.443 -5.694 -1.043 171 HD13 ILE 44 HD13 ILE 44 -2.894 -5.072 0.544 172 H THR 45 H THR 45 2.485 -8.332 -1.374 173 HA THR 45 HA THR 45 1.665 -10.843 -2.660 174 HB THR 45 HB THR 45 3.289 -10.273 -4.429 175 HG1 THR 45 HG1 THR 45 4.785 -8.896 -3.839 176 HG21 THR 45 HG21 THR 45 0.959 -8.623 -3.727 177 HG22 THR 45 HG22 THR 45 1.344 -9.461 -5.230 178 HG23 THR 45 HG23 THR 45 2.061 -7.887 -4.889 179 H THR 46 H THR 46 4.647 -9.235 -1.536 180 HA THR 46 HA THR 46 6.221 -11.582 -1.572 181 HB THR 46 HB THR 46 7.130 -9.246 -1.570 182 HG1 THR 46 HG1 THR 46 8.886 -9.830 -0.108 183 HG21 THR 46 HG21 THR 46 7.324 -8.950 1.276 184 HG22 THR 46 HG22 THR 46 5.627 -9.047 0.805 185 HG23 THR 46 HG23 THR 46 6.674 -7.825 0.083 186 H ILE 47 H ILE 47 3.832 -10.486 0.590 187 HA ILE 47 HA ILE 47 4.648 -12.538 2.540 188 HB ILE 47 HB ILE 47 3.458 -9.830 3.149 189 HG12 ILE 47 HG12 ILE 47 5.810 -10.565 4.646 190 HG13 ILE 47 HG13 ILE 47 6.126 -10.709 2.920 191 HG21 ILE 47 HG21 ILE 47 3.942 -12.197 4.949 192 HG22 ILE 47 HG22 ILE 47 3.606 -10.565 5.526 193 HG23 ILE 47 HG23 ILE 47 2.398 -11.431 4.577 194 HD11 ILE 47 HD11 ILE 47 6.638 -8.537 3.102 195 HD12 ILE 47 HD12 ILE 47 4.891 -8.314 2.998 196 HD13 ILE 47 HD13 ILE 47 5.687 -8.327 4.572 197 H SER 48 H SER 48 3.162 -14.050 2.881 198 HA SER 48 HA SER 48 0.412 -13.532 1.976 199 HB2 SER 48 HB2 SER 48 0.362 -15.621 1.125 200 HB3 SER 48 HB3 SER 48 2.115 -15.598 1.315 201 HG SER 48 HG SER 48 1.378 -17.407 2.351 202 H ASP 49 H ASP 49 2.364 -14.384 4.705 203 HA ASP 49 HA ASP 49 -0.063 -14.764 6.332 204 HB2 ASP 49 HB2 ASP 49 1.380 -16.721 6.377 205 HB3 ASP 49 HB3 ASP 49 2.762 -15.727 6.825 206 HA PRO 50 HA PRO 50 1.685 -10.667 7.569 207 HB2 PRO 50 HB2 PRO 50 -0.736 -9.467 7.835 208 HB3 PRO 50 HB3 PRO 50 0.121 -9.570 6.292 209 HG2 PRO 50 HG2 PRO 50 -2.112 -11.268 7.334 210 HG3 PRO 50 HG3 PRO 50 -1.884 -10.593 5.710 211 HD2 PRO 50 HD2 PRO 50 -1.307 -13.170 6.310 212 HD3 PRO 50 HD3 PRO 50 -0.401 -12.246 5.094 213 H MET 51 H MET 51 1.730 -9.742 9.618 214 HA MET 51 HA MET 51 0.536 -11.386 11.727 215 HB2 MET 51 HB2 MET 51 2.927 -9.621 11.542 216 HB3 MET 51 HB3 MET 51 2.147 -9.778 13.110 217 HG2 MET 51 HG2 MET 51 2.633 -12.033 13.274 218 HG3 MET 51 HG3 MET 51 2.864 -12.211 11.537 219 HE1 MET 51 HE1 MET 51 5.672 -10.654 14.709 220 HE2 MET 51 HE2 MET 51 4.971 -9.303 13.817 221 HE3 MET 51 HE3 MET 51 3.919 -10.466 14.627 222 H GLU 52 H GLU 52 -0.348 -10.314 13.640 223 HA GLU 52 HA GLU 52 -2.376 -8.515 13.039 224 HB2 GLU 52 HB2 GLU 52 -2.062 -10.045 15.100 225 HB3 GLU 52 HB3 GLU 52 -1.169 -8.694 15.786 226 HG2 GLU 52 HG2 GLU 52 -3.215 -7.281 15.314 227 HG3 GLU 52 HG3 GLU 52 -4.061 -8.795 14.996 228 H GLU 53 H GLU 53 0.861 -7.921 14.325 229 HA GLU 53 HA GLU 53 0.533 -5.169 14.840 230 HB2 GLU 53 HB2 GLU 53 2.382 -6.449 15.784 231 HB3 GLU 53 HB3 GLU 53 3.034 -6.731 14.176 232 HG2 GLU 53 HG2 GLU 53 4.302 -5.006 15.231 233 HG3 GLU 53 HG3 GLU 53 3.359 -4.294 13.925 234 H ASP 54 H ASP 54 1.863 -6.887 12.027 235 HA ASP 54 HA ASP 54 2.566 -4.680 10.491 236 HB2 ASP 54 HB2 ASP 54 1.848 -7.509 9.893 237 HB3 ASP 54 HB3 ASP 54 1.893 -6.375 8.545 238 H ILE 55 H ILE 55 -0.512 -6.466 10.528 239 HA ILE 55 HA ILE 55 -1.801 -4.803 8.634 240 HB ILE 55 HB ILE 55 -3.107 -6.484 10.776 241 HG12 ILE 55 HG12 ILE 55 -2.400 -7.271 7.942 242 HG13 ILE 55 HG13 ILE 55 -1.463 -7.736 9.359 243 HG21 ILE 55 HG21 ILE 55 -5.023 -6.520 9.306 244 HG22 ILE 55 HG22 ILE 55 -4.572 -4.850 9.648 245 HG23 ILE 55 HG23 ILE 55 -4.151 -5.577 8.097 246 HD11 ILE 55 HD11 ILE 55 -3.450 -9.208 8.246 247 HD12 ILE 55 HD12 ILE 55 -2.894 -9.356 9.913 248 HD13 ILE 55 HD13 ILE 55 -4.309 -8.373 9.540 249 H LEU 56 H LEU 56 -1.409 -4.640 12.104 250 HA LEU 56 HA LEU 56 -3.434 -2.766 12.667 251 HB2 LEU 56 HB2 LEU 56 -1.006 -3.768 14.022 252 HB3 LEU 56 HB3 LEU 56 -1.618 -2.206 14.563 253 HG LEU 56 HG LEU 56 -3.444 -4.574 14.412 254 HD11 LEU 56 HD11 LEU 56 -1.791 -3.896 16.831 255 HD12 LEU 56 HD12 LEU 56 -1.357 -5.170 15.693 256 HD13 LEU 56 HD13 LEU 56 -2.868 -5.273 16.595 257 HD21 LEU 56 HD21 LEU 56 -4.761 -3.380 15.921 258 HD22 LEU 56 HD22 LEU 56 -4.165 -2.143 14.814 259 HD23 LEU 56 HD23 LEU 56 -3.426 -2.333 16.405 260 H GLN 57 H GLN 57 -0.087 -2.402 11.634 261 HA GLN 57 HA GLN 57 0.268 0.315 12.056 262 HB2 GLN 57 HB2 GLN 57 1.437 -1.708 10.241 263 HB3 GLN 57 HB3 GLN 57 1.655 -0.030 9.763 264 HG2 GLN 57 HG2 GLN 57 2.329 -0.975 12.524 265 HG3 GLN 57 HG3 GLN 57 3.468 -1.123 11.187 266 HE21 GLN 57 HE21 GLN 57 4.889 0.447 11.134 267 HE22 GLN 57 HE22 GLN 57 4.623 2.088 11.601 268 H VAL 58 H VAL 58 -1.490 -1.353 9.532 269 HA VAL 58 HA VAL 58 -1.807 0.897 7.815 270 HB VAL 58 HB VAL 58 -3.645 -1.489 7.960 271 HG11 VAL 58 HG11 VAL 58 -3.422 0.804 6.240 272 HG12 VAL 58 HG12 VAL 58 -3.181 -0.683 5.321 273 HG13 VAL 58 HG13 VAL 58 -4.652 -0.459 6.269 274 HG21 VAL 58 HG21 VAL 58 -1.767 -2.693 7.624 275 HG22 VAL 58 HG22 VAL 58 -1.932 -2.111 5.968 276 HG23 VAL 58 HG23 VAL 58 -0.838 -1.294 7.084 277 H VAL 59 H VAL 59 -3.641 -0.430 10.500 278 HA VAL 59 HA VAL 59 -6.008 1.052 10.146 279 HB VAL 59 HB VAL 59 -4.786 -0.022 12.692 280 HG11 VAL 59 HG11 VAL 59 -7.101 0.129 13.582 281 HG12 VAL 59 HG12 VAL 59 -6.369 1.700 13.250 282 HG13 VAL 59 HG13 VAL 59 -7.557 1.027 12.134 283 HG21 VAL 59 HG21 VAL 59 -7.113 -1.414 11.783 284 HG22 VAL 59 HG22 VAL 59 -5.932 -1.334 10.477 285 HG23 VAL 59 HG23 VAL 59 -5.479 -2.028 12.034 286 H ARG 60 H ARG 60 -3.168 1.683 12.203 287 HA ARG 60 HA ARG 60 -4.040 4.121 13.260 288 HB2 ARG 60 HB2 ARG 60 -1.200 3.243 12.700 289 HB3 ARG 60 HB3 ARG 60 -1.681 4.539 13.788 290 HG2 ARG 60 HG2 ARG 60 -2.744 1.787 14.223 291 HG3 ARG 60 HG3 ARG 60 -1.099 2.183 14.724 292 HD2 ARG 60 HD2 ARG 60 -3.452 3.878 15.508 293 HD3 ARG 60 HD3 ARG 60 -2.969 2.464 16.447 294 HE ARG 60 HE ARG 60 -1.644 5.011 16.344 295 HH11 ARG 60 HH11 ARG 60 -1.250 1.606 16.960 296 HH12 ARG 60 HH12 ARG 60 0.136 1.818 17.978 297 HH21 ARG 60 HH21 ARG 60 0.179 5.302 17.683 298 HH22 ARG 60 HH22 ARG 60 0.947 3.920 18.389 299 H TYR 61 H TYR 61 -2.683 3.327 10.167 300 HA TYR 61 HA TYR 61 -1.935 5.998 9.459 301 HB2 TYR 61 HB2 TYR 61 -0.798 4.211 8.350 302 HB3 TYR 61 HB3 TYR 61 -2.314 3.479 7.838 303 HD1 TYR 61 HD2 TYR 61 0.051 6.228 7.238 304 HD2 TYR 61 HD1 TYR 61 -3.497 4.294 5.906 305 HE1 TYR 61 HE2 TYR 61 0.179 7.467 5.116 306 HE2 TYR 61 HE1 TYR 61 -3.379 5.525 3.781 307 HH TYR 61 HH TYR 61 -0.993 6.768 2.505 308 H CYS 62 H CYS 62 -4.595 3.856 8.439 309 HA CYS 62 HA CYS 62 -5.943 5.809 6.915 310 HB2 CYS 62 HB2 CYS 62 -6.780 3.192 8.138 311 HB3 CYS 62 HB3 CYS 62 -7.943 4.213 7.303 312 HG CYS 62 HG CYS 62 -5.549 4.075 5.220 313 H THR 63 H THR 63 -6.326 4.730 10.265 314 HA THR 63 HA THR 63 -8.603 6.198 10.924 315 HB THR 63 HB THR 63 -7.757 6.099 13.284 316 HG1 THR 63 HG1 THR 63 -5.494 6.177 12.702 317 HG21 THR 63 HG21 THR 63 -7.287 3.361 12.646 318 HG22 THR 63 HG22 THR 63 -8.524 3.986 11.556 319 HG23 THR 63 HG23 THR 63 -8.745 4.104 13.302 320 H ASP 64 H ASP 64 -5.287 7.195 10.566 321 HA ASP 64 HA ASP 64 -5.554 9.684 11.945 322 HB2 ASP 64 HB2 ASP 64 -3.492 8.488 10.120 323 HB3 ASP 64 HB3 ASP 64 -3.404 10.193 10.557 324 H LEU 65 H LEU 65 -5.880 8.629 8.604 325 HA LEU 65 HA LEU 65 -5.923 11.074 7.301 326 HB2 LEU 65 HB2 LEU 65 -6.852 8.369 6.772 327 HB3 LEU 65 HB3 LEU 65 -7.861 9.593 6.004 328 HG LEU 65 HG LEU 65 -6.064 10.396 4.699 329 HD11 LEU 65 HD11 LEU 65 -4.295 8.748 6.491 330 HD12 LEU 65 HD12 LEU 65 -4.302 10.500 6.290 331 HD13 LEU 65 HD13 LEU 65 -3.754 9.463 4.972 332 HD21 LEU 65 HD21 LEU 65 -6.211 8.680 3.300 333 HD22 LEU 65 HD22 LEU 65 -6.865 7.701 4.614 334 HD23 LEU 65 HD23 LEU 65 -5.128 7.718 4.308 335 H ILE 66 H ILE 66 -8.413 9.504 9.204 336 HA ILE 66 HA ILE 66 -10.594 11.107 8.434 337 HB ILE 66 HB ILE 66 -10.026 9.533 10.933 338 HG12 ILE 66 HG12 ILE 66 -12.372 8.954 9.255 339 HG13 ILE 66 HG13 ILE 66 -10.828 8.757 8.433 340 HG21 ILE 66 HG21 ILE 66 -12.161 11.511 10.425 341 HG22 ILE 66 HG22 ILE 66 -12.657 9.981 11.147 342 HG23 ILE 66 HG23 ILE 66 -11.442 10.978 11.946 343 HD11 ILE 66 HD11 ILE 66 -11.689 7.404 10.978 344 HD12 ILE 66 HD12 ILE 66 -11.528 6.663 9.385 345 HD13 ILE 66 HD13 ILE 66 -10.098 7.249 10.234 346 H GLU 67 H GLU 67 -8.340 11.404 11.171 347 HA GLU 67 HA GLU 67 -9.484 13.852 12.097 348 HB2 GLU 67 HB2 GLU 67 -6.724 12.808 12.724 349 HB3 GLU 67 HB3 GLU 67 -7.705 13.899 13.692 350 HG2 GLU 67 HG2 GLU 67 -9.338 12.050 14.004 351 HG3 GLU 67 HG3 GLU 67 -8.208 10.979 13.178 352 H GLU 68 H GLU 68 -6.889 12.987 9.917 353 HA GLU 68 HA GLU 68 -5.866 15.682 9.751 354 HB2 GLU 68 HB2 GLU 68 -5.235 13.132 8.275 355 HB3 GLU 68 HB3 GLU 68 -4.502 14.672 7.846 356 HG2 GLU 68 HG2 GLU 68 -4.357 13.700 10.660 357 HG3 GLU 68 HG3 GLU 68 -3.271 13.036 9.442 358 H LYS 69 H LYS 69 -8.486 14.064 8.459 359 HA LYS 69 HA LYS 69 -10.010 14.577 6.852 360 HB2 LYS 69 HB2 LYS 69 -8.541 17.197 6.550 361 HB3 LYS 69 HB3 LYS 69 -10.212 16.858 6.123 362 HG2 LYS 69 HG2 LYS 69 -9.171 16.707 8.939 363 HG3 LYS 69 HG3 LYS 69 -9.868 18.167 8.235 364 HD2 LYS 69 HD2 LYS 69 -11.554 15.855 7.792 365 HD3 LYS 69 HD3 LYS 69 -11.238 16.110 9.509 366 HE2 LYS 69 HE2 LYS 69 -11.765 18.632 8.785 367 HE3 LYS 69 HE3 LYS 69 -12.725 17.785 7.573 368 HZ1 LYS 69 HZ1 LYS 69 -14.278 17.489 9.101 369 HZ2 LYS 69 HZ2 LYS 69 -13.320 18.226 10.285 370 HZ3 LYS 69 HZ3 LYS 69 -13.209 16.558 10.023 371 H ASP 70 H ASP 70 -7.791 13.075 6.083 372 HA ASP 70 HA ASP 70 -7.284 14.039 3.345 373 HB2 ASP 70 HB2 ASP 70 -5.610 12.456 5.260 374 HB3 ASP 70 HB3 ASP 70 -5.377 12.242 3.527 375 H LEU 71 H LEU 71 -9.675 12.678 4.120 376 HA LEU 71 HA LEU 71 -9.709 9.943 3.688 377 HB2 LEU 71 HB2 LEU 71 -11.825 11.845 2.711 378 HB3 LEU 71 HB3 LEU 71 -12.028 10.159 3.182 379 HG LEU 71 HG LEU 71 -11.399 12.463 5.027 380 HD11 LEU 71 HD11 LEU 71 -13.584 12.665 5.413 381 HD12 LEU 71 HD12 LEU 71 -13.819 10.918 5.485 382 HD13 LEU 71 HD13 LEU 71 -13.817 11.743 3.927 383 HD21 LEU 71 HD21 LEU 71 -10.481 10.837 6.275 384 HD22 LEU 71 HD22 LEU 71 -11.248 9.548 5.347 385 HD23 LEU 71 HD23 LEU 71 -12.155 10.389 6.605 386 H GLU 72 H GLU 72 -9.168 12.504 1.447 387 HA GLU 72 HA GLU 72 -9.975 11.455 -0.966 388 HB2 GLU 72 HB2 GLU 72 -9.069 13.672 -0.861 389 HB3 GLU 72 HB3 GLU 72 -7.516 13.072 -0.296 390 HG2 GLU 72 HG2 GLU 72 -6.892 12.323 -2.379 391 HG3 GLU 72 HG3 GLU 72 -8.556 12.181 -2.942 392 H LYS 73 H LYS 73 -6.875 10.900 0.686 393 HA LYS 73 HA LYS 73 -6.012 8.980 -1.272 394 HB2 LYS 73 HB2 LYS 73 -4.842 9.490 1.465 395 HB3 LYS 73 HB3 LYS 73 -4.047 8.723 0.097 396 HG2 LYS 73 HG2 LYS 73 -3.343 10.678 -0.665 397 HG3 LYS 73 HG3 LYS 73 -4.982 11.335 -0.641 398 HD2 LYS 73 HD2 LYS 73 -4.144 12.724 0.919 399 HD3 LYS 73 HD3 LYS 73 -4.382 11.352 2.003 400 HE2 LYS 73 HE2 LYS 73 -2.063 10.643 1.575 401 HE3 LYS 73 HE3 LYS 73 -1.837 12.055 0.543 402 HZ1 LYS 73 HZ1 LYS 73 -2.807 13.055 2.901 403 HZ2 LYS 73 HZ2 LYS 73 -1.202 13.114 2.371 404 HZ3 LYS 73 HZ3 LYS 73 -1.713 11.858 3.383 405 H LEU 74 H LEU 74 -7.826 8.911 1.652 406 HA LEU 74 HA LEU 74 -7.343 6.309 2.544 407 HB2 LEU 74 HB2 LEU 74 -8.617 8.082 3.750 408 HB3 LEU 74 HB3 LEU 74 -9.968 7.784 2.658 409 HG LEU 74 HG LEU 74 -10.015 5.424 3.519 410 HD11 LEU 74 HD11 LEU 74 -8.335 6.462 5.779 411 HD12 LEU 74 HD12 LEU 74 -7.634 5.597 4.412 412 HD13 LEU 74 HD13 LEU 74 -8.827 4.802 5.439 413 HD21 LEU 74 HD21 LEU 74 -11.612 7.079 4.286 414 HD22 LEU 74 HD22 LEU 74 -10.464 7.662 5.492 415 HD23 LEU 74 HD23 LEU 74 -11.132 6.034 5.624 416 H ASP 75 H ASP 75 -10.075 7.440 0.545 417 HA ASP 75 HA ASP 75 -11.113 4.930 -0.061 418 HB2 ASP 75 HB2 ASP 75 -11.985 7.382 -0.543 419 HB3 ASP 75 HB3 ASP 75 -11.241 7.095 -2.114 420 H LEU 76 H LEU 76 -8.371 6.605 -1.365 421 HA LEU 76 HA LEU 76 -8.150 5.003 -3.736 422 HB2 LEU 76 HB2 LEU 76 -6.124 6.771 -2.373 423 HB3 LEU 76 HB3 LEU 76 -5.953 6.070 -3.981 424 HG LEU 76 HG LEU 76 -8.175 7.972 -3.272 425 HD11 LEU 76 HD11 LEU 76 -6.279 9.286 -4.858 426 HD12 LEU 76 HD12 LEU 76 -5.374 8.537 -3.544 427 HD13 LEU 76 HD13 LEU 76 -6.709 9.632 -3.184 428 HD21 LEU 76 HD21 LEU 76 -8.356 6.483 -5.287 429 HD22 LEU 76 HD22 LEU 76 -6.942 7.314 -5.940 430 HD23 LEU 76 HD23 LEU 76 -8.426 8.214 -5.622 431 H VAL 77 H VAL 77 -6.550 5.068 -0.573 432 HA VAL 77 HA VAL 77 -4.803 2.889 -1.141 433 HB VAL 77 HB VAL 77 -5.662 4.042 1.516 434 HG11 VAL 77 HG11 VAL 77 -4.204 1.667 0.907 435 HG12 VAL 77 HG12 VAL 77 -3.113 2.833 1.659 436 HG13 VAL 77 HG13 VAL 77 -4.597 2.352 2.483 437 HG21 VAL 77 HG21 VAL 77 -3.004 4.465 0.208 438 HG22 VAL 77 HG22 VAL 77 -4.386 5.466 -0.238 439 HG23 VAL 77 HG23 VAL 77 -3.817 5.441 1.431 440 H ILE 78 H ILE 78 -7.973 3.194 0.356 441 HA ILE 78 HA ILE 78 -8.144 0.551 1.349 442 HB ILE 78 HB ILE 78 -10.291 2.540 0.621 443 HG12 ILE 78 HG12 ILE 78 -8.845 3.135 2.528 444 HG13 ILE 78 HG13 ILE 78 -10.496 2.807 3.043 445 HG21 ILE 78 HG21 ILE 78 -11.277 0.372 0.400 446 HG22 ILE 78 HG22 ILE 78 -10.550 -0.169 1.912 447 HG23 ILE 78 HG23 ILE 78 -11.813 1.061 1.932 448 HD11 ILE 78 HD11 ILE 78 -8.950 0.403 3.154 449 HD12 ILE 78 HD12 ILE 78 -8.135 1.694 4.038 450 HD13 ILE 78 HD13 ILE 78 -9.793 1.255 4.447 451 H LYS 79 H LYS 79 -9.525 2.040 -1.581 452 HA LYS 79 HA LYS 79 -10.578 -0.353 -2.637 453 HB2 LYS 79 HB2 LYS 79 -10.963 0.869 -4.645 454 HB3 LYS 79 HB3 LYS 79 -11.210 1.991 -3.314 455 HG2 LYS 79 HG2 LYS 79 -9.917 3.343 -4.546 456 HG3 LYS 79 HG3 LYS 79 -8.596 2.417 -3.830 457 HD2 LYS 79 HD2 LYS 79 -9.437 0.918 -6.032 458 HD3 LYS 79 HD3 LYS 79 -9.436 2.594 -6.586 459 HE2 LYS 79 HE2 LYS 79 -7.090 2.370 -5.137 460 HE3 LYS 79 HE3 LYS 79 -7.210 0.827 -5.979 461 HZ1 LYS 79 HZ1 LYS 79 -6.433 1.863 -7.761 462 HZ2 LYS 79 HZ2 LYS 79 -6.529 3.377 -7.014 463 HZ3 LYS 79 HZ3 LYS 79 -7.869 2.753 -7.838 464 H TYR 80 H TYR 80 -7.396 0.999 -2.640 465 HA TYR 80 HA TYR 80 -6.433 -0.602 -4.837 466 HB2 TYR 80 HB2 TYR 80 -5.426 1.579 -4.398 467 HB3 TYR 80 HB3 TYR 80 -4.948 1.055 -2.787 468 HD1 TYR 80 HD1 TYR 80 -3.176 -0.670 -2.528 469 HD2 TYR 80 HD2 TYR 80 -4.129 1.016 -6.315 470 HE1 TYR 80 HE1 TYR 80 -1.037 -1.489 -3.424 471 HE2 TYR 80 HE2 TYR 80 -1.994 0.200 -7.223 472 HH TYR 80 HH TYR 80 0.006 -0.692 -6.702 473 H MET 81 H MET 81 -6.149 -0.638 -1.304 474 HA MET 81 HA MET 81 -4.508 -2.976 -1.243 475 HB2 MET 81 HB2 MET 81 -4.639 -2.835 1.106 476 HB3 MET 81 HB3 MET 81 -4.672 -1.168 0.548 477 HG2 MET 81 HG2 MET 81 -7.023 -1.015 0.911 478 HG3 MET 81 HG3 MET 81 -7.136 -2.743 1.238 479 HE1 MET 81 HE1 MET 81 -4.883 0.406 3.130 480 HE2 MET 81 HE2 MET 81 -6.341 0.638 2.165 481 HE3 MET 81 HE3 MET 81 -6.436 0.668 3.926 482 H LYS 82 H LYS 82 -7.947 -2.338 -1.105 483 HA LYS 82 HA LYS 82 -8.731 -4.927 -0.229 484 HB2 LYS 82 HB2 LYS 82 -10.932 -4.227 -0.574 485 HB3 LYS 82 HB3 LYS 82 -10.085 -2.731 -0.205 486 HG2 LYS 82 HG2 LYS 82 -11.237 -2.019 -2.012 487 HG3 LYS 82 HG3 LYS 82 -9.837 -2.686 -2.856 488 HD2 LYS 82 HD2 LYS 82 -11.536 -3.674 -4.036 489 HD3 LYS 82 HD3 LYS 82 -11.272 -4.895 -2.790 490 HE2 LYS 82 HE2 LYS 82 -13.360 -4.660 -2.070 491 HE3 LYS 82 HE3 LYS 82 -13.109 -2.933 -1.816 492 HZ1 LYS 82 HZ1 LYS 82 -14.369 -2.493 -3.564 493 HZ2 LYS 82 HZ2 LYS 82 -14.715 -4.141 -3.723 494 HZ3 LYS 82 HZ3 LYS 82 -13.417 -3.464 -4.571 495 H ARG 83 H ARG 83 -8.054 -3.503 -3.349 496 HA ARG 83 HA ARG 83 -9.224 -5.578 -4.911 497 HB2 ARG 83 HB2 ARG 83 -8.607 -4.336 -6.701 498 HB3 ARG 83 HB3 ARG 83 -8.338 -3.094 -5.484 499 HG2 ARG 83 HG2 ARG 83 -5.948 -3.914 -5.367 500 HG3 ARG 83 HG3 ARG 83 -6.304 -4.851 -6.819 501 HD2 ARG 83 HD2 ARG 83 -6.569 -1.860 -6.533 502 HD3 ARG 83 HD3 ARG 83 -5.262 -2.705 -7.362 503 HE ARG 83 HE ARG 83 -7.878 -2.159 -8.381 504 HH11 ARG 83 HH11 ARG 83 -5.190 -4.366 -8.534 505 HH12 ARG 83 HH12 ARG 83 -5.557 -4.908 -10.137 506 HH21 ARG 83 HH21 ARG 83 -8.372 -2.864 -10.493 507 HH22 ARG 83 HH22 ARG 83 -7.367 -4.052 -11.251 508 H LEU 84 H LEU 84 -6.122 -5.103 -3.395 509 HA LEU 84 HA LEU 84 -4.841 -7.247 -4.842 510 HB2 LEU 84 HB2 LEU 84 -3.928 -5.786 -2.369 511 HB3 LEU 84 HB3 LEU 84 -2.941 -6.826 -3.395 512 HG LEU 84 HG LEU 84 -4.219 -4.346 -4.495 513 HD11 LEU 84 HD11 LEU 84 -3.053 -3.204 -2.939 514 HD12 LEU 84 HD12 LEU 84 -1.705 -3.530 -4.026 515 HD13 LEU 84 HD13 LEU 84 -1.960 -4.548 -2.609 516 HD21 LEU 84 HD21 LEU 84 -2.099 -4.497 -5.905 517 HD22 LEU 84 HD22 LEU 84 -3.344 -5.714 -6.187 518 HD23 LEU 84 HD23 LEU 84 -1.913 -6.120 -5.240 519 H MET 85 H MET 85 -5.711 -6.715 -1.421 520 HA MET 85 HA MET 85 -5.123 -9.253 -0.477 521 HB2 MET 85 HB2 MET 85 -7.262 -7.316 0.416 522 HB3 MET 85 HB3 MET 85 -6.811 -8.759 1.313 523 HG2 MET 85 HG2 MET 85 -4.465 -7.844 1.372 524 HG3 MET 85 HG3 MET 85 -5.131 -6.338 0.747 525 HE1 MET 85 HE1 MET 85 -4.194 -5.361 4.123 526 HE2 MET 85 HE2 MET 85 -4.080 -5.195 2.371 527 HE3 MET 85 HE3 MET 85 -5.383 -4.393 3.251 528 H GLN 86 H GLN 86 -7.824 -8.158 -2.362 529 HA GLN 86 HA GLN 86 -9.458 -10.468 -1.841 530 HB2 GLN 86 HB2 GLN 86 -9.653 -8.086 -3.642 531 HB3 GLN 86 HB3 GLN 86 -10.685 -9.479 -3.941 532 HG2 GLN 86 HG2 GLN 86 -11.507 -9.304 -1.608 533 HG3 GLN 86 HG3 GLN 86 -10.566 -7.823 -1.434 534 HE21 GLN 86 HE21 GLN 86 -12.893 -7.188 -0.901 535 HE22 GLN 86 HE22 GLN 86 -13.819 -6.551 -2.213 536 H GLN 87 H GLN 87 -7.339 -9.358 -4.441 537 HA GLN 87 HA GLN 87 -7.822 -11.774 -5.981 538 HB2 GLN 87 HB2 GLN 87 -6.657 -10.753 -7.735 539 HB3 GLN 87 HB3 GLN 87 -7.496 -9.418 -6.956 540 HG2 GLN 87 HG2 GLN 87 -5.391 -8.939 -5.698 541 HG3 GLN 87 HG3 GLN 87 -4.591 -10.145 -6.705 542 HE21 GLN 87 HE21 GLN 87 -6.971 -7.616 -7.415 543 HE22 GLN 87 HE22 GLN 87 -6.032 -6.832 -8.635 544 H SER 88 H SER 88 -6.208 -11.359 -3.299 545 HA SER 88 HA SER 88 -3.568 -12.214 -3.878 546 HB2 SER 88 HB2 SER 88 -3.380 -12.628 -1.474 547 HB3 SER 88 HB3 SER 88 -4.187 -11.088 -1.765 548 HG SER 88 HG SER 88 -6.196 -12.338 -1.529 549 H VAL 89 H VAL 89 -2.864 -14.333 -2.520 550 HA VAL 89 HA VAL 89 -4.310 -16.522 -3.828 551 HB VAL 89 HB VAL 89 -1.977 -16.518 -4.344 552 HG11 VAL 89 HG11 VAL 89 -0.678 -17.034 -1.901 553 HG12 VAL 89 HG12 VAL 89 -0.512 -15.617 -2.939 554 HG13 VAL 89 HG13 VAL 89 -1.704 -15.623 -1.640 555 HG21 VAL 89 HG21 VAL 89 -3.008 -18.709 -3.943 556 HG22 VAL 89 HG22 VAL 89 -1.290 -18.709 -3.540 557 HG23 VAL 89 HG23 VAL 89 -2.498 -18.634 -2.257 558 H GLU 90 H GLU 90 -3.366 -15.320 -0.683 559 HA GLU 90 HA GLU 90 -4.462 -17.694 0.630 560 HB2 GLU 90 HB2 GLU 90 -2.845 -15.350 1.611 561 HB3 GLU 90 HB3 GLU 90 -3.637 -16.455 2.724 562 HG2 GLU 90 HG2 GLU 90 -1.747 -17.412 0.603 563 HG3 GLU 90 HG3 GLU 90 -1.196 -16.887 2.192 564 H SER 91 H SER 91 -6.520 -17.726 1.207 565 HA SER 91 HA SER 91 -8.299 -15.606 0.940 566 HB2 SER 91 HB2 SER 91 -8.918 -17.684 2.980 567 HB3 SER 91 HB3 SER 91 -9.915 -17.065 1.664 568 HG SER 91 HG SER 91 -8.681 -18.296 0.220 569 H VAL 92 H VAL 92 -6.182 -16.432 3.551 570 HA VAL 92 HA VAL 92 -7.411 -15.204 5.715 571 HB VAL 92 HB VAL 92 -5.337 -16.564 5.851 572 HG11 VAL 92 HG11 VAL 92 -3.356 -15.948 4.972 573 HG12 VAL 92 HG12 VAL 92 -4.360 -14.960 3.910 574 HG13 VAL 92 HG13 VAL 92 -3.608 -14.240 5.334 575 HG21 VAL 92 HG21 VAL 92 -6.124 -14.421 7.416 576 HG22 VAL 92 HG22 VAL 92 -4.982 -15.686 7.870 577 HG23 VAL 92 HG23 VAL 92 -4.393 -14.171 7.187 578 H TRP 93 H TRP 93 -5.702 -13.804 3.012 579 HA TRP 93 HA TRP 93 -5.227 -11.245 4.074 580 HB2 TRP 93 HB2 TRP 93 -5.286 -12.466 1.382 581 HB3 TRP 93 HB3 TRP 93 -5.547 -10.724 1.432 582 HD1 TRP 93 HD1 TRP 93 -2.838 -12.910 0.817 583 HE1 TRP 93 HE1 TRP 93 -0.567 -11.924 1.521 584 HE3 TRP 93 HE3 TRP 93 -4.495 -9.150 3.860 585 HZ2 TRP 93 HZ2 TRP 93 0.394 -9.830 3.151 586 HZ3 TRP 93 HZ3 TRP 93 -2.834 -7.701 4.954 587 HH2 TRP 93 HH2 TRP 93 -0.441 -8.036 4.607 588 H ASN 94 H ASN 94 -8.035 -12.654 2.487 589 HA ASN 94 HA ASN 94 -9.520 -10.359 1.998 590 HB2 ASN 94 HB2 ASN 94 -10.663 -13.002 2.914 591 HB3 ASN 94 HB3 ASN 94 -11.460 -11.780 1.928 592 HD21 ASN 94 HD21 ASN 94 -9.453 -11.166 0.148 593 HD22 ASN 94 HD22 ASN 94 -9.133 -12.540 -0.847 594 H MET 95 H MET 95 -9.229 -12.274 4.956 595 HA MET 95 HA MET 95 -11.165 -10.772 6.415 596 HB2 MET 95 HB2 MET 95 -8.935 -12.432 7.583 597 HB3 MET 95 HB3 MET 95 -10.481 -12.036 8.322 598 HG2 MET 95 HG2 MET 95 -11.483 -13.313 6.301 599 HG3 MET 95 HG3 MET 95 -9.865 -13.997 6.160 600 HE1 MET 95 HE1 MET 95 -8.974 -15.479 9.199 601 HE2 MET 95 HE2 MET 95 -9.626 -16.708 8.115 602 HE3 MET 95 HE3 MET 95 -8.763 -15.318 7.455 603 H ALA 96 H ALA 96 -7.686 -10.580 5.983 604 HA ALA 96 HA ALA 96 -6.998 -8.871 8.054 605 HB1 ALA 96 HB1 ALA 96 -5.402 -8.032 5.971 606 HB2 ALA 96 HB2 ALA 96 -5.061 -9.372 7.068 607 HB3 ALA 96 HB3 ALA 96 -5.838 -9.679 5.514 608 H PHE 97 H PHE 97 -8.337 -8.113 4.870 609 HA PHE 97 HA PHE 97 -8.102 -5.322 5.013 610 HB2 PHE 97 HB2 PHE 97 -8.600 -6.469 2.919 611 HB3 PHE 97 HB3 PHE 97 -10.149 -7.008 3.558 612 HD1 PHE 97 HD2 PHE 97 -8.436 -3.697 3.585 613 HD2 PHE 97 HD1 PHE 97 -11.839 -5.965 2.406 614 HE1 PHE 97 HE2 PHE 97 -9.496 -1.651 2.725 615 HE2 PHE 97 HE1 PHE 97 -12.905 -3.922 1.543 616 HZ PHE 97 HZ PHE 97 -11.733 -1.761 1.701 617 H ASP 98 H ASP 98 -10.811 -7.454 5.876 618 HA ASP 98 HA ASP 98 -12.586 -5.448 6.698 619 HB2 ASP 98 HB2 ASP 98 -13.162 -7.858 6.277 620 HB3 ASP 98 HB3 ASP 98 -12.417 -8.247 7.826 621 H PHE 99 H PHE 99 -10.044 -7.163 8.430 622 HA PHE 99 HA PHE 99 -10.628 -6.390 11.032 623 HB2 PHE 99 HB2 PHE 99 -8.927 -7.992 10.797 624 HB3 PHE 99 HB3 PHE 99 -8.046 -7.016 9.626 625 HD1 PHE 99 HD2 PHE 99 -8.803 -7.493 13.181 626 HD2 PHE 99 HD1 PHE 99 -6.536 -5.294 10.328 627 HE1 PHE 99 HE2 PHE 99 -7.381 -6.619 14.989 628 HE2 PHE 99 HE1 PHE 99 -5.109 -4.418 12.131 629 HZ PHE 99 HZ PHE 99 -5.531 -5.081 14.466 630 H ILE 100 H ILE 100 -8.728 -4.697 8.563 631 HA ILE 100 HA ILE 100 -7.990 -2.512 10.201 632 HB ILE 100 HB ILE 100 -8.237 -2.638 7.193 633 HG12 ILE 100 HG12 ILE 100 -5.606 -2.669 8.559 634 HG13 ILE 100 HG13 ILE 100 -6.576 -4.130 8.708 635 HG21 ILE 100 HG21 ILE 100 -7.271 -0.543 9.061 636 HG22 ILE 100 HG22 ILE 100 -6.392 -0.777 7.551 637 HG23 ILE 100 HG23 ILE 100 -8.111 -0.384 7.519 638 HD11 ILE 100 HD11 ILE 100 -6.479 -4.577 6.450 639 HD12 ILE 100 HD12 ILE 100 -6.124 -2.902 6.027 640 HD13 ILE 100 HD13 ILE 100 -4.880 -3.906 6.772 641 H LEU 101 H LEU 101 -10.597 -2.921 7.817 642 HA LEU 101 HA LEU 101 -11.685 -0.352 8.027 643 HB2 LEU 101 HB2 LEU 101 -12.898 -3.003 7.296 644 HB3 LEU 101 HB3 LEU 101 -13.819 -1.501 7.255 645 HG LEU 101 HG LEU 101 -11.274 -1.794 5.694 646 HD11 LEU 101 HD11 LEU 101 -13.828 -3.139 5.226 647 HD12 LEU 101 HD12 LEU 101 -12.234 -3.451 4.538 648 HD13 LEU 101 HD13 LEU 101 -13.254 -2.184 3.858 649 HD21 LEU 101 HD21 LEU 101 -13.725 -0.054 5.509 650 HD22 LEU 101 HD22 LEU 101 -12.504 -0.150 4.239 651 HD23 LEU 101 HD23 LEU 101 -12.065 0.439 5.843 652 H ASP 102 H ASP 102 -12.231 -3.265 9.929 653 HA ASP 102 HA ASP 102 -14.471 -2.442 11.377 654 HB2 ASP 102 HB2 ASP 102 -13.108 -4.722 11.311 655 HB3 ASP 102 HB3 ASP 102 -12.366 -4.043 12.756 656 H ASN 103 H ASN 103 -11.155 -1.487 11.613 657 HA ASN 103 HA ASN 103 -11.621 -0.163 14.184 658 HB2 ASN 103 HB2 ASN 103 -9.131 -0.777 12.602 659 HB3 ASN 103 HB3 ASN 103 -9.112 0.350 13.955 660 HD21 ASN 103 HD21 ASN 103 -10.021 -2.947 13.074 661 HD22 ASN 103 HD22 ASN 103 -9.667 -3.645 14.615 662 H VAL 104 H VAL 104 -10.655 0.534 10.852 663 HA VAL 104 HA VAL 104 -10.398 3.346 11.240 664 HB VAL 104 HB VAL 104 -10.766 1.739 8.709 665 HG11 VAL 104 HG11 VAL 104 -11.515 3.987 8.302 666 HG12 VAL 104 HG12 VAL 104 -10.080 4.651 9.085 667 HG13 VAL 104 HG13 VAL 104 -9.930 3.774 7.561 668 HG21 VAL 104 HG21 VAL 104 -8.446 1.778 8.465 669 HG22 VAL 104 HG22 VAL 104 -8.248 3.074 9.645 670 HG23 VAL 104 HG23 VAL 104 -8.679 1.451 10.183 671 H GLN 105 H GLN 105 -12.849 1.446 9.469 672 HA GLN 105 HA GLN 105 -14.626 3.449 8.885 673 HB2 GLN 105 HB2 GLN 105 -15.347 0.638 9.730 674 HB3 GLN 105 HB3 GLN 105 -16.366 1.732 8.803 675 HG2 GLN 105 HG2 GLN 105 -13.671 0.825 7.843 676 HG3 GLN 105 HG3 GLN 105 -15.156 -0.062 7.507 677 HE21 GLN 105 HE21 GLN 105 -13.409 2.911 6.967 678 HE22 GLN 105 HE22 GLN 105 -14.308 3.417 5.583 679 H VAL 106 H VAL 106 -14.024 1.936 11.959 680 HA VAL 106 HA VAL 106 -16.398 2.839 13.255 681 HB VAL 106 HB VAL 106 -13.788 1.725 14.221 682 HG11 VAL 106 HG11 VAL 106 -14.990 1.819 16.536 683 HG12 VAL 106 HG12 VAL 106 -14.076 3.213 15.958 684 HG13 VAL 106 HG13 VAL 106 -15.835 3.193 15.824 685 HG21 VAL 106 HG21 VAL 106 -15.134 -0.088 14.992 686 HG22 VAL 106 HG22 VAL 106 -16.621 0.814 14.699 687 HG23 VAL 106 HG23 VAL 106 -15.634 0.276 13.340 688 H VAL 107 H VAL 107 -13.008 3.936 13.426 689 HA VAL 107 HA VAL 107 -13.568 6.221 15.000 690 HB VAL 107 HB VAL 107 -11.329 5.329 14.958 691 HG11 VAL 107 HG11 VAL 107 -10.974 4.369 12.891 692 HG12 VAL 107 HG12 VAL 107 -11.567 5.781 12.015 693 HG13 VAL 107 HG13 VAL 107 -9.979 5.820 12.783 694 HG21 VAL 107 HG21 VAL 107 -11.537 7.708 15.396 695 HG22 VAL 107 HG22 VAL 107 -10.049 7.380 14.509 696 HG23 VAL 107 HG23 VAL 107 -11.444 8.055 13.669 697 H LEU 108 H LEU 108 -13.720 5.590 11.596 698 HA LEU 108 HA LEU 108 -13.643 8.318 10.747 699 HB2 LEU 108 HB2 LEU 108 -13.430 7.374 8.757 700 HB3 LEU 108 HB3 LEU 108 -13.602 5.797 9.525 701 HG LEU 108 HG LEU 108 -16.111 6.090 9.206 702 HD11 LEU 108 HD11 LEU 108 -16.794 8.084 8.504 703 HD12 LEU 108 HD12 LEU 108 -16.110 7.677 6.930 704 HD13 LEU 108 HD13 LEU 108 -15.151 8.582 8.099 705 HD21 LEU 108 HD21 LEU 108 -15.108 6.006 6.484 706 HD22 LEU 108 HD22 LEU 108 -15.869 4.741 7.449 707 HD23 LEU 108 HD23 LEU 108 -14.135 5.033 7.588 708 H GLN 109 H GLN 109 -16.190 6.011 11.532 709 HA GLN 109 HA GLN 109 -18.359 7.606 10.657 710 HB2 GLN 109 HB2 GLN 109 -18.064 5.227 12.441 711 HB3 GLN 109 HB3 GLN 109 -19.591 6.100 12.435 712 HG2 GLN 109 HG2 GLN 109 -19.887 5.691 10.096 713 HG3 GLN 109 HG3 GLN 109 -18.273 4.994 9.968 714 HE21 GLN 109 HE21 GLN 109 -17.969 3.181 11.720 715 HE22 GLN 109 HE22 GLN 109 -19.224 1.993 11.733 716 H GLN 110 H GLN 110 -16.729 7.254 13.774 717 HA GLN 110 HA GLN 110 -18.495 8.855 15.274 718 HB2 GLN 110 HB2 GLN 110 -15.574 8.198 15.667 719 HB3 GLN 110 HB3 GLN 110 -16.532 9.088 16.842 720 HG2 GLN 110 HG2 GLN 110 -18.097 7.118 16.890 721 HG3 GLN 110 HG3 GLN 110 -16.891 6.245 15.946 722 HE21 GLN 110 HE21 GLN 110 -15.116 5.444 16.936 723 HE22 GLN 110 HE22 GLN 110 -14.817 5.560 18.634 724 H THR 111 H THR 111 -16.268 9.667 12.855 725 HA THR 111 HA THR 111 -15.920 12.407 13.813 726 HB THR 111 HB THR 111 -14.735 10.976 11.428 727 HG1 THR 111 HG1 THR 111 -13.434 11.999 13.742 728 HG21 THR 111 HG21 THR 111 -13.320 12.984 11.178 729 HG22 THR 111 HG22 THR 111 -14.272 13.790 12.425 730 HG23 THR 111 HG23 THR 111 -15.026 13.330 10.900 731 H TYR 112 H TYR 112 -16.831 10.856 10.728 732 HA TYR 112 HA TYR 112 -18.448 13.221 10.097 733 HB2 TYR 112 HB2 TYR 112 -17.749 10.984 8.201 734 HB3 TYR 112 HB3 TYR 112 -18.290 12.611 7.808 735 HD1 TYR 112 HD1 TYR 112 -15.441 10.563 8.873 736 HD2 TYR 112 HD2 TYR 112 -16.747 14.476 7.830 737 HE1 TYR 112 HE1 TYR 112 -13.099 11.285 8.672 738 HE2 TYR 112 HE2 TYR 112 -14.408 15.209 7.625 739 HH TYR 112 HH TYR 112 -11.922 13.329 7.220 740 H GLY 113 H GLY 113 -18.606 9.683 10.234 741 HA2 GLY 113 HA2 GLY 113 -20.606 8.681 11.205 742 HA3 GLY 113 HA3 GLY 113 -21.544 9.930 10.399 743 H SER 114 H SER 114 -19.533 9.394 8.061 744 HA SER 114 HA SER 114 -21.227 7.358 6.826 745 HB2 SER 114 HB2 SER 114 -20.500 9.708 5.821 746 HB3 SER 114 HB3 SER 114 -19.095 8.781 5.296 747 HG SER 114 HG SER 114 -20.799 8.775 3.748 748 H THR 115 H THR 115 -19.719 6.223 4.949 749 HA THR 115 HA THR 115 -17.231 5.249 6.077 750 HB THR 115 HB THR 115 -17.892 2.871 5.938 751 HG1 THR 115 HG1 THR 115 -19.796 2.335 5.181 752 HG21 THR 115 HG21 THR 115 -19.807 4.284 7.777 753 HG22 THR 115 HG22 THR 115 -18.066 4.293 8.061 754 HG23 THR 115 HG23 THR 115 -18.948 2.766 8.036 755 H LEU 116 H LEU 116 -16.545 3.245 4.542 756 HA LEU 116 HA LEU 116 -16.606 4.376 1.848 757 HB2 LEU 116 HB2 LEU 116 -14.606 3.209 3.429 758 HB3 LEU 116 HB3 LEU 116 -14.920 2.062 2.128 759 HG LEU 116 HG LEU 116 -14.710 4.425 0.766 760 HD11 LEU 116 HD11 LEU 116 -13.961 5.812 2.466 761 HD12 LEU 116 HD12 LEU 116 -12.463 5.283 1.702 762 HD13 LEU 116 HD13 LEU 116 -12.989 4.543 3.212 763 HD21 LEU 116 HD21 LEU 116 -12.191 2.962 1.256 764 HD22 LEU 116 HD22 LEU 116 -12.984 3.385 -0.261 765 HD23 LEU 116 HD23 LEU 116 -13.557 2.008 0.681 766 H LYS 117 H LYS 117 -17.137 3.168 0.019 767 HA LYS 117 HA LYS 117 -18.870 0.865 0.567 768 HB2 LYS 117 HB2 LYS 117 -19.927 2.714 -0.620 769 HB3 LYS 117 HB3 LYS 117 -18.680 2.660 -1.859 770 HG2 LYS 117 HG2 LYS 117 -20.085 0.123 -1.441 771 HG3 LYS 117 HG3 LYS 117 -21.098 1.443 -2.031 772 HD2 LYS 117 HD2 LYS 117 -20.250 1.231 -4.076 773 HD3 LYS 117 HD3 LYS 117 -18.610 1.434 -3.452 774 HE2 LYS 117 HE2 LYS 117 -18.646 -0.668 -4.533 775 HE3 LYS 117 HE3 LYS 117 -18.692 -1.007 -2.805 776 HZ1 LYS 117 HZ1 LYS 117 -20.407 -2.000 -4.654 777 HZ2 LYS 117 HZ2 LYS 117 -21.300 -0.736 -3.970 778 HZ3 LYS 117 HZ3 LYS 117 -20.680 -1.964 -2.985 779 H VAL 118 H VAL 118 -17.657 -0.943 0.532 780 HA VAL 118 HA VAL 118 -15.893 -1.361 -1.794 781 HB VAL 118 HB VAL 118 -14.813 -3.141 -0.329 782 HG11 VAL 118 HG11 VAL 118 -14.162 -0.582 -0.758 783 HG12 VAL 118 HG12 VAL 118 -14.345 -0.540 0.997 784 HG13 VAL 118 HG13 VAL 118 -13.202 -1.660 0.255 785 HG21 VAL 118 HG21 VAL 118 -16.911 -2.585 1.357 786 HG22 VAL 118 HG22 VAL 118 -15.447 -3.466 1.791 787 HG23 VAL 118 HG23 VAL 118 -15.562 -1.736 2.112 788 H THR 119 H THR 119 -16.965 -2.524 -3.260 789 HA THR 119 HA THR 119 -19.133 -4.216 -2.783 790 HB THR 119 HB THR 119 -17.462 -4.958 -5.093 791 HG1 THR 119 HG1 THR 119 -17.936 -2.922 -6.134 792 HG21 THR 119 HG21 THR 119 -20.295 -3.934 -4.860 793 HG22 THR 119 HG22 THR 119 -19.820 -5.632 -4.813 794 HG23 THR 119 HG23 THR 119 -19.566 -4.686 -6.279 795 H LYS 207 H LYS 207 7.641 -7.259 16.293 796 HA LYS 207 HA LYS 207 9.721 -7.186 14.208 797 HB2 LYS 207 HB2 LYS 207 9.015 -9.604 13.764 798 HB3 LYS 207 HB3 LYS 207 9.985 -9.301 15.199 799 HG2 LYS 207 HG2 LYS 207 7.032 -9.270 15.489 800 HG3 LYS 207 HG3 LYS 207 7.830 -10.827 15.257 801 HD2 LYS 207 HD2 LYS 207 9.435 -9.840 17.135 802 HD3 LYS 207 HD3 LYS 207 7.977 -8.929 17.537 803 HE2 LYS 207 HE2 LYS 207 6.734 -10.913 17.901 804 HE3 LYS 207 HE3 LYS 207 7.988 -11.917 17.176 805 HZ1 LYS 207 HZ1 LYS 207 9.313 -10.700 19.177 806 HZ2 LYS 207 HZ2 LYS 207 8.619 -12.239 19.281 807 HZ3 LYS 207 HZ3 LYS 207 7.778 -10.892 19.862 808 H SER 208 H SER 208 9.059 -6.963 12.136 809 HA SER 208 HA SER 208 6.548 -7.655 11.110 810 HB2 SER 208 HB2 SER 208 5.219 -5.819 11.311 811 HB3 SER 208 HB3 SER 208 6.222 -5.502 12.726 812 HG SER 208 HG SER 208 6.006 -3.705 11.244 813 H PHE 209 H PHE 209 6.151 -6.602 8.933 814 HA PHE 209 HA PHE 209 8.658 -6.552 7.502 815 HB2 PHE 209 HB2 PHE 209 6.889 -7.792 6.477 816 HB3 PHE 209 HB3 PHE 209 5.776 -6.433 6.609 817 HD1 PHE 209 HD2 PHE 209 8.799 -7.660 4.880 818 HD2 PHE 209 HD1 PHE 209 5.669 -4.777 4.940 819 HE1 PHE 209 HE2 PHE 209 9.435 -6.927 2.619 820 HE2 PHE 209 HE1 PHE 209 6.299 -4.040 2.679 821 HZ PHE 209 HZ PHE 209 8.185 -5.114 1.516 822 H PHE 210 H PHE 210 6.048 -4.304 8.257 823 HA PHE 210 HA PHE 210 6.951 -2.174 6.638 824 HB2 PHE 210 HB2 PHE 210 5.144 -2.336 9.037 825 HB3 PHE 210 HB3 PHE 210 5.564 -0.783 8.320 826 HD1 PHE 210 HD1 PHE 210 5.384 -0.942 5.579 827 HD2 PHE 210 HD2 PHE 210 3.092 -3.124 8.425 828 HE1 PHE 210 HE1 PHE 210 3.594 -1.224 3.915 829 HE2 PHE 210 HE2 PHE 210 1.299 -3.411 6.766 830 HZ PHE 210 HZ PHE 210 1.547 -2.460 4.508 831 H ASP 211 H ASP 211 7.909 -3.341 9.756 832 HA ASP 211 HA ASP 211 9.254 -0.942 10.575 833 HB2 ASP 211 HB2 ASP 211 8.965 -3.710 11.628 834 HB3 ASP 211 HB3 ASP 211 10.368 -2.786 12.161 835 H LYS 212 H LYS 212 10.234 -4.031 9.152 836 HA LYS 212 HA LYS 212 13.021 -3.353 9.120 837 HB2 LYS 212 HB2 LYS 212 13.361 -5.441 8.036 838 HB3 LYS 212 HB3 LYS 212 12.084 -5.699 9.218 839 HG2 LYS 212 HG2 LYS 212 10.407 -5.585 7.475 840 HG3 LYS 212 HG3 LYS 212 11.650 -5.232 6.274 841 HD2 LYS 212 HD2 LYS 212 11.904 -7.696 7.934 842 HD3 LYS 212 HD3 LYS 212 10.744 -7.678 6.603 843 HE2 LYS 212 HE2 LYS 212 12.382 -7.489 5.002 844 HE3 LYS 212 HE3 LYS 212 13.524 -6.725 6.106 845 HZ1 LYS 212 HZ1 LYS 212 13.570 -9.324 5.343 846 HZ2 LYS 212 HZ2 LYS 212 12.835 -9.408 6.863 847 HZ3 LYS 212 HZ3 LYS 212 14.358 -8.689 6.699 848 H LYS 213 H LYS 213 10.321 -2.872 7.019 849 HA LYS 213 HA LYS 213 11.925 -2.352 4.671 850 HB2 LYS 213 HB2 LYS 213 9.758 -3.288 4.288 851 HB3 LYS 213 HB3 LYS 213 8.982 -2.049 5.265 852 HG2 LYS 213 HG2 LYS 213 8.611 -1.654 2.901 853 HG3 LYS 213 HG3 LYS 213 9.579 -0.359 3.611 854 HD2 LYS 213 HD2 LYS 213 11.105 -0.702 2.029 855 HD3 LYS 213 HD3 LYS 213 11.404 -2.299 2.717 856 HE2 LYS 213 HE2 LYS 213 9.283 -2.953 1.320 857 HE3 LYS 213 HE3 LYS 213 9.705 -1.514 0.392 858 HZ1 LYS 213 HZ1 LYS 213 10.729 -3.423 -0.595 859 HZ2 LYS 213 HZ2 LYS 213 11.434 -3.879 0.873 860 HZ3 LYS 213 HZ3 LYS 213 11.942 -2.467 0.094 861 H ARG 214 H ARG 214 9.902 -0.423 6.875 862 HA ARG 214 HA ARG 214 10.288 2.073 5.748 863 HB2 ARG 214 HB2 ARG 214 9.637 3.005 7.852 864 HB3 ARG 214 HB3 ARG 214 8.740 1.507 7.640 865 HG2 ARG 214 HG2 ARG 214 10.202 0.355 9.160 866 HG3 ARG 214 HG3 ARG 214 11.245 1.773 9.287 867 HD2 ARG 214 HD2 ARG 214 9.425 3.035 10.301 868 HD3 ARG 214 HD3 ARG 214 8.354 1.644 10.137 869 HE ARG 214 HE ARG 214 9.339 0.706 11.985 870 HH11 ARG 214 HH11 ARG 214 11.285 3.365 10.859 871 HH12 ARG 214 HH12 ARG 214 12.328 3.357 12.243 872 HH21 ARG 214 HH21 ARG 214 10.705 0.686 13.811 873 HH22 ARG 214 HH22 ARG 214 11.998 1.833 13.920 874 H SER 215 H SER 215 12.429 0.193 7.778 875 HA SER 215 HA SER 215 14.223 2.189 8.554 876 HB2 SER 215 HB2 SER 215 14.785 0.303 9.682 877 HB3 SER 215 HB3 SER 215 14.257 -0.755 8.373 878 HG SER 215 HG SER 215 16.199 -0.533 7.394 879 H GLU 216 H GLU 216 14.434 -0.040 5.779 880 HA GLU 216 HA GLU 216 16.753 1.093 4.667 881 HB2 GLU 216 HB2 GLU 216 14.553 -0.637 3.599 882 HB3 GLU 216 HB3 GLU 216 15.747 0.031 2.495 883 HG2 GLU 216 HG2 GLU 216 17.468 -0.969 4.154 884 HG3 GLU 216 HG3 GLU 216 16.109 -1.952 4.695 885 H ARG 217 H ARG 217 13.382 1.958 4.431 886 HA ARG 217 HA ARG 217 13.610 3.656 2.164 887 HB2 ARG 217 HB2 ARG 217 11.443 2.828 2.757 888 HB3 ARG 217 HB3 ARG 217 11.569 3.490 4.380 889 HG2 ARG 217 HG2 ARG 217 11.799 5.447 2.197 890 HG3 ARG 217 HG3 ARG 217 10.225 4.665 2.366 891 HD2 ARG 217 HD2 ARG 217 9.819 5.613 4.397 892 HD3 ARG 217 HD3 ARG 217 11.526 5.663 4.835 893 HE ARG 217 HE ARG 217 10.816 7.468 2.712 894 HH11 ARG 217 HH11 ARG 217 11.033 7.035 6.160 895 HH12 ARG 217 HH12 ARG 217 11.155 8.730 6.496 896 HH21 ARG 217 HH21 ARG 217 10.977 9.702 3.143 897 HH22 ARG 217 HH22 ARG 217 11.123 10.246 4.780 898 H ILE 218 H ILE 218 14.242 4.056 5.553 899 HA ILE 218 HA ILE 218 14.263 6.937 5.470 900 HB ILE 218 HB ILE 218 15.285 5.043 7.589 901 HG12 ILE 218 HG12 ILE 218 12.868 6.708 7.999 902 HG13 ILE 218 HG13 ILE 218 12.707 5.369 6.869 903 HG21 ILE 218 HG21 ILE 218 16.420 7.008 8.031 904 HG22 ILE 218 HG22 ILE 218 15.101 8.022 7.449 905 HG23 ILE 218 HG23 ILE 218 14.958 7.195 9.000 906 HD11 ILE 218 HD11 ILE 218 12.181 4.212 8.708 907 HD12 ILE 218 HD12 ILE 218 13.928 4.140 8.941 908 HD13 ILE 218 HD13 ILE 218 12.975 5.360 9.785 909 H SER 219 H SER 219 16.761 4.428 5.907 910 HA SER 219 HA SER 219 18.851 6.387 5.402 911 HB2 SER 219 HB2 SER 219 18.900 4.444 7.148 912 HB3 SER 219 HB3 SER 219 19.357 3.450 5.765 913 HG SER 219 HG SER 219 21.266 4.156 6.455 914 H ASN 220 H ASN 220 20.758 5.320 4.019 915 HA ASN 220 HA ASN 220 19.675 4.081 1.603 916 HB2 ASN 220 HB2 ASN 220 19.723 6.643 1.416 917 HB3 ASN 220 HB3 ASN 220 21.476 6.487 1.391 918 HD21 ASN 220 HD21 ASN 220 22.413 6.201 -0.503 919 HD22 ASN 220 HD22 ASN 220 21.621 5.709 -1.958 Start of MODEL 15 1 H ALA 23 H ALA 23 4.819 14.237 12.407 2 HA ALA 23 HA ALA 23 2.952 12.348 13.621 3 HB1 ALA 23 HB1 ALA 23 1.766 14.584 14.210 4 HB2 ALA 23 HB2 ALA 23 3.242 14.129 15.062 5 HB3 ALA 23 HB3 ALA 23 3.308 15.311 13.755 6 H ALA 24 H ALA 24 3.224 12.310 10.772 7 HA ALA 24 HA ALA 24 0.553 13.273 9.977 8 HB1 ALA 24 HB1 ALA 24 1.926 12.922 7.617 9 HB2 ALA 24 HB2 ALA 24 1.633 14.461 8.427 10 HB3 ALA 24 HB3 ALA 24 3.146 13.597 8.698 11 HA PRO 25 HA PRO 25 -0.603 9.179 8.905 12 HB2 PRO 25 HB2 PRO 25 -2.052 9.557 6.641 13 HB3 PRO 25 HB3 PRO 25 -2.632 10.028 8.243 14 HG2 PRO 25 HG2 PRO 25 -1.378 11.715 6.111 15 HG3 PRO 25 HG3 PRO 25 -2.776 12.072 7.143 16 HD2 PRO 25 HD2 PRO 25 -0.307 13.066 7.639 17 HD3 PRO 25 HD3 PRO 25 -1.458 12.678 8.934 18 H ASN 26 H ASN 26 1.590 8.476 8.434 19 HA ASN 26 HA ASN 26 2.023 8.066 5.549 20 HB2 ASN 26 HB2 ASN 26 4.311 8.184 7.489 21 HB3 ASN 26 HB3 ASN 26 4.321 8.439 5.748 22 HD21 ASN 26 HD21 ASN 26 2.277 10.244 5.460 23 HD22 ASN 26 HD22 ASN 26 2.705 11.727 6.235 24 H LEU 27 H LEU 27 2.977 6.080 4.935 25 HA LEU 27 HA LEU 27 2.613 3.953 6.933 26 HB2 LEU 27 HB2 LEU 27 1.343 4.106 4.638 27 HB3 LEU 27 HB3 LEU 27 2.835 3.406 4.012 28 HG LEU 27 HG LEU 27 2.516 1.528 5.663 29 HD11 LEU 27 HD11 LEU 27 0.901 2.888 