NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
611271 | 5tr5 | 30197 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 1.339 -1.283 0.499 2 H2 MET 1 HT2 MET 1 0.265 -0.373 -0.421 3 H3 MET 1 HT3 MET 1 1.427 0.407 0.544 4 HA MET 1 HA MET 1 2.037 0.463 -1.778 5 HB2 MET 1 HB2 MET 1 4.294 -0.298 -1.545 6 HB3 MET 1 HB1 MET 1 3.784 0.275 0.034 7 HG2 MET 1 HG2 MET 1 3.417 -2.021 0.760 8 HG3 MET 1 HG1 MET 1 3.904 -2.605 -0.831 9 HE1 MET 1 HE1 MET 1 5.350 -3.836 1.666 10 HE2 MET 1 HE2 MET 1 7.019 -3.755 1.094 11 HE3 MET 1 HE3 MET 1 5.723 -4.172 -0.024 12 H ILE 2 H ILE 2 2.800 -0.766 -3.623 13 HA ILE 2 HA ILE 2 1.311 -3.273 -3.862 14 HB ILE 2 HB ILE 2 2.316 -1.381 -5.995 15 HG12 ILE 2 HG12 ILE 2 -0.491 -2.037 -5.069 16 HG13 ILE 2 HG11 ILE 2 0.380 -0.548 -4.720 17 HG21 ILE 2 HG21 ILE 2 2.396 -3.681 -6.783 18 HG22 ILE 2 HG22 ILE 2 1.100 -2.791 -7.582 19 HG23 ILE 2 HG23 ILE 2 0.723 -3.925 -6.283 20 HD11 ILE 2 HD11 ILE 2 0.407 -0.013 -7.102 21 HD12 ILE 2 HD12 ILE 2 -1.237 -0.239 -6.501 22 HD13 ILE 2 HD13 ILE 2 -0.459 -1.509 -7.445 23 H VAL 3 H VAL 3 2.407 -5.105 -3.875 24 HA VAL 3 HA VAL 3 5.267 -5.008 -4.518 25 HB VAL 3 HB VAL 3 5.465 -7.193 -3.402 26 HG11 VAL 3 HG11 VAL 3 4.998 -6.452 -1.091 27 HG12 VAL 3 HG12 VAL 3 4.115 -5.072 -1.747 28 HG13 VAL 3 HG13 VAL 3 5.841 -5.246 -2.059 29 HG21 VAL 3 HG21 VAL 3 2.530 -6.879 -2.769 30 HG22 VAL 3 HG22 VAL 3 3.599 -8.119 -2.112 31 HG23 VAL 3 HG23 VAL 3 3.243 -8.087 -3.841 32 H PHE 4 H PHE 4 6.166 -6.502 -5.946 33 HA PHE 4 HA PHE 4 4.302 -7.428 -7.992 34 HB2 PHE 4 HB2 PHE 4 7.330 -7.367 -8.023 35 HB3 PHE 4 HB1 PHE 4 6.282 -7.704 -9.394 36 HD1 PHE 4 HD1 PHE 4 8.014 -5.204 -7.579 37 HD2 PHE 4 HD2 PHE 4 4.650 -5.854 -10.096 38 HE1 PHE 4 HE1 PHE 4 7.948 -2.800 -8.103 39 HE2 PHE 4 HE2 PHE 4 4.577 -3.457 -10.629 40 HZ PHE 4 HZ PHE 4 6.229 -1.926 -9.633 41 H VAL 5 H VAL 5 3.796 -9.515 -8.238 42 HA VAL 5 HA VAL 5 5.518 -11.507 -6.991 43 HB VAL 5 HB VAL 5 3.956 -11.007 -5.246 44 HG11 VAL 5 HG11 VAL 5 2.251 -9.900 -6.528 45 HG12 VAL 5 HG12 VAL 5 1.542 -11.170 -5.530 46 HG13 VAL 5 HG13 VAL 5 1.773 -11.431 -7.259 47 HG21 VAL 5 HG21 VAL 5 3.127 -13.542 -6.638 48 HG22 VAL 5 HG22 VAL 5 2.791 -13.131 -4.956 49 HG23 VAL 5 HG23 VAL 5 4.459 -13.360 -5.491 50 H ARG 6 H ARG 6 5.633 -13.387 -8.037 51 HA ARG 6 HA ARG 6 3.880 -13.801 -10.370 52 HB2 ARG 6 HB2 ARG 6 6.770 -14.420 -9.886 53 HB3 ARG 6 HB1 ARG 6 5.859 -15.352 -11.056 54 HG2 ARG 6 HG2 ARG 6 5.334 -13.286 -12.260 55 HG3 ARG 6 HG1 ARG 6 6.313 -12.389 -11.095 56 HD2 ARG 6 HD2 ARG 6 8.272 -13.684 -11.722 57 HD3 ARG 6 HD1 ARG 6 7.299 -14.628 -12.849 58 HE ARG 6 HE ARG 6 6.941 -12.056 -13.653 59 HH11 ARG 6 HH11 ARG 6 9.739 -14.105 -13.129 60 HH12 ARG 6 HH12 ARG 6 10.698 -13.319 -14.334 61 HH21 ARG 6 HH21 ARG 6 8.206 -11.016 -15.248 62 HH22 ARG 6 HH22 ARG 6 9.823 -11.556 -15.540 63 H PHE 7 H PHE 7 2.416 -15.306 -9.957 64 HA PHE 7 HA PHE 7 3.034 -17.460 -8.106 65 HB2 PHE 7 HB2 PHE 7 0.784 -16.303 -8.097 66 HB3 PHE 7 HB1 PHE 7 0.479 -17.016 -9.671 67 HD1 PHE 7 HD1 PHE 7 1.038 -17.775 -6.113 68 HD2 PHE 7 HD2 PHE 7 -0.250 -19.250 -9.885 69 HE1 PHE 7 HE1 PHE 7 0.145 -19.786 -5.018 70 HE2 PHE 7 HE2 PHE 7 -1.144 -21.266 -8.798 71 HZ PHE 7 HZ PHE 7 -0.946 -21.536 -6.361 72 H ASN 8 H ASN 8 3.207 -19.588 -8.699 73 HA ASN 8 HA ASN 8 4.530 -20.260 -11.003 74 HB2 ASN 8 HB2 ASN 8 4.458 -21.684 -9.027 75 HB3 ASN 8 HB1 ASN 8 2.771 -22.069 -9.348 76 HD21 ASN 8 HD21 ASN 8 2.263 -23.554 -10.932 77 HD22 ASN 8 HD22 ASN 8 3.454 -24.520 -11.726 78 H SER 9 H SER 9 1.041 -20.272 -10.543 79 HA SER 9 HA SER 9 0.704 -21.225 -13.299 80 HB2 SER 9 HB2 SER 9 -0.435 -22.514 -11.494 81 HB3 SER 9 HB1 SER 9 -1.357 -21.071 -11.082 82 HG SER 9 HG SER 9 -2.187 -21.120 -13.239 83 H SER 10 H SER 10 1.370 -18.425 -12.351 84 HA SER 10 HA SER 10 -0.700 -17.071 -13.904 85 HB2 SER 10 HB2 SER 10 0.220 -16.039 -11.217 86 HB3 SER 10 HB1 SER 10 -1.005 -15.328 -12.257 87 HG SER 10 HG SER 10 -1.810 -16.634 -10.459 88 H HIS 11 H HIS 11 0.124 -14.519 -13.737 89 HA HIS 11 HA HIS 11 2.894 -14.627 -14.702 90 HB2 HIS 11 HB2 HIS 11 2.401 -12.578 -15.953 91 HB3 HIS 11 HB1 HIS 11 1.209 -13.809 -16.337 92 HD2 HIS 11 HD2 HIS 11 -1.368 -13.347 -15.156 93 HE1 HIS 11 HE1 HIS 11 -0.583 -9.233 -14.552 94 HE2 HIS 11 HE2 HIS 11 -2.389 -10.989 -14.783 95 H GLY 12 H GLY 12 3.551 -11.940 -14.505 96 HA2 GLY 12 HA2 GLY 12 3.972 -11.667 -11.654 97 HA3 GLY 12 HA1 GLY 12 4.633 -10.631 -12.915 98 H PHE 13 H PHE 13 1.981 -11.198 -10.776 99 HA PHE 13 HA PHE 13 0.604 -8.847 -11.819 100 HB2 PHE 13 HB2 PHE 13 -1.314 -9.623 -10.374 101 HB3 PHE 13 HB1 PHE 13 -0.883 -10.703 -11.689 102 HD1 PHE 13 HD1 PHE 13 -1.059 -10.273 -8.078 103 HD2 PHE 13 HD2 PHE 13 0.190 -12.850 -11.218 104 HE1 PHE 13 HE1 PHE 13 -0.910 -12.140 -6.485 105 HE2 PHE 13 HE2 PHE 13 0.350 -14.716 -9.628 106 HZ PHE 13 HZ PHE 13 -0.205 -14.365 -7.258 107 HA PRO 14 HA PRO 14 1.728 -6.600 -8.193 108 HB2 PRO 14 HB2 PRO 14 0.185 -4.447 -8.517 109 HB3 PRO 14 HB1 PRO 14 1.477 -4.826 -9.661 110 HG2 PRO 14 HG2 PRO 14 -1.461 -5.128 -9.958 111 HG3 PRO 14 HG1 PRO 14 -0.235 -4.790 -11.188 112 HD2 PRO 14 HD2 PRO 14 -1.413 -7.303 -10.584 113 HD3 PRO 14 HD1 PRO 14 -0.054 -6.993 -11.680 114 H VAL 15 H VAL 15 1.186 -6.914 -6.118 115 HA VAL 15 HA VAL 15 -1.673 -7.045 -5.436 116 HB VAL 15 HB VAL 15 0.646 -8.529 -4.148 117 HG11 VAL 15 HG11 VAL 15 -0.964 -9.435 -2.561 118 HG12 VAL 15 HG12 VAL 15 -2.247 -8.462 -3.276 119 HG13 VAL 15 HG13 VAL 15 -0.917 -7.677 -2.428 120 HG21 VAL 15 HG21 VAL 15 -1.862 -9.479 -5.523 121 HG22 VAL 15 HG22 VAL 15 -0.642 -10.508 -4.771 122 HG23 VAL 15 HG23 VAL 15 -0.226 -9.533 -6.182 123 H GLU 16 H GLU 16 -2.413 -5.487 -4.208 124 HA GLU 16 HA GLU 16 -0.611 -3.569 -3.013 125 HB2 GLU 16 HB2 GLU 16 -2.940 -3.200 -4.217 126 HB3 GLU 16 HB1 GLU 16 -3.581 -3.522 -2.618 127 HG2 GLU 16 HG2 GLU 16 -1.642 -1.323 -3.330 128 HG3 GLU 16 HG1 GLU 16 -3.368 -1.127 -3.063 129 H VAL 17 H VAL 17 0.111 -3.739 -1.001 130 HA VAL 17 HA VAL 17 -1.518 -5.141 1.004 131 HB VAL 17 HB VAL 17 0.480 -6.177 1.965 132 HG11 VAL 17 HG11 VAL 17 0.103 -6.772 -0.956 133 HG12 VAL 17 HG12 VAL 17 -0.754 -7.512 0.400 134 HG13 VAL 17 HG13 VAL 17 0.973 -7.804 0.174 135 HG21 VAL 17 HG21 VAL 17 2.615 -6.168 0.732 136 HG22 VAL 17 HG22 VAL 17 2.158 -4.567 1.307 137 HG23 VAL 17 HG23 VAL 17 1.941 -4.988 -0.393 138 H ASP 18 H ASP 18 -0.959 -4.553 3.210 139 HA ASP 18 HA ASP 18 -0.205 -1.755 3.360 140 HB2 ASP 18 HB2 ASP 18 -1.455 -3.680 5.308 141 HB3 ASP 18 HB1 ASP 18 -0.807 -2.137 5.848 142 H SER 19 H SER 19 1.275 -1.091 5.129 143 HA SER 19 HA SER 19 3.743 -2.410 4.786 144 HB2 SER 19 HB2 SER 19 3.019 -0.339 6.861 145 HB3 SER 19 HB1 SER 19 4.635 -0.718 6.256 146 HG SER 19 HG SER 19 4.044 0.989 5.047 147 H ASP 20 H ASP 20 1.239 -2.657 7.167 148 HA ASP 20 HA ASP 20 2.958 -4.131 8.993 149 HB2 ASP 20 HB2 ASP 20 0.057 -3.341 9.263 150 HB3 ASP 20 HB1 ASP 20 1.006 -4.154 10.502 151 H THR 21 H THR 21 1.437 -4.958 6.266 152 HA THR 21 HA THR 21 0.004 -7.275 7.037 153 HB THR 21 HB THR 21 1.363 -6.676 4.390 154 HG1 THR 21 HG1 THR 21 -1.121 -5.945 5.513 155 HG21 THR 21 HG21 THR 21 -0.887 -8.583 5.066 156 HG22 THR 21 HG22 THR 21 0.766 -9.048 4.660 157 HG23 THR 21 HG23 THR 21 -0.254 -8.265 3.451 158 H SER 22 H SER 22 0.889 -8.965 8.020 159 HA SER 22 HA SER 22 3.683 -9.419 8.078 160 HB2 SER 22 HB2 SER 22 1.476 -11.322 8.873 161 HB3 SER 22 HB1 SER 22 3.146 -11.329 9.444 162 HG SER 22 HG SER 22 2.599 -9.924 10.888 163 H ILE 23 H ILE 23 4.851 -11.188 7.220 164 HA ILE 23 HA ILE 23 4.414 -11.764 4.543 165 HB ILE 23 HB ILE 23 6.011 -13.431 6.499 166 HG12 ILE 23 HG12 ILE 23 6.739 -11.108 6.529 167 HG13 ILE 23 HG11 ILE 23 7.939 -12.094 5.705 168 HG21 ILE 23 HG21 ILE 23 5.534 -14.576 4.355 169 HG22 ILE 23 HG22 ILE 23 7.247 -14.240 4.585 170 HG23 ILE 23 HG23 ILE 23 6.294 -13.235 3.496 171 HD11 ILE 23 HD11 ILE 23 7.635 -10.006 4.545 172 HD12 ILE 23 HD12 ILE 23 5.902 -10.298 4.407 173 HD13 ILE 23 HD13 ILE 23 7.041 -11.333 3.544 174 H PHE 24 H PHE 24 3.608 -13.778 7.377 175 HA PHE 24 HA PHE 24 2.588 -15.932 5.867 176 HB2 PHE 24 HB2 PHE 24 3.199 -16.111 8.261 177 HB3 PHE 24 HB1 PHE 24 1.812 -15.112 8.671 178 HD1 PHE 24 HD1 PHE 24 2.345 -18.073 6.451 179 HD2 PHE 24 HD2 PHE 24 0.136 -16.338 9.646 180 HE1 PHE 24 HE1 PHE 24 0.936 -20.086 6.567 181 HE2 PHE 24 HE2 PHE 24 -1.276 -18.346 9.766 182 HZ PHE 24 HZ PHE 24 -0.877 -20.224 8.225 183 H GLN 25 H GLN 25 1.094 -13.020 7.181 184 HA GLN 25 HA GLN 25 -1.563 -13.625 6.512 185 HB2 GLN 25 HB2 GLN 25 -0.149 -10.971 6.762 186 HB3 GLN 25 HB1 GLN 25 -1.879 -11.121 6.489 187 HG2 GLN 25 HG2 GLN 25 -2.114 -12.328 8.585 188 HG3 GLN 25 HG1 GLN 25 -0.378 -12.198 8.862 189 HE21 GLN 25 HE21 GLN 25 -2.624 -11.216 10.437 190 HE22 GLN 25 HE22 GLN 25 -2.382 -9.514 10.604 191 H LEU 26 H LEU 26 1.027 -12.043 4.691 192 HA LEU 26 HA LEU 26 -0.498 -11.476 2.388 193 HB2 LEU 26 HB2 LEU 26 1.634 -10.386 2.733 194 HB3 LEU 26 HB1 LEU 26 2.466 -11.931 2.729 195 HG LEU 26 HG LEU 26 2.012 -12.223 0.362 196 HD11 LEU 26 HD11 LEU 26 -0.134 -11.203 0.144 197 HD12 LEU 26 HD12 LEU 26 0.982 -10.352 -0.925 198 HD13 LEU 26 HD13 LEU 26 0.506 -9.632 0.612 199 HD21 LEU 26 HD21 LEU 26 3.101 -9.483 0.981 200 HD22 LEU 26 HD22 LEU 26 3.350 -10.375 -0.519 201 HD23 LEU 26 HD23 LEU 26 4.012 -10.992 0.995 202 H LYS 27 H LYS 27 1.413 -14.284 3.346 203 HA LYS 27 HA LYS 27 1.184 -15.822 1.027 204 HB2 LYS 27 HB2 LYS 27 2.572 -16.445 2.999 205 HB3 LYS 27 HB1 LYS 27 1.092 -16.765 3.902 206 HG2 LYS 27 HG2 LYS 27 0.528 -18.562 2.333 207 HG3 LYS 27 HG1 LYS 27 2.023 -18.256 1.449 208 HD2 LYS 27 HD2 LYS 27 1.905 -19.046 4.364 209 HD3 LYS 27 HD1 LYS 27 2.136 -20.187 3.040 210 HE2 LYS 27 HE2 LYS 27 4.180 -18.940 2.383 211 HE3 LYS 27 HE1 LYS 27 3.963 -17.901 3.791 212 HZ1 LYS 27 HZ1 LYS 27 4.218 -19.815 5.222 213 HZ2 LYS 27 HZ2 LYS 27 5.562 -19.719 4.196 214 HZ3 LYS 27 HZ3 LYS 27 4.337 -20.844 3.894 215 H GLU 28 H GLU 28 -0.941 -15.523 3.822 216 HA GLU 28 HA GLU 28 -2.945 -17.286 2.939 217 HB2 GLU 28 HB2 GLU 28 -2.980 -14.999 4.885 218 HB3 GLU 28 HB1 GLU 28 -4.329 -16.116 4.678 219 HG2 GLU 28 HG2 GLU 28 -2.867 -17.958 5.368 220 HG3 GLU 28 HG1 GLU 28 -1.540 -16.817 5.575 221 H VAL 29 H VAL 29 -2.346 -13.874 2.353 222 HA VAL 29 HA VAL 29 -4.876 -13.205 1.262 223 HB VAL 29 HB VAL 29 -2.141 -11.976 0.801 224 HG11 VAL 29 HG11 VAL 29 -4.831 -10.967 -0.119 225 HG12 VAL 29 HG12 VAL 29 -3.511 -11.515 -1.151 226 HG13 VAL 29 HG13 VAL 29 -3.326 -10.052 -0.185 227 HG21 VAL 29 HG21 VAL 29 -3.009 -10.172 2.221 228 HG22 VAL 29 HG22 VAL 29 -3.002 -11.722 3.061 229 HG23 VAL 29 HG23 VAL 29 -4.513 -11.069 2.428 230 H VAL 30 H VAL 30 -1.819 -14.166 -0.275 231 HA VAL 30 HA VAL 30 -2.817 -14.215 -2.913 232 HB VAL 30 HB VAL 30 -0.535 -15.834 -1.747 233 HG11 VAL 30 HG11 VAL 30 0.302 -15.933 -4.054 234 HG12 VAL 30 HG12 VAL 30 -1.149 -15.100 -4.612 235 HG13 VAL 30 HG13 VAL 30 -1.275 -16.710 -3.902 236 HG21 VAL 30 HG21 VAL 30 0.903 -14.034 -2.586 237 HG22 VAL 30 HG22 VAL 30 -0.242 -13.439 -1.382 238 HG23 VAL 30 HG23 VAL 30 -0.525 -13.134 -3.097 239 H ALA 31 H ALA 31 -2.630 -16.647 -0.374 240 HA ALA 31 HA ALA 31 -3.556 -18.847 -1.830 241 HB1 ALA 31 HB1 ALA 31 -4.113 -19.826 0.333 242 HB2 ALA 31 HB2 ALA 31 -3.954 -18.244 1.096 243 HB3 ALA 31 HB3 ALA 31 -2.540 -19.029 0.390 244 H LYS 32 H LYS 32 -5.233 -16.280 -0.139 245 HA LYS 32 HA LYS 32 -7.862 -17.287 -0.402 246 HB2 LYS 32 HB2 LYS 32 -7.373 -15.612 1.244 247 HB3 LYS 32 HB1 LYS 32 -6.730 -14.522 0.029 248 HG2 LYS 32 HG2 LYS 32 -9.119 -14.564 -0.946 249 HG3 LYS 32 HG1 LYS 32 -9.578 -15.204 0.632 250 HD2 LYS 32 HD2 LYS 32 -8.060 -12.639 0.173 251 HD3 LYS 32 HD1 LYS 32 -9.791 -12.740 0.497 252 HE2 LYS 32 HE2 LYS 32 -7.658 -13.786 2.356 253 HE3 LYS 32 HE1 LYS 32 -8.361 -12.176 2.482 254 HZ1 LYS 32 HZ1 LYS 32 -9.853 -14.737 2.689 255 HZ2 LYS 32 HZ2 LYS 32 -10.528 -13.194 2.789 256 HZ3 LYS 32 HZ3 LYS 32 -9.447 -13.716 3.974 257 H ARG 33 H ARG 33 -5.953 -14.954 -2.256 258 HA ARG 33 HA ARG 33 -7.929 -14.073 -3.999 259 HB2 ARG 33 HB2 ARG 33 -5.548 -13.171 -3.580 260 HB3 ARG 33 HB1 ARG 33 -5.056 -14.295 -4.837 261 HG2 ARG 33 HG2 ARG 33 -6.599 -13.216 -6.400 262 HG3 ARG 33 HG1 ARG 33 -7.073 -12.079 -5.138 263 HD2 ARG 33 HD2 ARG 33 -4.583 -11.493 -4.991 264 HD3 ARG 33 HD1 ARG 33 -4.420 -12.344 -6.526 265 HE ARG 33 HE ARG 33 -6.272 -10.075 -6.186 266 HH11 ARG 33 HH11 ARG 33 -3.708 -11.662 -8.002 267 HH12 ARG 33 HH12 ARG 33 -3.668 -10.435 -9.223 268 HH21 ARG 33 HH21 ARG 33 -6.208 -8.484 -7.813 269 HH22 ARG 33 HH22 ARG 33 -5.087 -8.643 -9.125 270 H GLN 34 H GLN 34 -5.578 -16.726 -4.511 271 HA GLN 34 HA GLN 34 -7.066 -17.384 -6.948 272 HB2 GLN 34 HB2 GLN 34 -4.307 -18.212 -6.075 273 HB3 GLN 34 HB1 GLN 34 -5.112 -18.851 -7.501 274 HG2 GLN 34 HG2 GLN 34 -5.341 -16.455 -8.279 275 HG3 GLN 34 HG1 GLN 34 -4.237 -16.028 -6.978 276 HE21 GLN 34 HE21 GLN 34 -4.022 -19.001 -8.818 277 HE22 GLN 34 HE22 GLN 34 -2.555 -18.603 -9.636 278 H GLY 35 H GLY 35 -7.352 -18.193 -3.886 279 HA2 GLY 35 HA2 GLY 35 -8.355 -19.931 -2.792 280 HA3 GLY 35 HA1 GLY 35 -8.938 -20.444 -4.366 281 H VAL 36 H VAL 36 -5.760 -20.332 -2.775 282 HA VAL 36 HA VAL 36 -5.440 -23.172 -3.493 283 HB VAL 36 HB VAL 36 -2.999 -22.791 -3.646 284 HG11 VAL 36 HG11 VAL 36 -4.308 -22.720 -5.678 285 HG12 VAL 36 HG12 VAL 36 -3.002 -21.539 -5.767 286 HG13 VAL 36 HG13 VAL 36 -4.651 -21.009 -5.430 287 HG21 VAL 36 HG21 VAL 36 -3.664 -19.863 -3.421 288 HG22 VAL 36 HG22 VAL 36 -2.065 -20.563 -3.672 289 HG23 VAL 36 HG23 VAL 36 -2.913 -20.820 -2.143 290 HA PRO 37 HA PRO 37 -4.874 -24.046 0.789 291 HB2 PRO 37 HB2 PRO 37 -2.993 -26.037 0.688 292 HB3 PRO 37 HB1 PRO 37 -4.699 -26.284 0.301 293 HG2 PRO 37 HG2 PRO 37 -2.378 -25.868 -1.540 294 HG3 PRO 37 HG1 PRO 37 -3.746 -26.985 -1.695 295 HD2 PRO 37 HD2 PRO 37 -3.620 -24.662 -3.062 296 HD3 PRO 37 HD1 PRO 37 -5.156 -25.343 -2.496 297 H ALA 38 H ALA 38 -3.902 -22.556 2.010 298 HA ALA 38 HA ALA 38 -1.389 -21.404 1.446 299 HB1 ALA 38 HB1 ALA 38 -2.953 -21.340 4.021 300 HB2 ALA 38 HB2 ALA 38 -3.138 -20.226 2.663 301 HB3 ALA 38 HB3 ALA 38 -1.629 -20.260 3.576 302 H ASP 39 H ASP 39 -2.338 -24.140 3.379 303 HA ASP 39 HA ASP 39 0.044 -24.389 4.909 304 HB2 ASP 39 HB2 ASP 39 -1.987 -26.470 4.077 305 HB3 ASP 39 HB1 ASP 39 -0.659 -26.789 5.182 306 H GLN 40 H GLN 40 -0.728 -25.056 1.659 307 HA GLN 40 HA GLN 40 1.738 -26.625 1.320 308 HB2 GLN 40 HB2 GLN 40 -0.670 -26.520 -0.503 309 HB3 GLN 40 HB1 GLN 40 0.726 -27.570 -0.672 310 HG2 GLN 40 HG2 GLN 40 -1.190 -27.665 1.648 311 HG3 GLN 40 HG1 GLN 40 -1.313 -28.680 0.217 312 HE21 GLN 40 HE21 GLN 40 -1.071 -30.561 1.368 313 HE22 GLN 40 HE22 GLN 40 0.428 -31.050 2.078 314 H LEU 41 H LEU 41 0.971 -23.610 1.293 315 HA LEU 41 HA LEU 41 1.770 -22.936 -1.419 316 HB2 LEU 41 HB2 LEU 41 -0.154 -21.791 -0.305 317 HB3 LEU 41 HB1 LEU 41 0.984 -21.081 0.823 318 HG LEU 41 HG LEU 41 2.081 -19.893 -1.013 319 HD11 LEU 41 HD11 LEU 41 1.674 -21.466 -2.811 320 HD12 LEU 41 HD12 LEU 41 1.041 -19.878 -3.236 321 HD13 LEU 41 HD13 LEU 41 -0.060 -21.155 -2.721 322 HD21 LEU 41 HD21 LEU 41 -0.908 -19.506 -0.968 323 HD22 LEU 41 HD22 LEU 41 0.284 -18.324 -1.507 324 HD23 LEU 41 HD23 LEU 41 0.238 -18.821 0.184 325 H ARG 42 H ARG 42 3.709 -22.247 -1.956 326 HA ARG 42 HA ARG 42 5.686 -21.822 0.180 327 HB2 ARG 42 HB2 ARG 42 6.122 -23.862 -1.018 328 HB3 ARG 42 HB1 ARG 42 5.926 -23.055 -2.561 329 HG2 ARG 42 HG2 ARG 42 8.243 -23.486 -2.180 330 HG3 ARG 42 HG1 ARG 42 7.966 -21.747 -2.094 331 HD2 ARG 42 HD2 ARG 42 8.305 -21.674 0.182 332 HD3 ARG 42 HD1 ARG 42 7.910 -23.381 0.405 333 HE ARG 42 HE ARG 42 10.175 -23.301 -1.168 334 HH11 ARG 42 HH11 ARG 42 9.326 -22.192 2.055 335 HH12 ARG 42 HH12 ARG 42 10.901 -22.525 2.703 336 HH21 ARG 42 HH21 ARG 42 12.256 -23.718 -0.300 337 HH22 ARG 42 HH22 ARG 42 12.567 -23.381 1.365 338 H VAL 43 H VAL 43 6.479 -19.811 0.271 339 HA VAL 43 HA VAL 43 6.341 -18.187 -2.162 340 HB VAL 43 HB VAL 43 6.344 -16.177 -0.767 341 HG11 VAL 43 HG11 VAL 43 4.270 -18.166 0.142 342 HG12 VAL 43 HG12 VAL 43 4.190 -17.163 -1.305 343 HG13 VAL 43 HG13 VAL 43 4.148 -16.413 0.291 344 HG21 VAL 43 HG21 VAL 43 6.131 -16.332 1.688 345 HG22 VAL 43 HG22 VAL 43 7.679 -16.933 1.103 346 HG23 VAL 43 HG23 VAL 43 6.417 -18.070 1.585 347 H ILE 44 H ILE 44 8.149 -17.269 -2.973 348 HA ILE 44 HA ILE 44 10.652 -17.851 -1.545 349 HB ILE 44 HB ILE 44 10.092 -18.057 -4.505 350 HG12 ILE 44 HG12 ILE 44 9.386 -20.002 -3.174 351 HG13 ILE 44 HG11 ILE 44 10.726 -20.402 -4.240 352 HG21 ILE 44 HG21 ILE 44 12.444 -18.674 -4.789 353 HG22 ILE 44 HG22 ILE 44 12.738 -18.322 -3.088 354 HG23 ILE 44 HG23 ILE 44 12.267 -17.026 -4.187 355 HD11 ILE 44 HD11 ILE 44 12.266 -20.210 -2.330 356 HD12 ILE 44 HD12 ILE 44 11.025 -21.437 -2.080 357 HD13 ILE 44 HD13 ILE 44 10.892 -19.874 -1.278 358 H PHE 45 H PHE 45 11.860 -16.195 -1.128 359 HA PHE 45 HA PHE 45 11.842 -13.860 -2.895 360 HB2 PHE 45 HB2 PHE 45 10.449 -13.265 -0.995 361 HB3 PHE 45 HB1 PHE 45 11.674 -13.840 0.130 362 HD1 PHE 45 HD1 PHE 45 10.696 -11.145 -2.142 363 HD2 PHE 45 HD2 PHE 45 13.649 -12.516 0.597 364 HE1 PHE 45 HE1 PHE 45 11.660 -8.883 -2.043 365 HE2 PHE 45 HE2 PHE 45 14.611 -10.261 0.701 366 HZ PHE 45 HZ PHE 45 13.616 -8.441 -0.613 367 H ALA 46 H ALA 46 13.834 -13.558 -3.610 368 HA ALA 46 HA ALA 46 16.087 -13.585 -3.832 369 HB1 ALA 46 HB1 ALA 46 16.150 -13.654 -0.812 370 HB2 ALA 46 HB2 ALA 46 16.021 -12.195 -1.793 371 HB3 ALA 46 HB3 ALA 46 17.475 -13.188 -1.879 372 H GLY 47 H GLY 47 14.422 -16.140 -3.210 373 HA2 GLY 47 HA2 GLY 47 15.318 -18.268 -3.964 374 HA3 GLY 47 HA1 GLY 47 16.781 -17.902 -3.064 375 H LYS 48 H LYS 48 15.140 -16.898 -0.772 376 HA LYS 48 HA LYS 48 14.426 -19.547 0.290 377 HB2 LYS 48 HB2 LYS 48 15.047 -18.541 2.546 378 HB3 LYS 48 HB1 LYS 48 16.371 -18.859 1.441 379 HG2 LYS 48 HG2 LYS 48 16.872 -16.767 2.358 380 HG3 LYS 48 HG1 LYS 48 16.180 -16.387 0.782 381 HD2 LYS 48 HD2 LYS 48 13.987 -16.020 1.926 382 HD3 LYS 48 HD1 LYS 48 14.821 -16.219 3.468 383 HE2 LYS 48 HE2 LYS 48 15.414 -14.127 1.378 384 HE3 LYS 48 HE1 LYS 48 14.576 -13.857 2.902 385 HZ1 LYS 48 HZ1 LYS 48 16.876 -13.191 3.030 386 HZ2 LYS 48 HZ2 LYS 48 17.392 -14.739 2.607 387 HZ3 LYS 48 HZ3 LYS 48 16.593 -14.487 4.077 388 H GLU 49 H GLU 49 12.925 -19.383 2.248 389 HA GLU 49 HA GLU 49 10.712 -17.646 1.497 390 HB2 GLU 49 HB2 GLU 49 10.327 -20.092 1.927 391 HB3 GLU 49 HB1 GLU 49 10.752 -19.811 3.611 392 HG2 GLU 49 HG2 GLU 49 8.878 -18.340 3.897 393 HG3 GLU 49 HG1 GLU 49 8.501 -18.427 2.180 394 H LEU 50 H LEU 50 9.855 -16.116 2.845 395 HA LEU 50 HA LEU 50 11.721 -14.992 4.725 396 HB2 LEU 50 HB2 LEU 50 8.984 -14.081 3.886 397 HB3 LEU 50 HB1 LEU 50 10.081 -13.167 4.900 398 HG LEU 50 HG LEU 50 10.546 -13.942 2.038 399 HD11 LEU 50 HD11 LEU 50 10.343 -11.528 1.627 400 HD12 LEU 50 HD12 LEU 50 9.867 -11.310 3.314 401 HD13 LEU 50 HD13 LEU 50 8.852 -12.255 2.227 402 HD21 LEU 50 HD21 LEU 50 12.206 -12.309 3.954 403 HD22 LEU 50 HD22 LEU 50 12.493 -12.425 2.219 404 HD23 LEU 50 HD23 LEU 50 12.639 -13.860 3.233 405 H ARG 51 H ARG 51 11.169 -14.322 6.841 406 HA ARG 51 HA ARG 51 10.091 -16.281 8.482 407 HB2 ARG 51 HB2 ARG 51 10.293 -14.716 10.290 408 HB3 ARG 51 HB1 ARG 51 11.637 -14.433 9.204 409 HG2 ARG 51 HG2 ARG 51 9.121 -12.777 9.177 410 HG3 ARG 51 HG1 ARG 51 10.532 -12.380 10.152 411 HD2 ARG 51 HD2 ARG 51 10.529 -12.673 7.143 412 HD3 ARG 51 HD1 ARG 51 10.428 -11.140 8.003 413 HE ARG 51 HE ARG 51 12.708 -12.736 8.725 414 HH11 ARG 51 HH11 ARG 51 11.492 -10.306 6.500 415 HH12 ARG 51 HH12 ARG 51 13.063 -9.705 6.103 416 HH21 ARG 51 HH21 ARG 51 14.795 -11.931 8.180 417 HH22 ARG 51 HH22 ARG 51 14.942 -10.628 7.058 418 H ASN 52 H ASN 52 8.088 -16.644 9.344 419 HA ASN 52 HA ASN 52 5.893 -15.713 7.791 420 HB2 ASN 52 HB2 ASN 52 4.508 -17.184 9.139 421 HB3 ASN 52 HB1 ASN 52 5.997 -18.006 8.703 422 HD21 ASN 52 HD21 ASN 52 4.080 -18.420 10.910 423 HD22 ASN 52 HD22 ASN 52 5.030 -18.363 12.353 424 H ASP 53 H ASP 53 7.308 -14.508 10.684 425 HA ASP 53 HA ASP 53 4.912 -12.884 11.117 426 HB2 ASP 53 HB2 ASP 53 5.112 -14.486 12.942 427 HB3 ASP 53 HB1 ASP 53 6.760 -13.957 13.254 428 H TRP 54 H TRP 54 5.801 -11.352 9.762 429 HA TRP 54 HA TRP 54 7.034 -9.260 11.179 430 HB2 TRP 54 HB2 TRP 54 9.070 -10.646 10.663 431 HB3 TRP 54 HB1 TRP 54 8.748 -10.384 8.953 432 HD1 TRP 54 HD1 TRP 54 10.456 -8.684 8.102 433 HE1 TRP 54 HE1 TRP 54 11.381 -6.430 8.923 434 HE3 TRP 54 HE3 TRP 54 8.107 -8.435 12.640 435 HZ2 TRP 54 HZ2 TRP 54 11.128 -4.760 11.179 436 HZ3 TRP 54 HZ3 TRP 54 8.505 -6.474 14.063 437 HH2 TRP 54 HH2 TRP 54 9.987 -4.677 13.348 438 H THR 55 H THR 55 7.308 -7.307 9.823 439 HA THR 55 HA THR 55 5.007 -6.913 8.229 440 HB THR 55 HB THR 55 5.863 -4.630 7.901 441 HG1 THR 55 HG1 THR 55 8.043 -4.653 9.409 442 HG21 THR 55 HG21 THR 55 4.796 -5.214 10.055 443 HG22 THR 55 HG22 THR 55 6.014 -3.949 10.230 444 HG23 THR 55 HG23 THR 55 6.389 -5.602 10.712 445 H VAL 56 H VAL 56 4.764 -6.726 6.034 446 HA VAL 56 HA VAL 56 6.687 -7.999 4.377 447 HB VAL 56 HB VAL 56 4.267 -8.170 3.938 448 HG11 VAL 56 HG11 VAL 56 4.415 -5.269 3.159 449 HG12 VAL 56 HG12 VAL 56 3.599 -5.928 4.578 450 HG13 VAL 56 HG13 VAL 56 3.022 -6.337 2.963 451 HG21 VAL 56 HG21 VAL 56 5.747 -8.608 2.103 452 HG22 VAL 56 HG22 VAL 56 5.838 -6.892 1.713 453 HG23 VAL 56 HG23 VAL 56 4.320 -7.763 1.501 454 H GLN 57 H GLN 57 6.042 -4.721 5.270 455 HA GLN 57 HA GLN 57 7.260 -3.416 3.099 456 HB2 GLN 57 HB2 GLN 57 5.879 -2.110 4.526 457 HB3 GLN 57 HB1 GLN 57 6.796 -2.568 5.953 458 HG2 GLN 57 HG2 GLN 57 8.735 -1.322 5.066 459 HG3 GLN 57 HG1 GLN 57 7.747 -0.808 3.702 460 HE21 GLN 57 HE21 GLN 57 6.221 0.777 3.997 461 HE22 GLN 57 HE22 GLN 57 6.122 1.724 5.436 462 H ASN 58 H ASN 58 8.536 -4.364 6.270 463 HA ASN 58 HA ASN 58 11.150 -3.351 5.690 464 HB2 ASN 58 HB2 ASN 58 10.192 -3.369 7.972 465 HB3 ASN 58 HB1 ASN 58 10.225 -5.126 7.961 466 HD21 ASN 58 HD21 ASN 58 12.155 -2.224 8.051 467 HD22 ASN 58 HD22 ASN 58 13.597 -2.971 8.640 468 H CYS 59 H CYS 59 9.613 -6.025 4.565 469 HA CYS 59 HA CYS 59 12.014 -7.679 4.580 470 HB2 CYS 59 HB2 CYS 59 9.206 -8.293 3.663 471 HB3 CYS 59 HB1 CYS 59 10.558 -9.413 3.542 472 HG CYS 59 HG CYS 59 8.896 -8.364 6.309 473 H ASP 60 H ASP 60 10.577 -5.338 2.671 474 HA ASP 60 HA ASP 60 11.166 -4.400 0.680 475 HB2 ASP 60 HB2 ASP 60 13.436 -6.385 0.789 476 HB3 ASP 60 HB1 ASP 60 13.277 -5.129 -0.426 477 H LEU 61 H LEU 61 9.199 -6.557 0.573 478 HA LEU 61 HA LEU 61 9.780 -8.245 -1.652 479 HB2 LEU 61 HB2 LEU 61 7.165 -7.517 -0.348 480 HB3 LEU 61 HB1 LEU 61 7.242 -8.537 -1.767 481 HG LEU 61 HG LEU 61 8.774 -10.061 -0.435 482 HD11 LEU 61 HD11 LEU 61 9.407 -8.556 1.307 483 HD12 LEU 61 HD12 LEU 61 8.537 -9.927 1.998 484 HD13 LEU 61 HD13 LEU 61 7.728 -8.372 1.810 485 HD21 LEU 61 HD21 LEU 61 6.502 -10.689 -0.905 486 HD22 LEU 61 HD22 LEU 61 5.909 -9.680 0.409 487 HD23 LEU 61 HD23 LEU 61 6.879 -11.108 0.766 488 H ASP 62 H ASP 62 8.976 -4.981 -1.503 489 HA ASP 62 HA ASP 62 7.957 -4.926 -4.249 490 HB2 ASP 62 HB2 ASP 62 7.334 -2.652 -3.813 491 HB3 ASP 62 HB1 ASP 62 6.838 -3.598 -2.414 492 H GLN 63 H GLN 63 10.770 -4.386 -2.391 493 HA GLN 63 HA GLN 63 11.954 -2.589 -4.356 494 HB2 GLN 63 HB2 GLN 63 12.095 -2.043 -1.950 495 HB3 GLN 63 HB1 GLN 63 13.041 -3.500 -1.694 496 HG2 GLN 63 HG2 GLN 63 14.569 -1.716 -1.785 497 HG3 GLN 63 HG1 GLN 63 14.716 -2.570 -3.319 498 HE21 GLN 63 HE21 GLN 63 15.437 0.146 -2.669 499 HE22 GLN 63 HE22 GLN 63 14.543 1.162 -3.747 500 H GLN 64 H GLN 64 12.659 -5.741 -2.837 501 HA GLN 64 HA GLN 64 14.969 -6.004 -4.587 502 HB2 GLN 64 HB2 GLN 64 14.030 -7.811 -2.371 503 HB3 GLN 64 HB1 GLN 64 15.536 -7.972 -3.259 504 HG2 GLN 64 HG2 GLN 64 14.767 -5.653 -1.506 505 HG3 GLN 64 HG1 GLN 64 15.896 -6.941 -1.088 506 HE21 GLN 64 HE21 GLN 64 16.249 -4.028 -1.318 507 HE22 GLN 64 HE22 GLN 64 17.544 -3.804 -2.438 508 H SEP 65 H SEP 65 14.122 -6.353 -6.566 509 HA SEP 65 HA SEP 65 13.419 -7.546 -8.348 510 HB2 SEP 65 HB1 SEP 65 13.641 -10.022 -6.631 511 HB3 SEP 65 HB2 SEP 65 15.061 -9.182 -7.252 512 H ILE 66 H ILE 66 11.929 -10.079 -8.224 513 HA ILE 66 HA ILE 66 9.332 -9.023 -7.323 514 HB ILE 66 HB ILE 66 9.575 -9.218 -9.817 515 HG12 ILE 66 HG12 ILE 66 7.556 -11.200 -8.783 516 HG13 ILE 66 HG11 ILE 66 7.376 -9.463 -8.578 517 HG21 ILE 66 HG21 ILE 66 11.032 -11.155 -9.916 518 HG22 ILE 66 HG22 ILE 66 9.554 -11.438 -10.842 519 HG23 ILE 66 HG23 ILE 66 9.748 -12.169 -9.250 520 HD11 ILE 66 HD11 ILE 66 7.347 -9.158 -10.979 521 HD12 ILE 66 HD12 ILE 66 6.109 -10.315 -10.488 522 HD13 ILE 66 HD13 ILE 66 7.612 -10.883 -11.219 523 H VAL 67 H VAL 67 7.922 -10.463 -6.279 524 HA VAL 67 HA VAL 67 9.260 -12.590 -4.857 525 HB VAL 67 HB VAL 67 6.349 -11.781 -4.717 526 HG11 VAL 67 HG11 VAL 67 6.805 -13.961 -3.739 527 HG12 VAL 67 HG12 VAL 67 6.427 -12.785 -2.479 528 HG13 VAL 67 HG13 VAL 67 8.099 -13.268 -2.759 529 HG21 VAL 67 HG21 VAL 67 6.955 -10.380 -2.829 530 HG22 VAL 67 HG22 VAL 67 7.812 -9.866 -4.281 531 HG23 VAL 67 HG23 VAL 67 8.654 -10.797 -3.043 532 H HIS 68 H HIS 68 8.959 -14.757 -5.115 533 HA HIS 68 HA HIS 68 7.240 -15.584 -7.370 534 HB2 HIS 68 HB2 HIS 68 9.435 -17.267 -6.164 535 HB3 HIS 68 HB1 HIS 68 8.674 -17.439 -7.735 536 HD2 HIS 68 HD2 HIS 68 9.238 -14.471 -8.944 537 HE1 HIS 68 HE1 HIS 68 13.265 -15.356 -8.005 538 HE2 HIS 68 HE2 HIS 68 11.719 -13.689 -9.068 539 H ILE 69 H ILE 69 5.577 -16.969 -6.965 540 HA ILE 69 HA ILE 69 5.569 -18.326 -4.364 541 HB ILE 69 HB ILE 69 3.208 -16.848 -5.550 542 HG12 ILE 69 HG12 ILE 69 4.861 -16.396 -3.055 543 HG13 ILE 69 HG11 ILE 69 4.746 -15.338 -4.454 544 HG21 ILE 69 HG21 ILE 69 2.497 -18.946 -4.539 545 HG22 ILE 69 HG22 ILE 69 1.978 -17.576 -3.556 546 HG23 ILE 69 HG23 ILE 69 3.365 -18.543 -3.058 547 HD11 ILE 69 HD11 ILE 69 2.397 -14.915 -3.932 548 HD12 ILE 69 HD12 ILE 69 3.461 -14.463 -2.602 549 HD13 ILE 69 HD13 ILE 69 2.528 -15.958 -2.518 550 H VAL 70 H VAL 70 5.209 -20.403 -4.502 551 HA VAL 70 HA VAL 70 3.776 -21.463 -6.837 552 HB VAL 70 HB VAL 70 6.179 -21.807 -7.206 553 HG11 VAL 70 HG11 VAL 70 7.535 -23.180 -5.723 554 HG12 VAL 70 HG12 VAL 70 6.185 -23.310 -4.599 555 HG13 VAL 70 HG13 VAL 70 6.937 -21.742 -4.894 556 HG21 VAL 70 HG21 VAL 70 4.742 -24.359 -6.477 557 HG22 VAL 70 HG22 VAL 70 6.203 -24.264 -7.461 558 HG23 VAL 70 HG23 VAL 70 4.704 -23.535 -8.037 559 H GLN 71 H GLN 71 2.417 -23.202 -6.403 560 HA GLN 71 HA GLN 71 2.092 -23.791 -3.550 561 HB2 GLN 71 HB2 GLN 71 -0.185 -24.493 -4.059 562 HB3 GLN 71 HB1 GLN 71 0.091 -22.862 -4.645 563 HG2 GLN 71 HG2 GLN 71 0.190 -23.582 -6.889 564 HG3 GLN 71 HG1 GLN 71 0.306 -25.275 -6.416 565 HE21 GLN 71 HE21 GLN 71 -1.586 -23.969 -8.182 566 HE22 GLN 71 HE22 GLN 71 -3.152 -24.288 -7.525 567 H ARG 72 H ARG 72 2.105 -25.844 -2.796 568 HA ARG 72 HA ARG 72 2.707 -27.964 -4.749 569 HB2 ARG 72 HB2 ARG 72 3.841 -27.683 -1.954 570 HB3 ARG 72 HB1 ARG 72 4.166 -29.005 -3.062 571 HG2 ARG 72 HG2 ARG 72 4.933 -26.123 -3.495 572 HG3 ARG 72 HG1 ARG 72 6.014 -27.413 -2.968 573 HD2 ARG 72 HD2 ARG 72 4.522 -27.343 -5.592 574 HD3 ARG 72 HD1 ARG 72 6.219 -26.926 -5.374 575 HE ARG 72 HE ARG 72 5.530 -29.569 -4.448 576 HH11 ARG 72 HH11 ARG 72 6.495 -27.664 -7.221 577 HH12 ARG 72 HH12 ARG 72 7.236 -28.988 -8.044 578 HH21 ARG 72 HH21 ARG 72 6.499 -31.349 -5.548 579 HH22 ARG 72 HH22 ARG 72 7.226 -31.095 -7.095 580 HA PRO 73 HA PRO 73 -0.912 -29.154 -2.146 581 HB2 PRO 73 HB2 PRO 73 -2.782 -29.372 -4.039 582 HB3 PRO 73 HB1 PRO 73 -2.321 -27.794 -3.387 583 HG2 PRO 73 HG2 PRO 73 -1.587 -29.058 -5.984 584 HG3 PRO 73 HG1 PRO 73 -1.905 -27.355 -5.613 585 HD2 PRO 73 HD2 PRO 73 0.622 -28.549 -5.838 586 HD3 PRO 73 HD1 PRO 73 0.278 -26.971 -5.105 587 H TRP 74 H TRP 74 -1.616 -31.212 -1.779 588 HA TRP 74 HA TRP 74 -0.396 -33.293 -3.370 589 HB2 TRP 74 HB2 TRP 74 -0.433 -33.339 -0.853 590 HB3 TRP 74 HB1 TRP 74 -2.173 -33.584 -0.939 591 HD1 TRP 74 HD1 TRP 74 1.132 -35.362 -1.794 592 HE1 TRP 74 HE1 TRP 74 0.684 -37.892 -1.918 593 HE3 TRP 74 HE3 TRP 74 -3.951 -35.313 -1.274 594 HZ2 TRP 74 HZ2 TRP 74 -1.528 -39.634 -1.804 595 HZ3 TRP 74 HZ3 TRP 74 -5.154 -37.459 -1.292 596 HH2 TRP 74 HH2 TRP 74 -3.965 -39.570 -1.553 597 H ARG 75 H ARG 75 -3.510 -31.838 -2.880 598 HA ARG 75 HA ARG 75 -4.576 -33.549 -4.983 599 HB2 ARG 75 HB2 ARG 75 -6.723 -33.802 -3.787 600 HB3 ARG 75 HB1 ARG 75 -5.390 -34.579 -2.947 601 HG2 ARG 75 HG2 ARG 75 -5.295 -32.791 -1.338 602 HG3 ARG 75 HG1 ARG 75 -6.506 -31.871 -2.236 603 HD2 ARG 75 HD2 ARG 75 -7.613 -32.901 -0.399 604 HD3 ARG 75 HD1 ARG 75 -8.096 -33.764 -1.857 605 HE ARG 75 HE ARG 75 -6.021 -34.769 -0.017 606 HH11 ARG 75 HH11 ARG 75 -8.828 -35.307 -2.059 607 HH12 ARG 75 HH12 ARG 75 -8.966 -36.978 -1.645 608 HH21 ARG 75 HH21 ARG 75 -6.203 -36.988 0.521 609 HH22 ARG 75 HH22 ARG 75 -7.472 -37.939 -0.168 610 H LYS 76 H LYS 76 -4.827 -32.103 -6.545 611 HA LYS 76 HA LYS 76 -6.905 -30.174 -6.280 612 HB2 LYS 76 HB2 LYS 76 -5.058 -28.831 -5.411 613 HB3 LYS 76 HB1 LYS 76 -4.100 -29.193 -6.838 614 HG2 LYS 76 HG2 LYS 76 -5.426 -27.856 -8.219 615 HG3 LYS 76 HG1 LYS 76 -6.754 -27.831 -7.066 616 HD2 LYS 76 HD2 LYS 76 -4.075 -26.610 -6.477 617 HD3 LYS 76 HD1 LYS 76 -5.372 -25.709 -7.267 618 HE2 LYS 76 HE2 LYS 76 -5.513 -27.024 -4.549 619 HE3 LYS 76 HE1 LYS 76 -5.355 -25.297 -4.857 620 HZ1 LYS 76 HZ1 LYS 76 -7.669 -26.980 -5.670 621 HZ2 LYS 76 HZ2 LYS 76 -7.519 -25.318 -5.930 622 HZ3 LYS 76 HZ3 LYS 76 -7.641 -25.918 -4.360 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 0.049 -1.072 0.837 2 H2 MET 1 HT2 MET 1 0.021 0.200 -0.275 3 H3 MET 1 HT3 MET 1 0.765 0.410 1.226 4 HA MET 1 HA MET 1 2.378 0.106 -0.551 5 HB2 MET 1 HB2 MET 1 2.894 -0.621 1.751 6 HB3 MET 1 HB1 MET 1 2.235 -2.210 1.393 7 HG2 MET 1 HG2 MET 1 3.975 -2.539 -0.297 8 HG3 MET 1 HG1 MET 1 4.636 -0.952 0.087 9 HE1 MET 1 HE1 MET 1 7.031 -1.961 0.516 10 HE2 MET 1 HE2 MET 1 6.409 -3.552 0.078 11 HE3 MET 1 HE3 MET 1 7.338 -3.348 1.562 12 H ILE 2 H ILE 2 2.678 -0.713 -2.510 13 HA ILE 2 HA ILE 2 1.171 -3.135 -3.221 14 HB ILE 2 HB ILE 2 2.213 -0.939 -5.027 15 HG12 ILE 2 HG12 ILE 2 -0.618 -1.696 -4.258 16 HG13 ILE 2 HG11 ILE 2 0.259 -0.290 -3.664 17 HG21 ILE 2 HG21 ILE 2 0.612 -3.410 -5.701 18 HG22 ILE 2 HG22 ILE 2 2.288 -3.099 -6.156 19 HG23 ILE 2 HG23 ILE 2 0.993 -2.102 -6.821 20 HD11 ILE 2 HD11 ILE 2 -1.309 0.322 -5.403 21 HD12 ILE 2 HD12 ILE 2 -0.542 -0.810 -6.516 22 HD13 ILE 2 HD13 ILE 2 0.348 0.599 -5.942 23 H VAL 3 H VAL 3 2.357 -4.903 -3.306 24 HA VAL 3 HA VAL 3 5.180 -4.643 -4.082 25 HB VAL 3 HB VAL 3 5.596 -6.752 -2.873 26 HG11 VAL 3 HG11 VAL 3 5.364 -5.856 -0.603 27 HG12 VAL 3 HG12 VAL 3 4.273 -4.612 -1.214 28 HG13 VAL 3 HG13 VAL 3 5.958 -4.643 -1.736 29 HG21 VAL 3 HG21 VAL 3 3.371 -7.748 -3.049 30 HG22 VAL 3 HG22 VAL 3 2.719 -6.501 -1.986 31 HG23 VAL 3 HG23 VAL 3 3.890 -7.665 -1.365 32 H PHE 4 H PHE 4 6.075 -6.289 -5.405 33 HA PHE 4 HA PHE 4 4.127 -7.286 -7.323 34 HB2 PHE 4 HB2 PHE 4 7.147 -7.297 -7.472 35 HB3 PHE 4 HB1 PHE 4 6.034 -7.658 -8.786 36 HD1 PHE 4 HD1 PHE 4 8.008 -5.176 -7.298 37 HD2 PHE 4 HD2 PHE 4 4.313 -5.739 -9.333 38 HE1 PHE 4 HE1 PHE 4 7.989 -2.797 -7.915 39 HE2 PHE 4 HE2 PHE 4 4.292 -3.366 -9.959 40 HZ PHE 4 HZ PHE 4 6.130 -1.889 -9.251 41 H VAL 5 H VAL 5 3.689 -9.416 -7.650 42 HA VAL 5 HA VAL 5 5.336 -11.377 -6.241 43 HB VAL 5 HB VAL 5 3.407 -10.686 -4.783 44 HG11 VAL 5 HG11 VAL 5 1.762 -10.292 -6.501 45 HG12 VAL 5 HG12 VAL 5 1.179 -11.471 -5.325 46 HG13 VAL 5 HG13 VAL 5 1.750 -12.009 -6.905 47 HG21 VAL 5 HG21 VAL 5 3.393 -13.553 -5.697 48 HG22 VAL 5 HG22 VAL 5 2.735 -12.943 -4.177 49 HG23 VAL 5 HG23 VAL 5 4.466 -12.852 -4.486 50 H ARG 6 H ARG 6 5.329 -13.415 -7.122 51 HA ARG 6 HA ARG 6 3.922 -13.755 -9.689 52 HB2 ARG 6 HB2 ARG 6 6.417 -15.157 -8.713 53 HB3 ARG 6 HB1 ARG 6 5.671 -15.343 -10.286 54 HG2 ARG 6 HG2 ARG 6 6.172 -12.955 -10.730 55 HG3 ARG 6 HG1 ARG 6 7.075 -12.924 -9.211 56 HD2 ARG 6 HD2 ARG 6 8.597 -13.322 -11.038 57 HD3 ARG 6 HD1 ARG 6 8.477 -14.774 -10.044 58 HE ARG 6 HE ARG 6 7.022 -14.427 -12.585 59 HH11 ARG 6 HH11 ARG 6 8.885 -16.446 -10.377 60 HH12 ARG 6 HH12 ARG 6 8.826 -17.832 -11.404 61 HH21 ARG 6 HH21 ARG 6 6.948 -16.256 -13.927 62 HH22 ARG 6 HH22 ARG 6 7.708 -17.729 -13.433 63 H PHE 7 H PHE 7 2.976 -15.806 -10.056 64 HA PHE 7 HA PHE 7 2.878 -17.572 -7.734 65 HB2 PHE 7 HB2 PHE 7 0.825 -16.117 -7.782 66 HB3 PHE 7 HB1 PHE 7 0.416 -16.833 -9.339 67 HD1 PHE 7 HD1 PHE 7 0.947 -17.583 -5.762 68 HD2 PHE 7 HD2 PHE 7 -0.657 -18.920 -9.461 69 HE1 PHE 7 HE1 PHE 7 -0.170 -19.440 -4.605 70 HE2 PHE 7 HE2 PHE 7 -1.772 -20.783 -8.311 71 HZ PHE 7 HZ PHE 7 -1.522 -21.050 -5.878 72 H ASN 8 H ASN 8 2.602 -19.736 -8.212 73 HA ASN 8 HA ASN 8 3.854 -20.741 -10.457 74 HB2 ASN 8 HB2 ASN 8 3.584 -22.077 -8.461 75 HB3 ASN 8 HB1 ASN 8 1.838 -22.106 -8.663 76 HD21 ASN 8 HD21 ASN 8 4.890 -23.332 -9.819 77 HD22 ASN 8 HD22 ASN 8 4.235 -24.646 -10.727 78 H SER 9 H SER 9 0.423 -20.112 -10.042 79 HA SER 9 HA SER 9 -0.150 -21.195 -12.695 80 HB2 SER 9 HB2 SER 9 -2.108 -20.085 -10.680 81 HB3 SER 9 HB1 SER 9 -2.462 -21.110 -12.070 82 HG SER 9 HG SER 9 -2.264 -22.079 -9.833 83 H SER 10 H SER 10 1.243 -18.538 -12.007 84 HA SER 10 HA SER 10 -0.341 -16.909 -13.839 85 HB2 SER 10 HB2 SER 10 -0.954 -16.285 -11.479 86 HB3 SER 10 HB1 SER 10 0.729 -15.839 -11.211 87 HG SER 10 HG SER 10 -1.214 -14.374 -12.269 88 H HIS 11 H HIS 11 1.223 -14.617 -13.666 89 HA HIS 11 HA HIS 11 3.893 -15.570 -14.467 90 HB2 HIS 11 HB2 HIS 11 2.649 -14.848 -16.439 91 HB3 HIS 11 HB1 HIS 11 2.243 -13.325 -15.665 92 HD2 HIS 11 HD2 HIS 11 4.197 -11.373 -15.739 93 HE1 HIS 11 HE1 HIS 11 6.888 -13.604 -18.121 94 HE2 HIS 11 HE2 HIS 11 6.253 -11.296 -17.317 95 H GLY 12 H GLY 12 2.232 -12.529 -13.609 96 HA2 GLY 12 HA2 GLY 12 3.726 -12.075 -11.268 97 HA3 GLY 12 HA1 GLY 12 4.474 -11.211 -12.605 98 H PHE 13 H PHE 13 2.375 -10.870 -10.130 99 HA PHE 13 HA PHE 13 1.123 -8.573 -11.415 100 HB2 PHE 13 HB2 PHE 13 -1.070 -9.128 -10.343 101 HB3 PHE 13 HB1 PHE 13 -0.593 -10.255 -11.604 102 HD1 PHE 13 HD1 PHE 13 -1.294 -9.819 -8.061 103 HD2 PHE 13 HD2 PHE 13 0.124 -12.532 -11.018 104 HE1 PHE 13 HE1 PHE 13 -1.641 -11.692 -6.507 105 HE2 PHE 13 HE2 PHE 13 -0.216 -14.406 -9.464 106 HZ PHE 13 HZ PHE 13 -1.100 -13.988 -7.206 107 HA PRO 14 HA PRO 14 2.060 -6.813 -7.467 108 HB2 PRO 14 HB2 PRO 14 0.788 -4.478 -7.661 109 HB3 PRO 14 HB1 PRO 14 2.145 -4.865 -8.724 110 HG2 PRO 14 HG2 PRO 14 -0.774 -4.858 -9.307 111 HG3 PRO 14 HG1 PRO 14 0.583 -4.433 -10.362 112 HD2 PRO 14 HD2 PRO 14 -0.789 -6.893 -10.315 113 HD3 PRO 14 HD1 PRO 14 0.756 -6.567 -11.121 114 H VAL 15 H VAL 15 1.269 -6.898 -5.437 115 HA VAL 15 HA VAL 15 -1.646 -7.122 -5.132 116 HB VAL 15 HB VAL 15 0.516 -8.434 -3.450 117 HG11 VAL 15 HG11 VAL 15 -1.384 -7.578 -2.081 118 HG12 VAL 15 HG12 VAL 15 -1.258 -9.336 -2.077 119 HG13 VAL 15 HG13 VAL 15 -2.480 -8.541 -3.070 120 HG21 VAL 15 HG21 VAL 15 -0.536 -10.504 -4.188 121 HG22 VAL 15 HG22 VAL 15 0.015 -9.550 -5.565 122 HG23 VAL 15 HG23 VAL 15 -1.697 -9.583 -5.143 123 H GLU 16 H GLU 16 -2.597 -5.606 -4.078 124 HA GLU 16 HA GLU 16 -1.118 -3.500 -2.808 125 HB2 GLU 16 HB2 GLU 16 -3.053 -3.121 -4.305 126 HB3 GLU 16 HB1 GLU 16 -4.086 -3.922 -3.138 127 HG2 GLU 16 HG2 GLU 16 -3.621 -2.173 -1.516 128 HG3 GLU 16 HG1 GLU 16 -2.563 -1.373 -2.684 129 H VAL 17 H VAL 17 -0.338 -4.040 -0.842 130 HA VAL 17 HA VAL 17 -2.213 -5.202 1.113 131 HB VAL 17 HB VAL 17 -0.189 -6.032 2.335 132 HG11 VAL 17 HG11 VAL 17 -1.532 -7.476 0.853 133 HG12 VAL 17 HG12 VAL 17 0.164 -7.951 0.922 134 HG13 VAL 17 HG13 VAL 17 -0.446 -7.072 -0.478 135 HG21 VAL 17 HG21 VAL 17 1.231 -5.185 -0.192 136 HG22 VAL 17 HG22 VAL 17 1.925 -6.215 1.058 137 HG23 VAL 17 HG23 VAL 17 1.496 -4.545 1.431 138 H ASP 18 H ASP 18 -1.010 -4.773 3.429 139 HA ASP 18 HA ASP 18 -0.954 -1.843 3.644 140 HB2 ASP 18 HB2 ASP 18 -2.739 -3.013 4.898 141 HB3 ASP 18 HB1 ASP 18 -1.523 -3.955 5.742 142 H SER 19 H SER 19 0.537 -0.954 5.292 143 HA SER 19 HA SER 19 3.161 -1.911 4.902 144 HB2 SER 19 HB2 SER 19 2.129 0.124 6.884 145 HB3 SER 19 HB1 SER 19 3.820 -0.109 6.437 146 HG SER 19 HG SER 19 3.465 1.126 4.797 147 H ASP 20 H ASP 20 0.777 -2.937 7.094 148 HA ASP 20 HA ASP 20 2.885 -4.087 8.797 149 HB2 ASP 20 HB2 ASP 20 0.072 -3.284 9.492 150 HB3 ASP 20 HB1 ASP 20 1.000 -4.391 10.500 151 H THR 21 H THR 21 1.491 -5.003 6.233 152 HA THR 21 HA THR 21 0.208 -7.451 6.990 153 HB THR 21 HB THR 21 1.274 -6.497 4.315 154 HG1 THR 21 HG1 THR 21 -1.077 -6.125 5.719 155 HG21 THR 21 HG21 THR 21 -0.128 -8.279 3.332 156 HG22 THR 21 HG22 THR 21 -0.495 -8.870 4.955 157 HG23 THR 21 HG23 THR 21 1.159 -8.938 4.342 158 H SER 22 H SER 22 1.255 -9.193 7.710 159 HA SER 22 HA SER 22 4.114 -9.380 7.437 160 HB2 SER 22 HB2 SER 22 3.853 -11.440 8.794 161 HB3 SER 22 HB1 SER 22 3.078 -10.042 9.538 162 HG SER 22 HG SER 22 1.318 -11.157 9.513 163 H ILE 23 H ILE 23 5.142 -11.401 6.681 164 HA ILE 23 HA ILE 23 4.410 -12.046 4.056 165 HB ILE 23 HB ILE 23 6.151 -13.696 5.913 166 HG12 ILE 23 HG12 ILE 23 6.948 -11.388 5.839 167 HG13 ILE 23 HG11 ILE 23 8.052 -12.438 4.960 168 HG21 ILE 23 HG21 ILE 23 5.564 -14.939 3.925 169 HG22 ILE 23 HG22 ILE 23 7.252 -14.438 3.815 170 HG23 ILE 23 HG23 ILE 23 6.019 -13.579 2.898 171 HD11 ILE 23 HD11 ILE 23 7.727 -10.347 3.784 172 HD12 ILE 23 HD12 ILE 23 5.985 -10.613 3.746 173 HD13 ILE 23 HD13 ILE 23 7.061 -11.684 2.847 174 H PHE 24 H PHE 24 3.599 -13.493 7.132 175 HA PHE 24 HA PHE 24 2.501 -15.923 6.237 176 HB2 PHE 24 HB2 PHE 24 2.995 -15.327 8.626 177 HB3 PHE 24 HB1 PHE 24 1.594 -14.269 8.602 178 HD1 PHE 24 HD1 PHE 24 2.549 -17.810 7.976 179 HD2 PHE 24 HD2 PHE 24 -0.459 -15.093 9.264 180 HE1 PHE 24 HE1 PHE 24 1.119 -19.703 8.611 181 HE2 PHE 24 HE2 PHE 24 -1.897 -16.982 9.904 182 HZ PHE 24 HZ PHE 24 -1.110 -19.293 9.577 183 H GLN 25 H GLN 25 0.999 -12.770 6.871 184 HA GLN 25 HA GLN 25 -1.605 -13.515 6.019 185 HB2 GLN 25 HB2 GLN 25 -0.378 -10.755 6.086 186 HB3 GLN 25 HB1 GLN 25 -2.094 -11.134 6.036 187 HG2 GLN 25 HG2 GLN 25 -1.951 -12.140 8.241 188 HG3 GLN 25 HG1 GLN 25 -0.219 -11.806 8.288 189 HE21 GLN 25 HE21 GLN 25 -3.391 -10.477 8.501 190 HE22 GLN 25 HE22 GLN 25 -2.925 -8.912 9.071 191 H LEU 26 H LEU 26 1.111 -11.888 4.439 192 HA LEU 26 HA LEU 26 -0.092 -11.286 1.997 193 HB2 LEU 26 HB2 LEU 26 2.088 -10.414 2.618 194 HB3 LEU 26 HB1 LEU 26 2.768 -12.028 2.620 195 HG LEU 26 HG LEU 26 2.469 -12.161 0.184 196 HD11 LEU 26 HD11 LEU 26 0.520 -10.686 -0.015 197 HD12 LEU 26 HD12 LEU 26 1.828 -10.195 -1.092 198 HD13 LEU 26 HD13 LEU 26 1.535 -9.303 0.399 199 HD21 LEU 26 HD21 LEU 26 3.927 -9.707 1.144 200 HD22 LEU 26 HD22 LEU 26 4.180 -10.503 -0.412 201 HD23 LEU 26 HD23 LEU 26 4.571 -11.348 1.088 202 H LYS 27 H LYS 27 1.486 -14.239 3.098 203 HA LYS 27 HA LYS 27 1.377 -15.757 0.760 204 HB2 LYS 27 HB2 LYS 27 2.548 -16.446 2.829 205 HB3 LYS 27 HB1 LYS 27 0.988 -16.659 3.618 206 HG2 LYS 27 HG2 LYS 27 0.463 -18.370 1.838 207 HG3 LYS 27 HG1 LYS 27 2.161 -18.275 1.374 208 HD2 LYS 27 HD2 LYS 27 1.837 -20.141 2.879 209 HD3 LYS 27 HD1 LYS 27 2.784 -18.893 3.692 210 HE2 LYS 27 HE2 LYS 27 0.916 -18.190 4.980 211 HE3 LYS 27 HE1 LYS 27 -0.204 -19.124 3.994 212 HZ1 LYS 27 HZ1 LYS 27 0.188 -20.239 6.070 213 HZ2 LYS 27 HZ2 LYS 27 1.860 -20.219 5.822 214 HZ3 LYS 27 HZ3 LYS 27 0.873 -21.146 4.821 215 H GLU 28 H GLU 28 -0.959 -15.419 3.395 216 HA GLU 28 HA GLU 28 -2.918 -17.129 2.339 217 HB2 GLU 28 HB2 GLU 28 -3.054 -14.893 4.336 218 HB3 GLU 28 HB1 GLU 28 -4.422 -15.934 3.970 219 HG2 GLU 28 HG2 GLU 28 -3.043 -17.877 4.668 220 HG3 GLU 28 HG1 GLU 28 -1.776 -16.748 5.147 221 H VAL 29 H VAL 29 -2.386 -13.650 2.023 222 HA VAL 29 HA VAL 29 -4.775 -12.944 0.762 223 HB VAL 29 HB VAL 29 -2.002 -11.792 0.321 224 HG11 VAL 29 HG11 VAL 29 -3.162 -9.800 -0.548 225 HG12 VAL 29 HG12 VAL 29 -4.695 -10.669 -0.453 226 HG13 VAL 29 HG13 VAL 29 -3.435 -11.222 -1.554 227 HG21 VAL 29 HG21 VAL 29 -4.277 -10.851 2.066 228 HG22 VAL 29 HG22 VAL 29 -2.730 -10.034 1.854 229 HG23 VAL 29 HG23 VAL 29 -2.792 -11.616 2.629 230 H VAL 30 H VAL 30 -1.692 -13.936 -0.697 231 HA VAL 30 HA VAL 30 -2.653 -13.912 -3.355 232 HB VAL 30 HB VAL 30 -0.308 -15.454 -2.217 233 HG11 VAL 30 HG11 VAL 30 -0.979 -16.299 -4.401 234 HG12 VAL 30 HG12 VAL 30 0.551 -15.431 -4.517 235 HG13 VAL 30 HG13 VAL 30 -0.942 -14.664 -5.061 236 HG21 VAL 30 HG21 VAL 30 1.042 -13.556 -2.991 237 HG22 VAL 30 HG22 VAL 30 -0.137 -13.062 -1.775 238 HG23 VAL 30 HG23 VAL 30 -0.430 -12.716 -3.479 239 H ALA 31 H ALA 31 -2.407 -16.451 -0.913 240 HA ALA 31 HA ALA 31 -3.144 -18.628 -2.521 241 HB1 ALA 31 HB1 ALA 31 -2.187 -18.799 -0.244 242 HB2 ALA 31 HB2 ALA 31 -3.632 -19.784 -0.471 243 HB3 ALA 31 HB3 ALA 31 -3.733 -18.258 0.405 244 H LYS 32 H LYS 32 -5.113 -16.471 -0.500 245 HA LYS 32 HA LYS 32 -7.597 -17.673 -1.041 246 HB2 LYS 32 HB2 LYS 32 -7.092 -16.143 0.834 247 HB3 LYS 32 HB1 LYS 32 -6.938 -14.822 -0.311 248 HG2 LYS 32 HG2 LYS 32 -9.322 -15.240 -0.958 249 HG3 LYS 32 HG1 LYS 32 -9.413 -16.356 0.409 250 HD2 LYS 32 HD2 LYS 32 -8.642 -13.456 0.559 251 HD3 LYS 32 HD1 LYS 32 -10.227 -14.105 0.996 252 HE2 LYS 32 HE2 LYS 32 -7.576 -14.711 2.321 253 HE3 LYS 32 HE1 LYS 32 -8.881 -13.739 2.991 254 HZ1 LYS 32 HZ1 LYS 32 -8.945 -15.909 3.952 255 HZ2 LYS 32 HZ2 LYS 32 -8.945 -16.653 2.442 256 HZ3 LYS 32 HZ3 LYS 32 -10.288 -15.751 2.938 257 H ARG 33 H ARG 33 -5.749 -15.126 -2.574 258 HA ARG 33 HA ARG 33 -7.696 -14.152 -4.352 259 HB2 ARG 33 HB2 ARG 33 -5.488 -13.099 -3.705 260 HB3 ARG 33 HB1 ARG 33 -4.716 -14.237 -4.800 261 HG2 ARG 33 HG2 ARG 33 -5.753 -13.256 -6.690 262 HG3 ARG 33 HG1 ARG 33 -6.828 -12.284 -5.677 263 HD2 ARG 33 HD2 ARG 33 -4.861 -11.108 -4.766 264 HD3 ARG 33 HD1 ARG 33 -3.826 -12.042 -5.840 265 HE ARG 33 HE ARG 33 -5.020 -10.957 -7.705 266 HH11 ARG 33 HH11 ARG 33 -5.133 -9.424 -4.544 267 HH12 ARG 33 HH12 ARG 33 -5.347 -7.831 -5.178 268 HH21 ARG 33 HH21 ARG 33 -5.309 -8.840 -8.547 269 HH22 ARG 33 HH22 ARG 33 -5.446 -7.498 -7.468 270 H GLN 34 H GLN 34 -5.462 -16.838 -4.536 271 HA GLN 34 HA GLN 34 -6.152 -17.361 -7.317 272 HB2 GLN 34 HB2 GLN 34 -4.178 -18.691 -5.462 273 HB3 GLN 34 HB1 GLN 34 -4.404 -19.110 -7.156 274 HG2 GLN 34 HG2 GLN 34 -3.670 -16.342 -6.257 275 HG3 GLN 34 HG1 GLN 34 -2.462 -17.568 -6.615 276 HE21 GLN 34 HE21 GLN 34 -3.005 -15.007 -7.916 277 HE22 GLN 34 HE22 GLN 34 -3.316 -15.368 -9.576 278 H GLY 35 H GLY 35 -7.091 -18.338 -4.196 279 HA2 GLY 35 HA2 GLY 35 -8.886 -19.701 -3.627 280 HA3 GLY 35 HA1 GLY 35 -8.993 -20.215 -5.305 281 H VAL 36 H VAL 36 -6.210 -20.350 -3.128 282 HA VAL 36 HA VAL 36 -6.327 -23.285 -3.282 283 HB VAL 36 HB VAL 36 -3.904 -23.394 -3.545 284 HG11 VAL 36 HG11 VAL 36 -3.709 -22.532 -5.830 285 HG12 VAL 36 HG12 VAL 36 -5.185 -21.595 -5.597 286 HG13 VAL 36 HG13 VAL 36 -5.245 -23.358 -5.566 287 HG21 VAL 36 HG21 VAL 36 -2.555 -21.395 -3.952 288 HG22 VAL 36 HG22 VAL 36 -3.320 -21.316 -2.364 289 HG23 VAL 36 HG23 VAL 36 -3.974 -20.377 -3.703 290 HA PRO 37 HA PRO 37 -5.580 -23.258 1.103 291 HB2 PRO 37 HB2 PRO 37 -3.675 -25.487 0.771 292 HB3 PRO 37 HB1 PRO 37 -5.213 -25.453 1.639 293 HG2 PRO 37 HG2 PRO 37 -4.927 -26.792 -0.673 294 HG3 PRO 37 HG1 PRO 37 -6.441 -25.973 -0.247 295 HD2 PRO 37 HD2 PRO 37 -4.269 -25.101 -2.111 296 HD3 PRO 37 HD1 PRO 37 -6.032 -24.973 -2.291 297 H ALA 38 H ALA 38 -4.332 -21.787 2.062 298 HA ALA 38 HA ALA 38 -1.839 -20.948 1.010 299 HB1 ALA 38 HB1 ALA 38 -1.773 -19.381 2.818 300 HB2 ALA 38 HB2 ALA 38 -2.989 -20.292 3.714 301 HB3 ALA 38 HB3 ALA 38 -3.424 -19.479 2.210 302 H ASP 39 H ASP 39 -2.671 -23.419 3.199 303 HA ASP 39 HA ASP 39 -0.169 -23.476 4.595 304 HB2 ASP 39 HB2 ASP 39 -2.305 -25.609 4.370 305 HB3 ASP 39 HB1 ASP 39 -0.949 -25.638 5.494 306 H GLN 40 H GLN 40 -1.415 -24.773 1.651 307 HA GLN 40 HA GLN 40 0.879 -26.559 1.294 308 HB2 GLN 40 HB2 GLN 40 -1.464 -26.060 -0.553 309 HB3 GLN 40 HB1 GLN 40 -0.262 -27.328 -0.715 310 HG2 GLN 40 HG2 GLN 40 -1.078 -28.332 1.377 311 HG3 GLN 40 HG1 GLN 40 -2.314 -27.078 1.471 312 HE21 GLN 40 HE21 GLN 40 -2.686 -29.931 1.283 313 HE22 GLN 40 HE22 GLN 40 -3.607 -30.207 -0.155 314 H LEU 41 H LEU 41 0.851 -23.534 1.287 315 HA LEU 41 HA LEU 41 1.741 -23.070 -1.455 316 HB2 LEU 41 HB2 LEU 41 -0.120 -21.702 -0.411 317 HB3 LEU 41 HB1 LEU 41 1.108 -20.991 0.616 318 HG LEU 41 HG LEU 41 2.259 -20.112 -1.355 319 HD11 LEU 41 HD11 LEU 41 1.168 -20.238 -3.542 320 HD12 LEU 41 HD12 LEU 41 -0.060 -21.311 -2.872 321 HD13 LEU 41 HD13 LEU 41 1.625 -21.831 -2.956 322 HD21 LEU 41 HD21 LEU 41 0.595 -18.434 -1.952 323 HD22 LEU 41 HD22 LEU 41 0.553 -18.766 -0.221 324 HD23 LEU 41 HD23 LEU 41 -0.679 -19.449 -1.282 325 H ARG 42 H ARG 42 3.769 -22.401 -1.894 326 HA ARG 42 HA ARG 42 5.604 -22.103 0.380 327 HB2 ARG 42 HB2 ARG 42 6.155 -24.176 -0.602 328 HB3 ARG 42 HB1 ARG 42 5.932 -23.566 -2.230 329 HG2 ARG 42 HG2 ARG 42 8.291 -23.979 -1.682 330 HG3 ARG 42 HG1 ARG 42 7.975 -22.291 -2.080 331 HD2 ARG 42 HD2 ARG 42 9.473 -22.451 -0.181 332 HD3 ARG 42 HD1 ARG 42 7.938 -21.742 0.305 333 HE ARG 42 HE ARG 42 7.458 -24.197 1.027 334 HH11 ARG 42 HH11 ARG 42 10.530 -22.538 1.225 335 HH12 ARG 42 HH12 ARG 42 11.057 -23.373 2.644 336 HH21 ARG 42 HH21 ARG 42 8.142 -25.320 2.917 337 HH22 ARG 42 HH22 ARG 42 9.688 -24.968 3.608 338 H VAL 43 H VAL 43 6.513 -20.183 0.520 339 HA VAL 43 HA VAL 43 6.536 -18.448 -1.833 340 HB VAL 43 HB VAL 43 6.883 -16.576 -0.269 341 HG11 VAL 43 HG11 VAL 43 4.589 -18.356 0.542 342 HG12 VAL 43 HG12 VAL 43 4.601 -17.243 -0.824 343 HG13 VAL 43 HG13 VAL 43 4.697 -16.619 0.822 344 HG21 VAL 43 HG21 VAL 43 6.747 -16.921 2.160 345 HG22 VAL 43 HG22 VAL 43 8.150 -17.738 1.471 346 HG23 VAL 43 HG23 VAL 43 6.717 -18.667 1.908 347 H ILE 44 H ILE 44 8.369 -17.845 -2.802 348 HA ILE 44 HA ILE 44 10.932 -18.365 -1.448 349 HB ILE 44 HB ILE 44 10.282 -18.838 -4.375 350 HG12 ILE 44 HG12 ILE 44 9.484 -20.628 -2.878 351 HG13 ILE 44 HG11 ILE 44 10.786 -21.187 -3.921 352 HG21 ILE 44 HG21 ILE 44 12.523 -17.914 -4.145 353 HG22 ILE 44 HG22 ILE 44 12.600 -19.614 -4.607 354 HG23 ILE 44 HG23 ILE 44 12.922 -19.140 -2.940 355 HD11 ILE 44 HD11 ILE 44 12.360 -20.926 -2.051 356 HD12 ILE 44 HD12 ILE 44 11.059 -22.059 -1.689 357 HD13 ILE 44 HD13 ILE 44 11.022 -20.432 -1.015 358 H PHE 45 H PHE 45 12.383 -16.744 -1.546 359 HA PHE 45 HA PHE 45 12.080 -14.620 -3.507 360 HB2 PHE 45 HB2 PHE 45 10.705 -13.767 -1.723 361 HB3 PHE 45 HB1 PHE 45 11.929 -14.163 -0.522 362 HD1 PHE 45 HD1 PHE 45 11.272 -12.017 -3.466 363 HD2 PHE 45 HD2 PHE 45 13.563 -12.609 0.068 364 HE1 PHE 45 HE1 PHE 45 12.235 -9.774 -3.714 365 HE2 PHE 45 HE2 PHE 45 14.529 -10.365 -0.173 366 HZ PHE 45 HZ PHE 45 13.867 -8.944 -2.068 367 H ALA 46 H ALA 46 14.020 -14.012 -4.227 368 HA ALA 46 HA ALA 46 16.266 -13.819 -4.473 369 HB1 ALA 46 HB1 ALA 46 15.973 -12.216 -2.638 370 HB2 ALA 46 HB2 ALA 46 17.541 -13.016 -2.558 371 HB3 ALA 46 HB3 ALA 46 16.245 -13.510 -1.470 372 H GLY 47 H GLY 47 15.090 -16.511 -3.911 373 HA2 GLY 47 HA2 GLY 47 16.130 -18.591 -4.148 374 HA3 GLY 47 HA1 GLY 47 17.635 -17.879 -3.606 375 H LYS 48 H LYS 48 15.308 -16.932 -1.443 376 HA LYS 48 HA LYS 48 15.761 -19.304 0.250 377 HB2 LYS 48 HB2 LYS 48 15.981 -17.866 2.190 378 HB3 LYS 48 HB1 LYS 48 17.191 -17.453 0.987 379 HG2 LYS 48 HG2 LYS 48 16.079 -15.476 0.397 380 HG3 LYS 48 HG1 LYS 48 14.599 -15.969 1.220 381 HD2 LYS 48 HD2 LYS 48 15.643 -15.777 3.343 382 HD3 LYS 48 HD1 LYS 48 17.217 -15.443 2.604 383 HE2 LYS 48 HE2 LYS 48 16.122 -13.417 1.546 384 HE3 LYS 48 HE1 LYS 48 14.744 -13.724 2.597 385 HZ1 LYS 48 HZ1 LYS 48 16.196 -13.482 4.513 386 HZ2 LYS 48 HZ2 LYS 48 16.226 -12.092 3.548 387 HZ3 LYS 48 HZ3 LYS 48 17.518 -13.183 3.498 388 H GLU 49 H GLU 49 14.255 -19.100 2.268 389 HA GLU 49 HA GLU 49 11.574 -18.438 1.277 390 HB2 GLU 49 HB2 GLU 49 10.743 -20.053 2.981 391 HB3 GLU 49 HB1 GLU 49 11.768 -20.799 1.766 392 HG2 GLU 49 HG2 GLU 49 13.613 -20.874 3.296 393 HG3 GLU 49 HG1 GLU 49 12.696 -19.970 4.500 394 H LEU 50 H LEU 50 10.668 -16.743 2.147 395 HA LEU 50 HA LEU 50 11.799 -15.225 4.234 396 HB2 LEU 50 HB2 LEU 50 8.983 -15.130 3.162 397 HB3 LEU 50 HB1 LEU 50 9.744 -13.891 4.140 398 HG LEU 50 HG LEU 50 10.478 -14.678 1.332 399 HD11 LEU 50 HD11 LEU 50 9.281 -12.154 2.438 400 HD12 LEU 50 HD12 LEU 50 8.444 -13.372 1.477 401 HD13 LEU 50 HD13 LEU 50 9.748 -12.429 0.760 402 HD21 LEU 50 HD21 LEU 50 12.494 -14.091 2.540 403 HD22 LEU 50 HD22 LEU 50 11.725 -12.631 3.164 404 HD23 LEU 50 HD23 LEU 50 12.062 -12.781 1.441 405 H ARG 51 H ARG 51 10.811 -14.684 6.277 406 HA ARG 51 HA ARG 51 9.695 -17.024 7.581 407 HB2 ARG 51 HB2 ARG 51 9.977 -15.634 9.681 408 HB3 ARG 51 HB1 ARG 51 11.456 -16.066 8.840 409 HG2 ARG 51 HG2 ARG 51 10.358 -13.499 7.995 410 HG3 ARG 51 HG1 ARG 51 10.779 -13.562 9.710 411 HD2 ARG 51 HD2 ARG 51 12.604 -14.312 7.426 412 HD3 ARG 51 HD1 ARG 51 12.661 -12.794 8.324 413 HE ARG 51 HE ARG 51 12.894 -14.619 10.277 414 HH11 ARG 51 HH11 ARG 51 14.608 -14.234 7.247 415 HH12 ARG 51 HH12 ARG 51 16.063 -14.946 7.843 416 HH21 ARG 51 HH21 ARG 51 14.823 -15.568 11.057 417 HH22 ARG 51 HH22 ARG 51 16.191 -15.708 10.011 418 H ASN 52 H ASN 52 7.757 -17.038 8.684 419 HA ASN 52 HA ASN 52 5.660 -15.656 7.414 420 HB2 ASN 52 HB2 ASN 52 4.179 -16.776 8.990 421 HB3 ASN 52 HB1 ASN 52 5.389 -17.894 8.387 422 HD21 ASN 52 HD21 ASN 52 3.752 -17.894 10.844 423 HD22 ASN 52 HD22 ASN 52 4.872 -18.034 12.147 424 H ASP 53 H ASP 53 7.246 -15.130 10.518 425 HA ASP 53 HA ASP 53 5.419 -12.946 11.080 426 HB2 ASP 53 HB2 ASP 53 5.846 -14.483 12.932 427 HB3 ASP 53 HB1 ASP 53 7.571 -14.146 12.832 428 H TRP 54 H TRP 54 6.335 -11.921 9.227 429 HA TRP 54 HA TRP 54 8.171 -9.897 10.126 430 HB2 TRP 54 HB2 TRP 54 9.653 -11.655 9.153 431 HB3 TRP 54 HB1 TRP 54 8.803 -11.481 7.624 432 HD1 TRP 54 HD1 TRP 54 10.227 -10.122 5.998 433 HE1 TRP 54 HE1 TRP 54 11.791 -8.082 6.162 434 HE3 TRP 54 HE3 TRP 54 9.958 -9.290 11.033 435 HZ2 TRP 54 HZ2 TRP 54 12.768 -6.351 8.159 436 HZ3 TRP 54 HZ3 TRP 54 11.234 -7.422 11.989 437 HH2 TRP 54 HH2 TRP 54 12.609 -5.983 10.581 438 H THR 55 H THR 55 7.771 -7.962 9.140 439 HA THR 55 HA THR 55 5.307 -7.823 7.684 440 HB THR 55 HB THR 55 5.618 -6.123 9.322 441 HG1 THR 55 HG1 THR 55 5.041 -4.447 8.077 442 HG21 THR 55 HG21 THR 55 8.173 -5.406 7.884 443 HG22 THR 55 HG22 THR 55 8.052 -6.151 9.478 444 HG23 THR 55 HG23 THR 55 7.474 -4.503 9.228 445 H VAL 56 H VAL 56 4.955 -7.133 5.631 446 HA VAL 56 HA VAL 56 6.943 -7.746 3.705 447 HB VAL 56 HB VAL 56 4.492 -8.062 3.360 448 HG11 VAL 56 HG11 VAL 56 3.074 -6.199 2.750 449 HG12 VAL 56 HG12 VAL 56 4.393 -5.068 3.064 450 HG13 VAL 56 HG13 VAL 56 3.698 -6.006 4.387 451 HG21 VAL 56 HG21 VAL 56 5.986 -6.392 1.359 452 HG22 VAL 56 HG22 VAL 56 4.418 -7.127 1.023 453 HG23 VAL 56 HG23 VAL 56 5.802 -8.150 1.403 454 H GLN 57 H GLN 57 6.025 -4.902 5.394 455 HA GLN 57 HA GLN 57 6.878 -2.930 3.575 456 HB2 GLN 57 HB2 GLN 57 5.423 -2.483 5.516 457 HB3 GLN 57 HB1 GLN 57 6.775 -2.809 6.589 458 HG2 GLN 57 HG2 GLN 57 7.989 -0.915 5.532 459 HG3 GLN 57 HG1 GLN 57 6.525 -0.551 4.618 460 HE21 GLN 57 HE21 GLN 57 6.237 1.440 5.539 461 HE22 GLN 57 HE22 GLN 57 5.762 1.663 7.185 462 H ASN 58 H ASN 58 8.460 -4.232 6.479 463 HA ASN 58 HA ASN 58 10.951 -2.941 5.868 464 HB2 ASN 58 HB2 ASN 58 10.136 -4.892 8.010 465 HB3 ASN 58 HB1 ASN 58 11.784 -4.308 7.850 466 HD21 ASN 58 HD21 ASN 58 12.230 -2.148 8.283 467 HD22 ASN 58 HD22 ASN 58 11.128 -1.149 9.168 468 H CYS 59 H CYS 59 9.550 -5.565 4.552 469 HA CYS 59 HA CYS 59 12.054 -7.012 4.190 470 HB2 CYS 59 HB2 CYS 59 9.839 -8.176 4.706 471 HB3 CYS 59 HB1 CYS 59 9.345 -7.753 3.074 472 HG CYS 59 HG CYS 59 11.889 -9.118 2.185 473 H ASP 60 H ASP 60 10.172 -4.616 2.812 474 HA ASP 60 HA ASP 60 10.221 -3.388 0.930 475 HB2 ASP 60 HB2 ASP 60 13.080 -4.316 1.013 476 HB3 ASP 60 HB1 ASP 60 12.494 -3.112 -0.128 477 H LEU 61 H LEU 61 8.989 -5.745 0.318 478 HA LEU 61 HA LEU 61 10.094 -6.860 -2.098 479 HB2 LEU 61 HB2 LEU 61 7.290 -7.008 -0.975 480 HB3 LEU 61 HB1 LEU 61 7.814 -7.865 -2.406 481 HG LEU 61 HG LEU 61 7.833 -9.460 -0.699 482 HD11 LEU 61 HD11 LEU 61 9.852 -9.503 -2.062 483 HD12 LEU 61 HD12 LEU 61 10.151 -10.084 -0.425 484 HD13 LEU 61 HD13 LEU 61 10.663 -8.463 -0.892 485 HD21 LEU 61 HD21 LEU 61 8.808 -9.164 1.475 486 HD22 LEU 61 HD22 LEU 61 7.646 -7.871 1.167 487 HD23 LEU 61 HD23 LEU 61 9.373 -7.555 1.032 488 H ASP 62 H ASP 62 8.995 -3.942 -1.454 489 HA ASP 62 HA ASP 62 7.349 -3.335 -3.707 490 HB2 ASP 62 HB2 ASP 62 7.153 -2.005 -1.703 491 HB3 ASP 62 HB1 ASP 62 8.868 -1.623 -1.729 492 H GLN 63 H GLN 63 10.771 -3.276 -2.978 493 HA GLN 63 HA GLN 63 11.299 -2.347 -5.719 494 HB2 GLN 63 HB2 GLN 63 12.864 -1.651 -3.234 495 HB3 GLN 63 HB1 GLN 63 13.341 -1.231 -4.873 496 HG2 GLN 63 HG2 GLN 63 10.799 -0.332 -3.537 497 HG3 GLN 63 HG1 GLN 63 12.273 0.626 -3.656 498 HE21 GLN 63 HE21 GLN 63 9.534 1.002 -4.707 499 HE22 GLN 63 HE22 GLN 63 9.737 1.286 -6.405 500 H GLN 64 H GLN 64 12.387 -4.372 -3.039 501 HA GLN 64 HA GLN 64 14.629 -5.396 -4.503 502 HB2 GLN 64 HB2 GLN 64 13.372 -6.210 -1.888 503 HB3 GLN 64 HB1 GLN 64 14.766 -7.025 -2.580 504 HG2 GLN 64 HG2 GLN 64 14.663 -4.103 -1.877 505 HG3 GLN 64 HG1 GLN 64 15.356 -5.364 -0.859 506 HE21 GLN 64 HE21 GLN 64 17.277 -6.358 -1.493 507 HE22 GLN 64 HE22 GLN 64 18.319 -5.661 -2.682 508 H SEP 65 H SEP 65 13.984 -6.370 -6.342 509 HA SEP 65 HA SEP 65 13.263 -8.009 -7.723 510 HB2 SEP 65 HB1 SEP 65 13.362 -10.313 -6.806 511 HB3 SEP 65 HB2 SEP 65 13.522 -9.630 -5.188 512 H ILE 66 H ILE 66 11.703 -10.307 -7.185 513 HA ILE 66 HA ILE 66 9.122 -9.214 -6.378 514 HB ILE 66 HB ILE 66 9.332 -9.204 -8.883 515 HG12 ILE 66 HG12 ILE 66 7.330 -11.246 -7.922 516 HG13 ILE 66 HG11 ILE 66 7.143 -9.510 -7.712 517 HG21 ILE 66 HG21 ILE 66 9.524 -12.191 -8.572 518 HG22 ILE 66 HG22 ILE 66 10.801 -11.116 -9.148 519 HG23 ILE 66 HG23 ILE 66 9.324 -11.324 -10.094 520 HD11 ILE 66 HD11 ILE 66 7.354 -10.947 -10.346 521 HD12 ILE 66 HD12 ILE 66 7.141 -9.209 -10.129 522 HD13 ILE 66 HD13 ILE 66 5.872 -10.323 -9.619 523 H VAL 67 H VAL 67 7.722 -10.792 -5.454 524 HA VAL 67 HA VAL 67 9.160 -12.976 -4.220 525 HB VAL 67 HB VAL 67 6.221 -12.318 -3.971 526 HG11 VAL 67 HG11 VAL 67 8.071 -13.877 -2.167 527 HG12 VAL 67 HG12 VAL 67 6.809 -14.552 -3.195 528 HG13 