7.070 30 HD12 LEU 27 HD12 LEU 27 0.455 1.214 6.745 31 HD13 LEU 27 HD13 LEU 27 -0.313 2.521 5.844 32 HD21 LEU 27 HD21 LEU 27 1.750 1.705 3.147 33 HD22 LEU 27 HD22 LEU 27 0.143 1.599 3.867 34 HD23 LEU 27 HD23 LEU 27 1.318 0.312 4.140 35 H ALA 28 H ALA 28 4.441 3.241 7.797 36 HA ALA 28 HA ALA 28 6.619 2.636 8.075 37 HB1 ALA 28 HB1 ALA 28 6.219 0.801 6.696 38 HB2 ALA 28 HB2 ALA 28 6.083 1.798 5.247 39 HB3 ALA 28 HB3 ALA 28 7.659 1.541 5.995 40 H GLY 29 H GLY 29 6.008 5.405 7.222 41 HA2 GLY 29 HA2 GLY 29 7.551 7.196 7.160 42 HA3 GLY 29 HA3 GLY 29 8.739 6.116 6.444 43 H ALA 30 H ALA 30 5.673 5.847 5.028 44 HA ALA 30 HA ALA 30 6.612 7.381 2.704 45 HB1 ALA 30 HB1 ALA 30 5.011 6.051 1.402 46 HB2 ALA 30 HB2 ALA 30 6.171 5.036 2.262 47 HB3 ALA 30 HB3 ALA 30 4.526 5.211 2.875 48 H VAL 31 H VAL 31 5.808 9.366 2.562 49 HA VAL 31 HA VAL 31 3.233 10.003 3.765 50 HB VAL 31 HB VAL 31 5.129 11.880 2.356 51 HG11 VAL 31 HG11 VAL 31 3.165 13.051 2.524 52 HG12 VAL 31 HG12 VAL 31 2.658 12.205 3.988 53 HG13 VAL 31 HG13 VAL 31 3.908 13.446 4.074 54 HG21 VAL 31 HG21 VAL 31 5.372 12.361 5.052 55 HG22 VAL 31 HG22 VAL 31 5.315 10.600 4.968 56 HG23 VAL 31 HG23 VAL 31 6.533 11.488 4.053 57 H GLU 32 H GLU 32 4.767 9.864 0.598 58 HA GLU 32 HA GLU 32 2.574 11.004 -0.822 59 HB2 GLU 32 HB2 GLU 32 4.859 9.281 -1.794 60 HB3 GLU 32 HB3 GLU 32 3.732 10.138 -2.836 61 HG2 GLU 32 HG2 GLU 32 5.228 11.688 -0.790 62 HG3 GLU 32 HG3 GLU 32 6.082 11.141 -2.231 63 H PHE 33 H PHE 33 0.948 10.018 -1.981 64 HA PHE 33 HA PHE 33 -0.115 7.632 -0.958 65 HB2 PHE 33 HB2 PHE 33 -1.651 9.145 -1.920 66 HB3 PHE 33 HB3 PHE 33 -0.730 9.258 -3.417 67 HD1 PHE 33 HD1 PHE 33 -2.730 6.891 -1.370 68 HD2 PHE 33 HD2 PHE 33 -1.286 7.931 -5.238 69 HE1 PHE 33 HE1 PHE 33 -4.148 5.143 -2.366 70 HE2 PHE 33 HE2 PHE 33 -2.702 6.186 -6.239 71 HZ PHE 33 HZ PHE 33 -4.136 4.790 -4.803 72 H SER 34 H SER 34 1.457 8.279 -4.086 73 HA SER 34 HA SER 34 1.314 5.751 -5.185 74 HB2 SER 34 HB2 SER 34 3.071 6.403 -6.652 75 HB3 SER 34 HB3 SER 34 2.200 7.885 -6.260 76 HG SER 34 HG SER 34 4.027 8.622 -5.564 77 H ASP 35 H ASP 35 3.584 7.012 -2.813 78 HA ASP 35 HA ASP 35 5.296 4.724 -2.842 79 HB2 ASP 35 HB2 ASP 35 5.009 7.152 -1.121 80 HB3 ASP 35 HB3 ASP 35 5.949 5.790 -0.517 81 H VAL 36 H VAL 36 2.398 5.627 -1.135 82 HA VAL 36 HA VAL 36 2.610 3.682 0.940 83 HB VAL 36 HB VAL 36 0.163 5.106 -0.116 84 HG11 VAL 36 HG11 VAL 36 0.458 2.984 1.794 85 HG12 VAL 36 HG12 VAL 36 -0.150 4.438 2.589 86 HG13 VAL 36 HG13 VAL 36 -1.011 3.762 1.206 87 HG21 VAL 36 HG21 VAL 36 1.227 5.893 2.483 88 HG22 VAL 36 HG22 VAL 36 2.341 6.201 1.151 89 HG23 VAL 36 HG23 VAL 36 0.717 6.889 1.118 90 H LYS 37 H LYS 37 0.534 3.848 -1.958 91 HA LYS 37 HA LYS 37 -0.578 1.304 -1.740 92 HB2 LYS 37 HB2 LYS 37 -0.979 1.504 -4.209 93 HB3 LYS 37 HB3 LYS 37 -1.536 2.878 -3.264 94 HG2 LYS 37 HG2 LYS 37 0.190 4.252 -4.024 95 HG3 LYS 37 HG3 LYS 37 1.152 2.884 -4.588 96 HD2 LYS 37 HD2 LYS 37 -1.386 2.858 -5.904 97 HD3 LYS 37 HD3 LYS 37 -0.668 4.462 -6.061 98 HE2 LYS 37 HE2 LYS 37 1.425 3.385 -6.854 99 HE3 LYS 37 HE3 LYS 37 0.597 1.829 -6.812 100 HZ1 LYS 37 HZ1 LYS 37 -1.024 3.545 -8.257 101 HZ2 LYS 37 HZ2 LYS 37 -0.112 2.252 -8.853 102 HZ3 LYS 37 HZ3 LYS 37 0.546 3.810 -8.826 103 H THR 38 H THR 38 2.506 2.338 -3.022 104 HA THR 38 HA THR 38 3.163 -0.044 -4.403 105 HB THR 38 HB THR 38 4.942 2.094 -3.218 106 HG1 THR 38 HG1 THR 38 4.547 1.658 -5.967 107 HG21 THR 38 HG21 THR 38 5.634 -0.205 -5.050 108 HG22 THR 38 HG22 THR 38 6.232 0.060 -3.412 109 HG23 THR 38 HG23 THR 38 6.695 1.162 -4.709 110 H LEU 39 H LEU 39 3.716 1.050 -1.088 111 HA LEU 39 HA LEU 39 5.345 -1.150 -0.327 112 HB2 LEU 39 HB2 LEU 39 3.696 0.757 1.324 113 HB3 LEU 39 HB3 LEU 39 4.840 -0.408 1.988 114 HG LEU 39 HG LEU 39 5.836 1.562 -0.008 115 HD11 LEU 39 HD11 LEU 39 5.566 3.382 1.241 116 HD12 LEU 39 HD12 LEU 39 6.050 2.539 2.713 117 HD13 LEU 39 HD13 LEU 39 4.377 2.457 2.161 118 HD21 LEU 39 HD21 LEU 39 6.955 0.240 2.458 119 HD22 LEU 39 HD22 LEU 39 7.819 1.437 1.493 120 HD23 LEU 39 HD23 LEU 39 7.362 -0.110 0.778 121 H LEU 40 H LEU 40 1.888 -0.537 -0.288 122 HA LEU 40 HA LEU 40 1.203 -2.812 1.287 123 HB2 LEU 40 HB2 LEU 40 -0.518 -1.293 -0.664 124 HB3 LEU 40 HB3 LEU 40 -1.076 -2.361 0.621 125 HG LEU 40 HG LEU 40 0.501 0.115 1.242 126 HD11 LEU 40 HD11 LEU 40 -2.041 0.065 -0.014 127 HD12 LEU 40 HD12 LEU 40 -1.153 1.448 0.622 128 HD13 LEU 40 HD13 LEU 40 -2.266 0.562 1.664 129 HD21 LEU 40 HD21 LEU 40 -1.314 -1.749 2.728 130 HD22 LEU 40 HD22 LEU 40 -1.024 -0.108 3.307 131 HD23 LEU 40 HD23 LEU 40 0.325 -1.233 3.129 132 H LYS 41 H LYS 41 1.174 -2.144 -2.201 133 HA LYS 41 HA LYS 41 0.109 -4.518 -3.125 134 HB2 LYS 41 HB2 LYS 41 1.032 -2.327 -4.339 135 HB3 LYS 41 HB3 LYS 41 2.415 -3.376 -4.621 136 HG2 LYS 41 HG2 LYS 41 0.548 -5.050 -5.431 137 HG3 LYS 41 HG3 LYS 41 -0.352 -3.553 -5.684 138 HD2 LYS 41 HD2 LYS 41 0.740 -4.003 -7.730 139 HD3 LYS 41 HD3 LYS 41 1.671 -2.715 -6.962 140 HE2 LYS 41 HE2 LYS 41 3.233 -4.448 -6.097 141 HE3 LYS 41 HE3 LYS 41 2.342 -5.655 -7.023 142 HZ1 LYS 41 HZ1 LYS 41 3.451 -3.271 -8.356 143 HZ2 LYS 41 HZ2 LYS 41 3.064 -4.777 -9.021 144 HZ3 LYS 41 HZ3 LYS 41 4.435 -4.612 -8.045 145 H GLU 42 H GLU 42 3.466 -3.793 -2.259 146 HA GLU 42 HA GLU 42 4.409 -6.410 -2.968 147 HB2 GLU 42 HB2 GLU 42 6.523 -5.680 -1.927 148 HB3 GLU 42 HB3 GLU 42 5.920 -4.515 -3.096 149 HG2 GLU 42 HG2 GLU 42 4.990 -3.188 -1.225 150 HG3 GLU 42 HG3 GLU 42 5.737 -4.320 -0.100 151 H TRP 43 H TRP 43 3.584 -4.737 0.037 152 HA TRP 43 HA TRP 43 4.391 -6.777 1.803 153 HB2 TRP 43 HB2 TRP 43 4.007 -4.576 2.668 154 HB3 TRP 43 HB3 TRP 43 2.344 -4.574 2.086 155 HD1 TRP 43 HD1 TRP 43 4.444 -6.721 4.563 156 HE1 TRP 43 HE1 TRP 43 2.948 -7.275 6.582 157 HE3 TRP 43 HE3 TRP 43 0.131 -4.449 3.024 158 HZ2 TRP 43 HZ2 TRP 43 0.290 -6.812 7.412 159 HZ3 TRP 43 HZ3 TRP 43 -1.843 -4.551 4.489 160 HH2 TRP 43 HH2 TRP 43 -1.764 -5.708 6.637 161 H ILE 44 H ILE 44 1.799 -6.618 -0.377 162 HA ILE 44 HA ILE 44 0.251 -8.630 1.096 163 HB ILE 44 HB ILE 44 -0.489 -7.041 -1.364 164 HG12 ILE 44 HG12 ILE 44 -1.835 -6.839 1.307 165 HG13 ILE 44 HG13 ILE 44 -0.338 -5.959 1.019 166 HG21 ILE 44 HG21 ILE 44 -2.796 -7.963 -0.822 167 HG22 ILE 44 HG22 ILE 44 -1.638 -9.084 -1.538 168 HG23 ILE 44 HG23 ILE 44 -1.966 -9.142 0.194 169 HD11 ILE 44 HD11 ILE 44 -2.355 -4.606 0.633 170 HD12 ILE 44 HD12 ILE 44 -1.348 -4.761 -0.807 171 HD13 ILE 44 HD13 ILE 44 -2.825 -5.713 -0.657 172 H THR 45 H THR 45 2.524 -8.343 -1.381 173 HA THR 45 HA THR 45 1.676 -10.854 -2.650 174 HB THR 45 HB THR 45 3.310 -10.306 -4.425 175 HG1 THR 45 HG1 THR 45 4.793 -8.906 -3.861 176 HG21 THR 45 HG21 THR 45 2.092 -8.010 -5.034 177 HG22 THR 45 HG22 THR 45 1.028 -8.542 -3.731 178 HG23 THR 45 HG23 THR 45 1.277 -9.570 -5.142 179 H THR 46 H THR 46 4.673 -9.259 -1.549 180 HA THR 46 HA THR 46 6.228 -11.621 -1.573 181 HB THR 46 HB THR 46 7.161 -9.295 -1.606 182 HG1 THR 46 HG1 THR 46 8.850 -9.901 0.050 183 HG21 THR 46 HG21 THR 46 6.719 -7.846 0.027 184 HG22 THR 46 HG22 THR 46 7.374 -8.956 1.231 185 HG23 THR 46 HG23 THR 46 5.674 -9.051 0.777 186 H ILE 47 H ILE 47 3.849 -10.499 0.578 187 HA ILE 47 HA ILE 47 4.663 -12.526 2.552 188 HB ILE 47 HB ILE 47 3.497 -9.805 3.140 189 HG12 ILE 47 HG12 ILE 47 5.862 -10.536 4.620 190 HG13 ILE 47 HG13 ILE 47 6.158 -10.693 2.892 191 HG21 ILE 47 HG21 ILE 47 3.718 -10.542 5.536 192 HG22 ILE 47 HG22 ILE 47 2.433 -11.325 4.616 193 HG23 ILE 47 HG23 ILE 47 3.942 -12.183 4.928 194 HD11 ILE 47 HD11 ILE 47 4.931 -8.293 2.967 195 HD12 ILE 47 HD12 ILE 47 5.747 -8.298 4.531 196 HD13 ILE 47 HD13 ILE 47 6.678 -8.522 3.050 197 H SER 48 H SER 48 3.157 -14.001 2.980 198 HA SER 48 HA SER 48 0.417 -13.492 2.041 199 HB2 SER 48 HB2 SER 48 0.357 -15.606 1.260 200 HB3 SER 48 HB3 SER 48 2.107 -15.603 1.477 201 HG SER 48 HG SER 48 1.088 -17.383 2.516 202 H ASP 49 H ASP 49 2.348 -14.226 4.811 203 HA ASP 49 HA ASP 49 -0.094 -14.467 6.444 204 HB2 ASP 49 HB2 ASP 49 2.651 -15.512 7.159 205 HB3 ASP 49 HB3 ASP 49 1.144 -15.799 8.025 206 HA PRO 50 HA PRO 50 1.859 -10.462 7.608 207 HB2 PRO 50 HB2 PRO 50 -0.503 -9.183 8.004 208 HB3 PRO 50 HB3 PRO 50 0.261 -9.320 6.415 209 HG2 PRO 50 HG2 PRO 50 -1.964 -10.940 7.594 210 HG3 PRO 50 HG3 PRO 50 -1.807 -10.281 5.955 211 HD2 PRO 50 HD2 PRO 50 -1.279 -12.872 6.539 212 HD3 PRO 50 HD3 PRO 50 -0.416 -11.985 5.268 213 H MET 51 H MET 51 2.107 -9.586 9.647 214 HA MET 51 HA MET 51 1.065 -11.198 11.834 215 HB2 MET 51 HB2 MET 51 3.515 -10.450 11.560 216 HB3 MET 51 HB3 MET 51 2.957 -8.876 12.111 217 HG2 MET 51 HG2 MET 51 1.951 -10.241 14.089 218 HG3 MET 51 HG3 MET 51 3.133 -11.451 13.596 219 HE1 MET 51 HE1 MET 51 5.425 -11.181 13.343 220 HE2 MET 51 HE2 MET 51 6.013 -9.560 12.974 221 HE3 MET 51 HE3 MET 51 6.418 -10.316 14.516 222 H GLU 52 H GLU 52 0.042 -10.288 13.682 223 HA GLU 52 HA GLU 52 -2.051 -8.557 13.172 224 HB2 GLU 52 HB2 GLU 52 -1.978 -10.057 15.111 225 HB3 GLU 52 HB3 GLU 52 -0.699 -9.086 15.825 226 HG2 GLU 52 HG2 GLU 52 -2.201 -7.201 16.032 227 HG3 GLU 52 HG3 GLU 52 -3.485 -8.111 15.237 228 H GLU 53 H GLU 53 1.213 -7.844 14.237 229 HA GLU 53 HA GLU 53 0.726 -5.118 14.908 230 HB2 GLU 53 HB2 GLU 53 3.182 -6.769 14.432 231 HB3 GLU 53 HB3 GLU 53 3.314 -5.021 14.569 232 HG2 GLU 53 HG2 GLU 53 1.999 -6.738 16.654 233 HG3 GLU 53 HG3 GLU 53 3.712 -6.322 16.677 234 H ASP 54 H ASP 54 2.116 -6.720 12.058 235 HA ASP 54 HA ASP 54 2.723 -4.461 10.561 236 HB2 ASP 54 HB2 ASP 54 2.288 -7.313 10.016 237 HB3 ASP 54 HB3 ASP 54 1.944 -6.262 8.645 238 H ILE 55 H ILE 55 -0.296 -6.333 10.650 239 HA ILE 55 HA ILE 55 -1.675 -4.759 8.753 240 HB ILE 55 HB ILE 55 -2.893 -6.365 11.000 241 HG12 ILE 55 HG12 ILE 55 -2.213 -7.263 8.193 242 HG13 ILE 55 HG13 ILE 55 -1.271 -7.669 9.624 243 HG21 ILE 55 HG21 ILE 55 -4.468 -4.875 9.913 244 HG22 ILE 55 HG22 ILE 55 -3.988 -5.489 8.331 245 HG23 ILE 55 HG23 ILE 55 -4.813 -6.549 9.476 246 HD11 ILE 55 HD11 ILE 55 -2.606 -9.538 9.225 247 HD12 ILE 55 HD12 ILE 55 -3.421 -8.684 10.536 248 HD13 ILE 55 HD13 ILE 55 -4.033 -8.560 8.887 249 H LEU 56 H LEU 56 -1.188 -4.450 12.201 250 HA LEU 56 HA LEU 56 -3.225 -2.597 12.762 251 HB2 LEU 56 HB2 LEU 56 -0.792 -3.573 14.068 252 HB3 LEU 56 HB3 LEU 56 -1.235 -1.924 14.506 253 HG LEU 56 HG LEU 56 -2.979 -4.367 14.815 254 HD11 LEU 56 HD11 LEU 56 -1.369 -2.744 16.767 255 HD12 LEU 56 HD12 LEU 56 -1.271 -4.475 16.444 256 HD13 LEU 56 HD13 LEU 56 -2.686 -3.808 17.257 257 HD21 LEU 56 HD21 LEU 56 -3.435 -1.451 15.383 258 HD22 LEU 56 HD22 LEU 56 -4.358 -2.724 16.179 259 HD23 LEU 56 HD23 LEU 56 -4.425 -2.552 14.425 260 H GLN 57 H GLN 57 0.085 -2.185 11.614 261 HA GLN 57 HA GLN 57 0.357 0.560 11.884 262 HB2 GLN 57 HB2 GLN 57 1.563 -1.526 10.180 263 HB3 GLN 57 HB3 GLN 57 1.685 0.113 9.558 264 HG2 GLN 57 HG2 GLN 57 2.446 -0.453 12.384 265 HG3 GLN 57 HG3 GLN 57 3.556 -0.858 11.076 266 HE21 GLN 57 HE21 GLN 57 3.130 1.339 13.306 267 HE22 GLN 57 HE22 GLN 57 3.641 2.772 12.489 268 H VAL 58 H VAL 58 -1.412 -1.293 9.502 269 HA VAL 58 HA VAL 58 -1.840 0.850 7.675 270 HB VAL 58 HB VAL 58 -3.579 -1.593 8.004 271 HG11 VAL 58 HG11 VAL 58 -4.688 -0.748 6.278 272 HG12 VAL 58 HG12 VAL 58 -3.588 0.630 6.211 273 HG13 VAL 58 HG13 VAL 58 -3.218 -0.841 5.310 274 HG21 VAL 58 HG21 VAL 58 -0.820 -1.325 7.029 275 HG22 VAL 58 HG22 VAL 58 -1.682 -2.744 7.624 276 HG23 VAL 58 HG23 VAL 58 -1.910 -2.208 5.959 277 H VAL 59 H VAL 59 -3.557 -0.379 10.480 278 HA VAL 59 HA VAL 59 -5.971 1.039 10.099 279 HB VAL 59 HB VAL 59 -4.716 0.091 12.679 280 HG11 VAL 59 HG11 VAL 59 -7.097 0.132 13.487 281 HG12 VAL 59 HG12 VAL 59 -6.368 1.716 13.215 282 HG13 VAL 59 HG13 VAL 59 -7.496 1.050 12.035 283 HG21 VAL 59 HG21 VAL 59 -5.241 -1.963 12.022 284 HG22 VAL 59 HG22 VAL 59 -6.931 -1.483 11.888 285 HG23 VAL 59 HG23 VAL 59 -5.860 -1.335 10.495 286 H ARG 60 H ARG 60 -3.123 1.765 12.113 287 HA ARG 60 HA ARG 60 -4.027 4.231 13.091 288 HB2 ARG 60 HB2 ARG 60 -1.171 3.377 12.581 289 HB3 ARG 60 HB3 ARG 60 -1.690 4.676 13.647 290 HG2 ARG 60 HG2 ARG 60 -2.643 1.873 14.077 291 HG3 ARG 60 HG3 ARG 60 -1.065 2.399 14.667 292 HD2 ARG 60 HD2 ARG 60 -2.041 4.064 16.050 293 HD3 ARG 60 HD3 ARG 60 -3.619 3.864 15.288 294 HE ARG 60 HE ARG 60 -4.017 2.065 16.653 295 HH11 ARG 60 HH11 ARG 60 -0.635 2.881 16.775 296 HH12 ARG 60 HH12 ARG 60 -0.288 1.802 18.086 297 HH21 ARG 60 HH21 ARG 60 -3.574 0.640 18.378 298 HH22 ARG 60 HH22 ARG 60 -1.960 0.528 18.997 299 H TYR 61 H TYR 61 -2.682 3.336 10.028 300 HA TYR 61 HA TYR 61 -1.910 5.976 9.233 301 HB2 TYR 61 HB2 TYR 61 -0.791 4.159 8.168 302 HB3 TYR 61 HB3 TYR 61 -2.312 3.403 7.706 303 HD1 TYR 61 HD2 TYR 61 -0.022 6.208 7.001 304 HD2 TYR 61 HD1 TYR 61 -3.464 4.060 5.721 305 HE1 TYR 61 HE2 TYR 61 0.072 7.362 4.832 306 HE2 TYR 61 HE1 TYR 61 -3.378 5.207 3.547 307 HH TYR 61 HH TYR 61 -1.341 6.372 2.161 308 H CYS 62 H CYS 62 -4.616 3.835 8.348 309 HA CYS 62 HA CYS 62 -5.949 5.771 6.767 310 HB2 CYS 62 HB2 CYS 62 -6.852 3.196 8.049 311 HB3 CYS 62 HB3 CYS 62 -7.936 4.197 7.090 312 HG CYS 62 HG CYS 62 -6.102 4.050 4.830 313 H THR 63 H THR 63 -6.385 4.682 10.113 314 HA THR 63 HA THR 63 -8.640 6.176 10.758 315 HB THR 63 HB THR 63 -7.844 6.058 13.120 316 HG1 THR 63 HG1 THR 63 -5.691 6.079 13.144 317 HG21 THR 63 HG21 THR 63 -7.290 3.336 12.503 318 HG22 THR 63 HG22 THR 63 -8.499 3.925 11.361 319 HG23 THR 63 HG23 THR 63 -8.791 4.044 13.096 320 H ASP 64 H ASP 64 -5.338 7.163 10.361 321 HA ASP 64 HA ASP 64 -5.558 9.640 11.768 322 HB2 ASP 64 HB2 ASP 64 -3.550 8.422 9.908 323 HB3 ASP 64 HB3 ASP 64 -3.453 10.142 10.275 324 H LEU 65 H LEU 65 -5.952 8.630 8.417 325 HA LEU 65 HA LEU 65 -6.044 11.098 7.160 326 HB2 LEU 65 HB2 LEU 65 -6.958 8.392 6.596 327 HB3 LEU 65 HB3 LEU 65 -7.980 9.625 5.860 328 HG LEU 65 HG LEU 65 -6.198 10.459 4.553 329 HD11 LEU 65 HD11 LEU 65 -4.403 8.775 6.284 330 HD12 LEU 65 HD12 LEU 65 -4.423 10.531 6.137 331 HD13 LEU 65 HD13 LEU 65 -3.884 9.540 4.783 332 HD21 LEU 65 HD21 LEU 65 -6.377 8.770 3.127 333 HD22 LEU 65 HD22 LEU 65 -6.982 7.753 4.436 334 HD23 LEU 65 HD23 LEU 65 -5.253 7.804 4.085 335 H ILE 66 H ILE 66 -8.471 9.471 9.089 336 HA ILE 66 HA ILE 66 -10.687 11.062 8.379 337 HB ILE 66 HB ILE 66 -10.053 9.395 10.794 338 HG12 ILE 66 HG12 ILE 66 -12.509 8.883 9.313 339 HG13 ILE 66 HG13 ILE 66 -11.089 8.841 8.273 340 HG21 ILE 66 HG21 ILE 66 -12.641 9.875 11.200 341 HG22 ILE 66 HG22 ILE 66 -11.370 10.849 11.935 342 HG23 ILE 66 HG23 ILE 66 -12.189 11.421 10.483 343 HD11 ILE 66 HD11 ILE 66 -11.887 7.039 10.477 344 HD12 ILE 66 HD12 ILE 66 -11.124 6.677 8.929 345 HD13 ILE 66 HD13 ILE 66 -10.164 7.340 10.252 346 H GLU 67 H GLU 67 -8.304 11.363 10.991 347 HA GLU 67 HA GLU 67 -9.482 13.731 12.076 348 HB2 GLU 67 HB2 GLU 67 -6.684 12.653 12.469 349 HB3 GLU 67 HB3 GLU 67 -7.489 13.848 13.476 350 HG2 GLU 67 HG2 GLU 67 -8.493 11.040 13.103 351 HG3 GLU 67 HG3 GLU 67 -7.422 11.534 14.412 352 H GLU 68 H GLU 68 -6.932 13.041 9.762 353 HA GLU 68 HA GLU 68 -6.102 15.801 9.586 354 HB2 GLU 68 HB2 GLU 68 -5.352 13.314 8.056 355 HB3 GLU 68 HB3 GLU 68 -4.735 14.904 7.632 356 HG2 GLU 68 HG2 GLU 68 -4.288 13.378 10.180 357 HG3 GLU 68 HG3 GLU 68 -3.095 13.827 8.962 358 H LYS 69 H LYS 69 -8.650 14.019 8.370 359 HA LYS 69 HA LYS 69 -10.268 14.453 6.832 360 HB2 LYS 69 HB2 LYS 69 -8.974 17.143 6.407 361 HB3 LYS 69 HB3 LYS 69 -10.657 16.702 6.149 362 HG2 LYS 69 HG2 LYS 69 -9.300 16.757 8.836 363 HG3 LYS 69 HG3 LYS 69 -10.288 18.063 8.178 364 HD2 LYS 69 HD2 LYS 69 -12.061 16.151 7.887 365 HD3 LYS 69 HD3 LYS 69 -11.102 15.357 9.139 366 HE2 LYS 69 HE2 LYS 69 -11.324 17.707 10.313 367 HE3 LYS 69 HE3 LYS 69 -12.746 17.838 9.280 368 HZ1 LYS 69 HZ1 LYS 69 -12.688 16.643 11.698 369 HZ2 LYS 69 HZ2 LYS 69 -12.537 15.319 10.657 370 HZ3 LYS 69 HZ3 LYS 69 -13.859 16.365 10.509 371 H ASP 70 H ASP 70 -7.992 13.073 5.985 372 HA ASP 70 HA ASP 70 -7.639 14.049 3.228 373 HB2 ASP 70 HB2 ASP 70 -5.831 12.534 5.077 374 HB3 ASP 70 HB3 ASP 70 -5.649 12.343 3.336 375 H LEU 71 H LEU 71 -9.946 12.605 4.051 376 HA LEU 71 HA LEU 71 -9.888 9.866 3.643 377 HB2 LEU 71 HB2 LEU 71 -12.092 11.680 2.693 378 HB3 LEU 71 HB3 LEU 71 -12.224 9.992 3.183 379 HG LEU 71 HG LEU 71 -11.633 12.330 4.998 380 HD11 LEU 71 HD11 LEU 71 -14.027 11.739 3.955 381 HD12 LEU 71 HD12 LEU 71 -13.813 12.368 5.588 382 HD13 LEU 71 HD13 LEU 71 -14.029 10.637 5.332 383 HD21 LEU 71 HD21 LEU 71 -11.314 9.452 5.318 384 HD22 LEU 71 HD22 LEU 71 -12.345 10.178 6.550 385 HD23 LEU 71 HD23 LEU 71 -10.704 10.778 6.307 386 H GLU 72 H GLU 72 -9.482 12.426 1.372 387 HA GLU 72 HA GLU 72 -10.299 11.333 -1.017 388 HB2 GLU 72 HB2 GLU 72 -9.464 13.577 -0.952 389 HB3 GLU 72 HB3 GLU 72 -7.884 13.035 -0.402 390 HG2 GLU 72 HG2 GLU 72 -7.273 12.260 -2.486 391 HG3 GLU 72 HG3 GLU 72 -8.943 12.104 -3.031 392 H LYS 73 H LYS 73 -7.168 10.869 0.599 393 HA LYS 73 HA LYS 73 -6.268 8.977 -1.371 394 HB2 LYS 73 HB2 LYS 73 -5.106 9.575 1.355 395 HB3 LYS 73 HB3 LYS 73 -4.299 8.741 0.033 396 HG2 LYS 73 HG2 LYS 73 -3.695 10.649 -0.947 397 HG3 LYS 73 HG3 LYS 73 -5.287 11.377 -0.714 398 HD2 LYS 73 HD2 LYS 73 -4.176 12.725 0.713 399 HD3 LYS 73 HD3 LYS 73 -4.372 11.371 1.828 400 HE2 LYS 73 HE2 LYS 73 -2.015 11.370 0.017 401 HE3 LYS 73 HE3 LYS 73 -2.013 12.488 1.379 402 HZ1 LYS 73 HZ1 LYS 73 -1.129 10.692 2.399 403 HZ2 LYS 73 HZ2 LYS 73 -1.870 9.577 1.366 404 HZ3 LYS 73 HZ3 LYS 73 -2.756 10.286 2.621 405 H LEU 74 H LEU 74 -8.061 8.853 1.563 406 HA LEU 74 HA LEU 74 -7.495 6.257 2.438 407 HB2 LEU 74 HB2 LEU 74 -8.798 8.014 3.660 408 HB3 LEU 74 HB3 LEU 74 -10.162 7.647 2.606 409 HG LEU 74 HG LEU 74 -10.253 5.377 3.506 410 HD11 LEU 74 HD11 LEU 74 -8.883 4.743 5.420 411 HD12 LEU 74 HD12 LEU 74 -8.012 6.272 5.313 412 HD13 LEU 74 HD13 LEU 74 -7.883 5.091 4.010 413 HD21 LEU 74 HD21 LEU 74 -10.165 7.326 5.795 414 HD22 LEU 74 HD22 LEU 74 -11.206 5.915 5.598 415 HD23 LEU 74 HD23 LEU 74 -11.443 7.336 4.579 416 H ASP 75 H ASP 75 -10.078 7.409 0.276 417 HA ASP 75 HA ASP 75 -11.187 4.882 -0.258 418 HB2 ASP 75 HB2 ASP 75 -11.238 7.506 -1.735 419 HB3 ASP 75 HB3 ASP 75 -12.035 6.074 -2.383 420 H LEU 76 H LEU 76 -8.434 6.553 -1.579 421 HA LEU 76 HA LEU 76 -8.167 4.869 -3.887 422 HB2 LEU 76 HB2 LEU 76 -6.092 6.634 -2.601 423 HB3 LEU 76 HB3 LEU 76 -6.063 5.990 -4.240 424 HG LEU 76 HG LEU 76 -8.182 7.901 -3.284 425 HD11 LEU 76 HD11 LEU 76 -6.412 9.250 -4.974 426 HD12 LEU 76 HD12 LEU 76 -5.401 8.425 -3.788 427 HD13 LEU 76 HD13 LEU 76 -6.671 9.524 -3.251 428 HD21 LEU 76 HD21 LEU 76 -8.166 6.347 -5.476 429 HD22 LEU 76 HD22 LEU 76 -7.296 7.752 -6.094 430 HD23 LEU 76 HD23 LEU 76 -8.916 7.942 -5.418 431 H VAL 77 H VAL 77 -6.571 5.086 -0.725 432 HA VAL 77 HA VAL 77 -4.786 2.922 -1.191 433 HB VAL 77 HB VAL 77 -5.720 4.138 1.412 434 HG11 VAL 77 HG11 VAL 77 -4.670 2.478 2.446 435 HG12 VAL 77 HG12 VAL 77 -4.190 1.774 0.901 436 HG13 VAL 77 HG13 VAL 77 -3.166 2.984 1.676 437 HG21 VAL 77 HG21 VAL 77 -3.849 5.528 1.337 438 HG22 VAL 77 HG22 VAL 77 -3.056 4.557 0.097 439 HG23 VAL 77 HG23 VAL 77 -4.450 5.553 -0.321 440 H ILE 78 H ILE 78 -7.927 3.201 0.417 441 HA ILE 78 HA ILE 78 -8.053 0.557 1.386 442 HB ILE 78 HB ILE 78 -10.228 2.534 0.715 443 HG12 ILE 78 HG12 ILE 78 -8.731 3.073 2.615 444 HG13 ILE 78 HG13 ILE 78 -10.391 2.790 3.128 445 HG21 ILE 78 HG21 ILE 78 -10.414 -0.309 1.356 446 HG22 ILE 78 HG22 ILE 78 -11.367 0.723 2.421 447 HG23 ILE 78 HG23 ILE 78 -11.621 0.782 0.676 448 HD11 ILE 78 HD11 ILE 78 -8.833 0.361 3.196 449 HD12 ILE 78 HD12 ILE 78 -8.110 1.636 4.177 450 HD13 ILE 78 HD13 ILE 78 -9.776 1.137 4.468 451 H LYS 79 H LYS 79 -9.492 2.022 -1.528 452 HA LYS 79 HA LYS 79 -10.562 -0.378 -2.551 453 HB2 LYS 79 HB2 LYS 79 -11.083 0.835 -4.483 454 HB3 LYS 79 HB3 LYS 79 -11.092 2.052 -3.214 455 HG2 LYS 79 HG2 LYS 79 -9.858 3.183 -4.724 456 HG3 LYS 79 HG3 LYS 79 -8.544 2.268 -3.981 457 HD2 LYS 79 HD2 LYS 79 -8.158 1.879 -6.219 458 HD3 LYS 79 HD3 LYS 79 -9.155 0.485 -5.795 459 HE2 LYS 79 HE2 LYS 79 -10.997 1.296 -6.910 460 HE3 LYS 79 HE3 LYS 79 -10.482 2.975 -6.758 461 HZ1 LYS 79 HZ1 LYS 79 -8.789 2.592 -8.415 462 HZ2 LYS 79 HZ2 LYS 79 -10.300 2.153 -9.037 463 HZ3 LYS 79 HZ3 LYS 79 -9.214 0.958 -8.531 464 H TYR 80 H TYR 80 -7.377 0.974 -2.616 465 HA TYR 80 HA TYR 80 -6.447 -0.646 -4.810 466 HB2 TYR 80 HB2 TYR 80 -5.425 1.532 -4.395 467 HB3 TYR 80 HB3 TYR 80 -4.930 1.017 -2.786 468 HD1 TYR 80 HD1 TYR 80 -3.177 -0.741 -2.545 469 HD2 TYR 80 HD2 TYR 80 -4.138 0.980 -6.316 470 HE1 TYR 80 HE1 TYR 80 -1.051 -1.573 -3.461 471 HE2 TYR 80 HE2 TYR 80 -2.016 0.152 -7.242 472 HH TYR 80 HH TYR 80 -0.302 -1.339 -6.872 473 H MET 81 H MET 81 -6.143 -0.674 -1.281 474 HA MET 81 HA MET 81 -4.501 -3.015 -1.226 475 HB2 MET 81 HB2 MET 81 -4.609 -2.865 1.124 476 HB3 MET 81 HB3 MET 81 -4.641 -1.199 0.560 477 HG2 MET 81 HG2 MET 81 -7.001 -1.053 0.926 478 HG3 MET 81 HG3 MET 81 -7.092 -2.772 1.304 479 HE1 MET 81 HE1 MET 81 -6.193 0.629 2.084 480 HE2 MET 81 HE2 MET 81 -6.379 0.740 3.834 481 HE3 MET 81 HE3 MET 81 -4.792 0.416 3.134 482 H LYS 82 H LYS 82 -7.935 -2.364 -1.064 483 HA LYS 82 HA LYS 82 -8.718 -4.951 -0.168 484 HB2 LYS 82 HB2 LYS 82 -10.917 -4.240 -0.478 485 HB3 LYS 82 HB3 LYS 82 -10.061 -2.741 -0.142 486 HG2 LYS 82 HG2 LYS 82 -11.240 -2.047 -1.937 487 HG3 LYS 82 HG3 LYS 82 -9.860 -2.734 -2.798 488 HD2 LYS 82 HD2 LYS 82 -11.650 -3.674 -3.923 489 HD3 LYS 82 HD3 LYS 82 -11.258 -4.927 -2.744 490 HE2 LYS 82 HE2 LYS 82 -13.188 -4.648 -1.616 491 HE3 LYS 82 HE3 LYS 82 -13.169 -2.896 -1.816 492 HZ1 LYS 82 HZ1 LYS 82 -13.907 -3.222 -4.120 493 HZ2 LYS 82 HZ2 LYS 82 -15.019 -3.835 -3.003 494 HZ3 LYS 82 HZ3 LYS 82 -14.007 -4.890 -3.851 495 H ARG 83 H ARG 83 -8.080 -3.531 -3.301 496 HA ARG 83 HA ARG 83 -9.273 -5.604 -4.844 497 HB2 ARG 83 HB2 ARG 83 -8.641 -4.390 -6.657 498 HB3 ARG 83 HB3 ARG 83 -8.423 -3.132 -5.447 499 HG2 ARG 83 HG2 ARG 83 -6.007 -3.978 -5.288 500 HG3 ARG 83 HG3 ARG 83 -6.349 -4.803 -6.811 501 HD2 ARG 83 HD2 ARG 83 -7.061 -1.928 -6.597 502 HD3 ARG 83 HD3 ARG 83 -5.352 -2.344 -6.723 503 HE ARG 83 HE ARG 83 -7.017 -3.617 -8.695 504 HH11 ARG 83 HH11 ARG 83 -5.153 -0.786 -7.901 505 HH12 ARG 83 HH12 ARG 83 -4.899 -0.330 -9.553 506 HH21 ARG 83 HH21 ARG 83 -6.690 -3.027 -10.874 507 HH22 ARG 83 HH22 ARG 83 -5.774 -1.605 -11.243 508 H LEU 84 H LEU 84 -6.156 -5.142 -3.361 509 HA LEU 84 HA LEU 84 -4.900 -7.293 -4.821 510 HB2 LEU 84 HB2 LEU 84 -3.953 -5.811 -2.373 511 HB3 LEU 84 HB3 LEU 84 -2.981 -6.879 -3.385 512 HG LEU 84 HG LEU 84 -4.238 -4.382 -4.486 513 HD11 LEU 84 HD11 LEU 84 -1.870 -4.663 -2.731 514 HD12 LEU 84 HD12 LEU 84 -2.976 -3.305 -2.940 515 HD13 LEU 84 HD13 LEU 84 -1.715 -3.607 -4.136 516 HD21 LEU 84 HD21 LEU 84 -3.188 -4.941 -6.363 517 HD22 LEU 84 HD22 LEU 84 -2.842 -6.505 -5.624 518 HD23 LEU 84 HD23 LEU 84 -1.665 -5.194 -5.512 519 H MET 85 H MET 85 -5.757 -6.744 -1.401 520 HA MET 85 HA MET 85 -5.154 -9.280 -0.449 521 HB2 MET 85 HB2 MET 85 -7.259 -7.313 0.455 522 HB3 MET 85 HB3 MET 85 -6.844 -8.770 1.349 523 HG2 MET 85 HG2 MET 85 -4.485 -7.923 1.437 524 HG3 MET 85 HG3 MET 85 -5.084 -6.405 0.773 525 HE1 MET 85 HE1 MET 85 -3.814 -5.427 3.309 526 HE2 MET 85 HE2 MET 85 -4.960 -4.641 2.222 527 HE3 MET 85 HE3 MET 85 -5.233 -4.608 3.964 528 H GLN 86 H GLN 86 -7.847 -8.196 -2.339 529 HA GLN 86 HA GLN 86 -9.488 -10.502 -1.783 530 HB2 GLN 86 HB2 GLN 86 -9.709 -8.118 -3.580 531 HB3 GLN 86 HB3 GLN 86 -10.746 -9.510 -3.860 532 HG2 GLN 86 HG2 GLN 86 -11.537 -9.330 -1.521 533 HG3 GLN 86 HG3 GLN 86 -10.581 -7.859 -1.351 534 HE21 GLN 86 HE21 GLN 86 -12.904 -7.219 -0.784 535 HE22 GLN 86 HE22 GLN 86 -13.837 -6.561 -2.079 536 H GLN 87 H GLN 87 -7.798 -9.274 -4.675 537 HA GLN 87 HA GLN 87 -8.230 -11.595 -6.222 538 HB2 GLN 87 HB2 GLN 87 -6.762 -10.642 -7.815 539 HB3 GLN 87 HB3 GLN 87 -7.591 -9.287 -7.058 540 HG2 GLN 87 HG2 GLN 87 -5.608 -8.999 -5.574 541 HG3 GLN 87 HG3 GLN 87 -4.785 -10.230 -6.531 542 HE21 GLN 87 HE21 GLN 87 -6.872 -7.486 -7.367 543 HE22 GLN 87 HE22 GLN 87 -5.756 -6.749 -8.460 544 H SER 88 H SER 88 -6.152 -10.994 -3.618 545 HA SER 88 HA SER 88 -3.857 -12.418 -4.185 546 HB2 SER 88 HB2 SER 88 -5.375 -11.828 -1.688 547 HB3 SER 88 HB3 SER 88 -4.108 -13.053 -1.605 548 HG SER 88 HG SER 88 -3.682 -10.488 -2.722 549 H VAL 89 H VAL 89 -3.229 -14.588 -3.333 550 HA VAL 89 HA VAL 89 -5.139 -16.555 -4.271 551 HB VAL 89 HB VAL 89 -3.384 -18.096 -4.338 552 HG11 VAL 89 HG11 VAL 89 -3.140 -15.846 -5.704 553 HG12 VAL 89 HG12 VAL 89 -1.681 -15.689 -4.722 554 HG13 VAL 89 HG13 VAL 89 -1.900 -17.100 -5.759 555 HG21 VAL 89 HG21 VAL 89 -1.992 -16.346 -2.320 556 HG22 VAL 89 HG22 VAL 89 -2.578 -17.996 -2.101 557 HG23 VAL 89 HG23 VAL 89 -1.201 -17.681 -3.159 558 H GLU 90 H GLU 90 -3.883 -15.387 -1.258 559 HA GLU 90 HA GLU 90 -4.984 -17.655 0.217 560 HB2 GLU 90 HB2 GLU 90 -3.618 -15.248 1.406 561 HB3 GLU 90 HB3 GLU 90 -3.816 -16.845 2.113 562 HG2 GLU 90 HG2 GLU 90 -2.157 -16.301 -0.333 563 HG3 GLU 90 HG3 GLU 90 -1.513 -16.313 1.308 564 H SER 91 H SER 91 -6.893 -17.605 1.209 565 HA SER 91 HA SER 91 -8.639 -15.382 0.888 566 HB2 SER 91 HB2 SER 91 -10.298 -16.727 1.949 567 HB3 SER 91 HB3 SER 91 -9.310 -17.832 0.992 568 HG SER 91 HG SER 91 -8.718 -18.796 2.761 569 H VAL 92 H VAL 92 -6.475 -16.413 3.383 570 HA VAL 92 HA VAL 92 -7.557 -15.211 5.638 571 HB VAL 92 HB VAL 92 -5.229 -15.029 6.480 572 HG11 VAL 92 HG11 VAL 92 -6.589 -17.153 6.512 573 HG12 VAL 92 HG12 VAL 92 -5.666 -17.667 5.098 574 HG13 VAL 92 HG13 VAL 92 -4.842 -17.362 6.628 575 HG21 VAL 92 HG21 VAL 92 -4.632 -15.050 3.689 576 HG22 VAL 92 HG22 VAL 92 -3.546 -14.785 5.052 577 HG23 VAL 92 HG23 VAL 92 -3.833 -16.421 4.459 578 H TRP 93 H TRP 93 -6.045 -13.778 2.868 579 HA TRP 93 HA TRP 93 -5.368 -11.280 4.028 580 HB2 TRP 93 HB2 TRP 93 -5.555 -12.399 1.295 581 HB3 TRP 93 HB3 TRP 93 -5.725 -10.651 1.422 582 HD1 TRP 93 HD1 TRP 93 -3.148 -13.025 0.744 583 HE1 TRP 93 HE1 TRP 93 -0.812 -12.152 1.380 584 HE3 TRP 93 HE3 TRP 93 -4.530 -9.117 3.736 585 HZ2 TRP 93 HZ2 TRP 93 0.298 -10.081 2.945 586 HZ3 TRP 93 HZ3 TRP 93 -2.770 -7.740 4.766 587 HH2 TRP 93 HH2 TRP 93 -0.407 -8.214 4.378 588 H ASN 94 H ASN 94 -8.276 -12.551 2.523 589 HA ASN 94 HA ASN 94 -9.691 -10.191 2.119 590 HB2 ASN 94 HB2 ASN 94 -10.599 -12.988 2.788 591 HB3 ASN 94 HB3 ASN 94 -11.743 -11.682 2.490 592 HD21 ASN 94 HD21 ASN 94 -9.078 -13.494 1.080 593 HD22 ASN 94 HD22 ASN 94 -9.553 -13.266 -0.565 594 H MET 95 H MET 95 -9.292 -12.129 5.038 595 HA MET 95 HA MET 95 -11.155 -10.639 6.601 596 HB2 MET 95 HB2 MET 95 -8.867 -12.314 7.631 597 HB3 MET 95 HB3 MET 95 -10.357 -11.905 8.470 598 HG2 MET 95 HG2 MET 95 -11.494 -13.162 6.498 599 HG3 MET 95 HG3 MET 95 -9.896 -13.876 6.283 600 HE1 MET 95 HE1 MET 95 -8.720 -15.150 7.587 601 HE2 MET 95 HE2 MET 95 -8.953 -15.495 9.302 602 HE3 MET 95 HE3 MET 95 -9.627 -16.580 8.083 603 H ALA 96 H ALA 96 -7.664 -10.514 6.112 604 HA ALA 96 HA ALA 96 -6.928 -8.766 8.124 605 HB1 ALA 96 HB1 ALA 96 -5.719 -9.866 5.856 606 HB2 ALA 96 HB2 ALA 96 -5.517 -8.120 5.706 607 HB3 ALA 96 HB3 ALA 96 -4.943 -8.953 7.150 608 H PHE 97 H PHE 97 -8.356 -8.062 4.975 609 HA PHE 97 HA PHE 97 -8.067 -5.260 5.069 610 HB2 PHE 97 HB2 PHE 97 -8.568 -6.409 2.984 611 HB3 PHE 97 HB3 PHE 97 -10.112 -6.962 3.628 612 HD1 PHE 97 HD2 PHE 97 -8.434 -3.632 3.646 613 HD2 PHE 97 HD1 PHE 97 -11.810 -5.941 2.467 614 HE1 PHE 97 HE2 PHE 97 -9.518 -1.599 2.779 615 HE2 PHE 97 HE1 PHE 97 -12.898 -3.913 1.598 616 HZ PHE 97 HZ PHE 97 -11.752 -1.739 1.752 617 H ASP 98 H ASP 98 -10.792 -7.366 5.951 618 HA ASP 98 HA ASP 98 -12.554 -5.341 6.755 619 HB2 ASP 98 HB2 ASP 98 -13.069 -7.808 6.365 620 HB3 ASP 98 HB3 ASP 98 -12.442 -8.092 7.987 621 H PHE 99 H PHE 99 -9.944 -6.959 8.445 622 HA PHE 99 HA PHE 99 -10.541 -6.200 11.064 623 HB2 PHE 99 HB2 PHE 99 -8.830 -7.801 10.790 624 HB3 PHE 99 HB3 PHE 99 -7.945 -6.784 9.658 625 HD1 PHE 99 HD2 PHE 99 -8.812 -7.281 13.198 626 HD2 PHE 99 HD1 PHE 99 -6.406 -5.141 10.414 627 HE1 PHE 99 HE2 PHE 99 -7.431 -6.434 15.049 628 HE2 PHE 99 HE1 PHE 99 -5.021 -4.290 12.261 629 HZ PHE 99 HZ PHE 99 -5.530 -4.938 14.582 630 H ILE 100 H ILE 100 -8.554 -4.544 8.625 631 HA ILE 100 HA ILE 100 -7.871 -2.332 10.227 632 HB ILE 100 HB ILE 100 -8.098 -2.477 7.218 633 HG12 ILE 100 HG12 ILE 100 -5.447 -2.490 8.490 634 HG13 ILE 100 HG13 ILE 100 -6.419 -3.915 8.838 635 HG21 ILE 100 HG21 ILE 100 -7.563 -0.283 8.970 636 HG22 ILE 100 HG22 ILE 100 -6.117 -0.649 8.030 637 HG23 ILE 100 HG23 ILE 100 -7.639 -0.307 7.208 638 HD11 ILE 100 HD11 ILE 100 -6.601 -4.454 6.539 639 HD12 ILE 100 HD12 ILE 100 -5.915 -2.903 6.057 640 HD13 ILE 100 HD13 ILE 100 -4.903 -4.102 6.861 641 H LEU 101 H LEU 101 -10.586 -2.934 8.053 642 HA LEU 101 HA LEU 101 -11.649 -0.302 8.174 643 HB2 LEU 101 HB2 LEU 101 -12.844 -2.957 7.421 644 HB3 LEU 101 HB3 LEU 101 -13.753 -1.448 7.356 645 HG LEU 101 HG LEU 101 -11.182 -1.761 5.844 646 HD11 LEU 101 HD11 LEU 101 -12.083 -3.360 4.592 647 HD12 LEU 101 HD12 LEU 101 -13.233 -2.151 4.022 648 HD13 LEU 101 HD13 LEU 101 -13.653 -3.195 5.380 649 HD21 LEU 101 HD21 LEU 101 -13.624 -0.018 5.615 650 HD22 LEU 101 HD22 LEU 101 -12.402 -0.134 4.349 651 HD23 LEU 101 HD23 LEU 101 -11.963 0.472 5.947 652 H ASP 102 H ASP 102 -12.066 -3.197 10.105 653 HA ASP 102 HA ASP 102 -14.369 -2.474 11.519 654 HB2 ASP 102 HB2 ASP 102 -12.987 -4.702 11.489 655 HB3 ASP 102 HB3 ASP 102 -12.148 -3.977 12.857 656 H ASN 103 H ASN 103 -11.057 -1.451 11.845 657 HA ASN 103 HA ASN 103 -11.655 -0.057 14.349 658 HB2 ASN 103 HB2 ASN 103 -9.069 -0.593 12.883 659 HB3 ASN 103 HB3 ASN 103 -9.171 0.454 14.295 660 HD21 ASN 103 HD21 ASN 103 -9.624 -2.819 13.130 661 HD22 ASN 103 HD22 ASN 103 -9.457 -3.590 14.666 662 H VAL 104 H VAL 104 -10.715 0.536 11.007 663 HA VAL 104 HA VAL 104 -10.414 3.361 11.313 664 HB VAL 104 HB VAL 104 -10.799 1.681 8.833 665 HG11 VAL 104 HG11 VAL 104 -11.534 3.936 8.383 666 HG12 VAL 104 HG12 VAL 104 -10.067 4.594 9.110 667 HG13 VAL 104 HG13 VAL 104 -9.971 3.665 7.613 668 HG21 VAL 104 HG21 VAL 104 -8.694 1.525 10.389 669 HG22 VAL 104 HG22 VAL 104 -8.512 1.576 8.635 670 HG23 VAL 104 HG23 VAL 104 -8.254 3.035 9.592 671 H GLN 105 H GLN 105 -12.865 1.443 9.561 672 HA GLN 105 HA GLN 105 -14.636 3.451 8.961 673 HB2 GLN 105 HB2 GLN 105 -15.368 0.640 9.795 674 HB3 GLN 105 HB3 GLN 105 -16.373 1.737 8.857 675 HG2 GLN 105 HG2 GLN 105 -13.668 0.830 7.928 676 HG3 GLN 105 HG3 GLN 105 -15.146 -0.064 7.579 677 HE21 GLN 105 HE21 GLN 105 -13.386 2.895 7.029 678 HE22 GLN 105 HE22 GLN 105 -14.281 3.401 5.641 679 H VAL 106 H VAL 106 -14.072 1.915 12.035 680 HA VAL 106 HA VAL 106 -16.449 2.805 13.319 681 HB VAL 106 HB VAL 106 -13.840 1.701 14.280 682 HG11 VAL 106 HG11 VAL 106 -14.137 3.298 15.956 683 HG12 VAL 106 HG12 VAL 106 -15.893 3.128 15.937 684 HG13 VAL 106 HG13 VAL 106 -14.889 1.846 16.618 685 HG21 VAL 106 HG21 VAL 106 -15.193 -0.085 15.100 686 HG22 VAL 106 HG22 VAL 106 -16.675 0.830 14.817 687 HG23 VAL 106 HG23 VAL 106 -15.715 0.261 13.451 688 H VAL 107 H VAL 107 -13.079 3.961 13.464 689 HA VAL 107 HA VAL 107 -13.686 6.244 15.038 690 HB VAL 107 HB VAL 107 -11.432 5.340 15.000 691 HG11 VAL 107 HG11 VAL 107 -11.054 4.470 12.893 692 HG12 VAL 107 HG12 VAL 107 -11.631 5.923 12.074 693 HG13 VAL 107 HG13 VAL 107 -10.058 5.924 12.873 694 HG21 VAL 107 HG21 VAL 107 -11.572 8.112 13.818 695 HG22 VAL 107 HG22 VAL 107 -11.687 7.700 15.528 696 HG23 VAL 107 HG23 VAL 107 -10.179 7.426 14.655 697 H LEU 108 H LEU 108 -13.826 5.577 11.647 698 HA LEU 108 HA LEU 108 -13.745 8.294 10.761 699 HB2 LEU 108 HB2 LEU 108 -13.527 7.320 8.786 700 HB3 LEU 108 HB3 LEU 108 -13.712 5.755 9.574 701 HG LEU 108 HG LEU 108 -16.216 6.054 9.242 702 HD11 LEU 108 HD11 LEU 108 -15.263 8.544 8.155 703 HD12 LEU 108 HD12 LEU 108 -16.913 8.024 8.496 704 HD13 LEU 108 HD13 LEU 108 -16.169 7.635 6.946 705 HD21 LEU 108 HD21 LEU 108 -15.987 4.703 7.482 706 HD22 LEU 108 HD22 LEU 108 -14.250 4.960 7.650 707 HD23 LEU 108 HD23 LEU 108 -15.183 5.949 6.526 708 H GLN 109 H GLN 109 -16.298 5.996 11.561 709 HA GLN 109 HA GLN 109 -18.465 7.574 10.666 710 HB2 GLN 109 HB2 GLN 109 -18.195 5.265 12.560 711 HB3 GLN 109 HB3 GLN 109 -19.729 6.111 12.417 712 HG2 GLN 109 HG2 GLN 109 -19.946 5.530 10.137 713 HG3 GLN 109 HG3 GLN 109 -18.278 4.965 10.053 714 HE21 GLN 109 HE21 GLN 109 -17.773 3.150 11.610 715 HE22 GLN 109 HE22 GLN 109 -18.957 1.900 11.749 716 H GLN 110 H GLN 110 -16.830 7.295 13.787 717 HA GLN 110 HA GLN 110 -18.598 8.932 15.249 718 HB2 GLN 110 HB2 GLN 110 -15.676 8.298 15.673 719 HB3 GLN 110 HB3 GLN 110 -16.664 9.178 16.832 720 HG2 GLN 110 HG2 GLN 110 -18.216 7.116 16.711 721 HG3 GLN 110 HG3 GLN 110 -16.811 6.307 16.021 722 HE21 GLN 110 HE21 GLN 110 -15.601 5.280 17.426 723 HE22 GLN 110 HE22 GLN 110 -15.414 5.672 19.098 724 H THR 111 H THR 111 -16.360 9.679 12.821 725 HA THR 111 HA THR 111 -15.999 12.437 13.720 726 HB THR 111 HB THR 111 -14.825 10.960 11.357 727 HG1 THR 111 HG1 THR 111 -13.944 11.594 13.953 728 HG21 THR 111 HG21 THR 111 -15.080 13.306 10.796 729 HG22 THR 111 HG22 THR 111 -13.380 12.952 11.101 730 HG23 THR 111 HG23 THR 111 -14.342 13.779 12.325 731 H TYR 112 H TYR 112 -16.951 10.806 10.689 732 HA TYR 112 HA TYR 112 -18.556 13.171 10.012 733 HB2 TYR 112 HB2 TYR 112 -17.828 10.917 8.144 734 HB3 TYR 112 HB3 TYR 112 -18.389 12.532 7.728 735 HD1 TYR 112 HD1 TYR 112 -15.518 10.575 8.948 736 HD2 TYR 112 HD2 TYR 112 -16.870 14.381 7.612 737 HE1 TYR 112 HE1 TYR 112 -13.185 11.326 8.745 738 HE2 TYR 112 HE2 TYR 112 -14.541 15.142 7.405 739 HH TYR 112 HH TYR 112 -11.990 13.226 7.232 740 H GLY 113 H GLY 113 -18.692 9.633 10.185 741 HA2 GLY 113 HA2 GLY 113 -20.684 8.622 11.154 742 HA3 GLY 113 HA3 GLY 113 -21.631 9.862 10.343 743 H SER 114 H SER 114 -19.617 9.328 8.006 744 HA SER 114 HA SER 114 -21.298 7.276 6.782 745 HB2 SER 114 HB2 SER 114 -20.616 9.617 5.757 746 HB3 SER 114 HB3 SER 114 -19.173 8.733 5.264 747 HG SER 114 HG SER 114 -21.592 8.709 4.149 748 H THR 115 H THR 115 -19.764 6.163 4.897 749 HA THR 115 HA THR 115 -17.282 5.197 6.044 750 HB THR 115 HB THR 115 -17.920 2.820 5.896 751 HG1 THR 115 HG1 THR 115 -19.736 2.327 4.946 752 HG21 THR 115 HG21 THR 115 -18.164 4.237 8.016 753 HG22 THR 115 HG22 THR 115 -19.022 2.697 7.969 754 HG23 THR 115 HG23 THR 115 -19.896 4.204 7.690 755 H LEU 116 H LEU 116 -16.563 3.212 4.504 756 HA LEU 116 HA LEU 116 -16.548 4.376 1.831 757 HB2 LEU 116 HB2 LEU 116 -14.666 3.004 3.437 758 HB3 LEU 116 HB3 LEU 116 -14.970 2.006 2.017 759 HG LEU 116 HG LEU 116 -14.581 4.401 0.838 760 HD11 LEU 116 HD11 LEU 116 -13.281 4.508 3.501 761 HD12 LEU 116 HD12 LEU 116 -13.941 5.805 2.505 762 HD13 LEU 116 HD13 LEU 116 -12.367 5.110 2.117 763 HD21 LEU 116 HD21 LEU 116 -12.759 3.409 -0.055 764 HD22 LEU 116 HD22 LEU 116 -13.389 1.995 0.793 765 HD23 LEU 116 HD23 LEU 116 -12.099 2.957 1.517 766 H LYS 117 H LYS 117 -16.869 3.072 -0.063 767 HA LYS 117 HA LYS 117 -18.845 0.941 0.386 768 HB2 LYS 117 HB2 LYS 117 -19.822 2.661 -0.906 769 HB3 LYS 117 HB3 LYS 117 -18.383 2.843 -1.902 770 HG2 LYS 117 HG2 LYS 117 -20.224 1.748 -3.095 771 HG3 LYS 117 HG3 LYS 117 -18.799 0.715 -2.962 772 HD2 LYS 117 HD2 LYS 117 -20.398 0.222 -0.686 773 HD3 LYS 117 HD3 LYS 117 -21.472 0.213 -2.086 774 HE2 LYS 117 HE2 LYS 117 -18.960 -1.207 -2.531 775 HE3 LYS 117 HE3 LYS 117 -19.931 -1.892 -1.228 776 HZ1 LYS 117 HZ1 LYS 117 -20.370 -1.966 -4.055 777 HZ2 LYS 117 HZ2 LYS 117 -21.731 -1.415 -3.216 778 HZ3 LYS 117 HZ3 LYS 117 -21.053 -2.917 -2.833 779 H VAL 118 H VAL 118 -17.633 -0.889 0.557 780 HA VAL 118 HA VAL 118 -15.890 -1.539 -1.733 781 HB VAL 118 HB VAL 118 -14.796 -3.179 -0.107 782 HG11 VAL 118 HG11 VAL 118 -13.188 -1.657 -0.248 783 HG12 VAL 118 HG12 VAL 118 -14.379 -0.394 -0.565 784 HG13 VAL 118 HG13 VAL 118 -13.920 -0.778 1.094 785 HG21 VAL 118 HG21 VAL 118 -15.460 -1.466 2.164 786 HG22 VAL 118 HG22 VAL 118 -16.827 -2.406 1.564 787 HG23 VAL 118 HG23 VAL 118 -15.347 -3.224 2.063 788 H THR 119 H THR 119 -17.436 -2.564 -2.974 789 HA THR 119 HA THR 119 -19.408 -4.316 -2.174 790 HB THR 119 HB THR 119 -19.207 -3.471 -4.477 791 HG1 THR 119 HG1 THR 119 -20.262 -5.188 -5.177 792 HG21 THR 119 HG21 THR 119 -17.126 -5.576 -4.991 793 HG22 THR 119 HG22 THR 119 -16.674 -3.935 -4.526 794 HG23 THR 119 HG23 THR 119 -17.595 -4.211 -6.003 795 H LYS 207 H LYS 207 8.012 -6.083 15.963 796 HA LYS 207 HA LYS 207 9.940 -7.133 14.022 797 HB2 LYS 207 HB2 LYS 207 8.948 -8.636 16.179 798 HB3 LYS 207 HB3 LYS 207 8.051 -9.186 14.769 799 HG2 LYS 207 HG2 LYS 207 10.700 -9.038 13.923 800 HG3 LYS 207 HG3 LYS 207 10.770 -9.729 15.545 801 HD2 LYS 207 HD2 LYS 207 8.667 -10.813 13.790 802 HD3 LYS 207 HD3 LYS 207 10.325 -11.172 13.304 803 HE2 LYS 207 HE2 LYS 207 10.747 -11.990 15.623 804 HE3 LYS 207 HE3 LYS 207 9.029 -11.777 15.958 805 HZ1 LYS 207 HZ1 LYS 207 9.474 -14.051 15.374 806 HZ2 LYS 207 HZ2 LYS 207 10.213 -13.588 13.924 807 HZ3 LYS 207 HZ3 LYS 207 8.555 -13.340 14.144 808 H SER 208 H SER 208 9.186 -6.655 12.076 809 HA SER 208 HA SER 208 6.713 -7.493 11.085 810 HB2 SER 208 HB2 SER 208 5.259 -5.797 11.401 811 HB3 SER 208 HB3 SER 208 6.363 -5.261 12.668 812 HG SER 208 HG SER 208 5.927 -3.583 11.197 