VAL 67 HG13 VAL 67 6.377 -13.513 -1.837 529 HG21 VAL 67 HG21 VAL 67 6.813 -11.089 -1.942 530 HG22 VAL 67 HG22 VAL 67 7.551 -10.373 -3.374 531 HG23 VAL 67 HG23 VAL 67 8.522 -11.359 -2.281 532 H HIS 68 H HIS 68 9.114 -15.067 -4.806 533 HA HIS 68 HA HIS 68 7.354 -15.831 -7.031 534 HB2 HIS 68 HB2 HIS 68 9.877 -17.087 -5.927 535 HB3 HIS 68 HB1 HIS 68 8.877 -17.851 -7.152 536 HD2 HIS 68 HD2 HIS 68 9.917 -14.056 -7.281 537 HE1 HIS 68 HE1 HIS 68 11.721 -16.147 -10.488 538 HE2 HIS 68 HE2 HIS 68 11.525 -13.916 -9.314 539 H ILE 69 H ILE 69 5.474 -16.649 -6.301 540 HA ILE 69 HA ILE 69 5.605 -18.405 -3.958 541 HB ILE 69 HB ILE 69 3.250 -16.840 -5.023 542 HG12 ILE 69 HG12 ILE 69 5.012 -16.464 -2.595 543 HG13 ILE 69 HG11 ILE 69 4.835 -15.372 -3.959 544 HG21 ILE 69 HG21 ILE 69 2.091 -17.595 -3.017 545 HG22 ILE 69 HG22 ILE 69 3.484 -18.584 -2.582 546 HG23 ILE 69 HG23 ILE 69 2.564 -18.949 -4.042 547 HD11 ILE 69 HD11 ILE 69 2.508 -14.970 -3.319 548 HD12 ILE 69 HD12 ILE 69 3.639 -14.528 -2.040 549 HD13 ILE 69 HD13 ILE 69 2.718 -16.028 -1.924 550 H VAL 70 H VAL 70 5.383 -20.483 -4.336 551 HA VAL 70 HA VAL 70 3.822 -21.313 -6.683 552 HB VAL 70 HB VAL 70 5.263 -23.327 -6.840 553 HG11 VAL 70 HG11 VAL 70 7.231 -22.207 -7.795 554 HG12 VAL 70 HG12 VAL 70 6.739 -20.704 -7.018 555 HG13 VAL 70 HG13 VAL 70 5.726 -21.421 -8.270 556 HG21 VAL 70 HG21 VAL 70 6.951 -21.929 -4.760 557 HG22 VAL 70 HG22 VAL 70 7.413 -23.381 -5.648 558 HG23 VAL 70 HG23 VAL 70 6.048 -23.426 -4.531 559 H GLN 71 H GLN 71 2.521 -23.152 -6.478 560 HA GLN 71 HA GLN 71 1.738 -23.716 -3.725 561 HB2 GLN 71 HB2 GLN 71 0.064 -23.047 -5.500 562 HB3 GLN 71 HB1 GLN 71 0.373 -24.597 -6.269 563 HG2 GLN 71 HG2 GLN 71 -0.280 -25.650 -4.046 564 HG3 GLN 71 HG1 GLN 71 -0.896 -24.059 -3.604 565 HE21 GLN 71 HE21 GLN 71 -2.384 -26.489 -3.883 566 HE22 GLN 71 HE22 GLN 71 -3.556 -26.226 -5.123 567 H ARG 72 H ARG 72 1.916 -25.680 -2.803 568 HA ARG 72 HA ARG 72 2.870 -27.909 -4.465 569 HB2 ARG 72 HB2 ARG 72 3.792 -27.137 -1.688 570 HB3 ARG 72 HB1 ARG 72 4.149 -28.685 -2.436 571 HG2 ARG 72 HG2 ARG 72 4.967 -26.040 -3.628 572 HG3 ARG 72 HG1 ARG 72 5.988 -26.979 -2.537 573 HD2 ARG 72 HD2 ARG 72 6.652 -27.481 -4.784 574 HD3 ARG 72 HD1 ARG 72 5.816 -28.890 -4.136 575 HE ARG 72 HE ARG 72 4.194 -27.042 -5.688 576 HH11 ARG 72 HH11 ARG 72 6.091 -29.993 -5.682 577 HH12 ARG 72 HH12 ARG 72 5.345 -30.625 -7.106 578 HH21 ARG 72 HH21 ARG 72 3.213 -27.866 -7.588 579 HH22 ARG 72 HH22 ARG 72 3.697 -29.407 -8.202 580 HA PRO 73 HA PRO 73 -0.937 -29.117 -2.279 581 HB2 PRO 73 HB2 PRO 73 -2.168 -30.304 -4.341 582 HB3 PRO 73 HB1 PRO 73 -2.155 -28.548 -4.150 583 HG2 PRO 73 HG2 PRO 73 -0.540 -30.266 -5.976 584 HG3 PRO 73 HG1 PRO 73 -1.228 -28.659 -6.261 585 HD2 PRO 73 HD2 PRO 73 1.421 -29.181 -5.586 586 HD3 PRO 73 HD1 PRO 73 0.608 -27.615 -5.409 587 H TRP 74 H TRP 74 -0.583 -30.780 -0.970 588 HA TRP 74 HA TRP 74 0.528 -33.275 -2.031 589 HB2 TRP 74 HB2 TRP 74 0.025 -32.447 0.839 590 HB3 TRP 74 HB1 TRP 74 0.857 -33.906 0.316 591 HD1 TRP 74 HD1 TRP 74 3.270 -33.456 -1.010 592 HE1 TRP 74 HE1 TRP 74 5.037 -31.637 -0.556 593 HE3 TRP 74 HE3 TRP 74 0.377 -30.154 1.605 594 HZ2 TRP 74 HZ2 TRP 74 5.180 -29.132 0.738 595 HZ3 TRP 74 HZ3 TRP 74 1.406 -28.076 2.420 596 HH2 TRP 74 HH2 TRP 74 3.755 -27.575 1.994 597 H ARG 75 H ARG 75 -2.355 -32.068 -2.046 598 HA ARG 75 HA ARG 75 -3.694 -34.554 -1.218 599 HB2 ARG 75 HB2 ARG 75 -4.164 -32.571 0.269 600 HB3 ARG 75 HB1 ARG 75 -4.886 -31.774 -1.119 601 HG2 ARG 75 HG2 ARG 75 -6.625 -32.687 0.243 602 HG3 ARG 75 HG1 ARG 75 -6.537 -33.618 -1.253 603 HD2 ARG 75 HD2 ARG 75 -5.257 -35.351 -0.102 604 HD3 ARG 75 HD1 ARG 75 -5.330 -34.416 1.391 605 HE ARG 75 HE ARG 75 -7.799 -35.293 0.080 606 HH11 ARG 75 HH11 ARG 75 -5.631 -35.404 2.828 607 HH12 ARG 75 HH12 ARG 75 -6.760 -36.200 3.863 608 HH21 ARG 75 HH21 ARG 75 -9.303 -36.365 1.444 609 HH22 ARG 75 HH22 ARG 75 -8.860 -36.751 3.067 610 H LYS 76 H LYS 76 -2.679 -32.998 -3.769 611 HA LYS 76 HA LYS 76 -5.098 -33.451 -5.375 612 HB2 LYS 76 HB2 LYS 76 -2.851 -31.481 -5.806 613 HB3 LYS 76 HB1 LYS 76 -4.089 -31.823 -7.001 614 HG2 LYS 76 HG2 LYS 76 -4.640 -30.751 -4.238 615 HG3 LYS 76 HG1 LYS 76 -4.506 -29.760 -5.691 616 HD2 LYS 76 HD2 LYS 76 -6.493 -32.008 -5.343 617 HD3 LYS 76 HD1 LYS 76 -6.854 -30.310 -5.038 618 HE2 LYS 76 HE2 LYS 76 -6.477 -29.742 -7.323 619 HE3 LYS 76 HE1 LYS 76 -5.830 -31.339 -7.678 620 HZ1 LYS 76 HZ1 LYS 76 -8.625 -30.763 -6.874 621 HZ2 LYS 76 HZ2 LYS 76 -8.003 -32.281 -7.276 622 HZ3 LYS 76 HZ3 LYS 76 -8.105 -31.075 -8.450 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 0.455 -1.188 0.886 2 H2 MET 1 HT2 MET 1 0.547 0.051 -0.261 3 H3 MET 1 HT3 MET 1 1.365 0.200 1.204 4 HA MET 1 HA MET 1 2.865 -0.344 -0.603 5 HB2 MET 1 HB2 MET 1 3.369 -1.084 1.688 6 HB3 MET 1 HB1 MET 1 2.482 -2.574 1.404 7 HG2 MET 1 HG2 MET 1 4.097 -3.179 -0.343 8 HG3 MET 1 HG1 MET 1 4.996 -1.702 -0.003 9 HE1 MET 1 HE1 MET 1 7.236 -3.047 0.397 10 HE2 MET 1 HE2 MET 1 6.384 -4.536 0.000 11 HE3 MET 1 HE3 MET 1 7.358 -4.444 1.466 12 H ILE 2 H ILE 2 2.923 -1.171 -2.574 13 HA ILE 2 HA ILE 2 1.202 -3.491 -3.134 14 HB ILE 2 HB ILE 2 2.208 -1.384 -5.062 15 HG12 ILE 2 HG12 ILE 2 -0.576 -1.950 -4.013 16 HG13 ILE 2 HG11 ILE 2 0.431 -0.579 -3.561 17 HG21 ILE 2 HG21 ILE 2 0.394 -3.751 -5.546 18 HG22 ILE 2 HG22 ILE 2 2.044 -3.570 -6.140 19 HG23 ILE 2 HG23 ILE 2 0.775 -2.494 -6.723 20 HD11 ILE 2 HD11 ILE 2 -0.658 -1.140 -6.308 21 HD12 ILE 2 HD12 ILE 2 0.338 0.241 -5.854 22 HD13 ILE 2 HD13 ILE 2 -1.275 0.055 -5.168 23 H VAL 3 H VAL 3 2.315 -5.297 -3.160 24 HA VAL 3 HA VAL 3 5.062 -5.267 -4.197 25 HB VAL 3 HB VAL 3 5.353 -7.461 -3.127 26 HG11 VAL 3 HG11 VAL 3 4.276 -5.329 -1.295 27 HG12 VAL 3 HG12 VAL 3 5.946 -5.540 -1.823 28 HG13 VAL 3 HG13 VAL 3 5.199 -6.734 -0.766 29 HG21 VAL 3 HG21 VAL 3 3.066 -8.294 -3.284 30 HG22 VAL 3 HG22 VAL 3 2.534 -7.087 -2.112 31 HG23 VAL 3 HG23 VAL 3 3.651 -8.365 -1.620 32 H PHE 4 H PHE 4 5.646 -7.362 -5.379 33 HA PHE 4 HA PHE 4 3.443 -8.032 -7.210 34 HB2 PHE 4 HB2 PHE 4 6.400 -7.871 -7.845 35 HB3 PHE 4 HB1 PHE 4 5.124 -8.289 -8.980 36 HD1 PHE 4 HD1 PHE 4 7.011 -5.650 -7.488 37 HD2 PHE 4 HD2 PHE 4 3.363 -6.532 -9.495 38 HE1 PHE 4 HE1 PHE 4 6.753 -3.271 -8.055 39 HE2 PHE 4 HE2 PHE 4 3.099 -4.157 -10.067 40 HZ PHE 4 HZ PHE 4 4.794 -2.520 -9.346 41 H VAL 5 H VAL 5 3.041 -10.166 -7.572 42 HA VAL 5 HA VAL 5 4.984 -12.089 -6.495 43 HB VAL 5 HB VAL 5 3.180 -13.473 -5.584 44 HG11 VAL 5 HG11 VAL 5 4.313 -11.946 -4.096 45 HG12 VAL 5 HG12 VAL 5 2.614 -12.075 -3.644 46 HG13 VAL 5 HG13 VAL 5 3.193 -10.657 -4.523 47 HG21 VAL 5 HG21 VAL 5 1.364 -12.783 -7.014 48 HG22 VAL 5 HG22 VAL 5 1.384 -11.168 -6.301 49 HG23 VAL 5 HG23 VAL 5 0.919 -12.560 -5.321 50 H ARG 6 H ARG 6 5.060 -14.062 -7.450 51 HA ARG 6 HA ARG 6 3.615 -14.370 -10.000 52 HB2 ARG 6 HB2 ARG 6 6.174 -15.649 -9.029 53 HB3 ARG 6 HB1 ARG 6 5.402 -15.976 -10.570 54 HG2 ARG 6 HG2 ARG 6 5.720 -13.575 -11.136 55 HG3 ARG 6 HG1 ARG 6 6.679 -13.434 -9.655 56 HD2 ARG 6 HD2 ARG 6 8.253 -15.051 -10.433 57 HD3 ARG 6 HD1 ARG 6 7.232 -15.462 -11.807 58 HE ARG 6 HE ARG 6 7.959 -12.726 -11.887 59 HH11 ARG 6 HH11 ARG 6 9.217 -15.957 -12.451 60 HH12 ARG 6 HH12 ARG 6 10.420 -15.425 -13.575 61 HH21 ARG 6 HH21 ARG 6 9.557 -12.032 -13.394 62 HH22 ARG 6 HH22 ARG 6 10.602 -13.202 -14.121 63 H PHE 7 H PHE 7 2.806 -16.509 -10.462 64 HA PHE 7 HA PHE 7 2.674 -18.262 -8.115 65 HB2 PHE 7 HB2 PHE 7 0.602 -16.825 -8.369 66 HB3 PHE 7 HB1 PHE 7 0.299 -17.668 -9.880 67 HD1 PHE 7 HD1 PHE 7 0.659 -18.125 -6.240 68 HD2 PHE 7 HD2 PHE 7 -0.761 -19.764 -9.900 69 HE1 PHE 7 HE1 PHE 7 -0.536 -19.862 -4.991 70 HE2 PHE 7 HE2 PHE 7 -1.962 -21.512 -8.655 71 HZ PHE 7 HZ PHE 7 -1.852 -21.563 -6.198 72 H ASN 8 H ASN 8 3.825 -19.926 -8.804 73 HA ASN 8 HA ASN 8 4.663 -21.634 -10.076 74 HB2 ASN 8 HB2 ASN 8 1.704 -21.839 -10.551 75 HB3 ASN 8 HB1 ASN 8 2.830 -23.047 -11.155 76 HD21 ASN 8 HD21 ASN 8 3.966 -24.316 -9.685 77 HD22 ASN 8 HD22 ASN 8 3.440 -24.512 -8.052 78 H SER 9 H SER 9 4.479 -19.010 -11.558 79 HA SER 9 HA SER 9 5.141 -20.030 -14.164 80 HB2 SER 9 HB2 SER 9 2.708 -18.250 -13.826 81 HB3 SER 9 HB1 SER 9 3.458 -18.642 -15.369 82 HG SER 9 HG SER 9 2.883 -20.845 -13.850 83 H SER 10 H SER 10 5.776 -18.186 -15.646 84 HA SER 10 HA SER 10 7.408 -16.321 -14.239 85 HB2 SER 10 HB2 SER 10 6.701 -16.445 -17.182 86 HB3 SER 10 HB1 SER 10 8.034 -15.533 -16.472 87 HG SER 10 HG SER 10 9.162 -17.304 -16.274 88 H HIS 11 H HIS 11 7.130 -14.122 -14.007 89 HA HIS 11 HA HIS 11 6.037 -12.166 -13.674 90 HB2 HIS 11 HB2 HIS 11 4.268 -13.095 -15.955 91 HB3 HIS 11 HB1 HIS 11 4.238 -11.481 -15.258 92 HD2 HIS 11 HD2 HIS 11 7.102 -10.403 -15.368 93 HE1 HIS 11 HE1 HIS 11 7.428 -12.078 -19.241 94 HE2 HIS 11 HE2 HIS 11 8.556 -10.623 -17.501 95 H GLY 12 H GLY 12 3.585 -11.322 -13.278 96 HA2 GLY 12 HA2 GLY 12 1.784 -13.279 -12.311 97 HA3 GLY 12 HA1 GLY 12 2.760 -12.660 -10.992 98 H PHE 13 H PHE 13 1.431 -11.452 -9.867 99 HA PHE 13 HA PHE 13 0.138 -9.211 -11.216 100 HB2 PHE 13 HB2 PHE 13 -1.962 -9.618 -9.944 101 HB3 PHE 13 HB1 PHE 13 -1.605 -10.888 -11.104 102 HD1 PHE 13 HD1 PHE 13 -2.251 -10.095 -7.668 103 HD2 PHE 13 HD2 PHE 13 -0.620 -13.062 -10.244 104 HE1 PHE 13 HE1 PHE 13 -2.485 -11.769 -5.885 105 HE2 PHE 13 HE2 PHE 13 -0.853 -14.739 -8.467 106 HZ PHE 13 HZ PHE 13 -1.787 -14.095 -6.287 107 HA PRO 14 HA PRO 14 1.479 -7.108 -7.556 108 HB2 PRO 14 HB2 PRO 14 0.015 -4.867 -7.690 109 HB3 PRO 14 HB1 PRO 14 1.279 -5.217 -8.877 110 HG2 PRO 14 HG2 PRO 14 -1.683 -5.505 -9.123 111 HG3 PRO 14 HG1 PRO 14 -0.509 -4.940 -10.322 112 HD2 PRO 14 HD2 PRO 14 -1.569 -7.494 -10.230 113 HD3 PRO 14 HD1 PRO 14 -0.046 -7.059 -11.025 114 H VAL 15 H VAL 15 0.943 -6.860 -5.434 115 HA VAL 15 HA VAL 15 -1.866 -7.333 -4.673 116 HB VAL 15 HB VAL 15 0.556 -8.304 -3.132 117 HG11 VAL 15 HG11 VAL 15 -1.391 -7.795 -1.742 118 HG12 VAL 15 HG12 VAL 15 -1.066 -9.528 -1.781 119 HG13 VAL 15 HG13 VAL 15 -2.385 -8.853 -2.741 120 HG21 VAL 15 HG21 VAL 15 -0.099 -10.561 -3.819 121 HG22 VAL 15 HG22 VAL 15 0.315 -9.559 -5.212 122 HG23 VAL 15 HG23 VAL 15 -1.375 -9.882 -4.830 123 H GLU 16 H GLU 16 -2.692 -5.707 -3.570 124 HA GLU 16 HA GLU 16 -0.921 -3.687 -2.460 125 HB2 GLU 16 HB2 GLU 16 -2.757 -3.005 -3.951 126 HB3 GLU 16 HB1 GLU 16 -3.920 -3.686 -2.826 127 HG2 GLU 16 HG2 GLU 16 -3.273 -2.068 -1.141 128 HG3 GLU 16 HG1 GLU 16 -2.047 -1.411 -2.227 129 H VAL 17 H VAL 17 -0.327 -3.905 -0.431 130 HA VAL 17 HA VAL 17 -2.295 -4.842 1.548 131 HB VAL 17 HB VAL 17 -0.422 -5.877 2.823 132 HG11 VAL 17 HG11 VAL 17 -0.255 -7.885 1.479 133 HG12 VAL 17 HG12 VAL 17 -0.766 -6.997 0.047 134 HG13 VAL 17 HG13 VAL 17 -1.888 -7.229 1.387 135 HG21 VAL 17 HG21 VAL 17 1.159 -5.355 0.304 136 HG22 VAL 17 HG22 VAL 17 1.691 -6.358 1.652 137 HG23 VAL 17 HG23 VAL 17 1.441 -4.628 1.886 138 H ASP 18 H ASP 18 -1.326 -4.324 3.843 139 HA ASP 18 HA ASP 18 -0.935 -1.449 3.887 140 HB2 ASP 18 HB2 ASP 18 -1.220 -3.421 6.167 141 HB3 ASP 18 HB1 ASP 18 -1.216 -1.669 6.324 142 H SER 19 H SER 19 0.681 -0.572 5.511 143 HA SER 19 HA SER 19 3.277 -1.496 4.827 144 HB2 SER 19 HB2 SER 19 2.443 0.483 6.956 145 HB3 SER 19 HB1 SER 19 4.065 0.294 6.293 146 HG SER 19 HG SER 19 3.469 1.632 4.818 147 H ASP 20 H ASP 20 1.101 -2.264 7.369 148 HA ASP 20 HA ASP 20 3.259 -3.581 8.871 149 HB2 ASP 20 HB2 ASP 20 0.605 -2.469 9.732 150 HB3 ASP 20 HB1 ASP 20 1.423 -3.691 10.700 151 H THR 21 H THR 21 2.150 -4.675 6.508 152 HA THR 21 HA THR 21 0.391 -6.822 7.326 153 HB THR 21 HB THR 21 1.825 -6.420 4.688 154 HG1 THR 21 HG1 THR 21 0.509 -4.764 4.663 155 HG21 THR 21 HG21 THR 21 -0.580 -8.102 5.422 156 HG22 THR 21 HG22 THR 21 1.022 -8.705 4.990 157 HG23 THR 21 HG23 THR 21 0.042 -7.866 3.789 158 H SER 22 H SER 22 1.069 -8.761 7.986 159 HA SER 22 HA SER 22 3.906 -9.284 8.134 160 HB2 SER 22 HB2 SER 22 2.388 -9.818 10.023 161 HB3 SER 22 HB1 SER 22 1.565 -10.997 9.004 162 HG SER 22 HG SER 22 3.090 -12.061 10.234 163 H ILE 23 H ILE 23 4.900 -11.182 7.272 164 HA ILE 23 HA ILE 23 4.324 -11.710 4.587 165 HB ILE 23 HB ILE 23 5.869 -13.520 6.465 166 HG12 ILE 23 HG12 ILE 23 6.731 -11.216 6.557 167 HG13 ILE 23 HG11 ILE 23 7.876 -12.289 5.761 168 HG21 ILE 23 HG21 ILE 23 7.079 -14.209 4.420 169 HG22 ILE 23 HG22 ILE 23 5.977 -13.224 3.462 170 HG23 ILE 23 HG23 ILE 23 5.363 -14.610 4.360 171 HD11 ILE 23 HD11 ILE 23 7.132 -11.444 3.586 172 HD12 ILE 23 HD12 ILE 23 7.753 -10.160 4.623 173 HD13 ILE 23 HD13 ILE 23 6.013 -10.352 4.403 174 H PHE 24 H PHE 24 3.429 -13.479 7.516 175 HA PHE 24 HA PHE 24 2.242 -15.728 6.305 176 HB2 PHE 24 HB2 PHE 24 2.761 -15.543 8.729 177 HB3 PHE 24 HB1 PHE 24 1.450 -14.386 8.898 178 HD1 PHE 24 HD1 PHE 24 2.177 -17.874 7.885 179 HD2 PHE 24 HD2 PHE 24 -0.716 -15.109 9.322 180 HE1 PHE 24 HE1 PHE 24 0.608 -19.721 8.261 181 HE2 PHE 24 HE2 PHE 24 -2.294 -16.952 9.705 182 HZ PHE 24 HZ PHE 24 -1.634 -19.264 9.177 183 H GLN 25 H GLN 25 0.918 -12.591 7.231 184 HA GLN 25 HA GLN 25 -1.764 -13.122 6.542 185 HB2 GLN 25 HB2 GLN 25 -0.251 -10.510 6.667 186 HB3 GLN 25 HB1 GLN 25 -1.993 -10.641 6.486 187 HG2 GLN 25 HG2 GLN 25 -2.186 -11.676 8.651 188 HG3 GLN 25 HG1 GLN 25 -0.432 -11.705 8.827 189 HE21 GLN 25 HE21 GLN 25 -2.485 -10.434 10.478 190 HE22 GLN 25 HE22 GLN 25 -2.080 -8.753 10.531 191 H LEU 26 H LEU 26 0.883 -11.556 4.785 192 HA LEU 26 HA LEU 26 -0.471 -10.970 2.420 193 HB2 LEU 26 HB2 LEU 26 1.718 -10.076 2.878 194 HB3 LEU 26 HB1 LEU 26 2.418 -11.678 2.914 195 HG LEU 26 HG LEU 26 2.022 -11.912 0.501 196 HD11 LEU 26 HD11 LEU 26 0.044 -10.458 0.342 197 HD12 LEU 26 HD12 LEU 26 1.289 -10.034 -0.831 198 HD13 LEU 26 HD13 LEU 26 1.076 -9.056 0.618 199 HD21 LEU 26 HD21 LEU 26 4.143 -11.037 1.282 200 HD22 LEU 26 HD22 LEU 26 3.477 -9.404 1.298 201 HD23 LEU 26 HD23 LEU 26 3.679 -10.261 -0.233 202 H LYS 27 H LYS 27 1.256 -13.889 3.396 203 HA LYS 27 HA LYS 27 1.018 -15.367 1.046 204 HB2 LYS 27 HB2 LYS 27 2.451 -16.043 2.895 205 HB3 LYS 27 HB1 LYS 27 1.048 -16.293 3.922 206 HG2 LYS 27 HG2 LYS 27 0.312 -18.110 2.461 207 HG3 LYS 27 HG1 LYS 27 1.740 -17.866 1.453 208 HD2 LYS 27 HD2 LYS 27 3.179 -18.392 3.347 209 HD3 LYS 27 HD1 LYS 27 1.763 -18.599 4.380 210 HE2 LYS 27 HE2 LYS 27 1.003 -20.439 2.988 211 HE3 LYS 27 HE1 LYS 27 2.383 -20.214 1.917 212 HZ1 LYS 27 HZ1 LYS 27 2.772 -22.012 3.431 213 HZ2 LYS 27 HZ2 LYS 27 2.493 -21.022 4.768 214 HZ3 LYS 27 HZ3 LYS 27 3.841 -20.753 3.783 215 H GLU 28 H GLU 28 -1.147 -15.184 3.854 216 HA GLU 28 HA GLU 28 -3.082 -16.960 2.801 217 HB2 GLU 28 HB2 GLU 28 -2.931 -15.101 5.103 218 HB3 GLU 28 HB1 GLU 28 -4.532 -15.573 4.555 219 HG2 GLU 28 HG2 GLU 28 -2.400 -17.590 5.163 220 HG3 GLU 28 HG1 GLU 28 -3.482 -16.967 6.402 221 H VAL 29 H VAL 29 -2.682 -13.455 2.623 222 HA VAL 29 HA VAL 29 -5.185 -12.833 1.505 223 HB VAL 29 HB VAL 29 -2.507 -11.466 1.097 224 HG11 VAL 29 HG11 VAL 29 -3.985 -10.936 -0.775 225 HG12 VAL 29 HG12 VAL 29 -3.775 -9.532 0.272 226 HG13 VAL 29 HG13 VAL 29 -5.263 -10.475 0.352 227 HG21 VAL 29 HG21 VAL 29 -4.869 -10.777 2.848 228 HG22 VAL 29 HG22 VAL 29 -3.399 -9.816 2.682 229 HG23 VAL 29 HG23 VAL 29 -3.323 -11.426 3.397 230 H VAL 30 H VAL 30 -2.121 -13.719 -0.041 231 HA VAL 30 HA VAL 30 -3.044 -13.592 -2.703 232 HB VAL 30 HB VAL 30 -0.834 -15.287 -1.507 233 HG11 VAL 30 HG11 VAL 30 -1.387 -14.625 -4.400 234 HG12 VAL 30 HG12 VAL 30 -1.567 -16.209 -3.648 235 HG13 VAL 30 HG13 VAL 30 0.032 -15.477 -3.795 236 HG21 VAL 30 HG21 VAL 30 -0.481 -12.896 -1.213 237 HG22 VAL 30 HG22 VAL 30 -0.754 -12.629 -2.934 238 HG23 VAL 30 HG23 VAL 30 0.653 -13.546 -2.398 239 H ALA 31 H ALA 31 -2.825 -16.281 -0.404 240 HA ALA 31 HA ALA 31 -3.825 -18.303 -2.049 241 HB1 ALA 31 HB1 ALA 31 -4.109 -18.034 0.943 242 HB2 ALA 31 HB2 ALA 31 -2.714 -18.708 0.103 243 HB3 ALA 31 HB3 ALA 31 -4.277 -19.523 0.013 244 H LYS 32 H LYS 32 -5.486 -16.111 0.160 245 HA LYS 32 HA LYS 32 -8.092 -17.102 -0.172 246 HB2 LYS 32 HB2 LYS 32 -7.535 -15.694 1.683 247 HB3 LYS 32 HB1 LYS 32 -7.009 -14.402 0.620 248 HG2 LYS 32 HG2 LYS 32 -9.370 -14.204 -0.166 249 HG3 LYS 32 HG1 LYS 32 -9.820 -15.352 1.097 250 HD2 LYS 32 HD2 LYS 32 -8.335 -12.786 1.620 251 HD3 LYS 32 HD1 LYS 32 -10.093 -12.927 1.709 252 HE2 LYS 32 HE2 LYS 32 -8.161 -14.590 3.327 253 HE3 LYS 32 HE1 LYS 32 -8.927 -13.115 3.911 254 HZ1 LYS 32 HZ1 LYS 32 -11.081 -14.155 3.603 255 HZ2 LYS 32 HZ2 LYS 32 -10.123 -15.079 4.642 256 HZ3 LYS 32 HZ3 LYS 32 -10.355 -15.574 3.048 257 H ARG 33 H ARG 33 -6.280 -14.589 -1.855 258 HA ARG 33 HA ARG 33 -8.383 -13.556 -3.397 259 HB2 ARG 33 HB2 ARG 33 -6.211 -12.430 -3.012 260 HB3 ARG 33 HB1 ARG 33 -5.436 -13.609 -4.057 261 HG2 ARG 33 HG2 ARG 33 -6.748 -12.822 -5.946 262 HG3 ARG 33 HG1 ARG 33 -7.577 -11.667 -4.900 263 HD2 ARG 33 HD2 ARG 33 -5.407 -10.596 -4.410 264 HD3 ARG 33 HD1 ARG 33 -4.624 -11.718 -5.521 265 HE ARG 33 HE ARG 33 -6.697 -10.445 -6.882 266 HH11 ARG 33 HH11 ARG 33 -3.600 -9.615 -5.464 267 HH12 ARG 33 HH12 ARG 33 -3.288 -8.313 -6.563 268 HH21 ARG 33 HH21 ARG 33 -6.307 -8.724 -8.328 269 HH22 ARG 33 HH22 ARG 33 -4.858 -7.792 -8.187 270 H GLN 34 H GLN 34 -5.919 -16.000 -4.224 271 HA GLN 34 HA GLN 34 -7.168 -16.435 -6.801 272 HB2 GLN 34 HB2 GLN 34 -4.802 -17.789 -5.519 273 HB3 GLN 34 HB1 GLN 34 -5.350 -18.060 -7.168 274 HG2 GLN 34 HG2 GLN 34 -4.965 -15.671 -7.646 275 HG3 GLN 34 HG1 GLN 34 -4.318 -15.481 -6.018 276 HE21 GLN 34 HE21 GLN 34 -3.791 -16.779 -9.178 277 HE22 GLN 34 HE22 GLN 34 -2.118 -17.154 -8.964 278 H GLY 35 H GLY 35 -7.621 -17.656 -3.712 279 HA2 GLY 35 HA2 GLY 35 -9.167 -19.222 -3.012 280 HA3 GLY 35 HA1 GLY 35 -9.508 -19.585 -4.698 281 H VAL 36 H VAL 36 -6.587 -19.802 -2.700 282 HA VAL 36 HA VAL 36 -6.518 -22.691 -3.230 283 HB VAL 36 HB VAL 36 -4.060 -22.604 -3.499 284 HG11 VAL 36 HG11 VAL 36 -5.539 -20.857 -5.460 285 HG12 VAL 36 HG12 VAL 36 -5.446 -22.617 -5.492 286 HG13 VAL 36 HG13 VAL 36 -3.994 -21.654 -5.756 287 HG21 VAL 36 HG21 VAL 36 -3.624 -20.541 -2.252 288 HG22 VAL 36 HG22 VAL 36 -4.413 -19.607 -3.526 289 HG23 VAL 36 HG23 VAL 36 -2.917 -20.472 -3.868 290 HA PRO 37 HA PRO 37 -5.609 -22.880 1.113 291 HB2 PRO 37 HB2 PRO 37 -4.106 -25.334 0.874 292 HB3 PRO 37 HB1 PRO 37 -5.777 -25.128 1.400 293 HG2 PRO 37 HG2 PRO 37 -5.046 -26.364 -0.941 294 HG3 PRO 37 HG1 PRO 37 -6.617 -25.591 -0.674 295 HD2 PRO 37 HD2 PRO 37 -4.207 -24.550 -2.111 296 HD3 PRO 37 HD1 PRO 37 -5.926 -24.396 -2.531 297 H ALA 38 H ALA 38 -4.113 -21.820 2.259 298 HA ALA 38 HA ALA 38 -1.488 -21.389 1.217 299 HB1 ALA 38 HB1 ALA 38 -2.672 -19.625 2.418 300 HB2 ALA 38 HB2 ALA 38 -1.134 -19.997 3.196 301 HB3 ALA 38 HB3 ALA 38 -2.641 -20.589 3.893 302 H ASP 39 H ASP 39 -2.819 -23.915 2.913 303 HA ASP 39 HA ASP 39 -0.912 -24.717 4.780 304 HB2 ASP 39 HB2 ASP 39 -2.823 -26.231 3.032 305 HB3 ASP 39 HB1 ASP 39 -1.636 -27.117 3.978 306 H GLN 40 H GLN 40 -1.109 -25.647 1.357 307 HA GLN 40 HA GLN 40 1.624 -26.680 1.520 308 HB2 GLN 40 HB2 GLN 40 -0.506 -27.054 -0.585 309 HB3 GLN 40 HB1 GLN 40 1.109 -27.746 -0.659 310 HG2 GLN 40 HG2 GLN 40 -0.958 -28.324 1.452 311 HG3 GLN 40 HG1 GLN 40 -0.533 -29.374 0.100 312 HE21 GLN 40 HE21 GLN 40 -0.383 -29.826 2.989 313 HE22 GLN 40 HE22 GLN 40 1.258 -30.241 3.322 314 H LEU 41 H LEU 41 0.326 -23.832 0.947 315 HA LEU 41 HA LEU 41 1.535 -23.108 -1.547 316 HB2 LEU 41 HB2 LEU 41 -0.483 -22.005 -0.565 317 HB3 LEU 41 HB1 LEU 41 0.541 -21.341 0.690 318 HG LEU 41 HG LEU 41 1.810 -20.111 -1.061 319 HD11 LEU 41 HD11 LEU 41 0.785 -19.895 -3.281 320 HD12 LEU 41 HD12 LEU 41 -0.374 -21.154 -2.854 321 HD13 LEU 41 HD13 LEU 41 1.344 -21.536 -2.958 322 HD21 LEU 41 HD21 LEU 41 0.092 -18.424 -1.444 323 HD22 LEU 41 HD22 LEU 41 0.015 -19.036 0.208 324 HD23 LEU 41 HD23 LEU 41 -1.157 -19.582 -0.991 325 H ARG 42 H ARG 42 3.568 -22.376 -1.874 326 HA ARG 42 HA ARG 42 5.174 -21.807 0.525 327 HB2 ARG 42 HB2 ARG 42 5.737 -23.979 -0.547 328 HB3 ARG 42 HB1 ARG 42 6.133 -23.114 -2.022 329 HG2 ARG 42 HG2 ARG 42 8.109 -23.732 -0.687 330 HG3 ARG 42 HG1 ARG 42 7.955 -21.991 -0.940 331 HD2 ARG 42 HD2 ARG 42 7.153 -21.650 1.255 332 HD3 ARG 42 HD1 ARG 42 6.944 -23.380 1.525 333 HE ARG 42 HE ARG 42 9.629 -22.310 1.052 334 HH11 ARG 42 HH11 ARG 42 7.301 -23.778 3.226 335 HH12 ARG 42 HH12 ARG 42 8.485 -24.227 4.402 336 HH21 ARG 42 HH21 ARG 42 11.212 -22.920 2.610 337 HH22 ARG 42 HH22 ARG 42 10.704 -23.748 4.048 338 H VAL 43 H VAL 43 6.278 -19.932 0.549 339 HA VAL 43 HA VAL 43 6.244 -18.375 -1.929 340 HB VAL 43 HB VAL 43 6.189 -16.321 -0.547 341 HG11 VAL 43 HG11 VAL 43 3.957 -18.254 0.078 342 HG12 VAL 43 HG12 VAL 43 4.097 -17.276 -1.380 343 HG13 VAL 43 HG13 VAL 43 3.862 -16.496 0.184 344 HG21 VAL 43 HG21 VAL 43 5.682 -16.462 1.851 345 HG22 VAL 43 HG22 VAL 43 7.246 -17.190 1.482 346 HG23 VAL 43 HG23 VAL 43 5.844 -18.217 1.782 347 H ILE 44 H ILE 44 8.120 -17.759 -2.772 348 HA ILE 44 HA ILE 44 10.494 -17.680 -1.030 349 HB ILE 44 HB ILE 44 10.228 -18.802 -3.823 350 HG12 ILE 44 HG12 ILE 44 11.813 -20.536 -2.813 351 HG13 ILE 44 HG11 ILE 44 11.515 -19.762 -1.264 352 HG21 ILE 44 HG21 ILE 44 11.984 -17.151 -4.032 353 HG22 ILE 44 HG22 ILE 44 12.674 -18.773 -4.075 354 HG23 ILE 44 HG23 ILE 44 12.801 -17.802 -2.610 355 HD11 ILE 44 HD11 ILE 44 10.140 -21.723 -1.543 356 HD12 ILE 44 HD12 ILE 44 9.456 -21.059 -3.028 357 HD13 ILE 44 HD13 ILE 44 9.142 -20.271 -1.480 358 H PHE 45 H PHE 45 11.484 -15.776 -0.965 359 HA PHE 45 HA PHE 45 10.925 -13.874 -3.128 360 HB2 PHE 45 HB2 PHE 45 9.772 -13.087 -1.176 361 HB3 PHE 45 HB1 PHE 45 11.190 -13.349 -0.167 362 HD1 PHE 45 HD1 PHE 45 10.343 -11.513 -3.310 363 HD2 PHE 45 HD2 PHE 45 12.323 -11.462 0.455 364 HE1 PHE 45 HE1 PHE 45 11.061 -9.201 -3.720 365 HE2 PHE 45 HE2 PHE 45 13.044 -9.152 0.051 366 HZ PHE 45 HZ PHE 45 12.414 -8.017 -2.037 367 H ALA 46 H ALA 46 12.648 -13.767 -4.325 368 HA ALA 46 HA ALA 46 14.753 -13.495 -5.030 369 HB1 ALA 46 HB1 ALA 46 16.207 -11.998 -3.807 370 HB2 ALA 46 HB2 ALA 46 15.227 -12.187 -2.354 371 HB3 ALA 46 HB3 ALA 46 14.552 -11.389 -3.774 372 H GLY 47 H GLY 47 14.610 -15.936 -4.654 373 HA2 GLY 47 HA2 GLY 47 16.094 -17.698 -4.576 374 HA3 GLY 47 HA1 GLY 47 17.250 -16.652 -3.780 375 H LYS 48 H LYS 48 14.715 -16.276 -1.809 376 HA LYS 48 HA LYS 48 14.884 -18.825 -0.459 377 HB2 LYS 48 HB2 LYS 48 15.656 -17.684 1.704 378 HB3 LYS 48 HB1 LYS 48 16.865 -18.001 0.471 379 HG2 LYS 48 HG2 LYS 48 17.338 -15.842 1.277 380 HG3 LYS 48 HG1 LYS 48 16.536 -15.589 -0.270 381 HD2 LYS 48 HD2 LYS 48 14.420 -15.179 0.930 382 HD3 LYS 48 HD1 LYS 48 15.272 -15.371 2.462 383 HE2 LYS 48 HE2 LYS 48 15.023 -13.011 1.921 384 HE3 LYS 48 HE1 LYS 48 16.723 -13.477 1.883 385 HZ1 LYS 48 HZ1 LYS 48 16.633 -13.574 -0.512 386 HZ2 LYS 48 HZ2 LYS 48 16.085 -12.062 0.003 387 HZ3 LYS 48 HZ3 LYS 48 14.977 -13.233 -0.507 388 H GLU 49 H GLU 49 13.473 -19.043 1.356 389 HA GLU 49 HA GLU 49 11.063 -17.490 1.028 390 HB2 GLU 49 HB2 GLU 49 10.124 -19.034 2.750 391 HB3 GLU 49 HB1 GLU 49 10.770 -19.856 1.340 392 HG2 GLU 49 HG2 GLU 49 12.424 -19.513 3.809 393 HG3 GLU 49 HG1 GLU 49 11.241 -20.812 3.681 394 H LEU 50 H LEU 50 9.906 -16.822 3.125 395 HA LEU 50 HA LEU 50 11.861 -15.360 4.779 396 HB2 LEU 50 HB2 LEU 50 9.086 -14.417 4.116 397 HB3 LEU 50 HB1 LEU 50 10.382 -13.502 4.856 398 HG LEU 50 HG LEU 50 10.335 -14.463 2.002 399 HD11 LEU 50 HD11 LEU 50 9.901 -11.721 3.153 400 HD12 LEU 50 HD12 LEU 50 8.681 -12.744 2.391 401 HD13 LEU 50 HD13 LEU 50 10.024 -12.109 1.437 402 HD21 LEU 50 HD21 LEU 50 12.265 -12.629 3.425 403 HD22 LEU 50 HD22 LEU 50 12.300 -13.042 1.710 404 HD23 LEU 50 HD23 LEU 50 12.606 -14.285 2.920 405 H ARG 51 H ARG 51 11.145 -14.821 6.913 406 HA ARG 51 HA ARG 51 9.799 -16.854 8.312 407 HB2 ARG 51 HB2 ARG 51 9.998 -15.461 10.261 408 HB3 ARG 51 HB1 ARG 51 11.455 -15.230 9.313 409 HG2 ARG 51 HG2 ARG 51 9.113 -13.344 9.211 410 HG3 ARG 51 HG1 ARG 51 10.458 -13.156 10.336 411 HD2 ARG 51 HD2 ARG 51 10.650 -13.189 7.321 412 HD3 ARG 51 HD1 ARG 51 10.713 -11.755 8.342 413 HE ARG 51 HE ARG 51 12.692 -13.632 9.120 414 HH11 ARG 51 HH11 ARG 51 11.984 -11.273 6.611 415 HH12 ARG 51 HH12 ARG 51 13.647 -10.942 6.281 416 HH21 ARG 51 HH21 ARG 51 14.869 -13.201 8.692 417 HH22 ARG 51 HH22 ARG 51 15.312 -12.035 7.487 418 H ASN 52 H ASN 52 7.718 -16.769 9.353 419 HA ASN 52 HA ASN 52 5.786 -15.545 7.572 420 HB2 ASN 52 HB2 ASN 52 4.122 -16.965 8.630 421 HB3 ASN 52 HB1 ASN 52 5.532 -17.913 8.187 422 HD21 ASN 52 HD21 ASN 52 3.608 -16.673 10.797 423 HD22 ASN 52 HD22 ASN 52 4.376 -17.573 12.052 424 H ASP 53 H ASP 53 7.003 -14.924 10.757 425 HA ASP 53 HA ASP 53 4.684 -13.182 11.246 426 HB2 ASP 53 HB2 ASP 53 5.148 -15.053 12.904 427 HB3 ASP 53 HB1 ASP 53 6.593 -14.163 13.367 428 H TRP 54 H TRP 54 5.900 -11.724 9.736 429 HA TRP 54 HA TRP 54 7.130 -9.680 11.299 430 HB2 TRP 54 HB2 TRP 54 9.000 -11.310 10.826 431 HB3 TRP 54 HB1 TRP 54 8.809 -10.920 9.124 432 HD1 TRP 54 HD1 TRP 54 9.374 -8.858 12.383 433 HE1 TRP 54 HE1 TRP 54 11.121 -7.048 11.840 434 HE3 TRP 54 HE3 TRP 54 10.106 -9.946 7.485 435 HZ2 TRP 54 HZ2 TRP 54 12.626 -6.211 9.607 436 HZ3 TRP 54 HZ3 TRP 54 11.730 -8.601 6.198 437 HH2 TRP 54 HH2 TRP 54 12.954 -6.771 7.244 438 H THR 55 H THR 55 7.472 -7.693 10.019 439 HA THR 55 HA THR 55 5.294 -7.285 8.255 440 HB THR 55 HB THR 55 5.949 -5.491 9.712 441 HG1 THR 55 HG1 THR 55 5.531 -4.007 8.239 442 HG21 THR 55 HG21 THR 55 8.584 -5.478 8.231 443 HG22 THR 55 HG22 THR 55 8.333 -5.949 9.912 444 HG23 THR 55 HG23 THR 55 8.071 -4.278 9.416 445 H VAL 56 H VAL 56 5.184 -6.842 6.143 446 HA VAL 56 HA VAL 56 7.220 -7.936 4.436 447 HB VAL 56 HB VAL 56 4.826 -8.314 3.975 448 HG11 VAL 56 HG11 VAL 56 3.933 -6.189 4.751 449 HG12 VAL 56 HG12 VAL 56 3.412 -6.522 3.098 450 HG13 VAL 56 HG13 VAL 56 4.702 -5.357 3.400 451 HG21 VAL 56 HG21 VAL 56 6.241 -6.733 1.836 452 HG22 VAL 56 HG22 VAL 56 4.840 -7.770 1.573 453 HG23 VAL 56 HG23 VAL 56 6.363 -8.467 2.126 454 H GLN 57 H GLN 57 6.236 -4.779 5.498 455 HA GLN 57 HA GLN 57 7.173 -3.243 3.323 456 HB2 GLN 57 HB2 GLN 57 5.633 -2.527 5.252 457 HB3 GLN 57 HB1 GLN 57 7.101 -2.290 6.184 458 HG2 GLN 57 HG2 GLN 57 6.607 -0.912 3.554 459 HG3 GLN 57 HG1 GLN 57 6.088 -0.240 5.094 460 HE21 GLN 57 HE21 GLN 57 7.980 0.786 3.131 461 HE22 GLN 57 HE22 GLN 57 9.474 1.005 3.969 462 H ASN 58 H ASN 58 8.707 -4.265 6.332 463 HA ASN 58 HA ASN 58 11.160 -2.891 5.687 464 HB2 ASN 58 HB2 ASN 58 10.265 -3.256 8.052 465 HB3 ASN 58 HB1 ASN 58 10.750 -4.932 7.870 466 HD21 ASN 58 HD21 ASN 58 12.593 -2.278 6.508 467 HD22 ASN 58 HD22 ASN 58 13.949 -2.437 7.566 468 H CYS 59 H CYS 59 9.822 -5.621 4.490 469 HA CYS 59 HA CYS 59 12.332 -7.112 4.413 470 HB2 CYS 59 HB2 CYS 59 10.061 -8.167 5.013 471 HB3 CYS 59 HB1 CYS 59 9.716 -8.072 3.292 472 HG CYS 59 HG CYS 59 12.622 -9.437 3.457 473 H ASP 60 H ASP 60 10.468 -4.986 2.537 474 HA ASP 60 HA ASP 60 10.827 -3.987 0.517 475 HB2 ASP 60 HB2 ASP 60 13.395 -5.565 0.286 476 HB3 ASP 60 HB1 ASP 60 13.001 -4.042 -0.490 477 H LEU 61 H LEU 61 9.211 -6.336 0.470 478 HA LEU 61 HA LEU 61 10.009 -8.135 -1.575 479 HB2 LEU 61 HB2 LEU 61 7.372 -7.606 -0.266 480 HB3 LEU 61 HB1 LEU 61 7.432 -8.585 -1.714 481 HG LEU 61 HG LEU 61 9.054 -10.095 -0.560 482 HD11 LEU 61 HD11 LEU 61 8.318 -8.438 1.825 483 HD12 LEU 61 HD12 LEU 61 9.912 -8.594 1.091 484 HD13 LEU 61 HD13 LEU 61 9.163 -9.983 1.879 485 HD21 LEU 61 HD21 LEU 61 7.348 -11.153 0.897 486 HD22 LEU 61 HD22 LEU 61 6.757 -10.749 -0.711 487 HD23 LEU 61 HD23 LEU 61 6.323 -9.739 0.662 488 H ASP 62 H ASP 62 8.788 -4.964 -1.842 489 HA ASP 62 HA ASP 62 7.840 -5.445 -4.567 490 HB2 ASP 62 HB2 ASP 62 6.945 -3.206 -4.509 491 HB3 ASP 62 HB1 ASP 62 6.477 -4.034 -3.031 492 H GLN 63 H GLN 63 10.713 -4.922 -3.158 493 HA GLN 63 HA GLN 63 11.676 -3.028 -5.177 494 HB2 GLN 63 HB2 GLN 63 12.947 -4.011 -2.632 495 HB3 GLN 63 HB1 GLN 63 13.709 -2.901 -3.762 496 HG2 GLN 63 HG2 GLN 63 12.051 -1.235 -3.348 497 HG3 GLN 63 HG1 GLN 63 11.098 -2.358 -2.377 498 HE21 GLN 63 HE21 GLN 63 11.169 -1.012 -0.596 499 HE22 GLN 63 HE22 GLN 63 12.601 -0.837 0.358 500 H GLN 64 H GLN 64 12.644 -6.140 -3.716 501 HA GLN 64 HA GLN 64 14.617 -6.550 -5.774 502 HB2 GLN 64 HB2 GLN 64 13.680 -8.420 -3.594 503 HB3 GLN 64 HB1 GLN 64 15.054 -8.697 -4.651 504 HG2 GLN 64 HG2 GLN 64 14.788 -6.413 -2.704 505 HG3 GLN 64 HG1 GLN 64 15.720 -7.885 -2.437 506 HE21 GLN 64 HE21 GLN 64 16.564 -5.080 -2.539 507 HE22 GLN 64 HE22 GLN 64 17.791 -5.001 -3.750 508 H SEP 65 H SEP 65 13.308 -6.488 -7.609 509 HA SEP 65 HA SEP 65 12.111 -7.307 -9.323 510 HB2 SEP 65 HB1 SEP 65 12.253 -9.833 -9.656 511 HB3 SEP 65 HB2 SEP 65 13.215 -9.859 -8.181 512 H ILE 66 H ILE 66 11.225 -10.276 -7.850 513 HA ILE 66 HA ILE 66 8.616 -9.330 -7.116 514 HB ILE 66 HB ILE 66 8.525 -9.540 -9.592 515 HG12 ILE 66 HG12 ILE 66 6.879 -11.713 -8.304 516 HG13 ILE 66 HG11 ILE 66 6.532 -9.999 -8.111 517 HG21 ILE 66 HG21 ILE 66 8.629 -11.751 -10.624 518 HG22 ILE 66 HG22 ILE 66 9.088 -12.448 -9.073 519 HG23 ILE 66 HG23 ILE 66 10.162 -11.298 -9.876 520 HD11 ILE 66 HD11 ILE 66 6.207 -9.784 -10.512 521 HD12 ILE 66 HD12 ILE 66 5.144 -11.018 -9.832 522 HD13 ILE 66 HD13 ILE 66 6.593 -11.492 -10.721 523 H VAL 67 H VAL 67 7.372 -11.009 -6.048 524 HA VAL 67 HA VAL 67 9.040 -12.970 -4.719 525 HB VAL 67 HB VAL 67 6.071 -12.554 -4.403 526 HG11 VAL 67 HG11 VAL 67 6.432 -13.483 -2.160 527 HG12 VAL 67 HG12 VAL 67 8.136 -13.723 -2.546 528 HG13 VAL 67 HG13 VAL 67 6.899 -14.615 -3.430 529 HG21 VAL 67 HG21 VAL 67 7.284 -10.430 -4.086 530 HG22 VAL 67 HG22 VAL 67 8.260 -11.200 -2.833 531 HG23 VAL 67 HG23 VAL 67 6.520 -11.013 -2.612 532 H HIS 68 H HIS 68 9.033 -15.131 -5.091 533 HA HIS 68 HA HIS 68 7.350 -16.105 -7.279 534 HB2 HIS 68 HB2 HIS 68 9.929 -17.082 -6.075 535 HB3 HIS 68 HB1 HIS 68 8.940 -18.136 -7.077 536 HD2 HIS 68 HD2 HIS 68 9.715 -14.360 -7.914 537 HE1 HIS 68 HE1 HIS 68 11.372 -16.874 -10.890 538 HE2 HIS 68 HE2 HIS 68 11.164 -14.490 -10.065 539 H ILE 69 H ILE 69 5.481 -16.907 -6.601 540 HA ILE 69 HA ILE 69 5.450 -18.459 -4.116 541 HB ILE 69 HB ILE 69 3.134 -17.179 -5.596 542 HG12 ILE 69 HG12 ILE 69 4.555 -16.356 -3.054 543 HG13 ILE 69 HG11 ILE 69 4.571 -15.497 -4.588 544 HG21 ILE 69 HG21 ILE 69 1.825 -17.743 -3.601 545 HG22 ILE 69 HG22 ILE 69 3.224 -18.582 -2.927 546 HG23 ILE 69 HG23 ILE 69 2.461 -19.183 -4.398 547 HD11 ILE 69 HD11 ILE 69 2.156 -15.944 -2.853 548 HD12 ILE 69 HD12 ILE 69 2.183 -15.074 -4.384 549 HD13 ILE 69 HD13 ILE 69 3.071 -14.442 -2.995 550 H VAL 70 H VAL 70 4.993 -20.577 -4.180 551 HA VAL 70 HA VAL 70 3.929 -21.660 -6.691 552 HB VAL 70 HB VAL 70 5.333 -23.688 -6.378 553 HG11 VAL 70 HG11 VAL 70 6.031 -21.964 -7.941 554 HG12 VAL 70 HG12 VAL 70 7.436 -22.691 -7.162 555 HG13 VAL 70 HG13 VAL 70 6.866 -21.104 -6.646 556 HG21 VAL 70 HG21 VAL 70 5.772 -23.524 -3.995 557 HG22 VAL 70 HG22 VAL 70 6.697 -22.044 -4.245 558 HG23 VAL 70 HG23 VAL 70 7.292 -23.574 -4.889 559 H GLN 71 H GLN 71 2.356 -23.108 -6.525 560 HA GLN 71 HA GLN 71 1.535 -23.928 -3.823 561 HB2 GLN 71 HB2 GLN 71 -0.063 -22.414 -4.833 562 HB3 GLN 71 HB1 GLN 71 -0.103 -23.379 -6.299 563 HG2 GLN 71 HG2 GLN 71 -2.097 -23.749 -5.002 564 HG3 GLN 71 HG1 GLN 71 -1.129 -25.217 -5.047 565 HE21 GLN 71 HE21 GLN 71 -2.236 -22.582 -3.093 566 HE22 GLN 71 HE22 GLN 71 -1.867 -23.296 -1.560 567 H ARG 72 H ARG 72 1.427 -26.029 -3.423 568 HA ARG 72 HA ARG 72 1.166 -27.891 -5.659 569 HB2 ARG 72 HB2 ARG 72 3.553 -27.837 -5.096 570 HB3 ARG 72 HB1 ARG 72 3.176 -28.174 -3.412 571 HG2 ARG 72 HG2 ARG 72 2.313 -30.360 -4.014 572 HG3 ARG 72 HG1 ARG 72 2.600 -30.024 -5.721 573 HD2 ARG 72 HD2 ARG 72 4.731 -30.099 -3.592 574 HD3 ARG 72 HD1 ARG 72 4.356 -31.430 -4.684 575 HE ARG 72 HE ARG 72 4.845 -29.233 -6.282 576 HH11 ARG 72 HH11 ARG 72 6.629 -31.113 -3.915 577 HH12 ARG 72 HH12 ARG 72 8.165 -30.845 -4.665 578 HH21 ARG 72 HH21 ARG 72 6.894 -28.863 -7.276 579 HH22 ARG 72 HH22 ARG 72 8.314 -29.559 -6.579 580 HA PRO 73 HA PRO 73 -1.970 -28.687 -2.421 581 HB2 PRO 73 HB2 PRO 73 -3.444 -29.745 -4.742 582 HB3 PRO 73 HB1 PRO 73 -3.935 -28.515 -3.571 583 HG2 PRO 73 HG2 PRO 73 -3.314 -27.867 -6.095 584 HG3 PRO 73 HG1 PRO 73 -2.901 -26.805 -4.736 585 HD2 PRO 73 HD2 PRO 73 -1.158 -28.721 -6.242 586 HD3 PRO 73 HD1 PRO 73 -0.803 -27.066 -5.702 587 H TRP 74 H TRP 74 -2.452 -30.579 -1.431 588 HA TRP 74 HA TRP 74 -1.174 -32.954 -2.564 589 HB2 TRP 74 HB2 TRP 74 -0.483 -32.011 -0.293 590 HB3 TRP 74 HB1 TRP 74 -2.030 -32.612 0.297 591 HD1 TRP 74 HD1 TRP 74 -2.290 -35.213 0.609 592 HE1 TRP 74 HE1 TRP 74 -0.605 -37.157 0.610 593 HE3 TRP 74 HE3 TRP 74 1.712 -32.792 -1.427 594 HZ2 TRP 74 HZ2 TRP 74 2.078 -37.599 -0.163 595 HZ3 TRP 74 HZ3 TRP 74 3.801 -34.042 -1.767 596 HH2 TRP 74 HH2 TRP 74 3.980 -36.397 -1.149 597 H ARG 75 H ARG 75 -4.218 -31.737 -1.302 598 HA ARG 75 HA ARG 75 -5.391 -34.356 -1.960 599 HB2 ARG 75 HB2 ARG 75 -7.204 -33.845 -0.373 600 HB3 ARG 75 HB1 ARG 75 -5.627 -33.923 0.392 601 HG2 ARG 75 HG2 ARG 75 -5.525 -31.534 0.559 602 HG3 ARG 75 HG1 ARG 75 -7.012 -31.365 -0.379 603 HD2 ARG 75 HD2 ARG 75 -7.376 -31.107 2.049 604 HD3 ARG 75 HD1 ARG 75 -8.277 -32.457 1.363 605 HE ARG 75 HE ARG 75 -5.711 -33.173 2.474 606 HH11 ARG 75 HH11 ARG 75 -9.132 -32.764 3.136 607 HH12 ARG 75 HH12 ARG 75 -9.120 -33.820 4.508 608 HH21 ARG 75 HH21 ARG 75 -5.699 -34.569 4.301 609 HH22 ARG 75 HH22 ARG 75 -7.165 -34.833 5.178 610 H LYS 76 H LYS 76 -4.961 -31.842 -3.625 611 HA LYS 76 HA LYS 76 -7.529 -30.800 -4.182 612 HB2 LYS 76 HB2 LYS 76 -5.572 -29.552 -4.869 613 HB3 LYS 76 HB1 LYS 76 -5.041 -30.875 -5.895 614 HG2 LYS 76 HG2 LYS 76 -5.948 -29.470 -7.463 615 HG3 LYS 76 HG1 LYS 76 -7.345 -30.470 -7.090 616 HD2 LYS 76 HD2 LYS 76 -6.781 -27.770 -5.845 617 HD3 LYS 76 HD1 LYS 76 -7.847 -28.027 -7.220 618 HE2 LYS 76 HE2 LYS 76 -8.218 -29.128 -4.428 619 HE3 LYS 76 HE1 LYS 76 -9.122 -27.817 -5.163 620 HZ1 LYS 76 HZ1 LYS 76 -10.027 -29.350 -6.775 621 HZ2 LYS 76 HZ2 LYS 76 -10.347 -29.897 -5.212 622 HZ3 LYS 76 HZ3 LYS 76 -9.133 -30.633 -6.126 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 1.448 0.491 0.002 2 H2 MET 1 HT2 MET 1 1.786 1.289 -1.444 3 H3 MET 1 HT3 MET 1 2.617 1.710 -0.036 4 HA MET 1 HA MET 1 4.009 0.386 -1.465 5 HB2 MET 1 HB2 MET 1 4.256 0.179 0.980 6 HB3 MET 1 HB1 MET 1 3.069 -1.115 0.992 7 HG2 MET 1 HG2 MET 1 4.554 -2.507 -0.345 8 HG3 MET 1 HG1 MET 1 5.738 -1.200 -0.391 9 HE1 MET 1 HE1 MET 1 6.434 -4.167 0.559 10 HE2 MET 1 HE2 MET 1 7.432 -3.835 1.974 11 HE3 MET 1 HE3 MET 1 7.616 -2.858 0.517 12 H ILE 2 H ILE 2 4.045 -0.983 -3.100 13 HA ILE 2 HA ILE 2 1.950 -3.045 -3.260 14 HB ILE 2 HB ILE 2 2.967 -1.344 -5.550 15 HG12 ILE 2 HG12 ILE 2 0.233 -1.428 -4.252 16 HG13 ILE 2 HG11 ILE 2 1.419 -0.147 -4.042 17 HG21 ILE 2 HG21 ILE 2 0.903 -3.540 -5.505 18 HG22 ILE 2 HG22 ILE 2 2.495 -3.613 -6.262 19 HG23 ILE 2 HG23 ILE 2 1.270 -2.508 -6.886 20 HD11 ILE 2 HD11 ILE 2 0.082 -0.902 -6.629 21 HD12 ILE 2 HD12 ILE 2 1.257 0.396 -6.411 22 HD13 ILE 2 HD13 ILE 2 -0.315 0.485 -5.616 23 H VAL 3 H VAL 3 2.891 -4.964 -3.236 24 HA VAL 3 HA VAL 3 5.678 -5.148 -4.055 25 HB VAL 3 HB VAL 3 5.778 -7.262 -2.906 26 HG11 VAL 3 HG11 VAL 3 5.215 -6.556 -0.612 27 HG12 VAL 3 HG12 VAL 3 4.301 -5.201 -1.274 28 HG13 VAL 3 HG13 VAL 3 6.043 -5.296 -1.526 29 HG21 VAL 3 HG21 VAL 3 3.856 -8.225 -1.748 30 HG22 VAL 3 HG22 VAL 3 3.581 -8.143 -3.490 31 HG23 VAL 3 HG23 VAL 3 2.815 -6.968 -2.417 32 H PHE 4 H PHE 4 6.416 -6.598 -5.565 33 HA PHE 4 HA PHE 4 4.431 -7.387 -7.555 34 HB2 PHE 4 HB2 PHE 4 7.449 -7.190 -7.642 35 HB3 PHE 4 HB1 PHE 4 6.489 -7.841 -8.965 36 HD1 PHE 4 HD1 PHE 4 6.680 -4.794 -6.808 37 HD2 PHE 4 HD2 PHE 4 5.850 -6.425 -10.649 38 HE1 PHE 4 HE1 PHE 4 6.352 -2.527 -7.696 39 HE2 PHE 4 HE2 PHE 4 5.522 -4.160 -11.540 40 HZ PHE 4 HZ PHE 4 5.769 -2.211 -10.066 41 H VAL 5 H VAL 5 3.834 -9.459 -7.839 42 HA VAL 5 HA VAL 5 5.532 -11.537 -6.677 43 HB VAL 5 HB VAL 5 3.933 -10.943 -4.943 44 HG11 VAL 5 HG11 VAL 5 1.799 -11.579 -6.958 45 HG12 VAL 5 HG12 VAL 5 2.180 -9.992 -6.287 46 HG13 VAL 5 HG13 VAL 5 1.531 -11.259 -5.245 47 HG21 VAL 5 HG21 VAL 5 4.572 -13.274 -5.088 48 HG22 VAL 5 HG22 VAL 5 3.251 -13.579 -6.221 49 HG23 VAL 5 HG23 VAL 5 2.899 -13.110 -4.556 50 H ARG 6 H ARG 6 5.528 -13.465 -7.726 51 HA ARG 6 HA ARG 6 3.704 -13.783 -10.030 52 HB2 ARG 6 HB2 ARG 6 6.439 -15.027 -9.651 53 HB3 ARG 6 HB1 ARG 6 5.400 -15.226 -11.045 54 HG2 ARG 6 HG2 ARG 6 5.615 -12.654 -11.236 55 HG3 ARG 6 HG1 ARG 6 7.033 -12.893 -10.216 56 HD2 ARG 6 HD2 ARG 6 6.494 -14.095 -12.926 57 HD3 ARG 6 HD1 ARG 6 7.742 -12.931 -12.496 58 HE ARG 6 HE ARG 6 7.781 -15.601 -11.269 59 HH11 ARG 6 HH11 ARG 6 9.250 -13.234 -13.412 60 HH12 ARG 6 HH12 ARG 6 10.734 -14.108 -13.560 61 HH21 ARG 6 HH21 ARG 6 9.743 -16.771 -11.507 62 HH22 ARG 6 HH22 ARG 6 11.017 -16.117 -12.485 63 H PHE 7 H PHE 7 2.492 -15.599 -10.098 64 HA PHE 7 HA PHE 7 2.864 -17.494 -7.900 65 HB2 PHE 7 HB2 PHE 7 0.587 -16.436 -8.261 66 HB3 PHE 7 HB1 PHE 7 0.499 -17.316 -9.781 67 HD1 PHE 7 HD1 PHE 7 0.869 -17.787 -6.127 68 HD2 PHE 7 HD2 PHE 7 -0.283 -19.509 -9.840 69 HE1 PHE 7 HE1 PHE 7 -0.025 -19.742 -4.940 70 HE2 PHE 7 HE2 PHE 7 -1.175 -21.474 -8.657 71 HZ PHE 7 HZ PHE 7 -1.040 -21.592 -6.202 72 H ASN 8 H ASN 8 3.071 -19.697 -8.300 73 HA ASN 8 HA ASN 8 4.690 -20.450 -10.418 74 HB2 ASN 8 HB2 ASN 8 4.566 -21.678 -8.318 75 HB3 ASN 8 HB1 ASN 8 2.938 -22.216 -8.702 76 HD21 ASN 8 HD21 ASN 8 2.658 -23.925 -10.071 77 HD22 ASN 8 HD22 ASN 8 3.964 -24.864 -10.704 78 H SER 9 H SER 9 1.217 -20.341 -10.342 79 HA SER 9 HA SER 9 1.174 -21.581 -13.009 80 HB2 SER 9 HB2 SER 9 -0.073 -22.803 -11.158 81 HB3 SER 9 HB1 SER 9 -1.177 -21.430 -11.107 82 HG SER 9 HG SER 9 -2.183 -22.525 -12.604 83 H SER 10 H SER 10 1.682 -18.757 -12.275 84 HA SER 10 HA SER 10 -0.248 -17.555 -14.075 85 HB2 SER 10 HB2 SER 10 -1.195 -17.330 -11.715 86 HB3 SER 10 HB1 SER 10 0.213 -16.345 -11.335 87 HG SER 10 HG SER 10 -1.314 -14.915 -11.908 88 H HIS 11 H HIS 11 0.478 -14.941 -13.802 89 HA HIS 11 HA HIS 11 3.377 -14.993 -14.299 90 HB2 HIS 11 HB2 HIS 11 1.177 -13.319 -15.495 91 HB3 HIS 11 HB1 HIS 11 2.855 -12.802 -15.570 92 HD2 HIS 11 HD2 HIS 11 4.508 -14.326 -17.227 93 HE1 HIS 11 HE1 HIS 11 1.308 -16.424 -19.029 94 HE2 HIS 11 HE2 HIS 11 3.710 -15.661 -19.293 95 H GLY 12 H GLY 12 3.938 -12.311 -14.171 96 HA2 GLY 12 HA2 GLY 12 3.832 -11.905 -11.320 97 HA3 GLY 12 HA1 GLY 12 4.710 -10.925 -12.488 98 H PHE 13 H PHE 13 2.517 -10.660 -10.243 99 HA PHE 13 HA PHE 13 1.224 -8.437 -11.606 100 HB2 PHE 13 HB2 PHE 13 -0.942 -9.032 -10.399 101 HB3 PHE 13 HB1 PHE 13 -0.509 -10.048 -11.765 102 HD1 PHE 13 HD1 PHE 13 -0.682 -9.882 -8.084 103 HD2 PHE 13 HD2 PHE 13 -0.103 -12.370 -11.483 104 HE1 PHE 13 HE1 PHE 13 -0.933 -11.875 -6.664 105 HE2 PHE 13 HE2 PHE 13 -0.345 -14.368 -10.069 106 HZ PHE 13 HZ PHE 13 -0.765 -14.120 -7.655 107 HA PRO 14 HA PRO 14 2.307 -6.449 -7.832 108 HB2 PRO 14 HB2 PRO 14 0.965 -4.143 -8.123 109 HB3 PRO 14 HB1 PRO 14 2.344 -4.553 -9.148 110 HG2 PRO 14 HG2 PRO 14 -0.574 -4.674 -9.753 111 HG3 PRO 14 HG1 PRO 14 0.774 -4.212 -10.805 112 HD2 PRO 14 HD2 PRO 14 -0.469 -6.695 -10.789 113 HD3 PRO 14 HD1 PRO 14 1.142 -6.362 -11.448 114 H VAL 15 H VAL 15 1.616 -6.633 -5.806 115 HA VAL 15 HA VAL 15 -1.275 -6.591 -5.281 116 HB VAL 15 HB VAL 15 0.825 -8.394 -4.020 117 HG11 VAL 15 HG11 VAL 15 -0.642 -7.506 -2.262 118 HG12 VAL 15 HG12 VAL 15 -0.951 -9.219 -2.545 119 HG13 VAL 15 HG13 VAL 15 -2.059 -8.006 -3.185 120 HG21 VAL 15 HG21 VAL 15 -1.739 -8.985 -5.500 121 HG22 VAL 15 HG22 VAL 15 -0.654 -10.183 -4.791 122 HG23 VAL 15 HG23 VAL 15 -0.104 -9.178 -6.130 123 H GLU 16 H GLU 16 -1.847 -4.936 -4.062 124 HA GLU 16 HA GLU 16 0.123 -3.372 -2.671 125 HB2 GLU 16 HB2 GLU 16 -1.786 -2.327 -3.854 126 HB3 GLU 16 HB1 GLU 16 -2.881 -3.078 -2.704 127 HG2 GLU 16 HG2 GLU 16 -1.754 -1.831 -0.890 128 HG3 GLU 16 HG1 GLU 16 -0.780 -1.016 -2.110 129 H VAL 17 H VAL 17 0.555 -3.360 -0.564 130 HA VAL 17 HA VAL 17 -1.119 -5.002 1.211 131 HB VAL 17 HB VAL 17 0.940 -5.757 2.377 132 HG11 VAL 17 HG11 VAL 17 1.664 -7.383 0.677 133 HG12 VAL 17 HG12 VAL 17 0.806 -6.453 -0.554 134 HG13 VAL 17 HG13 VAL 17 -0.092 -7.226 0.752 135 HG21 VAL 17 HG21 VAL 17 3.119 -5.510 1.261 136 HG22 VAL 17 HG22 VAL 17 2.439 -3.951 1.723 137 HG23 VAL 17 HG23 VAL 17 2.369 -4.480 0.042 138 H ASP 18 H ASP 18 -0.175 -4.590 3.585 139 HA ASP 18 HA ASP 18 -0.037 -1.670 3.884 140 HB2 ASP 18 HB2 ASP 18 -1.199 -3.799 5.688 141 HB3 ASP 18 HB1 ASP 18 -0.857 -2.170 6.258 142 H SER 19 H SER 19 1.142 -0.998 5.911 143 HA SER 19 HA SER 19 3.759 -2.095 5.801 144 HB2 SER 19 HB2 SER 19 4.179 -0.416 7.673 145 HB3 SER 19 HB1 SER 19 3.617 0.239 6.136 146 HG SER 19 HG SER 19 2.449 1.165 7.793 147 H ASP 20 H ASP 20 1.093 -3.222 7.345 148 HA ASP 20 HA ASP 20 2.725 -4.453 9.463 149 HB2 ASP 20 HB2 ASP 20 -0.206 -3.715 9.553 150 HB3 ASP 20 HB1 ASP 20 0.606 -4.684 10.777 151 H THR 21 H THR 21 1.817 -5.166 6.596 152 HA THR 21 HA THR 21 0.257 -7.539 6.980 153 HB THR 21 HB THR 21 1.800 -6.591 4.550 154 HG1 THR 21 HG1 THR 21 -0.909 -6.259 5.362 155 HG21 THR 21 HG21 THR 21 1.298 -8.994 4.471 156 HG22 THR 21 HG22 THR 21 0.329 -8.109 3.294 157 HG23 THR 21 HG23 THR 21 -0.402 -8.652 4.804 158 H SER 22 H SER 22 1.102 -9.343 7.779 159 HA SER 22 HA SER 22 3.939 -9.804 7.760 160 HB2 SER 22 HB2 SER 22 1.721 -11.685 8.605 161 HB3 SER 22 HB1 SER 22 3.421 -11.769 9.063 162 HG SER 22 HG SER 22 3.176 -10.065 10.387 163 H ILE 23 H ILE 23 4.954 -11.624 6.710 164 HA ILE 23 HA ILE 23 4.128 -12.025 4.059 165 HB ILE 23 HB ILE 23 6.030 -13.738 5.682 166 HG12 ILE 23 HG12 ILE 23 6.680 -11.359 5.592 167 HG13 ILE 23 HG11 ILE 23 7.809 -12.384 4.716 168 HG21 ILE 23 HG21 ILE 23 6.980 -14.396 3.503 169 HG22 ILE 23 HG22 ILE 23 5.683 -13.521 2.694 170 HG23 ILE 23 HG23 ILE 23 5.309 -14.924 3.697 171 HD11 ILE 23 HD11 ILE 23 7.379 -10.333 3.510 172 HD12 ILE 23 HD12 ILE 23 5.650 -10.677 3.498 173 HD13 ILE 23 HD13 ILE 23 6.764 -11.718 2.609 174 H PHE 24 H PHE 24 3.430 -13.784 6.989 175 HA PHE 24 HA PHE 24 2.321 -16.137 5.918 176 HB2 PHE 24 HB2 PHE 24 2.820 -15.691 8.349 177 HB3 PHE 24 HB1 PHE 24 1.401 -14.657 8.391 178 HD1 PHE 24 HD1 PHE 24 2.537 -18.122 7.842 179 HD2 PHE 24 HD2 PHE 24 -0.746 -15.557 8.681 180 HE1 PHE 24 HE1 PHE 24 1.149 -20.075 8.350 181 HE2 PHE 24 HE2 PHE 24 -2.144 -17.512 9.192 182 HZ PHE 24 HZ PHE 24 -1.199 -19.778 9.026 183 H GLN 25 H GLN 25 0.909 -12.981 6.653 184 HA GLN 25 HA GLN 25 -1.724 -13.703 5.855 185 HB2 GLN 25 HB2 GLN 25 -0.508 -10.958 6.191 186 HB3 GLN 25 HB1 GLN 25 -2.224 -11.306 6.032 187 HG2 GLN 25 HG2 GLN 25 -0.410 -12.117 8.290 188 HG3 GLN 25 HG1 GLN 25 -1.705 -10.922 8.336 189 HE21 GLN 25 HE21 GLN 25 -3.525 -12.538 6.743 190 HE22 GLN 25 HE22 GLN 25 -4.068 -13.812 7.771 191 H LEU 26 H LEU 26 1.001 -12.101 4.310 192 HA LEU 26 HA LEU 26 -0.276 -11.346 1.937 193 HB2 LEU 26 HB2 LEU 26 1.939 -10.546 2.501 194 HB3 LEU 26 HB1 LEU 26 2.586 -12.174 2.435 195 HG LEU 26 HG LEU 26 2.204 -12.238 0.013 196 HD11 LEU 26 HD11 LEU 26 1.243 -9.403 0.367 197 HD12 LEU 26 HD12 LEU 26 0.272 -10.786 -0.142 198 HD13 LEU 26 HD13 LEU 26 1.566 -10.186 -1.180 199 HD21 LEU 26 HD21 LEU 26 4.349 -11.454 0.856 200 HD22 LEU 26 HD22 LEU 26 3.725 -9.807 0.943 201 HD23 LEU 26 HD23 LEU 26 3.910 -10.599 -0.623 202 H LYS 27 H LYS 27 1.239 -14.378 2.919 203 HA LYS 27 HA LYS 27 0.956 -15.815 0.537 204 HB2 LYS 27 HB2 LYS 27 2.234 -16.696 2.427 205 HB3 LYS 27 HB1 LYS 27 0.773 -16.767 3.406 206 HG2 LYS 27 HG2 LYS 27 -0.145 -18.384 1.703 207 HG3 LYS 27 HG1 LYS 27 1.479 -18.445 1.018 208 HD2 LYS 27 HD2 LYS 27 0.806 -19.095 3.886 209 HD3 LYS 27 HD1 LYS 27 0.972 -20.296 2.608 210 HE2 LYS 27 HE2 LYS 27 3.298 -19.400 2.236 211 HE3 LYS 27 HE1 LYS 27 3.087 -18.466 3.717 212 HZ1 LYS 27 HZ1 LYS 27 2.945 -21.427 3.487 213 HZ2 LYS 27 HZ2 LYS 27 2.704 -20.552 4.911 214 HZ3 LYS 27 HZ3 LYS 27 4.215 -20.544 4.162 215 H GLU 28 H GLU 28 -1.204 -15.551 3.340 216 HA GLU 28 HA GLU 28 -3.292 -17.115 2.409 217 HB2 GLU 28 HB2 GLU 28 -3.123 -14.857 4.346 218 HB3 GLU 28 HB1 GLU 28 -4.694 -15.506 3.911 219 HG2 GLU 28 HG2 GLU 28 -3.783 -17.767 4.586 220 HG3 GLU 28 HG1 GLU 28 -2.424 -16.888 5.290 221 H VAL 29 H VAL 29 -2.872 -13.593 2.123 222 HA VAL 29 HA VAL 29 -5.254 -12.966 0.864 223 HB VAL 29 HB VAL 29 -2.547 -11.685 0.375 224 HG11 VAL 29 HG11 VAL 29 -5.314 -10.617 -0.184 225 HG12 VAL 29 HG12 VAL 29 -4.124 -11.105 -1.391 226 HG13 VAL 29 HG13 VAL 29 -3.809 -9.714 -0.354 227 HG21 VAL 29 HG21 VAL 29 -3.204 -11.646 2.722 228 HG22 VAL 29 HG22 VAL 29 -4.763 -10.944 2.287 229 HG23 VAL 29 HG23 VAL 29 -3.278 -10.029 2.025 230 H VAL 30 H VAL 30 -2.170 -13.796 -0.733 231 HA VAL 30 HA VAL 30 -3.253 -13.707 -3.348 232 HB VAL 30 HB VAL 30 -0.804 -15.202 -2.370 233 HG11 VAL 30 HG11 VAL 30 -1.552 -16.015 -4.543 234 HG12 VAL 30 HG12 VAL 30 -0.055 -15.096 -4.705 235 HG13 VAL 30 HG13 VAL 30 -1.593 -14.363 -5.160 236 HG21 VAL 30 HG21 VAL 30 0.449 -13.244 -3.160 237 HG22 VAL 30 HG22 VAL 30 -0.678 -12.820 -1.871 238 HG23 VAL 30 HG23 VAL 30 -1.071 -12.435 -3.547 239 H ALA 31 H ALA 31 -2.718 -16.341 -1.053 240 HA ALA 31 HA ALA 31 -3.366 -18.494 -2.696 241 HB1 ALA 31 HB1 ALA 31 -2.324 -18.686 -0.478 242 HB2 ALA 31 HB2 ALA 31 -3.711 -19.757 -0.675 243 HB3 ALA 31 HB3 ALA 31 -3.869 -18.268 0.259 244 H LYS 32 H LYS 32 -5.479 -16.786 -0.402 245 HA LYS 32 HA LYS 32 -7.791 -18.263 -1.101 246 HB2 LYS 32 HB2 LYS 32 -9.016 -16.667 0.251 247 HB3 LYS 32 HB1 LYS 32 -7.511 -17.093 1.053 248 HG2 LYS 32 HG2 LYS 32 -6.525 -14.986 0.176 249 HG3 LYS 32 HG1 LYS 32 -8.124 -14.552 -0.430 250 HD2 LYS 32 HD2 LYS 32 -7.725 -13.492 1.699 251 HD3 LYS 32 HD1 LYS 32 -9.007 -14.693 1.851 252 HE2 LYS 32 HE2 LYS 32 -7.476 -16.273 2.866 253 HE3 LYS 32 HE1 LYS 32 -6.115 -15.196 2.568 254 HZ1 LYS 32 HZ1 LYS 32 -6.873 -15.138 4.882 255 HZ2 LYS 32 HZ2 LYS 32 -8.397 -14.603 4.382 256 HZ3 LYS 32 HZ3 LYS 32 -7.037 -13.629 4.141 257 H ARG 33 H ARG 33 -6.368 -15.315 -2.333 258 HA ARG 33 HA ARG 33 -8.603 -14.366 -3.737 259 HB2 ARG 33 HB2 ARG 33 -6.587 -13.007 -3.262 260 HB3 ARG 33 HB1 ARG 33 -5.676 -13.995 -4.400 261 HG2 ARG 33 HG2 ARG 33 -7.069 -13.223 -6.228 262 HG3 ARG 33 HG1 ARG 33 -8.047 -12.275 -5.106 263 HD2 ARG 33 HD2 ARG 33 -5.091 -11.891 -5.579 264 HD3 ARG 33 HD1 ARG 33 -6.364 -10.921 -6.318 265 HE ARG 33 HE ARG 33 -6.718 -10.857 -3.538 266 HH11 ARG 33 HH11 ARG 33 -4.417 -9.733 -5.931 267 HH12 ARG 33 HH12 ARG 33 -3.933 -8.350 -5.013 268 HH21 ARG 33 HH21 ARG 33 -6.063 -9.042 -2.307 269 HH22 ARG 33 HH22 ARG 33 -4.861 -7.968 -2.924 270 H GLN 34 H GLN 34 -5.871 -16.399 -4.696 271 HA GLN 34 HA GLN 34 -6.817 -16.760 -7.386 272 HB2 GLN 34 HB2 GLN 34 -4.605 -18.120 -5.844 273 HB3 GLN 34 HB1 GLN 34 -4.897 -18.314 -7.568 274 HG2 GLN 34 HG2 GLN 34 -4.439 -15.609 -6.376 275 HG3 GLN 34 HG1 GLN 34 -3.086 -16.649 -6.796 276 HE21 GLN 34 HE21 GLN 34 -5.738 -14.751 -8.002 277 HE22 GLN 34 HE22 GLN 34 -5.244 -14.744 -9.655 278 H GLY 35 H GLY 35 -7.026 -18.510 -4.369 279 HA2 GLY 35 HA2 GLY 35 -8.839 -20.015 -3.965 280 HA3 GLY 35 HA1 GLY 35 -8.862 -20.395 -5.679 281 H VAL 36 H VAL 36 -5.984 -20.263 -3.691 282 HA VAL 36 HA VAL 36 -5.701 -23.163 -4.077 283 HB VAL 36 HB VAL 36 -3.260 -22.848 -4.116 284 HG11 VAL 36 HG11 VAL 36 -3.086 -21.767 -6.309 285 HG12 VAL 36 HG12 VAL 36 -4.714 -21.120 -6.112 286 HG13 VAL 36 HG13 VAL 36 -4.465 -22.861 -6.225 287 HG21 VAL 36 HG21 VAL 36 -2.280 -20.615 -4.272 288 HG22 VAL 36 HG22 VAL 36 -3.132 -20.824 -2.740 289 HG23 VAL 36 HG23 VAL 36 -3.876 -19.896 -4.045 290 HA PRO 37 HA PRO 37 -5.227 -23.533 0.290 291 HB2 PRO 37 HB2 PRO 37 -3.195 -25.558 0.224 292 HB3 PRO 37 HB1 PRO 37 -4.936 -25.777 0.395 293 HG2 PRO 37 HG2 PRO 37 -3.451 -26.560 -1.806 294 HG3 PRO 37 HG1 PRO 37 -5.199 -26.286 -1.811 295 HD2 PRO 37 HD2 PRO 37 -2.993 -24.511 -2.746 296 HD3 PRO 37 HD1 PRO 37 -4.616 -24.750 -3.424 297 H ALA 38 H ALA 38 -4.294 -21.911 1.382 298 HA ALA 38 HA ALA 38 -1.618 -21.034 1.021 299 HB1 ALA 38 HB1 ALA 38 -3.409 -19.568 1.842 300 HB2 ALA 38 HB2 ALA 38 -2.032 -19.599 2.943 301 HB3 ALA 38 HB3 ALA 38 -3.491 -20.511 3.330 302 H ASP 39 H ASP 39 -3.083 -23.483 2.898 303 HA ASP 39 HA ASP 39 -1.273 -23.733 5.026 304 HB2 ASP 39 HB2 ASP 39 -2.848 -25.944 3.687 305 HB3 ASP 39 HB1 ASP 39 -2.187 -25.969 5.318 306 H GLN 40 H GLN 40 -1.226 -24.978 1.748 307 HA GLN 40 HA GLN 40 1.424 -26.146 2.271 308 HB2 GLN 40 HB2 GLN 40 -0.725 -26.955 0.320 309 HB3 GLN 40 HB1 GLN 40 0.927 -27.544 0.217 310 HG2 GLN 40 HG2 GLN 40 -0.952 -27.945 2.537 311 HG3 GLN 40 HG1 GLN 40 -0.531 -29.148 1.321 312 HE21 GLN 40 HE21 GLN 40 -0.186 -29.256 4.189 313 HE22 GLN 40 HE22 GLN 40 1.501 -29.488 4.480 314 H LEU 41 H LEU 41 0.630 -23.379 1.503 315 HA LEU 41 HA LEU 41 1.790 -23.171 -1.166 316 HB2 LEU 41 HB2 LEU 41 -0.312 -21.938 -0.511 317 HB3 LEU 41 HB1 LEU 41 0.673 -20.977 0.574 318 HG LEU 41 HG LEU 41 1.966 -20.155 -1.362 319 HD11 LEU 41 HD11 LEU 41 1.646 -22.051 -2.847 320 HD12 LEU 41 HD12 LEU 41 1.115 -20.560 -3.613 321 HD13 LEU 41 HD13 LEU 41 -0.075 -21.686 -2.965 322 HD21 LEU 41 HD21 LEU 41 0.232 -18.698 -2.243 323 HD22 LEU 41 HD22 LEU 41 0.038 -18.899 -0.501 324 HD23 LEU 41 HD23 LEU 41 -1.012 -19.775 -1.615 325 H ARG 42 H ARG 42 3.784 -22.254 -1.539 326 HA ARG 42 HA ARG 42 5.296 -21.495 0.871 327 HB2 ARG 42 HB2 ARG 42 6.030 -23.659 -0.027 328 HB3 ARG 42 HB1 ARG 42 6.324 -22.912 -1.591 329 HG2 ARG 42 HG2 ARG 42 8.413 -23.192 -0.434 330 HG3 ARG 42 HG1 ARG 42 8.036 -21.471 -0.543 331 HD2 ARG 42 HD2 ARG 42 8.855 -21.980 1.670 332 HD3 ARG 42 HD1 ARG 42 7.145 -21.548 1.750 333 HE ARG 42 HE ARG 42 7.763 -24.387 1.554 334 HH11 ARG 42 HH11 ARG 42 6.953 -21.729 3.697 335 HH12 ARG 42 HH12 ARG 42 6.389 -22.756 4.965 336 HH21 ARG 42 HH21 ARG 42 7.022 -25.741 3.215 337 HH22 ARG 42 HH22 ARG 42 6.421 -25.057 4.689 338 H VAL 43 H VAL 43 6.417 -19.624 0.836 339 HA VAL 43 HA VAL 43 6.362 -18.124 -1.665 340 HB VAL 43 HB VAL 43 6.642 -16.075 -0.341 341 HG11 VAL 43 HG11 VAL 43 4.459 -16.040 0.767 342 HG12 VAL 43 HG12 VAL 43 4.389 -17.800 0.678 343 HG13 VAL 43 HG13 VAL 43 4.378 -16.844 -0.802 344 HG21 VAL 43 HG21 VAL 43 6.517 -16.126 2.112 345 HG22 VAL 43 HG22 VAL 43 7.942 -16.981 1.517 346 HG23 VAL 43 HG23 VAL 43 6.536 -17.889 2.069 347 H ILE 44 H ILE 44 8.199 -17.526 -2.646 348 HA ILE 44 HA ILE 44 10.738 -17.985 -1.227 349 HB ILE 44 HB ILE 44 10.108 -18.723 -4.101 350 HG12 ILE 44 HG12 ILE 44 9.246 -20.343 -2.443 351 HG13 ILE 44 HG11 ILE 44 10.531 -21.029 -3.427 352 HG21 ILE 44 HG21 ILE 44 12.404 -19.572 -4.227 353 HG22 ILE 44 HG22 ILE 44 12.718 -18.950 -2.608 354 HG23 ILE 44 HG23 ILE 44 12.363 -17.835 -3.927 355 HD11 ILE 44 HD11 ILE 44 10.765 -21.701 -1.115 356 HD12 ILE 44 HD12 ILE 44 10.803 -20.015 -0.603 357 HD13 ILE 44 HD13 ILE 44 12.113 -20.668 -1.588 358 H PHE 45 H PHE 45 12.142 -16.355 -1.365 359 HA PHE 45 HA PHE 45 11.965 -14.484 -3.593 360 HB2 PHE 45 HB2 PHE 45 10.638 -13.474 -1.768 361 HB3 PHE 45 HB1 PHE 45 12.026 -13.611 -0.695 362 HD1 PHE 45 HD1 PHE 45 10.843 -12.009 -3.813 363 HD2 PHE 45 HD2 PHE 45 13.662 -11.936 -0.631 364 HE1 PHE 45 HE1 PHE 45 11.626 -9.805 -4.567 365 HE2 PHE 45 HE2 PHE 45 14.451 -9.732 -1.380 366 HZ PHE 45 HZ PHE 45 13.435 -8.665 -3.350 367 H ALA 46 H ALA 46 13.903 -14.051 -4.379 368 HA ALA 46 HA ALA 46 16.146 -13.978 -4.680 369 HB1 ALA 46 HB1 ALA 46 16.068 -12.395 -2.781 370 HB2 ALA 46 HB2 ALA 46 17.573 -13.311 -2.838 371 HB3 ALA 46 HB3 ALA 46 16.322 -13.743 -1.672 372 H GLY 47 H GLY 47 14.660 -16.535 -3.893 373 HA2 GLY 47 HA2 GLY 47 15.413 -18.735 -4.179 374 HA3 GLY 47 HA1 GLY 47 17.052 -18.195 -3.852 375 H LYS 48 H LYS 48 14.930 -16.980 -1.537 376 HA LYS 48 HA LYS 48 15.266 -19.315 0.182 377 HB2 LYS 48 HB2 LYS 48 15.943 -17.796 2.078 378 HB3 LYS 48 HB1 LYS 48 17.142 -18.013 0.816 379 HG2 LYS 48 HG2 LYS 48 17.240 -15.742 1.340 380 HG3 LYS 48 HG1 LYS 48 16.282 -15.800 -0.138 381 HD2 LYS 48 HD2 LYS 48 14.228 -15.636 1.201 382 HD3 LYS 48 HD1 LYS 48 15.202 -15.566 2.672 383 HE2 LYS 48 HE2 LYS 48 15.303 -13.577 0.407 384 HE3 LYS 48 HE1 LYS 48 14.457 -13.342 1.934 385 HZ1 LYS 48 HZ1 LYS 48 16.572 -13.513 3.086 386 HZ2 LYS 48 HZ2 LYS 48 16.607 -12.265 1.951 387 HZ3 LYS 48 HZ3 LYS 48 17.382 -13.728 1.618 388 H GLU 49 H GLU 49 14.071 -18.960 2.320 389 HA GLU 49 HA GLU 49 11.361 -18.177 1.610 390 HB2 GLU 49 HB2 GLU 49 12.476 -19.669 3.981 391 HB3 GLU 49 HB1 GLU 49 10.771 -19.321 3.741 392 HG2 GLU 49 HG2 GLU 49 10.717 -20.668 1.757 393 HG3 GLU 49 HG1 GLU 49 12.461 -20.908 1.826 394 H LEU 50 H LEU 50 10.083 -16.813 2.897 395 HA LEU 50 HA LEU 50 11.634 -14.782 4.334 396 HB2 LEU 50 HB2 LEU 50 8.838 -14.647 3.231 397 HB3 LEU 50 HB1 LEU 50 9.693 -13.326 3.999 398 HG LEU 50 HG LEU 50 10.372 -14.626 1.374 399 HD11 LEU 50 HD11 LEU 50 8.428 -13.192 1.257 400 HD12 LEU 50 HD12 LEU 50 9.796 -12.447 0.429 401 HD13 LEU 50 HD13 LEU 50 9.323 -11.886 2.032 402 HD21 LEU 50 HD21 LEU 50 12.416 -13.971 2.495 403 HD22 LEU 50 HD22 LEU 50 11.743 -12.382 2.855 404 HD23 LEU 50 HD23 LEU 50 12.079 -12.837 1.186 405 H ARG 51 H ARG 51 11.073 -14.108 6.372 406 HA ARG 51 HA ARG 51 9.854 -15.911 8.143 407 HB2 ARG 51 HB2 ARG 51 9.861 -13.976 9.768 408 HB3 ARG 51 HB1 ARG 51 11.420 -14.333 9.042 409 HG2 ARG 51 HG2 ARG 51 9.781 -12.287 7.674 410 HG3 ARG 51 HG1 ARG 51 10.407 -11.865 9.267 411 HD2 ARG 51 HD2 ARG 51 12.133 -12.938 7.041 412 HD3 ARG 51 HD1 ARG 51 11.870 -11.219 7.323 413 HE ARG 51 HE ARG 51 12.701 -12.386 9.721 414 HH11 ARG 51 HH11 ARG 51 14.023 -11.708 6.540 415 HH12 ARG 51 HH12 ARG 51 15.638 -11.496 7.111 416 HH21 ARG 51 HH21 ARG 51 14.828 -12.097 10.487 417 HH22 ARG 51 HH22 ARG 51 16.102 -11.719 9.379 418 H ASN 52 H ASN 52 7.780 -16.340 8.532 419 HA ASN 52 HA ASN 52 5.787 -14.948 6.998 420 HB2 ASN 52 HB2 ASN 52 4.289 -16.693 7.525 421 HB3 ASN 52 HB1 ASN 52 5.854 -17.457 7.335 422 HD21 ASN 52 HD21 ASN 52 6.853 -18.378 9.109 423 HD22 ASN 52 HD22 ASN 52 6.038 -18.635 10.610 424 H ASP 53 H ASP 53 6.726 -14.979 10.353 425 HA ASP 53 HA ASP 53 4.205 -13.830 11.226 426 HB2 ASP 53 HB2 ASP 53 5.044 -14.008 13.454 427 HB3 ASP 53 HB1 ASP 53 5.502 -15.481 12.605 428 H TRP 54 H TRP 54 6.985 -12.548 9.879 429 HA TRP 54 HA TRP 54 6.857 -10.150 11.529 430 HB2 TRP 54 HB2 TRP 54 9.005 -11.466 10.977 431 HB3 TRP 54 HB1 TRP 54 8.894 -10.665 9.415 432 HD1 TRP 54 HD1 TRP 54 