813 H PHE 209 H PHE 209 6.318 -6.759 8.873 814 HA PHE 209 HA PHE 209 8.737 -6.561 7.403 815 HB2 PHE 209 HB2 PHE 209 6.899 -7.743 6.420 816 HB3 PHE 209 HB3 PHE 209 5.842 -6.344 6.574 817 HD1 PHE 209 HD2 PHE 209 8.809 -7.656 4.804 818 HD2 PHE 209 HD1 PHE 209 5.744 -4.704 4.896 819 HE1 PHE 209 HE2 PHE 209 9.433 -6.943 2.533 820 HE2 PHE 209 HE1 PHE 209 6.362 -3.986 2.625 821 HZ PHE 209 HZ PHE 209 8.210 -5.106 1.441 822 H PHE 210 H PHE 210 6.125 -4.271 8.101 823 HA PHE 210 HA PHE 210 7.080 -2.146 6.538 824 HB2 PHE 210 HB2 PHE 210 5.307 -2.272 8.965 825 HB3 PHE 210 HB3 PHE 210 5.736 -0.734 8.226 826 HD1 PHE 210 HD1 PHE 210 5.531 -0.977 5.469 827 HD2 PHE 210 HD2 PHE 210 3.205 -2.976 8.420 828 HE1 PHE 210 HE1 PHE 210 3.707 -1.252 3.840 829 HE2 PHE 210 HE2 PHE 210 1.377 -3.254 6.796 830 HZ PHE 210 HZ PHE 210 1.627 -2.390 4.504 831 H ASP 211 H ASP 211 8.074 -3.367 9.616 832 HA ASP 211 HA ASP 211 9.425 -1.013 10.508 833 HB2 ASP 211 HB2 ASP 211 9.219 -3.840 11.392 834 HB3 ASP 211 HB3 ASP 211 10.650 -2.952 11.911 835 H LYS 212 H LYS 212 10.480 -4.031 8.962 836 HA LYS 212 HA LYS 212 13.226 -3.285 8.847 837 HB2 LYS 212 HB2 LYS 212 13.489 -5.229 7.393 838 HB3 LYS 212 HB3 LYS 212 12.508 -5.631 8.795 839 HG2 LYS 212 HG2 LYS 212 10.516 -5.630 7.515 840 HG3 LYS 212 HG3 LYS 212 11.331 -4.905 6.126 841 HD2 LYS 212 HD2 LYS 212 10.973 -7.289 5.773 842 HD3 LYS 212 HD3 LYS 212 12.697 -6.928 5.883 843 HE2 LYS 212 HE2 LYS 212 12.177 -8.935 7.140 844 HE3 LYS 212 HE3 LYS 212 12.681 -7.646 8.233 845 HZ1 LYS 212 HZ1 LYS 212 10.490 -7.310 8.945 846 HZ2 LYS 212 HZ2 LYS 212 10.672 -8.991 8.911 847 HZ3 LYS 212 HZ3 LYS 212 9.830 -8.207 7.671 848 H LYS 213 H LYS 213 10.466 -2.631 6.884 849 HA LYS 213 HA LYS 213 11.985 -1.911 4.535 850 HB2 LYS 213 HB2 LYS 213 9.808 -2.780 4.126 851 HB3 LYS 213 HB3 LYS 213 9.072 -1.671 5.275 852 HG2 LYS 213 HG2 LYS 213 8.573 -0.964 3.032 853 HG3 LYS 213 HG3 LYS 213 9.651 0.209 3.792 854 HD2 LYS 213 HD2 LYS 213 10.640 -0.033 1.728 855 HD3 LYS 213 HD3 LYS 213 11.524 -1.235 2.670 856 HE2 LYS 213 HE2 LYS 213 9.034 -2.039 1.236 857 HE3 LYS 213 HE3 LYS 213 10.529 -1.839 0.321 858 HZ1 LYS 213 HZ1 LYS 213 9.907 -3.780 2.449 859 HZ2 LYS 213 HZ2 LYS 213 11.513 -3.349 2.141 860 HZ3 LYS 213 HZ3 LYS 213 10.578 -4.052 0.919 861 H ARG 214 H ARG 214 10.079 -0.170 6.986 862 HA ARG 214 HA ARG 214 10.522 2.415 6.038 863 HB2 ARG 214 HB2 ARG 214 9.832 3.187 8.201 864 HB3 ARG 214 HB3 ARG 214 8.885 1.758 7.810 865 HG2 ARG 214 HG2 ARG 214 10.183 0.405 9.286 866 HG3 ARG 214 HG3 ARG 214 11.340 1.712 9.547 867 HD2 ARG 214 HD2 ARG 214 9.794 2.975 10.788 868 HD3 ARG 214 HD3 ARG 214 8.431 2.007 10.229 869 HE ARG 214 HE ARG 214 8.879 0.475 11.877 870 HH11 ARG 214 HH11 ARG 214 11.579 2.649 11.550 871 HH12 ARG 214 HH12 ARG 214 12.384 2.071 12.971 872 HH21 ARG 214 HH21 ARG 214 9.930 -0.295 13.750 873 HH22 ARG 214 HH22 ARG 214 11.446 0.394 14.221 874 H SER 215 H SER 215 12.560 0.289 7.904 875 HA SER 215 HA SER 215 14.416 2.332 8.698 876 HB2 SER 215 HB2 SER 215 14.253 0.407 10.115 877 HB3 SER 215 HB3 SER 215 14.542 -0.688 8.763 878 HG SER 215 HG SER 215 16.417 1.227 9.694 879 H GLU 216 H GLU 216 14.089 0.101 6.029 880 HA GLU 216 HA GLU 216 16.707 0.200 5.029 881 HB2 GLU 216 HB2 GLU 216 14.038 -0.502 3.940 882 HB3 GLU 216 HB3 GLU 216 15.291 -0.125 2.766 883 HG2 GLU 216 HG2 GLU 216 15.811 -2.082 4.964 884 HG3 GLU 216 HG3 GLU 216 14.946 -2.569 3.507 885 H ARG 217 H ARG 217 13.870 2.198 4.265 886 HA ARG 217 HA ARG 217 15.168 3.831 2.361 887 HB2 ARG 217 HB2 ARG 217 13.253 5.381 2.726 888 HB3 ARG 217 HB3 ARG 217 12.762 3.722 2.409 889 HG2 ARG 217 HG2 ARG 217 12.404 3.378 4.808 890 HG3 ARG 217 HG3 ARG 217 12.873 5.053 5.109 891 HD2 ARG 217 HD2 ARG 217 10.465 4.027 3.628 892 HD3 ARG 217 HD3 ARG 217 10.508 5.019 5.084 893 HE ARG 217 HE ARG 217 11.732 6.592 3.281 894 HH11 ARG 217 HH11 ARG 217 8.738 4.816 3.198 895 HH12 ARG 217 HH12 ARG 217 7.954 5.933 2.130 896 HH21 ARG 217 HH21 ARG 217 10.710 8.069 1.876 897 HH22 ARG 217 HH22 ARG 217 9.078 7.783 1.379 898 H ILE 218 H ILE 218 14.697 4.129 5.847 899 HA ILE 218 HA ILE 218 15.773 6.747 6.071 900 HB ILE 218 HB ILE 218 15.556 4.585 8.170 901 HG12 ILE 218 HG12 ILE 218 13.749 6.969 7.840 902 HG13 ILE 218 HG13 ILE 218 13.438 5.464 6.982 903 HG21 ILE 218 HG21 ILE 218 15.480 6.826 9.591 904 HG22 ILE 218 HG22 ILE 218 16.995 6.014 9.198 905 HG23 ILE 218 HG23 ILE 218 16.468 7.404 8.250 906 HD11 ILE 218 HD11 ILE 218 12.930 6.168 9.739 907 HD12 ILE 218 HD12 ILE 218 12.285 4.843 8.770 908 HD13 ILE 218 HD13 ILE 218 13.834 4.662 9.592 909 H SER 219 H SER 219 17.177 3.596 5.837 910 HA SER 219 HA SER 219 19.790 4.571 6.723 911 HB2 SER 219 HB2 SER 219 20.451 2.336 6.943 912 HB3 SER 219 HB3 SER 219 18.750 2.291 7.406 913 HG SER 219 HG SER 219 18.729 0.757 5.943 914 H ASN 220 H ASN 220 21.646 3.474 5.331 915 HA ASN 220 HA ASN 220 21.573 4.765 2.806 916 HB2 ASN 220 HB2 ASN 220 23.807 3.876 2.483 917 HB3 ASN 220 HB3 ASN 220 23.645 4.446 4.141 918 HD21 ASN 220 HD21 ASN 220 24.218 3.116 5.708 919 HD22 ASN 220 HD22 ASN 220 24.471 1.414 5.546 Start of MODEL 16 1 H ALA 23 H ALA 23 5.019 14.094 12.233 2 HA ALA 23 HA ALA 23 3.278 12.893 13.087 3 HB1 ALA 23 HB1 ALA 23 2.005 15.594 13.488 4 HB2 ALA 23 HB2 ALA 23 1.708 14.119 14.409 5 HB3 ALA 23 HB3 ALA 23 3.269 14.932 14.525 6 H ALA 24 H ALA 24 3.230 13.387 10.226 7 HA ALA 24 HA ALA 24 0.379 13.641 9.627 8 HB1 ALA 24 HB1 ALA 24 1.703 13.180 7.237 9 HB2 ALA 24 HB2 ALA 24 1.202 14.746 7.878 10 HB3 ALA 24 HB3 ALA 24 2.835 14.151 8.180 11 HA PRO 25 HA PRO 25 -0.369 9.360 9.023 12 HB2 PRO 25 HB2 PRO 25 -1.963 9.351 6.826 13 HB3 PRO 25 HB3 PRO 25 -2.511 9.919 8.407 14 HG2 PRO 25 HG2 PRO 25 -1.560 11.502 6.051 15 HG3 PRO 25 HG3 PRO 25 -2.935 11.813 7.126 16 HD2 PRO 25 HD2 PRO 25 -0.570 13.107 7.374 17 HD3 PRO 25 HD3 PRO 25 -1.604 12.734 8.768 18 H ASN 26 H ASN 26 1.636 8.486 8.505 19 HA ASN 26 HA ASN 26 2.133 8.128 5.624 20 HB2 ASN 26 HB2 ASN 26 4.383 8.119 7.609 21 HB3 ASN 26 HB3 ASN 26 4.430 8.440 5.877 22 HD21 ASN 26 HD21 ASN 26 2.505 10.329 5.575 23 HD22 ASN 26 HD22 ASN 26 2.943 11.763 6.433 24 H LEU 27 H LEU 27 2.909 6.113 4.965 25 HA LEU 27 HA LEU 27 2.549 3.973 6.951 26 HB2 LEU 27 HB2 LEU 27 1.151 4.215 4.743 27 HB3 LEU 27 HB3 LEU 27 2.571 3.471 4.012 28 HG LEU 27 HG LEU 27 2.288 1.557 5.594 29 HD11 LEU 27 HD11 LEU 27 -0.516 2.294 6.096 30 HD12 LEU 27 HD12 LEU 27 0.690 3.195 7.014 31 HD13 LEU 27 HD13 LEU 27 0.637 1.436 7.118 32 HD21 LEU 27 HD21 LEU 27 0.882 0.464 4.166 33 HD22 LEU 27 HD22 LEU 27 1.256 1.882 3.186 34 HD23 LEU 27 HD23 LEU 27 -0.261 1.805 4.085 35 H ALA 28 H ALA 28 4.369 3.109 7.677 36 HA ALA 28 HA ALA 28 6.514 2.361 7.811 37 HB1 ALA 28 HB1 ALA 28 6.780 1.887 4.918 38 HB2 ALA 28 HB2 ALA 28 7.037 0.794 6.279 39 HB3 ALA 28 HB3 ALA 28 5.402 1.109 5.698 40 H GLY 29 H GLY 29 6.044 5.204 7.250 41 HA2 GLY 29 HA2 GLY 29 7.611 6.949 7.198 42 HA3 GLY 29 HA3 GLY 29 8.769 5.857 6.452 43 H ALA 30 H ALA 30 5.709 5.753 4.999 44 HA ALA 30 HA ALA 30 6.721 7.356 2.753 45 HB1 ALA 30 HB1 ALA 30 4.611 5.202 2.815 46 HB2 ALA 30 HB2 ALA 30 5.081 6.120 1.383 47 HB3 ALA 30 HB3 ALA 30 6.248 5.059 2.173 48 H VAL 31 H VAL 31 5.890 9.313 2.492 49 HA VAL 31 HA VAL 31 3.362 9.995 3.784 50 HB VAL 31 HB VAL 31 5.260 11.846 2.338 51 HG11 VAL 31 HG11 VAL 31 2.975 12.689 2.643 52 HG12 VAL 31 HG12 VAL 31 3.107 12.397 4.379 53 HG13 VAL 31 HG13 VAL 31 4.143 13.596 3.604 54 HG21 VAL 31 HG21 VAL 31 6.668 11.266 4.010 55 HG22 VAL 31 HG22 VAL 31 5.679 12.398 4.935 56 HG23 VAL 31 HG23 VAL 31 5.370 10.664 5.042 57 H GLU 32 H GLU 32 4.831 9.830 0.588 58 HA GLU 32 HA GLU 32 2.618 10.996 -0.786 59 HB2 GLU 32 HB2 GLU 32 4.870 9.264 -1.818 60 HB3 GLU 32 HB3 GLU 32 3.735 10.150 -2.826 61 HG2 GLU 32 HG2 GLU 32 5.402 11.569 -0.789 62 HG3 GLU 32 HG3 GLU 32 6.057 11.157 -2.374 63 H PHE 33 H PHE 33 1.014 10.000 -2.001 64 HA PHE 33 HA PHE 33 -0.076 7.634 -0.943 65 HB2 PHE 33 HB2 PHE 33 -1.605 9.140 -1.920 66 HB3 PHE 33 HB3 PHE 33 -0.675 9.250 -3.411 67 HD1 PHE 33 HD1 PHE 33 -2.782 6.969 -1.392 68 HD2 PHE 33 HD2 PHE 33 -1.131 7.840 -5.217 69 HE1 PHE 33 HE1 PHE 33 -4.194 5.222 -2.394 70 HE2 PHE 33 HE2 PHE 33 -2.542 6.095 -6.226 71 HZ PHE 33 HZ PHE 33 -4.076 4.784 -4.815 72 H SER 34 H SER 34 1.512 8.245 -4.070 73 HA SER 34 HA SER 34 1.355 5.714 -5.156 74 HB2 SER 34 HB2 SER 34 3.018 6.374 -6.665 75 HB3 SER 34 HB3 SER 34 2.334 7.912 -6.141 76 HG SER 34 HG SER 34 4.450 8.231 -5.878 77 H ASP 35 H ASP 35 3.630 6.962 -2.779 78 HA ASP 35 HA ASP 35 5.307 4.649 -2.778 79 HB2 ASP 35 HB2 ASP 35 5.048 7.099 -1.086 80 HB3 ASP 35 HB3 ASP 35 5.953 5.728 -0.451 81 H VAL 36 H VAL 36 2.411 5.607 -1.098 82 HA VAL 36 HA VAL 36 2.583 3.675 0.994 83 HB VAL 36 HB VAL 36 0.172 5.143 -0.087 84 HG11 VAL 36 HG11 VAL 36 -0.137 4.438 2.631 85 HG12 VAL 36 HG12 VAL 36 -1.068 3.872 1.243 86 HG13 VAL 36 HG13 VAL 36 0.363 2.984 1.768 87 HG21 VAL 36 HG21 VAL 36 1.247 5.882 2.530 88 HG22 VAL 36 HG22 VAL 36 2.346 6.205 1.189 89 HG23 VAL 36 HG23 VAL 36 0.725 6.902 1.190 90 H LYS 37 H LYS 37 0.502 3.855 -1.901 91 HA LYS 37 HA LYS 37 -0.638 1.325 -1.673 92 HB2 LYS 37 HB2 LYS 37 -0.960 1.524 -4.188 93 HB3 LYS 37 HB3 LYS 37 -1.621 2.828 -3.210 94 HG2 LYS 37 HG2 LYS 37 -0.071 4.351 -3.944 95 HG3 LYS 37 HG3 LYS 37 1.125 3.111 -4.329 96 HD2 LYS 37 HD2 LYS 37 -1.326 2.873 -5.894 97 HD3 LYS 37 HD3 LYS 37 -0.492 4.409 -6.138 98 HE2 LYS 37 HE2 LYS 37 1.589 3.168 -6.603 99 HE3 LYS 37 HE3 LYS 37 0.703 1.653 -6.428 100 HZ1 LYS 37 HZ1 LYS 37 -0.587 3.400 -8.266 101 HZ2 LYS 37 HZ2 LYS 37 -0.042 1.815 -8.497 102 HZ3 LYS 37 HZ3 LYS 37 1.015 3.115 -8.731 103 H THR 38 H THR 38 2.431 2.322 -3.051 104 HA THR 38 HA THR 38 3.060 -0.086 -4.380 105 HB THR 38 HB THR 38 4.869 2.052 -3.243 106 HG1 THR 38 HG1 THR 38 4.785 2.884 -5.262 107 HG21 THR 38 HG21 THR 38 5.525 -0.288 -5.034 108 HG22 THR 38 HG22 THR 38 6.146 0.012 -3.411 109 HG23 THR 38 HG23 THR 38 6.598 1.079 -4.741 110 H LEU 39 H LEU 39 3.556 1.009 -1.070 111 HA LEU 39 HA LEU 39 5.224 -1.159 -0.287 112 HB2 LEU 39 HB2 LEU 39 3.534 0.755 1.311 113 HB3 LEU 39 HB3 LEU 39 4.626 -0.429 2.029 114 HG LEU 39 HG LEU 39 5.709 1.548 0.072 115 HD11 LEU 39 HD11 LEU 39 5.990 2.489 2.770 116 HD12 LEU 39 HD12 LEU 39 4.285 2.357 2.343 117 HD13 LEU 39 HD13 LEU 39 5.368 3.328 1.349 118 HD21 LEU 39 HD21 LEU 39 7.190 -0.182 0.815 119 HD22 LEU 39 HD22 LEU 39 6.778 0.121 2.504 120 HD23 LEU 39 HD23 LEU 39 7.676 1.329 1.584 121 H LEU 40 H LEU 40 1.753 -0.589 -0.249 122 HA LEU 40 HA LEU 40 1.105 -2.902 1.287 123 HB2 LEU 40 HB2 LEU 40 -0.654 -1.376 -0.625 124 HB3 LEU 40 HB3 LEU 40 -1.182 -2.460 0.661 125 HG LEU 40 HG LEU 40 0.374 0.031 1.275 126 HD11 LEU 40 HD11 LEU 40 -2.350 0.503 1.769 127 HD12 LEU 40 HD12 LEU 40 -2.237 -0.084 0.110 128 HD13 LEU 40 HD13 LEU 40 -1.299 1.322 0.613 129 HD21 LEU 40 HD21 LEU 40 -1.111 -0.226 3.363 130 HD22 LEU 40 HD22 LEU 40 0.244 -1.334 3.154 131 HD23 LEU 40 HD23 LEU 40 -1.395 -1.864 2.777 132 H LYS 41 H LYS 41 1.067 -2.164 -2.185 133 HA LYS 41 HA LYS 41 0.012 -4.521 -3.162 134 HB2 LYS 41 HB2 LYS 41 0.916 -2.310 -4.335 135 HB3 LYS 41 HB3 LYS 41 2.324 -3.327 -4.614 136 HG2 LYS 41 HG2 LYS 41 0.535 -5.027 -5.494 137 HG3 LYS 41 HG3 LYS 41 -0.437 -3.568 -5.697 138 HD2 LYS 41 HD2 LYS 41 0.614 -3.706 -7.745 139 HD3 LYS 41 HD3 LYS 41 1.715 -2.648 -6.862 140 HE2 LYS 41 HE2 LYS 41 3.242 -4.117 -7.676 141 HE3 LYS 41 HE3 LYS 41 2.799 -4.990 -6.210 142 HZ1 LYS 41 HZ1 LYS 41 1.181 -5.528 -8.564 143 HZ2 LYS 41 HZ2 LYS 41 1.744 -6.587 -7.371 144 HZ3 LYS 41 HZ3 LYS 41 2.774 -6.092 -8.618 145 H GLU 42 H GLU 42 3.367 -3.808 -2.278 146 HA GLU 42 HA GLU 42 4.312 -6.412 -3.031 147 HB2 GLU 42 HB2 GLU 42 6.424 -5.701 -1.976 148 HB3 GLU 42 HB3 GLU 42 5.822 -4.514 -3.123 149 HG2 GLU 42 HG2 GLU 42 4.891 -3.221 -1.231 150 HG3 GLU 42 HG3 GLU 42 5.636 -4.374 -0.125 151 H TRP 43 H TRP 43 3.476 -4.795 0.000 152 HA TRP 43 HA TRP 43 4.286 -6.863 1.732 153 HB2 TRP 43 HB2 TRP 43 3.895 -4.678 2.636 154 HB3 TRP 43 HB3 TRP 43 2.234 -4.670 2.051 155 HD1 TRP 43 HD1 TRP 43 4.308 -6.924 4.455 156 HE1 TRP 43 HE1 TRP 43 2.817 -7.490 6.476 157 HE3 TRP 43 HE3 TRP 43 0.053 -4.472 3.036 158 HZ2 TRP 43 HZ2 TRP 43 0.186 -6.968 7.352 159 HZ3 TRP 43 HZ3 TRP 43 -1.907 -4.555 4.521 160 HH2 TRP 43 HH2 TRP 43 -1.840 -5.778 6.634 161 H ILE 44 H ILE 44 1.700 -6.672 -0.450 162 HA ILE 44 HA ILE 44 0.156 -8.718 0.982 163 HB ILE 44 HB ILE 44 -0.593 -7.080 -1.442 164 HG12 ILE 44 HG12 ILE 44 -1.925 -6.936 1.242 165 HG13 ILE 44 HG13 ILE 44 -0.439 -6.038 0.953 166 HG21 ILE 44 HG21 ILE 44 -2.048 -9.226 0.070 167 HG22 ILE 44 HG22 ILE 44 -2.899 -8.020 -0.894 168 HG23 ILE 44 HG23 ILE 44 -1.745 -9.110 -1.664 169 HD11 ILE 44 HD11 ILE 44 -2.542 -4.745 0.614 170 HD12 ILE 44 HD12 ILE 44 -1.457 -4.767 -0.777 171 HD13 ILE 44 HD13 ILE 44 -2.893 -5.791 -0.762 172 H THR 45 H THR 45 2.443 -8.386 -1.465 173 HA THR 45 HA THR 45 1.596 -10.870 -2.789 174 HB THR 45 HB THR 45 3.215 -10.279 -4.563 175 HG1 THR 45 HG1 THR 45 4.713 -8.937 -3.843 176 HG21 THR 45 HG21 THR 45 1.215 -9.516 -5.305 177 HG22 THR 45 HG22 THR 45 1.970 -7.940 -5.062 178 HG23 THR 45 HG23 THR 45 0.897 -8.604 -3.831 179 H THR 46 H THR 46 4.589 -9.274 -1.680 180 HA THR 46 HA THR 46 6.154 -11.630 -1.746 181 HB THR 46 HB THR 46 7.073 -9.296 -1.766 182 HG1 THR 46 HG1 THR 46 8.904 -9.909 -0.583 183 HG21 THR 46 HG21 THR 46 6.679 -7.871 -0.097 184 HG22 THR 46 HG22 THR 46 7.314 -9.017 1.083 185 HG23 THR 46 HG23 THR 46 5.613 -9.076 0.624 186 H ILE 47 H ILE 47 3.812 -10.507 0.455 187 HA ILE 47 HA ILE 47 4.645 -12.559 2.396 188 HB ILE 47 HB ILE 47 3.509 -9.830 3.005 189 HG12 ILE 47 HG12 ILE 47 5.842 -10.620 4.506 190 HG13 ILE 47 HG13 ILE 47 6.152 -10.780 2.781 191 HG21 ILE 47 HG21 ILE 47 3.738 -10.618 5.409 192 HG22 ILE 47 HG22 ILE 47 2.393 -11.281 4.484 193 HG23 ILE 47 HG23 ILE 47 3.840 -12.252 4.753 194 HD11 ILE 47 HD11 ILE 47 4.983 -8.354 2.846 195 HD12 ILE 47 HD12 ILE 47 5.777 -8.381 4.421 196 HD13 ILE 47 HD13 ILE 47 6.722 -8.623 2.953 197 H SER 48 H SER 48 3.148 -14.044 2.817 198 HA SER 48 HA SER 48 0.393 -13.525 1.925 199 HB2 SER 48 HB2 SER 48 2.095 -15.977 2.028 200 HB3 SER 48 HB3 SER 48 0.352 -16.165 2.220 201 HG SER 48 HG SER 48 1.449 -16.132 -0.013 202 H ASP 49 H ASP 49 2.366 -14.339 4.654 203 HA ASP 49 HA ASP 49 -0.050 -14.625 6.316 204 HB2 ASP 49 HB2 ASP 49 1.670 -15.657 7.971 205 HB3 ASP 49 HB3 ASP 49 1.106 -16.627 6.614 206 HA PRO 50 HA PRO 50 1.801 -10.566 7.477 207 HB2 PRO 50 HB2 PRO 50 -0.592 -9.344 7.865 208 HB3 PRO 50 HB3 PRO 50 0.181 -9.461 6.279 209 HG2 PRO 50 HG2 PRO 50 -2.009 -11.135 7.446 210 HG3 PRO 50 HG3 PRO 50 -1.860 -10.469 5.809 211 HD2 PRO 50 HD2 PRO 50 -1.275 -13.048 6.391 212 HD3 PRO 50 HD3 PRO 50 -0.427 -12.139 5.125 213 H MET 51 H MET 51 2.034 -9.702 9.520 214 HA MET 51 HA MET 51 0.917 -11.303 11.694 215 HB2 MET 51 HB2 MET 51 3.443 -10.572 11.327 216 HB3 MET 51 HB3 MET 51 2.901 -9.131 12.178 217 HG2 MET 51 HG2 MET 51 2.266 -10.410 14.088 218 HG3 MET 51 HG3 MET 51 2.546 -11.924 13.229 219 HE1 MET 51 HE1 MET 51 3.837 -9.344 15.547 220 HE2 MET 51 HE2 MET 51 5.589 -9.295 15.351 221 HE3 MET 51 HE3 MET 51 4.545 -8.543 14.144 222 H GLU 52 H GLU 52 0.374 -10.076 13.742 223 HA GLU 52 HA GLU 52 -1.774 -8.345 13.263 224 HB2 GLU 52 HB2 GLU 52 -1.108 -9.799 15.362 225 HB3 GLU 52 HB3 GLU 52 -0.363 -8.299 15.896 226 HG2 GLU 52 HG2 GLU 52 -2.354 -7.820 16.761 227 HG3 GLU 52 HG3 GLU 52 -2.838 -7.460 15.104 228 H GLU 53 H GLU 53 1.376 -7.582 14.756 229 HA GLU 53 HA GLU 53 1.085 -4.847 14.956 230 HB2 GLU 53 HB2 GLU 53 3.471 -6.620 14.584 231 HB3 GLU 53 HB3 GLU 53 3.674 -4.874 14.568 232 HG2 GLU 53 HG2 GLU 53 4.088 -5.458 16.771 233 HG3 GLU 53 HG3 GLU 53 2.418 -4.897 16.797 234 H ASP 54 H ASP 54 1.818 -6.783 12.145 235 HA ASP 54 HA ASP 54 2.683 -4.651 10.473 236 HB2 ASP 54 HB2 ASP 54 1.566 -7.379 9.794 237 HB3 ASP 54 HB3 ASP 54 2.266 -6.270 8.618 238 H ILE 55 H ILE 55 -0.420 -6.367 10.777 239 HA ILE 55 HA ILE 55 -1.788 -4.795 8.867 240 HB ILE 55 HB ILE 55 -2.951 -6.335 11.191 241 HG12 ILE 55 HG12 ILE 55 -2.659 -7.240 8.324 242 HG13 ILE 55 HG13 ILE 55 -1.478 -7.624 9.573 243 HG21 ILE 55 HG21 ILE 55 -4.539 -4.757 10.276 244 HG22 ILE 55 HG22 ILE 55 -4.208 -5.330 8.642 245 HG23 ILE 55 HG23 ILE 55 -4.991 -6.396 9.809 246 HD11 ILE 55 HD11 ILE 55 -3.278 -8.737 10.856 247 HD12 ILE 55 HD12 ILE 55 -4.369 -8.447 9.500 248 HD13 ILE 55 HD13 ILE 55 -2.955 -9.481 9.290 249 H LEU 56 H LEU 56 -1.513 -4.577 12.391 250 HA LEU 56 HA LEU 56 -3.345 -2.580 12.910 251 HB2 LEU 56 HB2 LEU 56 -0.863 -3.540 14.179 252 HB3 LEU 56 HB3 LEU 56 -1.379 -1.919 14.637 253 HG LEU 56 HG LEU 56 -2.146 -3.666 16.203 254 HD11 LEU 56 HD11 LEU 56 -4.508 -2.497 14.766 255 HD12 LEU 56 HD12 LEU 56 -3.397 -1.508 15.712 256 HD13 LEU 56 HD13 LEU 56 -4.308 -2.801 16.491 257 HD21 LEU 56 HD21 LEU 56 -3.655 -4.657 13.790 258 HD22 LEU 56 HD22 LEU 56 -4.008 -5.143 15.449 259 HD23 LEU 56 HD23 LEU 56 -2.444 -5.528 14.729 260 H GLN 57 H GLN 57 -0.033 -2.286 11.725 261 HA GLN 57 HA GLN 57 0.315 0.454 11.925 262 HB2 GLN 57 HB2 GLN 57 1.423 -1.685 10.197 263 HB3 GLN 57 HB3 GLN 57 1.637 -0.034 9.632 264 HG2 GLN 57 HG2 GLN 57 2.411 -0.916 12.395 265 HG3 GLN 57 HG3 GLN 57 3.506 -1.004 11.017 266 HE21 GLN 57 HE21 GLN 57 4.546 0.433 12.824 267 HE22 GLN 57 HE22 GLN 57 4.349 2.132 12.583 268 H VAL 58 H VAL 58 -1.532 -1.400 9.606 269 HA VAL 58 HA VAL 58 -1.926 0.732 7.751 270 HB VAL 58 HB VAL 58 -3.715 -1.670 8.086 271 HG11 VAL 58 HG11 VAL 58 -3.244 -0.953 5.388 272 HG12 VAL 58 HG12 VAL 58 -4.750 -0.849 6.303 273 HG13 VAL 58 HG13 VAL 58 -3.639 0.520 6.270 274 HG21 VAL 58 HG21 VAL 58 -1.853 -2.889 7.766 275 HG22 VAL 58 HG22 VAL 58 -2.010 -2.363 6.090 276 HG23 VAL 58 HG23 VAL 58 -0.925 -1.507 7.184 277 H VAL 59 H VAL 59 -3.651 -0.462 10.565 278 HA VAL 59 HA VAL 59 -6.038 1.011 10.169 279 HB VAL 59 HB VAL 59 -4.838 -0.053 12.728 280 HG11 VAL 59 HG11 VAL 59 -7.592 1.014 12.129 281 HG12 VAL 59 HG12 VAL 59 -7.175 0.102 13.581 282 HG13 VAL 59 HG13 VAL 59 -6.419 1.665 13.272 283 HG21 VAL 59 HG21 VAL 59 -5.568 -2.065 12.124 284 HG22 VAL 59 HG22 VAL 59 -7.171 -1.430 11.758 285 HG23 VAL 59 HG23 VAL 59 -5.911 -1.406 10.525 286 H ARG 60 H ARG 60 -3.222 1.605 12.272 287 HA ARG 60 HA ARG 60 -4.060 4.068 13.290 288 HB2 ARG 60 HB2 ARG 60 -1.220 3.170 12.774 289 HB3 ARG 60 HB3 ARG 60 -1.723 4.440 13.881 290 HG2 ARG 60 HG2 ARG 60 -2.793 1.680 14.231 291 HG3 ARG 60 HG3 ARG 60 -1.157 2.062 14.771 292 HD2 ARG 60 HD2 ARG 60 -3.636 3.574 15.583 293 HD3 ARG 60 HD3 ARG 60 -2.871 2.312 16.547 294 HE ARG 60 HE ARG 60 -1.992 5.029 16.236 295 HH11 ARG 60 HH11 ARG 60 -1.014 1.774 16.989 296 HH12 ARG 60 HH12 ARG 60 0.374 2.263 17.903 297 HH21 ARG 60 HH21 ARG 60 -0.167 5.686 17.436 298 HH22 ARG 60 HH22 ARG 60 0.854 4.489 18.158 299 H TYR 61 H TYR 61 -2.722 3.225 10.210 300 HA TYR 61 HA TYR 61 -1.879 5.867 9.493 301 HB2 TYR 61 HB2 TYR 61 -0.802 4.042 8.390 302 HB3 TYR 61 HB3 TYR 61 -2.341 3.353 7.885 303 HD1 TYR 61 HD2 TYR 61 0.001 6.162 7.333 304 HD2 TYR 61 HD1 TYR 61 -3.398 4.055 5.881 305 HE1 TYR 61 HE2 TYR 61 0.161 7.383 5.205 306 HE2 TYR 61 HE1 TYR 61 -3.247 5.270 3.747 307 HH TYR 61 HH TYR 61 -1.590 6.472 2.427 308 H CYS 62 H CYS 62 -4.631 3.816 8.537 309 HA CYS 62 HA CYS 62 -5.908 5.820 6.995 310 HB2 CYS 62 HB2 CYS 62 -6.854 3.230 8.209 311 HB3 CYS 62 HB3 CYS 62 -7.945 4.287 7.321 312 HG CYS 62 HG CYS 62 -6.536 1.916 5.996 313 H THR 63 H THR 63 -6.404 4.669 10.314 314 HA THR 63 HA THR 63 -8.618 6.181 11.002 315 HB THR 63 HB THR 63 -7.739 6.092 13.357 316 HG1 THR 63 HG1 THR 63 -5.743 5.393 13.726 317 HG21 THR 63 HG21 THR 63 -8.722 4.093 13.428 318 HG22 THR 63 HG22 THR 63 -7.318 3.340 12.673 319 HG23 THR 63 HG23 THR 63 -8.606 4.007 11.671 320 H ASP 64 H ASP 64 -5.302 7.165 10.610 321 HA ASP 64 HA ASP 64 -5.547 9.658 11.987 322 HB2 ASP 64 HB2 ASP 64 -3.505 8.428 10.170 323 HB3 ASP 64 HB3 ASP 64 -3.414 10.147 10.544 324 H LEU 65 H LEU 65 -5.871 8.609 8.640 325 HA LEU 65 HA LEU 65 -5.942 11.061 7.353 326 HB2 LEU 65 HB2 LEU 65 -6.764 8.349 6.789 327 HB3 LEU 65 HB3 LEU 65 -7.879 9.515 6.081 328 HG LEU 65 HG LEU 65 -6.167 10.473 4.746 329 HD11 LEU 65 HD11 LEU 65 -4.342 10.591 6.257 330 HD12 LEU 65 HD12 LEU 65 -3.813 9.610 4.890 331 HD13 LEU 65 HD13 LEU 65 -4.267 8.835 6.407 332 HD21 LEU 65 HD21 LEU 65 -6.588 7.587 4.736 333 HD22 LEU 65 HD22 LEU 65 -5.094 8.080 3.939 334 HD23 LEU 65 HD23 LEU 65 -6.639 8.747 3.408 335 H ILE 66 H ILE 66 -8.401 9.461 9.260 336 HA ILE 66 HA ILE 66 -10.598 11.055 8.484 337 HB ILE 66 HB ILE 66 -10.047 9.427 10.952 338 HG12 ILE 66 HG12 ILE 66 -12.356 8.884 9.197 339 HG13 ILE 66 HG13 ILE 66 -10.780 8.674 8.441 340 HG21 ILE 66 HG21 ILE 66 -11.435 11.090 11.829 341 HG22 ILE 66 HG22 ILE 66 -12.390 11.199 10.351 342 HG23 ILE 66 HG23 ILE 66 -12.544 9.788 11.398 343 HD11 ILE 66 HD11 ILE 66 -11.738 7.325 10.953 344 HD12 ILE 66 HD12 ILE 66 -11.577 6.586 9.359 345 HD13 ILE 66 HD13 ILE 66 -10.143 7.130 10.229 346 H GLU 67 H GLU 67 -8.371 11.298 11.249 347 HA GLU 67 HA GLU 67 -9.540 13.711 12.229 348 HB2 GLU 67 HB2 GLU 67 -6.769 12.697 12.850 349 HB3 GLU 67 HB3 GLU 67 -7.790 13.724 13.846 350 HG2 GLU 67 HG2 GLU 67 -9.399 11.772 13.963 351 HG3 GLU 67 HG3 GLU 67 -8.104 10.797 13.269 352 H GLU 68 H GLU 68 -7.026 12.932 9.957 353 HA GLU 68 HA GLU 68 -5.999 15.644 9.891 354 HB2 GLU 68 HB2 GLU 68 -5.317 13.136 8.362 355 HB3 GLU 68 HB3 GLU 68 -4.601 14.696 7.982 356 HG2 GLU 68 HG2 GLU 68 -4.472 13.723 10.787 357 HG3 GLU 68 HG3 GLU 68 -3.409 12.993 9.584 358 H LYS 69 H LYS 69 -8.567 13.983 8.529 359 HA LYS 69 HA LYS 69 -10.091 14.503 6.923 360 HB2 LYS 69 HB2 LYS 69 -8.685 17.164 6.679 361 HB3 LYS 69 HB3 LYS 69 -10.351 16.791 6.257 362 HG2 LYS 69 HG2 LYS 69 -9.280 16.622 9.061 363 HG3 LYS 69 HG3 LYS 69 -10.035 18.068 8.388 364 HD2 LYS 69 HD2 LYS 69 -11.650 15.717 7.916 365 HD3 LYS 69 HD3 LYS 69 -11.316 15.933 9.637 366 HE2 LYS 69 HE2 LYS 69 -12.177 18.279 8.005 367 HE3 LYS 69 HE3 LYS 69 -13.381 17.096 8.515 368 HZ1 LYS 69 HZ1 LYS 69 -13.454 18.192 10.426 369 HZ2 LYS 69 HZ2 LYS 69 -12.106 19.136 10.035 370 HZ3 LYS 69 HZ3 LYS 69 -11.898 17.622 10.762 371 H ASP 70 H ASP 70 -7.885 13.040 6.124 372 HA ASP 70 HA ASP 70 -7.357 14.087 3.419 373 HB2 ASP 70 HB2 ASP 70 -5.618 12.814 5.409 374 HB3 ASP 70 HB3 ASP 70 -5.492 12.102 3.802 375 H LEU 71 H LEU 71 -9.724 12.663 4.137 376 HA LEU 71 HA LEU 71 -9.647 9.926 3.604 377 HB2 LEU 71 HB2 LEU 71 -11.897 11.743 2.787 378 HB3 LEU 71 HB3 LEU 71 -11.986 10.047 3.256 379 HG LEU 71 HG LEU 71 -11.408 12.382 5.077 380 HD11 LEU 71 HD11 LEU 71 -13.588 12.477 5.472 381 HD12 LEU 71 HD12 LEU 71 -13.665 10.739 5.761 382 HD13 LEU 71 HD13 LEU 71 -13.831 11.368 4.122 383 HD21 LEU 71 HD21 LEU 71 -11.348 9.418 5.503 384 HD22 LEU 71 HD22 LEU 71 -11.737 10.518 6.827 385 HD23 LEU 71 HD23 LEU 71 -10.180 10.641 6.006 386 H GLU 72 H GLU 72 -9.120 12.569 1.522 387 HA GLU 72 HA GLU 72 -10.054 11.751 -0.931 388 HB2 GLU 72 HB2 GLU 72 -8.977 13.898 -0.635 389 HB3 GLU 72 HB3 GLU 72 -7.442 13.121 -0.275 390 HG2 GLU 72 HG2 GLU 72 -7.242 12.325 -2.520 391 HG3 GLU 72 HG3 GLU 72 -8.870 12.879 -2.910 392 H LYS 73 H LYS 73 -6.854 10.990 0.447 393 HA LYS 73 HA LYS 73 -6.291 9.075 -1.624 394 HB2 LYS 73 HB2 LYS 73 -4.245 8.614 -0.271 395 HB3 LYS 73 HB3 LYS 73 -4.444 10.308 -0.703 396 HG2 LYS 73 HG2 LYS 73 -5.715 10.068 1.752 397 HG3 LYS 73 HG3 LYS 73 -4.263 9.075 1.901 398 HD2 LYS 73 HD2 LYS 73 -3.691 11.575 0.569 399 HD3 LYS 73 HD3 LYS 73 -4.438 11.847 2.145 400 HE2 LYS 73 HE2 LYS 73 -2.413 9.765 2.218 401 HE3 LYS 73 HE3 LYS 73 -1.768 11.305 1.656 402 HZ1 LYS 73 HZ1 LYS 73 -2.217 10.572 4.260 403 HZ2 LYS 73 HZ2 LYS 73 -3.475 11.648 3.909 404 HZ3 LYS 73 HZ3 LYS 73 -1.866 12.130 3.699 405 H LEU 74 H LEU 74 -7.784 9.025 1.474 406 HA LEU 74 HA LEU 74 -7.310 6.446 2.360 407 HB2 LEU 74 HB2 LEU 74 -8.547 8.208 3.592 408 HB3 LEU 74 HB3 LEU 74 -9.925 7.939 2.526 409 HG LEU 74 HG LEU 74 -10.063 5.610 3.386 410 HD11 LEU 74 HD11 LEU 74 -7.659 5.527 4.105 411 HD12 LEU 74 HD12 LEU 74 -8.819 4.918 5.285 412 HD13 LEU 74 HD13 LEU 74 -8.113 6.520 5.490 413 HD21 LEU 74 HD21 LEU 74 -10.190 7.641 5.605 414 HD22 LEU 74 HD22 LEU 74 -11.172 6.190 5.402 415 HD23 LEU 74 HD23 LEU 74 -11.376 7.554 4.302 416 H ASP 75 H ASP 75 -9.962 7.559 0.256 417 HA ASP 75 HA ASP 75 -11.081 5.026 -0.203 418 HB2 ASP 75 HB2 ASP 75 -11.331 7.716 -1.359 419 HB3 ASP 75 HB3 ASP 75 -11.676 6.412 -2.491 420 H LEU 76 H LEU 76 -8.334 6.629 -1.596 421 HA LEU 76 HA LEU 76 -8.142 4.930 -3.899 422 HB2 LEU 76 HB2 LEU 76 -6.022 6.667 -2.644 423 HB3 LEU 76 HB3 LEU 76 -6.003 5.995 -4.273 424 HG LEU 76 HG LEU 76 -8.025 8.011 -3.306 425 HD11 LEU 76 HD11 LEU 76 -5.948 8.801 -5.238 426 HD12 LEU 76 HD12 LEU 76 -5.405 8.566 -3.577 427 HD13 LEU 76 HD13 LEU 76 -6.695 9.718 -3.929 428 HD21 LEU 76 HD21 LEU 76 -8.299 6.345 -5.371 429 HD22 LEU 76 HD22 LEU 76 -7.354 7.608 -6.161 430 HD23 LEU 76 HD23 LEU 76 -8.895 8.005 -5.400 431 H VAL 77 H VAL 77 -6.526 5.106 -0.748 432 HA VAL 77 HA VAL 77 -4.777 2.914 -1.230 433 HB VAL 77 HB VAL 77 -5.684 4.117 1.389 434 HG11 VAL 77 HG11 VAL 77 -4.667 2.394 2.358 435 HG12 VAL 77 HG12 VAL 77 -4.100 1.781 0.803 436 HG13 VAL 77 HG13 VAL 77 -3.151 2.983 1.678 437 HG21 VAL 77 HG21 VAL 77 -3.708 5.429 1.335 438 HG22 VAL 77 HG22 VAL 77 -3.085 4.558 -0.067 439 HG23 VAL 77 HG23 VAL 77 -4.482 5.622 -0.238 440 H ILE 78 H ILE 78 -7.932 3.240 0.329 441 HA ILE 78 HA ILE 78 -8.101 0.604 1.317 442 HB ILE 78 HB ILE 78 -10.249 2.597 0.609 443 HG12 ILE 78 HG12 ILE 78 -8.770 3.167 2.507 444 HG13 ILE 78 HG13 ILE 78 -10.427 2.878 3.024 445 HG21 ILE 78 HG21 ILE 78 -11.655 0.857 0.590 446 HG22 ILE 78 HG22 ILE 78 -10.460 -0.233 1.291 447 HG23 ILE 78 HG23 ILE 78 -11.412 0.822 2.335 448 HD11 ILE 78 HD11 ILE 78 -8.888 0.452 3.127 449 HD12 ILE 78 HD12 ILE 78 -8.117 1.738 4.057 450 HD13 ILE 78 HD13 ILE 78 -9.783 1.275 4.403 451 H LYS 79 H LYS 79 -9.510 2.075 -1.608 452 HA LYS 79 HA LYS 79 -10.582 -0.322 -2.635 453 HB2 LYS 79 HB2 LYS 79 -11.037 0.887 -4.610 454 HB3 LYS 79 HB3 LYS 79 -11.159 2.066 -3.310 455 HG2 LYS 79 HG2 LYS 79 -9.862 3.317 -4.633 456 HG3 LYS 79 HG3 LYS 79 -8.551 2.324 -3.995 457 HD2 LYS 79 HD2 LYS 79 -8.122 1.965 -6.183 458 HD3 LYS 79 HD3 LYS 79 -9.396 0.755 -6.019 459 HE2 LYS 79 HE2 LYS 79 -10.291 1.844 -7.779 460 HE3 LYS 79 HE3 LYS 79 -10.878 2.948 -6.536 461 HZ1 LYS 79 HZ1 LYS 79 -9.276 4.505 -7.040 462 HZ2 LYS 79 HZ2 LYS 79 -9.641 3.888 -8.573 463 HZ3 LYS 79 HZ3 LYS 79 -8.240 3.384 -7.770 464 H TYR 80 H TYR 80 -7.394 1.017 -2.681 465 HA TYR 80 HA TYR 80 -6.461 -0.604 -4.875 466 HB2 TYR 80 HB2 TYR 80 -5.436 1.573 -4.453 467 HB3 TYR 80 HB3 TYR 80 -4.946 1.053 -2.846 468 HD1 TYR 80 HD1 TYR 80 -3.179 -0.676 -2.595 469 HD2 TYR 80 HD2 TYR 80 -4.165 0.989 -6.383 470 HE1 TYR 80 HE1 TYR 80 -1.054 -1.512 -3.509 471 HE2 TYR 80 HE2 TYR 80 -2.043 0.157 -7.308 472 HH TYR 80 HH TYR 80 0.500 -0.740 -5.553 473 H MET 81 H MET 81 -6.168 -0.632 -1.343 474 HA MET 81 HA MET 81 -4.534 -2.979 -1.285 475 HB2 MET 81 HB2 MET 81 -4.640 -2.822 1.063 476 HB3 MET 81 HB3 MET 81 -4.675 -1.157 0.499 477 HG2 MET 81 HG2 MET 81 -7.017 -0.992 0.889 478 HG3 MET 81 HG3 MET 81 -7.139 -2.720 1.213 479 HE1 MET 81 HE1 MET 81 -6.287 0.647 2.123 480 HE2 MET 81 HE2 MET 81 -6.443 0.684 3.880 481 HE3 MET 81 HE3 MET 81 -4.863 0.418 3.141 482 H LYS 82 H LYS 82 -7.964 -2.317 -1.157 483 HA LYS 82 HA LYS 82 -8.760 -4.897 -0.251 484 HB2 LYS 82 HB2 LYS 82 -10.956 -4.180 -0.570 485 HB3 LYS 82 HB3 LYS 82 -10.095 -2.685 -0.227 486 HG2 LYS 82 HG2 LYS 82 -11.274 -1.989 -2.024 487 HG3 LYS 82 HG3 LYS 82 -9.883 -2.661 -2.877 488 HD2 LYS 82 HD2 LYS 82 -11.585 -3.664 -4.035 489 HD3 LYS 82 HD3 LYS 82 -11.317 -4.871 -2.775 490 HE2 LYS 82 HE2 LYS 82 -13.428 -4.651 -2.125 491 HE3 LYS 82 HE3 LYS 82 -13.132 -2.953 -1.751 492 HZ1 LYS 82 HZ1 LYS 82 -14.967 -3.272 -3.324 493 HZ2 LYS 82 HZ2 LYS 82 -13.903 -3.989 -4.426 494 HZ3 LYS 82 HZ3 LYS 82 -13.708 -2.364 -3.999 495 H ARG 83 H ARG 83 -8.111 -3.480 -3.382 496 HA ARG 83 HA ARG 83 -9.303 -5.558 -4.924 497 HB2 ARG 83 HB2 ARG 83 -8.661 -4.354 -6.745 498 HB3 ARG 83 HB3 ARG 83 -8.482 -3.088 -5.537 499 HG2 ARG 83 HG2 ARG 83 -6.050 -3.928 -5.349 500 HG3 ARG 83 HG3 ARG 83 -6.371 -4.704 -6.901 501 HD2 ARG 83 HD2 ARG 83 -7.102 -1.841 -6.591 502 HD3 ARG 83 HD3 ARG 83 -5.392 -2.247 -6.732 503 HE ARG 83 HE ARG 83 -7.380 -2.369 -8.802 504 HH11 ARG 83 HH11 ARG 83 -4.317 -3.604 -7.701 505 HH12 ARG 83 HH12 ARG 83 -3.780 -4.051 -9.287 506 HH21 ARG 83 HH21 ARG 83 -6.684 -2.952 -10.895 507 HH22 ARG 83 HH22 ARG 83 -5.126 -3.679 -11.103 508 H LEU 84 H LEU 84 -6.198 -5.097 -3.423 509 HA LEU 84 HA LEU 84 -4.923 -7.232 -4.893 510 HB2 LEU 84 HB2 LEU 84 -4.001 -5.765 -2.426 511 HB3 LEU 84 HB3 LEU 84 -3.018 -6.822 -3.437 512 HG LEU 84 HG LEU 84 -4.278 -4.340 -4.558 513 HD11 LEU 84 HD11 LEU 84 -2.016 -4.554 -2.681 514 HD12 LEU 84 HD12 LEU 84 -3.085 -3.194 -3.028 515 HD13 LEU 84 HD13 LEU 84 -1.744 -3.561 -4.113 516 HD21 LEU 84 HD21 LEU 84 -3.434 -5.726 -6.248 517 HD22 LEU 84 HD22 LEU 84 -2.004 -6.155 -5.307 518 HD23 LEU 84 HD23 LEU 84 -2.165 -4.532 -5.979 519 H MET 85 H MET 85 -5.808 -6.712 -1.475 520 HA MET 85 HA MET 85 -5.207 -9.262 -0.547 521 HB2 MET 85 HB2 MET 85 -7.307 -7.300 0.381 522 HB3 MET 85 HB3 MET 85 -6.887 -8.763 1.259 523 HG2 MET 85 HG2 MET 85 -4.512 -7.896 1.300 524 HG3 MET 85 HG3 MET 85 -5.168 -6.364 0.727 525 HE1 MET 85 HE1 MET 85 -5.370 -4.669 3.934 526 HE2 MET 85 HE2 MET 85 -3.893 -5.425 3.335 527 HE3 MET 85 HE3 MET 85 -5.031 -4.692 2.203 528 H GLN 86 H GLN 86 -7.891 -8.148 -2.430 529 HA GLN 86 HA GLN 86 -9.550 -10.443 -1.893 530 HB2 GLN 86 HB2 GLN 86 -9.742 -8.045 -3.670 531 HB3 GLN 86 HB3 GLN 86 -10.780 -9.429 -3.986 532 HG2 GLN 86 HG2 GLN 86 -11.574 -9.280 -1.630 533 HG3 GLN 86 HG3 GLN 86 -10.656 -7.784 -1.473 534 HE21 GLN 86 HE21 GLN 86 -12.976 -7.168 -0.917 535 HE22 GLN 86 HE22 GLN 86 -13.932 -6.559 -2.222 536 H GLN 87 H GLN 87 -7.478 -9.319 -4.534 537 HA GLN 87 HA GLN 87 -7.993 -11.706 -6.093 538 HB2 GLN 87 HB2 GLN 87 -6.769 -10.693 -7.818 539 HB3 GLN 87 HB3 GLN 87 -7.595 -9.354 -7.033 540 HG2 GLN 87 HG2 GLN 87 -5.502 -8.933 -5.736 541 HG3 GLN 87 HG3 GLN 87 -4.709 -10.142 -6.743 542 HE21 GLN 87 HE21 GLN 87 -7.013 -7.537 -7.441 543 HE22 GLN 87 HE22 GLN 87 -6.041 -6.767 -8.644 544 H SER 88 H SER 88 -6.280 -11.247 -3.417 545 HA SER 88 HA SER 88 -3.708 -12.240 -4.010 546 HB2 SER 88 HB2 SER 88 -3.503 -12.639 -1.608 547 HB3 SER 88 HB3 SER 88 -4.272 -11.079 -1.898 548 HG SER 88 HG SER 88 -5.309 -13.395 -0.784 549 H VAL 89 H VAL 89 -3.076 -14.375 -2.625 550 HA VAL 89 HA VAL 89 -4.618 -16.518 -3.902 551 HB VAL 89 HB VAL 89 -2.301 -16.606 -4.472 552 HG11 VAL 89 HG11 VAL 89 -0.944 -17.137 -2.073 553 HG12 VAL 89 HG12 VAL 89 -0.784 -15.719 -3.112 554 HG13 VAL 89 HG13 VAL 89 -1.932 -15.707 -1.774 555 HG21 VAL 89 HG21 VAL 89 -1.672 -18.808 -3.667 556 HG22 VAL 89 HG22 VAL 89 -2.829 -18.677 -2.342 557 HG23 VAL 89 HG23 VAL 89 -3.402 -18.757 -4.008 558 H GLU 90 H GLU 90 -3.566 -15.327 -0.788 559 HA GLU 90 HA GLU 90 -4.624 -17.667 0.591 560 HB2 GLU 90 HB2 GLU 90 -2.966 -15.314 1.370 561 HB3 GLU 90 HB3 GLU 90 -3.918 -16.104 2.618 562 HG2 GLU 90 HG2 GLU 90 -2.065 -17.636 0.828 563 HG3 GLU 90 HG3 GLU 90 -1.514 -16.866 2.314 564 H SER 91 H SER 91 -6.500 -17.725 1.702 565 HA SER 91 HA SER 91 -8.460 -15.724 1.182 566 HB2 SER 91 HB2 SER 91 -9.403 -17.840 1.344 567 HB3 SER 91 HB3 SER 91 -8.402 -18.294 2.723 568 HG SER 91 HG SER 91 -10.537 -17.903 3.378 569 H VAL 92 H VAL 92 -6.204 -16.292 3.726 570 HA VAL 92 HA VAL 92 -7.477 -15.000 5.864 571 HB VAL 92 HB VAL 92 -5.393 -16.360 6.049 572 HG11 VAL 92 HG11 VAL 92 -3.405 -15.744 5.180 573 HG12 VAL 92 HG12 VAL 92 -4.411 -14.813 4.069 574 HG13 VAL 92 HG13 VAL 92 -3.688 -14.029 5.474 575 HG21 VAL 92 HG21 VAL 92 -4.758 -13.710 7.242 576 HG22 VAL 92 HG22 VAL 92 -6.274 -14.490 7.688 577 HG23 VAL 92 HG23 VAL 92 -4.741 -15.312 7.977 578 H TRP 93 H TRP 93 -5.821 -13.752 3.067 579 HA TRP 93 HA TRP 93 -5.312 -11.140 3.994 580 HB2 TRP 93 HB2 TRP 93 -5.417 -12.495 1.363 581 HB3 TRP 93 HB3 TRP 93 -5.641 -10.747 1.340 582 HD1 TRP 93 HD1 TRP 93 -2.989 -12.963 0.722 583 HE1 TRP 93 HE1 TRP 93 -0.689 -12.019 1.386 584 HE3 TRP 93 HE3 TRP 93 -4.524 -9.167 3.783 585 HZ2 TRP 93 HZ2 TRP 93 0.339 -9.939 2.996 586 HZ3 TRP 93 HZ3 TRP 93 -2.819 -7.747 4.846 587 HH2 TRP 93 HH2 TRP 93 -0.439 -8.126 4.460 588 H ASN 94 H ASN 94 -8.137 -12.624 2.506 589 HA ASN 94 HA ASN 94 -9.614 -10.327 1.941 590 HB2 ASN 94 HB2 ASN 94 -10.333 -13.172 2.542 591 HB3 ASN 94 HB3 ASN 94 -11.613 -11.967 2.434 592 HD21 ASN 94 HD21 ASN 94 -8.674 -12.876 0.659 593 HD22 ASN 94 HD22 ASN 94 -9.390 -12.778 -0.911 594 H MET 95 H MET 95 -9.365 -12.208 4.928 595 HA MET 95 HA MET 95 -11.298 -10.662 6.348 596 HB2 MET 95 HB2 MET 95 -9.106 -12.321 7.584 597 HB3 MET 95 HB3 MET 95 -10.679 -11.926 8.265 598 HG2 MET 95 HG2 MET 95 -11.612 -13.227 6.233 599 HG3 MET 95 HG3 MET 95 -9.985 -13.897 6.134 600 HE1 MET 95 HE1 MET 95 -9.794 -16.615 8.048 601 HE2 MET 95 HE2 MET 95 -8.910 -15.213 7.446 602 HE3 MET 95 HE3 MET 95 -9.166 -15.417 9.180 603 H ALA 96 H ALA 96 -7.810 -10.528 5.956 604 HA ALA 96 HA ALA 96 -7.104 -8.818 8.012 605 HB1 ALA 96 HB1 ALA 96 -5.373 -9.787 6.738 606 HB2 ALA 96 HB2 ALA 96 -5.999 -9.115 5.232 607 HB3 ALA 96 HB3 ALA 96 -5.273 -8.051 6.436 608 H PHE 97 H PHE 97 -8.322 -8.005 4.780 609 HA PHE 97 HA PHE 97 -8.111 -5.225 4.979 610 HB2 PHE 97 HB2 PHE 97 -8.545 -6.303 2.851 611 HB3 PHE 97 HB3 PHE 97 -10.092 -6.908 3.434 612 HD1 PHE 97 HD2 PHE 97 -8.493 -3.544 3.607 613 HD2 PHE 97 HD1 PHE 97 -11.776 -5.888 2.251 614 HE1 PHE 97 HE2 PHE 97 -9.596 -1.510 2.773 615 HE2 PHE 97 HE1 PHE 97 -12.885 -3.858 1.414 616 HZ PHE 97 HZ PHE 97 -11.796 -1.665 1.675 617 H ASP 98 H ASP 98 -10.784 -7.391 5.834 618 HA ASP 98 HA ASP 98 -12.618 -5.399 6.589 619 HB2 ASP 98 HB2 ASP 98 -13.089 -7.864 6.181 620 HB3 ASP 98 HB3 ASP 98 -12.460 -8.159 7.800 621 H PHE 99 H PHE 99 -10.103 -7.090 8.392 622 HA PHE 99 HA PHE 99 -10.746 -6.283 10.970 623 HB2 PHE 99 HB2 PHE 99 -9.045 -7.904 10.758 624 HB3 PHE 99 HB3 PHE 99 -8.115 -6.905 9.645 625 HD1 PHE 99 HD2 PHE 99 -8.970 -7.519 13.144 626 HD2 PHE 99 HD1 PHE 99 -6.702 -5.121 10.455 627 HE1 PHE 99 HE2 PHE 99 -7.633 -6.676 15.029 628 HE2 PHE 99 HE1 PHE 99 -5.361 -4.275 12.337 629 HZ PHE 99 HZ PHE 99 -5.825 -5.053 14.626 630 H ILE 100 H ILE 100 -8.665 -4.661 8.587 631 HA ILE 100 HA ILE 100 -7.992 -2.453 10.191 632 HB ILE 100 HB ILE 100 -8.176 -2.604 7.180 633 HG12 ILE 100 HG12 ILE 100 -5.575 -2.655 8.604 634 HG13 ILE 100 HG13 ILE 100 -6.566 -4.103 8.741 635 HG21 ILE 100 HG21 ILE 100 -7.379 -0.467 9.033 636 HG22 ILE 100 HG22 ILE 100 -6.254 -0.774 7.711 637 HG23 ILE 100 HG23 ILE 100 -7.936 -0.375 7.362 638 HD11 ILE 100 HD11 ILE 100 -6.037 -2.898 6.063 639 HD12 ILE 100 HD12 ILE 100 -4.830 -3.922 6.842 640 HD13 ILE 100 HD13 ILE 100 -6.434 -4.562 6.485 641 H LEU 101 H LEU 101 -10.667 -3.002 7.949 642 HA LEU 101 HA LEU 101 -11.705 -0.369 8.055 643 HB2 LEU 101 HB2 LEU 101 -12.897 -3.019 7.294 644 HB3 LEU 101 HB3 LEU 101 -13.830 -1.525 7.253 645 HG LEU 101 HG LEU 101 -11.261 -1.765 5.727 646 HD11 LEU 101 HD11 LEU 101 -12.120 -3.367 4.451 647 HD12 LEU 101 HD12 LEU 101 -13.321 -2.192 3.915 648 HD13 LEU 101 HD13 LEU 101 -13.683 -3.271 5.263 649 HD21 LEU 101 HD21 LEU 101 -12.121 0.446 5.872 650 HD22 LEU 101 HD22 LEU 101 -13.758 -0.095 5.496 651 HD23 LEU 101 HD23 LEU 101 -12.504 -0.150 4.256 652 H ASP 102 H ASP 102 -12.222 -3.257 9.984 653 HA ASP 102 HA ASP 102 -14.510 -2.446 11.383 654 HB2 ASP 102 HB2 ASP 102 -13.101 -4.717 11.345 655 HB3 ASP 102 HB3 ASP 102 -12.441 -4.027 12.826 656 H ASN 103 H ASN 103 -11.179 -1.525 11.700 657 HA ASN 103 HA ASN 103 -11.708 -0.166 14.239 658 HB2 ASN 103 HB2 ASN 103 -9.160 -0.765 12.734 659 HB3 ASN 103 HB3 ASN 103 -9.206 0.290 14.144 660 HD21 ASN 103 HD21 ASN 103 -10.152 -2.946 13.069 661 HD22 ASN 103 HD22 ASN 103 -9.839 -3.727 14.578 662 H VAL 104 H VAL 104 -10.771 0.465 10.901 663 HA VAL 104 HA VAL 104 -10.419 3.280 11.264 664 HB VAL 104 HB VAL 104 -10.811 1.653 8.749 665 HG11 VAL 104 HG11 VAL 104 -9.930 3.648 7.578 666 HG12 VAL 104 HG12 VAL 104 -11.500 3.928 8.333 667 HG13 VAL 104 HG13 VAL 104 -10.033 4.547 9.091 668 HG21 VAL 104 HG21 VAL 104 -8.259 2.941 9.637 669 HG22 VAL 104 HG22 VAL 104 -8.733 1.365 10.272 670 HG23 VAL 104 HG23 VAL 104 -8.501 1.584 8.537 671 H GLN 105 H GLN 105 -12.896 1.413 9.494 672 HA GLN 105 HA GLN 105 -14.629 3.449 8.884 673 HB2 GLN 105 HB2 GLN 105 -15.420 0.660 9.738 674 HB3 GLN 105 HB3 GLN 105 -16.397 1.768 8.785 675 HG2 GLN 105 HG2 GLN 105 -13.700 0.854 7.854 676 HG3 GLN 105 HG3 GLN 105 -15.158 -0.094 7.562 677 HE21 GLN 105 HE21 GLN 105 -13.552 2.952 6.938 678 HE22 GLN 105 HE22 GLN 105 -14.463 3.364 5.528 679 H VAL 106 H VAL 106 -14.084 1.934 11.969 680 HA VAL 106 HA VAL 106 -16.448 2.864 13.250 681 HB VAL 106 HB VAL 106 -13.837 1.770 14.234 682 HG11 VAL 106 HG11 VAL 106 -15.915 3.212 15.834 683 HG12 VAL 106 HG12 VAL 106 -14.982 1.897 16.551 684 HG13 VAL 106 HG13 VAL 106 -14.157 3.325 15.925 685 HG21 VAL 106 HG21 VAL 106 -15.585 0.250 13.397 686 HG22 VAL 106 HG22 VAL 106 -15.247 0.001 15.110 687 HG23 VAL 106 HG23 VAL 106 -16.695 0.879 14.616 688 H VAL 107 H VAL 107 -13.057 3.950 13.502 689 HA VAL 107 HA VAL 107 -13.636 6.260 15.014 690 HB VAL 107 HB VAL 107 -11.396 5.378 15.003 691 HG11 VAL 107 HG11 VAL 107 -10.039 5.857 12.814 692 HG12 VAL 107 HG12 VAL 107 -10.996 4.382 12.969 693 HG13 VAL 107 HG13 VAL 107 -11.627 5.752 12.053 694 HG21 VAL 107 HG21 VAL 107 -11.615 7.767 15.394 695 HG22 VAL 107 HG22 VAL 107 -10.114 7.421 14.534 696 HG23 VAL 107 HG23 VAL 107 -11.498 8.078 13.662 697 H LEU 108 H LEU 108 -13.777 5.589 11.619 698 HA LEU 108 HA LEU 108 -13.687 8.305 10.734 699 HB2 LEU 108 HB2 LEU 108 -13.459 7.324 8.763 700 HB3 LEU 108 HB3 LEU 108 -13.671 5.760 9.548 701 HG LEU 108 HG LEU 108 -16.165 6.086 9.196 702 HD11 LEU 108 HD11 LEU 108 -15.145 8.552 8.046 703 HD12 LEU 108 HD12 LEU 108 -16.784 8.120 8.532 704 HD13 LEU 108 HD13 LEU 108 -16.187 7.659 6.938 705 HD21 LEU 108 HD21 LEU 108 -15.219 5.978 6.477 706 HD22 LEU 108 HD22 LEU 108 -15.881 4.693 7.488 707 HD23 LEU 108 HD23 LEU 108 -14.157 5.064 7.548 708 H GLN 109 H GLN 109 -16.250 6.013 11.522 709 HA GLN 109 HA GLN 109 -18.408 7.607 10.628 710 HB2 GLN 109 HB2 GLN 109 -18.126 5.251 12.444 711 HB3 GLN 109 HB3 GLN 109 -19.648 6.131 12.427 712 HG2 GLN 109 HG2 GLN 109 -19.971 5.680 10.111 713 HG3 GLN 109 HG3 GLN 109 -18.345 5.015 9.959 714 HE21 GLN 109 HE21 GLN 109 -17.958 3.197 11.658 715 HE22 GLN 109 HE22 GLN 109 -19.194 1.991 11.716 716 H GLN 110 H GLN 110 -16.788 7.294 13.754 717 HA GLN 110 HA GLN 110 -18.550 8.918 15.230 718 HB2 GLN 110 HB2 GLN 110 -15.626 8.283 15.631 719 HB3 GLN 110 HB3 GLN 110 -16.597 9.172 16.797 720 HG2 GLN 110 HG2 GLN 110 -18.155 7.156 16.783 721 HG3 GLN 110 HG3 GLN 110 -16.849 6.308 15.955 722 HE21 GLN 110 HE21 GLN 110 -15.310 5.406 17.144 723 HE22 GLN 110 HE22 GLN 110 -15.064 5.668 18.834 724 H THR 111 H THR 111 -16.310 9.695 12.807 725 HA THR 111 HA THR 111 -15.981 12.452 13.720 726 HB THR 111 HB THR 111 -14.771 10.982 11.372 727 HG1 THR 111 HG1 THR 111 -13.624 11.990 13.783 728 HG21 THR 111 HG21 THR 111 -13.366 12.994 11.090 729 HG22 THR 111 HG22 THR 111 -14.337 13.821 12.308 730 HG23 THR 111 HG23 THR 111 -15.072 13.318 10.785 731 H TYR 112 H TYR 112 -16.864 10.844 10.655 732 HA TYR 112 HA TYR 112 -18.489 13.192 9.975 733 HB2 TYR 112 HB2 TYR 112 -17.792 10.939 8.103 734 HB3 TYR 112 HB3 TYR 112 -18.283 12.581 7.702 735 HD1 TYR 112 HD2 TYR 112 -16.690 14.436 7.891 736 HD2 TYR 112 HD1 TYR 112 -15.506 10.422 8.657 737 HE1 TYR 112 HE2 TYR 112 -14.329 15.106 7.715 738 HE2 TYR 112 HE1 TYR 112 -13.142 11.080 8.484 739 HH TYR 112 HH TYR 112 -11.982 13.878 8.826 740 H GLY 113 H GLY 113 -18.624 9.654 10.153 741 HA2 GLY 113 HA2 GLY 113 -20.619 8.643 11.118 742 HA3 GLY 113 HA3 GLY 113 -21.562 9.882 10.305 743 H SER 114 H SER 114 -19.549 9.353 7.969 744 HA SER 114 HA SER 114 -21.229 7.306 6.738 745 HB2 SER 114 HB2 SER 114 -20.507 9.651 5.724 746 HB3 SER 114 HB3 SER 114 -19.089 8.732 5.219 747 HG SER 114 HG SER 114 -21.572 8.732 4.179 748 H THR 115 H THR 115 -19.716 6.160 4.877 749 HA THR 115 HA THR 115 -17.231 5.195 6.018 750 HB THR 115 HB THR 115 -17.885 2.818 5.900 751 HG1 THR 115 HG1 THR 115 -20.591 3.626 5.793 752 HG21 THR 115 HG21 THR 115 -18.990 2.726 7.982 753 HG22 THR 115 HG22 THR 115 -19.816 4.260 7.703 754 HG23 THR 115 HG23 THR 115 -18.080 4.235 8.011 755 H LEU 116 H LEU 116 -16.526 3.192 4.500 756 HA LEU 116 HA LEU 116 -16.611 4.294 1.790 757 HB2 LEU 116 HB2 LEU 116 -14.573 3.216 3.382 758 HB3 LEU 116 HB3 LEU 116 -14.855 2.037 2.103 759 HG LEU 116 HG LEU 116 -14.720 4.378 0.698 760 HD11 LEU 116 HD11 LEU 116 -13.840 5.164 3.141 761 HD12 LEU 116 HD12 LEU 116 -13.358 5.905 1.615 762 HD13 LEU 116 HD13 LEU 116 -12.329 4.686 2.367 763 HD21 LEU 116 HD21 LEU 116 -13.478 1.995 0.676 764 HD22 LEU 116 HD22 LEU 116 -12.148 3.024 1.205 765 HD23 LEU 116 HD23 LEU 116 -12.975 3.365 -0.315 766 H LYS 117 H LYS 117 -17.151 3.069 -0.010 767 HA LYS 117 HA LYS 117 -18.830 0.742 0.568 768 HB2 LYS 117 HB2 LYS 117 -19.869 2.539 -0.713 769 HB3 LYS 117 HB3 LYS 117 -18.592 2.447 -1.919 770 HG2 LYS 117 HG2 LYS 117 -20.005 -0.076 -1.430 771 HG3 LYS 117 HG3 LYS 117 -20.992 1.215 -2.119 772 HD2 LYS 117 HD2 LYS 117 -20.090 0.857 -4.118 773 HD3 LYS 117 HD3 LYS 117 -18.480 1.173 -3.466 774 HE2 LYS 117 HE2 LYS 117 -18.178 -0.965 -4.200 775 HE3 LYS 117 HE3 LYS 117 -18.752 -1.298 -2.566 776 HZ1 LYS 117 HZ1 LYS 117 -20.192 -2.615 -3.647 777 HZ2 LYS 117 HZ2 LYS 117 -20.040 -1.790 -5.115 778 HZ3 LYS 117 HZ3 LYS 117 -21.054 -1.182 -3.905 779 H VAL 118 H VAL 118 -17.502 -1.003 0.690 780 HA VAL 118 HA VAL 118 -15.801 -1.549 -1.658 781 HB VAL 118 HB VAL 118 -14.536 -3.094 -0.076 782 HG11 VAL 118 HG11 VAL 118 -14.055 -0.430 1.019 783 HG12 VAL 118 HG12 VAL 118 -12.993 -1.479 0.080 784 HG13 VAL 118 HG13 VAL 118 -14.177 -0.461 -0.739 785 HG21 VAL 118 HG21 VAL 118 -15.014 -3.201 2.108 786 HG22 VAL 118 HG22 VAL 118 -15.262 -1.459 2.233 787 HG23 VAL 118 HG23 VAL 118 -16.569 -2.496 1.662 788 H THR 119 H THR 119 -16.933 -2.892 -2.922 789 HA THR 119 HA THR 119 -18.916 -4.683 -2.085 790 HB THR 119 HB THR 119 -18.628 -3.882 -4.428 791 HG1 THR 119 HG1 THR 119 -18.908 -6.189 -5.291 792 HG21 THR 119 HG21 THR 119 -16.829 -4.353 -5.689 793 HG22 THR 119 HG22 THR 119 -16.770 -6.028 -5.139 794 HG23 THR 119 HG23 THR 119 -16.041 -4.753 -4.163 795 H LYS 207 H LYS 207 8.258 -7.004 16.636 796 HA LYS 207 HA LYS 207 9.703 -6.958 14.180 797 HB2 LYS 207 HB2 LYS 207 7.963 -9.212 15.173 798 HB3 LYS 207 HB3 LYS 207 9.362 -9.315 14.111 799 HG2 LYS 207 HG2 LYS 207 10.543 -8.236 16.245 800 HG3 LYS 207 HG3 LYS 207 9.222 -9.084 17.053 801 HD2 LYS 207 HD2 LYS 207 10.803 -10.536 14.987 802 HD3 LYS 207 HD3 LYS 207 11.523 -10.277 16.578 803 HE2 LYS 207 HE2 LYS 207 9.843 -11.502 17.659 804 HE3 LYS 207 HE3 LYS 207 8.765 -11.418 16.266 805 HZ1 LYS 207 HZ1 LYS 207 9.970 -13.020 15.135 806 HZ2 LYS 207 HZ2 LYS 207 9.998 -13.598 16.724 807 HZ3 LYS 207 HZ3 LYS 207 11.356 -12.818 16.084 808 H SER 208 H SER 208 8.987 -6.649 12.175 809 HA SER 208 HA SER 208 6.480 -7.487 11.202 810 HB2 SER 208 HB2 SER 208 5.250 -5.471 11.015 811 HB3 SER 208 HB3 SER 208 5.834 -5.495 12.678 812 HG SER 208 HG SER 208 6.126 -3.465 11.532 813 H PHE 209 H PHE 209 6.013 -6.372 9.001 814 HA PHE 209 HA PHE 209 8.476 -6.492 7.497 815 HB2 PHE 209 HB2 PHE 209 6.576 -7.628 6.561 816 HB3 PHE 209 HB3 PHE 209 5.589 -6.174 6.665 817 HD1 PHE 209 HD2 PHE 209 8.605 -7.573 5.013 818 HD2 PHE 209 HD1 PHE 209 5.460 -4.708 4.867 819 HE1 PHE 209 HE2 PHE 209 9.265 -6.969 2.721 820 HE2 PHE 209 HE1 PHE 209 6.114 -4.101 2.574 821 HZ PHE 209 HZ PHE 209 8.021 -5.230 1.499 822 H PHE 210 H PHE 210 5.913 -4.101 8.064 823 HA PHE 210 HA PHE 210 7.011 -2.052 6.486 824 HB2 PHE 210 HB2 PHE 210 5.181 -1.938 8.889 825 HB3 PHE 210 HB3 PHE 210 5.582 -0.536 7.902 826 HD1 PHE 210 HD1 PHE 210 5.181 -0.882 5.313 827 HD2 PHE 210 HD2 PHE 210 3.267 -3.102 8.399 828 HE1 PHE 210 HE1 PHE 210 3.350 -1.442 3.768 829 HE2 PHE 210 HE2 PHE 210 1.434 -3.667 6.859 830 HZ PHE 210 HZ PHE 210 1.473 -2.839 4.540 831 H ASP 211 H ASP 211 7.819 -3.222 9.632 832 HA ASP 211 HA ASP 211 9.204 -0.868 10.505 833 HB2 ASP 211 HB2 ASP 211 8.267 -2.462 12.119 834 HB3 ASP 211 HB3 ASP 211 9.353 -3.714 11.522 835 H LYS 212 H LYS 212 10.149 -3.972 9.090 836 HA LYS 212 HA LYS 212 12.952 -3.350 9.132 837 HB2 LYS 212 HB2 LYS 212 13.259 -5.439 7.984 838 HB3 LYS 212 HB3 LYS 212 12.049 -5.674 9.238 839 HG2 LYS 212 HG2 LYS 212 10.280 -5.643 7.630 840 HG3 LYS 212 HG3 LYS 212 11.394 -5.172 6.344 841 HD2 LYS 212 HD2 LYS 212 10.996 -7.499 6.089 842 HD3 LYS 212 HD3 LYS 212 12.618 -7.333 6.766 843 HE2 LYS 212 HE2 LYS 212 11.768 -7.836 8.983 844 HE3 LYS 212 HE3 LYS 212 10.124 -7.921 8.356 845 HZ1 LYS 212 HZ1 LYS 212 10.694 -9.836 7.075 846 HZ2 LYS 212 HZ2 LYS 212 11.191 -10.113 8.668 847 HZ3 LYS 212 HZ3 LYS 212 12.330 -9.706 7.485 848 H LYS 213 H LYS 213 10.316 -2.803 6.974 849 HA LYS 213 HA LYS 213 11.985 -2.333 4.661 850 HB2 LYS 213 HB2 LYS 213 9.420 -3.097 4.882 851 HB3 LYS 213 HB3 LYS 213 9.180 -1.362 4.724 852 HG2 LYS 213 HG2 LYS 213 10.985 -2.700 2.784 853 HG3 LYS 213 HG3 LYS 213 9.246 -2.958 2.626 854 HD2 LYS 213 HD2 LYS 213 9.017 -0.427 2.741 855 HD3 LYS 213 HD3 LYS 213 10.767 -0.364 2.511 856 HE2 LYS 213 HE2 LYS 213 10.464 -1.717 0.435 857 HE3 LYS 213 HE3 LYS 213 8.721 -1.557 0.645 858 HZ1 LYS 213 HZ1 LYS 213 9.067 0.218 -0.683 859 HZ2 LYS 213 HZ2 LYS 213 10.678 0.422 -0.210 860 HZ3 LYS 213 HZ3 LYS 213 9.428 0.983 0.782 861 H ARG 214 H ARG 214 10.087 -0.386 6.938 862 HA ARG 214 HA ARG 214 10.560 2.115 5.762 863 HB2 ARG 214 HB2 ARG 214 9.799 3.073 7.812 864 HB3 ARG 214 HB3 ARG 214 8.870 1.602 7.550 865 HG2 ARG 214 HG2 ARG 214 10.198 0.414 9.165 866 HG3 ARG 214 HG3 ARG 214 11.271 1.803 9.354 867 HD2 ARG 214 HD2 ARG 214 9.569 1.542 11.168 868 HD3 ARG 214 HD3 ARG 214 9.536 3.102 10.347 869 HE ARG 214 HE ARG 214 7.713 1.206 9.215 870 HH11 ARG 214 HH11 ARG 214 8.162 3.541 11.757 871 HH12 ARG 214 HH12 ARG 214 6.467 3.845 11.954 872 HH21 ARG 214 HH21 ARG 214 5.480 1.596 9.466 873 HH22 ARG 214 HH22 ARG 214 4.943 2.737 10.653 874 H SER 215 H SER 215 12.497 0.149 7.906 875 HA SER 215 HA SER 215 14.312 2.101 8.783 876 HB2 SER 215 HB2 SER 215 14.572 0.168 9.993 877 HB3 SER 215 HB3 SER 215 14.317 -0.871 8.591 878 HG SER 215 HG SER 215 16.542 -0.669 9.532 879 H GLU 216 H GLU 216 14.286 0.051 5.905 880 HA GLU 216 HA GLU 216 16.850 0.795 4.963 881 HB2 GLU 216 HB2 GLU 216 14.435 -0.303 3.519 882 HB3 GLU 216 HB3 GLU 216 16.007 -0.080 2.764 883 HG2 GLU 216 HG2 GLU 216 16.908 -1.560 4.648 884 HG3 GLU 216 HG3 GLU 216 15.222 -1.990 4.931 885 H ARG 217 H ARG 217 13.600 2.046 4.349 886 HA ARG 217 HA ARG 217 14.224 3.847 2.309 887 HB2 ARG 217 HB2 ARG 217 11.925 3.271 2.912 888 HB3 ARG 217 HB3 ARG 217 12.114 4.077 4.463 889 HG2 ARG 217 HG2 ARG 217 12.410 6.214 3.323 890 HG3 ARG 217 HG3 ARG 217 12.232 5.407 1.763 891 HD2 ARG 217 HD2 ARG 217 9.969 4.694 2.417 892 HD3 ARG 217 HD3 ARG 217 10.152 5.556 3.943 893 HE ARG 217 HE ARG 217 9.714 7.515 2.846 894 HH11 ARG 217 HH11 ARG 217 10.512 5.058 0.512 895 HH12 ARG 217 HH12 ARG 217 10.103 6.039 -0.856 896 HH21 ARG 217 HH21 ARG 217 9.171 8.816 1.054 897 HH22 ARG 217 HH22 ARG 217 9.341 8.177 -0.546 898 H ILE 218 H ILE 218 14.780 4.006 5.729 899 HA ILE 218 HA ILE 218 15.262 6.847 5.780 900 HB ILE 218 HB ILE 218 15.901 4.738 7.845 901 HG12 ILE 218 HG12 ILE 218 13.664 6.747 7.959 902 HG13 ILE 218 HG13 ILE 218 13.449 5.190 7.167 903 HG21 ILE 218 HG21 ILE 218 17.239 6.421 8.568 904 HG22 ILE 218 HG22 ILE 218 16.304 7.668 7.745 905 HG23 ILE 218 HG23 ILE 218 15.721 6.987 9.263 906 HD11 ILE 218 HD11 ILE 218 14.461 4.379 9.516 907 HD12 ILE 218 HD12 ILE 218 13.638 5.854 10.023 908 HD13 ILE 218 HD13 ILE 218 12.737 4.579 9.204 909 H SER 219 H SER 219 17.106 3.974 5.214 910 HA SER 219 HA SER 219 19.643 5.391 5.522 911 HB2 SER 219 HB2 SER 219 19.886 3.271 6.440 912 HB3 SER 219 HB3 SER 219 18.862 2.514 5.221 913 HG SER 219 HG SER 219 21.534 2.826 5.233 914 H ASN 220 H ASN 220 18.568 3.041 3.079 915 HA ASN 220 HA ASN 220 18.707 4.865 0.908 916 HB2 ASN 220 HB2 ASN 220 21.161 4.502 1.556 917 HB3 ASN 220 HB3 ASN 220 20.961 2.865 0.942 918 HD21 ASN 220 HD21 ASN 220 22.204 5.684 0.140 919 HD22 ASN 220 HD22 ASN 220 21.951 5.689 -1.569 Start of MODEL 17 1 H ALA 23 H ALA 23 4.598 13.510 13.186 2 HA ALA 23 HA ALA 23 2.614 12.617 13.871 3 HB1 ALA 23 HB1 ALA 23 0.876 14.465 14.478 4 HB2 ALA 23 HB2 ALA 23 2.378 14.330 15.393 5 HB3 ALA 23 HB3 ALA 23 2.215 15.563 14.144 6 H ALA 24 H ALA 24 3.006 12.981 10.986 7 HA ALA 24 HA ALA 24 0.241 13.379 10.075 8 HB1 ALA 24 HB1 ALA 24 2.837 13.958 8.926 9 HB2 ALA 24 HB2 ALA 24 1.812 13.040 7.822 10 HB3 ALA 24 HB3 ALA 24 1.243 14.572 8.485 11 HA PRO 25 HA PRO 25 -0.408 9.131 9.187 12 HB2 PRO 25 HB2 PRO 25 -1.756 9.226 6.831 13 HB3 PRO 25 HB3 PRO 25 -2.475 9.716 8.370 14 HG2 PRO 25 HG2 PRO 25 -1.286 11.413 6.210 15 HG3 PRO 25 HG3 PRO 25 -2.771 11.669 7.144 16 HD2 PRO 25 HD2 PRO 25 -0.454 12.954 7.709 17 HD3 PRO 25 HD3 PRO 25 -1.631 12.511 8.963 18 H ASN 26 H ASN 26 1.677 8.329 8.853 19 HA ASN 26 HA ASN 26 2.460 8.073 6.024 20 HB2 ASN 26 HB2 ASN 26 4.507 8.058 8.219 21 HB3 ASN 26 HB3 ASN 26 4.713 8.425 6.509 22 HD21 ASN 26 HD21 ASN 26 2.752 10.272 6.085 23 HD22 ASN 26 HD22 ASN 26 3.079 11.695 7.009 24 H LEU 27 H LEU 27 2.927 6.062 5.320 25 HA LEU 27 HA LEU 27 2.678 3.881 7.269 26 HB2 LEU 27 HB2 LEU 27 1.209 4.154 5.139 27 HB3 LEU 27 HB3 LEU 27 2.618 3.503 4.303 28 HG LEU 27 HG LEU 27 2.474 1.469 5.676 29 HD11 LEU 27 HD11 LEU 27 0.643 3.097 7.188 30 HD12 LEU 27 HD12 LEU 27 1.393 1.558 7.612 31 HD13 LEU 27 HD13 LEU 27 -0.117 1.582 6.701 32 HD21 LEU 27 HD21 LEU 27 0.233 0.688 4.749 33 HD22 LEU 27 HD22 LEU 27 1.415 1.295 3.589 34 HD23 LEU 27 HD23 LEU 27 0.067 2.316 4.091 35 H ALA 28 H ALA 28 4.534 3.065 7.961 36 HA ALA 28 HA ALA 28 6.681 2.313 8.035 37 HB1 ALA 28 HB1 ALA 28 7.293 0.826 6.400 38 HB2 ALA 28 HB2 ALA 28 5.557 0.934 6.106 39 HB3 ALA 28 HB3 ALA 28 6.680 1.840 5.094 40 H GLY 29 H GLY 29 6.154 5.158 7.401 41 HA2 GLY 29 HA2 GLY 29 7.742 6.897 7.320 42 HA3 GLY 29 HA3 GLY 29 8.865 5.804 6.525 43 H ALA 30 H ALA 30 5.748 5.698 5.202 44 HA ALA 30 HA ALA 30 6.656 7.334 2.931 45 HB1 ALA 30 HB1 ALA 30 4.501 5.225 2.945 46 HB2 ALA 30 HB2 ALA 30 5.185 6.042 1.538 47 HB3 ALA 30 HB3 ALA 30 6.181 4.938 2.487 48 H VAL 31 H VAL 31 5.763 9.271 2.733 49 HA VAL 31 HA VAL 31 3.230 9.838 4.077 50 HB VAL 31 HB VAL 31 5.073 11.794 2.701 51 HG11 VAL 31 HG11 VAL 31 3.217 13.049 2.968 52 HG12 VAL 31 HG12 VAL 31 2.558 12.003 4.225 53 HG13 VAL 31 HG13 VAL 31 3.804 13.186 4.624 54 HG21 VAL 31 HG21 VAL 31 5.334 12.168 5.423 55 HG22 VAL 31 HG22 VAL 31 5.338 10.413 5.246 56 HG23 VAL 31 HG23 VAL 31 6.509 11.391 4.363 57 H GLU 32 H GLU 32 4.704 9.888 0.873 58 HA GLU 32 HA GLU 32 2.440 11.018 -0.444 59 HB2 GLU 32 HB2 GLU 32 4.791 9.454 -1.522 60 HB3 GLU 32 HB3 GLU 32 3.590 10.258 -2.523 61 HG2 GLU 32 HG2 GLU 32 5.059 11.831 -0.465 62 HG3 GLU 32 HG3 GLU 32 5.862 11.415 -1.978 63 H PHE 33 H PHE 33 0.828 10.031 -1.618 64 HA PHE 33 HA PHE 33 -0.167 7.591 -0.696 65 HB2 PHE 33 HB2 PHE 33 -1.720 9.090 -1.662 66 HB3 PHE 33 HB3 PHE 33 -0.782 9.235 -3.144 67 HD1 PHE 33 HD1 PHE 33 -2.666 6.732 -1.137 68 HD2 PHE 33 HD2 PHE 33 -1.374 7.988 -4.993 69 HE1 PHE 33 HE1 PHE 33 -4.031 4.962 -2.167 70 HE2 PHE 33 HE2 PHE 33 -2.737 6.220 -6.029 71 HZ PHE 33 HZ PHE 33 -4.068 4.706 -4.616 72 H SER 34 H SER 34 1.438 8.336 -3.787 73 HA SER 34 HA SER 34 1.384 5.832 -4.939 74 HB2 SER 34 HB2 SER 34 2.296 7.255 -6.450 75 HB3 SER 34 HB3 SER 34 3.070 8.236 -5.206 76 HG SER 34 HG SER 34 4.842 7.122 -5.442 77 H ASP 35 H ASP 35 3.583 7.089 -2.494 78 HA ASP 35 HA ASP 35 5.304 4.797 -2.523 79 HB2 ASP 35 HB2 ASP 35 5.010 7.195 -0.739 80 HB3 ASP 35 HB3 ASP 35 6.039 5.848 -0.259 81 H VAL 36 H VAL 36 2.414 5.736 -0.820 82 HA VAL 36 HA VAL 36 2.619 3.784 1.256 83 HB VAL 36 HB VAL 36 0.193 5.274 0.242 84 HG11 VAL 36 HG11 VAL 36 0.442 3.117 2.106 85 HG12 VAL 36 HG12 VAL 36 -0.080 4.574 2.954 86 HG13 VAL 36 HG13 VAL 36 -1.008 3.971 1.579 87 HG21 VAL 36 HG21 VAL 36 1.309 6.008 2.835 88 HG22 VAL 36 HG22 VAL 36 2.411 6.305 1.491 89 HG23 VAL 36 HG23 VAL 36 0.803 7.029 1.490 90 H LYS 37 H LYS 37 0.711 3.990 -1.742 91 HA LYS 37 HA LYS 37 -0.532 1.476 -1.489 92 HB2 LYS 37 HB2 LYS 37 -1.010 1.699 -3.904 93 HB3 LYS 37 HB3 LYS 37 -1.401 3.157 -3.004 94 HG2 LYS 37 HG2 LYS 37 0.437 4.321 -3.866 95 HG3 LYS 37 HG3 LYS 37 1.221 2.840 -4.424 96 HD2 LYS 37 HD2 LYS 37 -1.306 2.946 -5.671 97 HD3 LYS 37 HD3 LYS 37 -0.599 4.558 -5.816 98 HE2 LYS 37 HE2 LYS 37 1.456 3.537 -6.724 99 HE3 LYS 37 HE3 LYS 37 0.686 1.954 -6.637 100 HZ1 LYS 37 HZ1 LYS 37 -1.120 3.074 -8.073 101 HZ2 LYS 37 HZ2 LYS 37 0.319 2.576 -8.808 102 HZ3 LYS 37 HZ3 LYS 37 0.083 4.207 -8.431 103 H THR 38 H THR 38 2.589 2.447 -2.706 104 HA THR 38 HA THR 38 3.203 0.077 -4.130 105 HB THR 38 HB THR 38 5.012 2.152 -2.885 106 HG1 THR 38 HG1 THR 38 4.996 3.040 -4.883 107 HG21 THR 38 HG21 THR 38 5.690 -0.133 -4.741 108 HG22 THR 38 HG22 THR 38 6.251 0.081 -3.082 109 HG23 THR 38 HG23 THR 38 6.775 1.198 -4.342 110 H LEU 39 H LEU 39 3.732 1.092 -0.788 111 HA LEU 39 HA LEU 39 5.317 -1.126 -0.028 112 HB2 LEU 39 HB2 LEU 39 3.580 0.701 1.624 113 HB3 LEU 39 HB3 LEU 39 4.728 -0.461 2.285 114 HG LEU 39 HG LEU 39 5.676 1.663 0.406 115 HD11 LEU 39 HD11 LEU 39 4.867 3.221 1.802 116 HD12 LEU 39 HD12 LEU 39 6.205 2.732 2.841 117 HD13 LEU 39 HD13 LEU 39 4.595 2.062 3.103 118 HD21 LEU 39 HD21 LEU 39 7.030 0.476 2.810 119 HD22 LEU 39 HD22 LEU 39 7.757 1.315 1.439 120 HD23 LEU 39 HD23 LEU 39 7.075 -0.298 1.226 121 H LEU 40 H LEU 40 1.847 -0.523 -0.025 122 HA LEU 40 HA LEU 40 1.154 -2.888 1.405 123 HB2 LEU 40 HB2 LEU 40 -0.583 -1.315 -0.486 124 HB3 LEU 40 HB3 LEU 40 -1.111 -2.390 0.807 125 HG LEU 40 HG LEU 40 0.492 0.053 1.452 126 HD11 LEU 40 HD11 LEU 40 -1.216 1.500 1.199 127 HD12 LEU 40 HD12 LEU 40 -2.444 0.288 1.562 128 HD13 LEU 40 HD13 LEU 40 -1.720 0.354 -0.044 129 HD21 LEU 40 HD21 LEU 40 0.217 -1.287 3.328 130 HD22 LEU 40 HD22 LEU 40 -1.417 -1.769 2.869 131 HD23 LEU 40 HD23 LEU 40 -1.114 -0.136 3.467 132 H LYS 41 H LYS 41 1.225 -2.020 -2.033 133 HA LYS 41 HA LYS 41 0.148 -4.323 -3.124 134 HB2 LYS 41 HB2 LYS 41 1.051 -2.096 -4.214 135 HB3 LYS 41 HB3 LYS 41 2.510 -3.053 -4.447 136 HG2 LYS 41 HG2 LYS 41 0.798 -4.789 -5.447 137 HG3 LYS 41 HG3 LYS 41 -0.167 -3.334 -5.699 138 HD2 LYS 41 HD2 LYS 41 1.049 -3.553 -7.681 139 HD3 LYS 41 HD3 LYS 41 1.955 -2.351 -6.761 140 HE2 LYS 41 HE2 LYS 41 3.675 -3.820 -6.288 141 HE3 LYS 41 HE3 LYS 41 2.661 -5.244 -6.518 142 HZ1 LYS 41 HZ1 LYS 41 3.658 -3.447 -8.663 143 HZ2 LYS 41 HZ2 LYS 41 2.641 -4.777 -8.902 144 HZ3 LYS 41 HZ3 LYS 41 4.217 -5.010 -8.332 145 H GLU 42 H GLU 42 3.510 -3.680 -2.192 146 HA GLU 42 HA GLU 42 4.413 -6.283 -2.997 147 HB2 GLU 42 HB2 GLU 42 6.539 -5.632 -1.956 148 HB3 GLU 42 HB3 GLU 42 5.939 -4.380 -3.034 149 HG2 GLU 42 HG2 GLU 42 5.069 -3.155 -1.083 150 HG3 GLU 42 HG3 GLU 42 5.767 -4.385 -0.030 151 H TRP 43 H TRP 43 3.531 -4.728 0.046 152 HA TRP 43 HA TRP 43 4.333 -6.814 1.761 153 HB2 TRP 43 HB2 TRP 43 3.900 -4.644 2.686 154 HB3 TRP 43 HB3 TRP 43 2.247 -4.652 2.077 155 HD1 TRP 43 HD1 TRP 43 4.239 -7.096 4.364 156 HE1 TRP 43 HE1 TRP 43 2.759 -7.640 6.400 157 HE3 TRP 43 HE3 TRP 43 0.162 -4.242 3.193 158 HZ2 TRP 43 HZ2 TRP 43 0.202 -6.952 7.378 159 HZ3 TRP 43 HZ3 TRP 43 -1.758 -4.241 4.731 160 HH2 TRP 43 HH2 TRP 43 -1.737 -5.569 6.779 161 H ILE 44 H ILE 44 1.792 -6.622 -0.471 162 HA ILE 44 HA ILE 44 0.252 -8.715 0.899 163 HB ILE 44 HB ILE 44 -0.497 -7.027 -1.492 164 HG12 ILE 44 HG12 ILE 44 -1.855 -6.961 1.181 165 HG13 ILE 44 HG13 ILE 44 -0.374 -6.044 0.933 166 HG21 ILE 44 HG21 ILE 44 -1.943 -9.221 -0.038 167 HG22 ILE 44 HG22 ILE 44 -2.794 -8.007 -0.991 168 HG23 ILE 44 HG23 ILE 44 -1.620 -9.069 -1.766 169 HD11 ILE 44 HD11 ILE 44 -2.303 -5.625 -1.190 170 HD12 ILE 44 HD12 ILE 44 -2.930 -5.190 0.401 171 HD13 ILE 44 HD13 ILE 44 -1.440 -4.455 -0.190 172 H THR 45 H THR 45 2.563 -8.292 -1.509 173 HA THR 45 HA THR 45 1.758 -10.743 -2.920 174 HB THR 45 HB THR 45 3.374 -10.094 -4.657 175 HG1 THR 45 HG1 THR 45 4.767 -8.536 -4.304 176 HG21 THR 45 HG21 THR 45 1.047 -8.486 -3.888 177 HG22 THR 45 HG22 THR 45 1.459 -9.214 -5.442 178 HG23 THR 45 HG23 THR 45 2.163 -7.664 -4.980 179 H THR 46 H THR 46 4.717 -9.165 -1.701 180 HA THR 46 HA THR 46 6.281 -11.531 -1.800 181 HB THR 46 HB THR 46 7.214 -9.201 -1.798 182 HG1 THR 46 HG1 THR 46 8.881 -10.431 -1.348 183 HG21 THR 46 HG21 THR 46 6.809 -7.787 -0.125 184 HG22 THR 46 HG22 THR 46 7.442 -8.939 1.052 185 HG23 THR 46 HG23 THR 46 5.741 -8.994 0.589 186 H ILE 47 H ILE 47 3.849 -10.546 0.307 187 HA ILE 47 HA ILE 47 4.685 -12.573 2.264 188 HB ILE 47 HB ILE 47 3.564 -9.845 2.903 189 HG12 ILE 47 HG12 ILE 47 5.865 -10.648 4.427 190 HG13 ILE 47 HG13 ILE 47 6.204 -10.838 2.710 191 HG21 ILE 47 HG21 ILE 47 2.422 -11.332 4.339 192 HG22 ILE 47 HG22 ILE 47 3.875 -12.287 4.628 193 HG23 ILE 47 HG23 ILE 47 3.744 -10.658 5.292 194 HD11 ILE 47 HD11 ILE 47 6.830 -8.683 2.938 195 HD12 ILE 47 HD12 ILE 47 5.111 -8.408 2.656 196 HD13 ILE 47 HD13 ILE 47 5.748 -8.396 4.300 197 H SER 48 H SER 48 3.167 -14.041 2.684 198 HA SER 48 HA SER 48 0.430 -13.502 1.748 199 HB2 SER 48 HB2 SER 48 1.362 -16.264 2.406 200 HB3 SER 48 HB3 SER 48 0.210 -15.730 1.182 201 HG SER 48 HG SER 48 1.793 -15.715 -0.184 202 H ASP 49 H ASP 49 2.356 -14.302 4.509 203 HA ASP 49 HA ASP 49 -0.086 -14.585 6.133 204 HB2 ASP 49 HB2 ASP 49 1.240 -16.597 6.253 205 HB3 ASP 49 HB3 ASP 49 2.695 -15.669 6.606 206 HA PRO 50 HA PRO 50 1.742 -10.526 7.317 207 HB2 PRO 50 HB2 PRO 50 -0.658 -9.315 7.696 208 HB3 PRO 50 HB3 PRO 50 0.122 -9.427 6.114 209 HG2 PRO 50 HG2 PRO 50 -2.065 -11.112 7.271 210 HG3 PRO 50 HG3 PRO 50 -1.913 -10.445 5.635 211 HD2 PRO 50 HD2 PRO 50 -1.318 -13.020 6.218 212 HD3 PRO 50 HD3 PRO 50 -0.469 -12.107 4.954 213 H MET 51 H MET 51 1.962 -9.660 9.360 214 HA MET 51 HA MET 51 0.878 -11.282 11.532 215 HB2 MET 51 HB2 MET 51 3.241 -10.948 11.647 216 HB3 MET 51 HB3 MET 51 3.073 -9.213 11.416 217 HG2 MET 51 HG2 MET 51 2.510 -8.834 13.578 218 HG3 MET 51 HG3 MET 51 1.727 -10.401 13.766 219 HE1 MET 51 HE1 MET 51 6.213 -9.601 13.741 220 HE2 MET 51 HE2 MET 51 5.634 -10.584 12.396 221 HE3 MET 51 HE3 MET 51 4.986 -8.962 12.648 222 H GLU 52 H GLU 52 -0.237 -10.412 13.298 223 HA GLU 52 HA GLU 52 -2.185 -8.526 12.773 224 HB2 GLU 52 HB2 GLU 52 -2.469 -10.035 14.605 225 HB3 GLU 52 HB3 GLU 52 -1.015 -9.443 15.399 226 HG2 GLU 52 HG2 GLU 52 -2.956 -8.595 16.528 227 HG3 GLU 52 HG3 GLU 52 -2.110 -7.268 15.733 228 H GLU 53 H GLU 53 0.814 -8.058 14.639 229 HA GLU 53 HA GLU 53 0.530 -5.386 15.266 230 HB2 GLU 53 HB2 GLU 53 2.379 -7.027 15.950 231 HB3 GLU 53 HB3 GLU 53 3.173 -6.574 14.448 232 HG2 GLU 53 HG2 GLU 53 3.997 -5.336 16.416 233 HG3 GLU 53 HG3 GLU 53 3.348 -4.294 15.152 234 H ASP 54 H ASP 54 2.099 -6.759 12.378 235 HA ASP 54 HA ASP 54 2.775 -4.363 11.136 236 HB2 ASP 54 HB2 ASP 54 3.221 -6.921 10.524 237 HB3 ASP 54 HB3 ASP 54 1.875 -6.628 9.426 238 H ILE 55 H ILE 55 -0.269 -6.099 11.223 239 HA ILE 55 HA ILE 55 -1.545 -4.585 9.175 240 HB ILE 55 HB ILE 55 -2.766 -6.203 11.414 241 HG12 ILE 55 HG12 ILE 55 -2.664 -7.088 8.563 242 HG13 ILE 55 HG13 ILE 55 -1.207 -7.236 9.540 243 HG21 ILE 55 HG21 ILE 55 -4.776 -6.238 9.974 244 HG22 ILE 55 HG22 ILE 55 -4.372 -4.624 10.555 245 HG23 ILE 55 HG23 ILE 55 -3.989 -5.085 8.896 246 HD11 ILE 55 HD11 ILE 55 -3.471 -8.945 9.439 247 HD12 ILE 55 HD12 ILE 55 -1.979 -9.132 10.362 248 HD13 ILE 55 HD13 ILE 55 -3.347 -8.267 11.063 249 H LEU 56 H LEU 56 -1.450 -4.367 12.705 250 HA LEU 56 HA LEU 56 -3.362 -2.428 13.143 251 HB2 LEU 56 HB2 LEU 56 -0.892 -3.287 14.516 252 HB3 LEU 56 HB3 LEU 56 -1.523 -1.704 14.965 253 HG LEU 56 HG LEU 56 -2.271 -3.477 16.487 254 HD11 LEU 56 HD11 LEU 56 -3.668 -1.425 15.806 255 HD12 LEU 56 HD12 LEU 56 -4.466 -2.740 16.669 256 HD13 LEU 56 HD13 LEU 56 -4.663 -2.583 14.923 257 HD21 LEU 56 HD21 LEU 56 -2.335 -5.387 15.076 258 HD22 LEU 56 HD22 LEU 56 -3.488 -4.623 13.982 259 HD23 LEU 56 HD23 LEU 56 -3.989 -5.087 15.609 260 H GLN 57 H GLN 57 -0.034 -2.046 12.046 261 HA GLN 57 HA GLN 57 0.219 0.715 12.274 262 HB2 GLN 57 HB2 GLN 57 1.538 -1.424 10.768 263 HB3 GLN 57 HB3 GLN 57 1.606 0.141 9.969 264 HG2 GLN 57 HG2 GLN 57 2.324 -0.064 12.853 265 HG3 GLN 57 HG3 GLN 57 3.478 -0.582 11.625 266 HE21 GLN 57 HE21 GLN 57 3.402 1.708 13.560 267 HE22 GLN 57 HE22 GLN 57 3.697 3.107 12.588 268 H VAL 58 H VAL 58 -1.446 -1.217 9.882 269 HA VAL 58 HA VAL 58 -1.813 0.873 7.980 270 HB VAL 58 HB VAL 58 -3.563 -1.562 8.291 271 HG11 VAL 58 HG11 VAL 58 -3.529 0.600 6.471 272 HG12 VAL 58 HG12 VAL 58 -2.977 -0.832 5.599 273 HG13 VAL 58 HG13 VAL 58 -4.535 -0.847 6.429 274 HG21 VAL 58 HG21 VAL 58 -1.667 -2.745 8.054 275 HG22 VAL 58 HG22 VAL 58 -1.766 -2.240 6.367 276 HG23 VAL 58 HG23 VAL 58 -0.747 -1.348 7.497 277 H VAL 59 H VAL 59 -3.631 -0.298 10.746 278 HA VAL 59 HA VAL 59 -6.031 1.112 10.220 279 HB VAL 59 HB VAL 59 -4.914 0.153 12.858 280 HG11 VAL 59 HG11 VAL 59 -7.656 1.138 12.093 281 HG12 VAL 59 HG12 VAL 59 -7.315 0.238 13.572 282 HG13 VAL 59 HG13 VAL 59 -6.567 1.813 13.304 283 HG21 VAL 59 HG21 VAL 59 -5.419 -1.890 12.147 284 HG22 VAL 59 HG22 VAL 59 -7.106 -1.398 11.992 285 HG23 VAL 59 HG23 VAL 59 -6.011 -1.243 10.617 286 H ARG 60 H ARG 60 -3.290 1.831 12.379 287 HA ARG 60 HA ARG 60 -4.231 4.300 13.307 288 HB2 ARG 60 HB2 ARG 60 -1.362 3.419 12.941 289 HB3 ARG 60 HB3 ARG 60 -1.910 4.744 13.957 290 HG2 ARG 60 HG2 ARG 60 -3.026 2.029 14.434 291 HG3 ARG 60 HG3 ARG 60 -1.381 2.382 14.964 292 HD2 ARG 60 HD2 ARG 60 -2.210 4.304 16.237 293 HD3 ARG 60 HD3 ARG 60 -3.852 3.942 15.709 294 HE ARG 60 HE ARG 60 -2.977 1.641 16.901 295 HH11 ARG 60 HH11 ARG 60 -3.297 4.971 17.868 296 HH12 ARG 60 HH12 ARG 60 -3.577 4.596 19.536 297 HH21 ARG 60 HH21 ARG 60 -3.346 1.135 19.095 298 HH22 ARG 60 HH22 ARG 60 -3.604 2.414 20.232 299 H TYR 61 H TYR 61 -2.731 3.401 10.316 300 HA TYR 61 HA TYR 61 -1.916 6.036 9.556 301 HB2 TYR 61 HB2 TYR 61 -0.758 4.208 8.549 302 HB3 TYR 61 HB3 TYR 61 -2.262 3.468 8.008 303 HD1 TYR 61 HD2 TYR 61 0.115 6.218 7.415 304 HD2 TYR 61 HD1 TYR 61 -3.333 4.175 5.986 305 HE1 TYR 61 HE2 TYR 61 0.331 7.378 5.256 306 HE2 TYR 61 HE1 TYR 61 -3.126 5.328 3.823 307 HH TYR 61 HH TYR 61 -0.428 7.535 3.167 308 H CYS 62 H CYS 62 -4.577 3.905 8.519 309 HA CYS 62 HA CYS 62 -5.826 5.846 6.883 310 HB2 CYS 62 HB2 CYS 62 -6.774 3.264 8.113 311 HB3 CYS 62 HB3 CYS 62 -7.844 4.276 7.150 312 HG CYS 62 HG CYS 62 -5.467 4.113 5.160 313 H THR 63 H THR 63 -6.438 4.763 10.205 314 HA THR 63 HA THR 63 -8.709 6.271 10.739 315 HB THR 63 HB THR 63 -8.019 6.165 13.137 316 HG1 THR 63 HG1 THR 63 -5.625 5.374 11.918 317 HG21 THR 63 HG21 THR 63 -7.471 3.434 12.578 318 HG22 THR 63 HG22 THR 63 -8.600 4.020 11.356 319 HG23 THR 63 HG23 THR 63 -8.998 4.167 13.068 320 H ASP 64 H ASP 64 -5.396 7.250 10.470 321 HA ASP 64 HA ASP 64 -5.661 9.729 11.867 322 HB2 ASP 64 HB2 ASP 64 -3.589 8.468 10.123 323 HB3 ASP 64 HB3 ASP 64 -3.508 10.206 10.399 324 H LEU 65 H LEU 65 -5.928 8.719 8.502 325 HA LEU 65 HA LEU 65 -5.975 11.191 7.248 326 HB2 LEU 65 HB2 LEU 65 -6.869 8.484 6.643 327 HB3 LEU 65 HB3 LEU 65 -7.844 9.724 5.857 328 HG LEU 65 HG LEU 65 -6.011 10.529 4.622 329 HD11 LEU 65 HD11 LEU 65 -4.296 8.922 6.499 330 HD12 LEU 65 HD12 LEU 65 -4.314 10.670 6.271 331 HD13 LEU 65 HD13 LEU 65 -3.699 9.621 4.994 332 HD21 LEU 65 HD21 LEU 65 -5.013 7.870 4.272 333 HD22 LEU 65 HD22 LEU 65 -6.069 8.812 3.219 334 HD23 LEU 65 HD23 LEU 65 -6.761 7.822 4.505 335 H ILE 66 H ILE 66 -8.519 9.502 8.991 336 HA ILE 66 HA ILE 66 -10.689 11.107 8.219 337 HB ILE 66 HB ILE 66 -10.165 9.427 10.653 338 HG12 ILE 66 HG12 ILE 66 -12.530 8.918 9.016 339 HG13 ILE 66 HG13 ILE 66 -11.036 8.856 8.088 340 HG21 ILE 66 HG21 ILE 66 -12.617 9.821 11.187 341 HG22 ILE 66 HG22 ILE 66 -11.502 11.130 11.572 342 HG23 ILE 66 HG23 ILE 66 -12.511 11.228 10.130 343 HD11 ILE 66 HD11 ILE 66 -10.238 7.345 10.072 344 HD12 ILE 66 HD12 ILE 66 -11.971 7.108 10.298 345 HD13 ILE 66 HD13 ILE 66 -11.216 6.686 8.762 346 H GLU 67 H GLU 67 -8.456 11.385 10.966 347 HA GLU 67 HA GLU 67 -9.690 13.752 11.990 348 HB2 GLU 67 HB2 GLU 67 -6.885 12.814 12.575 349 HB3 GLU 67 HB3 GLU 67 -7.930 13.796 13.592 350 HG2 GLU 67 HG2 GLU 67 -9.423 11.885 13.901 351 HG3 GLU 67 HG3 GLU 67 -8.364 10.900 12.893 352 H GLU 68 H GLU 68 -7.030 13.060 9.815 353 HA GLU 68 HA GLU 68 -6.149 15.808 9.721 354 HB2 GLU 68 HB2 GLU 68 -5.347 13.307 8.252 355 HB3 GLU 68 HB3 GLU 68 -4.725 14.885 7.791 356 HG2 GLU 68 HG2 GLU 68 -4.371 13.497 10.434 357 HG3 GLU 68 HG3 GLU 68 -3.136 13.807 9.214 358 H LYS 69 H LYS 69 -8.683 14.123 8.386 359 HA LYS 69 HA LYS 69 -10.210 14.598 6.768 360 HB2 LYS 69 HB2 LYS 69 -8.805 17.256 6.484 361 HB3 LYS 69 HB3 LYS 69 -10.462 16.874 6.035 362 HG2 LYS 69 HG2 LYS 69 -9.470 16.718 8.865 363 HG3 LYS 69 HG3 LYS 69 -10.149 18.189 8.163 364 HD2 LYS 69 HD2 LYS 69 -11.777 15.786 7.743 365 HD3 LYS 69 HD3 LYS 69 -11.587 16.249 9.436 366 HE2 LYS 69 HE2 LYS 69 -12.133 18.648 8.455 367 HE3 LYS 69 HE3 LYS 69 -12.921 17.689 7.204 368 HZ1 LYS 69 HZ1 LYS 69 -13.684 18.108 9.962 369 HZ2 LYS 69 HZ2 LYS 69 -13.817 16.507 9.432 370 HZ3 LYS 69 HZ3 LYS 69 -14.642 17.740 8.616 371 H ASP 70 H ASP 70 -7.909 13.175 6.029 372 HA ASP 70 HA ASP 70 -7.422 14.144 3.289 373 HB2 ASP 70 HB2 ASP 70 -5.716 12.612 5.218 374 HB3 ASP 70 HB3 ASP 70 -5.461 12.414 3.486 375 H LEU 71 H LEU 71 -9.782 12.732 4.007 376 HA LEU 71 HA LEU 71 -9.743 9.991 3.609 377 HB2 LEU 71 HB2 LEU 71 -11.874 11.833 2.549 378 HB3 LEU 71 HB3 LEU 71 -12.053 10.149 3.037 379 HG LEU 71 HG LEU 71 -11.511 12.483 4.873 380 HD11 LEU 71 HD11 LEU 71 -13.883 11.777 3.702 381 HD12 LEU 71 HD12 LEU 71 -13.710 12.655 5.221 382 HD13 LEU 71 HD13 LEU 71 -13.938 10.907 5.236 383 HD21 LEU 71 HD21 LEU 71 -10.632 10.881 6.176 384 HD22 LEU 71 HD22 LEU 71 -11.339 9.576 5.223 385 HD23 LEU 71 HD23 LEU 71 -12.311 10.408 6.438 386 H GLU 72 H GLU 72 -9.194 12.537 1.352 387 HA GLU 72 HA GLU 72 -9.911 11.449 -1.070 388 HB2 GLU 72 HB2 GLU 72 -9.049 13.676 -0.988 389 HB3 GLU 72 HB3 GLU 72 -7.513 13.124 -0.335 390 HG2 GLU 72 HG2 GLU 72 -6.796 12.288 -2.372 391 HG3 GLU 72 HG3 GLU 72 -8.431 12.203 -3.025 392 H LYS 73 H LYS 73 -6.853 10.956 0.678 393 HA LYS 73 HA LYS 73 -5.907 9.028 -1.235 394 HB2 LYS 73 HB2 LYS 73 -4.833 9.640 1.523 395 HB3 LYS 73 HB3 LYS 73 -3.991 8.790 0.234 396 HG2 LYS 73 HG2 LYS 73 -3.311 10.688 -0.704 397 HG3 LYS 73 HG3 LYS 73 -4.916 11.412 -0.597 398 HD2 LYS 73 HD2 LYS 73 -3.900 12.796 0.869 399 HD3 LYS 73 HD3 LYS 73 -4.188 11.472 2.000 400 HE2 LYS 73 HE2 LYS 73 -1.965 11.756 2.370 401 HE3 LYS 73 HE3 LYS 73 -1.862 10.646 1.004 402 HZ1 LYS 73 HZ1 LYS 73 -1.767 13.602 0.758 403 HZ2 LYS 73 HZ2 LYS 73 -1.500 12.472 -0.472 404 HZ3 LYS 73 HZ3 LYS 73 -0.399 12.609 0.805 405 H LEU 74 H LEU 74 -7.795 8.967 1.646 406 HA LEU 74 HA LEU 74 -7.294 6.361 2.549 407 HB2 LEU 74 HB2 LEU 74 -8.571 8.151 3.747 408 HB3 LEU 74 HB3 LEU 74 -9.927 7.818 2.670 409 HG LEU 74 HG LEU 74 -10.140 5.582 3.579 410 HD11 LEU 74 HD11 LEU 74 -7.792 6.315 5.321 411 HD12 LEU 74 HD12 LEU 74 -7.801 5.116 4.029 412 HD13 LEU 74 HD13 LEU 74 -8.772 4.857 5.477 413 HD21 LEU 74 HD21 LEU 74 -11.449 7.127 4.750 414 HD22 LEU 74 HD22 LEU 74 -10.049 7.854 5.539 415 HD23 LEU 74 HD23 LEU 74 -10.589 6.241 6.010 416 H ASP 75 H ASP 75 -10.084 7.479 0.622 417 HA ASP 75 HA ASP 75 -11.121 4.990 -0.004 418 HB2 ASP 75 HB2 ASP 75 -11.928 7.473 -0.524 419 HB3 ASP 75 HB3 ASP 75 -11.224 7.109 -2.098 420 H LEU 76 H LEU 76 -8.378 6.648 -1.353 421 HA LEU 76 HA LEU 76 -8.165 4.993 -3.687 422 HB2 LEU 76 HB2 LEU 76 -6.132 6.792 -2.376 423 HB3 LEU 76 HB3 LEU 76 -5.975 6.060 -3.971 424 HG LEU 76 HG LEU 76 -8.214 7.950 -3.297 425 HD11 LEU 76 HD11 LEU 76 -6.002 9.047 -4.848 426 HD12 LEU 76 HD12 LEU 76 -5.575 8.680 -3.177 427 HD13 LEU 76 HD13 LEU 76 -6.927 9.759 -3.525 428 HD21 LEU 76 HD21 LEU 76 -8.760 6.922 -5.278 429 HD22 LEU 76 HD22 LEU 76 -7.077 6.715 -5.763 430 HD23 LEU 76 HD23 LEU 76 -7.836 8.305 -5.864 431 H VAL 77 H VAL 77 -6.529 5.140 -0.543 432 HA VAL 77 HA VAL 77 -4.769 2.968 -1.062 433 HB VAL 77 HB VAL 77 -5.674 4.129 1.576 434 HG11 VAL 77 HG11 VAL 77 -4.100 1.801 0.964 435 HG12 VAL 77 HG12 VAL 77 -3.132 2.995 1.832 436 HG13 VAL 77 HG13 VAL 77 -4.642 2.407 2.528 437 HG21 VAL 77 HG21 VAL 77 -2.974 4.591 0.429 438 HG22 VAL 77 HG22 VAL 77 -4.330 5.480 -0.265 439 HG23 VAL 77 HG23 VAL 77 -3.961 5.633 1.453 440 H ILE 78 H ILE 78 -7.996 3.234 0.281 441 HA ILE 78 HA ILE 78 -8.131 0.597 1.334 442 HB ILE 78 HB ILE 78 -10.298 2.549 0.561 443 HG12 ILE 78 HG12 ILE 78 -8.912 3.212 2.474 444 HG13 ILE 78 HG13 ILE 78 -10.544 2.807 2.994 445 HG21 ILE 78 HG21 ILE 78 -10.525 -0.154 1.870 446 HG22 ILE 78 HG22 ILE 78 -11.806 1.057 1.881 447 HG23 ILE 78 HG23 ILE 78 -11.255 0.371 0.353 448 HD11 ILE 78 HD11 ILE 78 -9.066 0.436 3.170 449 HD12 ILE 78 HD12 ILE 78 -8.047 1.709 3.841 450 HD13 ILE 78 HD13 ILE 78 -9.666 1.442 4.489 451 H LYS 79 H LYS 79 -9.559 2.045 -1.597 452 HA LYS 79 HA LYS 79 -10.538 -0.367 -2.663 453 HB2 LYS 79 HB2 LYS 79 -10.862 0.845 -4.714 454 HB3 LYS 79 HB3 LYS 79 -11.244 1.918 -3.374 455 HG2 LYS 79 HG2 LYS 79 -9.946 3.387 -4.436 456 HG3 LYS 79 HG3 LYS 79 -8.601 2.450 -3.780 457 HD2 LYS 79 HD2 LYS 79 -9.482 1.140 -6.129 458 HD3 LYS 79 HD3 LYS 79 -9.338 2.859 -6.506 459 HE2 LYS 79 HE2 LYS 79 -7.067 2.389 -5.056 460 HE3 LYS 79 HE3 LYS 79 -7.267 0.872 -5.931 461 HZ1 LYS 79 HZ1 LYS 79 -7.733 2.974 -7.714 462 HZ2 LYS 79 HZ2 LYS 79 -6.468 1.851 -7.729 463 HZ3 LYS 79 HZ3 LYS 79 -6.291 3.312 -6.894 464 H TYR 80 H TYR 80 -7.378 1.042 -2.648 465 HA TYR 80 HA TYR 80 -6.362 -0.528 -4.835 466 HB2 TYR 80 HB2 TYR 80 -5.382 1.654 -4.316 467 HB3 TYR 80 HB3 TYR 80 -4.912 1.079 -2.720 468 HD1 TYR 80 HD1 TYR 80 -3.087 -0.554 -2.476 469 HD2 TYR 80 HD2 TYR 80 -4.116 1.069 -6.273 470 HE1 TYR 80 HE1 TYR 80 -0.937 -1.330 -3.385 471 HE2 TYR 80 HE2 TYR 80 -1.969 0.297 -7.192 472 HH TYR 80 HH TYR 80 0.332 -0.263 -6.274 473 H MET 81 H MET 81 -6.143 -0.632 -1.297 474 HA MET 81 HA MET 81 -4.501 -2.973 -1.259 475 HB2 MET 81 HB2 MET 81 -4.682 -2.885 1.099 476 HB3 MET 81 HB3 MET 81 -4.651 -1.211 0.562 477 HG2 MET 81 HG2 MET 81 -7.005 -0.991 0.878 478 HG3 MET 81 HG3 MET 81 -7.176 -2.717 1.188 479 HE1 MET 81 HE1 MET 81 -5.021 0.346 2.414 480 HE2 MET 81 HE2 MET 81 -6.713 0.745 2.716 481 HE3 MET 81 HE3 MET 81 -5.611 0.486 4.070 482 H LYS 82 H LYS 82 -7.936 -2.329 -1.175 483 HA LYS 82 HA LYS 82 -8.746 -4.921 -0.331 484 HB2 LYS 82 HB2 LYS 82 -10.921 -4.192 -0.648 485 HB3 LYS 82 HB3 LYS 82 -10.073 -2.676 -0.374 486 HG2 LYS 82 HG2 LYS 82 -11.262 -2.075 -2.201 487 HG3 LYS 82 HG3 LYS 82 -9.862 -2.768 -3.022 488 HD2 LYS 82 HD2 LYS 82 -11.615 -3.790 -4.127 489 HD3 LYS 82 HD3 LYS 82 -11.223 -4.985 -2.888 490 HE2 LYS 82 HE2 LYS 82 -13.118 -4.539 -1.670 491 HE3 LYS 82 HE3 LYS 82 -13.244 -2.886 -2.269 492 HZ1 LYS 82 HZ1 LYS 82 -13.575 -5.008 -4.233 493 HZ2 LYS 82 HZ2 LYS 82 -14.392 -3.535 -4.083 494 HZ3 LYS 82 HZ3 LYS 82 -14.818 -4.842 -3.097 495 H ARG 83 H ARG 83 -7.997 -3.480 -3.426 496 HA ARG 83 HA ARG 83 -9.134 -5.563 -5.014 497 HB2 ARG 83 HB2 ARG 83 -8.498 -4.319 -6.803 498 HB3 ARG 83 HB3 ARG 83 -8.327 -3.066 -5.581 499 HG2 ARG 83 HG2 ARG 83 -5.898 -3.850 -5.386 500 HG3 ARG 83 HG3 ARG 83 -6.192 -4.693 -6.908 501 HD2 ARG 83 HD2 ARG 83 -6.943 -1.820 -6.693 502 HD3 ARG 83 HD3 ARG 83 -5.238 -2.236 -6.860 503 HE ARG 83 HE ARG 83 -6.953 -3.506 -8.793 504 HH11 ARG 83 HH11 ARG 83 -5.059 -0.682 -8.041 505 HH12 ARG 83 HH12 ARG 83 -4.842 -0.226 -9.698 506 HH21 ARG 83 HH21 ARG 83 -6.673 -2.916 -10.979 507 HH22 ARG 83 HH22 ARG 83 -5.760 -1.497 -11.368 508 H LEU 84 H LEU 84 -6.054 -5.032 -3.470 509 HA LEU 84 HA LEU 84 -4.723 -7.148 -4.914 510 HB2 LEU 84 HB2 LEU 84 -3.851 -5.655 -2.446 511 HB3 LEU 84 HB3 LEU 84 -2.839 -6.690 -3.450 512 HG LEU 84 HG LEU 84 -4.145 -4.230 -4.569 513 HD11 LEU 84 HD11 LEU 84 -1.855 -4.420 -2.717 514 HD12 LEU 84 HD12 LEU 84 -2.963 -3.084 -3.025 515 HD13 LEU 84 HD13 LEU 84 -1.633 -3.399 -4.138 516 HD21 LEU 84 HD21 LEU 84 -3.131 -4.903 -6.422 517 HD22 LEU 84 HD22 LEU 84 -2.474 -6.304 -5.575 518 HD23 LEU 84 HD23 LEU 84 -1.572 -4.787 -5.607 519 H MET 85 H MET 85 -5.635 -6.628 -1.503 520 HA MET 85 HA MET 85 -4.991 -9.147 -0.544 521 HB2 MET 85 HB2 MET 85 -7.184 -7.258 0.323 522 HB3 MET 85 HB3 MET 85 -6.708 -8.688 1.229 523 HG2 MET 85 HG2 MET 85 -4.390 -7.724 1.324 524 HG3 MET 85 HG3 MET 85 -5.067 -6.239 0.660 525 HE1 MET 85 HE1 MET 85 -3.745 -5.360 2.661 526 HE2 MET 85 HE2 MET 85 -5.158 -4.306 2.710 527 HE3 MET 85 HE3 MET 85 -4.538 -5.018 4.200 528 H GLN 86 H GLN 86 -7.699 -8.125 -2.458 529 HA GLN 86 HA GLN 86 -9.273 -10.482 -1.946 530 HB2 GLN 86 HB2 GLN 86 -9.534 -8.108 -3.753 531 HB3 GLN 86 HB3 GLN 86 -10.537 -9.525 -4.028 532 HG2 GLN 86 HG2 GLN 86 -11.388 -9.349 -1.731 533 HG3 GLN 86 HG3 GLN 86 -10.416 -7.895 -1.501 534 HE21 GLN 86 HE21 GLN 86 -12.568 -7.010 -0.982 535 HE22 GLN 86 HE22 GLN 86 -13.531 -6.396 -2.278 536 H GLN 87 H GLN 87 -7.587 -9.195 -4.813 537 HA GLN 87 HA GLN 87 -7.926 -11.512 -6.381 538 HB2 GLN 87 HB2 GLN 87 -6.452 -10.514 -7.935 539 HB3 GLN 87 HB3 GLN 87 -7.308 -9.178 -7.176 540 HG2 GLN 87 HG2 GLN 87 -5.354 -8.884 -5.658 541 HG3 GLN 87 HG3 GLN 87 -4.502 -10.098 -6.609 542 HE21 GLN 87 HE21 GLN 87 -6.590 -7.351 -7.437 543 HE22 GLN 87 HE22 GLN 87 -5.466 -6.600 -8.512 544 H SER 88 H SER 88 -5.895 -10.875 -3.740 545 HA SER 88 HA SER 88 -3.586 -12.300 -4.297 546 HB2 SER 88 HB2 SER 88 -5.083 -11.656 -1.796 547 HB3 SER 88 HB3 SER 88 -3.787 -12.848 -1.704 548 HG SER 88 HG SER 88 -2.444 -11.247 -1.739 549 H VAL 89 H VAL 89 -3.043 -14.427 -3.038 550 HA VAL 89 HA VAL 89 -4.931 -16.434 -4.014 551 HB VAL 89 HB VAL 89 -2.681 -16.794 -4.744 552 HG11 