8.284 -9.146 12.928 433 HE1 TRP 54 HE1 TRP 54 9.867 -7.139 13.190 434 HE3 TRP 54 HE3 TRP 54 10.792 -9.568 8.532 435 HZ2 TRP 54 HZ2 TRP 54 11.921 -5.905 11.713 436 HZ3 TRP 54 HZ3 TRP 54 12.566 -7.934 8.020 437 HH2 TRP 54 HH2 TRP 54 13.103 -6.141 9.586 438 H THR 55 H THR 55 7.393 -8.069 10.203 439 HA THR 55 HA THR 55 5.156 -7.732 8.429 440 HB THR 55 HB THR 55 5.501 -6.007 10.061 441 HG1 THR 55 HG1 THR 55 5.188 -4.357 8.690 442 HG21 THR 55 HG21 THR 55 7.519 -4.587 10.082 443 HG22 THR 55 HG22 THR 55 8.245 -5.601 8.836 444 HG23 THR 55 HG23 THR 55 7.914 -6.270 10.430 445 H VAL 56 H VAL 56 5.146 -7.267 6.318 446 HA VAL 56 HA VAL 56 7.432 -7.937 4.731 447 HB VAL 56 HB VAL 56 5.071 -8.451 4.061 448 HG11 VAL 56 HG11 VAL 56 3.679 -6.734 3.076 449 HG12 VAL 56 HG12 VAL 56 4.878 -5.505 3.487 450 HG13 VAL 56 HG13 VAL 56 4.026 -6.371 4.767 451 HG21 VAL 56 HG21 VAL 56 6.843 -8.491 2.392 452 HG22 VAL 56 HG22 VAL 56 6.629 -6.764 2.108 453 HG23 VAL 56 HG23 VAL 56 5.341 -7.894 1.684 454 H GLN 57 H GLN 57 6.276 -5.075 6.162 455 HA GLN 57 HA GLN 57 6.957 -3.126 4.267 456 HB2 GLN 57 HB2 GLN 57 5.604 -2.774 6.358 457 HB3 GLN 57 HB1 GLN 57 7.095 -2.841 7.277 458 HG2 GLN 57 HG2 GLN 57 6.713 -0.835 5.078 459 HG3 GLN 57 HG1 GLN 57 6.103 -0.544 6.703 460 HE21 GLN 57 HE21 GLN 57 8.138 0.873 5.176 461 HE22 GLN 57 HE22 GLN 57 9.571 0.840 6.136 462 H ASN 58 H ASN 58 8.877 -4.623 6.832 463 HA ASN 58 HA ASN 58 11.198 -3.045 6.142 464 HB2 ASN 58 HB2 ASN 58 10.580 -3.866 8.500 465 HB3 ASN 58 HB1 ASN 58 11.189 -5.431 7.978 466 HD21 ASN 58 HD21 ASN 58 13.407 -5.679 7.567 467 HD22 ASN 58 HD22 ASN 58 14.571 -4.538 8.142 468 H CYS 59 H CYS 59 9.818 -6.039 5.208 469 HA CYS 59 HA CYS 59 12.217 -7.297 4.315 470 HB2 CYS 59 HB2 CYS 59 9.334 -7.780 3.538 471 HB3 CYS 59 HB1 CYS 59 10.685 -8.813 3.086 472 HG CYS 59 HG CYS 59 11.235 -9.707 5.610 473 H ASP 60 H ASP 60 9.785 -5.217 2.936 474 HA ASP 60 HA ASP 60 9.652 -4.002 1.057 475 HB2 ASP 60 HB2 ASP 60 11.740 -2.999 1.794 476 HB3 ASP 60 HB1 ASP 60 12.660 -4.290 1.030 477 H LEU 61 H LEU 61 8.494 -5.436 -0.093 478 HA LEU 61 HA LEU 61 9.988 -6.882 -2.173 479 HB2 LEU 61 HB2 LEU 61 7.149 -7.346 -1.225 480 HB3 LEU 61 HB1 LEU 61 8.003 -8.313 -2.407 481 HG LEU 61 HG LEU 61 8.694 -8.107 0.528 482 HD11 LEU 61 HD11 LEU 61 6.622 -9.336 0.094 483 HD12 LEU 61 HD12 LEU 61 7.907 -10.368 0.715 484 HD13 LEU 61 HD13 LEU 61 7.505 -10.405 -0.999 485 HD21 LEU 61 HD21 LEU 61 9.898 -9.809 -1.649 486 HD22 LEU 61 HD22 LEU 61 10.261 -9.937 0.071 487 HD23 LEU 61 HD23 LEU 61 10.683 -8.470 -0.813 488 H ASP 62 H ASP 62 8.935 -4.091 -1.685 489 HA ASP 62 HA ASP 62 7.097 -3.661 -3.903 490 HB2 ASP 62 HB2 ASP 62 6.544 -2.536 -1.851 491 HB3 ASP 62 HB1 ASP 62 8.169 -1.885 -1.705 492 H GLN 63 H GLN 63 10.315 -2.662 -2.784 493 HA GLN 63 HA GLN 63 10.761 -1.383 -5.391 494 HB2 GLN 63 HB2 GLN 63 11.135 -0.014 -3.371 495 HB3 GLN 63 HB1 GLN 63 12.359 -1.153 -2.835 496 HG2 GLN 63 HG2 GLN 63 13.745 -0.605 -4.743 497 HG3 GLN 63 HG1 GLN 63 12.497 0.474 -5.363 498 HE21 GLN 63 HE21 GLN 63 14.930 0.007 -2.934 499 HE22 GLN 63 HE22 GLN 63 14.997 1.648 -2.399 500 H GLN 64 H GLN 64 11.568 -4.169 -3.639 501 HA GLN 64 HA GLN 64 14.117 -4.601 -4.938 502 HB2 GLN 64 HB2 GLN 64 12.501 -6.475 -3.204 503 HB3 GLN 64 HB1 GLN 64 14.174 -6.701 -3.698 504 HG2 GLN 64 HG2 GLN 64 13.128 -4.492 -1.948 505 HG3 GLN 64 HG1 GLN 64 14.029 -5.910 -1.414 506 HE21 GLN 64 HE21 GLN 64 14.568 -3.026 -1.236 507 HE22 GLN 64 HE22 GLN 64 16.145 -2.816 -1.928 508 H SEP 65 H SEP 65 13.897 -7.408 -5.318 509 HA SEP 65 HA SEP 65 12.931 -7.482 -7.982 510 HB2 SEP 65 HB1 SEP 65 13.695 -9.839 -6.250 511 HB3 SEP 65 HB2 SEP 65 14.882 -8.799 -7.032 512 H ILE 66 H ILE 66 11.660 -9.817 -8.374 513 HA ILE 66 HA ILE 66 9.066 -9.207 -7.205 514 HB ILE 66 HB ILE 66 9.418 -9.434 -9.721 515 HG12 ILE 66 HG12 ILE 66 7.334 -11.358 -8.750 516 HG13 ILE 66 HG11 ILE 66 7.211 -9.641 -8.387 517 HG21 ILE 66 HG21 ILE 66 9.517 -12.358 -9.019 518 HG22 ILE 66 HG22 ILE 66 10.813 -11.406 -9.745 519 HG23 ILE 66 HG23 ILE 66 9.325 -11.707 -10.646 520 HD11 ILE 66 HD11 ILE 66 7.221 -9.133 -10.769 521 HD12 ILE 66 HD12 ILE 66 5.910 -10.235 -10.352 522 HD13 ILE 66 HD13 ILE 66 7.363 -10.850 -11.140 523 H VAL 67 H VAL 67 7.793 -10.685 -6.130 524 HA VAL 67 HA VAL 67 9.254 -12.742 -4.697 525 HB VAL 67 HB VAL 67 6.318 -12.135 -4.405 526 HG11 VAL 67 HG11 VAL 67 8.404 -13.094 -2.452 527 HG12 VAL 67 HG12 VAL 67 7.143 -14.078 -3.199 528 HG13 VAL 67 HG13 VAL 67 6.710 -12.787 -2.074 529 HG21 VAL 67 HG21 VAL 67 8.559 -10.643 -3.055 530 HG22 VAL 67 HG22 VAL 67 6.826 -10.401 -2.810 531 HG23 VAL 67 HG23 VAL 67 7.560 -10.012 -4.363 532 H HIS 68 H HIS 68 8.912 -14.927 -4.840 533 HA HIS 68 HA HIS 68 7.175 -15.816 -7.044 534 HB2 HIS 68 HB2 HIS 68 9.582 -17.199 -5.831 535 HB3 HIS 68 HB1 HIS 68 8.618 -17.808 -7.168 536 HD2 HIS 68 HD2 HIS 68 8.758 -14.499 -8.418 537 HE1 HIS 68 HE1 HIS 68 12.661 -15.915 -9.214 538 HE2 HIS 68 HE2 HIS 68 11.047 -14.011 -9.550 539 H ILE 69 H ILE 69 5.417 -16.957 -6.502 540 HA ILE 69 HA ILE 69 5.440 -18.307 -3.888 541 HB ILE 69 HB ILE 69 3.091 -17.034 -5.307 542 HG12 ILE 69 HG12 ILE 69 4.533 -16.391 -2.728 543 HG13 ILE 69 HG11 ILE 69 4.460 -15.399 -4.176 544 HG21 ILE 69 HG21 ILE 69 3.146 -18.612 -2.739 545 HG22 ILE 69 HG22 ILE 69 2.417 -19.121 -4.262 546 HG23 ILE 69 HG23 ILE 69 1.754 -17.743 -3.386 547 HD11 ILE 69 HD11 ILE 69 2.063 -15.075 -3.828 548 HD12 ILE 69 HD12 ILE 69 3.004 -14.532 -2.439 549 HD13 ILE 69 HD13 ILE 69 2.142 -16.070 -2.374 550 H VAL 70 H VAL 70 5.395 -20.420 -3.995 551 HA VAL 70 HA VAL 70 4.259 -21.684 -6.397 552 HB VAL 70 HB VAL 70 5.863 -23.531 -6.100 553 HG11 VAL 70 HG11 VAL 70 7.117 -20.798 -6.297 554 HG12 VAL 70 HG12 VAL 70 6.475 -21.766 -7.623 555 HG13 VAL 70 HG13 VAL 70 7.911 -22.303 -6.754 556 HG21 VAL 70 HG21 VAL 70 7.760 -23.288 -4.549 557 HG22 VAL 70 HG22 VAL 70 6.218 -23.374 -3.696 558 HG23 VAL 70 HG23 VAL 70 7.027 -21.821 -3.899 559 H GLN 71 H GLN 71 3.053 -23.562 -6.145 560 HA GLN 71 HA GLN 71 2.012 -23.953 -3.432 561 HB2 GLN 71 HB2 GLN 71 0.419 -23.329 -5.244 562 HB3 GLN 71 HB1 GLN 71 0.827 -24.826 -6.067 563 HG2 GLN 71 HG2 GLN 71 0.056 -26.023 -3.966 564 HG3 GLN 71 HG1 GLN 71 -0.611 -24.473 -3.458 565 HE21 GLN 71 HE21 GLN 71 -1.232 -23.749 -6.241 566 HE22 GLN 71 HE22 GLN 71 -2.643 -24.651 -6.655 567 H ARG 72 H ARG 72 2.424 -25.766 -2.367 568 HA ARG 72 HA ARG 72 3.193 -28.167 -3.887 569 HB2 ARG 72 HB2 ARG 72 5.160 -27.124 -2.749 570 HB3 ARG 72 HB1 ARG 72 4.323 -27.301 -1.214 571 HG2 ARG 72 HG2 ARG 72 4.200 -29.820 -1.956 572 HG3 ARG 72 HG1 ARG 72 5.597 -29.358 -2.931 573 HD2 ARG 72 HD2 ARG 72 6.346 -30.211 -0.803 574 HD3 ARG 72 HD1 ARG 72 6.676 -28.479 -0.891 575 HE ARG 72 HE ARG 72 4.156 -28.942 0.314 576 HH11 ARG 72 HH11 ARG 72 7.593 -29.146 0.975 577 HH12 ARG 72 HH12 ARG 72 7.417 -28.936 2.683 578 HH21 ARG 72 HH21 ARG 72 3.898 -28.656 2.574 579 HH22 ARG 72 HH22 ARG 72 5.296 -28.646 3.602 580 HA PRO 73 HA PRO 73 -0.493 -28.779 -1.191 581 HB2 PRO 73 HB2 PRO 73 -1.960 -30.227 -2.915 582 HB3 PRO 73 HB1 PRO 73 -1.855 -28.465 -3.013 583 HG2 PRO 73 HG2 PRO 73 -0.429 -30.541 -4.621 584 HG3 PRO 73 HG1 PRO 73 -1.153 -29.013 -5.153 585 HD2 PRO 73 HD2 PRO 73 1.526 -29.357 -4.691 586 HD3 PRO 73 HD1 PRO 73 0.698 -27.796 -4.566 587 H TRP 74 H TRP 74 -1.297 -30.540 -0.085 588 HA TRP 74 HA TRP 74 0.131 -33.084 -0.469 589 HB2 TRP 74 HB2 TRP 74 0.963 -31.962 1.541 590 HB3 TRP 74 HB1 TRP 74 -0.681 -31.739 2.127 591 HD1 TRP 74 HD1 TRP 74 1.862 -34.574 1.467 592 HE1 TRP 74 HE1 TRP 74 1.301 -36.536 3.040 593 HE3 TRP 74 HE3 TRP 74 -2.432 -32.745 3.559 594 HZ2 TRP 74 HZ2 TRP 74 -0.689 -37.217 4.915 595 HZ3 TRP 74 HZ3 TRP 74 -3.603 -34.115 5.236 596 HH2 TRP 74 HH2 TRP 74 -2.747 -36.303 5.898 597 H ARG 75 H ARG 75 -1.118 -34.892 -0.512 598 HA ARG 75 HA ARG 75 -2.941 -36.244 -0.583 599 HB2 ARG 75 HB2 ARG 75 -3.190 -35.480 1.808 600 HB3 ARG 75 HB1 ARG 75 -4.271 -34.221 1.246 601 HG2 ARG 75 HG2 ARG 75 -5.494 -36.110 2.185 602 HG3 ARG 75 HG1 ARG 75 -5.853 -35.902 0.471 603 HD2 ARG 75 HD2 ARG 75 -4.408 -37.720 -0.115 604 HD3 ARG 75 HD1 ARG 75 -3.820 -37.850 1.540 605 HE ARG 75 HE ARG 75 -6.265 -38.392 2.056 606 HH11 ARG 75 HH11 ARG 75 -4.639 -39.286 -0.926 607 HH12 ARG 75 HH12 ARG 75 -5.622 -40.678 -1.201 608 HH21 ARG 75 HH21 ARG 75 -7.570 -40.261 1.699 609 HH22 ARG 75 HH22 ARG 75 -7.298 -41.230 0.292 610 H LYS 76 H LYS 76 -2.591 -33.724 -2.256 611 HA LYS 76 HA LYS 76 -5.307 -33.141 -3.092 612 HB2 LYS 76 HB2 LYS 76 -3.695 -31.305 -2.981 613 HB3 LYS 76 HB1 LYS 76 -2.642 -32.136 -4.113 614 HG2 LYS 76 HG2 LYS 76 -3.790 -30.416 -5.300 615 HG3 LYS 76 HG1 LYS 76 -4.452 -31.964 -5.822 616 HD2 LYS 76 HD2 LYS 76 -6.270 -30.420 -5.506 617 HD3 LYS 76 HD1 LYS 76 -6.337 -31.626 -4.221 618 HE2 LYS 76 HE2 LYS 76 -5.286 -30.065 -2.678 619 HE3 LYS 76 HE1 LYS 76 -5.128 -28.871 -3.963 620 HZ1 LYS 76 HZ1 LYS 76 -7.024 -28.389 -2.571 621 HZ2 LYS 76 HZ2 LYS 76 -7.675 -29.921 -2.852 622 HZ3 LYS 76 HZ3 LYS 76 -7.555 -28.812 -4.119 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 1.154 -1.144 0.920 2 H2 MET 1 HT2 MET 1 0.023 -0.157 0.154 3 H3 MET 1 HT3 MET 1 1.298 0.534 1.017 4 HA MET 1 HA MET 1 1.655 0.663 -1.367 5 HB2 MET 1 HB2 MET 1 3.924 -0.096 -1.359 6 HB3 MET 1 HB1 MET 1 3.559 0.424 0.278 7 HG2 MET 1 HG2 MET 1 3.194 -1.942 0.906 8 HG3 MET 1 HG1 MET 1 3.680 -2.412 -0.722 9 HE1 MET 1 HE1 MET 1 6.892 -3.581 0.936 10 HE2 MET 1 HE2 MET 1 5.490 -3.960 -0.062 11 HE3 MET 1 HE3 MET 1 5.302 -3.758 1.681 12 H ILE 2 H ILE 2 2.417 -0.629 -3.275 13 HA ILE 2 HA ILE 2 0.949 -3.180 -3.401 14 HB ILE 2 HB ILE 2 1.486 -1.228 -5.652 15 HG12 ILE 2 HG12 ILE 2 -1.115 -1.907 -4.259 16 HG13 ILE 2 HG11 ILE 2 -0.201 -0.422 -4.025 17 HG21 ILE 2 HG21 ILE 2 -0.100 -3.798 -5.621 18 HG22 ILE 2 HG22 ILE 2 1.442 -3.534 -6.435 19 HG23 ILE 2 HG23 ILE 2 -0.000 -2.676 -6.977 20 HD11 ILE 2 HD11 ILE 2 -0.561 0.167 -6.364 21 HD12 ILE 2 HD12 ILE 2 -2.088 -0.082 -5.518 22 HD13 ILE 2 HD13 ILE 2 -1.466 -1.327 -6.602 23 H VAL 3 H VAL 3 2.195 -4.910 -3.670 24 HA VAL 3 HA VAL 3 4.800 -4.523 -4.974 25 HB VAL 3 HB VAL 3 5.638 -6.491 -3.754 26 HG11 VAL 3 HG11 VAL 3 5.821 -5.470 -1.548 27 HG12 VAL 3 HG12 VAL 3 4.505 -4.368 -1.952 28 HG13 VAL 3 HG13 VAL 3 6.030 -4.283 -2.836 29 HG21 VAL 3 HG21 VAL 3 4.390 -7.432 -1.879 30 HG22 VAL 3 HG22 VAL 3 3.523 -7.667 -3.400 31 HG23 VAL 3 HG23 VAL 3 3.007 -6.409 -2.273 32 H PHE 4 H PHE 4 5.568 -6.287 -6.270 33 HA PHE 4 HA PHE 4 3.344 -7.541 -7.676 34 HB2 PHE 4 HB2 PHE 4 6.263 -7.324 -8.448 35 HB3 PHE 4 HB1 PHE 4 4.984 -7.981 -9.457 36 HD1 PHE 4 HD1 PHE 4 6.903 -5.154 -8.830 37 HD2 PHE 4 HD2 PHE 4 2.912 -6.313 -9.751 38 HE1 PHE 4 HE1 PHE 4 6.455 -2.902 -9.710 39 HE2 PHE 4 HE2 PHE 4 2.461 -4.066 -10.638 40 HZ PHE 4 HZ PHE 4 4.231 -2.356 -10.618 41 H VAL 5 H VAL 5 3.087 -9.723 -7.840 42 HA VAL 5 HA VAL 5 5.103 -11.407 -6.564 43 HB VAL 5 HB VAL 5 3.357 -10.859 -4.881 44 HG11 VAL 5 HG11 VAL 5 1.130 -11.823 -5.093 45 HG12 VAL 5 HG12 VAL 5 1.509 -12.315 -6.742 46 HG13 VAL 5 HG13 VAL 5 1.454 -10.604 -6.324 47 HG21 VAL 5 HG21 VAL 5 4.598 -12.948 -4.728 48 HG22 VAL 5 HG22 VAL 5 3.385 -13.746 -5.731 49 HG23 VAL 5 HG23 VAL 5 2.947 -13.126 -4.136 50 H ARG 6 H ARG 6 5.423 -13.312 -7.525 51 HA ARG 6 HA ARG 6 3.759 -13.960 -9.854 52 HB2 ARG 6 HB2 ARG 6 6.611 -14.649 -9.172 53 HB3 ARG 6 HB1 ARG 6 5.734 -15.390 -10.497 54 HG2 ARG 6 HG2 ARG 6 5.396 -13.151 -11.469 55 HG3 ARG 6 HG1 ARG 6 6.398 -12.490 -10.176 56 HD2 ARG 6 HD2 ARG 6 7.653 -12.848 -12.257 57 HD3 ARG 6 HD1 ARG 6 8.283 -13.806 -10.917 58 HE ARG 6 HE ARG 6 6.650 -15.564 -12.058 59 HH11 ARG 6 HH11 ARG 6 8.965 -13.381 -13.535 60 HH12 ARG 6 HH12 ARG 6 9.329 -14.448 -14.845 61 HH21 ARG 6 HH21 ARG 6 7.112 -16.977 -13.802 62 HH22 ARG 6 HH22 ARG 6 8.267 -16.506 -14.996 63 H PHE 7 H PHE 7 2.455 -15.596 -9.689 64 HA PHE 7 HA PHE 7 2.840 -17.515 -7.526 65 HB2 PHE 7 HB2 PHE 7 0.631 -16.364 -7.821 66 HB3 PHE 7 HB1 PHE 7 0.460 -17.172 -9.375 67 HD1 PHE 7 HD1 PHE 7 0.611 -17.661 -5.734 68 HD2 PHE 7 HD2 PHE 7 -0.251 -19.442 -9.498 69 HE1 PHE 7 HE1 PHE 7 -0.423 -19.571 -4.591 70 HE2 PHE 7 HE2 PHE 7 -1.283 -21.360 -8.359 71 HZ PHE 7 HZ PHE 7 -1.363 -21.432 -5.901 72 H ASN 8 H ASN 8 2.850 -19.761 -7.928 73 HA ASN 8 HA ASN 8 4.329 -20.651 -10.116 74 HB2 ASN 8 HB2 ASN 8 4.248 -21.959 -8.092 75 HB3 ASN 8 HB1 ASN 8 2.513 -22.203 -8.263 76 HD21 ASN 8 HD21 ASN 8 5.668 -23.105 -9.410 77 HD22 ASN 8 HD22 ASN 8 5.159 -24.507 -10.286 78 H SER 9 H SER 9 3.879 -21.276 -12.125 79 HA SER 9 HA SER 9 2.771 -21.764 -14.031 80 HB2 SER 9 HB2 SER 9 0.441 -22.445 -12.211 81 HB3 SER 9 HB1 SER 9 0.562 -22.860 -13.922 82 HG SER 9 HG SER 9 2.135 -23.819 -11.757 83 H SER 10 H SER 10 2.657 -19.137 -12.620 84 HA SER 10 HA SER 10 0.779 -17.874 -14.437 85 HB2 SER 10 HB2 SER 10 0.797 -17.329 -11.454 86 HB3 SER 10 HB1 SER 10 -0.155 -16.456 -12.654 87 HG SER 10 HG SER 10 -0.616 -19.059 -12.952 88 H HIS 11 H HIS 11 1.113 -15.331 -14.032 89 HA HIS 11 HA HIS 11 4.020 -14.972 -14.042 90 HB2 HIS 11 HB2 HIS 11 2.516 -14.326 -16.060 91 HB3 HIS 11 HB1 HIS 11 2.026 -12.956 -15.070 92 HD2 HIS 11 HD2 HIS 11 5.374 -14.385 -16.590 93 HE1 HIS 11 HE1 HIS 11 5.709 -10.205 -16.023 94 HE2 HIS 11 HE2 HIS 11 6.919 -12.305 -16.752 95 H GLY 12 H GLY 12 3.798 -12.080 -13.716 96 HA2 GLY 12 HA2 GLY 12 3.470 -12.092 -10.802 97 HA3 GLY 12 HA1 GLY 12 4.442 -10.955 -11.724 98 H PHE 13 H PHE 13 1.707 -11.282 -9.994 99 HA PHE 13 HA PHE 13 0.416 -9.081 -11.434 100 HB2 PHE 13 HB2 PHE 13 -1.694 -9.816 -10.197 101 HB3 PHE 13 HB1 PHE 13 -1.133 -10.859 -11.493 102 HD1 PHE 13 HD1 PHE 13 -1.530 -10.509 -7.867 103 HD2 PHE 13 HD2 PHE 13 -0.322 -13.069 -11.041 104 HE1 PHE 13 HE1 PHE 13 -1.590 -12.435 -6.334 105 HE2 PHE 13 HE2 PHE 13 -0.371 -14.996 -9.516 106 HZ PHE 13 HZ PHE 13 -1.008 -14.683 -7.161 107 HA PRO 14 HA PRO 14 1.218 -6.549 -7.957 108 HB2 PRO 14 HB2 PRO 14 -0.667 -4.646 -8.253 109 HB3 PRO 14 HB1 PRO 14 0.696 -4.806 -9.367 110 HG2 PRO 14 HG2 PRO 14 -2.132 -5.730 -9.689 111 HG3 PRO 14 HG1 PRO 14 -1.066 -4.957 -10.876 112 HD2 PRO 14 HD2 PRO 14 -1.529 -7.648 -10.784 113 HD3 PRO 14 HD1 PRO 14 -0.034 -6.933 -11.413 114 H VAL 15 H VAL 15 0.817 -6.854 -5.881 115 HA VAL 15 HA VAL 15 -1.963 -7.272 -5.013 116 HB VAL 15 HB VAL 15 0.566 -8.550 -3.905 117 HG11 VAL 15 HG11 VAL 15 -0.852 -9.575 -2.197 118 HG12 VAL 15 HG12 VAL 15 -2.243 -8.667 -2.790 119 HG13 VAL 15 HG13 VAL 15 -0.883 -7.818 -2.056 120 HG21 VAL 15 HG21 VAL 15 -1.965 -9.750 -5.003 121 HG22 VAL 15 HG22 VAL 15 -0.550 -10.630 -4.430 122 HG23 VAL 15 HG23 VAL 15 -0.437 -9.620 -5.873 123 H GLU 16 H GLU 16 -2.692 -5.650 -3.849 124 HA GLU 16 HA GLU 16 -0.877 -3.730 -2.709 125 HB2 GLU 16 HB2 GLU 16 -3.010 -3.059 -3.808 126 HB3 GLU 16 HB1 GLU 16 -3.889 -3.855 -2.510 127 HG2 GLU 16 HG2 GLU 16 -2.844 -2.336 -0.895 128 HG3 GLU 16 HG1 GLU 16 -2.020 -1.518 -2.218 129 H VAL 17 H VAL 17 -0.183 -3.698 -0.702 130 HA VAL 17 HA VAL 17 -1.547 -5.367 1.300 131 HB VAL 17 HB VAL 17 0.680 -5.926 2.252 132 HG11 VAL 17 HG11 VAL 17 -0.422 -7.529 0.807 133 HG12 VAL 17 HG12 VAL 17 1.322 -7.565 0.541 134 HG13 VAL 17 HG13 VAL 17 0.271 -6.752 -0.616 135 HG21 VAL 17 HG21 VAL 17 1.718 -4.620 -0.266 136 HG22 VAL 17 HG22 VAL 17 2.685 -5.595 0.839 137 HG23 VAL 17 HG23 VAL 17 1.982 -4.075 1.391 138 H ASP 18 H ASP 18 -0.453 -4.824 3.533 139 HA ASP 18 HA ASP 18 -0.492 -1.899 3.811 140 HB2 ASP 18 HB2 ASP 18 -1.090 -4.092 5.815 141 HB3 ASP 18 HB1 ASP 18 -1.013 -2.381 6.214 142 H SER 19 H SER 19 0.799 -1.263 5.869 143 HA SER 19 HA SER 19 3.515 -1.879 5.413 144 HB2 SER 19 HB2 SER 19 3.812 -0.600 7.598 145 HB3 SER 19 HB1 SER 19 2.980 0.265 6.302 146 HG SER 19 HG SER 19 1.915 -0.886 8.658 147 H ASP 20 H ASP 20 1.090 -3.110 7.567 148 HA ASP 20 HA ASP 20 3.080 -4.615 9.072 149 HB2 ASP 20 HB2 ASP 20 0.186 -3.985 9.635 150 HB3 ASP 20 HB1 ASP 20 1.142 -5.083 10.620 151 H THR 21 H THR 21 1.633 -5.220 6.321 152 HA THR 21 HA THR 21 0.310 -7.683 6.789 153 HB THR 21 HB THR 21 1.679 -6.692 4.270 154 HG1 THR 21 HG1 THR 21 -1.105 -6.739 4.627 155 HG21 THR 21 HG21 THR 21 -0.353 -8.902 4.655 156 HG22 THR 21 HG22 THR 21 1.338 -9.115 4.201 157 HG23 THR 21 HG23 THR 21 0.226 -8.308 3.099 158 H SER 22 H SER 22 1.440 -9.153 7.947 159 HA SER 22 HA SER 22 4.202 -9.631 7.751 160 HB2 SER 22 HB2 SER 22 2.204 -11.736 8.545 161 HB3 SER 22 HB1 SER 22 3.820 -11.449 9.191 162 HG SER 22 HG SER 22 3.019 -9.507 10.122 163 H ILE 23 H ILE 23 5.343 -11.325 6.696 164 HA ILE 23 HA ILE 23 4.575 -11.919 4.077 165 HB ILE 23 HB ILE 23 6.504 -13.461 5.834 166 HG12 ILE 23 HG12 ILE 23 7.108 -11.092 5.609 167 HG13 ILE 23 HG11 ILE 23 8.262 -12.113 4.762 168 HG21 ILE 23 HG21 ILE 23 5.793 -14.768 3.881 169 HG22 ILE 23 HG22 ILE 23 7.492 -14.314 3.789 170 HG23 ILE 23 HG23 ILE 23 6.299 -13.448 2.824 171 HD11 ILE 23 HD11 ILE 23 7.127 -11.581 2.644 172 HD12 ILE 23 HD12 ILE 23 7.762 -10.151 3.460 173 HD13 ILE 23 HD13 ILE 23 6.036 -10.507 3.521 174 H PHE 24 H PHE 24 4.019 -13.660 7.066 175 HA PHE 24 HA PHE 24 2.967 -16.075 6.107 176 HB2 PHE 24 HB2 PHE 24 3.502 -15.521 8.496 177 HB3 PHE 24 HB1 PHE 24 2.067 -14.509 8.540 178 HD1 PHE 24 HD1 PHE 24 3.229 -17.977 8.048 179 HD2 PHE 24 HD2 PHE 24 -0.027 -15.428 9.028 180 HE1 PHE 24 HE1 PHE 24 1.910 -19.932 8.712 181 HE2 PHE 24 HE2 PHE 24 -1.360 -17.382 9.696 182 HZ PHE 24 HZ PHE 24 -0.393 -19.642 9.542 183 H GLN 25 H GLN 25 1.357 -13.017 6.885 184 HA GLN 25 HA GLN 25 -1.245 -13.815 6.082 185 HB2 GLN 25 HB2 GLN 25 0.002 -11.094 6.491 186 HB3 GLN 25 HB1 GLN 25 -1.696 -11.335 6.111 187 HG2 GLN 25 HG2 GLN 25 -1.997 -12.585 8.175 188 HG3 GLN 25 HG1 GLN 25 -0.285 -12.403 8.547 189 HE21 GLN 25 HE21 GLN 25 0.468 -10.451 9.340 190 HE22 GLN 25 HE22 GLN 25 -0.591 -9.163 9.796 191 H LEU 26 H LEU 26 1.393 -12.100 4.465 192 HA LEU 26 HA LEU 26 0.109 -11.322 2.123 193 HB2 LEU 26 HB2 LEU 26 2.342 -10.582 2.611 194 HB3 LEU 26 HB1 LEU 26 2.945 -12.227 2.592 195 HG LEU 26 HG LEU 26 2.532 -12.351 0.169 196 HD11 LEU 26 HD11 LEU 26 0.675 -10.799 -0.002 197 HD12 LEU 26 HD12 LEU 26 1.988 -10.309 -1.074 198 HD13 LEU 26 HD13 LEU 26 1.730 -9.463 0.451 199 HD21 LEU 26 HD21 LEU 26 4.171 -9.988 1.052 200 HD22 LEU 26 HD22 LEU 26 4.310 -10.806 -0.507 201 HD23 LEU 26 HD23 LEU 26 4.712 -11.664 0.982 202 H LYS 27 H LYS 27 1.674 -14.373 2.921 203 HA LYS 27 HA LYS 27 1.393 -15.781 0.557 204 HB2 LYS 27 HB2 LYS 27 2.586 -16.673 2.479 205 HB3 LYS 27 HB1 LYS 27 1.102 -16.715 3.413 206 HG2 LYS 27 HG2 LYS 27 0.225 -18.353 1.703 207 HG3 LYS 27 HG1 LYS 27 1.873 -18.445 1.086 208 HD2 LYS 27 HD2 LYS 27 1.705 -20.259 2.565 209 HD3 LYS 27 HD1 LYS 27 2.538 -19.017 3.498 210 HE2 LYS 27 HE2 LYS 27 -0.449 -19.254 3.651 211 HE3 LYS 27 HE1 LYS 27 0.561 -20.363 4.569 212 HZ1 LYS 27 HZ1 LYS 27 -0.157 -18.370 5.833 213 HZ2 LYS 27 HZ2 LYS 27 0.732 -17.397 4.786 214 HZ3 LYS 27 HZ3 LYS 27 1.521 -18.541 5.741 215 H GLU 28 H GLU 28 -0.912 -15.296 3.169 216 HA GLU 28 HA GLU 28 -2.894 -16.980 2.019 217 HB2 GLU 28 HB2 GLU 28 -2.742 -15.223 4.420 218 HB3 GLU 28 HB1 GLU 28 -4.281 -15.918 3.928 219 HG2 GLU 28 HG2 GLU 28 -3.626 -18.054 4.391 220 HG3 GLU 28 HG1 GLU 28 -1.925 -17.704 4.105 221 H VAL 29 H VAL 29 -2.219 -13.552 1.878 222 HA VAL 29 HA VAL 29 -4.764 -12.762 0.895 223 HB VAL 29 HB VAL 29 -2.072 -11.481 0.325 224 HG11 VAL 29 HG11 VAL 29 -3.813 -10.800 -1.264 225 HG12 VAL 29 HG12 VAL 29 -3.361 -9.467 -0.199 226 HG13 VAL 29 HG13 VAL 29 -4.863 -10.350 0.078 227 HG21 VAL 29 HG21 VAL 29 -4.118 -10.865 2.461 228 HG22 VAL 29 HG22 VAL 29 -2.659 -9.926 2.138 229 HG23 VAL 29 HG23 VAL 29 -2.529 -11.587 2.719 230 H VAL 30 H VAL 30 -1.802 -13.868 -0.649 231 HA VAL 30 HA VAL 30 -2.825 -13.651 -3.304 232 HB VAL 30 HB VAL 30 -0.494 -15.286 -2.263 233 HG11 VAL 30 HG11 VAL 30 -1.184 -14.445 -5.078 234 HG12 VAL 30 HG12 VAL 30 -1.258 -16.087 -4.436 235 HG13 VAL 30 HG13 VAL 30 0.298 -15.268 -4.587 236 HG21 VAL 30 HG21 VAL 30 -0.218 -12.917 -1.797 237 HG22 VAL 30 HG22 VAL 30 -0.580 -12.528 -3.479 238 HG23 VAL 30 HG23 VAL 30 0.887 -13.419 -3.077 239 H ALA 31 H ALA 31 -2.666 -16.170 -0.865 240 HA ALA 31 HA ALA 31 -3.441 -18.362 -2.419 241 HB1 ALA 31 HB1 ALA 31 -4.082 -17.894 0.485 242 HB2 ALA 31 HB2 ALA 31 -2.542 -18.504 -0.120 243 HB3 ALA 31 HB3 ALA 31 -4.016 -19.447 -0.348 244 H LYS 32 H LYS 32 -5.427 -16.133 -0.471 245 HA LYS 32 HA LYS 32 -7.898 -17.338 -1.144 246 HB2 LYS 32 HB2 LYS 32 -8.948 -15.352 -0.217 247 HB3 LYS 32 HB1 LYS 32 -7.613 -15.850 0.813 248 HG2 LYS 32 HG2 LYS 32 -6.229 -14.090 0.001 249 HG3 LYS 32 HG1 LYS 32 -7.394 -13.680 -1.257 250 HD2 LYS 32 HD2 LYS 32 -7.599 -12.067 0.485 251 HD3 LYS 32 HD1 LYS 32 -9.021 -13.107 0.550 252 HE2 LYS 32 HE2 LYS 32 -8.002 -14.366 2.385 253 HE3 LYS 32 HE1 LYS 32 -6.584 -13.319 2.312 254 HZ1 LYS 32 HZ1 LYS 32 -9.353 -12.503 2.999 255 HZ2 LYS 32 HZ2 LYS 32 -8.066 -11.430 2.804 256 HZ3 LYS 32 HZ3 LYS 32 -8.031 -12.567 4.050 257 H ARG 33 H ARG 33 -5.937 -14.892 -2.684 258 HA ARG 33 HA ARG 33 -7.897 -13.880 -4.440 259 HB2 ARG 33 HB2 ARG 33 -5.610 -12.881 -3.877 260 HB3 ARG 33 HB1 ARG 33 -4.955 -14.017 -5.056 261 HG2 ARG 33 HG2 ARG 33 -6.262 -13.029 -6.812 262 HG3 ARG 33 HG1 ARG 33 -7.079 -11.972 -5.662 263 HD2 ARG 33 HD2 ARG 33 -4.780 -11.058 -5.100 264 HD3 ARG 33 HD1 ARG 33 -4.202 -11.917 -6.529 265 HE ARG 33 HE ARG 33 -6.414 -10.377 -7.270 266 HH11 ARG 33 HH11 ARG 33 -3.111 -9.943 -6.238 267 HH12 ARG 33 HH12 ARG 33 -2.933 -8.385 -6.978 268 HH21 ARG 33 HH21 ARG 33 -6.202 -8.314 -8.241 269 HH22 ARG 33 HH22 ARG 33 -4.706 -7.456 -8.121 270 H GLN 34 H GLN 34 -5.636 -16.534 -4.614 271 HA GLN 34 HA GLN 34 -6.442 -17.186 -7.333 272 HB2 GLN 34 HB2 GLN 34 -4.349 -18.355 -5.502 273 HB3 GLN 34 HB1 GLN 34 -4.669 -18.936 -7.130 274 HG2 GLN 34 HG2 GLN 34 -3.888 -16.107 -6.494 275 HG3 GLN 34 HG1 GLN 34 -2.730 -17.361 -6.912 276 HE21 GLN 34 HE21 GLN 34 -2.718 -18.174 -9.025 277 HE22 GLN 34 HE22 GLN 34 -3.464 -17.331 -10.334 278 H GLY 35 H GLY 35 -7.510 -17.855 -4.256 279 HA2 GLY 35 HA2 GLY 35 -9.030 -19.361 -3.429 280 HA3 GLY 35 HA1 GLY 35 -9.362 -19.815 -5.094 281 H VAL 36 H VAL 36 -6.300 -20.049 -3.376 282 HA VAL 36 HA VAL 36 -6.397 -22.956 -3.827 283 HB VAL 36 HB VAL 36 -3.948 -22.925 -3.983 284 HG11 VAL 36 HG11 VAL 36 -5.245 -22.706 -6.025 285 HG12 VAL 36 HG12 VAL 36 -3.749 -21.781 -6.142 286 HG13 VAL 36 HG13 VAL 36 -5.276 -20.953 -5.838 287 HG21 VAL 36 HG21 VAL 36 -2.722 -20.803 -4.116 288 HG22 VAL 36 HG22 VAL 36 -3.498 -20.998 -2.544 289 HG23 VAL 36 HG23 VAL 36 -4.207 -19.925 -3.749 290 HA PRO 37 HA PRO 37 -5.868 -23.718 0.505 291 HB2 PRO 37 HB2 PRO 37 -3.757 -25.688 -0.160 292 HB3 PRO 37 HB1 PRO 37 -5.290 -25.931 0.680 293 HG2 PRO 37 HG2 PRO 37 -4.940 -26.810 -1.815 294 HG3 PRO 37 HG1 PRO 37 -6.493 -26.134 -1.289 295 HD2 PRO 37 HD2 PRO 37 -4.327 -24.864 -2.919 296 HD3 PRO 37 HD1 PRO 37 -6.089 -24.783 -3.123 297 H ALA 38 H ALA 38 -4.888 -22.095 1.548 298 HA ALA 38 HA ALA 38 -2.303 -21.099 1.003 299 HB1 ALA 38 HB1 ALA 38 -4.066 -19.763 2.052 300 HB2 ALA 38 HB2 ALA 38 -2.591 -19.770 3.019 301 HB3 ALA 38 HB3 ALA 38 -3.964 -20.768 3.497 302 H ASP 39 H ASP 39 -3.448 -23.661 2.995 303 HA ASP 39 HA ASP 39 -1.334 -23.876 4.837 304 HB2 ASP 39 HB2 ASP 39 -3.474 -25.053 5.106 305 HB3 ASP 39 HB1 ASP 39 -3.107 -26.054 3.705 306 H GLN 40 H GLN 40 -1.725 -25.044 1.561 307 HA GLN 40 HA GLN 40 0.873 -26.404 1.687 308 HB2 GLN 40 HB2 GLN 40 -1.300 -26.504 -0.407 309 HB3 GLN 40 HB1 GLN 40 0.213 -27.387 -0.490 310 HG2 GLN 40 HG2 GLN 40 -0.416 -28.576 1.578 311 HG3 GLN 40 HG1 GLN 40 -1.966 -27.739 1.548 312 HE21 GLN 40 HE21 GLN 40 -0.001 -30.189 0.085 313 HE22 GLN 40 HE22 GLN 40 -1.244 -30.886 -0.886 314 H LEU 41 H LEU 41 0.341 -23.429 1.461 315 HA LEU 41 HA LEU 41 1.526 -22.942 -1.162 316 HB2 LEU 41 HB2 LEU 41 -0.554 -21.720 -0.346 317 HB3 LEU 41 HB1 LEU 41 0.505 -20.870 0.760 318 HG LEU 41 HG LEU 41 1.757 -19.948 -1.131 319 HD11 LEU 41 HD11 LEU 41 1.431 -21.770 -2.713 320 HD12 LEU 41 HD12 LEU 41 0.914 -20.236 -3.401 321 HD13 LEU 41 HD13 LEU 41 -0.288 -21.386 -2.815 322 HD21 LEU 41 HD21 LEU 41 -0.139 -18.707 -0.239 323 HD22 LEU 41 HD22 LEU 41 -1.222 -19.555 -1.342 324 HD23 LEU 41 HD23 LEU 41 0.011 -18.467 -1.978 325 H ARG 42 H ARG 42 3.502 -21.962 -1.414 326 HA ARG 42 HA ARG 42 5.063 -21.508 1.039 327 HB2 ARG 42 HB2 ARG 42 5.629 -23.691 0.105 328 HB3 ARG 42 HB1 ARG 42 5.945 -22.958 -1.458 329 HG2 ARG 42 HG2 ARG 42 8.007 -23.478 -0.271 330 HG3 ARG 42 HG1 ARG 42 7.827 -21.738 -0.525 331 HD2 ARG 42 HD2 ARG 42 7.246 -21.362 1.707 332 HD3 ARG 42 HD1 ARG 42 6.945 -23.074 2.010 333 HE ARG 42 HE ARG 42 9.665 -22.378 1.290 334 HH11 ARG 42 HH11 ARG 42 7.354 -22.927 3.870 335 HH12 ARG 42 HH12 ARG 42 8.560 -23.304 5.045 336 HH21 ARG 42 HH21 ARG 42 11.284 -22.893 2.860 337 HH22 ARG 42 HH22 ARG 42 10.804 -23.272 4.476 338 H VAL 43 H VAL 43 6.120 -19.625 1.091 339 HA VAL 43 HA VAL 43 6.183 -18.007 -1.327 340 HB VAL 43 HB VAL 43 6.803 -16.118 0.174 341 HG11 VAL 43 HG11 VAL 43 4.463 -16.518 -0.343 342 HG12 VAL 43 HG12 VAL 43 4.638 -15.923 1.307 343 HG13 VAL 43 HG13 VAL 43 4.338 -17.635 1.016 344 HG21 VAL 43 HG21 VAL 43 6.667 -16.408 2.609 345 HG22 VAL 43 HG22 VAL 43 7.958 -17.390 1.919 346 HG23 VAL 43 HG23 VAL 43 6.435 -18.143 2.390 347 H ILE 44 H ILE 44 8.011 -17.469 -2.399 348 HA ILE 44 HA ILE 44 10.594 -18.131 -1.162 349 HB ILE 44 HB ILE 44 9.789 -18.896 -3.984 350 HG12 ILE 44 HG12 ILE 44 8.894 -20.416 -2.227 351 HG13 ILE 44 HG11 ILE 44 10.058 -21.208 -3.281 352 HG21 ILE 44 HG21 ILE 44 12.031 -19.910 -4.140 353 HG22 ILE 44 HG22 ILE 44 12.430 -19.233 -2.560 354 HG23 ILE 44 HG23 ILE 44 12.097 -18.162 -3.919 355 HD11 ILE 44 HD11 ILE 44 10.382 -21.866 -0.971 356 HD12 ILE 44 HD12 ILE 44 10.591 -20.180 -0.500 357 HD13 ILE 44 HD13 ILE 44 11.777 -20.954 -1.552 358 H PHE 45 H PHE 45 11.979 -16.527 -1.312 359 HA PHE 45 HA PHE 45 12.062 -14.829 -3.664 360 HB2 PHE 45 HB2 PHE 45 10.526 -13.608 -2.180 361 HB3 PHE 45 HB1 PHE 45 11.698 -13.705 -0.875 362 HD1 PHE 45 HD1 PHE 45 11.009 -12.213 -4.173 363 HD2 PHE 45 HD2 PHE 45 13.496 -12.150 -0.723 364 HE1 PHE 45 HE1 PHE 45 11.988 -10.087 -4.920 365 HE2 PHE 45 HE2 PHE 45 14.479 -10.023 -1.463 366 HZ PHE 45 HZ PHE 45 13.725 -8.989 -3.567 367 H ALA 46 H ALA 46 14.125 -14.033 -4.031 368 HA ALA 46 HA ALA 46 16.392 -13.976 -3.937 369 HB1 ALA 46 HB1 ALA 46 16.040 -12.780 -1.794 370 HB2 ALA 46 HB2 ALA 46 17.508 -13.758 -1.784 371 HB3 ALA 46 HB3 ALA 46 16.064 -14.332 -0.949 372 H GLY 47 H GLY 47 14.666 -16.571 -3.707 373 HA2 GLY 47 HA2 GLY 47 15.425 -18.697 -4.396 374 HA3 GLY 47 HA1 GLY 47 16.993 -18.338 -3.693 375 H LYS 48 H LYS 48 14.896 -17.372 -1.369 376 HA LYS 48 HA LYS 48 14.526 -20.056 -0.269 377 HB2 LYS 48 HB2 LYS 48 15.755 -19.736 1.683 378 HB3 LYS 48 HB1 LYS 48 16.771 -18.995 0.461 379 HG2 LYS 48 HG2 LYS 48 14.981 -17.554 2.421 380 HG3 LYS 48 HG1 LYS 48 16.741 -17.641 2.474 381 HD2 LYS 48 HD2 LYS 48 16.675 -16.512 0.191 382 HD3 LYS 48 HD1 LYS 48 14.963 -16.220 0.545 383 HE2 LYS 48 HE2 LYS 48 17.265 -15.327 2.286 384 HE3 LYS 48 HE1 LYS 48 16.407 -14.295 1.147 385 HZ1 LYS 48 HZ1 