VAL 89 HG11 VAL 89 -1.933 -16.587 -1.833 553 HG12 VAL 89 HG12 VAL 89 -0.846 -17.175 -3.093 554 HG13 VAL 89 HG13 VAL 89 -1.444 -15.516 -3.147 555 HG21 VAL 89 HG21 VAL 89 -2.240 -19.025 -3.884 556 HG22 VAL 89 HG22 VAL 89 -3.287 -18.717 -2.499 557 HG23 VAL 89 HG23 VAL 89 -3.973 -18.790 -4.121 558 H GLU 90 H GLU 90 -3.480 -15.260 -1.050 559 HA GLU 90 HA GLU 90 -4.557 -17.415 0.548 560 HB2 GLU 90 HB2 GLU 90 -2.864 -15.020 1.042 561 HB3 GLU 90 HB3 GLU 90 -3.787 -15.649 2.399 562 HG2 GLU 90 HG2 GLU 90 -1.969 -17.355 0.724 563 HG3 GLU 90 HG3 GLU 90 -1.434 -16.500 2.170 564 H SER 91 H SER 91 -6.533 -17.480 1.372 565 HA SER 91 HA SER 91 -8.414 -15.404 0.943 566 HB2 SER 91 HB2 SER 91 -8.713 -17.724 2.859 567 HB3 SER 91 HB3 SER 91 -9.999 -16.821 2.056 568 HG SER 91 HG SER 91 -9.836 -18.241 0.530 569 H VAL 92 H VAL 92 -6.277 -16.187 3.556 570 HA VAL 92 HA VAL 92 -7.527 -14.950 5.709 571 HB VAL 92 HB VAL 92 -5.439 -16.307 5.846 572 HG11 VAL 92 HG11 VAL 92 -4.469 -14.596 3.953 573 HG12 VAL 92 HG12 VAL 92 -3.690 -13.999 5.420 574 HG13 VAL 92 HG13 VAL 92 -3.488 -15.684 4.935 575 HG21 VAL 92 HG21 VAL 92 -6.319 -14.367 7.499 576 HG22 VAL 92 HG22 VAL 92 -4.933 -15.399 7.849 577 HG23 VAL 92 HG23 VAL 92 -4.685 -13.788 7.175 578 H TRP 93 H TRP 93 -5.969 -13.567 2.941 579 HA TRP 93 HA TRP 93 -5.418 -11.001 3.980 580 HB2 TRP 93 HB2 TRP 93 -5.677 -12.187 1.260 581 HB3 TRP 93 HB3 TRP 93 -5.748 -10.433 1.398 582 HD1 TRP 93 HD1 TRP 93 -3.319 -12.964 0.689 583 HE1 TRP 93 HE1 TRP 93 -0.926 -12.212 1.269 584 HE3 TRP 93 HE3 TRP 93 -4.424 -8.943 3.646 585 HZ2 TRP 93 HZ2 TRP 93 0.327 -10.184 2.779 586 HZ3 TRP 93 HZ3 TRP 93 -2.571 -7.651 4.621 587 HH2 TRP 93 HH2 TRP 93 -0.245 -8.260 4.195 588 H ASN 94 H ASN 94 -8.328 -12.509 2.843 589 HA ASN 94 HA ASN 94 -9.826 -10.174 2.299 590 HB2 ASN 94 HB2 ASN 94 -10.621 -12.997 3.003 591 HB3 ASN 94 HB3 ASN 94 -11.811 -11.739 2.681 592 HD21 ASN 94 HD21 ASN 94 -9.020 -13.394 1.298 593 HD22 ASN 94 HD22 ASN 94 -9.522 -13.244 -0.348 594 H MET 95 H MET 95 -9.341 -12.095 5.220 595 HA MET 95 HA MET 95 -11.237 -10.655 6.792 596 HB2 MET 95 HB2 MET 95 -8.897 -12.231 7.854 597 HB3 MET 95 HB3 MET 95 -10.439 -11.919 8.641 598 HG2 MET 95 HG2 MET 95 -11.563 -13.316 6.972 599 HG3 MET 95 HG3 MET 95 -10.006 -13.645 6.214 600 HE1 MET 95 HE1 MET 95 -10.522 -16.963 7.305 601 HE2 MET 95 HE2 MET 95 -10.010 -15.769 6.113 602 HE3 MET 95 HE3 MET 95 -8.840 -16.432 7.256 603 H ALA 96 H ALA 96 -7.750 -10.439 6.293 604 HA ALA 96 HA ALA 96 -7.086 -8.643 8.301 605 HB1 ALA 96 HB1 ALA 96 -5.272 -7.900 6.642 606 HB2 ALA 96 HB2 ALA 96 -5.293 -9.589 7.151 607 HB3 ALA 96 HB3 ALA 96 -5.942 -9.134 5.575 608 H PHE 97 H PHE 97 -8.323 -8.006 5.042 609 HA PHE 97 HA PHE 97 -8.124 -5.213 5.100 610 HB2 PHE 97 HB2 PHE 97 -8.550 -6.448 3.035 611 HB3 PHE 97 HB3 PHE 97 -10.121 -6.958 3.642 612 HD1 PHE 97 HD2 PHE 97 -8.402 -3.650 3.608 613 HD2 PHE 97 HD1 PHE 97 -11.762 -5.959 2.384 614 HE1 PHE 97 HE2 PHE 97 -9.427 -1.636 2.634 615 HE2 PHE 97 HE1 PHE 97 -12.792 -3.949 1.408 616 HZ PHE 97 HZ PHE 97 -11.625 -1.784 1.533 617 H ASP 98 H ASP 98 -10.758 -7.369 6.082 618 HA ASP 98 HA ASP 98 -12.593 -5.323 6.751 619 HB2 ASP 98 HB2 ASP 98 -12.958 -7.890 6.403 620 HB3 ASP 98 HB3 ASP 98 -12.601 -7.988 8.125 621 H PHE 99 H PHE 99 -10.028 -6.924 8.522 622 HA PHE 99 HA PHE 99 -10.709 -6.131 11.118 623 HB2 PHE 99 HB2 PHE 99 -9.021 -7.769 10.920 624 HB3 PHE 99 HB3 PHE 99 -8.077 -6.782 9.810 625 HD1 PHE 99 HD2 PHE 99 -9.074 -7.227 13.321 626 HD2 PHE 99 HD1 PHE 99 -6.541 -5.152 10.602 627 HE1 PHE 99 HE2 PHE 99 -7.744 -6.383 15.211 628 HE2 PHE 99 HE1 PHE 99 -5.206 -4.305 12.488 629 HZ PHE 99 HZ PHE 99 -5.807 -4.919 14.795 630 H ILE 100 H ILE 100 -8.641 -4.541 8.706 631 HA ILE 100 HA ILE 100 -7.973 -2.315 10.311 632 HB ILE 100 HB ILE 100 -8.061 -2.519 7.298 633 HG12 ILE 100 HG12 ILE 100 -5.483 -2.545 8.726 634 HG13 ILE 100 HG13 ILE 100 -6.491 -3.961 9.002 635 HG21 ILE 100 HG21 ILE 100 -7.602 -0.288 9.012 636 HG22 ILE 100 HG22 ILE 100 -6.097 -0.697 8.190 637 HG23 ILE 100 HG23 ILE 100 -7.551 -0.361 7.250 638 HD11 ILE 100 HD11 ILE 100 -5.801 -2.940 6.263 639 HD12 ILE 100 HD12 ILE 100 -4.848 -4.148 7.125 640 HD13 ILE 100 HD13 ILE 100 -6.523 -4.489 6.695 641 H LEU 101 H LEU 101 -10.617 -2.940 8.069 642 HA LEU 101 HA LEU 101 -11.633 -0.279 8.081 643 HB2 LEU 101 HB2 LEU 101 -12.814 -2.931 7.300 644 HB3 LEU 101 HB3 LEU 101 -13.721 -1.424 7.194 645 HG LEU 101 HG LEU 101 -11.091 -1.553 5.818 646 HD11 LEU 101 HD11 LEU 101 -11.602 -3.238 4.474 647 HD12 LEU 101 HD12 LEU 101 -13.086 -2.415 3.994 648 HD13 LEU 101 HD13 LEU 101 -13.093 -3.513 5.375 649 HD21 LEU 101 HD21 LEU 101 -12.577 -0.314 4.113 650 HD22 LEU 101 HD22 LEU 101 -12.134 0.512 5.607 651 HD23 LEU 101 HD23 LEU 101 -13.738 -0.203 5.437 652 H ASP 102 H ASP 102 -12.168 -3.130 10.042 653 HA ASP 102 HA ASP 102 -14.529 -2.356 11.334 654 HB2 ASP 102 HB2 ASP 102 -13.136 -4.598 11.398 655 HB3 ASP 102 HB3 ASP 102 -12.421 -3.860 12.829 656 H ASN 103 H ASN 103 -11.228 -1.358 11.776 657 HA ASN 103 HA ASN 103 -11.904 0.065 14.245 658 HB2 ASN 103 HB2 ASN 103 -9.294 -0.585 12.887 659 HB3 ASN 103 HB3 ASN 103 -9.389 0.587 14.198 660 HD21 ASN 103 HD21 ASN 103 -10.091 -2.757 13.340 661 HD22 ASN 103 HD22 ASN 103 -9.903 -3.394 14.936 662 H VAL 104 H VAL 104 -10.833 0.619 10.934 663 HA VAL 104 HA VAL 104 -10.534 3.447 11.225 664 HB VAL 104 HB VAL 104 -10.820 1.742 8.749 665 HG11 VAL 104 HG11 VAL 104 -10.093 4.656 9.025 666 HG12 VAL 104 HG12 VAL 104 -9.937 3.712 7.543 667 HG13 VAL 104 HG13 VAL 104 -11.530 3.995 8.247 668 HG21 VAL 104 HG21 VAL 104 -8.525 1.637 8.645 669 HG22 VAL 104 HG22 VAL 104 -8.306 3.101 9.604 670 HG23 VAL 104 HG23 VAL 104 -8.781 1.596 10.390 671 H GLN 105 H GLN 105 -12.923 1.506 9.415 672 HA GLN 105 HA GLN 105 -14.659 3.508 8.703 673 HB2 GLN 105 HB2 GLN 105 -15.450 0.725 9.578 674 HB3 GLN 105 HB3 GLN 105 -16.398 1.802 8.561 675 HG2 GLN 105 HG2 GLN 105 -13.665 0.820 7.797 676 HG3 GLN 105 HG3 GLN 105 -15.148 -0.037 7.383 677 HE21 GLN 105 HE21 GLN 105 -13.418 2.998 6.999 678 HE22 GLN 105 HE22 GLN 105 -14.162 3.448 5.506 679 H VAL 106 H VAL 106 -14.226 2.034 11.829 680 HA VAL 106 HA VAL 106 -16.644 2.974 13.001 681 HB VAL 106 HB VAL 106 -14.077 1.889 14.102 682 HG11 VAL 106 HG11 VAL 106 -14.466 3.471 15.757 683 HG12 VAL 106 HG12 VAL 106 -16.220 3.344 15.606 684 HG13 VAL 106 HG13 VAL 106 -15.303 2.045 16.371 685 HG21 VAL 106 HG21 VAL 106 -15.938 0.451 13.172 686 HG22 VAL 106 HG22 VAL 106 -15.419 0.075 14.816 687 HG23 VAL 106 HG23 VAL 106 -16.910 0.977 14.546 688 H VAL 107 H VAL 107 -13.267 4.082 13.318 689 HA VAL 107 HA VAL 107 -13.901 6.400 14.805 690 HB VAL 107 HB VAL 107 -11.655 5.487 14.846 691 HG11 VAL 107 HG11 VAL 107 -11.208 4.569 12.778 692 HG12 VAL 107 HG12 VAL 107 -11.779 5.993 11.905 693 HG13 VAL 107 HG13 VAL 107 -10.224 6.031 12.736 694 HG21 VAL 107 HG21 VAL 107 -11.907 7.859 15.317 695 HG22 VAL 107 HG22 VAL 107 -10.375 7.554 14.496 696 HG23 VAL 107 HG23 VAL 107 -11.735 8.235 13.602 697 H LEU 108 H LEU 108 -13.958 5.689 11.422 698 HA LEU 108 HA LEU 108 -13.830 8.392 10.501 699 HB2 LEU 108 HB2 LEU 108 -13.573 7.392 8.544 700 HB3 LEU 108 HB3 LEU 108 -13.784 5.839 9.350 701 HG LEU 108 HG LEU 108 -16.273 6.132 8.951 702 HD11 LEU 108 HD11 LEU 108 -16.864 8.184 8.290 703 HD12 LEU 108 HD12 LEU 108 -16.334 7.660 6.691 704 HD13 LEU 108 HD13 LEU 108 -15.240 8.576 7.727 705 HD21 LEU 108 HD21 LEU 108 -15.486 5.936 6.255 706 HD22 LEU 108 HD22 LEU 108 -15.803 4.626 7.393 707 HD23 LEU 108 HD23 LEU 108 -14.169 5.268 7.218 708 H GLN 109 H GLN 109 -16.424 6.125 11.255 709 HA GLN 109 HA GLN 109 -18.550 7.718 10.290 710 HB2 GLN 109 HB2 GLN 109 -18.351 5.411 12.192 711 HB3 GLN 109 HB3 GLN 109 -19.873 6.275 12.021 712 HG2 GLN 109 HG2 GLN 109 -19.955 5.757 9.670 713 HG3 GLN 109 HG3 GLN 109 -18.364 5.001 9.751 714 HE21 GLN 109 HE21 GLN 109 -18.161 3.103 11.136 715 HE22 GLN 109 HE22 GLN 109 -19.512 2.037 11.294 716 H GLN 110 H GLN 110 -17.008 7.437 13.457 717 HA GLN 110 HA GLN 110 -18.801 9.103 14.857 718 HB2 GLN 110 HB2 GLN 110 -15.893 8.477 15.390 719 HB3 GLN 110 HB3 GLN 110 -16.955 9.306 16.519 720 HG2 GLN 110 HG2 GLN 110 -18.452 7.229 16.310 721 HG3 GLN 110 HG3 GLN 110 -17.028 6.455 15.617 722 HE21 GLN 110 HE21 GLN 110 -15.772 5.439 16.995 723 HE22 GLN 110 HE22 GLN 110 -15.642 5.758 18.688 724 H THR 111 H THR 111 -16.493 9.811 12.489 725 HA THR 111 HA THR 111 -16.108 12.564 13.393 726 HB THR 111 HB THR 111 -14.902 11.070 11.057 727 HG1 THR 111 HG1 THR 111 -14.185 10.565 13.264 728 HG21 THR 111 HG21 THR 111 -14.715 13.924 11.931 729 HG22 THR 111 HG22 THR 111 -14.854 13.258 10.304 730 HG23 THR 111 HG23 THR 111 -13.325 13.147 11.175 731 H TYR 112 H TYR 112 -16.972 10.966 10.317 732 HA TYR 112 HA TYR 112 -18.518 13.350 9.592 733 HB2 TYR 112 HB2 TYR 112 -17.846 11.051 7.764 734 HB3 TYR 112 HB3 TYR 112 -18.311 12.692 7.326 735 HD1 TYR 112 HD2 TYR 112 -16.696 14.520 7.454 736 HD2 TYR 112 HD1 TYR 112 -15.573 10.528 8.404 737 HE1 TYR 112 HE2 TYR 112 -14.326 15.156 7.296 738 HE2 TYR 112 HE1 TYR 112 -13.199 11.153 8.252 739 HH TYR 112 HH TYR 112 -11.745 12.795 7.923 740 H GLY 113 H GLY 113 -18.768 9.820 9.802 741 HA2 GLY 113 HA2 GLY 113 -20.765 8.809 10.689 742 HA3 GLY 113 HA3 GLY 113 -21.690 10.139 10.008 743 H SER 114 H SER 114 -19.201 8.136 8.472 744 HA SER 114 HA SER 114 -21.178 6.728 6.893 745 HB2 SER 114 HB2 SER 114 -20.546 9.071 5.833 746 HB3 SER 114 HB3 SER 114 -19.119 8.189 5.291 747 HG SER 114 HG SER 114 -20.410 7.614 3.725 748 H THR 115 H THR 115 -19.856 5.451 5.080 749 HA THR 115 HA THR 115 -17.237 4.612 6.005 750 HB THR 115 HB THR 115 -17.829 2.242 6.183 751 HG1 THR 115 HG1 THR 115 -20.505 3.175 5.861 752 HG21 THR 115 HG21 THR 115 -18.779 2.309 8.342 753 HG22 THR 115 HG22 THR 115 -19.682 3.782 7.985 754 HG23 THR 115 HG23 THR 115 -17.929 3.844 8.165 755 H LEU 116 H LEU 116 -16.075 3.391 4.468 756 HA LEU 116 HA LEU 116 -16.679 3.996 1.773 757 HB2 LEU 116 HB2 LEU 116 -14.479 3.015 3.234 758 HB3 LEU 116 HB3 LEU 116 -14.817 1.829 1.975 759 HG LEU 116 HG LEU 116 -14.874 4.190 0.584 760 HD11 LEU 116 HD11 LEU 116 -12.591 4.386 2.538 761 HD12 LEU 116 HD12 LEU 116 -14.059 5.359 2.626 762 HD13 LEU 116 HD13 LEU 116 -12.987 5.505 1.233 763 HD21 LEU 116 HD21 LEU 116 -13.590 1.840 0.416 764 HD22 LEU 116 HD22 LEU 116 -12.238 2.886 0.855 765 HD23 LEU 116 HD23 LEU 116 -13.193 3.237 -0.586 766 H LYS 117 H LYS 117 -17.040 2.511 0.023 767 HA LYS 117 HA LYS 117 -18.676 0.210 0.847 768 HB2 LYS 117 HB2 LYS 117 -19.985 1.734 -0.419 769 HB3 LYS 117 HB3 LYS 117 -18.716 1.944 -1.618 770 HG2 LYS 117 HG2 LYS 117 -20.477 0.593 -2.538 771 HG3 LYS 117 HG3 LYS 117 -19.033 -0.399 -2.318 772 HD2 LYS 117 HD2 LYS 117 -20.995 -0.320 -0.092 773 HD3 LYS 117 HD3 LYS 117 -21.450 -1.208 -1.548 774 HE2 LYS 117 HE2 LYS 117 -19.006 -2.193 -1.254 775 HE3 LYS 117 HE3 LYS 117 -19.300 -1.759 0.428 776 HZ1 LYS 117 HZ1 LYS 117 -21.499 -3.142 -0.806 777 HZ2 LYS 117 HZ2 LYS 117 -20.738 -3.428 0.678 778 HZ3 LYS 117 HZ3 LYS 117 -20.081 -4.063 -0.747 779 H VAL 118 H VAL 118 -17.218 -1.438 0.983 780 HA VAL 118 HA VAL 118 -15.698 -2.060 -1.467 781 HB VAL 118 HB VAL 118 -14.209 -3.414 0.105 782 HG11 VAL 118 HG11 VAL 118 -12.764 -1.733 -0.116 783 HG12 VAL 118 HG12 VAL 118 -14.104 -0.783 -0.760 784 HG13 VAL 118 HG13 VAL 118 -13.702 -0.692 0.955 785 HG21 VAL 118 HG21 VAL 118 -16.091 -2.808 1.973 786 HG22 VAL 118 HG22 VAL 118 -14.440 -3.308 2.339 787 HG23 VAL 118 HG23 VAL 118 -14.857 -1.595 2.314 788 H THR 119 H THR 119 -17.402 -3.280 -2.349 789 HA THR 119 HA THR 119 -18.677 -5.401 -0.952 790 HB THR 119 HB THR 119 -19.753 -4.368 -2.878 791 HG1 THR 119 HG1 THR 119 -20.648 -6.232 -3.354 792 HG21 THR 119 HG21 THR 119 -18.191 -3.756 -4.439 793 HG22 THR 119 HG22 THR 119 -18.763 -5.257 -5.169 794 HG23 THR 119 HG23 THR 119 -17.259 -5.241 -4.249 795 H LYS 207 H LYS 207 9.128 -6.555 16.554 796 HA LYS 207 HA LYS 207 9.969 -7.224 14.004 797 HB2 LYS 207 HB2 LYS 207 9.359 -8.666 16.161 798 HB3 LYS 207 HB3 LYS 207 7.867 -8.915 15.264 799 HG2 LYS 207 HG2 LYS 207 10.510 -9.373 13.950 800 HG3 LYS 207 HG3 LYS 207 9.805 -10.601 15.003 801 HD2 LYS 207 HD2 LYS 207 7.892 -10.817 13.619 802 HD3 LYS 207 HD3 LYS 207 8.305 -9.365 12.703 803 HE2 LYS 207 HE2 LYS 207 9.953 -11.890 12.753 804 HE3 LYS 207 HE3 LYS 207 8.788 -11.481 11.495 805 HZ1 LYS 207 HZ1 LYS 207 10.095 -9.456 11.061 806 HZ2 LYS 207 HZ2 LYS 207 10.977 -10.872 10.780 807 HZ3 LYS 207 HZ3 LYS 207 11.250 -9.970 12.185 808 H SER 208 H SER 208 9.143 -6.647 12.113 809 HA SER 208 HA SER 208 6.565 -7.299 11.261 810 HB2 SER 208 HB2 SER 208 5.254 -5.506 11.658 811 HB3 SER 208 HB3 SER 208 6.452 -5.074 12.879 812 HG SER 208 HG SER 208 5.887 -3.428 11.237 813 H PHE 209 H PHE 209 6.177 -6.732 9.064 814 HA PHE 209 HA PHE 209 8.510 -6.581 7.488 815 HB2 PHE 209 HB2 PHE 209 6.585 -7.714 6.613 816 HB3 PHE 209 HB3 PHE 209 5.590 -6.271 6.780 817 HD1 PHE 209 HD2 PHE 209 8.608 -7.539 5.014 818 HD2 PHE 209 HD1 PHE 209 5.304 -4.858 4.975 819 HE1 PHE 209 HE2 PHE 209 9.162 -6.896 2.705 820 HE2 PHE 209 HE1 PHE 209 5.851 -4.211 2.666 821 HZ PHE 209 HZ PHE 209 7.784 -5.229 1.528 822 H PHE 210 H PHE 210 5.990 -4.196 8.223 823 HA PHE 210 HA PHE 210 6.977 -2.130 6.601 824 HB2 PHE 210 HB2 PHE 210 5.293 -2.100 9.103 825 HB3 PHE 210 HB3 PHE 210 5.689 -0.635 8.212 826 HD1 PHE 210 HD1 PHE 210 5.312 -1.049 5.519 827 HD2 PHE 210 HD2 PHE 210 3.188 -2.894 8.714 828 HE1 PHE 210 HE1 PHE 210 3.403 -1.445 4.017 829 HE2 PHE 210 HE2 PHE 210 1.277 -3.294 7.217 830 HZ PHE 210 HZ PHE 210 1.383 -2.570 4.866 831 H ASP 211 H ASP 211 8.000 -3.328 9.677 832 HA ASP 211 HA ASP 211 9.468 -0.988 10.450 833 HB2 ASP 211 HB2 ASP 211 8.585 -2.655 12.082 834 HB3 ASP 211 HB3 ASP 211 9.755 -3.822 11.471 835 H LYS 212 H LYS 212 10.289 -4.125 9.018 836 HA LYS 212 HA LYS 212 13.090 -3.514 8.845 837 HB2 LYS 212 HB2 LYS 212 13.335 -5.638 7.809 838 HB3 LYS 212 HB3 LYS 212 12.105 -5.835 9.051 839 HG2 LYS 212 HG2 LYS 212 10.356 -5.731 7.381 840 HG3 LYS 212 HG3 LYS 212 11.553 -5.436 6.118 841 HD2 LYS 212 HD2 LYS 212 12.576 -7.683 7.080 842 HD3 LYS 212 HD3 LYS 212 10.904 -7.941 7.582 843 HE2 LYS 212 HE2 LYS 212 10.323 -8.502 5.513 844 HE3 LYS 212 HE3 LYS 212 10.965 -6.986 4.882 845 HZ1 LYS 212 HZ1 LYS 212 12.180 -8.616 3.791 846 HZ2 LYS 212 HZ2 LYS 212 12.334 -9.586 5.168 847 HZ3 LYS 212 HZ3 LYS 212 13.217 -8.148 5.043 848 H LYS 213 H LYS 213 10.327 -2.851 6.949 849 HA LYS 213 HA LYS 213 11.799 -2.508 4.472 850 HB2 LYS 213 HB2 LYS 213 9.586 -3.324 4.193 851 HB3 LYS 213 HB3 LYS 213 8.919 -2.089 5.254 852 HG2 LYS 213 HG2 LYS 213 8.383 -1.589 2.957 853 HG3 LYS 213 HG3 LYS 213 9.493 -0.373 3.594 854 HD2 LYS 213 HD2 LYS 213 10.367 -0.852 1.489 855 HD3 LYS 213 HD3 LYS 213 11.346 -1.846 2.570 856 HE2 LYS 213 HE2 LYS 213 9.201 -3.473 1.954 857 HE3 LYS 213 HE3 LYS 213 9.525 -2.632 0.439 858 HZ1 LYS 213 HZ1 LYS 213 11.353 -4.355 2.001 859 HZ2 LYS 213 HZ2 LYS 213 11.929 -3.286 0.825 860 HZ3 LYS 213 HZ3 LYS 213 10.865 -4.529 0.390 861 H ARG 214 H ARG 214 10.133 -0.465 6.849 862 HA ARG 214 HA ARG 214 10.517 2.003 5.631 863 HB2 ARG 214 HB2 ARG 214 10.170 2.987 7.811 864 HB3 ARG 214 HB3 ARG 214 9.095 1.607 7.624 865 HG2 ARG 214 HG2 ARG 214 10.358 0.282 9.090 866 HG3 ARG 214 HG3 ARG 214 11.742 1.376 9.016 867 HD2 ARG 214 HD2 ARG 214 10.652 3.006 10.320 868 HD3 ARG 214 HD3 ARG 214 9.079 2.238 10.108 869 HE ARG 214 HE ARG 214 10.732 0.413 11.401 870 HH11 ARG 214 HH11 ARG 214 9.321 3.539 12.002 871 HH12 ARG 214 HH12 ARG 214 9.243 3.319 13.719 872 HH21 ARG 214 HH21 ARG 214 10.637 0.112 13.661 873 HH22 ARG 214 HH22 ARG 214 9.994 1.370 14.661 874 H SER 215 H SER 215 12.767 -0.042 7.291 875 HA SER 215 HA SER 215 14.732 1.989 7.773 876 HB2 SER 215 HB2 SER 215 14.641 -0.031 9.164 877 HB3 SER 215 HB3 SER 215 14.999 -1.028 7.754 878 HG SER 215 HG SER 215 16.728 1.058 8.531 879 H GLU 216 H GLU 216 13.909 -0.105 5.141 880 HA GLU 216 HA GLU 216 16.384 -0.090 3.779 881 HB2 GLU 216 HB2 GLU 216 13.587 -0.366 2.663 882 HB3 GLU 216 HB3 GLU 216 15.070 -0.756 1.803 883 HG2 GLU 216 HG2 GLU 216 14.439 -2.075 4.408 884 HG3 GLU 216 HG3 GLU 216 13.711 -2.648 2.910 885 H ARG 217 H ARG 217 13.435 1.838 3.217 886 HA ARG 217 HA ARG 217 14.435 3.485 1.219 887 HB2 ARG 217 HB2 ARG 217 12.694 5.135 2.027 888 HB3 ARG 217 HB3 ARG 217 12.100 3.524 1.644 889 HG2 ARG 217 HG2 ARG 217 11.692 3.002 3.847 890 HG3 ARG 217 HG3 ARG 217 12.862 4.176 4.452 891 HD2 ARG 217 HD2 ARG 217 10.428 4.756 4.798 892 HD3 ARG 217 HD3 ARG 217 11.412 5.990 4.014 893 HE ARG 217 HE ARG 217 10.083 5.797 2.172 894 HH11 ARG 217 HH11 ARG 217 9.728 2.923 4.104 895 HH12 ARG 217 HH12 ARG 217 8.467 2.260 3.118 896 HH21 ARG 217 HH21 ARG 217 8.424 4.934 0.867 897 HH22 ARG 217 HH22 ARG 217 7.727 3.403 1.277 898 H ILE 218 H ILE 218 14.840 3.659 4.691 899 HA ILE 218 HA ILE 218 15.906 6.300 4.756 900 HB ILE 218 HB ILE 218 16.226 4.054 6.751 901 HG12 ILE 218 HG12 ILE 218 14.384 6.418 6.997 902 HG13 ILE 218 HG13 ILE 218 13.875 4.960 6.154 903 HG21 ILE 218 HG21 ILE 218 17.033 6.923 6.769 904 HG22 ILE 218 HG22 ILE 218 16.538 6.155 8.276 905 HG23 ILE 218 HG23 ILE 218 17.899 5.507 7.362 906 HD11 ILE 218 HD11 ILE 218 14.811 3.909 8.459 907 HD12 ILE 218 HD12 ILE 218 14.205 5.468 9.019 908 HD13 ILE 218 HD13 ILE 218 13.130 4.356 8.173 909 H SER 219 H SER 219 17.218 3.175 4.062 910 HA SER 219 HA SER 219 19.968 4.108 4.351 911 HB2 SER 219 HB2 SER 219 19.223 1.801 5.102 912 HB3 SER 219 HB3 SER 219 19.049 1.393 3.395 913 HG SER 219 HG SER 219 21.101 0.986 3.448 914 H ASN 220 H ASN 220 21.324 2.876 2.397 915 HA ASN 220 HA ASN 220 20.256 4.101 -0.061 916 HB2 ASN 220 HB2 ASN 220 23.095 3.783 0.916 917 HB3 ASN 220 HB3 ASN 220 22.705 4.206 -0.749 918 HD21 ASN 220 HD21 ASN 220 22.921 6.279 -1.111 919 HD22 ASN 220 HD22 ASN 220 22.543 7.556 -0.011 Start of MODEL 18 1 H ALA 23 H ALA 23 4.899 14.226 11.894 2 HA ALA 23 HA ALA 23 2.997 12.969 13.765 3 HB1 ALA 23 HB1 ALA 23 3.742 15.813 13.318 4 HB2 ALA 23 HB2 ALA 23 2.079 15.442 13.773 5 HB3 ALA 23 HB3 ALA 23 3.410 14.952 14.821 6 H ALA 24 H ALA 24 3.403 12.651 10.790 7 HA ALA 24 HA ALA 24 0.676 13.403 9.961 8 HB1 ALA 24 HB1 ALA 24 3.262 13.536 8.500 9 HB2 ALA 24 HB2 ALA 24 1.799 13.161 7.588 10 HB3 ALA 24 HB3 ALA 24 1.906 14.664 8.505 11 HA PRO 25 HA PRO 25 -0.229 9.186 9.151 12 HB2 PRO 25 HB2 PRO 25 -1.726 9.339 6.891 13 HB3 PRO 25 HB3 PRO 25 -2.316 9.866 8.472 14 HG2 PRO 25 HG2 PRO 25 -1.196 11.500 6.227 15 HG3 PRO 25 HG3 PRO 25 -2.601 11.829 7.258 16 HD2 PRO 25 HD2 PRO 25 -0.195 13.002 7.659 17 HD3 PRO 25 HD3 PRO 25 -1.304 12.619 8.991 18 H ASN 26 H ASN 26 1.862 8.383 8.692 19 HA ASN 26 HA ASN 26 2.407 8.036 5.817 20 HB2 ASN 26 HB2 ASN 26 4.591 8.008 7.879 21 HB3 ASN 26 HB3 ASN 26 4.712 8.290 6.145 22 HD21 ASN 26 HD21 ASN 26 2.761 10.184 5.778 23 HD22 ASN 26 HD22 ASN 26 3.208 11.637 6.602 24 H LEU 27 H LEU 27 2.848 6.006 5.111 25 HA LEU 27 HA LEU 27 2.589 3.854 7.089 26 HB2 LEU 27 HB2 LEU 27 1.143 4.187 4.903 27 HB3 LEU 27 HB3 LEU 27 2.504 3.350 4.159 28 HG LEU 27 HG LEU 27 2.091 1.567 6.000 29 HD11 LEU 27 HD11 LEU 27 -0.156 1.402 6.803 30 HD12 LEU 27 HD12 LEU 27 -0.645 2.823 5.882 31 HD13 LEU 27 HD13 LEU 27 0.469 2.993 7.238 32 HD21 LEU 27 HD21 LEU 27 1.193 0.335 4.358 33 HD22 LEU 27 HD22 LEU 27 1.401 1.782 3.371 34 HD23 LEU 27 HD23 LEU 27 -0.157 1.446 4.128 35 H ALA 28 H ALA 28 4.431 2.985 7.756 36 HA ALA 28 HA ALA 28 6.565 2.192 7.805 37 HB1 ALA 28 HB1 ALA 28 6.778 1.623 4.949 38 HB2 ALA 28 HB2 ALA 28 6.887 0.537 6.336 39 HB3 ALA 28 HB3 ALA 28 5.308 0.989 5.692 40 H GLY 29 H GLY 29 6.159 5.028 7.241 41 HA2 GLY 29 HA2 GLY 29 7.770 6.723 7.072 42 HA3 GLY 29 HA3 GLY 29 8.845 5.591 6.262 43 H ALA 30 H ALA 30 5.701 5.559 5.003 44 HA ALA 30 HA ALA 30 6.608 7.132 2.692 45 HB1 ALA 30 HB1 ALA 30 4.457 5.027 2.874 46 HB2 ALA 30 HB2 ALA 30 4.897 5.915 1.414 47 HB3 ALA 30 HB3 ALA 30 6.063 4.829 2.171 48 H VAL 31 H VAL 31 5.814 9.114 2.519 49 HA VAL 31 HA VAL 31 3.353 9.821 3.920 50 HB VAL 31 HB VAL 31 5.235 11.656 2.437 51 HG11 VAL 31 HG11 VAL 31 2.685 12.083 3.474 52 HG12 VAL 31 HG12 VAL 31 3.787 12.783 4.663 53 HG13 VAL 31 HG13 VAL 31 3.851 13.310 2.979 54 HG21 VAL 31 HG21 VAL 31 6.654 10.924 4.069 55 HG22 VAL 31 HG22 VAL 31 5.821 12.199 4.959 56 HG23 VAL 31 HG23 VAL 31 5.346 10.514 5.179 57 H GLU 32 H GLU 32 4.726 9.839 0.661 58 HA GLU 32 HA GLU 32 2.435 10.991 -0.578 59 HB2 GLU 32 HB2 GLU 32 4.565 9.292 -1.882 60 HB3 GLU 32 HB3 GLU 32 3.500 10.448 -2.671 61 HG2 GLU 32 HG2 GLU 32 4.591 12.286 -1.623 62 HG3 GLU 32 HG3 GLU 32 5.521 11.210 -0.580 63 H PHE 33 H PHE 33 0.795 10.019 -1.752 64 HA PHE 33 HA PHE 33 -0.219 7.600 -0.778 65 HB2 PHE 33 HB2 PHE 33 -1.783 9.113 -1.693 66 HB3 PHE 33 HB3 PHE 33 -0.883 9.262 -3.198 67 HD1 PHE 33 HD1 PHE 33 -2.933 6.928 -1.185 68 HD2 PHE 33 HD2 PHE 33 -1.345 7.870 -5.020 69 HE1 PHE 33 HE1 PHE 33 -4.343 5.181 -2.194 70 HE2 PHE 33 HE2 PHE 33 -2.754 6.126 -6.035 71 HZ PHE 33 HZ PHE 33 -4.255 4.780 -4.622 72 H SER 34 H SER 34 1.331 8.325 -3.898 73 HA SER 34 HA SER 34 1.194 5.826 -5.061 74 HB2 SER 34 HB2 SER 34 2.114 7.196 -6.606 75 HB3 SER 34 HB3 SER 34 2.878 8.212 -5.381 76 HG SER 34 HG SER 34 4.444 7.134 -6.611 77 H ASP 35 H ASP 35 3.469 7.030 -2.661 78 HA ASP 35 HA ASP 35 5.163 4.725 -2.745 79 HB2 ASP 35 HB2 ASP 35 4.925 7.128 -0.975 80 HB3 ASP 35 HB3 ASP 35 5.886 5.753 -0.436 81 H VAL 36 H VAL 36 2.301 5.653 -0.990 82 HA VAL 36 HA VAL 36 2.510 3.704 1.076 83 HB VAL 36 HB VAL 36 0.060 5.126 0.026 84 HG11 VAL 36 HG11 VAL 36 0.360 3.010 1.937 85 HG12 VAL 36 HG12 VAL 36 -0.226 4.468 2.741 86 HG13 VAL 36 HG13 VAL 36 -1.110 3.799 1.369 87 HG21 VAL 36 HG21 VAL 36 1.130 5.931 2.613 88 HG22 VAL 36 HG22 VAL 36 2.247 6.223 1.280 89 HG23 VAL 36 HG23 VAL 36 0.626 6.917 1.241 90 H LYS 37 H LYS 37 0.483 3.863 -1.855 91 HA LYS 37 HA LYS 37 -0.654 1.321 -1.617 92 HB2 LYS 37 HB2 LYS 37 -1.074 1.515 -4.073 93 HB3 LYS 37 HB3 LYS 37 -1.594 2.915 -3.144 94 HG2 LYS 37 HG2 LYS 37 0.211 4.220 -3.906 95 HG3 LYS 37 HG3 LYS 37 1.060 2.810 -4.544 96 HD2 LYS 37 HD2 LYS 37 -1.497 2.900 -5.764 97 HD3 LYS 37 HD3 LYS 37 -0.802 4.520 -5.859 98 HE2 LYS 37 HE2 LYS 37 1.263 3.528 -6.801 99 HE3 LYS 37 HE3 LYS 37 0.474 1.951 -6.794 100 HZ1 LYS 37 HZ1 LYS 37 -0.868 4.175 -8.152 101 HZ2 LYS 37 HZ2 LYS 37 -0.894 2.522 -8.509 102 HZ3 LYS 37 HZ3 LYS 37 0.459 3.454 -8.916 103 H THR 38 H THR 38 2.430 2.351 -2.905 104 HA THR 38 HA THR 38 3.092 -0.021 -4.289 105 HB THR 38 HB THR 38 4.887 2.075 -3.052 106 HG1 THR 38 HG1 THR 38 5.069 2.500 -5.455 107 HG21 THR 38 HG21 THR 38 5.545 -0.175 -4.956 108 HG22 THR 38 HG22 THR 38 6.148 0.028 -3.311 109 HG23 THR 38 HG23 THR 38 6.624 1.165 -4.573 110 H LEU 39 H LEU 39 3.587 1.021 -0.952 111 HA LEU 39 HA LEU 39 5.211 -1.183 -0.193 112 HB2 LEU 39 HB2 LEU 39 3.523 0.703 1.443 113 HB3 LEU 39 HB3 LEU 39 4.634 -0.483 2.127 114 HG LEU 39 HG LEU 39 5.627 1.602 0.218 115 HD11 LEU 39 HD11 LEU 39 4.823 1.960 3.063 116 HD12 LEU 39 HD12 LEU 39 4.691 3.075 1.704 117 HD13 LEU 39 HD13 LEU 39 6.257 2.792 2.462 118 HD21 LEU 39 HD21 LEU 39 7.620 0.766 0.736 119 HD22 LEU 39 HD22 LEU 39 6.783 -0.541 1.574 120 HD23 LEU 39 HD23 LEU 39 7.291 0.894 2.464 121 H LEU 40 H LEU 40 1.747 -0.576 -0.176 122 HA LEU 40 HA LEU 40 1.058 -2.899 1.325 123 HB2 LEU 40 HB2 LEU 40 -0.664 -1.341 -0.595 124 HB3 LEU 40 HB3 LEU 40 -1.216 -2.427 0.678 125 HG LEU 40 HG LEU 40 0.354 0.049 1.319 126 HD11 LEU 40 HD11 LEU 40 -2.546 0.232 1.620 127 HD12 LEU 40 HD12 LEU 40 -2.001 0.180 -0.055 128 HD13 LEU 40 HD13 LEU 40 -1.386 1.423 1.033 129 HD21 LEU 40 HD21 LEU 40 -1.414 -1.861 2.799 130 HD22 LEU 40 HD22 LEU 40 -1.164 -0.220 3.394 131 HD23 LEU 40 HD23 LEU 40 0.212 -1.306 3.197 132 H LYS 41 H LYS 41 1.081 -2.128 -2.140 133 HA LYS 41 HA LYS 41 0.014 -4.471 -3.146 134 HB2 LYS 41 HB2 LYS 41 0.924 -2.254 -4.296 135 HB3 LYS 41 HB3 LYS 41 2.340 -3.261 -4.567 136 HG2 LYS 41 HG2 LYS 41 0.551 -4.961 -5.472 137 HG3 LYS 41 HG3 LYS 41 -0.400 -3.491 -5.695 138 HD2 LYS 41 HD2 LYS 41 0.728 -3.792 -7.732 139 HD3 LYS 41 HD3 LYS 41 1.653 -2.549 -6.886 140 HE2 LYS 41 HE2 LYS 41 3.340 -4.104 -6.274 141 HE3 LYS 41 HE3 LYS 41 2.356 -5.474 -6.786 142 HZ1 LYS 41 HZ1 LYS 41 2.564 -4.768 -9.061 143 HZ2 LYS 41 HZ2 LYS 41 4.108 -4.914 -8.386 144 HZ3 LYS 41 HZ3 LYS 41 3.421 -3.383 -8.606 145 H GLU 42 H GLU 42 3.374 -3.771 -2.257 146 HA GLU 42 HA GLU 42 4.304 -6.380 -3.014 147 HB2 GLU 42 HB2 GLU 42 6.427 -5.678 -1.982 148 HB3 GLU 42 HB3 GLU 42 5.816 -4.477 -3.111 149 HG2 GLU 42 HG2 GLU 42 4.892 -3.221 -1.174 150 HG3 GLU 42 HG3 GLU 42 5.696 -4.372 -0.107 151 H TRP 43 H TRP 43 3.469 -4.760 0.014 152 HA TRP 43 HA TRP 43 4.289 -6.810 1.757 153 HB2 TRP 43 HB2 TRP 43 3.856 -4.616 2.636 154 HB3 TRP 43 HB3 TRP 43 2.192 -4.656 2.059 155 HD1 TRP 43 HD1 TRP 43 4.312 -6.903 4.434 156 HE1 TRP 43 HE1 TRP 43 2.859 -7.463 6.483 157 HE3 TRP 43 HE3 TRP 43 0.048 -4.411 3.110 158 HZ2 TRP 43 HZ2 TRP 43 0.250 -6.921 7.414 159 HZ3 TRP 43 HZ3 TRP 43 -1.881 -4.483 4.635 160 HH2 TRP 43 HH2 TRP 43 -1.781 -5.713 6.742 161 H ILE 44 H ILE 44 1.708 -6.663 -0.438 162 HA ILE 44 HA ILE 44 0.190 -8.726 0.994 163 HB ILE 44 HB ILE 44 -0.569 -7.103 -1.437 164 HG12 ILE 44 HG12 ILE 44 -1.920 -6.990 1.239 165 HG13 ILE 44 HG13 ILE 44 -0.453 -6.058 0.956 166 HG21 ILE 44 HG21 ILE 44 -2.018 -9.261 0.068 167 HG22 ILE 44 HG22 ILE 44 -2.858 -8.083 -0.937 168 HG23 ILE 44 HG23 ILE 44 -1.672 -9.170 -1.658 169 HD11 ILE 44 HD11 ILE 44 -1.531 -4.531 -0.253 170 HD12 ILE 44 HD12 ILE 44 -2.457 -5.744 -1.137 171 HD13 ILE 44 HD13 ILE 44 -2.995 -5.212 0.456 172 H THR 45 H THR 45 2.456 -8.347 -1.481 173 HA THR 45 HA THR 45 1.661 -10.854 -2.790 174 HB THR 45 HB THR 45 3.263 -10.250 -4.562 175 HG1 THR 45 HG1 THR 45 4.218 -8.157 -4.478 176 HG21 THR 45 HG21 THR 45 2.050 -7.952 -5.126 177 HG22 THR 45 HG22 THR 45 1.008 -8.469 -3.802 178 HG23 THR 45 HG23 THR 45 1.208 -9.498 -5.220 179 H THR 46 H THR 46 4.630 -9.223 -1.667 180 HA THR 46 HA THR 46 6.222 -11.560 -1.720 181 HB THR 46 HB THR 46 7.115 -9.216 -1.733 182 HG1 THR 46 HG1 THR 46 8.615 -10.779 -1.314 183 HG21 THR 46 HG21 THR 46 5.629 -9.009 0.643 184 HG22 THR 46 HG22 THR 46 6.695 -7.796 -0.067 185 HG23 THR 46 HG23 THR 46 7.324 -8.937 1.120 186 H ILE 47 H ILE 47 3.862 -10.450 0.476 187 HA ILE 47 HA ILE 47 4.695 -12.506 2.413 188 HB ILE 47 HB ILE 47 3.555 -9.781 3.029 189 HG12 ILE 47 HG12 ILE 47 5.877 -10.547 4.542 190 HG13 ILE 47 HG13 ILE 47 6.203 -10.751 2.824 191 HG21 ILE 47 HG21 ILE 47 3.764 -10.565 5.426 192 HG22 ILE 47 HG22 ILE 47 2.439 -11.256 4.493 193 HG23 ILE 47 HG23 ILE 47 3.900 -12.200 4.780 194 HD11 ILE 47 HD11 ILE 47 5.088 -8.333 2.752 195 HD12 ILE 47 HD12 ILE 47 5.741 -8.296 4.390 196 HD13 ILE 47 HD13 ILE 47 6.811 -8.592 3.020 197 H SER 48 H SER 48 3.200 -13.998 2.814 198 HA SER 48 HA SER 48 0.445 -13.475 1.928 199 HB2 SER 48 HB2 SER 48 0.453 -15.527 1.019 200 HB3 SER 48 HB3 SER 48 2.174 -15.616 1.392 201 HG SER 48 HG SER 48 1.653 -16.578 3.363 202 H ASP 49 H ASP 49 2.420 -14.289 4.651 203 HA ASP 49 HA ASP 49 0.009 -14.633 6.309 204 HB2 ASP 49 HB2 ASP 49 2.826 -15.651 6.694 205 HB3 ASP 49 HB3 ASP 49 1.604 -15.698 7.961 206 HA PRO 50 HA PRO 50 1.751 -10.518 7.465 207 HB2 PRO 50 HB2 PRO 50 -0.672 -9.342 7.794 208 HB3 PRO 50 HB3 PRO 50 0.136 -9.453 6.227 209 HG2 PRO 50 HG2 PRO 50 -2.045 -11.163 7.357 210 HG3 PRO 50 HG3 PRO 50 -1.875 -10.503 5.720 211 HD2 PRO 50 HD2 PRO 50 -1.251 -13.066 6.330 212 HD3 PRO 50 HD3 PRO 50 -0.394 -12.149 5.076 213 H MET 51 H MET 51 2.036 -9.757 9.512 214 HA MET 51 HA MET 51 0.861 -11.325 11.667 215 HB2 MET 51 HB2 MET 51 3.166 -9.405 11.492 216 HB3 MET 51 HB3 MET 51 2.513 -9.894 13.050 217 HG2 MET 51 HG2 MET 51 2.889 -12.279 12.316 218 HG3 MET 51 HG3 MET 51 3.805 -11.618 10.963 219 HE1 MET 51 HE1 MET 51 5.329 -9.081 12.343 220 HE2 MET 51 HE2 MET 51 6.841 -9.940 12.637 221 HE3 MET 51 HE3 MET 51 5.929 -10.239 11.156 222 H GLU 52 H GLU 52 0.253 -10.118 13.699 223 HA GLU 52 HA GLU 52 -1.869 -8.352 13.145 224 HB2 GLU 52 HB2 GLU 52 -1.563 -9.893 15.167 225 HB3 GLU 52 HB3 GLU 52 -0.538 -8.631 15.833 226 HG2 GLU 52 HG2 GLU 52 -2.882 -8.580 16.642 227 HG3 GLU 52 HG3 GLU 52 -2.344 -7.082 15.886 228 H GLU 53 H GLU 53 1.199 -7.722 14.859 229 HA GLU 53 HA GLU 53 0.942 -4.994 15.171 230 HB2 GLU 53 HB2 GLU 53 3.259 -6.850 14.954 231 HB3 GLU 53 HB3 GLU 53 3.584 -5.127 14.838 232 HG2 GLU 53 HG2 GLU 53 3.854 -5.527 17.085 233 HG3 GLU 53 HG3 GLU 53 2.187 -4.959 17.005 234 H ASP 54 H ASP 54 1.812 -6.812 12.320 235 HA ASP 54 HA ASP 54 2.769 -4.581 10.814 236 HB2 ASP 54 HB2 ASP 54 1.809 -7.311 9.936 237 HB3 ASP 54 HB3 ASP 54 2.565 -6.131 8.870 238 H ILE 55 H ILE 55 -0.331 -6.242 11.112 239 HA ILE 55 HA ILE 55 -1.622 -4.768 9.042 240 HB ILE 55 HB ILE 55 -2.825 -6.306 11.348 241 HG12 ILE 55 HG12 ILE 55 -2.794 -7.271 8.521 242 HG13 ILE 55 HG13 ILE 55 -1.318 -7.411 9.469 243 HG21 ILE 55 HG21 ILE 55 -4.070 -5.202 8.836 244 HG22 ILE 55 HG22 ILE 55 -4.855 -6.359 9.911 245 HG23 ILE 55 HG23 ILE 55 -4.440 -4.748 10.499 246 HD11 ILE 55 HD11 ILE 55 -3.948 -8.757 9.855 247 HD12 ILE 55 HD12 ILE 55 -2.326 -9.445 9.817 248 HD13 ILE 55 HD13 ILE 55 -2.861 -8.529 11.225 249 H LEU 56 H LEU 56 -1.460 -4.457 12.565 250 HA LEU 56 HA LEU 56 -3.334 -2.473 12.979 251 HB2 LEU 56 HB2 LEU 56 -0.865 -3.349 14.340 252 HB3 LEU 56 HB3 LEU 56 -1.448 -1.737 14.752 253 HG LEU 56 HG LEU 56 -2.209 -3.468 16.329 254 HD11 LEU 56 HD11 LEU 56 -3.683 -1.430 15.170 255 HD12 LEU 56 HD12 LEU 56 -4.043 -2.263 16.682 256 HD13 LEU 56 HD13 LEU 56 -4.781 -2.811 15.177 257 HD21 LEU 56 HD21 LEU 56 -3.945 -5.062 15.576 258 HD22 LEU 56 HD22 LEU 56 -2.366 -5.367 14.854 259 HD23 LEU 56 HD23 LEU 56 -3.630 -4.576 13.911 260 H GLN 57 H GLN 57 -0.012 -2.176 11.836 261 HA GLN 57 HA GLN 57 0.323 0.568 11.993 262 HB2 GLN 57 HB2 GLN 57 1.511 -1.626 10.455 263 HB3 GLN 57 HB3 GLN 57 1.595 -0.069 9.640 264 HG2 GLN 57 HG2 GLN 57 2.423 -0.277 12.495 265 HG3 GLN 57 HG3 GLN 57 3.509 -0.841 11.227 266 HE21 GLN 57 HE21 GLN 57 3.228 0.922 9.255 267 HE22 GLN 57 HE22 GLN 57 3.668 2.512 9.766 268 H VAL 58 H VAL 58 -1.519 -1.330 9.712 269 HA VAL 58 HA VAL 58 -1.898 0.764 7.806 270 HB VAL 58 HB VAL 58 -3.690 -1.632 8.180 271 HG11 VAL 58 HG11 VAL 58 -4.709 -0.862 6.366 272 HG12 VAL 58 HG12 VAL 58 -3.614 0.522 6.327 273 HG13 VAL 58 HG13 VAL 58 -3.194 -0.962 5.471 274 HG21 VAL 58 HG21 VAL 58 -1.832 -2.862 7.893 275 HG22 VAL 58 HG22 VAL 58 -1.967 -2.361 6.207 276 HG23 VAL 58 HG23 VAL 58 -0.893 -1.491 7.302 277 H VAL 59 H VAL 59 -3.636 -0.374 10.636 278 HA VAL 59 HA VAL 59 -6.022 1.092 10.197 279 HB VAL 59 HB VAL 59 -4.834 0.062 12.776 280 HG11 VAL 59 HG11 VAL 59 -7.154 0.264 13.643 281 HG12 VAL 59 HG12 VAL 59 -6.400 1.817 13.279 282 HG13 VAL 59 HG13 VAL 59 -7.588 1.132 12.170 283 HG21 VAL 59 HG21 VAL 59 -7.188 -1.291 11.807 284 HG22 VAL 59 HG22 VAL 59 -5.905 -1.317 10.598 285 HG23 VAL 59 HG23 VAL 59 -5.605 -1.950 12.216 286 H ARG 60 H ARG 60 -3.207 1.726 12.289 287 HA ARG 60 HA ARG 60 -4.049 4.202 13.269 288 HB2 ARG 60 HB2 ARG 60 -1.216 3.272 12.766 289 HB3 ARG 60 HB3 ARG 60 -1.693 4.597 13.820 290 HG2 ARG 60 HG2 ARG 60 -2.843 1.902 14.319 291 HG3 ARG 60 HG3 ARG 60 -1.167 2.211 14.775 292 HD2 ARG 60 HD2 ARG 60 -3.503 3.920 15.617 293 HD3 ARG 60 HD3 ARG 60 -2.819 2.623 16.597 294 HE ARG 60 HE ARG 60 -0.746 4.351 15.894 295 HH11 ARG 60 HH11 ARG 60 -3.660 4.374 17.799 296 HH12 ARG 60 HH12 ARG 60 -3.074 5.559 18.919 297 HH21 ARG 60 HH21 ARG 60 0.037 5.912 17.363 298 HH22 ARG 60 HH22 ARG 60 -0.971 6.433 18.670 299 H TYR 61 H TYR 61 -2.719 3.314 10.200 300 HA TYR 61 HA TYR 61 -1.885 5.945 9.437 301 HB2 TYR 61 HB2 TYR 61 -0.807 4.101 8.363 302 HB3 TYR 61 HB3 TYR 61 -2.347 3.407 7.869 303 HD1 TYR 61 HD2 TYR 61 0.028 6.166 7.256 304 HD2 TYR 61 HD1 TYR 61 -3.437 4.121 5.874 305 HE1 TYR 61 HE2 TYR 61 0.190 7.356 5.111 306 HE2 TYR 61 HE1 TYR 61 -3.285 5.306 3.724 307 HH TYR 61 HH TYR 61 -1.214 6.446 2.393 308 H CYS 62 H CYS 62 -4.638 3.874 8.532 309 HA CYS 62 HA CYS 62 -5.923 5.844 6.956 310 HB2 CYS 62 HB2 CYS 62 -6.813 3.256 8.197 311 HB3 CYS 62 HB3 CYS 62 -7.967 4.303 7.379 312 HG CYS 62 HG CYS 62 -6.312 4.273 4.979 313 H THR 63 H THR 63 -6.404 4.759 10.299 314 HA THR 63 HA THR 63 -8.614 6.288 10.963 315 HB THR 63 HB THR 63 -7.736 6.231 13.318 316 HG1 THR 63 HG1 THR 63 -5.480 5.345 11.922 317 HG21 THR 63 HG21 THR 63 -8.634 4.135 11.676 318 HG22 THR 63 HG22 THR 63 -8.710 4.230 13.435 319 HG23 THR 63 HG23 THR 63 -7.328 3.465 12.652 320 H ASP 64 H ASP 64 -5.303 7.254 10.530 321 HA ASP 64 HA ASP 64 -5.524 9.766 11.880 322 HB2 ASP 64 HB2 ASP 64 -3.505 8.514 10.049 323 HB3 ASP 64 HB3 ASP 64 -3.399 10.232 10.428 324 H LEU 65 H LEU 65 -5.899 8.669 8.555 325 HA LEU 65 HA LEU 65 -5.960 11.100 7.228 326 HB2 LEU 65 HB2 LEU 65 -6.832 8.389 6.725 327 HB3 LEU 65 HB3 LEU 65 -7.933 9.564 6.007 328 HG LEU 65 HG LEU 65 -6.235 10.451 4.622 329 HD11 LEU 65 HD11 LEU 65 -4.445 9.248 6.617 330 HD12 LEU 65 HD12 LEU 65 -4.258 10.714 5.656 331 HD13 LEU 65 HD13 LEU 65 -3.893 9.142 4.945 332 HD21 LEU 65 HD21 LEU 65 -6.727 8.673 3.356 333 HD22 LEU 65 HD22 LEU 65 -6.633 7.559 4.720 334 HD23 LEU 65 HD23 LEU 65 -5.163 8.047 3.877 335 H ILE 66 H ILE 66 -8.495 9.481 9.062 336 HA ILE 66 HA ILE 66 -10.653 11.108 8.334 337 HB ILE 66 HB ILE 66 -10.092 9.545 10.844 338 HG12 ILE 66 HG12 ILE 66 -12.396 8.925 9.115 339 HG13 ILE 66 HG13 ILE 66 -10.825 8.721 8.347 340 HG21 ILE 66 HG21 ILE 66 -12.362 11.375 10.215 341 HG22 ILE 66 HG22 ILE 66 -12.656 9.916 11.161 342 HG23 ILE 66 HG23 ILE 66 -11.508 11.125 11.737 343 HD11 ILE 66 HD11 ILE 66 -10.147 7.240 10.181 344 HD12 ILE 66 HD12 ILE 66 -11.753 7.411 10.890 345 HD13 ILE 66 HD13 ILE 66 -11.562 6.643 9.315 346 H GLU 67 H GLU 67 -8.381 11.403 11.055 347 HA GLU 67 HA GLU 67 -9.532 13.835 12.012 348 HB2 GLU 67 HB2 GLU 67 -6.745 12.839 12.591 349 HB3 GLU 67 HB3 GLU 67 -7.749 13.880 13.591 350 HG2 GLU 67 HG2 GLU 67 -9.341 11.938 13.802 351 HG3 GLU 67 HG3 GLU 67 -8.088 10.946 13.059 352 H GLU 68 H GLU 68 -6.943 13.008 9.803 353 HA GLU 68 HA GLU 68 -5.987 15.733 9.624 354 HB2 GLU 68 HB2 GLU 68 -5.273 13.202 8.147 355 HB3 GLU 68 HB3 GLU 68 -4.558 14.763 7.768 356 HG2 GLU 68 HG2 GLU 68 -4.396 13.355 10.423 357 HG3 GLU 68 HG3 GLU 68 -3.118 13.429 9.213 358 H LYS 69 H LYS 69 -8.638 14.189 8.464 359 HA LYS 69 HA LYS 69 -10.139 14.585 6.800 360 HB2 LYS 69 HB2 LYS 69 -8.724 17.237 6.499 361 HB3 LYS 69 HB3 LYS 69 -10.378 16.859 6.039 362 HG2 LYS 69 HG2 LYS 69 -9.434 16.678 8.880 363 HG3 LYS 69 HG3 LYS 69 -10.038 18.181 8.179 364 HD2 LYS 69 HD2 LYS 69 -11.710 15.769 7.797 365 HD3 LYS 69 HD3 LYS 69 -11.611 16.411 9.439 366 HE2 LYS 69 HE2 LYS 69 -13.106 17.959 8.894 367 HE3 LYS 69 HE3 LYS 69 -11.971 18.614 7.716 368 HZ1 LYS 69 HZ1 LYS 69 -13.384 17.997 6.146 369 HZ2 LYS 69 HZ2 LYS 69 -14.389 17.223 7.265 370 HZ3 LYS 69 HZ3 LYS 69 -13.109 16.377 6.551 371 H ASP 70 H ASP 70 -7.939 13.099 6.024 372 HA ASP 70 HA ASP 70 -7.421 14.070 3.290 373 HB2 ASP 70 HB2 ASP 70 -5.745 12.511 5.218 374 HB3 ASP 70 HB3 ASP 70 -5.514 12.264 3.489 375 H LEU 71 H LEU 71 -9.804 12.681 4.092 376 HA LEU 71 HA LEU 71 -9.783 9.943 3.602 377 HB2 LEU 71 HB2 LEU 71 -12.004 11.783 2.757 378 HB3 LEU 71 HB3 LEU 71 -12.121 10.099 3.262 379 HG LEU 71 HG LEU 71 -11.502 12.467 5.026 380 HD11 LEU 71 HD11 LEU 71 -13.755 10.882 5.800 381 HD12 LEU 71 HD12 LEU 71 -13.940 11.404 4.127 382 HD13 LEU 71 HD13 LEU 71 -13.682 12.597 5.398 383 HD21 LEU 71 HD21 LEU 71 -10.287 10.771 6.021 384 HD22 LEU 71 HD22 LEU 71 -11.411 9.516 5.502 385 HD23 LEU 71 HD23 LEU 71 -11.856 10.613 6.810 386 H GLU 72 H GLU 72 -9.271 12.547 1.450 387 HA GLU 72 HA GLU 72 -10.218 11.654 -0.974 388 HB2 GLU 72 HB2 GLU 72 -9.036 13.827 -0.528 389 HB3 GLU 72 HB3 GLU 72 -7.516 12.943 -0.566 390 HG2 GLU 72 HG2 GLU 72 -7.979 14.063 -2.683 391 HG3 GLU 72 HG3 GLU 72 -7.903 12.313 -2.869 392 H LYS 73 H LYS 73 -7.001 10.962 0.400 393 HA LYS 73 HA LYS 73 -6.429 9.003 -1.626 394 HB2 LYS 73 HB2 LYS 73 -4.337 8.668 -0.449 395 HB3 LYS 73 HB3 LYS 73 -4.659 10.391 -0.596 396 HG2 LYS 73 HG2 LYS 73 -5.763 9.953 1.799 397 HG3 LYS 73 HG3 LYS 73 -4.543 8.677 1.806 398 HD2 LYS 73 HD2 LYS 73 -3.253 10.961 0.816 399 HD3 LYS 73 HD3 LYS 73 -4.224 11.514 2.183 400 HE2 LYS 73 HE2 LYS 73 -2.975 10.391 3.687 401 HE3 LYS 73 HE3 LYS 73 -2.747 9.007 2.620 402 HZ1 LYS 73 HZ1 LYS 73 -0.759 10.553 3.225 403 HZ2 LYS 73 HZ2 LYS 73 -1.379 11.527 1.989 404 HZ3 LYS 73 HZ3 LYS 73 -0.909 9.936 1.657 405 H LEU 74 H LEU 74 -7.911 9.010 1.479 406 HA LEU 74 HA LEU 74 -7.413 6.451 2.414 407 HB2 LEU 74 HB2 LEU 74 -8.647 8.227 3.623 408 HB3 LEU 74 HB3 LEU 74 -10.030 7.938 2.570 409 HG LEU 74 HG LEU 74 -10.179 5.635 3.472 410 HD11 LEU 74 HD11 LEU 74 -7.768 5.516 4.140 411 HD12 LEU 74 HD12 LEU 74 -8.907 4.954 5.363 412 HD13 LEU 74 HD13 LEU 74 -8.165 6.547 5.515 413 HD21 LEU 74 HD21 LEU 74 -11.487 7.546 4.390 414 HD22 LEU 74 HD22 LEU 74 -10.246 7.738 5.629 415 HD23 LEU 74 HD23 LEU 74 -11.192 6.251 5.552 416 H ASP 75 H ASP 75 -10.111 7.502 0.334 417 HA ASP 75 HA ASP 75 -11.194 4.945 -0.076 418 HB2 ASP 75 HB2 ASP 75 -11.561 7.622 -1.175 419 HB3 ASP 75 HB3 ASP 75 -11.798 6.361 -2.382 420 H LEU 76 H LEU 76 -8.496 6.572 -1.527 421 HA LEU 76 HA LEU 76 -8.322 4.864 -3.824 422 HB2 LEU 76 HB2 LEU 76 -6.212 6.641 -2.609 423 HB3 LEU 76 HB3 LEU 76 -6.192 5.947 -4.228 424 HG LEU 76 HG LEU 76 -8.234 7.950 -3.272 425 HD11 LEU 76 HD11 LEU 76 -6.485 8.999 -5.248 426 HD12 LEU 76 HD12 LEU 76 -5.508 8.361 -3.925 427 HD13 LEU 76 HD13 LEU 76 -6.755 9.565 -3.600 428 HD21 LEU 76 HD21 LEU 76 -9.169 7.839 -5.319 429 HD22 LEU 76 HD22 LEU 76 -8.446 6.230 -5.341 430 HD23 LEU 76 HD23 LEU 76 -7.625 7.578 -6.129 431 H VAL 77 H VAL 77 -6.700 5.053 -0.684 432 HA VAL 77 HA VAL 77 -4.908 2.897 -1.181 433 HB VAL 77 HB VAL 77 -5.833 4.053 1.453 434 HG11 VAL 77 HG11 VAL 77 -4.156 1.789 0.815 435 HG12 VAL 77 HG12 VAL 77 -3.270 3.009 1.731 436 HG13 VAL 77 HG13 VAL 77 -4.766 2.333 2.376 437 HG21 VAL 77 HG21 VAL 77 -3.221 4.591 0.075 438 HG22 VAL 77 HG22 VAL 77 -4.654 5.569 -0.242 439 HG23 VAL 77 HG23 VAL 77 -3.984 5.489 1.386 440 H ILE 78 H ILE 78 -8.042 3.160 0.444 441 HA ILE 78 HA ILE 78 -8.169 0.518 1.401 442 HB ILE 78 HB ILE 78 -10.360 2.468 0.700 443 HG12 ILE 78 HG12 ILE 78 -8.929 3.116 2.581 444 HG13 ILE 78 HG13 ILE 78 -10.543 2.698 3.143 445 HG21 ILE 78 HG21 ILE 78 -10.505 -0.365 1.402 446 HG22 ILE 78 HG22 ILE 78 -11.479 0.678 2.438 447 HG23 ILE 78 HG23 ILE 78 -11.724 0.693 0.691 448 HD11 ILE 78 HD11 ILE 78 -9.662 1.258 4.563 449 HD12 ILE 78 HD12 ILE 78 -8.965 0.351 3.220 450 HD13 ILE 78 HD13 ILE 78 -8.048 1.654 3.974 451 H LYS 79 H LYS 79 -9.635 1.967 -1.509 452 HA LYS 79 HA LYS 79 -10.662 -0.443 -2.540 453 HB2 LYS 79 HB2 LYS 79 -11.133 0.761 -4.519 454 HB3 LYS 79 HB3 LYS 79 -11.289 1.927 -3.211 455 HG2 LYS 79 HG2 LYS 79 -10.013 3.221 -4.512 456 HG3 LYS 79 HG3 LYS 79 -8.681 2.245 -3.887 457 HD2 LYS 79 HD2 LYS 79 -8.278 2.019 -6.119 458 HD3 LYS 79 HD3 LYS 79 -9.397 0.670 -5.903 459 HE2 LYS 79 HE2 LYS 79 -11.210 2.475 -6.436 460 HE3 LYS 79 HE3 LYS 79 -9.855 3.343 -7.158 461 HZ1 LYS 79 HZ1 LYS 79 -10.766 0.610 -7.878 462 HZ2 LYS 79 HZ2 LYS 79 -9.416 1.385 -8.537 463 HZ3 LYS 79 HZ3 LYS 79 -10.965 2.008 -8.810 464 H TYR 80 H TYR 80 -7.497 0.950 -2.598 465 HA TYR 80 HA TYR 80 -6.540 -0.638 -4.801 466 HB2 TYR 80 HB2 TYR 80 -5.540 1.542 -4.352 467 HB3 TYR 80 HB3 TYR 80 -5.049 1.011 -2.748 468 HD1 TYR 80 HD1 TYR 80 -3.278 -0.728 -2.518 469 HD2 TYR 80 HD2 TYR 80 -4.241 1.022 -6.274 470 HE1 TYR 80 HE1 TYR 80 -1.139 -1.531 -3.433 471 HE2 TYR 80 HE2 TYR 80 -2.107 0.225 -7.201 472 HH TYR 80 HH TYR 80 -0.384 -1.267 -6.836 473 H MET 81 H MET 81 -6.244 -0.706 -1.270 474 HA MET 81 HA MET 81 -4.587 -3.038 -1.241 475 HB2 MET 81 HB2 MET 81 -4.711 -2.922 1.114 476 HB3 MET 81 HB3 MET 81 -4.731 -1.250 0.566 477 HG2 MET 81 HG2 MET 81 -7.079 -1.078 0.939 478 HG3 MET 81 HG3 MET 81 -7.207 -2.806 1.257 479 HE1 MET 81 HE1 MET 81 -6.371 0.583 3.975 480 HE2 MET 81 HE2 MET 81 -4.866 0.274 3.110 481 HE3 MET 81 HE3 MET 81 -6.356 0.567 2.211 482 H LYS 82 H LYS 82 -8.024 -2.414 -1.104 483 HA LYS 82 HA LYS 82 -8.795 -5.011 -0.229 484 HB2 LYS 82 HB2 LYS 82 -10.990 -4.306 -0.520 485 HB3 LYS 82 HB3 LYS 82 -10.146 -2.794 -0.213 486 HG2 LYS 82 HG2 LYS 82 -11.356 -2.148 -2.009 487 HG3 LYS 82 HG3 LYS 82 -9.963 -2.812 -2.865 488 HD2 LYS 82 HD2 LYS 82 -11.697 -3.831 -3.983 489 HD3 LYS 82 HD3 LYS 82 -11.336 -5.039 -2.748 490 HE2 LYS 82 HE2 LYS 82 -13.261 -4.637 -1.597 491 HE3 LYS 82 HE3 LYS 82 -13.312 -2.937 -2.063 492 HZ1 LYS 82 HZ1 LYS 82 -15.069 -4.394 -3.063 493 HZ2 LYS 82 HZ2 LYS 82 -13.852 -5.142 -3.969 494 HZ3 LYS 82 HZ3 LYS 82 -14.168 -3.492 -4.174 495 H ARG 83 H ARG 83 -8.148 -3.561 -3.344 496 HA ARG 83 HA ARG 83 -9.316 -5.630 -4.913 497 HB2 ARG 83 HB2 ARG 83 -8.685 -4.394 -6.710 498 HB3 ARG 83 HB3 ARG 83 -8.478 -3.146 -5.488 499 HG2 ARG 83 HG2 ARG 83 -6.060 -3.963 -5.328 500 HG3 ARG 83 HG3 ARG 83 -6.386 -4.805 -6.843 501 HD2 ARG 83 HD2 ARG 83 -7.107 -1.927 -6.641 502 HD3 ARG 83 HD3 ARG 83 -5.403 -2.351 -6.798 503 HE ARG 83 HE ARG 83 -6.807 -3.753 -8.753 504 HH11 ARG 83 HH11 ARG 83 -6.050 -0.457 -7.928 505 HH12 ARG 83 HH12 ARG 83 -6.097 0.102 -9.567 506 HH21 ARG 83 HH21 ARG 83 -6.872 -3.029 -10.915 507 HH22 ARG 83 HH22 ARG 83 -6.566 -1.363 -11.266 508 H LEU 84 H LEU 84 -6.208 -5.154 -3.412 509 HA LEU 84 HA LEU 84 -4.931 -7.288 -4.880 510 HB2 LEU 84 HB2 LEU 84 -3.997 -5.829 -2.414 511 HB3 LEU 84 HB3 LEU 84 -3.017 -6.863 -3.452 512 HG LEU 84 HG LEU 84 -4.314 -4.370 -4.510 513 HD11 LEU 84 HD11 LEU 84 -1.793 -3.567 -4.117 514 HD12 LEU 84 HD12 LEU 84 -1.981 -4.619 -2.714 515 HD13 LEU 84 HD13 LEU 84 -3.091 -3.270 -2.960 516 HD21 LEU 84 HD21 LEU 84 -1.734 -5.030 -5.558 517 HD22 LEU 84 HD22 LEU 84 -3.287 -4.942 -6.391 518 HD23 LEU 84 HD23 LEU 84 -2.780 -6.449 -5.625 519 H MET 85 H MET 85 -5.856 -6.763 -1.475 520 HA MET 85 HA MET 85 -5.221 -9.301 -0.526 521 HB2 MET 85 HB2 MET 85 -7.341 -7.348 0.370 522 HB3 MET 85 HB3 MET 85 -6.939 -8.812 1.257 523 HG2 MET 85 HG2 MET 85 -4.581 -7.972 1.385 524 HG3 MET 85 HG3 MET 85 -5.165 -6.448 0.721 525 HE1 MET 85 HE1 MET 85 -4.977 -4.717 2.210 526 HE2 MET 85 HE2 MET 85 -5.296 -4.697 3.945 527 HE3 MET 85 HE3 MET 85 -3.890 -5.559 3.317 528 H GLN 86 H GLN 86 -7.986 -8.188 -2.334 529 HA GLN 86 HA GLN 86 -9.578 -10.527 -1.835 530 HB2 GLN 86 HB2 GLN 86 -9.825 -8.146 -3.641 531 HB3 GLN 86 HB3 GLN 86 -10.879 -9.536 -3.864 532 HG2 GLN 86 HG2 GLN 86 -11.627 -9.308 -1.530 533 HG3 GLN 86 HG3 GLN 86 -10.621 -7.870 -1.372 534 HE21 GLN 86 HE21 GLN 86 -12.987 -7.257 -0.764 535 HE22 GLN 86 HE22 GLN 86 -13.893 -6.526 -2.041 536 H GLN 87 H GLN 87 -7.960 -9.244 -4.745 537 HA GLN 87 HA GLN 87 -8.366 -11.535 -6.321 538 HB2 GLN 87 HB2 GLN 87 -6.898 -10.555 -7.892 539 HB3 GLN 87 HB3 GLN 87 -7.695 -9.206 -7.094 540 HG2 GLN 87 HG2 GLN 87 -5.712 -8.961 -5.632 541 HG3 GLN 87 HG3 GLN 87 -4.915 -10.226 -6.568 542 HE21 GLN 87 HE21 GLN 87 -6.921 -7.447 -7.478 543 HE22 GLN 87 HE22 GLN 87 -5.767 -6.748 -8.556 544 H SER 88 H SER 88 -6.226 -10.944 -3.737 545 HA SER 88 HA SER 88 -3.981 -12.427 -4.339 546 HB2 SER 88 HB2 SER 88 -4.941 -11.180 -2.090 547 HB3 SER 88 HB3 SER 88 -4.969 -12.876 -1.608 548 HG SER 88 HG SER 88 -2.721 -11.571 -2.747 549 H VAL 89 H VAL 89 -3.394 -14.599 -3.392 550 HA VAL 89 HA VAL 89 -5.394 -16.533 -4.251 551 HB VAL 89 HB VAL 89 -3.683 -18.106 -4.434 552 HG11 VAL 89 HG11 VAL 89 -1.958 -15.730 -4.914 553 HG12 VAL 89 HG12 VAL 89 -2.244 -17.143 -5.931 554 HG13 VAL 89 HG13 VAL 89 -3.465 -15.875 -5.819 555 HG21 VAL 89 HG21 VAL 89 -2.733 -18.048 -2.260 556 HG22 VAL 89 HG22 VAL 89 -1.416 -17.739 -3.392 557 HG23 VAL 89 HG23 VAL 89 -2.137 -16.405 -2.490 558 H GLU 90 H GLU 90 -3.929 -15.353 -1.341 559 HA GLU 90 HA GLU 90 -4.936 -17.594 0.233 560 HB2 GLU 90 HB2 GLU 90 -3.524 -15.156 1.297 561 HB3 GLU 90 HB3 GLU 90 -3.668 -16.741 2.044 562 HG2 GLU 90 HG2 GLU 90 -2.158 -16.232 -0.504 563 HG3 GLU 90 HG3 GLU 90 -1.420 -16.209 1.097 564 H SER 91 H SER 91 -6.787 -17.542 1.329 565 HA SER 91 HA SER 91 -8.555 -15.320 1.083 566 HB2 SER 91 HB2 SER 91 -8.846 -17.738 2.880 567 HB3 SER 91 HB3 SER 91 -10.135 -16.666 2.336 568 HG SER 91 HG SER 91 -9.991 -17.488 0.324 569 H VAL 92 H VAL 92 -6.232 -16.308 3.430 570 HA VAL 92 HA VAL 92 -7.201 -15.146 5.760 571 HB VAL 92 HB VAL 92 -5.215 -16.538 5.779 572 HG11 VAL 92 HG11 VAL 92 -3.143 -15.928 4.823 573 HG12 VAL 92 HG12 VAL 92 -4.355 -15.639 3.574 574 HG13 VAL 92 HG13 VAL 92 -3.692 -14.286 4.492 575 HG21 VAL 92 HG21 VAL 92 -4.265 -15.496 7.547 576 HG22 VAL 92 HG22 VAL 92 -4.028 -13.985 6.669 577 HG23 VAL 92 HG23 VAL 92 -5.614 -14.380 7.333 578 H TRP 93 H TRP 93 -5.943 -13.665 2.900 579 HA TRP 93 HA TRP 93 -5.299 -11.141 4.079 580 HB2 TRP 93 HB2 TRP 93 -5.441 -12.259 1.333 581 HB3 TRP 93 HB3 TRP 93 -5.622 -10.512 1.484 582 HD1 TRP 93 HD1 TRP 93 -3.027 -12.867 0.795 583 HE1 TRP 93 HE1 TRP 93 -0.701 -11.988 1.460 584 HE3 TRP 93 HE3 TRP 93 -4.453 -9.001 3.822 585 HZ2 TRP 93 HZ2 TRP 93 0.386 -9.930 3.056 586 HZ3 TRP 93 HZ3 TRP 93 -2.708 -7.626 4.881 587 HH2 TRP 93 HH2 TRP 93 -0.339 -8.083 4.505 588 H ASN 94 H ASN 94 -8.151 -12.565 2.633 589 HA ASN 94 HA ASN 94 -9.649 -10.243 2.192 590 HB2 ASN 94 HB2 ASN 94 -10.434 -13.091 2.787 591 HB3 ASN 94 HB3 ASN 94 -11.641 -11.835 2.521 592 HD21 ASN 94 HD21 ASN 94 -8.830 -13.392 1.068 593 HD22 ASN 94 HD22 ASN 94 -9.333 -13.172 -0.571 594 H MET 95 H MET 95 -9.205 -12.206 5.087 595 HA MET 95 HA MET 95 -11.158 -10.826 6.643 596 HB2 MET 95 HB2 MET 95 -8.816 -12.381 7.728 597 HB3 MET 95 HB3 MET 95 -10.380 -12.110 8.484 598 HG2 MET 95 HG2 MET 95 -11.312 -13.405 6.447 599 HG3 MET 95 HG3 MET 95 -9.652 -13.966 6.264 600 HE1 MET 95 HE1 MET 95 -9.194 -16.681 8.574 601 HE2 MET 95 HE2 MET 95 -8.619 -15.612 7.294 602 HE3 MET 95 HE3 MET 95 -8.434 -15.145 8.985 603 H ALA 96 H ALA 96 -7.697 -10.486 6.127 604 HA ALA 96 HA ALA 96 -7.069 -8.746 8.208 605 HB1 ALA 96 HB1 ALA 96 -5.882 -9.471 5.626 606 HB2 ALA 96 HB2 ALA 96 -5.431 -7.875 6.226 607 HB3 ALA 96 HB3 ALA 96 -5.135 -9.305 7.215 608 H PHE 97 H PHE 97 -8.340 -8.054 4.974 609 HA PHE 97 HA PHE 97 -8.199 -5.266 5.073 610 HB2 PHE 97 HB2 PHE 97 -8.681 -6.488 3.009 611 HB3 PHE 97 HB3 PHE 97 -10.229 -7.014 3.665 612 HD1 PHE 97 HD2 PHE 97 -8.543 -3.690 3.631 613 HD2 PHE 97 HD1 PHE 97 -11.905 -6.017 2.449 614 HE1 PHE 97 HE2 PHE 97 -9.613 -1.673 2.713 615 HE2 PHE 97 HE1 PHE 97 -12.980 -4.004 1.529 616 HZ PHE 97 HZ PHE 97 -11.834 -1.828 1.661 617 H ASP 98 H ASP 98 -10.868 -7.433 5.980 618 HA ASP 98 HA ASP 98 -12.666 -5.430 6.781 619 HB2 ASP 98 HB2 ASP 98 -13.166 -7.887 6.368 620 HB3 ASP 98 HB3 ASP 98 -12.516 -8.197 7.976 621 H PHE 99 H PHE 99 -10.117 -7.127 8.522 622 HA PHE 99 HA PHE 99 -10.721 -6.331 11.120 623 HB2 PHE 99 HB2 PHE 99 -9.044 -7.972 10.872 624 HB3 PHE 99 HB3 PHE 99 -8.117 -6.976 9.754 625 HD1 PHE 99 HD2 PHE 99 -8.988 -7.536 13.270 626 HD2 PHE 99 HD1 PHE 99 -6.620 -5.281 10.546 627 HE1 PHE 99 HE2 PHE 99 -7.618 -6.719 15.143 628 HE2 PHE 99 HE1 PHE 99 -5.245 -4.461 12.414 629 HZ PHE 99 HZ PHE 99 -5.742 -5.180 14.716 630 H ILE 100 H ILE 100 -8.672 -4.724 8.701 631 HA ILE 100 HA ILE 100 -7.969 -2.520 10.315 632 HB ILE 100 HB ILE 100 -8.121 -2.684 7.303 633 HG12 ILE 100 HG12 ILE 100 -5.545 -2.772 8.782 634 HG13 ILE 100 HG13 ILE 100 -6.555 -4.212 8.863 635 HG21 ILE 100 HG21 ILE 100 -7.518 -0.501 9.089 636 HG22 ILE 100 HG22 ILE 100 -6.139 -0.881 8.060 637 HG23 ILE 100 HG23 ILE 100 -7.701 -0.501 7.335 638 HD11 ILE 100 HD11 ILE 100 -6.484 -4.492 6.513 639 HD12 ILE 100 HD12 ILE 100 -5.747 -2.906 6.282 640 HD13 ILE 100 HD13 ILE 100 -4.831 -4.200 7.054 641 H LEU 101 H LEU 101 -10.624 -3.056 8.047 642 HA LEU 101 HA LEU 101 -11.637 -0.416 8.109 643 HB2 LEU 101 HB2 LEU 101 -12.865 -3.065 7.403 644 HB3 LEU 101 HB3 LEU 101 -13.771 -1.555 7.320 645 HG LEU 101 HG LEU 101 -11.196 -1.833 5.823 646 HD11 LEU 101 HD11 LEU 101 -13.525 -3.458 5.410 647 HD12 LEU 101 HD12 LEU 101 -11.985 -3.467 4.550 648 HD13 LEU 101 HD13 LEU 101 -13.278 -2.383 4.035 649 HD21 LEU 101 HD21 LEU 101 -12.485 -0.321 4.267 650 HD22 LEU 101 HD22 LEU 101 -12.088 0.358 5.845 651 HD23 LEU 101 HD23 LEU 101 -13.721 -0.225 5.522 652 H ASP 102 H ASP 102 -12.212 -3.266 10.082 653 HA ASP 102 HA ASP 102 -14.486 -2.400 11.462 654 HB2 ASP 102 HB2 ASP 102 -13.131 -4.689 11.474 655 HB3 ASP 102 HB3 ASP 102 -12.421 -3.979 12.921 656 H ASN 103 H ASN 103 -11.175 -1.443 11.719 657 HA ASN 103 HA ASN 103 -11.667 -0.072 14.260 658 HB2 ASN 103 HB2 ASN 103 -9.152 -0.678 12.707 659 HB3 ASN 103 HB3 ASN 103 -9.167 0.429 14.079 660 HD21 ASN 103 HD21 ASN 103 -9.818 -2.875 13.082 661 HD22 ASN 103 HD22 ASN 103 -9.569 -3.589 14.636 662 H VAL 104 H VAL 104 -10.686 0.560 10.921 663 HA VAL 104 HA VAL 104 -10.435 3.381 11.261 664 HB VAL 104 HB VAL 104 -10.758 1.725 8.756 665 HG11 VAL 104 HG11 VAL 104 -11.508 3.950 8.274 666 HG12 VAL 104 HG12 VAL 104 -10.112 4.650 9.096 667 HG13 VAL 104 HG13 VAL 104 -9.893 3.751 7.594 668 HG21 VAL 104 HG21 VAL 104 -8.693 1.475 10.267 669 HG22 VAL 104 HG22 VAL 104 -8.434 1.767 8.548 670 HG23 VAL 104 HG23 VAL 104 -8.261 3.089 9.702 671 H GLN 105 H GLN 105 -12.853 1.429 9.502 672 HA GLN 105 HA GLN 105 -14.631 3.412 8.845 673 HB2 GLN 105 HB2 GLN 105 -15.366 0.622 9.749 674 HB3 GLN 105 HB3 GLN 105 -16.357 1.689 8.763 675 HG2 GLN 105 HG2 GLN 105 -13.642 0.724 7.914 676 HG3 GLN 105 HG3 GLN 105 -15.135 -0.133 7.540 677 HE21 GLN 105 HE21 GLN 105 -13.361 2.852 7.068 678 HE22 GLN 105 HE22 GLN 105 -14.171 3.327 5.619 679 H VAL 106 H VAL 106 -14.064 1.972 11.961 680 HA VAL 106 HA VAL 106 -16.460 2.888 13.205 681 HB VAL 106 HB VAL 106 -13.855 1.816 14.229 682 HG11 VAL 106 HG11 VAL 106 -15.968 3.246 15.800 683 HG12 VAL 106 HG12 VAL 106 -15.005 1.963 16.533 684 HG13 VAL 106 HG13 VAL 106 -14.214 3.404 15.891 685 HG21 VAL 106 HG21 VAL 106 -15.181 0.003 15.002 686 HG22 VAL 106 HG22 VAL 106 -16.679 0.892 14.726 687 HG23 VAL 106 HG23 VAL 106 -15.709 0.350 13.356 688 H VAL 107 H VAL 107 -13.079 4.009 13.415 689 HA VAL 107 HA VAL 107 -13.680 6.328 14.920 690 HB VAL 107 HB VAL 107 -11.435 5.453 14.933 691 HG11 VAL 107 HG11 VAL 107 -10.057 5.905 12.763 692 HG12 VAL 107 HG12 VAL 107 -11.037 4.443 12.900 693 HG13 VAL 107 HG13 VAL 107 -11.633 5.823 11.978 694 HG21 VAL 107 HG21 VAL 107 -11.666 7.842 15.307 695 HG22 VAL 107 HG22 VAL 107 -10.160 7.501 14.453 696 HG23 VAL 107 HG23 VAL 107 -11.546 8.145 13.573 697 H LEU 108 H LEU 108 -13.780 5.616 11.530 698 HA LEU 108 HA LEU 108 -13.706 8.324 10.618 699 HB2 LEU 108 HB2 LEU 108 -13.450 7.328 8.658 700 HB3 LEU 108 HB3 LEU 108 -13.645 5.770 9.458 701 HG LEU 108 HG LEU 108 -16.145 6.065 9.083 702 HD11 LEU 108 HD11 LEU 108 -15.154 8.530 7.942 703 HD12 LEU 108 HD12 LEU 108 -16.805 8.048 8.328 704 HD13 LEU 108 HD13 LEU 108 -16.098 7.602 6.775 705 HD21 LEU 108 HD21 LEU 108 -15.858 4.663 7.379 706 HD22 LEU 108 HD22 LEU 108 -14.130 4.986 7.511 707 HD23 LEU 108 HD23 LEU 108 -15.116 5.914 6.381 708 H GLN 109 H GLN 109 -16.254 6.017 11.409 709 HA GLN 109 HA GLN 109 -18.418 7.573 10.468 710 HB2 GLN 109 HB2 GLN 109 -18.136 5.254 12.334 711 HB3 GLN 109 HB3 GLN 109 -19.669 6.111 12.264 712 HG2 GLN 109 HG2 GLN 109 -19.905 5.626 9.931 713 HG3 GLN 109 HG3 GLN 109 -18.288 4.929 9.869 714 HE21 GLN 109 HE21 GLN 109 -18.062 3.218 11.781 715 HE22 GLN 109 HE22 GLN 109 -19.300 2.013 11.769 716 H GLN 110 H GLN 110 -16.826 7.327 13.614 717 HA GLN 110 HA GLN 110 -18.622 8.950 15.049 718 HB2 GLN 110 HB2 GLN 110 -15.693 8.360 15.486 719 HB3 GLN 110 HB3 GLN 110 -16.687 9.253 16.630 720 HG2 GLN 110 HG2 GLN 110 -18.222 7.202 16.597 721 HG3 GLN 110 HG3 GLN 110 -16.862 6.371 15.844 722 HE21 GLN 110 HE21 GLN 110 -15.599 5.332 17.193 723 HE22 GLN 110 HE22 GLN 110 -15.331 5.723 18.854 724 H THR 111 H THR 111 -16.358 9.718 12.640 725 HA THR 111 HA THR 111 -16.081 12.494 13.511 726 HB THR 111 HB THR 111 -14.815 10.997 11.210 727 HG1 THR 111 HG1 THR 111 -13.881 10.479 13.188 728 HG21 THR 111 HG21 THR 111 -15.135 13.306 10.553 729 HG22 THR 111 HG22 THR 111 -13.432 13.033 10.919 730 HG23 THR 111 HG23 THR 111 -14.461 13.867 12.082 731 H TYR 112 H TYR 112 -16.938 10.798 10.488 732 HA TYR 112 HA TYR 112 -18.582 13.116 9.744 733 HB2 TYR 112 HB2 TYR 112 -17.802 10.862 7.904 734 HB3 TYR 112 HB3 TYR 112 -18.326 12.488 7.481 735 HD1 TYR 112 HD2 TYR 112 -16.781 14.380 7.655 736 HD2 TYR 112 HD1 TYR 112 -15.513 10.412 8.520 737 HE1 TYR 112 HE2 TYR 112 -14.434 15.104 7.509 738 HE2 TYR 112 HE1 TYR 112 -13.164 11.124 8.379 739 HH TYR 112 HH TYR 112 -11.770 12.799 7.978 740 H GLY 113 H GLY 113 -18.636 9.578 9.953 741 HA2 GLY 113 HA2 GLY 113 -20.617 8.520 10.889 742 HA3 GLY 113 HA3 GLY 113 -21.582 9.737 10.066 743 H SER 114 H SER 114 -19.533 9.253 7.752 744 HA SER 114 HA SER 114 -21.160 7.179 6.498 745 HB2 SER 114 HB2 SER 114 -20.423 9.535 5.500 746 HB3 SER 114 HB3 SER 114 -19.009 8.606 5.003 747 HG SER 114 HG SER 114 -21.655 7.745 4.489 748 H THR 115 H THR 115 -19.606 6.041 4.670 749 HA THR 115 HA THR 115 -17.127 5.107 5.852 750 HB THR 115 HB THR 115 -17.750 2.726 5.752 751 HG1 THR 115 HG1 THR 115 -20.468 3.459 5.595 752 HG21 THR 115 HG21 THR 115 -18.023 4.170 7.841 753 HG22 THR 115 HG22 THR 115 -18.899 2.639 7.809 754 HG23 THR 115 HG23 THR 115 -19.751 4.150 7.490 755 H LEU 116 H LEU 116 -16.309 3.168 4.365 756 HA LEU 116 HA LEU 116 -16.348 4.247 1.659 757 HB2 LEU 116 HB2 LEU 116 -14.373 3.145 3.278 758 HB3 LEU 116 HB3 LEU 116 -14.677 1.917 2.051 759 HG LEU 116 HG LEU 116 -14.401 4.531 0.853 760 HD11 LEU 116 HD11 LEU 116 -12.419 5.294 1.607 761 HD12 LEU 116 HD12 LEU 116 -11.802 3.678 1.948 762 HD13 LEU 116 HD13 LEU 116 -12.904 4.459 3.082 763 HD21 LEU 116 HD21 LEU 116 -13.489 3.290 -0.759 764 HD22 LEU 116 HD22 LEU 116 -13.949 1.889 0.210 765 HD23 LEU 116 HD23 LEU 116 -12.323 2.561 0.346 766 H LYS 117 H LYS 117 -17.026 3.148 -0.134 767 HA LYS 117 HA LYS 117 -18.777 0.874 0.354 768 HB2 LYS 117 HB2 LYS 117 -19.756 2.568 -0.993 769 HB3 LYS 117 HB3 LYS 117 -18.332 2.678 -2.019 770 HG2 LYS 117 HG2 LYS 117 -20.205 1.542 -3.122 771 HG3 LYS 117 HG3 LYS 117 -18.789 0.501 -2.957 772 HD2 LYS 117 HD2 LYS 117 -20.585 0.307 -0.679 773 HD3 LYS 117 HD3 LYS 117 -21.377 -0.115 -2.199 774 HE2 LYS 117 HE2 LYS 117 -18.950 -1.387 -2.397 775 HE3 LYS 117 HE3 LYS 117 -19.333 -1.545 -0.683 776 HZ1 LYS 117 HZ1 LYS 117 -20.492 -2.874 -2.926 777 HZ2 LYS 117 HZ2 LYS 117 -21.673 -2.127 -1.974 778 HZ3 LYS 117 HZ3 LYS 117 -20.610 -3.245 -1.280 779 H VAL 118 H VAL 118 -17.482 -0.902 0.617 780 HA VAL 118 HA VAL 118 -15.771 -1.621 -1.675 781 HB VAL 118 HB VAL 118 -14.587 -3.134 0.008 782 HG11 VAL 118 HG11 VAL 118 -13.961 -0.455 0.954 783 HG12 VAL 118 HG12 VAL 118 -12.976 -1.588 0.029 784 HG13 VAL 118 HG13 VAL 118 -14.128 -0.540 -0.798 785 HG21 VAL 118 HG21 VAL 118 -15.339 -1.282 2.169 786 HG22 VAL 118 HG22 VAL 118 -16.588 -2.431 1.687 787 HG23 VAL 118 HG23 VAL 118 -15.012 -3.015 2.219 788 H THR 119 H THR 119 -17.375 -2.722 -2.801 789 HA THR 119 HA THR 119 -19.163 -4.586 -1.733 790 HB THR 119 HB THR 119 -18.120 -5.066 -4.478 791 HG1 THR 119 HG1 THR 119 -18.118 -2.882 -4.613 792 HG21 THR 119 HG21 THR 119 -20.542 -5.190 -4.964 793 HG22 THR 119 HG22 THR 119 -20.880 -4.802 -3.278 794 HG23 THR 119 HG23 THR 119 -20.051 -6.304 -3.689 795 H LYS 207 H LYS 207 9.689 -6.066 15.266 796 HA LYS 207 HA LYS 207 9.752 -8.604 13.800 797 HB2 LYS 207 HB2 LYS 207 9.302 -8.408 16.344 798 HB3 LYS 207 HB3 LYS 207 7.702 -7.858 15.865 799 HG2 LYS 207 HG2 LYS 207 7.048 -9.957 15.651 800 HG3 LYS 207 HG3 LYS 207 8.267 -10.211 14.399 801 HD2 LYS 207 HD2 LYS 207 9.243 -10.240 17.185 802 HD3 LYS 207 HD3 LYS 207 8.196 -11.582 16.717 803 HE2 LYS 207 HE2 LYS 207 9.790 -11.598 14.602 804 HE3 LYS 207 HE3 LYS 207 10.905 -10.844 15.740 805 HZ1 LYS 207 HZ1 LYS 207 10.170 -12.812 17.248 806 HZ2 LYS 207 HZ2 LYS 207 11.350 -13.051 16.060 807 HZ3 LYS 207 HZ3 LYS 207 9.756 -13.545 15.780 808 H SER 208 H SER 208 9.331 -7.101 11.874 809 HA SER 208 HA SER 208 6.726 -7.511 10.949 810 HB2 SER 208 HB2 SER 208 5.718 -5.823 12.123 811 HB3 SER 208 HB3 SER 208 7.214 -4.906 12.294 812 HG SER 208 HG SER 208 5.261 -4.695 10.419 813 H PHE 209 H PHE 209 6.375 -6.645 8.796 814 HA PHE 209 HA PHE 209 8.849 -6.498 7.323 815 HB2 PHE 209 HB2 PHE 209 7.109 -7.820 6.350 816 HB3 PHE 209 HB3 PHE 209 5.950 -6.501 6.478 817 HD1 PHE 209 HD2 PHE 209 9.082 -7.529 4.781 818 HD2 PHE 209 HD1 PHE 209 5.663 -4.994 4.724 819 HE1 PHE 209 HE2 PHE 209 9.655 -6.812 2.498 820 HE2 PHE 209 HE1 PHE 209 6.230 -4.274 2.440 821 HZ PHE 209 HZ PHE 209 8.228 -5.184 1.324 822 H PHE 210 H PHE 210 6.255 -4.323 8.234 823 HA PHE 210 HA PHE 210 7.011 -2.184 6.521 824 HB2 PHE 210 HB2 PHE 210 5.283 -2.369 8.979 825 HB3 PHE 210 HB3 PHE 210 5.618 -0.821 8.209 826 HD1 PHE 210 HD1 PHE 210 5.352 -1.063 5.480 827 HD2 PHE 210 HD2 PHE 210 3.245 -3.253 8.459 828 HE1 PHE 210 HE1 PHE 210 3.520 -1.461 3.887 829 HE2 PHE 210 HE2 PHE 210 1.410 -3.655 6.871 830 HZ PHE 210 HZ PHE 210 1.546 -2.757 4.581 831 H ASP 211 H ASP 211 8.108 -3.304 9.604 832 HA ASP 211 HA ASP 211 9.371 -0.858 10.401 833 HB2 ASP 211 HB2 ASP 211 9.268 -3.653 11.420 834 HB3 ASP 211 HB3 ASP 211 10.635 -2.660 11.919 835 H LYS 212 H LYS 212 10.510 -3.927 9.023 836 HA LYS 212 HA LYS 212 13.238 -3.166 8.892 837 HB2 LYS 212 HB2 LYS 212 13.573 -5.149 7.603 838 HB3 LYS 212 HB3 LYS 212 12.365 -5.521 8.826 839 HG2 LYS 212 HG2 LYS 212 10.596 -5.352 7.206 840 HG3 LYS 212 HG3 LYS 212 11.733 -4.812 5.970 841 HD2 LYS 212 HD2 LYS 212 12.895 -7.131 6.741 842 HD3 LYS 212 HD3 LYS 212 11.192 -7.518 7.000 843 HE2 LYS 212 HE2 LYS 212 11.288 -8.087 4.815 844 HE3 LYS 212 HE3 LYS 212 11.032 -6.358 4.584 845 HZ1 LYS 212 HZ1 LYS 212 13.705 -7.646 4.676 846 HZ2 LYS 212 HZ2 LYS 212 13.365 -6.036 4.281 847 HZ3 LYS 212 HZ3 LYS 212 12.875 -7.282 3.247 848 H LYS 213 H LYS 213 10.499 -2.605 6.843 849 HA LYS 213 HA LYS 213 12.042 -1.884 4.522 850 HB2 LYS 213 HB2 LYS 213 9.862 -2.757 4.114 851 HB3 LYS 213 HB3 LYS 213 9.122 -1.616 5.230 852 HG2 LYS 213 HG2 LYS 213 8.652 -0.955 2.969 853 HG3 LYS 213 HG3 LYS 213 9.737 0.224 3.709 854 HD2 LYS 213 HD2 LYS 213 10.725 -0.084 1.647 855 HD3 LYS 213 HD3 LYS 213 11.607 -1.248 2.638 856 HE2 LYS 213 HE2 LYS 213 10.052 -3.013 1.869 857 HE3 LYS 213 HE3 LYS 213 9.276 -1.833 0.814 858 HZ1 LYS 213 HZ1 LYS 213 10.756 -2.770 -0.620 859 HZ2 LYS 213 HZ2 LYS 213 11.910 -3.092 0.574 860 HZ3 LYS 213 HZ3 LYS 213 11.722 -1.518 -0.018 861 H ARG 214 H ARG 214 10.004 -0.069 6.819 862 HA ARG 214 HA ARG 214 10.503 2.484 5.875 863 HB2 ARG 214 HB2 ARG 214 9.790 3.295 8.022 864 HB3 ARG 214 HB3 ARG 214 8.835 1.872 7.626 865 HG2 ARG 214 HG2 ARG 214 10.085 0.519 9.140 866 HG3 ARG 214 HG3 ARG 214 11.258 1.811 9.407 867 HD2 ARG 214 HD2 ARG 214 9.551 3.176 10.462 868 HD3 ARG 214 HD3 ARG 214 8.331 1.949 10.125 869 HE ARG 214 HE ARG 214 10.201 0.621 11.579 870 HH11 ARG 214 HH11 ARG 214 8.379 3.548 12.062 871 HH12 ARG 214 HH12 ARG 214 8.349 3.399 13.788 872 HH21 ARG 214 HH21 ARG 214 10.170 0.415 13.851 873 HH22 ARG 214 HH22 ARG 214 9.369 1.617 14.805 874 H SER 215 H SER 215 12.535 0.378 7.750 875 HA SER 215 HA SER 215 14.354 2.404 8.633 876 HB2 SER 215 HB2 SER 215 14.416 0.512 9.990 877 HB3 SER 215 HB3 SER 215 14.363 -0.597 8.620 878 HG SER 215 HG SER 215 16.439 -0.679 9.155 879 H GLU 216 H GLU 216 14.153 0.242 5.873 880 HA GLU 216 HA GLU 216 16.730 0.461 4.867 881 HB2 GLU 216 HB2 GLU 216 14.092 0.200 3.419 882 HB3 GLU 216 HB3 GLU 216 15.653 0.067 2.621 883 HG2 GLU 216 HG2 GLU 216 15.202 -1.650 4.985 884 HG3 GLU 216 HG3 GLU 216 14.304 -2.039 3.519 885 H ARG 217 H ARG 217 13.901 2.431 3.943 886 HA ARG 217 HA ARG 217 15.254 4.227 2.300 887 HB2 ARG 217 HB2 ARG 217 13.336 5.767 2.756 888 HB3 ARG 217 HB3 ARG 217 12.858 4.149 2.265 889 HG2 ARG 217 HG2 ARG 217 12.547 3.611 4.697 890 HG3 ARG 217 HG3 ARG 217 12.785 5.327 5.029 891 HD2 ARG 217 HD2 ARG 217 10.401 4.687 4.873 892 HD3 ARG 217 HD3 ARG 217 10.871 5.903 3.687 893 HE ARG 217 HE ARG 217 10.994 3.193 2.715 894 HH11 ARG 217 HH11 ARG 217 8.996 6.011 3.151 895 HH12 ARG 217 HH12 ARG 217 7.894 5.586 1.883 896 HH21 ARG 217 HH21 ARG 217 9.549 2.623 1.045 897 HH22 ARG 217 HH22 ARG 217 8.209 3.658 0.687 898 H ILE 218 H ILE 218 14.572 4.408 5.777 899 HA ILE 218 HA ILE 218 15.687 6.960 6.200 900 HB ILE 218 HB ILE 218 15.437 4.665 8.149 901 HG12 ILE 218 HG12 ILE 218 13.617 7.053 7.911 902 HG13 ILE 218 HG13 ILE 218 13.336 5.587 6.978 903 HG21 ILE 218 HG21 ILE 218 15.345 6.719 9.760 904 HG22 ILE 218 HG22 ILE 218 16.898 6.082 9.220 905 HG23 ILE 218 HG23 ILE 218 16.225 7.525 8.462 906 HD11 ILE 218 HD11 ILE 218 13.695 4.689 9.572 907 HD12 ILE 218 HD12 ILE 218 12.738 6.161 9.738 908 HD13 ILE 218 HD13 ILE 218 12.168 4.850 8.706 909 H SER 219 H SER 219 17.114 3.833 5.805 910 HA SER 219 HA SER 219 19.691 4.730 6.843 911 HB2 SER 219 HB2 SER 219 18.780 2.431 7.356 912 HB3 SER 219 HB3 SER 219 19.013 2.033 5.653 913 HG SER 219 HG SER 219 21.172 3.127 7.041 914 H ASN 220 H ASN 220 21.508 5.014 5.605 915 HA ASN 220 HA ASN 220 21.035 5.385 2.750 916 HB2 ASN 220 HB2 ASN 220 23.102 6.360 4.689 917 HB3 ASN 220 HB3 ASN 220 23.459 6.366 2.964 918 HD21 ASN 220 HD21 ASN 220 21.287 7.150 1.739 919 HD22 ASN 220 HD22 ASN 220 20.750 8.699 2.283 Start of MODEL 19 1 H ALA 23 H ALA 23 4.226 14.915 11.993 2 HA ALA 23 HA ALA 23 2.838 12.797 13.502 3 HB1 ALA 23 HB1 ALA 23 2.746 14.598 14.947 4 HB2 ALA 23 HB2 ALA 23 2.589 15.772 13.639 5 HB3 ALA 23 HB3 ALA 23 1.222 14.745 14.070 6 H ALA 24 H ALA 24 3.187 12.830 10.661 7 HA ALA 24 HA ALA 24 0.431 13.357 9.756 8 HB1 ALA 24 HB1 ALA 24 2.998 13.949 8.567 9 HB2 ALA 24 HB2 ALA 24 1.990 12.988 7.485 10 HB3 ALA 24 HB3 ALA 24 1.390 14.520 8.120 11 HA PRO 25 HA PRO 25 -0.235 9.102 8.917 12 HB2 PRO 25 HB2 PRO 25 -1.623 9.177 6.585 13 HB3 PRO 25 HB3 PRO 25 -2.315 9.681 8.131 14 HG2 PRO 25 HG2 PRO 25 -1.164 11.359 5.936 15 HG3 PRO 25 HG3 PRO 25 -2.632 11.624 6.894 16 HD2 PRO 25 HD2 PRO 25 -0.306 12.911 7.407 17 HD3 PRO 25 HD3 PRO 25 -1.460 12.481 8.684 18 H ASN 26 H ASN 26 1.834 8.281 8.552 19 HA ASN 26 HA ASN 26 2.586 8.031 5.714 20 HB2 ASN 26 HB2 ASN 26 4.644 7.951 7.895 21 HB3 ASN 26 HB3 ASN 26 4.849 8.337 6.188 22 HD21 ASN 26 HD21 ASN 26 2.916 10.224 5.803 23 HD22 ASN 26 HD22 ASN 26 3.275 11.629 6.742 24 H LEU 27 H LEU 27 3.016 6.022 4.983 25 HA LEU 27 HA LEU 27 2.751 3.823 6.911 26 HB2 LEU 27 HB2 LEU 27 1.234 4.133 4.832 27 HB3 LEU 27 HB3 LEU 27 2.617 3.503 3.938 28 HG LEU 27 HG LEU 27 2.510 1.430 5.239 29 HD11 LEU 27 HD11 LEU 27 0.150 2.766 6.548 30 HD12 LEU 27 HD12 LEU 27 1.628 2.190 7.318 31 HD13 LEU 27 HD13 LEU 27 0.479 1.036 6.641 32 HD21 LEU 27 HD21 LEU 27 1.355 1.273 3.223 33 HD22 LEU 27 HD22 LEU 27 0.074 2.361 3.758 34 HD23 LEU 27 HD23 LEU 27 0.177 0.726 4.415 35 H ALA 28 H ALA 28 4.620 3.003 7.570 36 HA ALA 28 HA ALA 28 6.759 2.223 7.595 37 HB1 ALA 28 HB1 ALA 28 5.566 0.823 5.735 38 HB2 ALA 28 HB2 ALA 28 6.646 1.711 4.660 39 HB3 ALA 28 HB3 ALA 28 7.313 0.714 5.953 40 H GLY 29 H GLY 29 6.231 5.071 6.892 41 HA2 GLY 29 HA2 GLY 29 7.868 6.774 6.767 42 HA3 GLY 29 HA3 GLY 29 8.931 5.656 5.925 43 H ALA 30 H ALA 30 5.756 5.610 4.746 44 HA ALA 30 HA ALA 30 6.588 7.228 2.435 45 HB1 ALA 30 HB1 ALA 30 4.929 5.971 1.148 46 HB2 ALA 30 HB2 ALA 30 6.105 4.900 1.909 47 HB3 ALA 30 HB3 ALA 30 4.490 5.068 2.598 48 H VAL 31 H VAL 31 5.740 9.192 2.335 49 HA VAL 31 HA VAL 31 3.251 9.773 3.752 50 HB VAL 31 HB VAL 31 5.062 11.736 2.350 51 HG11 VAL 31 HG11 VAL 31 3.827 13.402 3.287 52 HG12 VAL 31 HG12 VAL 31 2.566 12.175 3.151 53 HG13 VAL 31 HG13 VAL 31 3.383 12.435 4.692 54 HG21 VAL 31 HG21 VAL 31 5.653 12.152 4.909 55 HG22 VAL 31 HG22 VAL 31 5.286 10.430 5.005 56 HG23 VAL 31 HG23 VAL 31 6.548 11.002 3.914 57 H GLU 32 H GLU 32 4.602 9.711 0.514 58 HA GLU 32 HA GLU 32 2.339 10.953 -0.730 59 HB2 GLU 32 HB2 GLU 32 4.557 9.295 -1.946 60 HB3 GLU 32 HB3 GLU 32 3.402 10.274 -2.841 61 HG2 GLU 32 HG2 GLU 32 4.274 12.288 -1.794 62 HG3 GLU 32 HG3 GLU 32 5.411 11.319 -0.858 63 H PHE 33 H PHE 33 0.690 10.003 -1.903 64 HA PHE 33 HA PHE 33 -0.359 7.598 -0.949 65 HB2 PHE 33 HB2 PHE 33 -1.897 9.110 -1.896 66 HB3 PHE 33 HB3 PHE 33 -0.964 9.264 -3.381 67 HD1 PHE 33 HD1 PHE 33 -3.014 6.879 -1.415 68 HD2 PHE 33 HD2 PHE 33 -1.446 7.933 -5.230 69 HE1 PHE 33 HE1 PHE 33 -4.410 5.146 -2.465 70 HE2 PHE 33 HE2 PHE 33 -2.840 6.200 -6.284 71 HZ PHE 33 HZ PHE 33 -4.325 4.805 -4.902 72 H SER 34 H SER 34 1.165 8.274 -4.098 73 HA SER 34 HA SER 34 1.049 5.742 -5.189 74 HB2 SER 34 HB2 SER 34 3.001 6.401 -6.555 75 HB3 SER 34 HB3 SER 34 1.806 7.694 -6.457 76 HG SER 34 HG SER 34 3.397 8.868 -5.766 77 H ASP 35 H ASP 35 3.325 7.039 -2.846 78 HA ASP 35 HA ASP 35 5.076 4.779 -2.908 79 HB2 ASP 35 HB2 ASP 35 5.688 7.128 -2.163 80 HB3 ASP 35 HB3 ASP 35 4.816 6.787 -0.671 81 H VAL 36 H VAL 36 2.217 5.669 -1.120 82 HA VAL 36 HA VAL 36 2.494 3.725 0.946 83 HB VAL 36 HB VAL 36 0.011 5.131 -0.047 84 HG11 VAL 36 HG11 VAL 36 -1.128 3.798 1.314 85 HG12 VAL 36 HG12 VAL 36 0.357 3.003 1.839 86 HG13 VAL 36 HG13 VAL 36 -0.210 4.452 2.670 87 HG21 VAL 36 HG21 VAL 36 1.145 5.921 2.524 88 HG22 VAL 36 HG22 VAL 36 2.208 6.248 1.155 89 HG23 VAL 36 HG23 VAL 36 0.576 6.914 1.182 90 H LYS 37 H LYS 37 0.387 3.867 -1.928 91 HA LYS 37 HA LYS 37 -0.726 1.323 -1.673 92 HB2 LYS 37 HB2 LYS 37 -1.193 1.503 -4.115 93 HB3 LYS 37 HB3 LYS 37 -1.680 2.922 -3.197 94 HG2 LYS 37 HG2 LYS 37 0.089 4.208 -4.030 95 HG3 LYS 37 HG3 LYS 37 0.963 2.788 -4.608 96 HD2 LYS 37 HD2 LYS 37 -1.587 2.797 -5.847 97 HD3 LYS 37 HD3 LYS 37 -0.910 4.420 -6.002 98 HE2 LYS 37 HE2 LYS 37 1.180 3.398 -6.877 99 HE3 LYS 37 HE3 LYS 37 0.382 1.826 -6.839 100 HZ1 LYS 37 HZ1 LYS 37 -0.326 2.289 -8.875 101 HZ2 LYS 37 HZ2 LYS 37 0.189 3.898 -8.783 102 HZ3 LYS 37 HZ3 LYS 37 -1.341 3.465 -8.203 103 H THR 38 H THR 38 2.352 2.346 -2.965 104 HA THR 38 HA THR 38 3.007 -0.013 -4.371 105 HB THR 38 HB THR 38 4.788 2.080 -3.117 106 HG1 THR 38 HG1 THR 38 4.423 3.114 -4.923 107 HG21 THR 38 HG21 THR 38 6.054 0.027 -3.329 108 HG22 THR 38 HG22 THR 38 6.562 1.160 -4.582 109 HG23 THR 38 HG23 THR 38 5.494 -0.182 -4.987 110 H LEU 39 H LEU 39 3.615 1.021 -1.038 111 HA LEU 39 HA LEU 39 5.167 -1.238 -0.315 112 HB2 LEU 39 HB2 LEU 39 3.539 0.596 1.439 113 HB3 LEU 39 HB3 LEU 39 4.795 -0.513 1.986 114 HG LEU 39 HG LEU 39 5.488 1.620 0.014 115 HD11 LEU 39 HD11 LEU 39 4.643 2.030 2.808 116 HD12 LEU 39 HD12 LEU 39 4.648 3.147 1.445 117 HD13 LEU 39 HD13 LEU 39 6.143 2.823 2.323 118 HD21 LEU 39 HD21 LEU 39 7.362 0.392 0.344 119 HD22 LEU 39 HD22 LEU 39 6.859 -0.156 1.943 120 HD23 LEU 39 HD23 LEU 39 7.528 1.464 1.734 121 H LEU 40 H LEU 40 1.732 -0.563 -0.329 122 HA LEU 40 HA LEU 40 0.971 -2.815 1.246 123 HB2 LEU 40 HB2 LEU 40 -0.681 -1.278 -0.751 124 HB3 LEU 40 HB3 LEU 40 -1.284 -2.324 0.532 125 HG LEU 40 HG LEU 40 0.339 0.103 1.195 126 HD11 LEU 40 HD11 LEU 40 -2.132 0.157 -0.191 127 HD12 LEU 40 HD12 LEU 40 -1.224 1.505 0.493 128 HD13 LEU 40 HD13 LEU 40 -2.427 0.666 1.472 129 HD21 LEU 40 HD21 LEU 40 -1.477 -1.785 2.591 130 HD22 LEU 40 HD22 LEU 40 -1.464 -0.104 3.126 131 HD23 LEU 40 HD23 LEU 40 0.029 -1.046 3.137 132 H LYS 41 H LYS 41 0.963 -2.160 -2.250 133 HA LYS 41 HA LYS 41 -0.090 -4.551 -3.153 134 HB2 LYS 41 HB2 LYS 41 0.800 -2.351 -4.384 135 HB3 LYS 41 HB3 LYS 41 2.186 -3.393 -4.680 136 HG2 LYS 41 HG2 LYS 41 0.354 -5.086 -5.479 137 HG3 LYS 41 HG3 LYS 41 -0.606 -3.619 -5.683 138 HD2 LYS 41 HD2 LYS 41 0.437 -3.987 -7.766 139 HD3 LYS 41 HD3 LYS 41 1.362 -2.694 -6.999 140 HE2 LYS 41 HE2 LYS 41 3.051 -4.302 -6.297 141 HE3 LYS 41 HE3 LYS 41 2.112 -5.617 -7.001 142 HZ1 LYS 41 HZ1 LYS 41 2.701 -3.463 -8.828 143 HZ2 LYS 41 HZ2 LYS 41 2.833 -5.134 -9.048 144 HZ3 LYS 41 HZ3 LYS 41 4.070 -4.284 -8.269 145 H GLU 42 H GLU 42 3.254 -3.785 -2.289 146 HA GLU 42 HA GLU 42 4.238 -6.381 -3.015 147 HB2 GLU 42 HB2 GLU 42 6.339 -5.632 -1.972 148 HB3 GLU 42 HB3 GLU 42 5.715 -4.452 -3.117 149 HG2 GLU 42 HG2 GLU 42 4.762 -3.185 -1.211 150 HG3 GLU 42 HG3 GLU 42 5.551 -4.321 -0.117 151 H TRP 43 H TRP 43 3.374 -4.748 0.000 152 HA TRP 43 HA TRP 43 4.205 -6.792 1.750 153 HB2 TRP 43 HB2 TRP 43 3.785 -4.593 2.621 154 HB3 TRP 43 HB3 TRP 43 2.117 -4.630 2.055 155 HD1 TRP 43 HD1 TRP 43 4.250 -6.862 4.431 156 HE1 TRP 43 HE1 TRP 43 2.806 -7.414 6.490 157 HE3 TRP 43 HE3 TRP 43 -0.025 -4.389 3.111 158 HZ2 TRP 43 HZ2 TRP 43 0.199 -6.873 7.428 159 HZ3 TRP 43 HZ3 TRP 43 -1.948 -4.456 4.644 160 HH2 TRP 43 HH2 TRP 43 -1.836 -5.674 6.758 161 H ILE 44 H ILE 44 1.629 -6.657 -0.443 162 HA ILE 44 HA ILE 44 0.109 -8.710 1.007 163 HB ILE 44 HB ILE 44 -0.676 -7.100 -1.426 164 HG12 ILE 44 HG12 ILE 44 -1.974 -6.925 1.273 165 HG13 ILE 44 HG13 ILE 44 -0.500 -6.018 0.949 166 HG21 ILE 44 HG21 ILE 44 -2.077 -9.253 0.121 167 HG22 ILE 44 HG22 ILE 44 -2.974 -8.049 -0.804 168 HG23 ILE 44 HG23 ILE 44 -1.834 -9.119 -1.620 169 HD11 ILE 44 HD11 ILE 44 -3.027 -5.131 0.489 170 HD12 ILE 44 HD12 ILE 44 -1.573 -4.504 -0.289 171 HD13 ILE 44 HD13 ILE 44 -2.554 -5.721 -1.105 172 H THR 45 H THR 45 2.415 -8.385 -1.401 173 HA THR 45 HA THR 45 1.587 -10.879 -2.727 174 HB THR 45 HB THR 45 3.177 -10.270 -4.520 175 HG1 THR 45 HG1 THR 45 4.571 -8.733 -4.147 176 HG21 THR 45 HG21 THR 45 0.837 -8.623 -3.777 177 HG22 THR 45 HG22 THR 45 1.147 -9.559 -5.239 178 HG23 THR 45 HG23 THR 45 1.883 -7.969 -5.038 179 H THR 46 H THR 46 4.558 -9.215 -1.660 180 HA THR 46 HA THR 46 6.176 -11.531 -1.729 181 HB THR 46 HB THR 46 7.037 -9.175 -1.748 182 HG1 THR 46 HG1 THR 46 8.860 -9.728 -0.416 183 HG21 THR 46 HG21 THR 46 6.637 -7.764 -0.068 184 HG22 THR 46 HG22 THR 46 7.269 -8.913 1.111 185 HG23 THR 46 HG23 THR 46 5.573 -8.982 0.635 186 H ILE 47 H ILE 47 3.831 -10.448 0.501 187 HA ILE 47 HA ILE 47 4.720 -12.489 2.430 188 HB ILE 47 HB ILE 47 3.514 -9.793 3.047 189 HG12 ILE 47 HG12 ILE 47 5.866 -10.492 4.544 190 HG13 ILE 47 HG13 ILE 47 6.185 -10.692 2.824 191 HG21 ILE 47 HG21 ILE 47 3.710 -10.535 5.434 192 HG22 ILE 47 HG22 ILE 47 2.457 -11.350 4.501 193 HG23 ILE 47 HG23 ILE 47 3.982 -12.170 4.832 194 HD11 ILE 47 HD11 ILE 47 5.687 -8.249 4.392 195 HD12 ILE 47 HD12 ILE 47 6.727 -8.515 2.992 196 HD13 ILE 47 HD13 ILE 47 4.991 -8.302 2.774 197 H SER 48 H SER 48 3.261 -14.006 2.876 198 HA SER 48 HA SER 48 0.493 -13.568 1.983 199 HB2 SER 48 HB2 SER 48 2.134 -16.080 2.308 200 HB3 SER 48 HB3 SER 48 0.384 -16.118 2.095 201 HG SER 48 HG SER 48 0.600 -15.509 0.064 202 H ASP 49 H ASP 49 2.491 -14.367 4.710 203 HA ASP 49 HA ASP 49 0.085 -14.689 6.378 204 HB2 ASP 49 HB2 ASP 49 1.718 -15.721 8.039 205 HB3 ASP 49 HB3 ASP 49 1.389 -16.656 6.583 206 HA PRO 50 HA PRO 50 1.822 -10.564 7.504 207 HB2 PRO 50 HB2 PRO 50 -0.603 -9.395 7.845 208 HB3 PRO 50 HB3 PRO 50 0.194 -9.511 6.272 209 HG2 PRO 50 HG2 PRO 50 -1.972 -11.222 7.429 210 HG3 PRO 50 HG3 PRO 50 -1.817 -10.572 5.786 211 HD2 PRO 50 HD2 PRO 50 -1.179 -13.129 6.406 212 HD3 PRO 50 HD3 PRO 50 -0.336 -12.215 5.140 213 H MET 51 H MET 51 1.943 -9.612 9.535 214 HA MET 51 HA MET 51 0.794 -11.208 11.712 215 HB2 MET 51 HB2 MET 51 3.109 -9.266 11.683 216 HB3 MET 51 HB3 MET 51 2.518 -10.083 13.124 217 HG2 MET 51 HG2 MET 51 3.021 -12.251 12.045 218 HG3 MET 51 HG3 MET 51 3.721 -11.372 10.687 219 HE1 MET 51 HE1 MET 51 5.340 -9.398 11.157 220 HE2 MET 51 HE2 MET 51 5.220 -8.893 12.842 221 HE3 MET 51 HE3 MET 51 6.731 -9.566 12.230 222 H GLU 52 H GLU 52 -0.026 -10.115 13.611 223 HA GLU 52 HA GLU 52 -1.973 -8.230 13.094 224 HB2 GLU 52 HB2 GLU 52 -1.525 -9.730 15.193 225 HB3 GLU 52 HB3 GLU 52 -0.664 -8.316 15.787 226 HG2 GLU 52 HG2 GLU 52 -2.621 -7.635 16.578 227 HG3 GLU 52 HG3 GLU 52 -3.043 -7.263 14.907 228 H GLU 53 H GLU 53 1.401 -7.760 13.846 229 HA GLU 53 HA GLU 53 1.215 -4.981 14.453 230 HB2 GLU 53 HB2 GLU 53 3.589 -6.623 13.552 231 HB3 GLU 53 HB3 GLU 53 3.671 -4.989 14.198 232 HG2 GLU 53 HG2 GLU 53 2.421 -6.059 16.232 233 HG3 GLU 53 HG3 GLU 53 3.103 -7.554 15.592 234 H ASP 54 H ASP 54 2.192 -6.789 11.552 235 HA ASP 54 HA ASP 54 2.793 -4.602 9.925 236 HB2 ASP 54 HB2 ASP 54 1.546 -7.139 8.883 237 HB3 ASP 54 HB3 ASP 54 2.732 -6.100 8.098 238 H ILE 55 H ILE 55 -0.277 -6.301 10.429 239 HA ILE 55 HA ILE 55 -1.735 -4.721 8.558 240 HB ILE 55 HB ILE 55 -2.884 -6.278 10.870 241 HG12 ILE 55 HG12 ILE 55 -2.233 -7.262 8.084 242 HG13 ILE 55 HG13 ILE 55 -1.335 -7.679 9.539 243 HG21 ILE 55 HG21 ILE 55 -4.861 -6.439 9.479 244 HG22 ILE 55 HG22 ILE 55 -4.415 -4.749 9.703 245 HG23 ILE 55 HG23 ILE 55 -4.048 -5.563 8.183 246 HD11 ILE 55 HD11 ILE 55 -3.464 -8.652 10.442 247 HD12 ILE 55 HD12 ILE 55 -4.153 -8.432 8.833 248 HD13 ILE 55 HD13 ILE 55 -2.763 -9.493 9.059 249 H LEU 56 H LEU 56 -1.191 -4.563 12.036 250 HA LEU 56 HA LEU 56 -3.085 -2.623 12.694 251 HB2 LEU 56 HB2 LEU 56 -0.589 -3.652 13.876 252 HB3 LEU 56 HB3 LEU 56 -1.078 -2.045 14.409 253 HG LEU 56 HG LEU 56 -2.735 -4.557 14.629 254 HD11 LEU 56 HD11 LEU 56 -2.388 -3.982 17.121 255 HD12 LEU 56 HD12 LEU 56 -0.999 -3.059 16.551 256 HD13 LEU 56 HD13 LEU 56 -1.090 -4.792 16.245 257 HD21 LEU 56 HD21 LEU 56 -4.120 -3.038 16.123 258 HD22 LEU 56 HD22 LEU 56 -4.244 -2.769 14.384 259 HD23 LEU 56 HD23 LEU 56 -3.258 -1.694 15.374 260 H GLN 57 H GLN 57 0.225 -2.286 11.497 261 HA GLN 57 HA GLN 57 0.562 0.448 11.792 262 HB2 GLN 57 HB2 GLN 57 1.647 -1.589 9.901 263 HB3 GLN 57 HB3 GLN 57 1.942 0.110 9.555 264 HG2 GLN 57 HG2 GLN 57 2.635 -1.236 12.155 265 HG3 GLN 57 HG3 GLN 57 3.760 -1.006 10.817 266 HE21 GLN 57 HE21 GLN 57 4.712 0.046 12.921 267 HE22 GLN 57 HE22 GLN 57 4.473 1.753 13.029 268 H VAL 58 H VAL 58 -1.294 -1.333 9.429 269 HA VAL 58 HA VAL 58 -1.682 0.845 7.626 270 HB VAL 58 HB VAL 58 -3.481 -1.556 7.919 271 HG11 VAL 58 HG11 VAL 58 -3.087 -0.826 5.236 272 HG12 VAL 58 HG12 VAL 58 -4.548 -0.626 6.207 273 HG13 VAL 58 HG13 VAL 58 -3.359 0.675 6.121 274 HG21 VAL 58 HG21 VAL 58 -0.708 -1.359 6.940 275 HG22 VAL 58 HG22 VAL 58 -1.591 -2.747 7.578 276 HG23 VAL 58 HG23 VAL 58 -1.828 -2.244 5.904 277 H VAL 59 H VAL 59 -3.411 -0.409 10.415 278 HA VAL 59 HA VAL 59 -5.805 1.035 10.084 279 HB VAL 59 HB VAL 59 -4.505 0.078 12.639 280 HG11 VAL 59 HG11 VAL 59 -6.123 1.747 13.189 