LYS 48 14.415 -14.527 2.409 386 HZ2 LYS 48 HZ2 LYS 48 15.644 -14.096 3.482 387 HZ3 LYS 48 HZ3 LYS 48 15.103 -15.692 3.421 388 H GLU 49 H GLU 49 13.636 -19.578 2.174 389 HA GLU 49 HA GLU 49 11.045 -18.416 1.728 390 HB2 GLU 49 HB2 GLU 49 11.406 -20.493 3.067 391 HB3 GLU 49 HB1 GLU 49 12.245 -19.530 4.274 392 HG2 GLU 49 HG2 GLU 49 10.004 -18.155 4.259 393 HG3 GLU 49 HG1 GLU 49 9.345 -19.667 3.632 394 H LEU 50 H LEU 50 10.260 -16.570 2.589 395 HA LEU 50 HA LEU 50 12.114 -14.614 3.612 396 HB2 LEU 50 HB2 LEU 50 9.168 -14.529 3.047 397 HB3 LEU 50 HB1 LEU 50 10.070 -13.153 3.645 398 HG LEU 50 HG LEU 50 10.484 -14.549 1.019 399 HD11 LEU 50 HD11 LEU 50 8.443 -13.243 1.087 400 HD12 LEU 50 HD12 LEU 50 9.649 -12.475 0.052 401 HD13 LEU 50 HD13 LEU 50 9.349 -11.846 1.671 402 HD21 LEU 50 HD21 LEU 50 11.902 -12.239 2.326 403 HD22 LEU 50 HD22 LEU 50 11.974 -12.545 0.597 404 HD23 LEU 50 HD23 LEU 50 12.604 -13.746 1.728 405 H ARG 51 H ARG 51 10.529 -13.166 5.363 406 HA ARG 51 HA ARG 51 10.627 -14.922 7.700 407 HB2 ARG 51 HB2 ARG 51 10.285 -11.934 7.740 408 HB3 ARG 51 HB1 ARG 51 10.885 -12.978 9.020 409 HG2 ARG 51 HG2 ARG 51 12.275 -12.264 6.456 410 HG3 ARG 51 HG1 ARG 51 12.707 -11.715 8.078 411 HD2 ARG 51 HD2 ARG 51 12.866 -14.533 6.997 412 HD3 ARG 51 HD1 ARG 51 14.217 -13.484 7.421 413 HE ARG 51 HE ARG 51 12.711 -13.739 9.716 414 HH11 ARG 51 HH11 ARG 51 14.489 -15.880 7.585 415 HH12 ARG 51 HH12 ARG 51 14.823 -17.047 8.818 416 HH21 ARG 51 HH21 ARG 51 13.148 -15.291 11.351 417 HH22 ARG 51 HH22 ARG 51 14.059 -16.708 10.966 418 H ASN 52 H ASN 52 8.695 -15.958 7.729 419 HA ASN 52 HA ASN 52 6.228 -14.913 6.945 420 HB2 ASN 52 HB2 ASN 52 7.037 -17.258 8.603 421 HB3 ASN 52 HB1 ASN 52 5.342 -16.789 8.570 422 HD21 ASN 52 HD21 ASN 52 7.992 -18.119 6.747 423 HD22 ASN 52 HD22 ASN 52 7.055 -18.603 5.384 424 H ASP 53 H ASP 53 7.872 -14.664 10.010 425 HA ASP 53 HA ASP 53 5.477 -13.670 11.327 426 HB2 ASP 53 HB2 ASP 53 6.685 -13.816 13.356 427 HB3 ASP 53 HB1 ASP 53 7.121 -15.246 12.429 428 H TRP 54 H TRP 54 7.530 -12.241 9.262 429 HA TRP 54 HA TRP 54 7.540 -9.756 10.823 430 HB2 TRP 54 HB2 TRP 54 9.818 -10.753 10.253 431 HB3 TRP 54 HB1 TRP 54 9.468 -10.332 8.578 432 HD1 TRP 54 HD1 TRP 54 10.853 -8.250 8.026 433 HE1 TRP 54 HE1 TRP 54 11.289 -5.975 9.163 434 HE3 TRP 54 HE3 TRP 54 8.372 -9.028 12.438 435 HZ2 TRP 54 HZ2 TRP 54 10.658 -4.689 11.576 436 HZ3 TRP 54 HZ3 TRP 54 8.336 -7.221 14.097 437 HH2 TRP 54 HH2 TRP 54 9.455 -5.099 13.676 438 H THR 55 H THR 55 7.648 -7.755 9.355 439 HA THR 55 HA THR 55 5.214 -7.760 7.867 440 HB THR 55 HB THR 55 5.567 -5.357 7.640 441 HG1 THR 55 HG1 THR 55 7.654 -4.729 8.931 442 HG21 THR 55 HG21 THR 55 5.638 -4.750 9.992 443 HG22 THR 55 HG22 THR 55 6.405 -6.282 10.395 444 HG23 THR 55 HG23 THR 55 4.738 -6.258 9.808 445 H VAL 56 H VAL 56 4.952 -6.985 5.716 446 HA VAL 56 HA VAL 56 6.871 -8.075 3.891 447 HB VAL 56 HB VAL 56 4.410 -8.293 3.565 448 HG11 VAL 56 HG11 VAL 56 4.509 -5.361 2.901 449 HG12 VAL 56 HG12 VAL 56 3.734 -6.082 4.311 450 HG13 VAL 56 HG13 VAL 56 3.122 -6.429 2.693 451 HG21 VAL 56 HG21 VAL 56 5.977 -6.948 1.378 452 HG22 VAL 56 HG22 VAL 56 4.407 -7.717 1.136 453 HG23 VAL 56 HG23 VAL 56 5.782 -8.677 1.681 454 H GLN 57 H GLN 57 5.956 -4.889 5.028 455 HA GLN 57 HA GLN 57 7.155 -3.468 2.883 456 HB2 GLN 57 HB2 GLN 57 5.446 -2.376 4.173 457 HB3 GLN 57 HB1 GLN 57 6.377 -2.564 5.653 458 HG2 GLN 57 HG2 GLN 57 8.040 -1.018 4.871 459 HG3 GLN 57 HG1 GLN 57 7.270 -0.926 3.290 460 HE21 GLN 57 HE21 GLN 57 7.885 1.131 5.306 461 HE22 GLN 57 HE22 GLN 57 6.382 1.920 5.637 462 H ASN 58 H ASN 58 8.252 -4.390 6.104 463 HA ASN 58 HA ASN 58 10.784 -3.079 5.712 464 HB2 ASN 58 HB2 ASN 58 9.604 -3.360 7.944 465 HB3 ASN 58 HB1 ASN 58 10.087 -5.050 7.883 466 HD21 ASN 58 HD21 ASN 58 11.933 -2.245 6.797 467 HD22 ASN 58 HD22 ASN 58 13.215 -2.439 7.937 468 H CYS 59 H CYS 59 9.491 -5.839 4.504 469 HA CYS 59 HA CYS 59 11.857 -7.497 4.691 470 HB2 CYS 59 HB2 CYS 59 9.558 -8.474 4.720 471 HB3 CYS 59 HB1 CYS 59 9.344 -7.937 3.060 472 HG CYS 59 HG CYS 59 11.595 -9.524 2.193 473 H ASP 60 H ASP 60 11.040 -4.855 2.953 474 HA ASP 60 HA ASP 60 12.023 -3.747 1.232 475 HB2 ASP 60 HB2 ASP 60 13.926 -6.094 1.206 476 HB3 ASP 60 HB1 ASP 60 14.118 -4.658 0.215 477 H LEU 61 H LEU 61 10.068 -6.175 0.815 478 HA LEU 61 HA LEU 61 10.612 -7.170 -1.783 479 HB2 LEU 61 HB2 LEU 61 7.952 -6.973 -0.382 480 HB3 LEU 61 HB1 LEU 61 8.290 -7.950 -1.793 481 HG LEU 61 HG LEU 61 9.391 -8.336 0.984 482 HD11 LEU 61 HD11 LEU 61 7.747 -10.203 -0.686 483 HD12 LEU 61 HD12 LEU 61 7.048 -9.042 0.431 484 HD13 LEU 61 HD13 LEU 61 8.113 -10.309 1.038 485 HD21 LEU 61 HD21 LEU 61 10.518 -10.321 0.073 486 HD22 LEU 61 HD22 LEU 61 11.141 -8.828 -0.622 487 HD23 LEU 61 HD23 LEU 61 10.034 -9.839 -1.553 488 H ASP 62 H ASP 62 9.423 -4.179 -0.764 489 HA ASP 62 HA ASP 62 7.990 -3.574 -3.198 490 HB2 ASP 62 HB2 ASP 62 7.180 -2.588 -1.161 491 HB3 ASP 62 HB1 ASP 62 8.759 -1.896 -0.813 492 H GLN 63 H GLN 63 11.170 -3.171 -1.919 493 HA GLN 63 HA GLN 63 11.840 -1.266 -4.051 494 HB2 GLN 63 HB2 GLN 63 12.391 -0.754 -1.646 495 HB3 GLN 63 HB1 GLN 63 13.567 -2.058 -1.710 496 HG2 GLN 63 HG2 GLN 63 14.642 0.083 -2.034 497 HG3 GLN 63 HG1 GLN 63 14.757 -0.899 -3.495 498 HE21 GLN 63 HE21 GLN 63 13.272 1.873 -2.018 499 HE22 GLN 63 HE22 GLN 63 12.697 2.594 -3.482 500 H GLN 64 H GLN 64 12.347 -4.544 -3.111 501 HA GLN 64 HA GLN 64 14.665 -4.788 -4.862 502 HB2 GLN 64 HB2 GLN 64 13.425 -6.872 -3.059 503 HB3 GLN 64 HB1 GLN 64 14.958 -7.012 -3.911 504 HG2 GLN 64 HG2 GLN 64 14.278 -5.168 -1.644 505 HG3 GLN 64 HG1 GLN 64 15.436 -6.497 -1.645 506 HE21 GLN 64 HE21 GLN 64 15.765 -3.639 -1.037 507 HE22 GLN 64 HE22 GLN 64 17.006 -3.071 -2.097 508 H SEP 65 H SEP 65 14.209 -7.585 -5.427 509 HA SEP 65 HA SEP 65 12.889 -7.323 -7.899 510 HB2 SEP 65 HB1 SEP 65 13.356 -9.696 -8.164 511 HB3 SEP 65 HB2 SEP 65 13.683 -9.846 -6.437 512 H ILE 66 H ILE 66 11.411 -9.582 -8.278 513 HA ILE 66 HA ILE 66 8.949 -8.803 -6.952 514 HB ILE 66 HB ILE 66 9.068 -9.044 -9.440 515 HG12 ILE 66 HG12 ILE 66 7.161 -11.041 -8.241 516 HG13 ILE 66 HG11 ILE 66 6.937 -9.299 -8.119 517 HG21 ILE 66 HG21 ILE 66 9.054 -11.277 -10.416 518 HG22 ILE 66 HG22 ILE 66 9.342 -11.969 -8.818 519 HG23 ILE 66 HG23 ILE 66 10.566 -10.939 -9.568 520 HD11 ILE 66 HD11 ILE 66 5.636 -10.351 -9.934 521 HD12 ILE 66 HD12 ILE 66 7.158 -10.800 -10.713 522 HD13 ILE 66 HD13 ILE 66 6.746 -9.101 -10.495 523 H VAL 67 H VAL 67 7.610 -10.237 -5.856 524 HA VAL 67 HA VAL 67 9.008 -12.313 -4.413 525 HB VAL 67 HB VAL 67 6.080 -11.630 -4.183 526 HG11 VAL 67 HG11 VAL 67 8.063 -12.710 -2.184 527 HG12 VAL 67 HG12 VAL 67 6.808 -13.633 -3.009 528 HG13 VAL 67 HG13 VAL 67 6.364 -12.365 -1.867 529 HG21 VAL 67 HG21 VAL 67 8.379 -10.233 -2.821 530 HG22 VAL 67 HG22 VAL 67 6.668 -9.983 -2.469 531 HG23 VAL 67 HG23 VAL 67 7.319 -9.541 -4.046 532 H HIS 68 H HIS 68 8.661 -14.504 -4.591 533 HA HIS 68 HA HIS 68 6.766 -15.364 -6.670 534 HB2 HIS 68 HB2 HIS 68 9.448 -16.495 -5.881 535 HB3 HIS 68 HB1 HIS 68 8.278 -17.429 -6.801 536 HD2 HIS 68 HD2 HIS 68 9.644 -13.749 -7.367 537 HE1 HIS 68 HE1 HIS 68 9.945 -16.012 -10.925 538 HE2 HIS 68 HE2 HIS 68 10.623 -13.873 -9.761 539 H ILE 69 H ILE 69 5.355 -16.980 -6.215 540 HA ILE 69 HA ILE 69 5.560 -18.275 -3.593 541 HB ILE 69 HB ILE 69 3.012 -17.071 -4.704 542 HG12 ILE 69 HG12 ILE 69 4.702 -16.279 -2.322 543 HG13 ILE 69 HG11 ILE 69 4.483 -15.349 -3.798 544 HG21 ILE 69 HG21 ILE 69 3.520 -18.535 -2.121 545 HG22 ILE 69 HG22 ILE 69 2.640 -19.162 -3.514 546 HG23 ILE 69 HG23 ILE 69 1.997 -17.790 -2.609 547 HD11 ILE 69 HD11 ILE 69 3.135 -14.433 -2.018 548 HD12 ILE 69 HD12 ILE 69 2.357 -15.999 -1.773 549 HD13 ILE 69 HD13 ILE 69 2.103 -15.116 -3.278 550 H VAL 70 H VAL 70 5.378 -20.394 -3.756 551 HA VAL 70 HA VAL 70 4.085 -21.486 -6.159 552 HB VAL 70 HB VAL 70 5.527 -23.478 -5.907 553 HG11 VAL 70 HG11 VAL 70 6.192 -21.705 -7.430 554 HG12 VAL 70 HG12 VAL 70 7.607 -22.445 -6.682 555 HG13 VAL 70 HG13 VAL 70 7.031 -20.875 -6.120 556 HG21 VAL 70 HG21 VAL 70 6.913 -21.864 -3.764 557 HG22 VAL 70 HG22 VAL 70 7.467 -23.406 -4.417 558 HG23 VAL 70 HG23 VAL 70 5.959 -23.325 -3.510 559 H GLN 71 H GLN 71 2.804 -23.320 -5.932 560 HA GLN 71 HA GLN 71 1.863 -23.802 -3.191 561 HB2 GLN 71 HB2 GLN 71 0.215 -22.766 -4.727 562 HB3 GLN 71 HB1 GLN 71 0.389 -24.141 -5.805 563 HG2 GLN 71 HG2 GLN 71 -0.334 -25.557 -3.788 564 HG3 GLN 71 HG1 GLN 71 -0.875 -24.029 -3.094 565 HE21 GLN 71 HE21 GLN 71 -2.446 -26.338 -3.876 566 HE22 GLN 71 HE22 GLN 71 -3.571 -25.772 -5.060 567 H ARG 72 H ARG 72 1.521 -25.921 -2.551 568 HA ARG 72 HA ARG 72 2.717 -27.974 -4.250 569 HB2 ARG 72 HB2 ARG 72 1.738 -28.139 -1.388 570 HB3 ARG 72 HB1 ARG 72 2.567 -29.414 -2.262 571 HG2 ARG 72 HG2 ARG 72 3.698 -26.765 -1.387 572 HG3 ARG 72 HG1 ARG 72 4.133 -28.370 -0.796 573 HD2 ARG 72 HD2 ARG 72 4.685 -27.171 -3.503 574 HD3 ARG 72 HD1 ARG 72 5.852 -27.699 -2.294 575 HE ARG 72 HE ARG 72 4.353 -29.924 -2.950 576 HH11 ARG 72 HH11 ARG 72 6.557 -27.721 -4.575 577 HH12 ARG 72 HH12 ARG 72 7.026 -28.877 -5.770 578 HH21 ARG 72 HH21 ARG 72 4.956 -31.437 -4.550 579 HH22 ARG 72 HH22 ARG 72 6.104 -30.997 -5.768 580 HA PRO 73 HA PRO 73 -1.660 -28.529 -5.195 581 HB2 PRO 73 HB2 PRO 73 -0.955 -29.655 -7.723 582 HB3 PRO 73 HB1 PRO 73 -1.581 -28.038 -7.394 583 HG2 PRO 73 HG2 PRO 73 0.976 -28.598 -8.314 584 HG3 PRO 73 HG1 PRO 73 0.490 -27.096 -7.510 585 HD2 PRO 73 HD2 PRO 73 1.900 -29.481 -6.394 586 HD3 PRO 73 HD1 PRO 73 2.133 -27.754 -6.041 587 H TRP 74 H TRP 74 -2.179 -30.179 -3.835 588 HA TRP 74 HA TRP 74 -1.379 -32.895 -4.407 589 HB2 TRP 74 HB2 TRP 74 -1.826 -32.065 -2.080 590 HB3 TRP 74 HB1 TRP 74 -3.521 -31.876 -2.514 591 HD1 TRP 74 HD1 TRP 74 -0.870 -34.641 -2.045 592 HE1 TRP 74 HE1 TRP 74 -2.084 -36.830 -1.458 593 HE3 TRP 74 HE3 TRP 74 -5.700 -33.065 -2.616 594 HZ2 TRP 74 HZ2 TRP 74 -4.737 -37.765 -1.266 595 HZ3 TRP 74 HZ3 TRP 74 -7.518 -34.672 -2.211 596 HH2 TRP 74 HH2 TRP 74 -7.045 -36.973 -1.550 597 H ARG 75 H ARG 75 -4.056 -30.756 -4.924 598 HA ARG 75 HA ARG 75 -5.303 -32.732 -6.691 599 HB2 ARG 75 HB2 ARG 75 -6.794 -32.438 -4.831 600 HB3 ARG 75 HB1 ARG 75 -6.603 -30.691 -4.879 601 HG2 ARG 75 HG2 ARG 75 -7.759 -30.625 -7.032 602 HG3 ARG 75 HG1 ARG 75 -7.956 -32.377 -6.976 603 HD2 ARG 75 HD2 ARG 75 -9.377 -32.236 -5.078 604 HD3 ARG 75 HD1 ARG 75 -8.999 -30.530 -4.842 605 HE ARG 75 HE ARG 75 -10.092 -30.310 -7.168 606 HH11 ARG 75 HH11 ARG 75 -11.117 -32.572 -4.683 607 HH12 ARG 75 HH12 ARG 75 -12.771 -32.566 -5.187 608 HH21 ARG 75 HH21 ARG 75 -12.275 -30.297 -7.816 609 HH22 ARG 75 HH22 ARG 75 -13.431 -31.270 -6.973 610 H LYS 76 H LYS 76 -4.504 -32.062 -8.590 611 HA LYS 76 HA LYS 76 -5.269 -29.400 -9.462 612 HB2 LYS 76 HB2 LYS 76 -2.943 -29.150 -8.797 613 HB3 LYS 76 HB1 LYS 76 -2.487 -30.540 -9.766 614 HG2 LYS 76 HG2 LYS 76 -1.825 -28.758 -11.085 615 HG3 LYS 76 HG1 LYS 76 -3.396 -29.168 -11.761 616 HD2 LYS 76 HD2 LYS 76 -3.021 -27.009 -9.686 617 HD3 LYS 76 HD1 LYS 76 -2.908 -26.693 -11.412 618 HE2 LYS 76 HE2 LYS 76 -5.326 -27.648 -9.870 619 HE3 LYS 76 HE1 LYS 76 -5.107 -26.109 -10.678 620 HZ1 LYS 76 HZ1 LYS 76 -4.947 -27.386 -12.805 621 HZ2 LYS 76 HZ2 LYS 76 -6.459 -27.421 -12.067 622 HZ3 LYS 76 HZ3 LYS 76 -5.447 -28.770 -11.962 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 0.832 -1.615 0.197 2 H2 MET 1 HT2 MET 1 0.355 -0.416 -0.892 3 H3 MET 1 HT3 MET 1 1.342 -0.016 0.412 4 HA MET 1 HA MET 1 2.557 -0.123 -1.682 5 HB2 MET 1 HB2 MET 1 3.670 -0.628 0.494 6 HB3 MET 1 HB1 MET 1 3.311 -2.330 0.246 7 HG2 MET 1 HG2 MET 1 4.709 -2.404 -1.696 8 HG3 MET 1 HG1 MET 1 4.973 -0.664 -1.624 9 HE1 MET 1 HE1 MET 1 5.075 -3.582 1.098 10 HE2 MET 1 HE2 MET 1 6.825 -3.805 1.196 11 HE3 MET 1 HE3 MET 1 5.977 -4.156 -0.307 12 H ILE 2 H ILE 2 2.821 -1.095 -3.611 13 HA ILE 2 HA ILE 2 1.387 -3.614 -4.007 14 HB ILE 2 HB ILE 2 2.374 -1.615 -6.052 15 HG12 ILE 2 HG12 ILE 2 -0.417 -2.218 -5.053 16 HG13 ILE 2 HG11 ILE 2 0.513 -0.763 -4.708 17 HG21 ILE 2 HG21 ILE 2 2.345 -3.880 -6.948 18 HG22 ILE 2 HG22 ILE 2 1.054 -2.913 -7.661 19 HG23 ILE 2 HG23 ILE 2 0.682 -4.089 -6.399 20 HD11 ILE 2 HD11 ILE 2 0.462 -0.163 -7.061 21 HD12 ILE 2 HD12 ILE 2 -1.166 -0.388 -6.421 22 HD13 ILE 2 HD13 ILE 2 -0.434 -1.638 -7.423 23 H VAL 3 H VAL 3 2.496 -5.429 -4.160 24 HA VAL 3 HA VAL 3 5.300 -5.253 -5.018 25 HB VAL 3 HB VAL 3 5.736 -7.316 -3.746 26 HG11 VAL 3 HG11 VAL 3 5.573 -6.365 -1.487 27 HG12 VAL 3 HG12 VAL 3 4.485 -5.121 -2.103 28 HG13 VAL 3 HG13 VAL 3 6.155 -5.191 -2.667 29 HG21 VAL 3 HG21 VAL 3 4.081 -8.185 -2.155 30 HG22 VAL 3 HG22 VAL 3 3.504 -8.308 -3.818 31 HG23 VAL 3 HG23 VAL 3 2.892 -7.033 -2.764 32 H PHE 4 H PHE 4 5.946 -6.458 -6.696 33 HA PHE 4 HA PHE 4 3.926 -7.833 -8.236 34 HB2 PHE 4 HB2 PHE 4 6.835 -7.205 -8.714 35 HB3 PHE 4 HB1 PHE 4 5.912 -8.231 -9.803 36 HD1 PHE 4 HD1 PHE 4 5.956 -4.853 -8.278 37 HD2 PHE 4 HD2 PHE 4 4.606 -7.310 -11.466 38 HE1 PHE 4 HE1 PHE 4 5.102 -2.860 -9.439 39 HE2 PHE 4 HE2 PHE 4 3.747 -5.321 -12.643 40 HZ PHE 4 HZ PHE 4 3.995 -3.092 -11.628 41 H VAL 5 H VAL 5 3.860 -10.002 -8.692 42 HA VAL 5 HA VAL 5 5.742 -11.693 -7.245 43 HB VAL 5 HB VAL 5 3.802 -11.247 -5.766 44 HG11 VAL 5 HG11 VAL 5 2.074 -10.980 -7.424 45 HG12 VAL 5 HG12 VAL 5 1.636 -12.220 -6.250 46 HG13 VAL 5 HG13 VAL 5 2.201 -12.686 -7.857 47 HG21 VAL 5 HG21 VAL 5 3.995 -14.095 -6.700 48 HG22 VAL 5 HG22 VAL 5 3.369 -13.531 -5.146 49 HG23 VAL 5 HG23 VAL 5 5.072 -13.304 -5.545 50 H ARG 6 H ARG 6 6.151 -13.624 -8.181 51 HA ARG 6 HA ARG 6 4.931 -14.170 -10.807 52 HB2 ARG 6 HB2 ARG 6 7.410 -15.388 -9.553 53 HB3 ARG 6 HB1 ARG 6 6.877 -15.585 -11.210 54 HG2 ARG 6 HG2 ARG 6 7.586 -12.894 -10.116 55 HG3 ARG 6 HG1 ARG 6 8.821 -13.998 -10.715 56 HD2 ARG 6 HD2 ARG 6 7.542 -14.103 -12.872 57 HD3 ARG 6 HD1 ARG 6 6.510 -12.815 -12.247 58 HE ARG 6 HE ARG 6 9.347 -12.252 -12.182 59 HH11 ARG 6 HH11 ARG 6 6.439 -12.032 -14.124 60 HH12 ARG 6 HH12 ARG 6 6.991 -10.668 -15.026 61 HH21 ARG 6 HH21 ARG 6 10.081 -10.442 -13.385 62 HH22 ARG 6 HH22 ARG 6 9.070 -9.760 -14.609 63 H PHE 7 H PHE 7 3.153 -15.435 -10.457 64 HA PHE 7 HA PHE 7 3.276 -17.503 -8.410 65 HB2 PHE 7 HB2 PHE 7 1.272 -16.023 -8.616 66 HB3 PHE 7 HB1 PHE 7 0.951 -16.749 -10.187 67 HD1 PHE 7 HD1 PHE 7 1.261 -17.498 -6.579 68 HD2 PHE 7 HD2 PHE 7 -0.260 -18.748 -10.350 69 HE1 PHE 7 HE1 PHE 7 -0.030 -19.267 -5.464 70 HE2 PHE 7 HE2 PHE 7 -1.555 -20.524 -9.241 71 HZ PHE 7 HZ PHE 7 -1.437 -20.782 -6.794 72 H ASN 8 H ASN 8 3.117 -19.665 -8.799 73 HA ASN 8 HA ASN 8 4.485 -20.789 -10.891 74 HB2 ASN 8 HB2 ASN 8 3.957 -21.962 -8.800 75 HB3 ASN 8 HB1 ASN 8 2.288 -22.144 -9.321 76 HD21 ASN 8 HD21 ASN 8 1.798 -23.674 -10.902 77 HD22 ASN 8 HD22 ASN 8 2.931 -24.873 -11.411 78 H SER 9 H SER 9 0.955 -20.435 -10.728 79 HA SER 9 HA SER 9 0.815 -21.463 -13.476 80 HB2 SER 9 HB2 SER 9 -0.464 -22.711 -11.736 81 HB3 SER 9 HB1 SER 9 -1.412 -21.258 -11.433 82 HG SER 9 HG SER 9 -2.015 -21.352 -13.682 83 H SER 10 H SER 10 1.530 -18.687 -12.759 84 HA SER 10 HA SER 10 -0.400 -17.375 -14.464 85 HB2 SER 10 HB2 SER 10 -1.225 -17.200 -12.028 86 HB3 SER 10 HB1 SER 10 0.150 -16.129 -11.779 87 HG SER 10 HG SER 10 -2.111 -15.776 -13.405 88 H HIS 11 H HIS 11 0.350 -14.826 -14.306 89 HA HIS 11 HA HIS 11 3.194 -14.916 -14.974 90 HB2 HIS 11 HB2 HIS 11 2.815 -12.780 -16.146 91 HB3 HIS 11 HB1 HIS 11 1.697 -14.010 -16.713 92 HD2 HIS 11 HD2 HIS 11 1.613 -10.821 -14.390 93 HE1 HIS 11 HE1 HIS 11 -2.244 -11.552 -15.961 94 HE2 HIS 11 HE2 HIS 11 -0.860 -10.039 -14.477 95 H GLY 12 H GLY 12 3.994 -12.364 -14.599 96 HA2 GLY 12 HA2 GLY 12 4.176 -12.206 -11.718 97 HA3 GLY 12 HA1 GLY 12 5.027 -11.194 -12.880 98 H PHE 13 H PHE 13 1.998 -11.685 -11.202 99 HA PHE 13 HA PHE 13 1.024 -9.116 -12.153 100 HB2 PHE 13 HB2 PHE 13 -1.108 -9.739 -11.018 101 HB3 PHE 13 HB1 PHE 13 -0.608 -10.891 -12.245 102 HD1 PHE 13 HD1 PHE 13 -1.149 -10.331 -8.676 103 HD2 PHE 13 HD2 PHE 13 0.115 -13.122 -11.627 104 HE1 PHE 13 HE1 PHE 13 -1.388 -12.156 -7.050 105 HE2 PHE 13 HE2 PHE 13 -0.117 -14.949 -9.999 106 HZ PHE 13 HZ PHE 13 -0.870 -14.467 -7.709 107 HA PRO 14 HA PRO 14 2.043 -7.156 -8.355 108 HB2 PRO 14 HB2 PRO 14 0.595 -4.918 -8.565 109 HB3 PRO 14 HB1 PRO 14 1.939 -5.258 -9.661 110 HG2 PRO 14 HG2 PRO 14 -0.989 -5.445 -10.138 111 HG3 PRO 14 HG1 PRO 14 0.308 -5.004 -11.259 112 HD2 PRO 14 HD2 PRO 14 -0.938 -7.518 -11.048 113 HD3 PRO 14 HD1 PRO 14 0.556 -7.153 -11.930 114 H VAL 15 H VAL 15 1.449 -7.543 -6.339 115 HA VAL 15 HA VAL 15 -1.412 -7.708 -5.686 116 HB VAL 15 HB VAL 15 0.966 -9.048 -4.341 117 HG11 VAL 15 HG11 VAL 15 -1.950 -9.105 -3.541 118 HG12 VAL 15 HG12 VAL 15 -0.655 -8.305 -2.654 119 HG13 VAL 15 HG13 VAL 15 -0.660 -10.060 -2.812 120 HG21 VAL 15 HG21 VAL 15 -1.434 -10.180 -5.767 121 HG22 VAL 15 HG22 VAL 15 -0.157 -11.111 -4.984 122 HG23 VAL 15 HG23 VAL 15 0.213 -10.119 -6.394 123 H GLU 16 H GLU 16 -2.168 -6.062 -4.582 124 HA GLU 16 HA GLU 16 -0.406 -4.162 -3.341 125 HB2 GLU 16 HB2 GLU 16 -2.456 -3.524 -4.614 126 HB3 GLU 16 HB1 GLU 16 -3.423 -4.249 -3.341 127 HG2 GLU 16 HG2 GLU 16 -2.601 -2.645 -1.745 128 HG3 GLU 16 HG1 GLU 16 -1.511 -1.965 -2.954 129 H VAL 17 H VAL 17 0.306 -4.324 -1.339 130 HA VAL 17 HA VAL 17 -1.327 -5.771 0.641 131 HB VAL 17 HB VAL 17 0.717 -6.563 1.714 132 HG11 VAL 17 HG11 VAL 17 1.513 -8.122 -0.034 133 HG12 VAL 17 HG12 VAL 17 0.631 -7.183 -1.235 134 HG13 VAL 17 HG13 VAL 17 -0.245 -8.018 0.048 135 HG21 VAL 17 HG21 VAL 17 2.213 -4.731 1.153 136 HG22 VAL 17 HG22 VAL 17 2.179 -5.195 -0.548 137 HG23 VAL 17 HG23 VAL 17 2.917 -6.266 0.644 138 H ASP 18 H ASP 18 -0.728 -5.139 2.920 139 HA ASP 18 HA ASP 18 -0.565 -2.222 3.051 140 HB2 ASP 18 HB2 ASP 18 -2.458 -3.394 4.173 141 HB3 ASP 18 HB1 ASP 18 -1.307 -4.236 5.196 142 H SER 19 H SER 19 0.749 -1.269 4.821 143 HA SER 19 HA SER 19 3.388 -2.262 4.725 144 HB2 SER 19 HB2 SER 19 2.201 -0.108 6.481 145 HB3 SER 19 HB1 SER 19 3.925 -0.399 6.250 146 HG SER 19 HG SER 19 2.060 0.760 4.547 147 H ASP 20 H ASP 20 0.752 -2.989 6.785 148 HA ASP 20 HA ASP 20 2.614 -4.133 8.757 149 HB2 ASP 20 HB2 ASP 20 -0.212 -3.181 8.998 150 HB3 ASP 20 HB1 ASP 20 0.424 -4.363 10.137 151 H THR 21 H THR 21 1.464 -5.167 6.072 152 HA THR 21 HA THR 21 -0.018 -7.484 6.792 153 HB THR 21 HB THR 21 1.524 -6.870 4.254 154 HG1 THR 21 HG1 THR 21 -1.087 -6.357 5.165 155 HG21 THR 21 HG21 THR 21 0.161 -8.630 3.221 156 HG22 THR 21 HG22 THR 21 -0.565 -8.995 4.786 157 HG23 THR 21 HG23 THR 21 1.155 -9.286 4.522 158 H SER 22 H SER 22 0.857 -8.958 8.065 159 HA SER 22 HA SER 22 3.586 -9.576 8.306 160 HB2 SER 22 HB2 SER 22 2.054 -10.125 10.086 161 HB3 SER 22 HB1 SER 22 1.088 -11.131 9.011 162 HG SER 22 HG SER 22 2.895 -12.005 10.544 163 H ILE 23 H ILE 23 4.742 -11.448 7.561 164 HA ILE 23 HA ILE 23 4.293 -12.116 4.856 165 HB ILE 23 HB ILE 23 5.984 -13.640 6.866 166 HG12 ILE 23 HG12 ILE 23 6.672 -11.304 6.763 167 HG13 ILE 23 HG11 ILE 23 7.874 -12.316 5.973 168 HG21 ILE 23 HG21 ILE 23 6.106 -13.606 3.848 169 HG22 ILE 23 HG22 ILE 23 5.551 -14.948 4.848 170 HG23 ILE 23 HG23 ILE 23 7.238 -14.440 4.910 171 HD11 ILE 23 HD11 ILE 23 7.521 -10.292 4.715 172 HD12 ILE 23 HD12 ILE 23 5.792 -10.619 4.614 173 HD13 ILE 23 HD13 ILE 23 6.938 -11.676 3.789 174 H PHE 24 H PHE 24 3.332 -13.646 7.863 175 HA PHE 24 HA PHE 24 2.380 -16.073 6.721 176 HB2 PHE 24 HB2 PHE 24 2.837 -15.661 9.183 177 HB3 PHE 24 HB1 PHE 24 1.347 -14.732 9.223 178 HD1 PHE 24 HD1 PHE 24 2.728 -18.097 8.570 179 HD2 PHE 24 HD2 PHE 24 -0.745 -15.796 9.427 180 HE1 PHE 24 HE1 PHE 24 1.460 -20.161 8.946 181 HE2 PHE 24 HE2 PHE 24 -2.020 -17.863 9.805 182 HZ PHE 24 HZ PHE 24 -0.919 -20.049 9.566 183 H GLN 25 H GLN 25 0.946 -12.940 7.428 184 HA GLN 25 HA GLN 25 -1.687 -13.605 6.596 185 HB2 GLN 25 HB2 GLN 25 -0.274 -10.958 6.910 186 HB3 GLN 25 HB1 GLN 25 -1.961 -11.094 6.440 187 HG2 GLN 25 HG2 GLN 25 -0.737 -12.041 9.022 188 HG3 GLN 25 HG1 GLN 25 -1.781 -10.636 8.802 189 HE21 GLN 25 HE21 GLN 25 -1.618 -14.056 9.101 190 HE22 GLN 25 HE22 GLN 25 -3.322 -14.354 9.131 191 H LEU 26 H LEU 26 1.128 -12.241 4.999 192 HA LEU 26 HA LEU 26 -0.009 -11.586 2.535 193 HB2 LEU 26 HB2 LEU 26 2.233 -10.897 3.138 194 HB3 LEU 26 HB1 LEU 26 2.762 -12.564 3.225 195 HG LEU 26 HG LEU 26 2.489 -12.786 0.798 196 HD11 LEU 26 HD11 LEU 26 0.680 -11.223 0.441 197 HD12 LEU 26 HD12 LEU 26 2.063 -10.782 -0.562 198 HD13 LEU 26 HD13 LEU 26 1.718 -9.880 0.913 199 HD21 LEU 26 HD21 LEU 26 4.336 -11.317 0.143 200 HD22 LEU 26 HD22 LEU 26 4.640 -12.096 1.696 201 HD23 LEU 26 HD23 LEU 26 4.134 -10.407 1.640 202 H LYS 27 H LYS 27 1.237 -14.621 3.792 203 HA LYS 27 HA LYS 27 1.021 -16.211 1.506 204 HB2 LYS 27 HB2 LYS 27 2.058 -16.900 3.688 205 HB3 LYS 27 HB1 LYS 27 0.439 -17.026 4.364 206 HG2 LYS 27 HG2 LYS 27 1.036 -19.221 3.814 207 HG3 LYS 27 HG1 LYS 27 -0.036 -18.701 2.513 208 HD2 LYS 27 HD2 LYS 27 1.726 -19.741 1.390 209 HD3 LYS 27 HD1 LYS 27 2.123 -18.026 1.286 210 HE2 LYS 27 HE2 LYS 27 4.119 -19.184 1.865 211 HE3 LYS 27 HE1 LYS 27 3.572 -18.341 3.313 212 HZ1 LYS 27 HZ1 LYS 27 3.140 -21.215 2.709 213 HZ2 LYS 27 HZ2 LYS 27 2.624 -20.415 4.108 214 HZ3 LYS 27 HZ3 LYS 27 4.274 -20.598 3.800 215 H GLU 28 H GLU 28 -1.318 -15.463 4.060 216 HA GLU 28 HA GLU 28 -3.444 -16.964 2.994 217 HB2 GLU 28 HB2 GLU 28 -3.316 -14.701 4.953 218 HB3 GLU 28 HB1 GLU 28 -4.846 -15.417 4.474 219 HG2 GLU 28 HG2 GLU 28 -3.774 -17.641 5.195 220 HG3 GLU 28 HG1 GLU 28 -2.594 -16.622 6.023 221 H VAL 29 H VAL 29 -2.444 -13.604 2.542 222 HA VAL 29 HA VAL 29 -4.712 -12.636 1.223 223 HB VAL 29 HB VAL 29 -1.818 -11.876 0.730 224 HG11 VAL 29 HG11 VAL 29 -4.343 -10.385 0.011 225 HG12 VAL 29 HG12 VAL 29 -3.270 -11.199 -1.125 226 HG13 VAL 29 HG13 VAL 29 -2.693 -9.800 -0.216 227 HG21 VAL 29 HG21 VAL 29 -3.918 -10.631 2.501 228 HG22 VAL 29 HG22 VAL 29 -2.301 -9.989 2.221 229 HG23 VAL 29 HG23 VAL 29 -2.505 -11.537 3.042 230 H VAL 30 H VAL 30 -1.773 -14.043 -0.191 231 HA VAL 30 HA VAL 30 -2.726 -13.996 -2.849 232 HB VAL 30 HB VAL 30 -0.602 -15.786 -1.642 233 HG11 VAL 30 HG11 VAL 30 0.255 -15.967 -3.934 234 HG12 VAL 30 HG12 VAL 30 -1.112 -15.021 -4.520 235 HG13 VAL 30 HG13 VAL 30 -1.382 -16.612 -3.805 236 HG21 VAL 30 HG21 VAL 30 0.983 -14.108 -2.461 237 HG22 VAL 30 HG22 VAL 30 -0.138 -13.415 -1.287 238 HG23 VAL 30 HG23 VAL 30 -0.361 -13.107 -3.009 239 H ALA 31 H ALA 31 -2.766 -16.458 -0.322 240 HA ALA 31 HA ALA 31 -3.831 -18.555 -1.865 241 HB1 ALA 31 HB1 ALA 31 -2.789 -18.881 0.327 242 HB2 ALA 31 HB2 ALA 31 -4.404 -19.586 0.261 243 HB3 ALA 31 HB3 ALA 31 -4.146 -18.050 1.089 244 H LYS 32 H LYS 32 -5.334 -15.956 -0.043 245 HA LYS 32 HA LYS 32 -8.010 -16.805 -0.257 246 HB2 LYS 32 HB2 LYS 32 -7.199 -15.183 1.382 247 HB3 LYS 32 HB1 LYS 32 -6.795 -14.063 0.096 248 HG2 LYS 32 HG2 LYS 32 -9.226 -13.991 -0.480 249 HG3 LYS 32 HG1 LYS 32 -9.528 -14.933 0.983 250 HD2 LYS 32 HD2 LYS 32 -8.136 -12.267 0.868 251 HD3 LYS 32 HD1 LYS 32 -9.810 -12.520 1.378 252 HE2 LYS 32 HE2 LYS 32 -7.357 -13.674 2.720 253 HE3 LYS 32 HE1 LYS 32 -8.260 -12.273 3.285 254 HZ1 LYS 32 HZ1 LYS 32 -9.433 -14.984 2.982 255 HZ2 LYS 32 HZ2 LYS 32 -10.153 -13.628 3.692 256 HZ3 LYS 32 HZ3 LYS 32 -8.830 -14.362 4.435 257 H ARG 33 H ARG 33 -6.038 -14.517 -2.109 258 HA ARG 33 HA ARG 33 -8.020 -13.683 -3.903 259 HB2 ARG 33 HB2 ARG 33 -5.841 -12.531 -3.546 260 HB3 ARG 33 HB1 ARG 33 -5.046 -13.852 -4.401 261 HG2 ARG 33 HG2 ARG 33 -6.211 -13.304 -6.435 262 HG3 ARG 33 HG1 ARG 33 -7.148 -12.063 -5.606 263 HD2 ARG 33 HD2 ARG 33 -4.149 -12.055 -5.947 264 HD3 ARG 33 HD1 ARG 33 -5.287 -11.122 -6.916 265 HE ARG 33 HE ARG 33 -5.428 -10.682 -4.053 266 HH11 ARG 33 HH11 ARG 33 -4.076 -9.592 -7.115 267 HH12 ARG 33 HH12 ARG 33 -3.754 -7.991 -6.536 268 HH21 ARG 33 HH21 ARG 33 -5.007 -8.585 -3.304 269 HH22 ARG 33 HH22 ARG 33 -4.302 -7.409 -4.358 270 H GLN 34 H GLN 34 -5.564 -16.207 -4.196 271 HA GLN 34 HA GLN 34 -6.421 -16.912 -6.845 272 HB2 GLN 34 HB2 GLN 34 -4.406 -18.178 -4.999 273 HB3 GLN 34 HB1 GLN 34 -4.663 -18.640 -6.678 274 HG2 GLN 34 HG2 GLN 34 -3.850 -15.895 -5.765 275 HG3 GLN 34 HG1 GLN 34 -2.732 -17.117 -6.354 276 HE21 GLN 34 HE21 GLN 34 -3.308 -14.484 -7.428 277 HE22 GLN 34 HE22 GLN 34 -3.861 -14.728 -9.047 278 H GLY 35 H GLY 35 -6.920 -18.177 -3.613 279 HA2 GLY 35 HA2 GLY 35 -8.704 -19.571 -3.002 280 HA3 GLY 35 HA1 GLY 35 -8.940 -19.980 -4.698 281 H VAL 36 H VAL 36 -6.039 -20.127 -2.687 282 HA VAL 36 HA VAL 36 -5.946 -23.031 -3.151 283 HB VAL 36 HB VAL 36 -3.471 -22.875 -3.289 284 HG11 VAL 36 HG11 VAL 36 -3.355 -21.927 -5.564 285 HG12 VAL 36 HG12 VAL 36 -4.973 -21.260 -5.344 286 HG13 VAL 36 HG13 VAL 36 -4.729 -23.006 -5.339 287 HG21 VAL 36 HG21 VAL 36 -3.187 -20.761 -2.070 288 HG22 VAL 36 HG22 VAL 36 -3.931 -19.894 -3.416 289 HG23 VAL 36 HG23 VAL 36 -2.388 -20.716 -3.643 290 HA PRO 37 HA PRO 37 -5.262 -23.463 1.215 291 HB2 PRO 37 HB2 PRO 37 -3.187 -25.490 0.660 292 HB3 PRO 37 HB1 PRO 37 -4.729 -25.671 1.500 293 HG2 PRO 37 HG2 PRO 37 -4.342 -26.701 -0.943 294 HG3 PRO 37 HG1 PRO 37 -5.907 -26.022 -0.457 295 HD2 PRO 37 HD2 PRO 37 -3.753 -24.811 -2.144 296 HD3 PRO 37 HD1 PRO 37 -5.515 -24.783 -2.370 297 H ALA 38 H ALA 38 -4.155 -22.011 2.371 298 HA ALA 38 HA ALA 38 -1.693 -20.899 1.482 299 HB1 ALA 38 HB1 ALA 38 -1.796 -19.543 3.496 300 HB2 ALA 38 HB2 ALA 38 -3.097 -20.557 4.124 301 HB3 ALA 38 HB3 ALA 38 -3.354 -19.586 2.673 302 H ASP 39 H ASP 39 -2.486 -23.498 3.627 303 HA ASP 39 HA ASP 39 -0.057 -23.496 5.115 304 HB2 ASP 39 HB2 ASP 39 -1.914 -25.821 4.563 305 HB3 ASP 39 HB1 ASP 39 -0.650 -25.786 5.782 306 H GLN 40 H GLN 40 -1.066 -24.989 2.105 307 HA GLN 40 HA GLN 40 1.473 -26.382 1.851 308 HB2 GLN 40 HB2 GLN 40 -0.995 -26.325 0.116 309 HB3 GLN 40 HB1 GLN 40 0.492 -27.101 -0.397 310 HG2 GLN 40 HG2 GLN 40 -0.766 -28.852 0.443 311 HG3 GLN 40 HG1 GLN 40 0.302 -28.449 1.781 312 HE21 GLN 40 HE21 GLN 40 -2.954 -28.397 0.591 313 HE22 GLN 40 HE22 GLN 40 -3.714 -28.021 2.094 314 H LEU 41 H LEU 41 0.065 -23.429 0.923 315 HA LEU 41 HA LEU 41 1.353 -22.897 -1.504 316 HB2 LEU 41 HB2 LEU 41 -0.552 -21.625 -0.650 317 HB3 LEU 41 HB1 LEU 41 0.435 -20.980 0.639 318 HG LEU 41 HG LEU 41 1.814 -19.792 -1.028 319 HD11 LEU 41 HD11 LEU 41 1.530 -21.279 -2.911 320 HD12 LEU 41 HD12 LEU 41 1.012 -19.650 -3.346 321 HD13 LEU 41 HD13 LEU 41 -0.189 -20.893 -2.991 322 HD21 LEU 41 HD21 LEU 41 -1.146 -19.264 -1.255 323 HD22 LEU 41 HD22 LEU 41 0.141 -18.125 -1.650 324 HD23 LEU 41 HD23 LEU 41 -0.080 -18.662 0.014 325 H ARG 42 H ARG 42 3.345 -22.233 -2.045 326 HA ARG 42 HA ARG 42 5.316 -21.906 0.113 327 HB2 ARG 42 HB2 ARG 42 5.799 -23.775 -1.327 328 HB3 ARG 42 HB1 ARG 42 5.594 -22.787 -2.763 329 HG2 ARG 42 HG2 ARG 42 7.915 -23.082 -2.495 330 HG3 ARG 42 HG1 ARG 42 7.572 -21.433 -1.969 331 HD2 ARG 42 HD2 ARG 42 9.073 -22.391 -0.395 332 HD3 ARG 42 HD1 ARG 42 7.488 -22.290 0.373 333 HE ARG 42 HE ARG 42 7.590 -24.796 -0.746 334 HH11 ARG 42 HH11 ARG 42 9.443 -23.048 1.695 335 HH12 ARG 42 HH12 ARG 42 9.995 -24.500 2.465 336 HH21 ARG 42 HH21 ARG 42 8.329 -26.690 0.294 337 HH22 ARG 42 HH22 ARG 42 9.365 -26.570 1.675 338 