281 HG12 VAL 59 HG12 VAL 59 -7.301 1.051 12.073 282 HG13 VAL 59 HG13 VAL 59 -6.838 0.172 13.530 283 HG21 VAL 59 HG21 VAL 59 -6.797 -1.422 11.815 284 HG22 VAL 59 HG22 VAL 59 -5.631 -1.358 10.493 285 HG23 VAL 59 HG23 VAL 59 -5.143 -1.973 12.073 286 H ARG 60 H ARG 60 -2.925 1.756 12.054 287 HA ARG 60 HA ARG 60 -3.800 4.228 13.036 288 HB2 ARG 60 HB2 ARG 60 -0.952 3.377 12.474 289 HB3 ARG 60 HB3 ARG 60 -1.459 4.664 13.561 290 HG2 ARG 60 HG2 ARG 60 -2.381 1.847 13.975 291 HG3 ARG 60 HG3 ARG 60 -0.806 2.391 14.558 292 HD2 ARG 60 HD2 ARG 60 -3.458 3.653 15.245 293 HD3 ARG 60 HD3 ARG 60 -2.554 2.551 16.283 294 HE ARG 60 HE ARG 60 -0.809 4.584 15.702 295 HH11 ARG 60 HH11 ARG 60 -3.966 4.341 17.149 296 HH12 ARG 60 HH12 ARG 60 -3.747 5.721 18.173 297 HH21 ARG 60 HH21 ARG 60 -0.508 6.403 17.046 298 HH22 ARG 60 HH22 ARG 60 -1.780 6.893 18.112 299 H TYR 61 H TYR 61 -2.516 3.318 9.951 300 HA TYR 61 HA TYR 61 -1.749 5.954 9.134 301 HB2 TYR 61 HB2 TYR 61 -0.662 4.109 8.065 302 HB3 TYR 61 HB3 TYR 61 -2.201 3.388 7.607 303 HD1 TYR 61 HD2 TYR 61 0.077 6.229 6.948 304 HD2 TYR 61 HD1 TYR 61 -3.290 4.007 5.596 305 HE1 TYR 61 HE2 TYR 61 0.182 7.398 4.787 306 HE2 TYR 61 HE1 TYR 61 -3.195 5.169 3.431 307 HH TYR 61 HH TYR 61 -0.821 7.732 2.824 308 H CYS 62 H CYS 62 -4.475 3.818 8.298 309 HA CYS 62 HA CYS 62 -5.830 5.752 6.735 310 HB2 CYS 62 HB2 CYS 62 -6.801 3.228 8.083 311 HB3 CYS 62 HB3 CYS 62 -7.796 4.202 7.008 312 HG CYS 62 HG CYS 62 -6.105 3.825 4.787 313 H THR 63 H THR 63 -6.208 4.682 10.095 314 HA THR 63 HA THR 63 -8.446 6.184 10.776 315 HB THR 63 HB THR 63 -7.590 6.088 13.124 316 HG1 THR 63 HG1 THR 63 -5.581 5.430 13.522 317 HG21 THR 63 HG21 THR 63 -7.080 3.352 12.493 318 HG22 THR 63 HG22 THR 63 -8.333 3.957 11.410 319 HG23 THR 63 HG23 THR 63 -8.544 4.077 13.157 320 H ASP 64 H ASP 64 -5.149 7.164 10.312 321 HA ASP 64 HA ASP 64 -5.346 9.655 11.700 322 HB2 ASP 64 HB2 ASP 64 -3.361 8.384 9.864 323 HB3 ASP 64 HB3 ASP 64 -3.267 10.123 10.130 324 H LEU 65 H LEU 65 -5.887 8.586 8.403 325 HA LEU 65 HA LEU 65 -5.969 11.063 7.118 326 HB2 LEU 65 HB2 LEU 65 -6.815 8.343 6.565 327 HB3 LEU 65 HB3 LEU 65 -7.910 9.532 5.863 328 HG LEU 65 HG LEU 65 -6.208 10.442 4.503 329 HD11 LEU 65 HD11 LEU 65 -4.421 9.202 6.485 330 HD12 LEU 65 HD12 LEU 65 -4.246 10.701 5.572 331 HD13 LEU 65 HD13 LEU 65 -3.859 9.156 4.814 332 HD21 LEU 65 HD21 LEU 65 -6.436 8.737 3.104 333 HD22 LEU 65 HD22 LEU 65 -6.813 7.661 4.450 334 HD23 LEU 65 HD23 LEU 65 -5.138 7.883 3.939 335 H ILE 66 H ILE 66 -8.362 9.404 9.065 336 HA ILE 66 HA ILE 66 -10.595 10.985 8.373 337 HB ILE 66 HB ILE 66 -9.954 9.296 10.773 338 HG12 ILE 66 HG12 ILE 66 -12.377 8.767 9.233 339 HG13 ILE 66 HG13 ILE 66 -10.924 8.724 8.241 340 HG21 ILE 66 HG21 ILE 66 -12.330 11.082 10.349 341 HG22 ILE 66 HG22 ILE 66 -12.391 9.666 11.397 342 HG23 ILE 66 HG23 ILE 66 -11.269 10.979 11.754 343 HD11 ILE 66 HD11 ILE 66 -11.746 6.958 10.482 344 HD12 ILE 66 HD12 ILE 66 -11.046 6.550 8.914 345 HD13 ILE 66 HD13 ILE 66 -10.027 7.218 10.189 346 H GLU 67 H GLU 67 -8.322 11.201 11.105 347 HA GLU 67 HA GLU 67 -9.487 13.606 12.121 348 HB2 GLU 67 HB2 GLU 67 -6.740 12.499 12.712 349 HB3 GLU 67 HB3 GLU 67 -7.666 13.621 13.698 350 HG2 GLU 67 HG2 GLU 67 -8.572 10.822 13.091 351 HG3 GLU 67 HG3 GLU 67 -7.612 11.251 14.507 352 H GLU 68 H GLU 68 -7.104 12.859 9.740 353 HA GLU 68 HA GLU 68 -6.016 15.559 9.730 354 HB2 GLU 68 HB2 GLU 68 -5.377 13.080 8.135 355 HB3 GLU 68 HB3 GLU 68 -4.642 14.641 7.802 356 HG2 GLU 68 HG2 GLU 68 -4.496 13.305 10.487 357 HG3 GLU 68 HG3 GLU 68 -3.295 13.063 9.220 358 H LYS 69 H LYS 69 -8.623 13.946 8.397 359 HA LYS 69 HA LYS 69 -10.171 14.502 6.825 360 HB2 LYS 69 HB2 LYS 69 -8.734 17.144 6.574 361 HB3 LYS 69 HB3 LYS 69 -10.414 16.799 6.188 362 HG2 LYS 69 HG2 LYS 69 -9.298 16.565 8.967 363 HG3 LYS 69 HG3 LYS 69 -10.000 18.053 8.330 364 HD2 LYS 69 HD2 LYS 69 -11.499 15.454 8.251 365 HD3 LYS 69 HD3 LYS 69 -11.514 16.480 9.686 366 HE2 LYS 69 HE2 LYS 69 -13.312 17.392 8.665 367 HE3 LYS 69 HE3 LYS 69 -12.079 18.315 7.807 368 HZ1 LYS 69 HZ1 LYS 69 -13.992 16.678 6.697 369 HZ2 LYS 69 HZ2 LYS 69 -12.544 15.817 6.540 370 HZ3 LYS 69 HZ3 LYS 69 -12.673 17.379 5.902 371 H ASP 70 H ASP 70 -7.984 13.025 5.976 372 HA ASP 70 HA ASP 70 -7.515 14.081 3.263 373 HB2 ASP 70 HB2 ASP 70 -5.770 12.511 5.123 374 HB3 ASP 70 HB3 ASP 70 -5.566 12.314 3.384 375 H LEU 71 H LEU 71 -9.863 12.658 4.018 376 HA LEU 71 HA LEU 71 -9.810 9.922 3.504 377 HB2 LEU 71 HB2 LEU 71 -12.046 11.751 2.673 378 HB3 LEU 71 HB3 LEU 71 -12.149 10.058 3.151 379 HG LEU 71 HG LEU 71 -11.536 12.390 4.965 380 HD11 LEU 71 HD11 LEU 71 -13.703 12.461 5.506 381 HD12 LEU 71 HD12 LEU 71 -13.858 10.705 5.502 382 HD13 LEU 71 HD13 LEU 71 -13.965 11.602 3.988 383 HD21 LEU 71 HD21 LEU 71 -10.599 10.895 6.315 384 HD22 LEU 71 HD22 LEU 71 -11.033 9.566 5.240 385 HD23 LEU 71 HD23 LEU 71 -12.179 10.125 6.459 386 H GLU 72 H GLU 72 -9.309 12.551 1.383 387 HA GLU 72 HA GLU 72 -10.238 11.681 -1.054 388 HB2 GLU 72 HB2 GLU 72 -9.215 13.843 -0.848 389 HB3 GLU 72 HB3 GLU 72 -7.676 13.130 -0.389 390 HG2 GLU 72 HG2 GLU 72 -7.431 12.178 -2.610 391 HG3 GLU 72 HG3 GLU 72 -8.997 12.839 -3.076 392 H LYS 73 H LYS 73 -7.026 10.986 0.330 393 HA LYS 73 HA LYS 73 -6.439 9.050 -1.716 394 HB2 LYS 73 HB2 LYS 73 -4.348 8.710 -0.527 395 HB3 LYS 73 HB3 LYS 73 -4.672 10.431 -0.690 396 HG2 LYS 73 HG2 LYS 73 -5.783 10.010 1.706 397 HG3 LYS 73 HG3 LYS 73 -4.556 8.742 1.725 398 HD2 LYS 73 HD2 LYS 73 -3.291 11.038 0.717 399 HD3 LYS 73 HD3 LYS 73 -4.253 11.575 2.096 400 HE2 LYS 73 HE2 LYS 73 -2.976 10.461 3.583 401 HE3 LYS 73 HE3 LYS 73 -2.748 9.082 2.510 402 HZ1 LYS 73 HZ1 LYS 73 -0.666 10.215 2.886 403 HZ2 LYS 73 HZ2 LYS 73 -1.316 11.678 2.341 404 HZ3 LYS 73 HZ3 LYS 73 -1.120 10.387 1.266 405 H LEU 74 H LEU 74 -7.905 9.025 1.399 406 HA LEU 74 HA LEU 74 -7.395 6.458 2.305 407 HB2 LEU 74 HB2 LEU 74 -8.616 8.205 3.554 408 HB3 LEU 74 HB3 LEU 74 -10.005 7.955 2.498 409 HG LEU 74 HG LEU 74 -10.200 5.646 3.351 410 HD11 LEU 74 HD11 LEU 74 -8.113 6.449 5.366 411 HD12 LEU 74 HD12 LEU 74 -7.792 5.425 3.968 412 HD13 LEU 74 HD13 LEU 74 -8.919 4.888 5.213 413 HD21 LEU 74 HD21 LEU 74 -11.139 6.229 5.486 414 HD22 LEU 74 HD22 LEU 74 -11.457 7.538 4.348 415 HD23 LEU 74 HD23 LEU 74 -10.178 7.707 5.551 416 H ASP 75 H ASP 75 -10.161 7.509 0.313 417 HA ASP 75 HA ASP 75 -11.240 4.971 -0.127 418 HB2 ASP 75 HB2 ASP 75 -11.574 7.650 -1.239 419 HB3 ASP 75 HB3 ASP 75 -11.838 6.383 -2.433 420 H LEU 76 H LEU 76 -8.534 6.577 -1.594 421 HA LEU 76 HA LEU 76 -8.377 4.854 -3.882 422 HB2 LEU 76 HB2 LEU 76 -6.230 6.605 -2.698 423 HB3 LEU 76 HB3 LEU 76 -6.270 5.936 -4.328 424 HG LEU 76 HG LEU 76 -8.231 7.969 -3.268 425 HD11 LEU 76 HD11 LEU 76 -6.564 8.986 -5.329 426 HD12 LEU 76 HD12 LEU 76 -5.534 8.317 -4.065 427 HD13 LEU 76 HD13 LEU 76 -6.731 9.548 -3.666 428 HD21 LEU 76 HD21 LEU 76 -7.800 6.652 -5.925 429 HD22 LEU 76 HD22 LEU 76 -8.553 8.243 -5.807 430 HD23 LEU 76 HD23 LEU 76 -9.295 6.854 -5.011 431 H VAL 77 H VAL 77 -6.684 5.084 -0.775 432 HA VAL 77 HA VAL 77 -4.932 2.900 -1.266 433 HB VAL 77 HB VAL 77 -5.798 4.133 1.353 434 HG11 VAL 77 HG11 VAL 77 -3.236 2.964 1.536 435 HG12 VAL 77 HG12 VAL 77 -4.713 2.486 2.374 436 HG13 VAL 77 HG13 VAL 77 -4.305 1.759 0.819 437 HG21 VAL 77 HG21 VAL 77 -3.689 4.771 -0.640 438 HG22 VAL 77 HG22 VAL 77 -4.667 5.849 0.355 439 HG23 VAL 77 HG23 VAL 77 -3.308 4.981 1.069 440 H ILE 78 H ILE 78 -8.063 3.214 0.341 441 HA ILE 78 HA ILE 78 -8.190 0.590 1.369 442 HB ILE 78 HB ILE 78 -10.372 2.547 0.661 443 HG12 ILE 78 HG12 ILE 78 -8.875 3.177 2.521 444 HG13 ILE 78 HG13 ILE 78 -10.517 2.868 3.075 445 HG21 ILE 78 HG21 ILE 78 -11.767 0.802 0.712 446 HG22 ILE 78 HG22 ILE 78 -10.539 -0.272 1.379 447 HG23 ILE 78 HG23 ILE 78 -11.468 0.778 2.450 448 HD11 ILE 78 HD11 ILE 78 -8.954 0.464 3.198 449 HD12 ILE 78 HD12 ILE 78 -8.152 1.776 4.063 450 HD13 ILE 78 HD13 ILE 78 -9.803 1.323 4.485 451 H LYS 79 H LYS 79 -9.689 2.001 -1.543 452 HA LYS 79 HA LYS 79 -10.737 -0.422 -2.522 453 HB2 LYS 79 HB2 LYS 79 -11.230 0.753 -4.516 454 HB3 LYS 79 HB3 LYS 79 -11.373 1.935 -3.221 455 HG2 LYS 79 HG2 LYS 79 -10.109 3.215 -4.543 456 HG3 LYS 79 HG3 LYS 79 -8.770 2.241 -3.933 457 HD2 LYS 79 HD2 LYS 79 -8.397 1.984 -6.164 458 HD3 LYS 79 HD3 LYS 79 -9.538 0.657 -5.931 459 HE2 LYS 79 HE2 LYS 79 -11.354 2.371 -6.499 460 HE3 LYS 79 HE3 LYS 79 -10.036 3.381 -7.093 461 HZ1 LYS 79 HZ1 LYS 79 -9.853 0.725 -8.102 462 HZ2 LYS 79 HZ2 LYS 79 -9.911 2.191 -8.944 463 HZ3 LYS 79 HZ3 LYS 79 -11.347 1.420 -8.489 464 H TYR 80 H TYR 80 -7.570 0.962 -2.649 465 HA TYR 80 HA TYR 80 -6.651 -0.668 -4.839 466 HB2 TYR 80 HB2 TYR 80 -5.640 1.517 -4.460 467 HB3 TYR 80 HB3 TYR 80 -5.134 1.029 -2.846 468 HD1 TYR 80 HD1 TYR 80 -3.361 -0.707 -2.587 469 HD2 TYR 80 HD2 TYR 80 -4.359 0.943 -6.380 470 HE1 TYR 80 HE1 TYR 80 -1.232 -1.533 -3.500 471 HE2 TYR 80 HE2 TYR 80 -2.233 0.120 -7.304 472 HH TYR 80 HH TYR 80 -0.035 -0.552 -6.548 473 H MET 81 H MET 81 -6.290 -0.663 -1.314 474 HA MET 81 HA MET 81 -4.635 -2.993 -1.265 475 HB2 MET 81 HB2 MET 81 -4.720 -2.831 1.089 476 HB3 MET 81 HB3 MET 81 -4.749 -1.171 0.508 477 HG2 MET 81 HG2 MET 81 -7.099 -1.003 0.904 478 HG3 MET 81 HG3 MET 81 -7.204 -2.720 1.287 479 HE1 MET 81 HE1 MET 81 -4.889 0.472 3.062 480 HE2 MET 81 HE2 MET 81 -6.332 0.680 2.070 481 HE3 MET 81 HE3 MET 81 -6.448 0.780 3.828 482 H LYS 82 H LYS 82 -8.069 -2.367 -1.071 483 HA LYS 82 HA LYS 82 -8.822 -4.949 -0.138 484 HB2 LYS 82 HB2 LYS 82 -11.026 -4.252 -0.406 485 HB3 LYS 82 HB3 LYS 82 -10.176 -2.738 -0.126 486 HG2 LYS 82 HG2 LYS 82 -11.414 -2.107 -1.909 487 HG3 LYS 82 HG3 LYS 82 -10.034 -2.781 -2.781 488 HD2 LYS 82 HD2 LYS 82 -11.773 -3.820 -3.864 489 HD3 LYS 82 HD3 LYS 82 -11.416 -5.008 -2.607 490 HE2 LYS 82 HE2 LYS 82 -13.267 -4.372 -1.323 491 HE3 LYS 82 HE3 LYS 82 -13.451 -2.844 -2.183 492 HZ1 LYS 82 HZ1 LYS 82 -13.713 -5.277 -3.764 493 HZ2 LYS 82 HZ2 LYS 82 -14.567 -3.820 -3.868 494 HZ3 LYS 82 HZ3 LYS 82 -14.964 -4.950 -2.672 495 H ARG 83 H ARG 83 -8.233 -3.554 -3.289 496 HA ARG 83 HA ARG 83 -9.433 -5.652 -4.798 497 HB2 ARG 83 HB2 ARG 83 -8.833 -4.452 -6.633 498 HB3 ARG 83 HB3 ARG 83 -8.624 -3.179 -5.438 499 HG2 ARG 83 HG2 ARG 83 -6.191 -4.013 -5.295 500 HG3 ARG 83 HG3 ARG 83 -6.543 -4.816 -6.827 501 HD2 ARG 83 HD2 ARG 83 -7.279 -1.952 -6.560 502 HD3 ARG 83 HD3 ARG 83 -5.567 -2.349 -6.708 503 HE ARG 83 HE ARG 83 -7.534 -2.449 -8.771 504 HH11 ARG 83 HH11 ARG 83 -4.593 -3.919 -7.627 505 HH12 ARG 83 HH12 ARG 83 -4.096 -4.457 -9.198 506 HH21 ARG 83 HH21 ARG 83 -6.892 -3.152 -10.843 507 HH22 ARG 83 HH22 ARG 83 -5.405 -4.020 -11.027 508 H LEU 84 H LEU 84 -6.313 -5.162 -3.339 509 HA LEU 84 HA LEU 84 -5.043 -7.299 -4.810 510 HB2 LEU 84 HB2 LEU 84 -4.100 -5.811 -2.364 511 HB3 LEU 84 HB3 LEU 84 -3.122 -6.868 -3.381 512 HG LEU 84 HG LEU 84 -4.408 -4.396 -4.493 513 HD11 LEU 84 HD11 LEU 84 -1.893 -3.583 -4.108 514 HD12 LEU 84 HD12 LEU 84 -2.080 -4.609 -2.687 515 HD13 LEU 84 HD13 LEU 84 -3.192 -3.268 -2.957 516 HD21 LEU 84 HD21 LEU 84 -3.597 -5.792 -6.193 517 HD22 LEU 84 HD22 LEU 84 -2.146 -6.208 -5.279 518 HD23 LEU 84 HD23 LEU 84 -2.329 -4.589 -5.958 519 H MET 85 H MET 85 -5.934 -6.761 -1.399 520 HA MET 85 HA MET 85 -5.294 -9.307 -0.460 521 HB2 MET 85 HB2 MET 85 -7.406 -7.366 0.491 522 HB3 MET 85 HB3 MET 85 -6.920 -8.806 1.377 523 HG2 MET 85 HG2 MET 85 -4.555 -7.844 1.279 524 HG3 MET 85 HG3 MET 85 -5.332 -6.333 0.807 525 HE1 MET 85 HE1 MET 85 -5.000 -4.799 2.267 526 HE2 MET 85 HE2 MET 85 -5.580 -4.682 3.929 527 HE3 MET 85 HE3 MET 85 -4.007 -5.407 3.593 528 H GLN 86 H GLN 86 -8.008 -8.204 -2.308 529 HA GLN 86 HA GLN 86 -9.644 -10.513 -1.743 530 HB2 GLN 86 HB2 GLN 86 -9.899 -8.120 -3.528 531 HB3 GLN 86 HB3 GLN 86 -10.958 -9.504 -3.764 532 HG2 GLN 86 HG2 GLN 86 -11.680 -9.304 -1.412 533 HG3 GLN 86 HG3 GLN 86 -10.686 -7.857 -1.260 534 HE21 GLN 86 HE21 GLN 86 -13.119 -7.367 -0.634 535 HE22 GLN 86 HE22 GLN 86 -14.019 -6.603 -1.895 536 H GLN 87 H GLN 87 -7.636 -9.350 -4.414 537 HA GLN 87 HA GLN 87 -8.185 -11.698 -6.010 538 HB2 GLN 87 HB2 GLN 87 -6.899 -10.679 -7.708 539 HB3 GLN 87 HB3 GLN 87 -7.772 -9.365 -6.933 540 HG2 GLN 87 HG2 GLN 87 -5.646 -9.071 -5.516 541 HG3 GLN 87 HG3 GLN 87 -4.868 -10.056 -6.754 542 HE21 GLN 87 HE21 GLN 87 -3.543 -8.307 -7.322 543 HE22 GLN 87 HE22 GLN 87 -4.143 -6.985 -8.259 544 H SER 88 H SER 88 -6.394 -11.261 -3.348 545 HA SER 88 HA SER 88 -3.865 -12.313 -3.978 546 HB2 SER 88 HB2 SER 88 -3.651 -12.764 -1.583 547 HB3 SER 88 HB3 SER 88 -4.383 -11.181 -1.841 548 HG SER 88 HG SER 88 -5.590 -13.576 -0.973 549 H VAL 89 H VAL 89 -3.246 -14.482 -2.658 550 HA VAL 89 HA VAL 89 -4.844 -16.576 -3.947 551 HB VAL 89 HB VAL 89 -2.535 -16.685 -4.555 552 HG11 VAL 89 HG11 VAL 89 -2.113 -15.844 -1.850 553 HG12 VAL 89 HG12 VAL 89 -1.163 -17.294 -2.178 554 HG13 VAL 89 HG13 VAL 89 -0.978 -15.868 -3.199 555 HG21 VAL 89 HG21 VAL 89 -3.065 -18.797 -2.467 556 HG22 VAL 89 HG22 VAL 89 -3.671 -18.826 -4.122 557 HG23 VAL 89 HG23 VAL 89 -1.937 -18.918 -3.817 558 H GLU 90 H GLU 90 -3.714 -15.469 -0.827 559 HA GLU 90 HA GLU 90 -4.821 -17.811 0.514 560 HB2 GLU 90 HB2 GLU 90 -3.300 -15.418 1.558 561 HB3 GLU 90 HB3 GLU 90 -3.915 -16.710 2.578 562 HG2 GLU 90 HG2 GLU 90 -2.046 -17.230 0.290 563 HG3 GLU 90 HG3 GLU 90 -1.474 -16.823 1.908 564 H SER 91 H SER 91 -6.672 -17.824 1.663 565 HA SER 91 HA SER 91 -8.556 -15.727 1.254 566 HB2 SER 91 HB2 SER 91 -9.913 -17.156 2.946 567 HB3 SER 91 HB3 SER 91 -9.530 -17.851 1.372 568 HG SER 91 HG SER 91 -9.060 -19.328 3.020 569 H VAL 92 H VAL 92 -6.281 -16.484 3.740 570 HA VAL 92 HA VAL 92 -7.432 -15.203 5.941 571 HB VAL 92 HB VAL 92 -5.209 -15.058 6.880 572 HG11 VAL 92 HG11 VAL 92 -4.899 -17.294 7.112 573 HG12 VAL 92 HG12 VAL 92 -6.455 -17.342 6.280 574 HG13 VAL 92 HG13 VAL 92 -4.962 -17.595 5.375 575 HG21 VAL 92 HG21 VAL 92 -4.374 -15.322 4.029 576 HG22 VAL 92 HG22 VAL 92 -3.777 -14.232 5.281 577 HG23 VAL 92 HG23 VAL 92 -3.313 -15.933 5.298 578 H TRP 93 H TRP 93 -5.987 -13.914 3.082 579 HA TRP 93 HA TRP 93 -5.312 -11.347 4.088 580 HB2 TRP 93 HB2 TRP 93 -5.519 -12.628 1.431 581 HB3 TRP 93 HB3 TRP 93 -5.721 -10.878 1.453 582 HD1 TRP 93 HD1 TRP 93 -3.112 -13.172 0.784 583 HE1 TRP 93 HE1 TRP 93 -0.784 -12.246 1.371 584 HE3 TRP 93 HE3 TRP 93 -4.518 -9.282 3.790 585 HZ2 TRP 93 HZ2 TRP 93 0.312 -10.146 2.906 586 HZ3 TRP 93 HZ3 TRP 93 -2.768 -7.863 4.779 587 HH2 TRP 93 HH2 TRP 93 -0.403 -8.288 4.344 588 H ASN 94 H ASN 94 -8.227 -12.735 2.704 589 HA ASN 94 HA ASN 94 -9.673 -10.412 2.195 590 HB2 ASN 94 HB2 ASN 94 -10.449 -13.223 2.894 591 HB3 ASN 94 HB3 ASN 94 -11.690 -11.977 2.789 592 HD21 ASN 94 HD21 ASN 94 -8.750 -12.503 0.891 593 HD22 ASN 94 HD22 ASN 94 -9.551 -12.635 -0.634 594 H MET 95 H MET 95 -9.258 -12.225 5.197 595 HA MET 95 HA MET 95 -11.106 -10.654 6.699 596 HB2 MET 95 HB2 MET 95 -8.830 -12.281 7.825 597 HB3 MET 95 HB3 MET 95 -10.350 -11.864 8.606 598 HG2 MET 95 HG2 MET 95 -11.412 -13.211 6.653 599 HG3 MET 95 HG3 MET 95 -9.799 -13.905 6.505 600 HE1 MET 95 HE1 MET 95 -8.580 -15.029 8.031 601 HE2 MET 95 HE2 MET 95 -9.061 -15.710 9.586 602 HE3 MET 95 HE3 MET 95 -9.548 -16.502 8.085 603 H ALA 96 H ALA 96 -7.659 -10.502 6.064 604 HA ALA 96 HA ALA 96 -6.825 -8.747 8.035 605 HB1 ALA 96 HB1 ALA 96 -5.329 -9.885 6.439 606 HB2 ALA 96 HB2 ALA 96 -5.876 -8.784 5.173 607 HB3 ALA 96 HB3 ALA 96 -4.998 -8.158 6.568 608 H PHE 97 H PHE 97 -8.212 -7.992 4.851 609 HA PHE 97 HA PHE 97 -8.033 -5.207 5.022 610 HB2 PHE 97 HB2 PHE 97 -8.531 -6.318 2.920 611 HB3 PHE 97 HB3 PHE 97 -10.052 -6.925 3.566 612 HD1 PHE 97 HD2 PHE 97 -8.492 -3.545 3.694 613 HD2 PHE 97 HD1 PHE 97 -11.761 -5.936 2.385 614 HE1 PHE 97 HE2 PHE 97 -9.639 -1.525 2.879 615 HE2 PHE 97 HE1 PHE 97 -12.912 -3.921 1.566 616 HZ PHE 97 HZ PHE 97 -11.852 -1.712 1.813 617 H ASP 98 H ASP 98 -10.537 -7.435 6.124 618 HA ASP 98 HA ASP 98 -12.412 -5.457 6.892 619 HB2 ASP 98 HB2 ASP 98 -13.216 -7.678 6.579 620 HB3 ASP 98 HB3 ASP 98 -12.038 -8.337 7.710 621 H PHE 99 H PHE 99 -9.735 -7.021 8.548 622 HA PHE 99 HA PHE 99 -10.285 -6.229 11.165 623 HB2 PHE 99 HB2 PHE 99 -8.557 -7.812 10.866 624 HB3 PHE 99 HB3 PHE 99 -7.704 -6.787 9.717 625 HD1 PHE 99 HD2 PHE 99 -8.397 -7.421 13.249 626 HD2 PHE 99 HD1 PHE 99 -6.298 -4.976 10.468 627 HE1 PHE 99 HE2 PHE 99 -7.002 -6.544 15.077 628 HE2 PHE 99 HE1 PHE 99 -4.900 -4.097 12.291 629 HZ PHE 99 HZ PHE 99 -5.250 -4.881 14.599 630 H ILE 100 H ILE 100 -8.396 -4.573 8.652 631 HA ILE 100 HA ILE 100 -7.702 -2.331 10.213 632 HB ILE 100 HB ILE 100 -7.996 -2.523 7.213 633 HG12 ILE 100 HG12 ILE 100 -5.328 -2.482 8.477 634 HG13 ILE 100 HG13 ILE 100 -6.273 -3.937 8.774 635 HG21 ILE 100 HG21 ILE 100 -7.676 -0.320 7.233 636 HG22 ILE 100 HG22 ILE 100 -7.352 -0.314 8.966 637 HG23 ILE 100 HG23 ILE 100 -6.048 -0.647 7.827 638 HD11 ILE 100 HD11 ILE 100 -6.345 -4.490 6.514 639 HD12 ILE 100 HD12 ILE 100 -5.891 -2.863 6.007 640 HD13 ILE 100 HD13 ILE 100 -4.698 -3.913 6.770 641 H LEU 101 H LEU 101 -10.449 -2.992 8.096 642 HA LEU 101 HA LEU 101 -11.552 -0.379 8.211 643 HB2 LEU 101 HB2 LEU 101 -12.727 -3.061 7.528 644 HB3 LEU 101 HB3 LEU 101 -13.658 -1.567 7.461 645 HG LEU 101 HG LEU 101 -11.116 -1.834 5.901 646 HD11 LEU 101 HD11 LEU 101 -13.419 -3.480 5.560 647 HD12 LEU 101 HD12 LEU 101 -11.944 -3.420 4.596 648 HD13 LEU 101 HD13 LEU 101 -13.300 -2.364 4.200 649 HD21 LEU 101 HD21 LEU 101 -12.430 -0.305 4.386 650 HD22 LEU 101 HD22 LEU 101 -11.996 0.363 5.960 651 HD23 LEU 101 HD23 LEU 101 -13.639 -0.212 5.667 652 H ASP 102 H ASP 102 -11.891 -3.254 10.189 653 HA ASP 102 HA ASP 102 -14.164 -2.521 11.653 654 HB2 ASP 102 HB2 ASP 102 -12.726 -4.743 11.594 655 HB3 ASP 102 HB3 ASP 102 -11.950 -4.009 12.994 656 H ASN 103 H ASN 103 -10.846 -1.498 11.878 657 HA ASN 103 HA ASN 103 -11.371 -0.095 14.394 658 HB2 ASN 103 HB2 ASN 103 -8.831 -0.658 12.862 659 HB3 ASN 103 HB3 ASN 103 -8.884 0.417 14.255 660 HD21 ASN 103 HD21 ASN 103 -9.191 -2.867 13.151 661 HD22 ASN 103 HD22 ASN 103 -9.058 -3.612 14.704 662 H VAL 104 H VAL 104 -10.549 0.478 11.022 663 HA VAL 104 HA VAL 104 -10.233 3.308 11.312 664 HB VAL 104 HB VAL 104 -10.660 1.610 8.851 665 HG11 VAL 104 HG11 VAL 104 -9.568 3.798 7.841 666 HG12 VAL 104 HG12 VAL 104 -11.315 3.638 8.031 667 HG13 VAL 104 HG13 VAL 104 -10.376 4.545 9.217 668 HG21 VAL 104 HG21 VAL 104 -8.348 1.643 8.550 669 HG22 VAL 104 HG22 VAL 104 -8.125 2.987 9.670 670 HG23 VAL 104 HG23 VAL 104 -8.536 1.387 10.285 671 H GLN 105 H GLN 105 -12.718 1.366 9.638 672 HA GLN 105 HA GLN 105 -14.507 3.365 9.056 673 HB2 GLN 105 HB2 GLN 105 -15.230 0.569 9.948 674 HB3 GLN 105 HB3 GLN 105 -16.238 1.650 8.996 675 HG2 GLN 105 HG2 GLN 105 -13.548 0.696 8.067 676 HG3 GLN 105 HG3 GLN 105 -15.043 -0.176 7.737 677 HE21 GLN 105 HE21 GLN 105 -13.249 2.759 7.151 678 HE22 GLN 105 HE22 GLN 105 -14.135 3.254 5.753 679 H VAL 106 H VAL 106 -13.866 1.865 12.133 680 HA VAL 106 HA VAL 106 -16.214 2.751 13.468 681 HB VAL 106 HB VAL 106 -13.560 1.707 14.377 682 HG11 VAL 106 HG11 VAL 106 -15.568 3.180 16.033 683 HG12 VAL 106 HG12 VAL 106 -14.630 1.862 16.738 684 HG13 VAL 106 HG13 VAL 106 -13.807 3.271 16.065 685 HG21 VAL 106 HG21 VAL 106 -14.825 -0.113 15.201 686 HG22 VAL 106 HG22 VAL 106 -16.341 0.778 15.060 687 HG23 VAL 106 HG23 VAL 106 -15.488 0.254 13.608 688 H VAL 107 H VAL 107 -12.856 3.952 13.522 689 HA VAL 107 HA VAL 107 -13.463 6.257 15.062 690 HB VAL 107 HB VAL 107 -11.201 5.398 15.016 691 HG11 VAL 107 HG11 VAL 107 -10.842 4.446 12.943 692 HG12 VAL 107 HG12 VAL 107 -11.458 5.851 12.074 693 HG13 VAL 107 HG13 VAL 107 -9.871 5.914 12.841 694 HG21 VAL 107 HG21 VAL 107 -11.389 8.117 13.724 695 HG22 VAL 107 HG22 VAL 107 -11.473 7.775 15.452 696 HG23 VAL 107 HG23 VAL 107 -9.978 7.480 14.567 697 H LEU 108 H LEU 108 -13.650 5.525 11.686 698 HA LEU 108 HA LEU 108 -13.621 8.226 10.751 699 HB2 LEU 108 HB2 LEU 108 -13.413 7.216 8.793 700 HB3 LEU 108 HB3 LEU 108 -13.578 5.663 9.611 701 HG LEU 108 HG LEU 108 -16.083 5.930 9.301 702 HD11 LEU 108 HD11 LEU 108 -15.163 8.414 8.150 703 HD12 LEU 108 HD12 LEU 108 -16.797 7.902 8.568 704 HD13 LEU 108 HD13 LEU 108 -16.116 7.480 6.997 705 HD21 LEU 108 HD21 LEU 108 -15.124 5.807 6.569 706 HD22 LEU 108 HD22 LEU 108 -15.842 4.546 7.573 707 HD23 LEU 108 HD23 LEU 108 -14.111 4.873 7.670 708 H GLN 109 H GLN 109 -16.131 5.903 11.618 709 HA GLN 109 HA GLN 109 -18.330 7.444 10.736 710 HB2 GLN 109 HB2 GLN 109 -17.979 5.128 12.593 711 HB3 GLN 109 HB3 GLN 109 -19.517 5.979 12.576 712 HG2 GLN 109 HG2 GLN 109 -19.850 5.480 10.268 713 HG3 GLN 109 HG3 GLN 109 -18.219 4.828 10.121 714 HE21 GLN 109 HE21 GLN 109 -17.887 3.144 12.085 715 HE22 GLN 109 HE22 GLN 109 -19.078 1.893 12.092 716 H GLN 110 H GLN 110 -16.647 7.219 13.836 717 HA GLN 110 HA GLN 110 -18.419 8.848 15.304 718 HB2 GLN 110 HB2 GLN 110 -15.483 8.257 15.700 719 HB3 GLN 110 HB3 GLN 110 -16.473 9.128 16.864 720 HG2 GLN 110 HG2 GLN 110 -17.994 7.044 16.776 721 HG3 GLN 110 HG3 GLN 110 -16.587 6.251 16.070 722 HE21 GLN 110 HE21 GLN 110 -15.359 5.237 17.468 723 HE22 GLN 110 HE22 GLN 110 -15.148 5.644 19.133 724 H THR 111 H THR 111 -16.225 9.598 12.839 725 HA THR 111 HA THR 111 -15.875 12.367 13.708 726 HB THR 111 HB THR 111 -14.732 10.880 11.337 727 HG1 THR 111 HG1 THR 111 -13.610 11.793 13.793 728 HG21 THR 111 HG21 THR 111 -13.227 12.973 11.277 729 HG22 THR 111 HG22 THR 111 -14.516 13.749 12.196 730 HG23 THR 111 HG23 THR 111 -14.848 13.093 10.593 731 H TYR 112 H TYR 112 -16.856 10.711 10.699 732 HA TYR 112 HA TYR 112 -18.508 13.051 10.044 733 HB2 TYR 112 HB2 TYR 112 -17.842 10.817 8.141 734 HB3 TYR 112 HB3 TYR 112 -18.319 12.470 7.770 735 HD1 TYR 112 HD2 TYR 112 -16.702 14.286 7.871 736 HD2 TYR 112 HD1 TYR 112 -15.552 10.282 8.738 737 HE1 TYR 112 HE2 TYR 112 -14.337 14.927 7.663 738 HE2 TYR 112 HE1 TYR 112 -13.183 10.912 8.534 739 HH TYR 112 HH TYR 112 -11.751 12.697 8.468 740 H GLY 113 H GLY 113 -18.586 9.513 10.229 741 HA2 GLY 113 HA2 GLY 113 -20.552 8.478 11.232 742 HA3 GLY 113 HA3 GLY 113 -21.527 9.697 10.423 743 H SER 114 H SER 114 -19.535 9.181 8.066 744 HA SER 114 HA SER 114 -21.202 7.102 6.871 745 HB2 SER 114 HB2 SER 114 -20.539 9.442 5.826 746 HB3 SER 114 HB3 SER 114 -19.097 8.557 5.325 747 HG SER 114 HG SER 114 -21.789 7.852 4.757 748 H THR 115 H THR 115 -19.657 6.002 4.976 749 HA THR 115 HA THR 115 -17.169 5.052 6.127 750 HB THR 115 HB THR 115 -17.796 2.668 5.964 751 HG1 THR 115 HG1 THR 115 -19.532 2.682 4.580 752 HG21 THR 115 HG21 THR 115 -19.757 4.041 7.784 753 HG22 THR 115 HG22 THR 115 -18.020 4.068 8.094 754 HG23 THR 115 HG23 THR 115 -18.884 2.532 8.045 755 H LEU 116 H LEU 116 -16.354 3.146 4.598 756 HA LEU 116 HA LEU 116 -16.168 4.322 1.985 757 HB2 LEU 116 HB2 LEU 116 -14.657 2.514 3.560 758 HB3 LEU 116 HB3 LEU 116 -15.053 1.701 2.048 759 HG LEU 116 HG LEU 116 -12.849 2.867 2.059 760 HD11 LEU 116 HD11 LEU 116 -13.037 3.661 -0.151 761 HD12 LEU 116 HD12 LEU 116 -14.734 4.086 0.062 762 HD13 LEU 116 HD13 LEU 116 -14.251 2.392 0.006 763 HD21 LEU 116 HD21 LEU 116 -13.762 4.812 3.432 764 HD22 LEU 116 HD22 LEU 116 -14.418 5.424 1.913 765 HD23 LEU 116 HD23 LEU 116 -12.678 5.206 2.097 766 H LYS 117 H LYS 117 -16.625 3.226 -0.007 767 HA LYS 117 HA LYS 117 -18.897 1.366 0.223 768 HB2 LYS 117 HB2 LYS 117 -19.563 3.481 -0.757 769 HB3 LYS 117 HB3 LYS 117 -18.253 3.389 -1.928 770 HG2 LYS 117 HG2 LYS 117 -20.088 1.100 -1.947 771 HG3 LYS 117 HG3 LYS 117 -20.805 2.643 -2.416 772 HD2 LYS 117 HD2 LYS 117 -19.834 2.526 -4.413 773 HD3 LYS 117 HD3 LYS 117 -18.244 2.360 -3.667 774 HE2 LYS 117 HE2 LYS 117 -18.312 0.050 -3.733 775 HE3 LYS 117 HE3 LYS 117 -20.073 0.001 -3.806 776 HZ1 LYS 117 HZ1 LYS 117 -19.892 -0.211 -5.988 777 HZ2 LYS 117 HZ2 LYS 117 -18.214 -0.013 -5.930 778 HZ3 LYS 117 HZ3 LYS 117 -19.220 1.339 -6.077 779 H VAL 118 H VAL 118 -17.949 -0.606 0.060 780 HA VAL 118 HA VAL 118 -16.238 -1.090 -2.291 781 HB VAL 118 HB VAL 118 -15.493 -3.152 -1.013 782 HG11 VAL 118 HG11 VAL 118 -14.443 -0.690 -1.136 783 HG12 VAL 118 HG12 VAL 118 -14.663 -0.825 0.609 784 HG13 VAL 118 HG13 VAL 118 -13.689 -2.016 -0.252 785 HG21 VAL 118 HG21 VAL 118 -16.044 -1.965 1.572 786 HG22 VAL 118 HG22 VAL 118 -17.524 -2.399 0.717 787 HG23 VAL 118 HG23 VAL 118 -16.288 -3.621 1.016 788 H THR 119 H THR 119 -17.369 -1.987 -3.881 789 HA THR 119 HA THR 119 -19.797 -3.418 -3.477 790 HB THR 119 HB THR 119 -19.448 -2.176 -5.538 791 HG1 THR 119 HG1 THR 119 -20.363 -3.692 -6.813 792 HG21 THR 119 HG21 THR 119 -17.623 -4.093 -6.782 793 HG22 THR 119 HG22 THR 119 -16.888 -3.165 -5.474 794 HG23 THR 119 HG23 THR 119 -17.627 -2.330 -6.840 795 H LYS 207 H LYS 207 8.712 -5.743 16.523 796 HA LYS 207 HA LYS 207 9.741 -6.860 14.137 797 HB2 LYS 207 HB2 LYS 207 9.495 -8.273 16.050 798 HB3 LYS 207 HB3 LYS 207 7.781 -7.900 16.181 799 HG2 LYS 207 HG2 LYS 207 8.187 -10.139 15.273 800 HG3 LYS 207 HG3 LYS 207 7.323 -9.101 14.136 801 HD2 LYS 207 HD2 LYS 207 9.058 -10.384 12.999 802 HD3 LYS 207 HD3 LYS 207 9.423 -8.657 12.954 803 HE2 LYS 207 HE2 LYS 207 11.424 -9.944 13.457 804 HE3 LYS 207 HE3 LYS 207 10.968 -8.941 14.833 805 HZ1 LYS 207 HZ1 LYS 207 9.932 -11.668 14.767 806 HZ2 LYS 207 HZ2 LYS 207 10.437 -10.736 16.084 807 HZ3 LYS 207 HZ3 LYS 207 11.583 -11.482 15.089 808 H SER 208 H SER 208 8.980 -6.293 12.200 809 HA SER 208 HA SER 208 6.450 -7.059 11.299 810 HB2 SER 208 HB2 SER 208 5.182 -5.381 12.130 811 HB3 SER 208 HB3 SER 208 6.583 -4.368 12.475 812 HG SER 208 HG SER 208 4.941 -3.819 10.681 813 H PHE 209 H PHE 209 6.034 -6.390 9.062 814 HA PHE 209 HA PHE 209 8.412 -6.415 7.525 815 HB2 PHE 209 HB2 PHE 209 6.444 -7.476 6.645 816 HB3 PHE 209 HB3 PHE 209 5.525 -5.979 6.752 817 HD1 PHE 209 HD2 PHE 209 8.525 -7.435 5.099 818 HD2 PHE 209 HD1 PHE 209 5.338 -4.622 4.893 819 HE1 PHE 209 HE2 PHE 209 9.162 -6.887 2.786 820 HE2 PHE 209 HE1 PHE 209 5.969 -4.070 2.580 821 HZ PHE 209 HZ PHE 209 7.883 -5.204 1.524 822 H PHE 210 H PHE 210 5.845 -3.947 7.745 823 HA PHE 210 HA PHE 210 7.163 -1.977 6.272 824 HB2 PHE 210 HB2 PHE 210 5.131 -1.680 8.494 825 HB3 PHE 210 HB3 PHE 210 5.622 -0.381 7.412 826 HD1 PHE 210 HD1 PHE 210 5.457 -1.050 4.829 827 HD2 PHE 210 HD2 PHE 210 3.196 -2.791 7.987 828 HE1 PHE 210 HE1 PHE 210 3.737 -1.744 3.212 829 HE2 PHE 210 HE2 PHE 210 1.474 -3.488 6.376 830 HZ PHE 210 HZ PHE 210 1.743 -2.966 3.984 831 H ASP 211 H ASP 211 7.599 -3.027 9.537 832 HA ASP 211 HA ASP 211 8.951 -0.674 10.455 833 HB2 ASP 211 HB2 ASP 211 7.780 -2.709 11.755 834 HB3 ASP 211 HB3 ASP 211 9.445 -3.282 11.788 835 H LYS 212 H LYS 212 9.969 -3.872 9.314 836 HA LYS 212 HA LYS 212 12.763 -3.300 9.611 837 HB2 LYS 212 HB2 LYS 212 13.126 -5.441 8.536 838 HB3 LYS 212 HB3 LYS 212 11.851 -5.597 9.737 839 HG2 LYS 212 HG2 LYS 212 10.164 -5.627 8.052 840 HG3 LYS 212 HG3 LYS 212 11.336 -5.213 6.798 841 HD2 LYS 212 HD2 LYS 212 11.468 -7.730 8.451 842 HD3 LYS 212 HD3 LYS 212 10.681 -7.633 6.875 843 HE2 LYS 212 HE2 LYS 212 12.901 -6.734 6.006 844 HE3 LYS 212 HE3 LYS 212 13.591 -7.270 7.537 845 HZ1 LYS 212 HZ1 LYS 212 12.370 -9.483 6.846 846 HZ2 LYS 212 HZ2 LYS 212 13.929 -9.122 6.298 847 HZ3 LYS 212 HZ3 LYS 212 12.595 -8.853 5.292 848 H LYS 213 H LYS 213 10.385 -2.758 7.182 849 HA LYS 213 HA LYS 213 12.302 -2.437 5.036 850 HB2 LYS 213 HB2 LYS 213 9.631 -3.053 5.100 851 HB3 LYS 213 HB3 LYS 213 9.601 -1.359 4.631 852 HG2 LYS 213 HG2 LYS 213 11.343 -3.358 3.229 853 HG3 LYS 213 HG3 LYS 213 9.657 -3.098 2.774 854 HD2 LYS 213 HD2 LYS 213 11.189 -0.626 3.058 855 HD3 LYS 213 HD3 LYS 213 11.807 -1.699 1.802 856 HE2 LYS 213 HE2 LYS 213 9.176 -1.836 1.271 857 HE3 LYS 213 HE3 LYS 213 9.257 -0.213 1.954 858 HZ1 LYS 213 HZ1 LYS 213 10.409 0.562 0.202 859 HZ2 LYS 213 HZ2 LYS 213 9.715 -0.751 -0.606 860 HZ3 LYS 213 HZ3 LYS 213 11.294 -0.864 -0.010 861 H ARG 214 H ARG 214 10.214 -0.363 7.014 862 HA ARG 214 HA ARG 214 10.883 2.076 5.789 863 HB2 ARG 214 HB2 ARG 214 9.880 3.140 7.672 864 HB3 ARG 214 HB3 ARG 214 8.966 1.669 7.366 865 HG2 ARG 214 HG2 ARG 214 10.097 0.548 9.189 866 HG3 ARG 214 HG3 ARG 214 11.105 1.971 9.464 867 HD2 ARG 214 HD2 ARG 214 9.345 1.984 11.081 868 HD3 ARG 214 HD3 ARG 214 9.028 3.269 9.917 869 HE ARG 214 HE ARG 214 7.713 0.794 9.287 870 HH11 ARG 214 HH11 ARG 214 7.512 3.759 11.101 871 HH12 ARG 214 HH12 ARG 214 5.781 3.739 11.192 872 HH21 ARG 214 HH21 ARG 214 5.435 0.756 9.401 873 HH22 ARG 214 HH22 ARG 214 4.601 2.030 10.225 874 H SER 215 H SER 215 12.456 0.192 8.286 875 HA SER 215 HA SER 215 14.159 2.054 9.407 876 HB2 SER 215 HB2 SER 215 14.500 0.105 10.507 877 HB3 SER 215 HB3 SER 215 14.155 -0.871 9.078 878 HG SER 215 HG SER 215 16.288 -1.163 9.473 879 H GLU 216 H GLU 216 14.720 0.064 6.510 880 HA GLU 216 HA GLU 216 17.264 1.141 5.918 881 HB2 GLU 216 HB2 GLU 216 15.219 -0.372 4.322 882 HB3 GLU 216 HB3 GLU 216 16.663 0.266 3.550 883 HG2 GLU 216 HG2 GLU 216 17.023 -1.336 6.015 884 HG3 GLU 216 HG3 GLU 216 16.546 -2.184 4.545 885 H ARG 217 H ARG 217 14.003 2.128 5.108 886 HA ARG 217 HA ARG 217 14.705 3.997 3.089 887 HB2 ARG 217 HB2 ARG 217 12.413 2.980 3.512 888 HB3 ARG 217 HB3 ARG 217 12.254 4.119 4.843 889 HG2 ARG 217 HG2 ARG 217 12.751 5.927 3.094 890 HG3 ARG 217 HG3 ARG 217 12.397 4.673 1.904 891 HD2 ARG 217 HD2 ARG 217 10.361 4.640 3.895 892 HD3 ARG 217 HD3 ARG 217 10.582 6.302 3.349 893 HE ARG 217 HE ARG 217 9.703 5.718 1.314 894 HH11 ARG 217 HH11 ARG 217 10.503 2.835 3.096 895 HH12 ARG 217 HH12 ARG 217 9.729 1.768 1.970 896 HH21 ARG 217 HH21 ARG 217 8.681 4.323 -0.174 897 HH22 ARG 217 HH22 ARG 217 8.694 2.616 0.111 898 H ILE 218 H ILE 218 14.164 4.259 6.574 899 HA ILE 218 HA ILE 218 14.256 7.025 6.839 900 HB ILE 218 HB ILE 218 15.295 4.950 8.773 901 HG12 ILE 218 HG12 ILE 218 12.700 6.336 9.169 902 HG13 ILE 218 HG13 ILE 218 12.762 5.138 7.881 903 HG21 ILE 218 HG21 ILE 218 16.205 6.981 9.494 904 HG22 ILE 218 HG22 ILE 218 14.756 7.887 9.057 905 HG23 ILE 218 HG23 ILE 218 14.731 6.802 10.446 906 HD11 ILE 218 HD11 ILE 218 12.562 4.762 10.714 907 HD12 ILE 218 HD12 ILE 218 12.399 3.584 9.410 908 HD13 ILE 218 HD13 ILE 218 13.989 3.939 10.086 909 H SER 219 H SER 219 16.886 4.676 6.666 910 HA SER 219 HA SER 219 18.954 6.566 7.204 911 HB2 SER 219 HB2 SER 219 19.421 4.263 7.656 912 HB3 SER 219 HB3 SER 219 18.986 3.787 6.015 913 HG SER 219 HG SER 219 21.294 3.973 6.462 914 H ASN 220 H ASN 220 20.118 7.814 5.849 915 HA ASN 220 HA ASN 220 19.129 8.611 3.392 916 HB2 ASN 220 HB2 ASN 220 21.286 9.726 3.043 917 HB3 ASN 220 HB3 ASN 220 20.730 9.939 4.701 918 HD21 ASN 220 HD21 ASN 220 22.017 9.338 6.317 919 HD22 ASN 220 HD22 ASN 220 23.507 8.482 6.134 Start of MODEL 20 1 H ALA 23 H ALA 23 3.946 15.410 12.114 2 HA ALA 23 HA ALA 23 3.832 12.524 12.612 3 HB1 ALA 23 HB1 ALA 23 3.502 14.156 14.488 4 HB2 ALA 23 HB2 ALA 23 1.994 14.640 13.712 5 HB3 ALA 23 HB3 ALA 23 2.201 12.983 14.281 6 H ALA 24 H ALA 24 3.315 13.788 9.978 7 HA ALA 24 HA ALA 24 0.514 13.734 9.476 8 HB1 ALA 24 HB1 ALA 24 2.953 14.141 7.934 9 HB2 ALA 24 HB2 ALA 24 1.694 13.292 7.037 10 HB3 ALA 24 HB3 ALA 24 1.358 14.870 7.749 11 HA PRO 25 HA PRO 25 -0.339 9.474 8.860 12 HB2 PRO 25 HB2 PRO 25 -1.989 9.513 6.704 13 HB3 PRO 25 HB3 PRO 25 -2.484 10.082 8.303 14 HG2 PRO 25 HG2 PRO 25 -1.560 11.661 5.933 15 HG3 PRO 25 HG3 PRO 25 -2.900 11.994 7.046 16 HD2 PRO 25 HD2 PRO 25 -0.503 13.236 7.241 17 HD3 PRO 25 HD3 PRO 25 -1.509 12.874 8.659 18 H ASN 26 H ASN 26 1.751 8.728 8.283 19 HA ASN 26 HA ASN 26 2.077 8.239 5.398 20 HB2 ASN 26 HB2 ASN 26 4.447 8.446 7.226 21 HB3 ASN 26 HB3 ASN 26 4.367 8.670 5.481 22 HD21 ASN 26 HD21 ASN 26 2.320 10.443 5.220 23 HD22 ASN 26 HD22 ASN 26 2.743 11.944 5.965 24 H LEU 27 H LEU 27 2.778 6.214 4.782 25 HA LEU 27 HA LEU 27 2.568 4.153 6.847 26 HB2 LEU 27 HB2 LEU 27 1.312 4.227 4.549 27 HB3 LEU 27 HB3 LEU 27 2.822 3.558 3.933 28 HG LEU 27 HG LEU 27 2.579 1.641 5.446 29 HD11 LEU 27 HD11 LEU 27 1.378 2.562 7.273 30 HD12 LEU 27 HD12 LEU 27 0.345 1.329 6.548 31 HD13 LEU 27 HD13 LEU 27 0.033 3.036 6.236 32 HD21 LEU 27 HD21 LEU 27 1.694 1.508 3.177 33 HD22 LEU 27 HD22 LEU 27 0.151 2.160 3.731 34 HD23 LEU 27 HD23 LEU 27 0.699 0.582 4.301 35 H ALA 28 H ALA 28 4.465 3.757 7.805 36 HA ALA 28 HA ALA 28 6.652 3.203 8.120 37 HB1 ALA 28 HB1 ALA 28 6.372 1.191 7.043 38 HB2 ALA 28 HB2 ALA 28 6.003 1.947 5.492 39 HB3 ALA 28 HB3 ALA 28 7.664 1.912 6.084 40 H GLY 29 H GLY 29 6.209 5.847 7.319 41 HA2 GLY 29 HA2 GLY 29 7.708 7.598 6.920 42 HA3 GLY 29 HA3 GLY 29 8.820 6.449 6.191 43 H ALA 30 H ALA 30 5.894 5.822 4.850 44 HA ALA 30 HA ALA 30 6.598 7.283 2.430 45 HB1 ALA 30 HB1 ALA 30 6.087 4.896 2.261 46 HB2 ALA 30 HB2 ALA 30 4.464 5.200 2.882 47 HB3 ALA 30 HB3 ALA 30 4.952 5.869 1.325 48 H VAL 31 H VAL 31 5.851 9.296 2.278 49 HA VAL 31 HA VAL 31 3.304 10.017 3.501 50 HB VAL 31 HB VAL 31 5.237 11.818 2.041 51 HG11 VAL 31 HG11 VAL 31 3.581 12.925 4.171 52 HG12 VAL 31 HG12 VAL 31 3.876 13.521 2.538 53 HG13 VAL 31 HG13 VAL 31 2.648 12.286 2.819 54 HG21 VAL 31 HG21 VAL 31 6.624 11.602 3.764 55 HG22 VAL 31 HG22 VAL 31 5.374 12.286 4.804 56 HG23 VAL 31 HG23 VAL 31 5.492 10.538 4.599 57 H GLU 32 H GLU 32 4.843 9.913 0.317 58 HA GLU 32 HA GLU 32 2.619 10.995 -1.090 59 HB2 GLU 32 HB2 GLU 32 4.850 9.259 -2.158 60 HB3 GLU 32 HB3 GLU 32 3.783 10.287 -3.104 61 HG2 GLU 32 HG2 GLU 32 5.615 11.354 -0.977 62 HG3 GLU 32 HG3 GLU 32 6.095 11.179 -2.665 63 H PHE 33 H PHE 33 0.868 10.033 -1.944 64 HA PHE 33 HA PHE 33 -0.091 7.618 -1.018 65 HB2 PHE 33 HB2 PHE 33 -1.659 9.110 -1.962 66 HB3 PHE 33 HB3 PHE 33 -0.768 9.221 -3.476 67 HD1 PHE 33 HD1 PHE 33 -2.792 6.925 -1.389 68 HD2 PHE 33 HD2 PHE 33 -1.256 7.797 -5.261 69 HE1 PHE 33 HE1 PHE 33 -4.207 5.155 -2.345 70 HE2 PHE 33 HE2 PHE 33 -2.670 6.029 -6.224 71 HZ PHE 33 HZ PHE 33 -4.147 4.703 -4.766 72 H SER 34 H SER 34 1.467 8.275 -4.148 73 HA SER 34 HA SER 34 1.320 5.761 -5.272 74 HB2 SER 34 HB2 SER 34 2.241 7.153 -6.809 75 HB3 SER 34 HB3 SER 34 3.084 8.106 -5.588 76 HG SER 34 HG SER 34 4.554 6.955 -6.883 77 H ASP 35 H ASP 35 3.598 6.982 -2.881 78 HA ASP 35 HA ASP 35 5.260 4.653 -2.911 79 HB2 ASP 35 HB2 ASP 35 5.071 7.133 -1.272 80 HB3 ASP 35 HB3 ASP 35 5.909 5.752 -0.568 81 H VAL 36 H VAL 36 2.404 5.652 -1.187 82 HA VAL 36 HA VAL 36 2.582 3.721 0.904 83 HB VAL 36 HB VAL 36 0.165 5.202 -0.143 84 HG11 VAL 36 HG11 VAL 36 -1.033 3.902 1.201 85 HG12 VAL 36 HG12 VAL 36 0.421 3.092 1.789 86 HG13 VAL 36 HG13 VAL 36 -0.143 4.570 2.569 87 HG21 VAL 36 HG21 VAL 36 1.268 5.986 2.439 88 HG22 VAL 36 HG22 VAL 36 2.385 6.245 1.098 89 HG23 VAL 36 HG23 VAL 36 0.783 6.981 1.065 90 H LYS 37 H LYS 37 0.514 3.913 -1.997 91 HA LYS 37 HA LYS 37 -0.679 1.406 -1.740 92 HB2 LYS 37 HB2 LYS 37 -1.137 1.590 -4.176 93 HB3 LYS 37 HB3 LYS 37 -1.560 3.043 -3.279 94 HG2 LYS 37 HG2 LYS 37 0.296 4.224 -4.110 95 HG3 LYS 37 HG3 LYS 37 1.063 2.751 -4.710 96 HD2 LYS 37 HD2 LYS 37 -1.483 2.903 -5.918 97 HD3 LYS 37 HD3 LYS 37 -0.759 4.508 -6.044 98 HE2 LYS 37 HE2 LYS 37 1.279 3.467 -6.987 99 HE3 LYS 37 HE3 LYS 37 0.468 1.903 -6.944 100 HZ1 LYS 37 HZ1 LYS 37 -0.351 2.372 -8.931 101 HZ2 LYS 37 HZ2 LYS 37 0.294 3.935 -8.897 102 HZ3 LYS 37 HZ3 LYS 37 -1.243 3.640 -8.254 103 H THR 38 H THR 38 2.432 2.334 -3.034 104 HA THR 38 HA THR 38 3.013 -0.084 -4.390 105 HB THR 38 HB THR 38 4.860 2.016 -3.244 106 HG1 THR 38 HG1 THR 38 4.310 1.520 -5.977 107 HG21 THR 38 HG21 THR 38 5.472 -0.317 -5.062 108 HG22 THR 38 HG22 THR 38 6.083 -0.064 -3.427 109 HG23 THR 38 HG23 THR 38 6.575 1.017 -4.729 110 H LEU 39 H LEU 39 3.591 1.034 -1.090 111 HA LEU 39 HA LEU 39 5.195 -1.156 -0.288 112 HB2 LEU 39 HB2 LEU 39 3.491 0.746 1.312 113 HB3 LEU 39 HB3 LEU 39 4.605 -0.423 2.020 114 HG LEU 39 HG LEU 39 5.631 1.594 0.068 115 HD11 LEU 39 HD11 LEU 39 6.159 2.899 2.289 116 HD12 LEU 39 HD12 LEU 39 4.680 2.112 2.838 117 HD13 LEU 39 HD13 LEU 39 4.647 3.155 1.417 118 HD21 LEU 39 HD21 LEU 39 6.835 0.319 2.521 119 HD22 LEU 39 HD22 LEU 39 7.668 1.326 1.337 120 HD23 LEU 39 HD23 LEU 39 7.053 -0.261 0.870 121 H LEU 40 H LEU 40 1.725 -0.555 -0.241 122 HA LEU 40 HA LEU 40 1.062 -2.881 1.267 123 HB2 LEU 40 HB2 LEU 40 -0.717 -1.367 -0.631 124 HB3 LEU 40 HB3 LEU 40 -1.214 -2.399 0.707 125 HG LEU 40 HG LEU 40 0.397 0.071 1.227 126 HD11 LEU 40 HD11 LEU 40 -1.773 0.400 -0.233 127 HD12 LEU 40 HD12 LEU 40 -1.384 1.489 1.097 128 HD13 LEU 40 HD13 LEU 40 -2.571 0.205 1.327 129 HD21 LEU 40 HD21 LEU 40 0.205 -1.031 3.208 130 HD22 LEU 40 HD22 LEU 40 -1.305 -1.822 2.753 131 HD23 LEU 40 HD23 LEU 40 -1.310 -0.130 3.252 132 H LYS 41 H LYS 41 1.060 -2.106 -2.194 133 HA LYS 41 HA LYS 41 -0.034 -4.436 -3.201 134 HB2 LYS 41 HB2 LYS 41 0.893 -2.228 -4.351 135 HB3 LYS 41 HB3 LYS 41 2.300 -3.247 -4.626 136 HG2 LYS 41 HG2 LYS 41 0.440 -4.922 -5.502 137 HG3 LYS 41 HG3 LYS 41 -0.420 -3.408 -5.786 138 HD2 LYS 41 HD2 LYS 41 0.742 -3.855 -7.787 139 HD3 LYS 41 HD3 LYS 41 1.685 -2.608 -6.965 140 HE2 LYS 41 HE2 LYS 41 3.359 -4.109 -6.352 141 HE3 LYS 41 HE3 LYS 41 2.317 -5.512 -6.585 142 HZ1 LYS 41 HZ1 LYS 41 3.673 -5.572 -8.428 143 HZ2 LYS 41 HZ2 LYS 41 3.718 -3.890 -8.604 144 HZ3 LYS 41 HZ3 LYS 41 2.325 -4.748 -9.034 145 H GLU 42 H GLU 42 3.335 -3.776 -2.319 146 HA GLU 42 HA GLU 42 4.235 -6.393 -3.086 147 HB2 GLU 42 HB2 GLU 42 6.366 -5.717 -2.055 148 HB3 GLU 42 HB3 GLU 42 5.768 -4.507 -3.181 149 HG2 GLU 42 HG2 GLU 42 4.872 -3.232 -1.254 150 HG3 GLU 42 HG3 GLU 42 5.633 -4.404 -0.178 151 H TRP 43 H TRP 43 3.409 -4.775 -0.055 152 HA TRP 43 HA TRP 43 4.217 -6.838 1.682 153 HB2 TRP 43 HB2 TRP 43 3.798 -4.627 2.549 154 HB3 TRP 43 HB3 TRP 43 2.123 -4.680 2.004 155 HD1 TRP 43 HD1 TRP 43 4.324 -6.847 4.377 156 HE1 TRP 43 HE1 TRP 43 2.903 -7.433 6.441 157 HE3 TRP 43 HE3 TRP 43 -0.034 -4.527 3.048 158 HZ2 TRP 43 HZ2 TRP 43 0.282 -6.974 7.381 159 HZ3 TRP 43 HZ3 TRP 43 -1.951 -4.649 4.585 160 HH2 TRP 43 HH2 TRP 43 -1.795 -5.848 6.706 161 H ILE 44 H ILE 44 1.643 -6.667 -0.516 162 HA ILE 44 HA ILE 44 0.104 -8.718 0.913 163 HB ILE 44 HB ILE 44 -0.646 -7.086 -1.514 164 HG12 ILE 44 HG12 ILE 44 -1.989 -6.946 1.163 165 HG13 ILE 44 HG13 ILE 44 -0.505 -6.042 0.882 166 HG21 ILE 44 HG21 ILE 44 -2.945 -8.037 -0.998 167 HG22 ILE 44 HG22 ILE 44 -1.776 -9.138 -1.726 168 HG23 ILE 44 HG23 ILE 44 -2.110 -9.225 0.003 169 HD11 ILE 44 HD11 ILE 44 -2.465 -5.677 -1.230 170 HD12 ILE 44 HD12 ILE 44 -3.049 -5.175 0.357 171 HD13 ILE 44 HD13 ILE 44 -1.564 -4.484 -0.294 172 H THR 45 H THR 45 2.376 -8.354 -1.555 173 HA THR 45 HA THR 45 1.553 -10.844 -2.880 174 HB THR 45 HB THR 45 3.163 -10.251 -4.646 175 HG1 THR 45 HG1 THR 45 4.676 -8.892 -4.066 176 HG21 THR 45 HG21 THR 45 0.875 -8.555 -3.891 177 HG22 THR 45 HG22 THR 45 1.204 -9.413 -5.398 178 HG23 THR 45 HG23 THR 45 1.971 -7.857 -5.083 179 H THR 46 H THR 46 4.534 -9.256 -1.727 180 HA THR 46 HA THR 46 6.089 -11.625 -1.785 181 HB THR 46 HB THR 46 7.028 -9.303 -1.822 182 HG1 THR 46 HG1 THR 46 8.790 -10.294 -1.218 183 HG21 THR 46 HG21 THR 46 5.555 -9.047 0.562 184 HG22 THR 46 HG22 THR 46 6.627 -7.855 -0.174 185 HG23 THR 46 HG23 THR 46 7.255 -8.987 1.023 186 H ILE 47 H ILE 47 3.747 -10.468 0.400 187 HA ILE 47 HA ILE 47 4.547 -12.524 2.350 188 HB ILE 47 HB ILE 47 3.475 -9.769 2.961 189 HG12 ILE 47 HG12 ILE 47 5.795 -10.580 4.454 190 HG13 ILE 47 HG13 ILE 47 6.099 -10.795 2.734 191 HG21 ILE 47 HG21 ILE 47 4.043 -10.916 5.372 192 HG22 ILE 47 HG22 ILE 47 2.433 -10.765 4.672 193 HG23 ILE 47 HG23 ILE 47 3.342 -12.264 4.478 194 HD11 ILE 47 HD11 ILE 47 5.059 -8.360 2.639 195 HD12 ILE 47 HD12 ILE 47 5.665 -8.321 4.294 196 HD13 ILE 47 HD13 ILE 47 6.769 -8.646 2.958 197 H SER 48 H SER 48 3.026 -13.994 2.710 198 HA SER 48 HA SER 48 0.270 -13.384 1.883 199 HB2 SER 48 HB2 SER 48 1.102 -16.188 2.429 200 HB3 SER 48 HB3 SER 48 0.026 -15.554 1.185 201 HG SER 48 HG SER 48 2.085 -16.344 0.403 202 H ASP 49 H ASP 49 2.268 -14.323 4.550 203 HA ASP 49 HA ASP 49 -0.127 -14.615 6.242 204 HB2 ASP 49 HB2 ASP 49 2.626 -15.822 6.483 205 HB3 ASP 49 HB3 ASP 49 1.495 -15.787 7.833 206 HA PRO 50 HA PRO 50 1.848 -10.638 7.498 207 HB2 PRO 50 HB2 PRO 50 -0.507 -9.356 7.929 208 HB3 PRO 50 HB3 PRO 50 0.257 -9.451 6.338 209 HG2 PRO 50 HG2 PRO 50 -1.977 -11.092 7.466 210 HG3 PRO 50 HG3 PRO 50 -1.816 -10.385 5.848 211 HD2 PRO 50 HD2 PRO 50 -1.305 -12.995 6.355 212 HD3 PRO 50 HD3 PRO 50 -0.434 -12.077 5.111 213 H MET 51 H MET 51 1.847 -9.599 9.556 214 HA MET 51 HA MET 51 0.787 -11.309 11.698 215 HB2 MET 51 HB2 MET 51 3.146 -9.454 11.539 216 HB3 MET 51 HB3 MET 51 2.489 -9.949 13.093 217 HG2 MET 51 HG2 MET 51 2.813 -12.321 12.381 218 HG3 MET 51 HG3 MET 51 3.660 -11.712 10.960 219 HE1 MET 51 HE1 MET 51 5.870 -10.452 10.977 220 HE2 MET 51 HE2 MET 51 5.341 -9.218 12.120 221 HE3 MET 51 HE3 MET 51 6.845 -10.096 12.403 222 H GLU 52 H GLU 52 0.381 -10.016 13.800 223 HA GLU 52 HA GLU 52 -1.798 -8.302 13.358 224 HB2 GLU 52 HB2 GLU 52 -1.138 -9.720 15.447 225 HB3 GLU 52 HB3 GLU 52 -0.258 -8.277 15.931 226 HG2 GLU 52 HG2 GLU 52 -2.160 -7.058 16.279 227 HG3 GLU 52 HG3 GLU 52 -3.105 -7.999 15.126 228 H GLU 53 H GLU 53 1.344 -7.481 14.843 229 HA GLU 53 HA GLU 53 1.042 -4.742 14.912 230 HB2 GLU 53 HB2 GLU 53 3.420 -6.542 14.724 231 HB3 GLU 53 HB3 GLU 53 3.654 -4.808 14.556 232 HG2 GLU 53 HG2 GLU 53 4.028 -5.324 16.824 233 HG3 GLU 53 HG3 GLU 53 2.453 -4.536 16.743 234 H ASP 54 H ASP 54 1.827 -6.799 12.209 235 HA ASP 54 HA ASP 54 2.765 -4.768 10.463 236 HB2 ASP 54 HB2 ASP 54 2.012 -7.611 10.247 237 HB3 ASP 54 HB3 ASP 54 1.794 -6.673 8.773 238 H ILE 55 H ILE 55 -0.403 -6.321 10.872 239 HA ILE 55 HA ILE 55 -1.680 -4.761 8.857 240 HB ILE 55 HB ILE 55 -2.924 -6.292 11.144 241 HG12 ILE 55 HG12 ILE 55 -2.651 -7.182 8.276 242 HG13 ILE 55 HG13 ILE 55 -1.443 -7.567 9.497 243 HG21 ILE 55 HG21 ILE 55 -4.946 -6.287 9.742 244 HG22 ILE 55 HG22 ILE 55 -4.457 -4.662 10.218 245 HG23 ILE 55 HG23 ILE 55 -4.123 -5.241 8.586 246 HD11 ILE 55 HD11 ILE 55 -4.297 -8.235 10.011 247 HD12 ILE 55 HD12 ILE 55 -3.340 -9.254 8.936 248 HD13 ILE 55 HD13 ILE 55 -2.831 -9.012 10.607 249 H LEU 56 H LEU 56 -1.449 -4.532 12.378 250 HA LEU 56 HA LEU 56 -3.270 -2.517 12.872 251 HB2 LEU 56 HB2 LEU 56 -0.774 -3.446 14.163 252 HB3 LEU 56 HB3 LEU 56 -1.374 -1.859 14.640 253 HG LEU 56 HG LEU 56 -2.123 -3.569 16.192 254 HD11 LEU 56 HD11 LEU 56 -3.590 -1.590 15.394 255 HD12 LEU 56 HD12 LEU 56 -4.319 -2.871 16.361 256 HD13 LEU 56 HD13 LEU 56 -4.556 -2.843 14.613 257 HD21 LEU 56 HD21 LEU 56 -3.851 -5.226 15.302 258 HD22 LEU 56 HD22 LEU 56 -2.154 -5.555 14.952 259 HD23 LEU 56 HD23 LEU 56 -3.194 -4.866 13.705 260 H GLN 57 H GLN 57 0.068 -2.255 11.742 261 HA GLN 57 HA GLN 57 0.424 0.485 11.925 262 HB2 GLN 57 HB2 GLN 57 1.618 -1.709 10.395 263 HB3 GLN 57 HB3 GLN 57 1.721 -0.152 9.581 264 HG2 GLN 57 HG2 GLN 57 2.512 -0.359 12.446 265 HG3 GLN 57 HG3 GLN 57 3.609 -0.939 11.195 266 HE21 GLN 57 HE21 GLN 57 2.806 1.656 13.036 267 HE22 GLN 57 HE22 GLN 57 3.471 2.920 12.065 268 H VAL 58 H VAL 58 -1.370 -1.384 9.575 269 HA VAL 58 HA VAL 58 -1.719 0.744 7.701 270 HB VAL 58 HB VAL 58 -3.494 -1.676 7.995 271 HG11 VAL 58 HG11 VAL 58 -4.390 -1.101 6.026 272 HG12 VAL 58 HG12 VAL 58 -3.694 0.492 6.331 273 HG13 VAL 58 HG13 VAL 58 -2.824 -0.676 5.335 274 HG21 VAL 58 HG21 VAL 58 -0.692 -1.472 7.141 275 HG22 VAL 58 HG22 VAL 58 -1.608 -2.868 7.707 276 HG23 VAL 58 HG23 VAL 58 -1.747 -2.344 6.030 277 H VAL 59 H VAL 59 -3.521 -0.463 10.464 278 HA VAL 59 HA VAL 59 -5.912 0.971 10.009 279 HB VAL 59 HB VAL 59 -4.736 0.006 12.621 280 HG11 VAL 59 HG11 VAL 59 -7.144 0.081 13.361 281 HG12 VAL 59 HG12 VAL 59 -6.367 1.650 13.138 282 HG13 VAL 59 HG13 VAL 59 -7.477 1.031 11.914 283 HG21 VAL 59 HG21 VAL 59 -6.834 -1.632 12.004 284 HG22 VAL 59 HG22 VAL 59 -6.127 -1.324 10.417 285 HG23 VAL 59 HG23 VAL 59 -5.136 -2.002 11.708 286 H ARG 60 H ARG 60 -3.119 1.679 12.106 287 HA ARG 60 HA ARG 60 -4.019 4.139 13.076 288 HB2 ARG 60 HB2 ARG 60 -1.162 3.282 12.576 289 HB3 ARG 60 HB3 ARG 60 -1.679 4.588 13.636 290 HG2 ARG 60 HG2 ARG 60 -2.786 1.883 14.138 291 HG3 ARG 60 HG3 ARG 60 -1.096 2.178 14.550 292 HD2 ARG 60 HD2 ARG 60 -2.144 4.355 15.650 293 HD3 ARG 60 HD3 ARG 60 -3.573 3.326 15.720 294 HE ARG 60 HE ARG 60 -1.526 1.805 16.739 295 HH11 ARG 60 HH11 ARG 60 -3.006 4.863 17.500 296 HH12 ARG 60 HH12 ARG 60 -2.676 4.748 19.197 297 HH21 ARG 60 HH21 ARG 60 -1.086 1.641 18.971 298 HH22 ARG 60 HH22 ARG 60 -1.583 2.915 20.033 299 H TYR 61 H TYR 61 -2.672 3.268 10.011 300 HA TYR 61 HA TYR 61 -1.893 5.912 9.237 301 HB2 TYR 61 HB2 TYR 61 -0.783 4.082 8.169 302 HB3 TYR 61 HB3 TYR 61 -2.312 3.361 7.676 303 HD1 TYR 61 HD2 TYR 61 0.015 6.162 7.059 304 HD2 TYR 61 HD1 TYR 61 -3.409 4.048 5.678 305 HE1 TYR 61 HE2 TYR 61 0.154 7.352 4.911 306 HE2 TYR 61 HE1 TYR 61 -3.279 5.231 3.525 307 HH TYR 61 HH TYR 61 -2.351 7.342 2.639 308 H CYS 62 H CYS 62 -4.605 3.783 8.339 309 HA CYS 62 HA CYS 62 -5.931 5.732 6.767 310 HB2 CYS 62 HB2 CYS 62 -6.929 3.197 8.076 311 HB3 CYS 62 HB3 CYS 62 -7.900 4.178 6.985 312 HG CYS 62 HG CYS 62 -6.115 3.826 4.812 313 H THR 63 H THR 63 -6.392 4.615 10.103 314 HA THR 63 HA THR 63 -8.634 6.121 10.756 315 HB THR 63 HB THR 63 -7.803 6.008 13.123 316 HG1 THR 63 HG1 THR 63 -5.757 5.603 13.432 317 HG21 THR 63 HG21 THR 63 -8.494 3.859 11.349 318 HG22 THR 63 HG22 THR 63 -8.898 4.068 13.052 319 HG23 THR 63 HG23 THR 63 -7.392 3.275 12.594 320 H ASP 64 H ASP 64 -5.337 7.102 10.342 321 HA ASP 64 HA ASP 64 -5.537 9.568 11.773 322 HB2 ASP 64 HB2 ASP 64 -3.550 8.384 9.862 323 HB3 ASP 64 HB3 ASP 64 -3.439 10.087 10.301 324 H LEU 65 H LEU 65 -5.951 8.587 8.414 325 HA LEU 65 HA LEU 65 -6.055 11.072 7.186 326 HB2 LEU 65 HB2 LEU 65 -6.983 8.369 6.597 327 HB3 LEU 65 HB3 LEU 65 -7.976 9.623 5.856 328 HG LEU 65 HG LEU 65 -6.174 10.432 4.569 329 HD11 LEU 65 HD11 LEU 65 -4.423 10.499 6.183 330 HD12 LEU 65 HD12 LEU 65 -3.867 9.506 4.837 331 HD13 LEU 65 HD13 LEU 65 -4.409 8.742 6.331 332 HD21 LEU 65 HD21 LEU 65 -6.256 8.740 3.134 333 HD22 LEU 65 HD22 LEU 65 -7.013 7.775 4.401 334 HD23 LEU 65 HD23 LEU 65 -5.264 7.726 4.182 335 H ILE 66 H ILE 66 -8.483 9.397 9.079 336 HA ILE 66 HA ILE 66 -10.702 10.989 8.400 337 HB ILE 66 HB ILE 66 -10.057 9.297 10.793 338 HG12 ILE 66 HG12 ILE 66 -12.511 8.809 9.283 339 HG13 ILE 66 HG13 ILE 66 -11.069 8.747 8.275 340 HG21 ILE 66 HG21 ILE 66 -12.527 9.704 11.395 341 HG22 ILE 66 HG22 ILE 66 -11.340 10.926 11.846 342 HG23 ILE 66 HG23 ILE 66 -12.364 11.172 10.432 343 HD11 ILE 66 HD11 ILE 66 -11.189 6.578 8.938 344 HD12 ILE 66 HD12 ILE 66 -10.189 7.228 10.238 345 HD13 ILE 66 HD13 ILE 66 -11.915 6.975 10.494 346 H GLU 67 H GLU 67 -8.365 11.248 11.065 347 HA GLU 67 HA GLU 67 -9.544 13.627 12.126 348 HB2 GLU 67 HB2 GLU 67 -6.755 12.579 12.617 349 HB3 GLU 67 HB3 GLU 67 -7.670 13.681 13.636 350 HG2 GLU 67 HG2 GLU 67 -8.336 10.795 13.101 351 HG3 GLU 67 HG3 GLU 67 -7.630 11.448 14.578 352 H GLU 68 H GLU 68 -7.001 12.908 9.836 353 HA GLU 68 HA GLU 68 -6.065 15.641 9.732 354 HB2 GLU 68 HB2 GLU 68 -5.396 13.206 8.073 355 HB3 GLU 68 HB3 GLU 68 -4.650 14.781 7.845 356 HG2 GLU 68 HG2 GLU 68 -4.580 13.412 10.504 357 HG3 GLU 68 HG3 GLU 68 -3.413 13.022 9.241 358 H LYS 69 H LYS 69 -8.664 13.981 8.463 359 HA LYS 69 HA LYS 69 -10.247 14.496 6.914 360 HB2 LYS 69 HB2 LYS 69 -8.845 17.148 6.586 361 HB3 LYS 69 HB3 LYS 69 -10.530 16.778 6.248 362 HG2 LYS 69 HG2 LYS 69 -9.318 16.648 8.998 363 HG3 LYS 69 HG3 LYS 69 -10.127 18.074 8.344 364 HD2 LYS 69 HD2 LYS 69 -11.756 15.731 7.968 365 HD3 LYS 69 HD3 LYS 69 -11.302 15.901 9.665 366 HE2 LYS 69 HE2 LYS 69 -12.246 18.312 8.198 367 HE3 LYS 69 HE3 LYS 69 -13.436 17.102 8.675 368 HZ1 LYS 69 HZ1 LYS 69 -13.348 17.798 10.764 369 HZ2 LYS 69 HZ2 LYS 69 -12.410 19.106 10.246 370 HZ3 LYS 69 HZ3 LYS 69 -11.660 17.700 10.813 371 H ASP 70 H ASP 70 -7.989 13.066 6.070 372 HA ASP 70 HA ASP 70 -7.599 14.071 3.328 373 HB2 ASP 70 HB2 ASP 70 -5.827 12.508 5.170 374 HB3 ASP 70 HB3 ASP 70 -5.637 12.334 3.427 375 H LEU 71 H LEU 71 -9.934 12.656 4.120 376 HA LEU 71 HA LEU 71 -9.919 9.921 3.685 377 HB2 LEU 71 HB2 LEU 71 -12.079 11.791 2.738 378 HB3 LEU 71 HB3 LEU 71 -12.251 10.097 3.192 379 HG LEU 71 HG LEU 71 -11.638 12.386 5.060 380 HD11 LEU 71 HD11 LEU 71 -14.060 10.741 5.371 381 HD12 LEU 71 HD12 LEU 71 -14.035 11.818 3.974 382 HD13 LEU 71 HD13 LEU 71 -13.822 12.474 5.597 383 HD21 LEU 71 HD21 LEU 71 -12.375 10.267 6.601 384 HD22 LEU 71 HD22 LEU 71 -10.710 10.766 6.301 385 HD23 LEU 71 HD23 LEU 71 -11.431 9.477 5.336 386 H GLU 72 H GLU 72 -9.457 12.496 1.439 387 HA GLU 72 HA GLU 72 -10.266 11.430 -0.966 388 HB2 GLU 72 HB2 GLU 72 -9.261 13.702 -0.585 389 HB3 GLU 72 HB3 GLU 72 -7.680 12.934 -0.552 390 HG2 GLU 72 HG2 GLU 72 -7.571 12.838 -2.767 391 HG3 GLU 72 HG3 GLU 72 -9.206 12.191 -2.901 392 H LYS 73 H LYS 73 -7.152 10.924 0.672 393 HA LYS 73 HA LYS 73 -6.258 9.032 -1.303 394 HB2 LYS 73 HB2 LYS 73 -5.104 9.611 1.429 395 HB3 LYS 73 HB3 LYS 73 -4.299 8.772 0.110 396 HG2 LYS 73 HG2 LYS 73 -3.665 10.676 -0.856 397 HG3 LYS 73 HG3 LYS 73 -5.255 11.414 -0.646 398 HD2 LYS 73 HD2 LYS 73 -4.160 12.757 0.797 399 HD3 LYS 73 HD3 LYS 73 -4.371 11.404 1.910 400 HE2 LYS 73 HE2 LYS 73 -2.162 10.559 1.312 401 HE3 LYS 73 HE3 LYS 73 -1.956 11.879 0.163 402 HZ1 LYS 73 HZ1 LYS 73 -1.262 13.199 1.784 403 HZ2 LYS 73 HZ2 LYS 73 -1.278 11.876 2.838 404 HZ3 LYS 73 HZ3 LYS 73 -2.632 12.885 2.725 405 H LEU 74 H LEU 74 -8.056 8.915 1.632 406 HA LEU 74 HA LEU 74 -7.525 6.326 2.519 407 HB2 LEU 74 HB2 LEU 74 -8.857 8.073 3.707 408 HB3 LEU 74 HB3 LEU 74 -10.191 7.724 2.610 409 HG LEU 74 HG LEU 74 -10.203 5.386 3.488 410 HD11 LEU 74 HD11 LEU 74 -7.746 5.916 4.451 411 HD12 LEU 74 HD12 LEU 74 -8.793 4.644 5.079 412 HD13 LEU 74 HD13 LEU 74 -8.717 6.206 5.895 413 HD21 LEU 74 HD21 LEU 74 -11.815 6.974 4.304 414 HD22 LEU 74 HD22 LEU 74 -10.644 7.639 5.444 415 HD23 LEU 74 HD23 LEU 74 -11.245 5.993 5.654 416 H ASP 75 H ASP 75 -10.278 7.381 0.508 417 HA ASP 75 HA ASP 75 -11.264 4.859 -0.102 418 HB2 ASP 75 HB2 ASP 75 -12.015 7.396 -0.711 419 HB3 ASP 75 HB3 ASP 75 -11.425 6.851 -2.279 420 H LEU 76 H LEU 76 -8.499 6.528 -1.358 421 HA LEU 76 HA LEU 76 -8.216 4.910 -3.711 422 HB2 LEU 76 HB2 LEU 76 -6.213 6.675 -2.311 423 HB3 LEU 76 HB3 LEU 76 -6.026 5.981 -3.921 424 HG LEU 76 HG LEU 76 -8.204 7.930 -3.188 425 HD11 LEU 76 HD11 LEU 76 -6.844 9.665 -3.527 426 HD12 LEU 76 HD12 LEU 76 -6.058 8.895 -4.904 427 HD13 LEU 76 HD13 LEU 76 -5.526 8.525 -3.264 428 HD21 LEU 76 HD21 LEU 76 -8.831 7.883 -5.364 429 HD22 LEU 76 HD22 LEU 76 -8.165 6.253 -5.266 430 HD23 LEU 76 HD23 LEU 76 -7.198 7.561 -5.945 431 H VAL 77 H VAL 77 -6.465 5.104 -0.613 432 HA VAL 77 HA VAL 77 -4.801 2.875 -1.102 433 HB VAL 77 HB VAL 77 -5.653 4.073 1.537 434 HG11 VAL 77 HG11 VAL 77 -4.146 1.713 0.939 435 HG12 VAL 77 HG12 VAL 77 -3.102 2.904 1.718 436 HG13 VAL 77 HG13 VAL 77 -4.591 2.382 2.508 437 HG21 VAL 77 HG21 VAL 77 -4.501 5.809 0.644 438 HG22 VAL 77 HG22 VAL 77 -3.120 4.873 1.215 439 HG23 VAL 77 HG23 VAL 77 -3.606 4.784 -0.478 440 H ILE 78 H ILE 78 -7.993 3.212 0.317 441 HA ILE 78 HA ILE 78 -8.151 0.577 1.377 442 HB ILE 78 HB ILE 78 -10.291 2.582 0.673 443 HG12 ILE 78 HG12 ILE 78 -8.818 3.164 2.562 444 HG13 ILE 78 HG13 ILE 78 -10.465 2.850 3.098 445 HG21 ILE 78 HG21 ILE 78 -11.434 0.796 2.420 446 HG22 ILE 78 HG22 ILE 78 -11.723 0.870 0.683 447 HG23 ILE 78 HG23 ILE 78 -10.519 -0.245 1.329 448 HD11 ILE 78 HD11 ILE 78 -8.090 1.704 4.046 449 HD12 ILE 78 HD12 ILE 78 -9.747 1.302 4.500 450 HD13 ILE 78 HD13 ILE 78 -8.955 0.427 3.190 451 H LYS 79 H LYS 79 -9.616 2.056 -1.521 452 HA LYS 79 HA LYS 79 -10.672 -0.343 -2.553 453 HB2 LYS 79 HB2 LYS 79 -11.192 0.876 -4.493 454 HB3 LYS 79 HB3 LYS 79 -11.255 2.065 -3.198 455 HG2 LYS 79 HG2 LYS 79 -10.009 3.284 -4.609 456 HG3 LYS 79 HG3 LYS 79 -8.682 2.321 -3.956 457 HD2 LYS 79 HD2 LYS 79 -8.303 1.976 -6.174 458 HD3 LYS 79 HD3 LYS 79 -9.452 0.666 -5.894 459 HE2 LYS 79 HE2 LYS 79 -11.239 2.438 -6.509 460 HE3 LYS 79 HE3 LYS 79 -9.886 3.315 -7.220 461 HZ1 LYS 79 HZ1 LYS 79 -10.432 0.489 -7.897 462 HZ2 LYS 79 HZ2 LYS 79 -9.496 1.613 -8.747 463 HZ3 LYS 79 HZ3 LYS 79 -11.181 1.762 -8.725 464 H TYR 80 H TYR 80 -7.498 1.028 -2.638 465 HA TYR 80 HA TYR 80 -6.580 -0.571 -4.853 466 HB2 TYR 80 HB2 TYR 80 -5.566 1.606 -4.453 467 HB3 TYR 80 HB3 TYR 80 -5.065 1.105 -2.842 468 HD1 TYR 80 HD1 TYR 80 -3.292 -0.628 -2.589 469 HD2 TYR 80 HD2 TYR 80 -4.281 1.044 -6.373 470 HE1 TYR 80 HE1 TYR 80 -1.160 -1.449 -3.502 471 HE2 TYR 80 HE2 TYR 80 -2.153 0.227 -7.298 472 HH TYR 80 HH TYR 80 0.007 -0.479 -6.598 473 H MET 81 H MET 81 -6.233 -0.611 -1.327 474 HA MET 81 HA MET 81 -4.574 -2.941 -1.303 475 HB2 MET 81 HB2 MET 81 -4.643 -2.795 1.045 476 HB3 MET 81 HB3 MET 81 -4.712 -1.127 0.491 477 HG2 MET 81 HG2 MET 81 -7.051 -1.002 0.919 478 HG3 MET 81 HG3 MET 81 -7.140 -2.733 1.237 479 HE1 MET 81 HE1 MET 81 -6.400 0.672 3.920 480 HE2 MET 81 HE2 MET 81 -4.858 0.416 3.105 481 HE3 MET 81 HE3 MET 81 -6.328 0.647 2.158 482 H LYS 82 H LYS 82 -8.007 -2.317 -1.125 483 HA LYS 82 HA LYS 82 -8.762 -4.912 -0.220 484 HB2 LYS 82 HB2 LYS 82 -10.969 -4.216 -0.496 485 HB3 LYS 82 HB3 LYS 82 -10.120 -2.712 -0.166 486 HG2 LYS 82 HG2 LYS 82 -11.335 -2.025 -1.942 487 HG3 LYS 82 HG3 LYS 82 -9.954 -2.684 -2.821 488 HD2 LYS 82 HD2 LYS 82 -11.696 -3.679 -3.943 489 HD3 LYS 82 HD3 LYS 82 -11.350 -4.904 -2.719 490 HE2 LYS 82 HE2 LYS 82 -13.253 -4.451 -1.531 491 HE3 LYS 82 HE3 LYS 82 -13.313 -2.770 -2.061 492 HZ1 LYS 82 HZ1 LYS 82 -13.912 -5.097 -3.805 493 HZ2 LYS 82 HZ2 LYS 82 -14.099 -3.462 -4.198 494 HZ3 LYS 82 HZ3 LYS 82 -15.086 -4.165 -3.019 495 H ARG 83 H ARG 83 -8.180 -3.469 -3.353 496 HA ARG 83 HA ARG 83 -9.376 -5.541 -4.894 497 HB2 ARG 83 HB2 ARG 83 -8.769 -4.313 -6.707 498 HB3 ARG 83 HB3 ARG 83 -8.543 -3.063 -5.492 499 HG2 ARG 83 HG2 ARG 83 -6.124 -3.880 -5.365 500 HG3 ARG 83 HG3 ARG 83 -6.472 -4.728 -6.873 501 HD2 ARG 83 HD2 ARG 83 -7.199 -1.853 -6.682 502 HD3 ARG 83 HD3 ARG 83 -5.492 -2.266 -6.839 503 HE ARG 83 HE ARG 83 -7.495 -2.430 -8.871 504 HH11 ARG 83 HH11 ARG 83 -4.507 -3.810 -7.738 505 HH12 ARG 83 HH12 ARG 83 -4.023 -4.377 -9.303 506 HH21 ARG 83 HH21 ARG 83 -6.870 -3.171 -10.935 507 HH22 ARG 83 HH22 ARG 83 -5.369 -4.012 -11.121 508 H LEU 84 H LEU 84 -6.239 -5.069 -3.451 509 HA LEU 84 HA LEU 84 -4.994 -7.209 -4.935 510 HB2 LEU 84 HB2 LEU 84 -4.018 -5.753 -2.483 511 HB3 LEU 84 HB3 LEU 84 -3.057 -6.790 -3.535 512 HG LEU 84 HG LEU 84 -4.361 -4.299 -4.583 513 HD11 LEU 84 HD11 LEU 84 -2.020 -4.538 -2.801 514 HD12 LEU 84 HD12 LEU 84 -3.125 -3.188 -3.054 515 HD13 LEU 84 HD13 LEU 84 -1.834 -3.498 -4.213 516 HD21 LEU 84 HD21 LEU 84 -2.619 -6.364 -5.599 517 HD22 LEU 84 HD22 LEU 84 -1.882 -4.770 -5.763 518 HD23 LEU 84 HD23 LEU 84 -3.470 -5.083 -6.463 519 H MET 85 H MET 85 -5.800 -6.683 -1.498 520 HA MET 85 HA MET 85 -5.178 -9.218 -0.565 521 HB2 MET 85 HB2 MET 85 -7.272 -7.252 0.361 522 HB3 MET 85 HB3 MET 85 -6.885 -8.726 1.238 523 HG2 MET 85 HG2 MET 85 -4.506 -7.912 1.327 524 HG3 MET 85 HG3 MET 85 -5.099 -6.371 0.713 525 HE1 MET 85 HE1 MET 85 -4.503 -4.926 2.137 526 HE2 MET 85 HE2 MET 85 -5.484 -4.462 3.527 527 HE3 MET 85 HE3 MET 85 -4.008 -5.399 3.764 528 H GLN 86 H GLN 86 -7.903 -8.145 -2.419 529 HA GLN 86 HA GLN 86 -9.537 -10.443 -1.855 530 HB2 GLN 86 HB2 GLN 86 -9.732 -8.092 -3.695 531 HB3 GLN 86 HB3 GLN 86 -10.767 -9.486 -3.970 532 HG2 GLN 86 HG2 GLN 86 -11.643 -9.275 -1.693 533 HG3 GLN 86 HG3 GLN 86 -10.625 -7.857 -1.444 534 HE21 GLN 86 HE21 GLN 86 -12.796 -6.951 -0.945 535 HE22 GLN 86 HE22 GLN 86 -13.703 -6.280 -2.254 536 H GLN 87 H GLN 87 -7.471 -9.369 -4.521 537 HA GLN 87 HA GLN 87 -7.968 -11.794 -6.024 538 HB2 GLN 87 HB2 GLN 87 -6.714 -10.822 -7.762 539 HB3 GLN 87 HB3 GLN 87 -7.583 -9.479 -7.031 540 HG2 GLN 87 HG2 GLN 87 -5.533 -8.959 -5.716 541 HG3 GLN 87 HG3 GLN 87 -4.689 -10.197 -6.647 542 HE21 GLN 87 HE21 GLN 87 -5.986 -7.010 -6.639 543 HE22 GLN 87 HE22 GLN 87 -5.397 -6.531 -8.190 544 H SER 88 H SER 88 -6.236 -11.229 -3.361 545 HA SER 88 HA SER 88 -3.673 -12.250 -3.926 546 HB2 SER 88 HB2 SER 88 -5.080 -11.344 -1.640 547 HB3 SER 88 HB3 SER 88 -4.472 -12.956 -1.262 548 HG SER 88 HG SER 88 -2.829 -10.979 -2.433 549 H VAL 89 H VAL 89 -2.953 -14.341 -2.643 550 HA VAL 89 HA VAL 89 -4.536 -16.520 -3.780 551 HB VAL 89 HB VAL 89 -2.221 -16.594 -4.389 552 HG11 VAL 89 HG11 VAL 89 -0.448 -16.821 -2.649 553 HG12 VAL 89 HG12 VAL 89 -1.238 -15.243 -2.672 554 HG13 VAL 89 HG13 VAL 89 -1.661 -16.425 -1.432 555 HG21 VAL 89 HG21 VAL 89 -1.582 -18.791 -3.577 556 HG22 VAL 89 HG22 VAL 89 -2.726 -18.654 -2.241 557 HG23 VAL 89 HG23 VAL 89 -3.315 -18.742 -3.901 558 H GLU 90 H GLU 90 -3.387 -15.279 -0.714 559 HA GLU 90 HA GLU 90 -4.445 -17.578 0.731 560 HB2 GLU 90 HB2 GLU 90 -2.862 -15.153 1.546 561 HB3 GLU 90 HB3 GLU 90 -3.615 -16.198 2.742 562 HG2 GLU 90 HG2 GLU 90 -1.550 -17.006 0.708 563 HG3 GLU 90 HG3 GLU 90 -1.299 -16.799 2.440 564 H SER 91 H SER 91 -6.513 -17.636 1.274 565 HA SER 91 HA SER 91 -8.326 -15.545 0.997 566 HB2 SER 91 HB2 SER 91 -9.686 -17.035 2.710 567 HB3 SER 91 HB3 SER 91 -9.375 -17.602 1.069 568 HG SER 91 HG SER 91 -7.954 -19.027 1.809 569 H VAL 92 H VAL 92 -6.175 -16.304 3.592 570 HA VAL 92 HA VAL 92 -7.420 -15.086 5.758 571 HB VAL 92 HB VAL 92 -5.314 -16.414 5.876 572 HG11 VAL 92 HG11 VAL 92 -3.640 -14.045 5.387 573 HG12 VAL 92 HG12 VAL 92 -3.350 -15.743 5.001 574 HG13 VAL 92 HG13 VAL 92 -4.375 -14.761 3.953 575 HG21 VAL 92 HG21 VAL 92 -5.957 -15.221 7.827 576 HG22 VAL 92 HG22 VAL 92 -4.229 -14.946 7.611 577 HG23 VAL 92 HG23 VAL 92 -5.384 -13.692 7.162 578 H TRP 93 H TRP 93 -5.802 -13.681 3.013 579 HA TRP 93 HA TRP 93 -5.321 -11.109 4.045 580 HB2 TRP 93 HB2 TRP 93 -5.474 -12.337 1.354 581 HB3 TRP 93 HB3 TRP 93 -5.710 -10.593 1.423 582 HD1 TRP 93 HD1 TRP 93 -3.055 -12.783 0.670 583 HE1 TRP 93 HE1 TRP 93 -0.749 -11.843 1.315 584 HE3 TRP 93 HE3 TRP 93 -4.551 -9.086 3.870 585 HZ2 TRP 93 HZ2 TRP 93 0.299 -9.804 2.963 586 HZ3 TRP 93 HZ3 TRP 93 -2.834 -7.687 4.940 587 HH2 TRP 93 HH2 TRP 93 -0.460 -8.040 4.495 588 H ASN 94 H ASN 94 -8.172 -12.584 2.622 589 HA ASN 94 HA ASN 94 -9.699 -10.303 2.144 590 HB2 ASN 94 HB2 ASN 94 -10.485 -13.117 2.898 591 HB3 ASN 94 HB3 ASN 94 -11.675 -11.873 2.525 592 HD21 ASN 94 HD21 ASN 94 -8.937 -13.664 1.246 593 HD22 ASN 94 HD22 ASN 94 -9.377 -13.511 -0.417 594 H MET 95 H MET 95 -9.316 -12.215 5.098 595 HA MET 95 HA MET 95 -11.201 -10.700 6.610 596 HB2 MET 95 HB2 MET 95 -8.951 -12.355 7.741 597 HB3 MET 95 HB3 MET 95 -10.497 -11.979 8.488 598 HG2 MET 95 HG2 MET 95 -11.500 -13.265 6.478 599 HG3 MET 95 HG3 MET 95 -9.873 -13.923 6.311 600 HE1 MET 95 HE1 MET 95 -9.001 -15.651 9.292 601 HE2 MET 95 HE2 MET 95 -9.630 -16.664 7.992 602 HE3 MET 95 HE3 MET 95 -8.717 -15.204 7.609 603 H ALA 96 H ALA 96 -7.772 -10.464 5.986 604 HA ALA 96 HA ALA 96 -7.005 -8.771 8.069 605 HB1 ALA 96 HB1 ALA 96 -5.050 -8.366 6.871 606 HB2 ALA 96 HB2 ALA 96 -5.563 -9.956 6.303 607 HB3 ALA 96 HB3 ALA 96 -5.859 -8.528 5.311 608 H PHE 97 H PHE 97 -8.315 -8.001 4.863 609 HA PHE 97 HA PHE 97 -8.109 -5.212 5.043 610 HB2 PHE 97 HB2 PHE 97 -8.551 -6.311 2.922 611 HB3 PHE 97 HB3 PHE 97 -10.092 -6.915 3.522 612 HD1 PHE 97 HD2 PHE 97 -8.481 -3.553 3.620 613 HD2 PHE 97 HD1 PHE 97 -11.809 -5.903 2.388 614 HE1 PHE 97 HE2 PHE 97 -9.597 -1.527 2.781 615 HE2 PHE 97 HE1 PHE 97 -12.929 -3.881 1.547 616 HZ PHE 97 HZ PHE 97 -11.824 -1.689 1.743 617 H ASP 98 H ASP 98 -10.733 -7.409 5.956 618 HA ASP 98 HA ASP 98 -12.598 -5.441 6.701 619 HB2 ASP 98 HB2 ASP 98 -13.275 -7.747 6.346 620 HB3 ASP 98 HB3 ASP 98 -12.266 -8.280 7.688 621 H PHE 99 H PHE 99 -10.012 -7.035 8.488 622 HA PHE 99 HA PHE 99 -10.644 -6.195 11.064 623 HB2 PHE 99 HB2 PHE 99 -8.923 -7.792 10.878 624 HB3 PHE 99 HB3 PHE 99 -8.028 -6.820 9.715 625 HD1 PHE 99 HD2 PHE 99 -8.804 -7.328 13.248 626 HD2 PHE 99 HD1 PHE 99 -6.619 -4.997 10.436 627 HE1 PHE 99 HE2 PHE 99 -7.439 -6.408 15.077 628 HE2 PHE 99 HE1 PHE 99 -5.249 -4.074 12.260 629 HZ PHE 99 HZ PHE 99 -5.657 -4.780 14.583 630 H ILE 100 H ILE 100 -8.622 -4.591 8.620 631 HA ILE 100 HA ILE 100 -7.937 -2.348 10.160 632 HB ILE 100 HB ILE 100 -8.228 -2.547 7.160 633 HG12 ILE 100 HG12 ILE 100 -5.570 -2.523 8.461 634 HG13 ILE 100 HG13 ILE 100 -6.529 -3.978 8.710 635 HG21 ILE 100 HG21 ILE 100 -7.513 -0.344 8.924 636 HG22 ILE 100 HG22 ILE 100 -6.284 -0.680 7.705 637 HG23 ILE 100 HG23 ILE 100 -7.942 -0.333 7.214 638 HD11 ILE 100 HD11 ILE 100 -4.918 -3.935 6.740 639 HD12 ILE 100 HD12 ILE 100 -6.568 -4.474 6.431 640 HD13 ILE 100 HD13 ILE 100 -6.073 -2.844 5.976 641 H LEU 101 H LEU 101 -10.658 -2.930 7.971 642 HA LEU 101 HA LEU 101 -11.733 -0.313 8.134 643 HB2 LEU 101 HB2 LEU 101 -12.933 -2.964 7.373 644 HB3 LEU 101 HB3 LEU 101 -13.839 -1.454 7.318 645 HG LEU 101 HG LEU 101 -11.275 -1.753 5.797 646 HD11 LEU 101 HD11 LEU 101 -13.316 -2.156 3.975 647 HD12 LEU 101 HD12 LEU 101 -13.742 -3.197 5.333 648 HD13 LEU 101 HD13 LEU 101 -12.169 -3.364 4.554 649 HD21 LEU 101 HD21 LEU 101 -12.528 -0.139 4.304 650 HD22 LEU 101 HD22 LEU 101 -12.057 0.473 5.890 651 HD23 LEU 101 HD23 LEU 101 -13.725 -0.020 5.593 652 H ASP 102 H ASP 102 -12.134 -3.220 10.049 653 HA ASP 102 HA ASP 102 -14.430 -2.500 11.483 654 HB2 ASP 102 HB2 ASP 102 -13.022 -4.731 11.415 655 HB3 ASP 102 HB3 ASP 102 -12.234 -4.024 12.824 656 H ASN 103 H ASN 103 -11.108 -1.509 11.800 657 HA ASN 103 HA ASN 103 -11.681 -0.135 14.321 658 HB2 ASN 103 HB2 ASN 103 -9.109 -0.694 12.841 659 HB3 ASN 103 HB3 ASN 103 -9.189 0.355 14.254 660 HD21 ASN 103 HD21 ASN 103 -9.741 -2.912 13.095 661 HD22 ASN 103 HD22 ASN 103 -9.554 -3.686 14.629 662 H VAL 104 H VAL 104 -10.778 0.478 10.977 663 HA VAL 104 HA VAL 104 -10.437 3.298 11.312 664 HB VAL 104 HB VAL 104 -10.856 1.651 8.814 665 HG11 VAL 104 HG11 VAL 104 -11.550 3.888 8.337 666 HG12 VAL 104 HG12 VAL 104 -10.137 4.559 9.155 667 HG13 VAL 104 HG13 VAL 104 -9.943 3.663 7.646 668 HG21 VAL 104 HG21 VAL 104 -8.582 1.482 8.622 669 HG22 VAL 104 HG22 VAL 104 -8.282 2.957 9.541 670 HG23 VAL 104 HG23 VAL 104 -8.739 1.473 10.379 671 H GLN 105 H GLN 105 -12.917 1.416 9.564 672 HA GLN 105 HA GLN 105 -14.672 3.446 8.987 673 HB2 GLN 105 HB2 GLN 105 -15.433 0.639 9.811 674 HB3 GLN 105 HB3 GLN 105 -16.425 1.751 8.876 675 HG2 GLN 105 HG2 GLN 105 -13.731 0.817 7.941 676 HG3 GLN 105 HG3 GLN 105 -15.219 -0.062 7.594 677 HE21 GLN 105 HE21 GLN 105 -13.438 2.887 7.052 678 HE22 GLN 105 HE22 GLN 105 -14.328 3.402 5.663 679 H VAL 106 H VAL 106 -14.105 1.881 12.046 680 HA VAL 106 HA VAL 106 -16.465 2.776 13.355 681 HB VAL 106 HB VAL 106 -13.846 1.670 14.292 682 HG11 VAL 106 HG11 VAL 106 -15.885 3.100 15.961 683 HG12 VAL 106 HG12 VAL 106 -14.897 1.802 16.637 684 HG13 VAL 106 HG13 VAL 106 -14.128 3.249 15.982 685 HG21 VAL 106 HG21 VAL 106 -15.729 0.234 13.467 686 HG22 VAL 106 HG22 VAL 106 -15.187 -0.126 15.106 687 HG23 VAL 106 HG23 VAL 106 -16.673 0.789 14.849 688 H VAL 107 H VAL 107 -13.093 3.929 13.475 689 HA VAL 107 HA VAL 107 -13.687 6.209 15.059 690 HB VAL 107 HB VAL 107 -11.437 5.311 15.018 691 HG11 VAL 107 HG11 VAL 107 -11.066 4.416 12.922 692 HG12 VAL 107 HG12 VAL 107 -11.647 5.858 12.087 693 HG13 VAL 107 HG13 VAL 107 -10.070 5.870 12.878 694 HG21 VAL 107 HG21 VAL 107 -11.685 7.677 15.519 695 HG22 VAL 107 HG22 VAL 107 -10.178 7.388 14.650 696 HG23 VAL 107 HG23 VAL 107 -11.568 8.070 13.804 697 H LEU 108 H LEU 108 -13.849 5.547 11.668 698 HA LEU 108 HA LEU 108 -13.759 8.262 10.782 699 HB2 LEU 108 HB2 LEU 108 -13.566 7.284 8.806 700 HB3 LEU 108 HB3 LEU 108 -13.759 5.721 9.596 701 HG LEU 108 HG LEU 108 -16.263 6.042 9.286 702 HD11 LEU 108 HD11 LEU 108 -16.955 8.012 8.539 703 HD12 LEU 108 HD12 LEU 108 -16.209 7.628 6.988 704 HD13 LEU 108 HD13 LEU 108 -15.302 8.527 8.202 705 HD21 LEU 108 HD21 LEU 108 -15.252 5.931 6.561 706 HD22 LEU 108 HD22 LEU 108 -16.066 4.694 7.519 707 HD23 LEU 108 HD23 LEU 108 -14.324 4.929 7.678 708 H GLN 109 H GLN 109 -16.324 5.983 11.598 709 HA GLN 109 HA GLN 109 -18.486 7.575 10.725 710 HB2 GLN 109 HB2 GLN 109 -18.220 5.277 12.634 711 HB3 GLN 109 HB3 GLN 109 -19.751 6.129 12.483 712 HG2 GLN 109 HG2 GLN 109 -19.973 5.527 10.211 713 HG3 GLN 109 HG3 GLN 109 -18.307 4.955 10.128 714 HE21 GLN 109 HE21 GLN 109 -17.779 3.113 11.572 715 HE22 GLN 109 HE22 GLN 109 -18.974 1.882 11.774 716 H GLN 110 H GLN 110 -16.827 7.291 13.833 717 HA GLN 110 HA GLN 110 -18.566 8.948 15.307 718 HB2 GLN 110 HB2 GLN 110 -15.648 8.282 15.698 719 HB3 GLN 110 HB3 GLN 110 -16.602 9.194 16.860 720 HG2 GLN 110 HG2 GLN 110 -18.163 7.233 16.965 721 HG3 GLN 110 HG3 GLN 110 -16.983 6.339 16.007 722 HE21 GLN 110 HE21 GLN 110 -15.241 5.482 16.983 723 HE22 GLN 110 HE22 GLN 110 -14.889 5.633 18.667 724 H THR 111 H THR 111 -16.345 9.672 12.854 725 HA THR 111 HA THR 111 -15.962 12.432 13.738 726 HB THR 111 HB THR 111 -14.815 10.933 11.377 727 HG1 THR 111 HG1 THR 111 -13.806 10.314 13.264 728 HG21 THR 111 HG21 THR 111 -14.338 13.766 12.306 729 HG22 THR 111 HG22 THR 111 -15.058 13.262 10.778 730 HG23 THR 111 HG23 THR 111 -13.359 12.925 11.106 731 H TYR 112 H TYR 112 -16.954 10.790 10.726 732 HA TYR 112 HA TYR 112 -18.557 13.160 10.057 733 HB2 TYR 112 HB2 TYR 112 -17.876 10.913 8.170 734 HB3 TYR 112 HB3 TYR 112 -18.384 12.551 7.777 735 HD1 TYR 112 HD1 TYR 112 -15.576 10.438 8.807 736 HD2 TYR 112 HD2 TYR 112 -16.804 14.394 7.835 737 HE1 TYR 112 HE1 TYR 112 -13.220 11.113 8.606 738 HE2 TYR 112 HE2 TYR 112 -14.451 15.081 7.630 739 HH TYR 112 HH TYR 112 -11.825 12.738 7.900 740 H GLY 113 H GLY 113 -18.693 9.624 10.229 741 HA2 GLY 113 HA2 GLY 113 -20.678 8.610 11.209 742 HA3 GLY 113 HA3 GLY 113 -21.631 9.853 10.412 743 H SER 114 H SER 114 -19.643 9.330 8.053 744 HA SER 114 HA SER 114 -21.338 7.286 6.835 745 HB2 SER 114 HB2 SER 114 -20.420 8.051 4.705 746 HB3 SER 114 HB3 SER 114 -21.001 9.429 5.640 747 HG SER 114 HG SER 114 -18.469 8.824 4.805 748 H THR 115 H THR 115 -19.812 6.182 4.931 749 HA THR 115 HA THR 115 -17.333 5.194 6.065 750 HB THR 115 HB THR 115 -17.982 2.822 5.897 751 HG1 THR 115 HG1 THR 115 -19.706 2.812 4.520 752 HG21 THR 115 HG21 THR 115 -19.953 4.189 7.709 753 HG22 THR 115 HG22 THR 115 -18.218 4.229 8.029 754 HG23 THR 115 HG23 THR 115 -19.071 2.686 7.972 755 H LEU 116 H LEU 116 -16.631 3.214 4.506 756 HA LEU 116 HA LEU 116 -16.630 4.399 1.839 757 HB2 LEU 116 HB2 LEU 116 -14.725 3.037 3.430 758 HB3 LEU 116 HB3 LEU 116 -15.024 2.049 2.003 759 HG LEU 116 HG LEU 116 -14.672 4.493 0.874 760 HD11 LEU 116 HD11 LEU 116 -14.101 5.636 2.885 761 HD12 LEU 116 HD12 LEU 116 -12.618 5.417 1.958 762 HD13 LEU 116 HD13 LEU 116 -12.952 4.379 3.344 763 HD21 LEU 116 HD21 LEU 116 -12.917 3.493 -0.122 764 HD22 LEU 116 HD22 LEU 116 -13.500 2.065 0.736 765 HD23 LEU 116 HD23 LEU 116 -12.178 3.022 1.409 766 H LYS 117 H LYS 117 -16.958 3.107 -0.058 767 HA LYS 117 HA LYS 117 -18.872 0.919 0.401 768 HB2 LYS 117 HB2 LYS 117 -19.955 2.630 -0.810 769 HB3 LYS 117 HB3 LYS 117 -18.555 2.903 -1.838 770 HG2 LYS 117 HG2 LYS 117 -20.385 1.774 -3.016 771 HG3 LYS 117 HG3 LYS 117 -18.916 0.798 -2.961 772 HD2 LYS 117 HD2 LYS 117 -20.399 0.145 -0.658 773 HD3 LYS 117 HD3 LYS 117 -21.544 0.172 -2.001 774 HE2 LYS 117 HE2 LYS 117 -18.997 -1.157 -2.592 775 HE3 LYS 117 HE3 LYS 117 -19.959 -1.943 -1.340 776 HZ1 LYS 117 HZ1 LYS 117 -20.434 -1.755 -4.176 777 HZ2 LYS 117 HZ2 LYS 117 -21.796 -1.407 -3.237 778 HZ3 LYS 117 HZ3 LYS 117 -21.003 -2.889 -3.056 779 H VAL 118 H VAL 118 -17.609 -0.880 0.472 780 HA VAL 118 HA VAL 118 -15.920 -1.408 -1.888 781 HB VAL 118 HB VAL 118 -14.724 -3.058 -0.350 782 HG11 VAL 118 HG11 VAL 118 -13.164 -1.485 -0.473 783 HG12 VAL 118 HG12 VAL 118 -14.401 -0.258 -0.749 784 HG13 VAL 118 HG13 VAL 118 -13.900 -0.652 0.896 785 HG21 VAL 118 HG21 VAL 118 -15.157 -3.153 1.853 786 HG22 VAL 118 HG22 VAL 118 -15.419 -1.414 1.981 787 HG23 VAL 118 HG23 VAL 118 -16.715 -2.461 1.404 788 H THR 119 H THR 119 -17.445 -2.461 -3.121 789 HA THR 119 HA THR 119 -19.349 -4.287 -2.313 790 HB THR 119 HB THR 119 -17.961 -4.866 -4.879 791 HG1 THR 119 HG1 THR 119 -18.483 -2.952 -5.775 792 HG21 THR 119 HG21 THR 119 -20.862 -4.235 -4.464 793 HG22 THR 119 HG22 THR 119 -20.209 -5.803 -3.991 794 HG23 THR 119 HG23 THR 119 -20.111 -5.278 -5.671 795 H LYS 207 H LYS 207 8.392 -7.719 16.346 796 HA LYS 207 HA LYS 207 9.960 -7.154 13.986 797 HB2 LYS 207 HB2 LYS 207 9.828 -9.355 15.429 798 HB3 LYS 207 HB3 LYS 207 8.469 -9.719 14.373 799 HG2 LYS 207 HG2 LYS 207 9.786 -9.995 12.538 800 HG3 LYS 207 HG3 LYS 207 11.013 -8.863 13.109 801 HD2 LYS 207 HD2 LYS 207 12.031 -10.974 13.248 802 HD3 LYS 207 HD3 LYS 207 11.540 -10.601 14.902 803 HE2 LYS 207 HE2 LYS 207 10.778 -12.751 14.732 804 HE3 LYS 207 HE3 LYS 207 9.350 -11.874 14.180 805 HZ1 LYS 207 HZ1 LYS 207 11.085 -13.656 12.729 806 HZ2 LYS 207 HZ2 LYS 207 10.754 -12.219 11.901 807 HZ3 LYS 207 HZ3 LYS 207 9.483 -13.212 12.415 808 H SER 208 H SER 208 9.237 -6.838 11.958 809 HA SER 208 HA SER 208 6.736 -7.661 10.963 810 HB2 SER 208 HB2 SER 208 5.408 -5.740 11.016 811 HB3 SER 208 HB3 SER 208 6.150 -5.735 12.615 812 HG SER 208 HG SER 208 6.215 -3.691 11.447 813 H PHE 209 H PHE 209 6.387 -7.015 8.766 814 HA PHE 209 HA PHE 209 8.765 -6.768 7.275 815 HB2 PHE 209 HB2 PHE 209 6.898 -7.893 6.284 816 HB3 PHE 209 HB3 PHE 209 5.862 -6.485 6.493 817 HD1 PHE 209 HD2 PHE 209 8.925 -7.631 4.730 818 HD2 PHE 209 HD1 PHE 209 5.618 -4.954 4.771 819 HE1 PHE 209 HE2 PHE 209 9.523 -6.865 2.470 820 HE2 PHE 209 HE1 PHE 209 6.209 -4.184 2.510 821 HZ PHE 209 HZ PHE 209 8.164 -5.138 1.358 822 H PHE 210 H PHE 210 6.138 -4.451 7.889 823 HA PHE 210 HA PHE 210 7.198 -2.319 6.420 824 HB2 PHE 210 HB2 PHE 210 5.367 -2.375 8.821 825 HB3 PHE 210 HB3 PHE 210 5.772 -0.892 7.963 826 HD1 PHE 210 HD1 PHE 210 5.452 -1.101 5.313 827 HD2 PHE 210 HD2 PHE 210 3.411 -3.412 8.248 828 HE1 PHE 210 HE1 PHE 210 3.639 -1.535 3.706 829 HE2 PHE 210 HE2 PHE 210 1.596 -3.850 6.646 830 HZ PHE 210 HZ PHE 210 1.709 -2.911 4.372 831 H ASP 211 H ASP 211 8.004 -3.563 9.553 832 HA ASP 211 HA ASP 211 9.356 -1.243 10.516 833 HB2 ASP 211 HB2 ASP 211 8.663 -2.734 12.194 834 HB3 ASP 211 HB3 ASP 211 9.310 -4.134 11.343 835 H LYS 212 H LYS 212 10.415 -4.245 8.953 836 HA LYS 212 HA LYS 212 13.184 -3.498 8.969 837 HB2 LYS 212 HB2 LYS 212 13.540 -5.505 7.655 838 HB3 LYS 212 HB3 LYS 212 12.443 -5.858 8.984 839 HG2 LYS 212 HG2 LYS 212 10.561 -5.881 7.529 840 HG3 LYS 212 HG3 LYS 212 11.518 -5.251 6.187 841 HD2 LYS 212 HD2 LYS 212 12.927 -7.482 6.857 842 HD3 LYS 212 HD3 LYS 212 11.275 -7.991 7.215 843 HE2 LYS 212 HE2 LYS 212 10.861 -6.842 4.838 844 HE3 LYS 212 HE3 LYS 212 12.545 -7.318 4.625 845 HZ1 LYS 212 HZ1 LYS 212 11.090 -9.054 3.853 846 HZ2 LYS 212 HZ2 LYS 212 10.292 -9.114 5.343 847 HZ3 LYS 212 HZ3 LYS 212 11.912 -9.591 5.229 848 H LYS 213 H LYS 213 10.495 -2.858 6.942 849 HA LYS 213 HA LYS 213 12.121 -2.210 4.621 850 HB2 LYS 213 HB2 LYS 213 10.022 -3.218 4.115 851 HB3 LYS 213 HB3 LYS 213 9.156 -2.102 5.163 852 HG2 LYS 213 HG2 LYS 213 8.792 -1.541 2.840 853 HG3 LYS 213 HG3 LYS 213 9.704 -0.261 3.644 854 HD2 LYS 213 HD2 LYS 213 11.234 -0.430 2.038 855 HD3 LYS 213 HD3 LYS 213 11.618 -2.044 2.639 856 HE2 LYS 213 HE2 LYS 213 10.362 -3.090 1.028 857 HE3 LYS 213 HE3 LYS 213 9.275 -1.717 0.832 858 HZ1 LYS 213 HZ1 LYS 213 11.754 -0.814 0.049 859 HZ2 LYS 213 HZ2 LYS 213 10.450 -1.194 -0.958 860 HZ3 LYS 213 HZ3 LYS 213 11.627 -2.362 -0.623 861 H ARG 214 H ARG 214 10.266 -0.569 7.129 862 HA ARG 214 HA ARG 214 10.603 2.044 6.029 863 HB2 ARG 214 HB2 ARG 214 9.571 2.849 8.009 864 HB3 ARG 214 HB3 ARG 214 8.779 1.327 7.626 865 HG2 ARG 214 HG2 ARG 214 9.137 0.795 9.757 866 HG3 ARG 214 HG3 ARG 214 10.816 0.537 9.280 867 HD2 ARG 214 HD2 ARG 214 10.639 1.982 11.254 868 HD3 ARG 214 HD3 ARG 214 11.362 2.826 9.885 869 HE ARG 214 HE ARG 214 9.605 4.281 9.920 870 HH11 ARG 214 HH11 ARG 214 8.704 1.398 11.651 871 HH12 ARG 214 HH12 ARG 214 7.192 2.043 12.198 872 HH21 ARG 214 HH21 ARG 214 7.617 5.141 10.634 873 HH22 ARG 214 HH22 ARG 214 6.574 4.172 11.618 874 H SER 215 H SER 215 12.495 -0.021 8.059 875 HA SER 215 HA SER 215 14.150 2.066 9.138 876 HB2 SER 215 HB2 SER 215 15.372 0.340 10.210 877 HB3 SER 215 HB3 SER 215 13.699 -0.216 10.205 878 HG SER 215 HG SER 215 14.543 -1.175 8.028 879 H GLU 216 H GLU 216 14.132 0.094 6.294 880 HA GLU 216 HA GLU 216 16.877 0.316 5.621 881 HB2 GLU 216 HB2 GLU 216 14.387 -0.484 4.206 882 HB3 GLU 216 HB3 GLU 216 15.770 -0.038 3.216 883 HG2 GLU 216 HG2 GLU 216 17.097 -1.696 4.626 884 HG3 GLU 216 HG3 GLU 216 15.532 -2.279 5.191 885 H ARG 217 H ARG 217 14.006 2.134 4.573 886 HA ARG 217 HA ARG 217 15.373 3.916 2.876 887 HB2 ARG 217 HB2 ARG 217 13.360 5.224 2.873 888 HB3 ARG 217 HB3 ARG 217 12.906 3.525 2.880 889 HG2 ARG 217 HG2 ARG 217 12.342 3.612 5.198 890 HG3 ARG 217 HG3 ARG 217 12.998 5.243 5.347 891 HD2 ARG 217 HD2 ARG 217 10.583 4.388 3.759 892 HD3 ARG 217 HD3 ARG 217 10.599 5.371 5.223 893 HE ARG 217 HE ARG 217 12.110 6.821 3.535 894 HH11 ARG 217 HH11 ARG 217 8.978 5.339 3.199 895 HH12 ARG 217 HH12 ARG 217 8.391 6.527 2.082 896 HH21 ARG 217 HH21 ARG 217 11.349 8.390 2.065 897 HH22 ARG 217 HH22 ARG 217 9.741 8.260 1.436 898 H ILE 218 H ILE 218 14.977 3.814 6.312 899 HA ILE 218 HA ILE 218 15.753 6.576 6.706 900 HB ILE 218 HB ILE 218 15.396 4.350 8.717 901 HG12 ILE 218 HG12 ILE 218 13.561 6.692 8.237 902 HG13 ILE 218 HG13 ILE 218 13.372 5.174 7.366 903 HG21 ILE 218 HG21 ILE 218 15.985 7.276 9.017 904 HG22 ILE 218 HG22 ILE 218 15.205 6.351 10.299 905 HG23 ILE 218 HG23 ILE 218 16.817 5.900 9.742 906 HD11 ILE 218 HD11 ILE 218 12.870 5.805 10.216 907 HD12 ILE 218 HD12 ILE 218 11.935 4.824 9.088 908 HD13 ILE 218 HD13 ILE 218 13.411 4.178 9.805 909 H SER 219 H SER 219 17.121 3.475 7.830 910 HA SER 219 HA SER 219 19.730 3.995 6.912 911 HB2 SER 219 HB2 SER 219 20.883 4.771 8.787 912 HB3 SER 219 HB3 SER 219 19.388 5.703 8.853 913 HG SER 219 HG SER 219 20.375 3.939 10.636 914 H ASN 220 H ASN 220 21.057 2.228 7.158 915 HA ASN 220 HA ASN 220 19.904 -0.043 8.641 916 HB2 ASN 220 HB2 ASN 220 21.031 -1.503 6.959 917 HB3 ASN 220 HB3 ASN 220 19.781 -0.472 6.266 918 HD21 ASN 220 HD21 ASN 220 22.930 -1.521 5.997 919 HD22 ASN 220 HD22 ASN 220 23.511 -0.337 4.881
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