H VAL 43 H VAL 43 6.419 -20.021 0.324 339 HA VAL 43 HA VAL 43 6.233 -18.109 -1.893 340 HB VAL 43 HB VAL 43 6.422 -16.258 -0.237 341 HG11 VAL 43 HG11 VAL 43 4.056 -18.089 0.101 342 HG12 VAL 43 HG12 VAL 43 4.246 -16.810 -1.095 343 HG13 VAL 43 HG13 VAL 43 4.107 -16.404 0.615 344 HG21 VAL 43 HG21 VAL 43 5.942 -16.724 2.141 345 HG22 VAL 43 HG22 VAL 43 7.463 -17.439 1.607 346 HG23 VAL 43 HG23 VAL 43 6.034 -18.452 1.803 347 H ILE 44 H ILE 44 8.056 -17.338 -2.708 348 HA ILE 44 HA ILE 44 10.556 -17.667 -1.194 349 HB ILE 44 HB ILE 44 10.111 -18.238 -4.143 350 HG12 ILE 44 HG12 ILE 44 9.434 -20.080 -2.648 351 HG13 ILE 44 HG11 ILE 44 10.830 -20.516 -3.624 352 HG21 ILE 44 HG21 ILE 44 12.502 -18.781 -4.262 353 HG22 ILE 44 HG22 ILE 44 12.700 -18.231 -2.599 354 HG23 ILE 44 HG23 ILE 44 12.225 -17.087 -3.853 355 HD11 ILE 44 HD11 ILE 44 12.288 -20.078 -1.693 356 HD12 ILE 44 HD12 ILE 44 11.088 -21.327 -1.363 357 HD13 ILE 44 HD13 ILE 44 10.864 -19.701 -0.723 358 H PHE 45 H PHE 45 11.859 -15.909 -1.224 359 HA PHE 45 HA PHE 45 11.332 -13.809 -3.184 360 HB2 PHE 45 HB2 PHE 45 10.043 -13.148 -1.227 361 HB3 PHE 45 HB1 PHE 45 11.455 -13.365 -0.197 362 HD1 PHE 45 HD1 PHE 45 10.249 -11.423 -3.119 363 HD2 PHE 45 HD2 PHE 45 12.859 -11.571 0.236 364 HE1 PHE 45 HE1 PHE 45 10.885 -9.084 -3.517 365 HE2 PHE 45 HE2 PHE 45 13.495 -9.236 -0.157 366 HZ PHE 45 HZ PHE 45 12.512 -7.986 -2.034 367 H ALA 46 H ALA 46 13.136 -13.122 -4.066 368 HA ALA 46 HA ALA 46 15.317 -12.681 -4.490 369 HB1 ALA 46 HB1 ALA 46 15.140 -11.235 -2.519 370 HB2 ALA 46 HB2 ALA 46 16.746 -11.947 -2.653 371 HB3 ALA 46 HB3 ALA 46 15.594 -12.589 -1.485 372 H GLY 47 H GLY 47 14.321 -15.496 -3.839 373 HA2 GLY 47 HA2 GLY 47 15.460 -17.489 -4.386 374 HA3 GLY 47 HA1 GLY 47 16.975 -16.720 -3.944 375 H LYS 48 H LYS 48 14.864 -15.988 -1.536 376 HA LYS 48 HA LYS 48 15.527 -18.412 -0.002 377 HB2 LYS 48 HB2 LYS 48 15.809 -16.945 1.992 378 HB3 LYS 48 HB1 LYS 48 17.035 -16.710 0.756 379 HG2 LYS 48 HG2 LYS 48 16.244 -14.626 0.179 380 HG3 LYS 48 HG1 LYS 48 14.623 -14.956 0.796 381 HD2 LYS 48 HD2 LYS 48 15.363 -14.799 3.035 382 HD3 LYS 48 HD1 LYS 48 17.059 -14.711 2.541 383 HE2 LYS 48 HE2 LYS 48 16.593 -12.561 1.420 384 HE3 LYS 48 HE1 LYS 48 14.916 -12.658 1.953 385 HZ1 LYS 48 HZ1 LYS 48 17.302 -12.447 3.722 386 HZ2 LYS 48 HZ2 LYS 48 15.709 -12.604 4.253 387 HZ3 LYS 48 HZ3 LYS 48 16.175 -11.225 3.408 388 H GLU 49 H GLU 49 14.204 -18.340 2.149 389 HA GLU 49 HA GLU 49 11.456 -17.555 1.468 390 HB2 GLU 49 HB2 GLU 49 11.803 -20.019 1.673 391 HB3 GLU 49 HB1 GLU 49 12.328 -19.774 3.333 392 HG2 GLU 49 HG2 GLU 49 10.132 -18.889 3.912 393 HG3 GLU 49 HG1 GLU 49 9.602 -19.104 2.246 394 H LEU 50 H LEU 50 10.457 -16.216 2.793 395 HA LEU 50 HA LEU 50 11.969 -14.897 4.846 396 HB2 LEU 50 HB2 LEU 50 9.075 -14.460 4.182 397 HB3 LEU 50 HB1 LEU 50 10.197 -13.324 4.904 398 HG LEU 50 HG LEU 50 10.268 -14.314 2.063 399 HD11 LEU 50 HD11 LEU 50 9.650 -12.025 1.486 400 HD12 LEU 50 HD12 LEU 50 9.487 -11.647 3.202 401 HD13 LEU 50 HD13 LEU 50 8.412 -12.826 2.452 402 HD21 LEU 50 HD21 LEU 50 12.510 -13.849 2.883 403 HD22 LEU 50 HD22 LEU 50 11.987 -12.272 3.472 404 HD23 LEU 50 HD23 LEU 50 12.007 -12.603 1.742 405 H ARG 51 H ARG 51 10.735 -14.312 6.918 406 HA ARG 51 HA ARG 51 9.769 -16.805 8.076 407 HB2 ARG 51 HB2 ARG 51 10.174 -15.709 10.294 408 HB3 ARG 51 HB1 ARG 51 11.615 -15.946 9.328 409 HG2 ARG 51 HG2 ARG 51 10.190 -13.330 9.250 410 HG3 ARG 51 HG1 ARG 51 11.243 -13.719 10.610 411 HD2 ARG 51 HD2 ARG 51 13.090 -14.122 9.040 412 HD3 ARG 51 HD1 ARG 51 12.038 -13.698 7.695 413 HE ARG 51 HE ARG 51 12.217 -11.663 9.704 414 HH11 ARG 51 HH11 ARG 51 13.741 -12.976 6.830 415 HH12 ARG 51 HH12 ARG 51 14.504 -11.493 6.399 416 HH21 ARG 51 HH21 ARG 51 13.250 -9.692 9.138 417 HH22 ARG 51 HH22 ARG 51 14.234 -9.619 7.719 418 H ASN 52 H ASN 52 7.835 -17.013 8.991 419 HA ASN 52 HA ASN 52 5.734 -15.493 7.935 420 HB2 ASN 52 HB2 ASN 52 4.258 -16.934 9.137 421 HB3 ASN 52 HB1 ASN 52 5.629 -17.903 8.617 422 HD21 ASN 52 HD21 ASN 52 7.061 -18.700 10.156 423 HD22 ASN 52 HD22 ASN 52 6.703 -18.684 11.848 424 H ASP 53 H ASP 53 7.476 -15.066 10.920 425 HA ASP 53 HA ASP 53 5.315 -13.545 12.129 426 HB2 ASP 53 HB2 ASP 53 6.621 -13.498 14.124 427 HB3 ASP 53 HB1 ASP 53 6.770 -15.116 13.450 428 H TRP 54 H TRP 54 7.194 -12.677 9.756 429 HA TRP 54 HA TRP 54 7.928 -10.070 10.903 430 HB2 TRP 54 HB2 TRP 54 9.746 -11.525 9.912 431 HB3 TRP 54 HB1 TRP 54 8.988 -11.282 8.345 432 HD1 TRP 54 HD1 TRP 54 10.435 -9.635 7.044 433 HE1 TRP 54 HE1 TRP 54 11.648 -7.422 7.553 434 HE3 TRP 54 HE3 TRP 54 9.406 -9.267 12.038 435 HZ2 TRP 54 HZ2 TRP 54 12.101 -5.749 9.769 436 HZ3 TRP 54 HZ3 TRP 54 10.266 -7.323 13.273 437 HH2 TRP 54 HH2 TRP 54 11.586 -5.603 12.159 438 H THR 55 H THR 55 7.682 -8.200 9.436 439 HA THR 55 HA THR 55 5.135 -8.364 8.026 440 HB THR 55 HB THR 55 5.183 -6.603 9.645 441 HG1 THR 55 HG1 THR 55 4.654 -4.895 8.343 442 HG21 THR 55 HG21 THR 55 6.876 -4.819 9.621 443 HG22 THR 55 HG22 THR 55 7.719 -5.650 8.314 444 HG23 THR 55 HG23 THR 55 7.603 -6.400 9.906 445 H VAL 56 H VAL 56 4.852 -7.452 5.933 446 HA VAL 56 HA VAL 56 6.963 -8.156 4.158 447 HB VAL 56 HB VAL 56 4.577 -8.518 3.615 448 HG11 VAL 56 HG11 VAL 56 3.647 -6.482 4.557 449 HG12 VAL 56 HG12 VAL 56 3.174 -6.679 2.871 450 HG13 VAL 56 HG13 VAL 56 4.440 -5.526 3.303 451 HG21 VAL 56 HG21 VAL 56 6.027 -6.728 1.671 452 HG22 VAL 56 HG22 VAL 56 4.675 -7.791 1.275 453 HG23 VAL 56 HG23 VAL 56 6.205 -8.474 1.822 454 H GLN 57 H GLN 57 5.877 -5.161 5.549 455 HA GLN 57 HA GLN 57 7.022 -3.470 3.575 456 HB2 GLN 57 HB2 GLN 57 5.215 -2.732 5.068 457 HB3 GLN 57 HB1 GLN 57 6.313 -2.824 6.435 458 HG2 GLN 57 HG2 GLN 57 6.023 -0.529 5.680 459 HG3 GLN 57 HG1 GLN 57 7.690 -1.067 5.475 460 HE21 GLN 57 HE21 GLN 57 4.720 -0.205 3.849 461 HE22 GLN 57 HE22 GLN 57 5.417 -0.049 2.270 462 H ASN 58 H ASN 58 8.078 -4.476 6.805 463 HA ASN 58 HA ASN 58 10.602 -3.131 6.492 464 HB2 ASN 58 HB2 ASN 58 9.596 -4.974 8.664 465 HB3 ASN 58 HB1 ASN 58 11.161 -4.173 8.692 466 HD21 ASN 58 HD21 ASN 58 11.259 -1.949 8.996 467 HD22 ASN 58 HD22 ASN 58 9.913 -1.052 9.604 468 H CYS 59 H CYS 59 9.402 -5.921 5.289 469 HA CYS 59 HA CYS 59 11.940 -7.356 5.329 470 HB2 CYS 59 HB2 CYS 59 9.635 -8.474 5.576 471 HB3 CYS 59 HB1 CYS 59 9.427 -8.156 3.860 472 HG CYS 59 HG CYS 59 12.106 -9.578 3.555 473 H ASP 60 H ASP 60 9.981 -5.300 3.408 474 HA ASP 60 HA ASP 60 10.241 -4.221 1.463 475 HB2 ASP 60 HB2 ASP 60 13.114 -5.050 1.834 476 HB3 ASP 60 HB1 ASP 60 12.574 -4.045 0.495 477 H LEU 61 H LEU 61 8.835 -5.776 0.517 478 HA LEU 61 HA LEU 61 10.188 -7.623 -1.314 479 HB2 LEU 61 HB2 LEU 61 7.392 -7.517 -0.245 480 HB3 LEU 61 HB1 LEU 61 7.723 -8.363 -1.741 481 HG LEU 61 HG LEU 61 9.387 -9.767 -0.497 482 HD11 LEU 61 HD11 LEU 61 8.179 -8.426 1.907 483 HD12 LEU 61 HD12 LEU 61 9.851 -8.309 1.361 484 HD13 LEU 61 HD13 LEU 61 9.218 -9.849 1.941 485 HD21 LEU 61 HD21 LEU 61 7.675 -11.147 0.625 486 HD22 LEU 61 HD22 LEU 61 7.201 -10.637 -0.993 487 HD23 LEU 61 HD23 LEU 61 6.517 -9.834 0.418 488 H ASP 62 H ASP 62 8.969 -4.564 -1.260 489 HA ASP 62 HA ASP 62 7.783 -4.376 -3.851 490 HB2 ASP 62 HB2 ASP 62 7.531 -2.688 -1.970 491 HB3 ASP 62 HB1 ASP 62 9.188 -2.195 -2.280 492 H GLN 63 H GLN 63 10.933 -3.811 -2.472 493 HA GLN 63 HA GLN 63 12.135 -3.700 -5.158 494 HB2 GLN 63 HB2 GLN 63 13.186 -2.632 -2.530 495 HB3 GLN 63 HB1 GLN 63 14.005 -2.514 -4.081 496 HG2 GLN 63 HG2 GLN 63 12.315 -1.066 -4.936 497 HG3 GLN 63 HG1 GLN 63 11.315 -1.307 -3.504 498 HE21 GLN 63 HE21 GLN 63 12.364 1.141 -4.649 499 HE22 GLN 63 HE22 GLN 63 13.304 1.894 -3.411 500 H GLN 64 H GLN 64 14.644 -4.328 -4.782 501 HA GLN 64 HA GLN 64 16.177 -5.961 -4.450 502 HB2 GLN 64 HB2 GLN 64 14.527 -6.685 -2.017 503 HB3 GLN 64 HB1 GLN 64 16.175 -7.203 -2.337 504 HG2 GLN 64 HG2 GLN 64 15.269 -4.370 -1.859 505 HG3 GLN 64 HG1 GLN 64 16.114 -5.402 -0.707 506 HE21 GLN 64 HE21 GLN 64 18.290 -5.839 -1.023 507 HE22 GLN 64 HE22 GLN 64 19.274 -4.899 -2.086 508 H SEP 65 H SEP 65 14.609 -6.589 -6.397 509 HA SEP 65 HA SEP 65 14.128 -8.326 -7.763 510 HB2 SEP 65 HB1 SEP 65 14.311 -10.681 -6.998 511 HB3 SEP 65 HB2 SEP 65 14.612 -10.102 -5.360 512 H ILE 66 H ILE 66 12.397 -9.964 -8.158 513 HA ILE 66 HA ILE 66 9.948 -8.940 -6.957 514 HB ILE 66 HB ILE 66 10.187 -9.069 -9.450 515 HG12 ILE 66 HG12 ILE 66 7.985 -10.799 -8.320 516 HG13 ILE 66 HG11 ILE 66 7.966 -9.041 -8.400 517 HG21 ILE 66 HG21 ILE 66 9.915 -11.247 -10.536 518 HG22 ILE 66 HG22 ILE 66 10.114 -12.035 -8.967 519 HG23 ILE 66 HG23 ILE 66 11.446 -11.103 -9.667 520 HD11 ILE 66 HD11 ILE 66 6.643 -10.104 -10.177 521 HD12 ILE 66 HD12 ILE 66 8.110 -10.869 -10.786 522 HD13 ILE 66 HD13 ILE 66 7.957 -9.113 -10.808 523 H VAL 67 H VAL 67 8.253 -10.403 -6.255 524 HA VAL 67 HA VAL 67 9.325 -12.527 -4.615 525 HB VAL 67 HB VAL 67 6.421 -11.762 -4.926 526 HG11 VAL 67 HG11 VAL 67 6.817 -13.840 -3.735 527 HG12 VAL 67 HG12 VAL 67 6.223 -12.599 -2.631 528 HG13 VAL 67 HG13 VAL 67 7.935 -13.021 -2.643 529 HG21 VAL 67 HG21 VAL 67 8.429 -10.533 -3.039 530 HG22 VAL 67 HG22 VAL 67 6.697 -10.201 -3.076 531 HG23 VAL 67 HG23 VAL 67 7.714 -9.742 -4.442 532 H HIS 68 H HIS 68 9.026 -14.692 -4.881 533 HA HIS 68 HA HIS 68 7.540 -15.573 -7.275 534 HB2 HIS 68 HB2 HIS 68 9.910 -16.858 -5.890 535 HB3 HIS 68 HB1 HIS 68 9.004 -17.604 -7.195 536 HD2 HIS 68 HD2 HIS 68 9.387 -14.045 -8.205 537 HE1 HIS 68 HE1 HIS 68 12.861 -16.009 -9.606 538 HE2 HIS 68 HE2 HIS 68 11.579 -13.832 -9.580 539 H ILE 69 H ILE 69 5.727 -16.687 -6.845 540 HA ILE 69 HA ILE 69 5.636 -18.189 -4.320 541 HB ILE 69 HB ILE 69 3.378 -16.641 -5.606 542 HG12 ILE 69 HG12 ILE 69 4.803 -16.402 -2.950 543 HG13 ILE 69 HG11 ILE 69 4.839 -15.252 -4.278 544 HG21 ILE 69 HG21 ILE 69 1.960 -17.481 -3.788 545 HG22 ILE 69 HG22 ILE 69 3.284 -18.509 -3.237 546 HG23 ILE 69 HG23 ILE 69 2.547 -18.792 -4.814 547 HD11 ILE 69 HD11 ILE 69 2.425 -14.862 -3.951 548 HD12 ILE 69 HD12 ILE 69 3.406 -14.426 -2.551 549 HD13 ILE 69 HD13 ILE 69 2.477 -15.927 -2.546 550 H VAL 70 H VAL 70 5.462 -20.269 -4.610 551 HA VAL 70 HA VAL 70 4.438 -21.188 -7.192 552 HB VAL 70 HB VAL 70 6.366 -22.582 -5.323 553 HG11 VAL 70 HG11 VAL 70 4.964 -24.166 -6.551 554 HG12 VAL 70 HG12 VAL 70 6.637 -24.221 -7.102 555 HG13 VAL 70 HG13 VAL 70 5.418 -23.393 -8.070 556 HG21 VAL 70 HG21 VAL 70 8.018 -22.180 -7.109 557 HG22 VAL 70 HG22 VAL 70 7.396 -20.680 -6.420 558 HG23 VAL 70 HG23 VAL 70 6.813 -21.240 -7.989 559 H GLN 71 H GLN 71 2.752 -22.505 -7.266 560 HA GLN 71 HA GLN 71 1.943 -24.041 -4.951 561 HB2 GLN 71 HB2 GLN 71 0.708 -21.982 -4.648 562 HB3 GLN 71 HB1 GLN 71 0.184 -22.013 -6.322 563 HG2 GLN 71 HG2 GLN 71 -1.589 -22.678 -4.776 564 HG3 GLN 71 HG1 GLN 71 -1.174 -23.964 -5.906 565 HE21 GLN 71 HE21 GLN 71 -1.970 -25.577 -4.605 566 HE22 GLN 71 HE22 GLN 71 -1.208 -26.051 -3.129 567 H ARG 72 H ARG 72 1.051 -25.952 -5.526 568 HA ARG 72 HA ARG 72 0.864 -26.560 -8.355 569 HB2 ARG 72 HB2 ARG 72 1.915 -28.153 -6.734 570 HB3 ARG 72 HB1 ARG 72 0.350 -28.331 -5.954 571 HG2 ARG 72 HG2 ARG 72 -0.551 -29.150 -8.143 572 HG3 ARG 72 HG1 ARG 72 1.110 -29.161 -8.743 573 HD2 ARG 72 HD2 ARG 72 0.071 -30.708 -6.369 574 HD3 ARG 72 HD1 ARG 72 0.406 -31.372 -7.966 575 HE ARG 72 HE ARG 72 2.740 -30.150 -7.054 576 HH11 ARG 72 HH11 ARG 72 0.684 -32.863 -6.206 577 HH12 ARG 72 HH12 ARG 72 1.962 -33.783 -5.493 578 HH21 ARG 72 HH21 ARG 72 4.458 -31.399 -6.114 579 HH22 ARG 72 HH22 ARG 72 4.106 -32.956 -5.445 580 HA PRO 73 HA PRO 73 -3.495 -25.401 -8.068 581 HB2 PRO 73 HB2 PRO 73 -3.554 -26.391 -10.849 582 HB3 PRO 73 HB1 PRO 73 -4.000 -24.804 -10.216 583 HG2 PRO 73 HG2 PRO 73 -1.771 -25.166 -11.649 584 HG3 PRO 73 HG1 PRO 73 -1.838 -24.012 -10.304 585 HD2 PRO 73 HD2 PRO 73 -0.641 -26.752 -10.395 586 HD3 PRO 73 HD1 PRO 73 -0.038 -25.281 -9.599 587 H TRP 74 H TRP 74 -4.367 -26.947 -6.777 588 HA TRP 74 HA TRP 74 -4.576 -29.685 -7.674 589 HB2 TRP 74 HB2 TRP 74 -4.201 -28.929 -5.245 590 HB3 TRP 74 HB1 TRP 74 -5.908 -28.497 -5.236 591 HD1 TRP 74 HD1 TRP 74 -3.704 -31.625 -5.841 592 HE1 TRP 74 HE1 TRP 74 -5.020 -33.694 -5.064 593 HE3 TRP 74 HE3 TRP 74 -8.101 -29.361 -4.559 594 HZ2 TRP 74 HZ2 TRP 74 -7.579 -34.287 -4.043 595 HZ3 TRP 74 HZ3 TRP 74 -9.931 -30.752 -3.691 596 HH2 TRP 74 HH2 TRP 74 -9.674 -33.160 -3.438 597 H ARG 75 H ARG 75 -6.470 -26.814 -7.561 598 HA ARG 75 HA ARG 75 -8.644 -28.233 -8.926 599 HB2 ARG 75 HB2 ARG 75 -8.937 -25.943 -6.975 600 HB3 ARG 75 HB1 ARG 75 -10.241 -26.616 -7.940 601 HG2 ARG 75 HG2 ARG 75 -9.852 -28.799 -6.815 602 HG3 ARG 75 HG1 ARG 75 -8.689 -27.980 -5.770 603 HD2 ARG 75 HD2 ARG 75 -10.429 -26.482 -4.979 604 HD3 ARG 75 HD1 ARG 75 -11.599 -27.253 -6.050 605 HE ARG 75 HE ARG 75 -10.426 -28.386 -3.624 606 HH11 ARG 75 HH11 ARG 75 -12.637 -28.710 -6.339 607 HH12 ARG 75 HH12 ARG 75 -13.507 -30.032 -5.641 608 HH21 ARG 75 HH21 ARG 75 -11.594 -30.146 -2.697 609 HH22 ARG 75 HH22 ARG 75 -12.916 -30.847 -3.561 610 H LYS 76 H LYS 76 -7.496 -27.661 -10.839 611 HA LYS 76 HA LYS 76 -7.654 -24.817 -11.510 612 HB2 LYS 76 HB2 LYS 76 -6.064 -25.413 -13.366 613 HB3 LYS 76 HB1 LYS 76 -5.414 -25.591 -11.750 614 HG2 LYS 76 HG2 LYS 76 -5.609 -27.969 -11.839 615 HG3 LYS 76 HG1 LYS 76 -6.509 -27.890 -13.355 616 HD2 LYS 76 HD2 LYS 76 -3.653 -26.997 -12.973 617 HD3 LYS 76 HD1 LYS 76 -4.156 -28.529 -13.694 618 HE2 LYS 76 HE2 LYS 76 -5.346 -27.293 -15.450 619 HE3 LYS 76 HE1 LYS 76 -4.820 -25.774 -14.732 620 HZ1 LYS 76 HZ1 LYS 76 -2.532 -26.408 -15.160 621 HZ2 LYS 76 HZ2 LYS 76 -3.431 -26.385 -16.590 622 HZ3 LYS 76 HZ3 LYS 76 -3.042 -27.859 -15.866 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 2.689 0.523 0.755 2 H2 MET 1 HT2 MET 1 2.369 -1.140 0.695 3 H3 MET 1 HT3 MET 1 1.329 -0.051 -0.063 4 HA MET 1 HA MET 1 2.950 0.570 -1.643 5 HB2 MET 1 HB2 MET 1 5.153 -0.389 -1.712 6 HB3 MET 1 HB1 MET 1 4.905 0.287 -0.112 7 HG2 MET 1 HG2 MET 1 4.499 -1.936 0.786 8 HG3 MET 1 HG1 MET 1 4.676 -2.631 -0.825 9 HE1 MET 1 HE1 MET 1 6.498 -4.332 -0.081 10 HE2 MET 1 HE2 MET 1 6.400 -3.785 1.594 11 HE3 MET 1 HE3 MET 1 7.969 -3.908 0.794 12 H ILE 2 H ILE 2 3.169 -0.573 -3.601 13 HA ILE 2 HA ILE 2 1.742 -3.138 -3.602 14 HB ILE 2 HB ILE 2 2.175 -1.169 -5.864 15 HG12 ILE 2 HG12 ILE 2 -0.311 -1.878 -4.293 16 HG13 ILE 2 HG11 ILE 2 0.572 -0.359 -4.203 17 HG21 ILE 2 HG21 ILE 2 2.107 -3.458 -6.695 18 HG22 ILE 2 HG22 ILE 2 0.638 -2.593 -7.148 19 HG23 ILE 2 HG23 ILE 2 0.606 -3.747 -5.815 20 HD11 ILE 2 HD11 ILE 2 -0.904 -1.419 -6.601 21 HD12 ILE 2 HD12 ILE 2 0.007 0.088 -6.541 22 HD13 ILE 2 HD13 ILE 2 -1.428 -0.114 -5.538 23 H VAL 3 H VAL 3 2.780 -4.924 -4.177 24 HA VAL 3 HA VAL 3 5.388 -4.632 -5.509 25 HB VAL 3 HB VAL 3 6.140 -6.680 -4.321 26 HG11 VAL 3 HG11 VAL 3 6.757 -4.497 -3.451 27 HG12 VAL 3 HG12 VAL 3 6.500 -5.638 -2.131 28 HG13 VAL 3 HG13 VAL 3 5.267 -4.434 -2.509 29 HG21 VAL 3 HG21 VAL 3 3.585 -6.358 -2.740 30 HG22 VAL 3 HG22 VAL 3 4.890 -7.481 -2.363 31 HG23 VAL 3 HG23 VAL 3 3.960 -7.677 -3.848 32 H PHE 4 H PHE 4 5.896 -6.164 -7.083 33 HA PHE 4 HA PHE 4 3.603 -7.389 -8.326 34 HB2 PHE 4 HB2 PHE 4 6.521 -7.390 -9.120 35 HB3 PHE 4 HB1 PHE 4 5.217 -8.063 -10.088 36 HD1 PHE 4 HD1 PHE 4 7.319 -5.423 -9.925 37 HD2 PHE 4 HD2 PHE 4 3.152 -6.215 -10.206 38 HE1 PHE 4 HE1 PHE 4 6.978 -3.231 -10.978 39 HE2 PHE 4 HE2 PHE 4 2.802 -4.031 -11.260 40 HZ PHE 4 HZ PHE 4 4.715 -2.527 -11.650 41 H VAL 5 H VAL 5 3.070 -9.492 -8.294 42 HA VAL 5 HA VAL 5 4.975 -11.375 -7.082 43 HB VAL 5 HB VAL 5 2.020 -11.141 -6.452 44 HG11 VAL 5 HG11 VAL 5 2.338 -13.021 -4.941 45 HG12 VAL 5 HG12 VAL 5 4.005 -13.192 -5.494 46 HG13 VAL 5 HG13 VAL 5 2.668 -13.480 -6.611 47 HG21 VAL 5 HG21 VAL 5 3.413 -9.522 -5.272 48 HG22 VAL 5 HG22 VAL 5 4.435 -10.831 -4.683 49 HG23 VAL 5 HG23 VAL 5 2.754 -10.726 -4.165 50 H ARG 6 H ARG 6 5.214 -13.206 -8.186 51 HA ARG 6 HA ARG 6 3.256 -13.776 -10.301 52 HB2 ARG 6 HB2 ARG 6 5.069 -15.062 -11.422 53 HB3 ARG 6 HB1 ARG 6 5.423 -13.351 -11.265 54 HG2 ARG 6 HG2 ARG 6 6.964 -13.750 -9.503 55 HG3 ARG 6 HG1 ARG 6 6.470 -15.438 -9.378 56 HD2 ARG 6 HD2 ARG 6 8.598 -15.219 -10.578 57 HD3 ARG 6 HD1 ARG 6 7.336 -15.882 -11.612 58 HE ARG 6 HE ARG 6 7.717 -13.019 -11.770 59 HH11 ARG 6 HH11 ARG 6 8.547 -16.143 -13.134 60 HH12 ARG 6 HH12 ARG 6 9.003 -15.491 -14.668 61 HH21 ARG 6 HH21 ARG 6 8.335 -12.164 -13.814 62 HH22 ARG 6 HH22 ARG 6 8.862 -13.237 -15.058 63 H PHE 7 H PHE 7 2.012 -15.455 -10.031 64 HA PHE 7 HA PHE 7 2.694 -17.369 -7.933 65 HB2 PHE 7 HB2 PHE 7 0.466 -16.248 -7.890 66 HB3 PHE 7 HB1 PHE 7 0.078 -17.032 -9.418 67 HD1 PHE 7 HD1 PHE 7 0.585 -17.502 -5.838 68 HD2 PHE 7 HD2 PHE 7 -0.417 -19.403 -9.509 69 HE1 PHE 7 HE1 PHE 7 -0.222 -19.455 -4.599 70 HE2 PHE 7 HE2 PHE 7 -1.228 -21.370 -8.273 71 HZ PHE 7 HZ PHE 7 -1.126 -21.401 -5.813 72 H ASN 8 H ASN 8 3.393 -19.335 -8.377 73 HA ASN 8 HA ASN 8 3.941 -21.261 -9.474 74 HB2 ASN 8 HB2 ASN 8 1.402 -21.328 -9.704 75 HB3 ASN 8 HB1 ASN 8 1.606 -20.665 -11.317 76 HD21 ASN 8 HD21 ASN 8 2.205 -22.013 -12.966 77 HD22 ASN 8 HD22 ASN 8 2.419 -23.718 -12.777 78 H SER 9 H SER 9 4.890 -18.585 -10.351 79 HA SER 9 HA SER 9 6.144 -17.551 -11.902 80 HB2 SER 9 HB2 SER 9 7.713 -18.983 -13.232 81 HB3 SER 9 HB1 SER 9 7.708 -19.346 -11.512 82 HG SER 9 HG SER 9 5.903 -20.924 -12.548 83 H SER 10 H SER 10 3.336 -18.506 -12.705 84 HA SER 10 HA SER 10 3.591 -18.620 -15.593 85 HB2 SER 10 HB2 SER 10 1.038 -18.566 -13.988 86 HB3 SER 10 HB1 SER 10 1.283 -19.189 -15.620 87 HG SER 10 HG SER 10 2.888 -20.642 -14.416 88 H HIS 11 H HIS 11 1.482 -16.743 -13.432 89 HA HIS 11 HA HIS 11 1.777 -14.467 -15.262 90 HB2 HIS 11 HB2 HIS 11 -0.520 -13.795 -14.304 91 HB3 HIS 11 HB1 HIS 11 -0.474 -15.132 -15.447 92 HD2 HIS 11 HD2 HIS 11 -0.678 -14.701 -11.525 93 HE1 HIS 11 HE1 HIS 11 -2.573 -18.296 -12.699 94 HE2 HIS 11 HE2 HIS 11 -2.208 -16.669 -10.797 95 H GLY 12 H GLY 12 1.727 -12.355 -14.343 96 HA2 GLY 12 HA2 GLY 12 2.562 -12.310 -11.512 97 HA3 GLY 12 HA1 GLY 12 3.355 -11.342 -12.747 98 H PHE 13 H PHE 13 1.279 -11.159 -10.280 99 HA PHE 13 HA PHE 13 -0.168 -8.906 -11.485 100 HB2 PHE 13 HB2 PHE 13 -2.007 -9.453 -9.790 101 HB3 PHE 13 HB1 PHE 13 -1.852 -10.530 -11.171 102 HD1 PHE 13 HD1 PHE 13 -1.221 -10.181 -7.552 103 HD2 PHE 13 HD2 PHE 13 -1.299 -12.816 -10.887 104 HE1 PHE 13 HE1 PHE 13 -1.064 -12.108 -6.029 105 HE2 PHE 13 HE2 PHE 13 -1.138 -14.747 -9.372 106 HZ PHE 13 HZ PHE 13 -1.021 -14.394 -6.944 107 HA PRO 14 HA PRO 14 1.506 -6.565 -8.139 108 HB2 PRO 14 HB2 PRO 14 -0.113 -4.422 -8.176 109 HB3 PRO 14 HB1 PRO 14 1.020 -4.752 -9.492 110 HG2 PRO 14 HG2 PRO 14 -1.924 -5.240 -9.359 111 HG3 PRO 14 HG1 PRO 14 -0.947 -4.651 -10.714 112 HD2 PRO 14 HD2 PRO 14 -1.806 -7.257 -10.419 113 HD3 PRO 14 HD1 PRO 14 -0.403 -6.765 -11.383 114 H VAL 15 H VAL 15 1.322 -6.787 -6.003 115 HA VAL 15 HA VAL 15 -1.368 -7.106 -4.846 116 HB VAL 15 HB VAL 15 1.260 -8.227 -3.821 117 HG11 VAL 15 HG11 VAL 15 -0.097 -9.397 -2.161 118 HG12 VAL 15 HG12 VAL 15 -1.546 -8.605 -2.775 119 HG13 VAL 15 HG13 VAL 15 -0.280 -7.650 -2.005 120 HG21 VAL 15 HG21 VAL 15 0.485 -9.400 -5.804 121 HG22 VAL 15 HG22 VAL 15 -1.108 -9.609 -5.078 122 HG23 VAL 15 HG23 VAL 15 0.294 -10.414 -4.374 123 H GLU 16 H GLU 16 -2.006 -5.521 -3.561 124 HA GLU 16 HA GLU 16 -0.082 -3.540 -2.653 125 HB2 GLU 16 HB2 GLU 16 -2.203 -2.813 -3.706 126 HB3 GLU 16 HB1 GLU 16 -3.095 -3.582 -2.401 127 HG2 GLU 16 HG2 GLU 16 -2.063 -2.060 -0.794 128 HG3 GLU 16 HG1 GLU 16 -1.170 -1.287 -2.104 129 H VAL 17 H VAL 17 0.828 -3.688 -0.723 130 HA VAL 17 HA VAL 17 -0.632 -5.124 1.390 131 HB VAL 17 HB VAL 17 1.480 -5.856 2.335 132 HG11 VAL 17 HG11 VAL 17 1.257 -6.497 -0.597 133 HG12 VAL 17 HG12 VAL 17 0.439 -7.325 0.728 134 HG13 VAL 17 HG13 VAL 17 2.195 -7.416 0.579 135 HG21 VAL 17 HG21 VAL 17 2.770 -4.449 -0.002 136 HG22 VAL 17 HG22 VAL 17 3.600 -5.527 1.123 137 HG23 VAL 17 HG23 VAL 17 2.907 -4.013 1.704 138 H ASP 18 H ASP 18 -0.142 -4.489 3.566 139 HA ASP 18 HA ASP 18 0.135 -1.592 3.808 140 HB2 ASP 18 HB2 ASP 18 -1.860 -2.552 4.797 141 HB3 ASP 18 HB1 ASP 18 -0.911 -3.736 5.676 142 H SER 19 H SER 19 1.364 -0.787 5.724 143 HA SER 19 HA SER 19 4.018 -1.679 5.717 144 HB2 SER 19 HB2 SER 19 4.267 -0.124 7.668 145 HB3 SER 19 HB1 SER 19 3.479 0.606 6.269 146 HG SER 19 HG SER 19 2.264 -0.346 8.662 147 H ASP 20 H ASP 20 1.270 -2.700 7.538 148 HA ASP 20 HA ASP 20 3.026 -4.186 9.366 149 HB2 ASP 20 HB2 ASP 20 0.210 -3.174 9.774 150 HB3 ASP 20 HB1 ASP 20 1.038 -4.254 10.891 151 H THR 21 H THR 21 1.832 -4.829 6.596 152 HA THR 21 HA THR 21 0.142 -7.076 7.112 153 HB THR 21 HB THR 21 1.660 -6.231 4.629 154 HG1 THR 21 HG1 THR 21 -0.912 -5.832 5.653 155 HG21 THR 21 HG21 THR 21 0.329 -7.883 3.404 156 HG22 THR 21 HG22 THR 21 -0.391 -8.440 4.917 157 HG23 THR 21 HG23 THR 21 1.333 -8.671 4.620 158 H SER 22 H SER 22 0.905 -8.785 8.149 159 HA SER 22 HA SER 22 3.656 -9.476 8.194 160 HB2 SER 22 HB2 SER 22 1.264 -11.123 9.027 161 HB3 SER 22 HB1 SER 22 2.937 -11.370 9.528 162 HG SER 22 HG SER 22 2.350 -10.135 11.130 163 H ILE 23 H ILE 23 4.661 -11.315 7.295 164 HA ILE 23 HA ILE 23 4.065 -11.892 4.632 165 HB ILE 23 HB ILE 23 5.642 -13.659 6.526 166 HG12 ILE 23 HG12 ILE 23 6.494 -11.377 6.606 167 HG13 ILE 23 HG11 ILE 23 7.625 -12.413 5.745 168 HG21 ILE 23 HG21 ILE 23 6.849 -14.368 4.491 169 HG22 ILE 23 HG22 ILE 23 5.751 -13.396 3.518 170 HG23 ILE 23 HG23 ILE 23 5.134 -14.777 4.423 171 HD11 ILE 23 HD11 ILE 23 5.696 -10.447 4.533 172 HD12 ILE 23 HD12 ILE 23 6.713 -11.555 3.614 173 HD13 ILE 23 HD13 ILE 23 7.453 -10.309 4.618 174 H PHE 24 H PHE 24 3.095 -13.522 7.582 175 HA PHE 24 HA PHE 24 1.959 -15.844 6.523 176 HB2 PHE 24 HB2 PHE 24 2.268 -15.470 8.939 177 HB3 PHE 24 HB1 PHE 24 1.058 -14.200 8.899 178 HD1 PHE 24 HD1 PHE 24 1.284 -17.742 7.739 179 HD2 PHE 24 HD2 PHE 24 -0.943 -14.780 9.826 180 HE1 PHE 24 HE1 PHE 24 -0.465 -19.399 8.216 181 HE2 PHE 24 HE2 PHE 24 -2.696 -16.432 10.307 182 HZ PHE 24 HZ PHE 24 -2.460 -18.747 9.503 183 H GLN 25 H GLN 25 0.547 -12.651 7.076 184 HA GLN 25 HA GLN 25 -2.033 -13.292 6.094 185 HB2 GLN 25 HB2 GLN 25 -0.683 -10.592 6.310 186 HB3 GLN 25 HB1 GLN 25 -2.404 -10.864 6.075 187 HG2 GLN 25 HG2 GLN 25 -0.791 -11.657 8.488 188 HG3 GLN 25 HG1 GLN 25 -1.923 -10.309 8.381 189 HE21 GLN 25 HE21 GLN 25 -1.902 -12.647 10.136 190 HE22 GLN 25 HE22 GLN 25 -3.426 -13.431 9.893 191 H LEU 26 H LEU 26 0.823 -11.781 4.653 192 HA LEU 26 HA LEU 26 -0.231 -11.156 2.151 193 HB2 LEU 26 HB2 LEU 26 1.941 -10.359 2.821 194 HB3 LEU 26 HB1 LEU 26 2.554 -11.995 2.947 195 HG LEU 26 HG LEU 26 2.373 -12.256 0.512 196 HD11 LEU 26 HD11 LEU 26 1.930 -10.287 -0.889 197 HD12 LEU 26 HD12 LEU 26 1.490 -9.378 0.557 198 HD13 LEU 26 HD13 LEU 26 0.525 -10.768 0.063 199 HD21 LEU 26 HD21 LEU 26 3.903 -9.814 1.386 200 HD22 LEU 26 HD22 LEU 26 4.188 -10.730 -0.093 201 HD23 LEU 26 HD23 LEU 26 4.464 -11.483 1.479 202 H LYS 27 H LYS 27 1.245 -14.149 3.312 203 HA LYS 27 HA LYS 27 1.172 -15.624 0.947 204 HB2 LYS 27 HB2 LYS 27 2.308 -16.314 3.059 205 HB3 LYS 27 HB1 LYS 27 0.726 -16.643 3.755 206 HG2 LYS 27 HG2 LYS 27 0.341 -18.329 1.991 207 HG3 LYS 27 HG1 LYS 27 1.977 -18.043 1.401 208 HD2 LYS 27 HD2 LYS 27 1.974 -20.002 2.808 209 HD3 LYS 27 HD1 LYS 27 2.845 -18.705 3.628 210 HE2 LYS 27 HE2 LYS 27 0.985 -18.266 5.063 211 HE3 LYS 27 HE1 LYS 27 -0.060 -19.335 4.129 212 HZ1 LYS 27 HZ1 LYS 27 2.280 -20.154 5.767 213 HZ2 LYS 27 HZ2 LYS 27 1.372 -21.194 4.806 214 HZ3 LYS 27 HZ3 LYS 27 0.656 -20.433 6.128 215 H GLU 28 H GLU 28 -1.238 -15.286 3.525 216 HA GLU 28 HA GLU 28 -3.151 -16.991 2.370 217 HB2 GLU 28 HB2 GLU 28 -3.301 -14.835 4.435 218 HB3 GLU 28 HB1 GLU 28 -4.739 -15.694 3.908 219 HG2 GLU 28 HG2 GLU 28 -3.461 -17.819 4.518 220 HG3 GLU 28 HG1 GLU 28 -2.341 -16.746 5.360 221 H VAL 29 H VAL 29 -2.629 -13.501 2.118 222 HA VAL 29 HA VAL 29 -4.978 -12.833 0.756 223 HB VAL 29 HB VAL 29 -2.227 -11.578 0.502 224 HG11 VAL 29 HG11 VAL 29 -3.383 -9.615 -0.421 225 HG12 VAL 29 HG12 VAL 29 -4.901 -10.515 -0.416 226 HG13 VAL 29 HG13 VAL 29 -3.573 -11.030 -1.456 227 HG21 VAL 29 HG21 VAL 29 -3.145 -9.866 2.006 228 HG22 VAL 29 HG22 VAL 29 -3.154 -11.465 2.752 229 HG23 VAL 29 HG23 VAL 29 -4.650 -10.779 2.117 230 H VAL 30 H VAL 30 -1.816 -13.797 -0.551 231 HA VAL 30 HA VAL 30 -2.678 -13.734 -3.258 232 HB VAL 30 HB VAL 30 -0.330 -15.221 -2.052 233 HG11 VAL 30 HG11 VAL 30 0.588 -15.199 -4.326 234 HG12 VAL 30 HG12 VAL 30 -0.892 -14.443 -4.915 235 HG13 VAL 30 HG13 VAL 30 -0.937 -16.079 -4.260 236 HG21 VAL 30 HG21 VAL 30 0.992 -13.289 -2.783 237 HG22 VAL 30 HG22 VAL 30 -0.245 -12.816 -1.619 238 HG23 VAL 30 HG23 VAL 30 -0.481 -12.491 -3.335 239 H ALA 31 H ALA 31 -2.512 -16.265 -0.808 240 HA ALA 31 HA ALA 31 -3.131 -18.451 -2.463 241 HB1 ALA 31 HB1 ALA 31 -2.292 -18.663 -0.158 242 HB2 ALA 31 HB2 ALA 31 -3.755 -19.607 -0.429 243 HB3 ALA 31 HB3 ALA 31 -3.842 -18.075 0.440 244 H LYS 32 H LYS 32 -5.189 -16.281 -0.573 245 HA LYS 32 HA LYS 32 -7.648 -17.473 -1.263 246 HB2 LYS 32 HB2 LYS 32 -7.149 -15.935 0.655 247 HB3 LYS 32 HB1 LYS 32 -7.084 -14.617 -0.500 248 HG2 LYS 32 HG2 LYS 32 -9.440 -15.182 -1.126 249 HG3 LYS 32 HG1 LYS 32 -9.456 -16.291 0.249 250 HD2 LYS 32 HD2 LYS 32 -8.856 -13.352 0.353 251 HD3 LYS 32 HD1 LYS 32 -10.386 -14.096 0.841 252 HE2 LYS 32 HE2 LYS 32 -7.670 -14.563 2.098 253 HE3 LYS 32 HE1 LYS 32 -8.971 -13.598 2.785 254 HZ1 LYS 32 HZ1 LYS 32 -9.108 -16.517 2.248 255 HZ2 LYS 32 HZ2 LYS 32 -10.319 -15.580 2.972 256 HZ3 LYS 32 HZ3 LYS 32 -8.845 -15.809 3.759 257 H ARG 33 H ARG 33 -5.666 -14.926 -2.619 258 HA ARG 33 HA ARG 33 -7.394 -13.830 -4.498 259 HB2 ARG 33 HB2 ARG 33 -4.878 -13.310 -3.738 260 HB3 ARG 33 HB1 ARG 33 -4.515 -14.210 -5.200 261 HG2 ARG 33 HG2 ARG 33 -6.311 -11.796 -5.142 262 HG3 ARG 33 HG1 ARG 33 -4.578 -11.715 -5.427 263 HD2 ARG 33 HD2 ARG 33 -4.892 -13.221 -7.382 264 HD3 ARG 33 HD1 ARG 33 -6.635 -13.127 -7.119 265 HE ARG 33 HE ARG 33 -5.575 -10.527 -7.279 266 HH11 ARG 33 HH11 ARG 33 -6.244 -13.271 -9.379 267 HH12 ARG 33 HH12 ARG 33 -6.433 -12.288 -10.787 268 HH21 ARG 33 HH21 ARG 33 -5.826 -9.253 -9.159 269 HH22 ARG 33 HH22 ARG 33 -6.196 -10.021 -10.667 270 H GLN 34 H GLN 34 -5.249 -16.622 -4.673 271 HA GLN 34 HA GLN 34 -6.017 -17.200 -7.422 272 HB2 GLN 34 HB2 GLN 34 -4.077 -18.556 -5.556 273 HB3 GLN 34 HB1 GLN 34 -4.344 -19.014 -7.231 274 HG2 GLN 34 HG2 GLN 34 -3.386 -16.310 -6.337 275 HG3 GLN 34 HG1 GLN 34 -2.332 -17.616 -6.872 276 HE21 GLN 34 HE21 GLN 34 -4.632 -15.225 -7.817 277 HE22 GLN 34 HE22 GLN 34 -4.381 -15.359 -9.521 278 H GLY 35 H GLY 35 -7.031 -18.055 -4.304 279 HA2 GLY 35 HA2 GLY 35 -8.676 -19.524 -3.625 280 HA3 GLY 35 HA1 GLY 35 -8.911 -19.966 -5.312 281 H VAL 36 H VAL 36 -6.059 -20.145 -3.239 282 HA VAL 36 HA VAL 36 -6.002 -23.065 -3.634 283 HB VAL 36 HB VAL 36 -3.551 -22.973 -3.834 284 HG11 VAL 36 HG11 VAL 36 -4.861 -22.941 -5.880 285 HG12 VAL 36 HG12 VAL 36 -3.394 -21.982 -6.070 286 HG13 VAL 36 HG13 VAL 36 -4.945 -21.180 -5.817 287 HG21 VAL 36 HG21 VAL 36 -3.889 -19.973 -3.814 288 HG22 VAL 36 HG22 VAL 36 -2.382 -20.839 -4.119 289 HG23 VAL 36 HG23 VAL 36 -3.154 -20.937 -2.534 290 HA PRO 37 HA PRO 37 -5.357 -23.356 0.748 291 HB2 PRO 37 HB2 PRO 37 -3.544 -25.400 0.928 292 HB3 PRO 37 HB1 PRO 37 -5.260 -25.647 0.588 293 HG2 PRO 37 HG2 PRO 37 -2.945 -25.568 -1.304 294 HG3 PRO 37 HG1 PRO 37 -4.337 -26.667 -1.282 295 HD2 PRO 37 HD2 PRO 37 -4.186 -24.586 -2.982 296 HD3 PRO 37 HD1 PRO 37 -5.728 -25.131 -2.295 297 H ALA 38 H ALA 38 -4.282 -21.883 1.875 298 HA ALA 38 HA ALA 38 -1.740 -20.868 1.077 299 HB1 ALA 38 HB1 ALA 38 -3.284 -20.351 3.612 300 HB2 ALA 38 HB2 ALA 38 -3.459 -19.462 2.099 301 HB3 ALA 38 HB3 ALA 38 -1.939 -19.393 2.989 302 H ASP 39 H ASP 39 -2.734 -23.408 3.123 303 HA ASP 39 HA ASP 39 -0.632 -23.443 4.986 304 HB2 ASP 39 HB2 ASP 39 -2.651 -24.783 5.278 305 HB3 ASP 39 HB1 ASP 39 -2.222 -25.760 3.878 306 H GLN 40 H GLN 40 -0.947 -24.986 1.823 307 HA GLN 40 HA GLN 40 1.816 -25.923 2.012 308 HB2 GLN 40 HB2 GLN 40 -0.492 -26.640 0.234 309 HB3 GLN 40 HB1 GLN 40 1.154 -27.089 -0.190 310 HG2 GLN 40 HG2 GLN 40 -0.106 -27.811 2.437 311 HG3 GLN 40 HG1 GLN 40 -0.208 -28.836 1.005 312 HE21 GLN 40 HE21 GLN 40 1.633 -29.838 0.249 313 HE22 GLN 40 HE22 GLN 40 3.054 -30.037 1.207 314 H LEU 41 H LEU 41 0.864 -23.108 1.464 315 HA LEU 41 HA LEU 41 2.004 -22.713 -1.191 316 HB2 LEU 41 HB2 LEU 41 -0.149 -21.601 -0.532 317 HB3 LEU 41 HB1 LEU 41 0.758 -20.669 0.644 318 HG LEU 41 HG LEU 41 2.094 -19.701 -1.203 319 HD11 LEU 41 HD11 LEU 41 0.126 -21.162 -2.954 320 HD12 LEU 41 HD12 LEU 41 1.850 -21.508 -2.810 321 HD13 LEU 41 HD13 LEU 41 1.315 -19.978 -3.495 322 HD21 LEU 41 HD21 LEU 41 0.351 -18.224 -2.035 323 HD22 LEU 41 HD22 LEU 41 0.130 -18.535 -0.312 324 HD23 LEU 41 HD23 LEU 41 -0.884 -19.361 -1.496 325 H ARG 42 H ARG 42 3.953 -21.707 -1.511 326 HA ARG 42 HA ARG 42 5.372 -20.872 0.924 327 HB2 ARG 42 HB2 ARG 42 6.142 -23.083 0.126 328 HB3 ARG 42 HB1 ARG 42 6.556 -22.361 -1.422 329 HG2 ARG 42 HG2 ARG 42 8.508 -22.686 0.065 330 HG3 ARG 42 HG1 ARG 42 8.249 -21.000 -0.403 331 HD2 ARG 42 HD2 ARG 42 8.818 -21.417 2.037 332 HD3 ARG 42 HD1 ARG 42 7.394 -20.431 1.717 333 HE ARG 42 HE ARG 42 6.492 -23.030 1.971 334 HH11 ARG 42 HH11 ARG 42 8.234 -20.781 4.013 335 HH12 ARG 42 HH12 ARG 42 7.518 -21.347 5.479 336 HH21 ARG 42 HH21 ARG 42 5.523 -23.791 3.931 337 HH22 ARG 42 HH22 ARG 42 5.968 -23.053 5.426 338 H VAL 43 H VAL 43 6.336 -18.960 0.861 339 HA VAL 43 HA VAL 43 6.280 -17.495 -1.651 340 HB VAL 43 HB VAL 43 6.648 -15.460 -0.286 341 HG11 VAL 43 HG11 VAL 43 4.474 -15.432 0.852 342 HG12 VAL 43 HG12 VAL 43 4.374 -17.184 0.689 343 HG13 VAL 43 HG13 VAL 43 4.367 -16.164 -0.748 344 HG21 VAL 43 HG21 VAL 43 7.945 -16.447 1.539 345 HG22 VAL 43 HG22 VAL 43 6.524 -17.340 2.078 346 HG23 VAL 43 HG23 VAL 43 6.542 -15.579 2.165 347 H ILE 44 H ILE 44 8.066 -16.833 -2.694 348 HA ILE 44 HA ILE 44 10.669 -17.357 -1.421 349 HB ILE 44 HB ILE 44 9.930 -17.770 -4.332 350 HG12 ILE 44 HG12 ILE 44 9.096 -19.561 -2.857 351 HG13 ILE 44 HG11 ILE 44 10.371 -20.143 -3.919 352 HG21 ILE 44 HG21 ILE 44 12.223 -18.620 -4.606 353 HG22 ILE 44 HG22 ILE 44 12.580 -18.164 -2.941 354 HG23 ILE 44 HG23 ILE 44 12.198 -16.922 -4.131 355 HD11 ILE 44 HD11 ILE 44 11.971 -19.978 -2.066 356 HD12 ILE 44 HD12 ILE 44 10.625 -21.055 -1.695 357 HD13 ILE 44 HD13 ILE 44 10.669 -19.432 -1.008 358 H PHE 45 H PHE 45 11.973 -15.676 -1.351 359 HA PHE 45 HA PHE 45 11.642 -13.493 -3.272 360 HB2 PHE 45 HB2 PHE 45 10.344 -12.897 -1.257 361 HB3 PHE 45 HB1 PHE 45 11.780 -13.133 -0.269 362 HD1 PHE 45 HD1 PHE 45 10.302 -11.065 -2.935 363 HD2 PHE 45 HD2 PHE 45 13.385 -11.426 -0.027 364 HE1 PHE 45 HE1 PHE 45 10.912 -8.715 -3.295 365 HE2 PHE 45 HE2 PHE 45 14.002 -9.072 -0.385 366 HZ PHE 45 HZ PHE 45 12.764 -7.717 -2.018 367 H ALA 46 H ALA 46 13.556 -13.006 -4.121 368 HA ALA 46 HA ALA 46 15.789 -12.798 -4.468 369 HB1 ALA 46 HB1 ALA 46 15.922 -12.484 -1.468 370 HB2 ALA 46 HB2 ALA 46 15.596 -11.191 -2.621 371 HB3 ALA 46 HB3 ALA 46 17.163 -11.997 -2.621 372 H GLY 47 H GLY 47 14.629 -15.489 -3.837 373 HA2 GLY 47 HA2 GLY 47 15.648 -17.576 -4.124 374 HA3 GLY 47 HA1 GLY 47 17.187 -16.865 -3.670 375 H LYS 48 H LYS 48 14.712 -16.073 -1.500 376 HA LYS 48 HA LYS 48 15.337 -18.374 0.224 377 HB2 LYS 48 HB2 LYS 48 15.648 -16.990 2.121 378 HB3 LYS 48 HB1 LYS 48 16.668 -16.334 0.849 379 HG2 LYS 48 HG2 LYS 48 15.157 -14.545 0.454 380 HG3 LYS 48 HG1 LYS 48 13.936 -15.271 1.500 381 HD2 LYS 48 HD2 LYS 48 14.963 -13.540 2.740 382 HD3 LYS 48 HD1 LYS 48 15.558 -15.089 3.355 383 HE2 LYS 48 HE2 LYS 48 17.633 -14.844 2.191 384 HE3 LYS 48 HE1 LYS 48 17.042 -13.424 1.328 385 HZ1 LYS 48 HZ1 LYS 48 18.530 -12.880 3.177 386 HZ2 LYS 48 HZ2 LYS 48 17.426 -13.559 4.269 387 HZ3 LYS 48 HZ3 LYS 48 16.997 -12.198 3.362 388 H GLU 49 H GLU 49 13.792 -18.296 2.180 389 HA GLU 49 HA GLU 49 11.151 -17.410 1.260 390 HB2 GLU 49 HB2 GLU 49 10.171 -19.279 2.567 391 HB3 GLU 49 HB1 GLU 49 11.176 -19.830 1.237 392 HG2 GLU 49 HG2 GLU 49 12.925 -20.446 2.701 393 HG3 GLU 49 HG1 GLU 49 12.155 -19.634 4.064 394 H LEU 50 H LEU 50 10.145 -16.048 2.537 395 HA LEU 50 HA LEU 50 11.503 -15.038 4.834 396 HB2 LEU 50 HB2 LEU 50 8.723 -14.352 3.928 397 HB3 LEU 50 HB1 LEU 50 9.785 -13.385 4.930 398 HG LEU 50 HG LEU 50 10.169 -14.004 2.009 399 HD11 LEU 50 HD11 LEU 50 8.368 -12.446 2.392 400 HD12 LEU 50 HD12 LEU 50 9.757 -11.631 1.675 401 HD13 LEU 50 HD13 LEU 50 9.419 -11.449 3.397 402 HD21 LEU 50 HD21 LEU 50 12.032 -12.401 2.119 403 HD22 LEU 50 HD22 LEU 50 12.319 -13.809 3.142 404 HD23 LEU 50 HD23 LEU 50 11.814 -12.282 3.865 405 H ARG 51 H ARG 51 10.544 -14.811 6.929 406 HA ARG 51 HA ARG 51 9.144 -17.186 7.764 407 HB2 ARG 51 HB2 ARG 51 9.401 -16.313 10.069 408 HB3 ARG 51 HB1 ARG 51 10.931 -16.409 9.221 409 HG2 ARG 51 HG2 ARG 51 9.414 -13.829 9.345 410 HG3 ARG 51 HG1 ARG 51 10.423 -14.347 10.695 411 HD2 ARG 51 HD2 ARG 51 12.275 -14.623 8.936 412 HD3 ARG 51 HD1 ARG 51 11.230 -13.676 7.882 413 HE ARG 51 HE ARG 51 11.746 -12.486 10.456 414 HH11 ARG 51 HH11 ARG 51 12.778 -12.712 7.104 415 HH12 ARG 51 HH12 ARG 51 13.707 -11.256 7.168 416 HH21 ARG 51 HH21 ARG 51 12.972 -10.562 10.524 417 HH22 ARG 51 HH22 ARG 51 13.792 -10.017 9.096 418 H ASN 52 H ASN 52 7.070 -17.293 8.529 419 HA ASN 52 HA ASN 52 5.283 -15.451 7.319 420 HB2 ASN 52 HB2 ASN 52 3.493 -16.814 8.156 421 HB3 ASN 52 HB1 ASN 52 4.792 -17.876 7.639 422 HD21 ASN 52 HD21 ASN 52 2.971 -16.676 10.341 423 HD22 ASN 52 HD22 ASN 52 3.568 -17.806 11.502 424 H ASP 53 H ASP 53 6.597 -15.663 10.511 425 HA ASP 53 HA ASP 53 4.599 -13.817 11.539 426 HB2 ASP 53 HB2 ASP 53 5.229 -15.817 12.885 427 HB3 ASP 53 HB1 ASP 53 6.856 -15.163 13.033 428 H TRP 54 H TRP 54 5.682 -12.366 9.837 429 HA TRP 54 HA TRP 54 7.116 -10.373 11.308 430 HB2 TRP 54 HB2 TRP 54 8.917 -11.989 10.528 431 HB3 TRP 54 HB1 TRP 54 8.521 -11.502 8.883 432 HD1 TRP 54 HD1 TRP 54 10.209 -9.800 8.029 433 HE1 TRP 54 HE1 TRP 54 11.556 -7.857 9.033 434 HE3 TRP 54 HE3 TRP 54 8.585 -10.106 12.864 435 HZ2 TRP 54 HZ2 TRP 54 11.874 -6.606 11.539 436 HZ3 TRP 54 HZ3 TRP 54 9.457 -8.494 14.500 437 HH2 TRP 54 HH2 TRP 54 11.065 -6.781 13.846 438 H THR 55 H THR 55 7.346 -8.365 10.065 439 HA THR 55 HA THR 55 5.056 -7.972 8.377 440 HB THR 55 HB THR 55 5.371 -6.197 9.874 441 HG1 THR 55 HG1 THR 55 5.238 -4.606 8.451 442 HG21 THR 55 HG21 THR 55 7.687 -6.638 10.531 443 HG22 THR 55 HG22 THR 55 7.489 -4.939 10.104 444 HG23 THR 55 HG23 THR 55 8.253 -6.049 8.968 445 H VAL 56 H VAL 56 4.981 -7.306 6.275 446 HA VAL 56 HA VAL 56 7.006 -8.328 4.559 447 HB VAL 56 HB VAL 56 4.583 -8.411 4.018 448 HG11 VAL 56 HG11 VAL 56 3.918 -6.237 4.865 449 HG12 VAL 56 HG12 VAL 56 3.438 -6.431 3.180 450 HG13 VAL 56 HG13 VAL 56 4.842 -5.442 3.588 451 HG21 VAL 56 HG21 VAL 56 6.177 -8.671 2.222 452 HG22 VAL 56 HG22 VAL 56 6.278 -6.922 2.020 453 HG23 VAL 56 HG23 VAL 56 4.777 -7.768 1.646 454 H GLN 57 H GLN 57 6.244 -5.174 5.823 455 HA GLN 57 HA GLN 57 7.580 -3.707 3.795 456 HB2 GLN 57 HB2 GLN 57 5.840 -2.706 5.226 457 HB3 GLN 57 HB1 GLN 57 6.903 -2.857 6.616 458 HG2 GLN 57 HG2 GLN 57 6.905 -0.582 5.786 459 HG3 GLN 57 HG1 GLN 57 8.492 -1.320 5.571 460 HE21 GLN 57 HE21 GLN 57 5.654 -0.108 3.984 461 HE22 GLN 57 HE22 GLN 57 6.306 -0.097 2.386 462 H ASN 58 H ASN 58 8.552 -5.097 6.863 463 HA ASN 58 HA ASN 58 11.121 -3.803 6.839 464 HB2 ASN 58 HB2 ASN 58 9.926 -4.490 8.940 465 HB3 ASN 58 HB1 ASN 58 10.267 -6.164 8.518 466 HD21 ASN 58 HD21 ASN 58 11.645 -3.117 9.483 467 HD22 ASN 58 HD22 ASN 58 13.163 -3.751 10.019 468 H CYS 59 H CYS 59 9.780 -6.599 5.423 469 HA CYS 59 HA CYS 59 12.306 -7.948 5.050 470 HB2 CYS 59 HB2 CYS 59 9.606 -8.459 3.784 471 HB3 CYS 59 HB1 CYS 59 11.011 -9.507 3.643 472 HG CYS 59 HG CYS 59 9.166 -8.890 6.455 473 H ASP 60 H ASP 60 10.451 -5.524 3.529 474 HA ASP 60 HA ASP 60 10.689 -4.228 1.700 475 HB2 ASP 60 HB2 ASP 60 13.543 -5.199 1.851 476 HB3 ASP 60 HB1 ASP 60 12.989 -3.901 0.805 477 H LEU 61 H LEU 61 9.251 -5.840 0.683 478 HA LEU 61 HA LEU 61 10.507 -7.579 -1.261 479 HB2 LEU 61 HB2 LEU 61 7.666 -7.125 -0.430 480 HB3 LEU 61 HB1 LEU 61 8.026 -7.978 -1.917 481 HG LEU 61 HG LEU 61 9.350 -9.626 -0.583 482 HD11 LEU 61 HD11 LEU 61 8.959 -9.713 1.838 483 HD12 LEU 61 HD12 LEU 61 8.169 -8.139 1.746 484 HD13 LEU 61 HD13 LEU 61 9.877 -8.294 1.339 485 HD21 LEU 61 HD21 LEU 61 7.088 -10.137 -1.262 486 HD22 LEU 61 HD22 LEU 61 6.445 -9.292 0.145 487 HD23 LEU 61 HD23 LEU 61 7.386 -10.768 0.357 488 H ASP 62 H ASP 62 9.977 -4.391 -1.223 489 HA ASP 62 HA ASP 62 9.045 -4.188 -3.979 490 HB2 ASP 62 HB2 ASP 62 8.839 -1.820 -3.584 491 HB3 ASP 62 HB1 ASP 62 8.114 -2.670 -2.227 492 H GLN 63 H GLN 63 11.886 -4.658 -2.419 493 HA GLN 63 HA GLN 63 13.564 -2.914 -3.976 494 HB2 GLN 63 HB2 GLN 63 14.239 -5.262 -2.203 495 HB3 GLN 63 HB1 GLN 63 15.441 -4.258 -3.004 496 HG2 GLN 63 HG2 GLN 63 13.427 -3.341 -0.970 497 HG3 GLN 63 HG1 GLN 63 15.155 -3.578 -0.697 498 HE21 GLN 63 HE21 GLN 63 16.607 -2.099 -1.594 499 HE22 GLN 63 HE22 GLN 63 16.099 -0.541 -2.144 500 H GLN 64 H GLN 64 12.631 -6.301 -4.123 501 HA GLN 64 HA GLN 64 14.273 -6.811 -6.434 502 HB2 GLN 64 HB2 GLN 64 12.129 -8.416 -5.045 503 HB3 GLN 64 HB1 GLN 64 12.931 -8.970 -6.506 504 HG2 GLN 64 HG2 GLN 64 14.375 -8.268 -3.964 505 HG3 GLN 64 HG1 GLN 64 13.842 -9.898 -4.378 506 HE21 GLN 64 HE21 GLN 64 14.862 -10.995 -6.049 507 HE22 GLN 64 HE22 GLN 64 16.406 -10.506 -6.660 508 H SEP 65 H SEP 65 13.092 -7.776 -8.421 509 HA SEP 65 HA SEP 65 11.355 -5.693 -9.323 510 HB2 SEP 65 HB1 SEP 65 13.032 -6.497 -10.849 511 HB3 SEP 65 HB2 SEP 65 11.444 -6.906 -11.497 512 H ILE 66 H ILE 66 11.036 -9.129 -8.562 513 HA ILE 66 HA ILE 66 8.217 -8.716 -8.183 514 HB ILE 66 HB ILE 66 8.480 -9.290 -10.640 515 HG12 ILE 66 HG12 ILE 66 6.933 -11.382 -9.125 516 HG13 ILE 66 HG11 ILE 66 6.415 -9.704 -9.215 517 HG21 ILE 66 HG21 ILE 66 10.301 -10.909 -10.420 518 HG22 ILE 66 HG22 ILE 66 8.902 -11.618 -11.233 519 HG23 ILE 66 HG23 ILE 66 9.219 -11.993 -9.540 520 HD11 ILE 66 HD11 ILE 66 5.267 -11.089 -10.844 521 HD12 ILE 66 HD12 ILE 66 6.820 -11.543 -11.556 522 HD13 ILE 66 HD13 ILE 66 6.267 -9.866 -11.630 523 H VAL 67 H VAL 67 7.276 -10.210 -6.833 524 HA VAL 67 HA VAL 67 9.112 -11.904 -5.333 525 HB VAL 67 HB VAL 67 6.172 -11.439 -4.835 526 HG11 VAL 67 HG11 VAL 67 7.095 -13.356 -3.670 527 HG12 VAL 67 HG12 VAL 67 6.696 -12.070 -2.530 528 HG13 VAL 67 HG13 VAL 67 8.376 -12.349 -2.993 529 HG21 VAL 67 HG21 VAL 67 7.332 -9.285 -4.883 530 HG22 VAL 67 HG22 VAL 67 8.487 -9.881 -3.689 531 HG23 VAL 67 HG23 VAL 67 6.788 -9.690 -3.257 532 H HIS 68 H HIS 68 8.863 -14.141 -5.168 533 HA HIS 68 HA HIS 68 7.183 -15.326 -7.267 534 HB2 HIS 68 HB2 HIS 68 9.745 -16.283 -5.989 535 HB3 HIS 68 HB1 HIS 68 8.759 -17.291 -7.038 536 HD2 HIS 68 HD2 HIS 68 9.712 -13.544 -7.801 537 HE1 HIS 68 HE1 HIS 68 11.398 -16.083 -10.726 538 HE2 HIS 68 HE2 HIS 68 11.305 -13.725 -9.827 539 H ILE 69 H ILE 69 5.615 -16.709 -6.728 540 HA ILE 69 HA ILE 69 5.691 -17.890 -4.053 541 HB ILE 69 HB ILE 69 3.298 -16.522 -5.297 542 HG12 ILE 69 HG12 ILE 69 4.862 -16.069 -2.749 543 HG13 ILE 69 HG11 ILE 69 4.771 -14.996 -4.139 544 HG21 ILE 69 HG21 ILE 69 2.594 -18.642 -4.339 545 HG22 ILE 69 HG22 ILE 69 2.018 -17.294 -3.356 546 HG23 ILE 69 HG23 ILE 69 3.407 -18.246 -2.825 547 HD11 ILE 69 HD11 ILE 69 2.497 -15.692 -2.299 548 HD12 ILE 69 HD12 ILE 69 2.411 -14.613 -3.688 549 HD13 ILE 69 HD13 ILE 69 3.411 -14.184 -2.299 550 H VAL 70 H VAL 70 5.561 -19.983 -4.137 551 HA VAL 70 HA VAL 70 4.221 -21.233 -6.436 552 HB VAL 70 HB VAL 70 5.857 -23.117 -6.210 553 HG11 VAL 70 HG11 VAL 70 7.701 -21.965 -7.353 554 HG12 VAL 70 HG12 VAL 70 7.039 -20.413 -6.840 555 HG13 VAL 70 HG13 VAL 70 6.129 -21.434 -7.952 556 HG21 VAL 70 HG21 VAL 70 6.589 -22.707 -3.919 557 HG22 VAL 70 HG22 VAL 70 7.324 -21.182 -4.414 558 HG23 VAL 70 HG23 VAL 70 7.968 -22.708 -5.021 559 H GLN 71 H GLN 71 3.083 -23.118 -6.051 560 HA GLN 71 HA GLN 71 2.348 -23.541 -3.253 561 HB2 GLN 71 HB2 GLN 71 0.627 -23.123 -5.108 562 HB3 GLN 71 HB1 GLN 71 1.015 -24.741 -5.676 563 HG2 GLN 71 HG2 GLN 71 0.374 -25.629 -3.463 564 HG3 GLN 71 HG1 GLN 71 -0.117 -24.004 -2.988 565 HE21 GLN 71 HE21 GLN 71 -1.079 -23.513 -5.782 566 HE22 GLN 71 HE22 GLN 71 -2.595 -24.337 -5.874 567 H ARG 72 H ARG 72 2.572 -25.540 -2.275 568 HA ARG 72 HA ARG 72 4.283 -27.422 -3.743 569 HB2 ARG 72 HB2 ARG 72 5.217 -26.374 -1.685 570 HB3 ARG 72 HB1 ARG 72 3.935 -27.135 -0.759 571 HG2 ARG 72 HG2 ARG 72 4.772 -29.331 -1.371 572 HG3 ARG 72 HG1 ARG 72 6.041 -28.586 -2.347 573 HD2 ARG 72 HD2 ARG 72 6.917 -29.247 -0.178 574 HD3 ARG 72 HD1 ARG 72 6.932 -27.494 -0.346 575 HE ARG 72 HE ARG 72 4.553 -28.418 0.908 576 HH11 ARG 72 HH11 ARG 72 7.936 -27.700 1.503 577 HH12 ARG 72 HH12 ARG 72 7.713 -27.408 3.191 578 HH21 ARG 72 HH21 ARG 72 4.247 -28.022 3.153 579 HH22 ARG 72 HH22 ARG 72 5.610 -27.605 4.135 580 HA PRO 73 HA PRO 73 0.368 -29.754 -3.814 581 HB2 PRO 73 HB2 PRO 73 2.214 -31.490 -5.386 582 HB3 PRO 73 HB1 PRO 73 0.570 -30.971 -5.767 583 HG2 PRO 73 HG2 PRO 73 2.591 -29.851 -7.020 584 HG3 PRO 73 HG1 PRO 73 1.259 -28.840 -6.419 585 HD2 PRO 73 HD2 PRO 73 3.977 -29.276 -5.240 586 HD3 PRO 73 HD1 PRO 73 3.053 -27.768 -5.428 587 H TRP 74 H TRP 74 -0.216 -31.080 -2.268 588 HA TRP 74 HA TRP 74 1.741 -32.830 -0.984 589 HB2 TRP 74 HB2 TRP 74 0.414 -31.410 0.493 590 HB3 TRP 74 HB1 TRP 74 -1.075 -32.026 -0.208 591 HD1 TRP 74 HD1 TRP 74 1.996 -33.676 1.538 592 HE1 TRP 74 HE1 TRP 74 1.089 -35.421 3.205 593 HE3 TRP 74 HE3 TRP 74 -3.007 -33.081 0.694 594 HZ2 TRP 74 HZ2 TRP 74 -1.414 -36.400 4.051 595 HZ3 TRP 74 HZ3 TRP 74 -4.590 -34.456 1.975 596 HH2 TRP 74 HH2 TRP 74 -3.809 -36.080 3.615 597 H ARG 75 H ARG 75 -1.581 -32.970 -2.215 598 HA ARG 75 HA ARG 75 -1.038 -35.572 -3.436 599 HB2 ARG 75 HB2 ARG 75 -3.348 -34.959 -1.579 600 HB3 ARG 75 HB1 ARG 75 -3.389 -36.289 -2.727 601 HG2 ARG 75 HG2 ARG 75 -1.367 -37.219 -1.650 602 HG3 ARG 75 HG1 ARG 75 -1.460 -35.933 -0.447 603 HD2 ARG 75 HD2 ARG 75 -3.681 -36.725 0.218 604 HD3 ARG 75 HD1 ARG 75 -3.576 -38.016 -0.981 605 HE ARG 75 HE ARG 75 -1.371 -38.435 0.480 606 HH11 ARG 75 HH11 ARG 75 -4.733 -37.982 1.395 607 HH12 ARG 75 HH12 ARG 75 -4.581 -38.864 2.878 608 HH21 ARG 75 HH21 ARG 75 -1.187 -39.638 2.432 609 HH22 ARG 75 HH22 ARG 75 -2.568 -39.821 3.456 610 H LYS 76 H LYS 76 -1.128 -32.950 -4.441 611 HA LYS 76 HA LYS 76 -3.688 -32.695 -5.821 612 HB2 LYS 76 HB2 LYS 76 -1.331 -30.802 -5.791 613 HB3 LYS 76 HB1 LYS 76 -2.930 -30.475 -6.439 614 HG2 LYS 76 HG2 LYS 76 -3.878 -30.654 -4.191 615 HG3 LYS 76 HG1 LYS 76 -2.268 -30.978 -3.545 616 HD2 LYS 76 HD2 LYS 76 -2.740 -28.663 -3.188 617 HD3 LYS 76 HD1 LYS 76 -1.546 -28.771 -4.482 618 HE2 LYS 76 HE2 LYS 76 -3.213 -27.138 -5.072 619 HE3 LYS 76 HE1 LYS 76 -3.372 -28.534 -6.134 620 HZ1 LYS 76 HZ1 LYS 76 -5.215 -29.305 -4.765 621 HZ2 LYS 76 HZ2 LYS 76 -5.520 -27.763 -5.370 622 HZ3 LYS 76 HZ3 LYS 76 -5.058 -27.959 -3.759 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 1.126 -0.195 1.147 2 H2 MET 1 HT2 MET 1 0.358 -1.648 0.723 3 H3 MET 1 HT3 MET 1 0.323 -0.331 -0.333 4 HA MET 1 HA MET 1 2.669 -0.460 -0.686 5 HB2 MET 1 HB2 MET 1 3.229 -1.304 1.567 6 HB3 MET 1 HB1 MET 1 2.527 -2.859 1.153 7 HG2 MET 1 HG2 MET 1 4.221 -3.167 -0.568 8 HG3 MET 1 HG1 MET 1 4.911 -1.593 -0.173 9 HE1 MET 1 HE1 MET 1 7.625 -4.027 1.210 10 HE2 MET 1 HE2 MET 1 7.310 -2.623 0.189 11 HE3 MET 1 HE3 MET 1 6.672 -4.204 -0.263 12 H ILE 2 H ILE 2 2.839 -1.170 -2.701 13 HA ILE 2 HA ILE 2 1.371 -3.621 -3.417 14 HB ILE 2 HB ILE 2 2.073 -1.260 -5.176 15 HG12 ILE 2 HG12 ILE 2 -0.604 -2.303 -4.219 16 HG13 ILE 2 HG11 ILE 2 0.205 -0.863 -3.609 17 HG21 ILE 2 HG21 ILE 2 2.216 -3.351 -6.437 18 HG22 ILE 2 HG22 ILE 2 0.803 -2.421 -6.934 19 HG23 ILE 2 HG23 ILE 2 0.610 -3.815 -5.872 20 HD11 ILE 2 HD11 ILE 2 -0.781 -1.271 -6.424 21 HD12 ILE 2 HD12 ILE 2 -0.002 0.181 -5.796 22 HD13 ILE 2 HD13 ILE 2 -1.576 -0.314 -5.175 23 H VAL 3 H VAL 3 2.614 -5.301 -3.768 24 HA VAL 3 HA VAL 3 5.243 -4.840 -4.996 25 HB VAL 3 HB VAL 3 6.088 -6.857 -3.849 26 HG11 VAL 3 HG11 VAL 3 4.995 -4.730 -2.018 27 HG12 VAL 3 HG12 VAL 3 6.546 -4.710 -2.860 28 HG13 VAL 3 HG13 VAL 3 6.248 -5.891 -1.585 29 HG21 VAL 3 HG21 VAL 3 3.976 -8.031 -3.497 30 HG22 VAL 3 HG22 VAL 3 3.470 -6.795 -2.343 31 HG23 VAL 3 HG23 VAL 3 4.852 -7.831 -1.979 32 H PHE 4 H PHE 4 5.961 -6.456 -6.451 33 HA PHE 4 HA PHE 4 3.735 -7.633 -7.882 34 HB2 PHE 4 HB2 PHE 4 6.658 -7.533 -8.652 35 HB3 PHE 4 HB1 PHE 4 5.312 -7.960 -9.699 36 HD1 PHE 4 HD1 PHE 4 7.403 -5.348 -8.570 37 HD2 PHE 4 HD2 PHE 4 3.481 -6.147 -10.015 38 HE1 PHE 4 HE1 PHE 4 7.153 -2.984 -9.192 39 HE2 PHE 4 HE2 PHE 4 3.228 -3.788 -10.647 40 HZ PHE 4 HZ PHE 4 5.065 -2.201 -10.233 41 H VAL 5 H VAL 5 3.454 -9.802 -8.240 42 HA VAL 5 HA VAL 5 5.282 -11.612 -6.823 43 HB VAL 5 HB VAL 5 2.263 -11.531 -6.612 44 HG11 VAL 5 HG11 VAL 5 2.945 -13.843 -6.905 45 HG12 VAL 5 HG12 VAL 5 2.415 -13.541 -5.248 46 HG13 VAL 5 HG13 VAL 5 4.137 -13.667 -5.614 47 HG21 VAL 5 HG21 VAL 5 2.667 -11.314 -4.236 48 HG22 VAL 5 HG22 VAL 5 3.519 -10.042 -5.121 49 HG23 VAL 5 HG23 VAL 5 4.405 -11.437 -4.505 50 H ARG 6 H ARG 6 5.793 -13.399 -7.873 51 HA ARG 6 HA ARG 6 4.375 -14.008 -10.378 52 HB2 ARG 6 HB2 ARG 6 7.215 -14.640 -9.579 53 HB3 ARG 6 HB1 ARG 6 6.460 -15.115 -11.091 54 HG2 ARG 6 HG2 ARG 6 6.123 -12.712 -11.605 55 HG3 ARG 6 HG1 ARG 6 7.043 -12.331 -10.146 56 HD2 ARG 6 HD2 ARG 6 8.453 -12.261 -12.164 57 HD3 ARG 6 HD1 ARG 6 8.980 -13.509 -11.034 58 HE ARG 6 HE ARG 6 7.159 -14.475 -13.026 59 HH11 ARG 6 HH11 ARG 6 10.539 -13.751 -12.400 60 HH12 ARG 6 HH12 ARG 6 11.126 -14.892 -13.557 61 HH21 ARG 6 HH21 ARG 6 7.939 -15.976 -14.558 62 HH22 ARG 6 HH22 ARG 6 9.641 -16.175 -14.786 63 H PHE 7 H PHE 7 2.983 -15.568 -10.030 64 HA PHE 7 HA PHE 7 3.432 -17.604 -8.039 65 HB2 PHE 7 HB2 PHE 7 1.195 -16.468 -8.716 66 HB3 PHE 7 HB1 PHE 7 1.207 -17.591 -10.071 67 HD1 PHE 7 HD1 PHE 7 0.951 -17.248 -6.443 68 HD2 PHE 7 HD2 PHE 7 0.761 -19.926 -9.732 69 HE1 PHE 7 HE1 PHE 7 -0.083 -18.937 -4.998 70 HE2 PHE 7 HE2 PHE 7 -0.269 -21.632 -8.293 71 HZ PHE 7 HZ PHE 7 -0.692 -21.139 -5.921 72 H ASN 8 H ASN 8 3.801 -19.769 -8.445 73 HA ASN 8 HA ASN 8 5.535 -20.490 -10.485 74 HB2 ASN 8 HB2 ASN 8 5.254 -21.722 -8.361 75 HB3 ASN 8 HB1 ASN 8 3.719 -22.354 -8.939 76 HD21 ASN 8 HD21 ASN 8 3.718 -23.992 -10.481 77 HD22 ASN 8 HD22 ASN 8 5.142 -24.870 -10.899 78 H SER 9 H SER 9 2.097 -20.354 -10.626 79 HA SER 9 HA SER 9 1.808 -22.135 -12.859 80 HB2 SER 9 HB2 SER 9 -0.182 -20.153 -11.739 81 HB3 SER 9 HB1 SER 9 -0.535 -21.530 -12.786 82 HG SER 9 HG SER 9 -0.895 -22.396 -10.858 83 H SER 10 H SER 10 3.633 -19.832 -13.199 84 HA SER 10 HA SER 10 4.269 -18.378 -14.834 85 HB2 SER 10 HB2 SER 10 1.958 -19.539 -16.414 86 HB3 SER 10 HB1 SER 10 3.367 -18.705 -17.068 87 HG SER 10 HG SER 10 3.918 -20.779 -17.265 88 H HIS 11 H HIS 11 2.386 -17.473 -12.836 89 HA HIS 11 HA HIS 11 0.960 -15.418 -14.382 90 HB2 HIS 11 HB2 HIS 11 -0.583 -17.113 -13.443 91 HB3 HIS 11 HB1 HIS 11 0.009 -16.732 -11.832 92 HD2 HIS 11 HD2 HIS 11 -1.289 -14.741 -10.582 93 HE1 HIS 11 HE1 HIS 11 -3.457 -13.355 -13.937 94 HE2 HIS 11 HE2 HIS 11 -3.334 -13.396 -11.412 95 H GLY 12 H GLY 12 1.970 -13.562 -14.067 96 HA2 GLY 12 HA2 GLY 12 2.944 -12.936 -11.353 97 HA3 GLY 12 HA1 GLY 12 3.676 -12.317 -12.829 98 H PHE 13 H PHE 13 1.765 -11.489 -10.309 99 HA PHE 13 HA PHE 13 0.625 -9.255 -11.806 100 HB2 PHE 13 HB2 PHE 13 -1.568 -9.500 -10.809 101 HB3 PHE 13 HB1 PHE 13 -1.143 -11.003 -11.611 102 HD1 PHE 13 HD1 PHE 13 -2.485 -9.602 -8.713 103 HD2 PHE 13 HD2 PHE 13 0.024 -12.786 -10.009 104 HE1 PHE 13 HE1 PHE 13 -2.975 -10.830 -6.643 105 HE2 PHE 13 HE2 PHE 13 -0.461 -14.015 -7.941 106 HZ PHE 13 HZ PHE 13 -1.966 -13.037 -6.256 107 HA PRO 14 HA PRO 14 1.826 -7.004 -8.151 108 HB2 PRO 14 HB2 PRO 14 -0.219 -5.001 -8.518 109 HB3 PRO 14 HB1 PRO 14 1.494 -4.895 -8.927 110 HG2 PRO 14 HG2 PRO 14 -0.520 -4.953 -10.789 111 HG3 PRO 14 HG1 PRO 14 1.138 -5.493 -11.107 112 HD2 PRO 14 HD2 PRO 14 -1.296 -7.113 -10.461 113 HD3 PRO 14 HD1 PRO 14 -0.008 -7.432 -11.643 114 H VAL 15 H VAL 15 1.373 -7.333 -6.069 115 HA VAL 15 HA VAL 15 -1.430 -7.784 -5.310 116 HB VAL 15 HB VAL 15 1.086 -8.765 -3.919 117 HG11 VAL 15 HG11 VAL 15 -1.816 -9.361 -3.337 118 HG12 VAL 15 HG12 VAL 15 -0.769 -8.330 -2.367 119 HG13 VAL 15 HG13 VAL 15 -0.425 -10.054 -2.504 120 HG21 VAL 15 HG21 VAL 15 0.710 -9.917 -6.018 121 HG22 VAL 15 HG22 VAL 15 -0.964 -10.241 -5.567 122 HG23 VAL 15 HG23 VAL 15 0.356 -10.988 -4.663 123 H GLU 16 H GLU 16 -2.357 -6.293 -4.111 124 HA GLU 16 HA GLU 16 -0.743 -4.193 -2.908 125 HB2 GLU 16 HB2 GLU 16 -2.690 -3.622 -4.329 126 HB3 GLU 16 HB1 GLU 16 -3.738 -4.432 -3.174 127 HG2 GLU 16 HG2 GLU 16 -2.800 -2.805 -1.450 128 HG3 GLU 16 HG1 GLU 16 -2.184 -1.896 -2.831 129 H VAL 17 H VAL 17 -0.106 -4.477 -0.890 130 HA VAL 17 HA VAL 17 -1.972 -5.710 1.017 131 HB VAL 17 HB VAL 17 0.032 -6.537 2.276 132 HG11 VAL 17 HG11 VAL 17 -1.285 -8.030 0.878 133 HG12 VAL 17 HG12 VAL 17 0.422 -8.466 0.821 134 HG13 VAL 17 HG13 VAL 17 -0.311 -7.594 -0.524 135 HG21 VAL 17 HG21 VAL 17 2.158 -6.758 1.023 136 HG22 VAL 17 HG22 VAL 17 1.737 -5.079 1.354 137 HG23 VAL 17 HG23 VAL 17 1.482 -5.750 -0.257 138 H ASP 18 H ASP 18 -0.920 -5.213 3.356 139 HA ASP 18 HA ASP 18 -0.915 -2.287 3.458 140 HB2 ASP 18 HB2 ASP 18 -1.472 -4.357 5.590 141 HB3 ASP 18 HB1 ASP 18 -1.410 -2.625 5.894 142 H SER 19 H SER 19 0.315 -1.457 5.476 143 HA SER 19 HA SER 19 3.049 -2.208 5.099 144 HB2 SER 19 HB2 SER 19 3.367 -0.389 6.896 145 HB3 SER 19 HB1 SER 19 2.720 0.101 5.330 146 HG SER 19 HG SER 19 1.278 0.983 6.626 147 H ASP 20 H ASP 20 0.617 -3.453 6.883 148 HA ASP 20 HA ASP 20 2.406 -4.356 9.036 149 HB2 ASP 20 HB2 ASP 20 -0.617 -4.120 9.013 150 HB3 ASP 20 HB1 ASP 20 0.313 -4.831 10.324 151 H THR 21 H THR 21 1.671 -5.365 6.199 152 HA THR 21 HA THR 21 0.407 -7.866 6.762 153 HB THR 21 HB THR 21 1.729 -6.874 4.226 154 HG1 THR 21 HG1 THR 21 -0.959 -6.897 5.167 155 HG21 THR 21 HG21 THR 21 1.604 -9.323 4.285 156 HG22 THR 21 HG22 THR 21 0.448 -8.669 3.125 157 HG23 THR 21 HG23 THR 21 -0.108 -9.234 4.701 158 H SER 22 H SER 22 1.568 -9.162 8.026 159 HA SER 22 HA SER 22 4.351 -9.550 7.883 160 HB2 SER 22 HB2 SER 22 2.301 -11.552 8.845 161 HB3 SER 22 HB1 SER 22 3.975 -11.386 9.374 162 HG SER 22 HG SER 22 3.238 -10.103 10.842 163 H ILE 23 H ILE 23 5.487 -11.366 6.978 164 HA ILE 23 HA ILE 23 4.743 -11.995 4.364 165 HB ILE 23 HB ILE 23 6.682 -13.447 6.175 166 HG12 ILE 23 HG12 ILE 23 7.275 -11.115 5.850 167 HG13 ILE 23 HG11 ILE 23 8.398 -12.144 4.970 168 HG21 ILE 23 HG21 ILE 23 7.661 -14.435 4.211 169 HG22 ILE 23 HG22 ILE 23 6.531 -13.584 3.165 170 HG23 ILE 23 HG23 ILE 23 5.945 -14.846 4.255 171 HD11 ILE 23 HD11 ILE 23 7.826 -10.210 3.652 172 HD12 ILE 23 HD12 ILE 23 6.109 -10.578 3.798 173 HD13 ILE 23 HD13 ILE 23 7.169 -11.659 2.893 174 H PHE 24 H PHE 24 4.048 -13.685 7.372 175 HA PHE 24 HA PHE 24 3.013 -16.077 6.278 176 HB2 PHE 24 HB2 PHE 24 3.494 -15.638 8.737 177 HB3 PHE 24 HB1 PHE 24 2.027 -14.677 8.772 178 HD1 PHE 24 HD1 PHE 24 3.270 -18.089 8.011 179 HD2 PHE 24 HD2 PHE 24 -0.032 -15.675 9.183 180 HE1 PHE 24 HE1 PHE 24 1.952 -20.114 8.450 181 HE2 PHE 24 HE2 PHE 24 -1.356 -17.698 9.624 182 HZ PHE 24 HZ PHE 24 -0.365 -19.922 9.259 183 H GLN 25 H GLN 25 1.509 -13.015 7.148 184 HA GLN 25 HA GLN 25 -1.131 -13.668 6.375 185 HB2 GLN 25 HB2 GLN 25 0.219 -10.968 6.602 186 HB3 GLN 25 HB1 GLN 25 -1.513 -11.228 6.473 187 HG2 GLN 25 HG2 GLN 25 0.229 -12.201 8.725 188 HG3 GLN 25 HG1 GLN 25 -0.792 -10.766 8.767 189 HE21 GLN 25 HE21 GLN 25 -3.017 -11.010 8.880 190 HE22 GLN 25 HE22 GLN 25 -3.760 -12.508 9.310 191 H LEU 26 H LEU 26 1.589 -12.166 4.729 192 HA LEU 26 HA LEU 26 0.386 -11.275 2.396 193 HB2 LEU 26 HB2 LEU 26 2.684 -10.766 2.944 194 HB3 LEU 26 HB1 LEU 26 3.127 -12.457 2.834 195 HG LEU 26 HG LEU 26 2.683 -12.398 0.403 196 HD11 LEU 26 HD11 LEU 26 1.021 -10.617 0.370 197 HD12 LEU 26 HD12 LEU 26 2.365 -10.257 -0.715 198 HD13 LEU 26 HD13 LEU 26 2.255 -9.450 0.849 199 HD21 LEU 26 HD21 LEU 26 4.596 -10.295 1.400 200 HD22 LEU 26 HD22 LEU 26 4.633 -11.044 -0.196 201 HD23 LEU 26 HD23 LEU 26 4.935 -12.019 1.245 202 H LYS 27 H LYS 27 1.709 -14.475 3.129 203 HA LYS 27 HA LYS 27 1.238 -15.690 0.661 204 HB2 LYS 27 HB2 LYS 27 2.566 -16.692 2.511 205 HB3 LYS 27 HB1 LYS 27 1.065 -16.963 3.393 206 HG2 LYS 27 HG2 LYS 27 0.290 -18.376 1.487 207 HG3 LYS 27 HG1 LYS 27 1.903 -18.225 0.793 208 HD2 LYS 27 HD2 LYS 27 1.728 -20.310 2.007 209 HD3 LYS 27 HD1 LYS 27 2.841 -19.230 2.847 210 HE2 LYS 27 HE2 LYS 27 1.259 -18.740 4.525 211 HE3 LYS 27 HE1 LYS 27 -0.068 -19.417 3.583 212 HZ1 LYS 27 HZ1 LYS 27 0.850 -21.599 3.876 213 HZ2 LYS 27 HZ2 LYS 27 0.637 -20.880 5.385 214 HZ3 LYS 27 HZ3 LYS 27 2.185 -20.993 4.714 215 H GLU 28 H GLU 28 -0.810 -15.423 3.530 216 HA GLU 28 HA GLU 28 -2.940 -16.942 2.485 217 HB2 GLU 28 HB2 GLU 28 -2.716 -15.028 4.772 218 HB3 GLU 28 HB1 GLU 28 -4.231 -15.822 4.381 219 HG2 GLU 28 HG2 GLU 28 -2.702 -17.975 4.477 220 HG3 GLU 28 HG1 GLU 28 -1.725 -16.931 5.509 221 H VAL 29 H VAL 29 -2.198 -13.501 2.386 222 HA VAL 29 HA VAL 29 -4.696 -12.585 1.471 223 HB VAL 29 HB VAL 29 -1.937 -11.481 0.848 224 HG11 VAL 29 HG11 VAL 29 -3.093 -9.390 0.290 225 HG12 VAL 29 HG12 VAL 29 -4.647 -10.196 0.513 226 HG13 VAL 29 HG13 VAL 29 -3.570 -10.705 -0.786 227 HG21 VAL 29 HG21 VAL 29 -2.443 -9.850 2.604 228 HG22 VAL 29 HG22 VAL 29 -2.443 -11.499 3.229 229 HG23 VAL 29 HG23 VAL 29 -3.971 -10.671 2.923 230 H VAL 30 H VAL 30 -1.823 -13.649 -0.298 231 HA VAL 30 HA VAL 30 -2.976 -13.389 -2.872 232 HB VAL 30 HB VAL 30 -0.679 -15.151 -1.977 233 HG11 VAL 30 HG11 VAL 30 -0.005 -15.126 -4.336 234 HG12 VAL 30 HG12 VAL 30 -1.466 -14.227 -4.737 235 HG13 VAL 30 HG13 VAL 30 -1.586 -15.873 -4.118 236 HG21 VAL 30 HG21 VAL 30 -0.686 -12.369 -3.146 237 HG22 VAL 30 HG22 VAL 30 0.750 -13.339 -2.820 238 HG23 VAL 30 HG23 VAL 30 -0.273 -12.803 -1.488 239 H ALA 31 H ALA 31 -2.754 -16.018 -0.550 240 HA ALA 31 HA ALA 31 -3.662 -18.126 -2.105 241 HB1 ALA 31 HB1 ALA 31 -4.266 -19.223 -0.027 242 HB2 ALA 31 HB2 ALA 31 -4.183 -17.683 0.828 243 HB3 ALA 31 HB3 ALA 31 -2.719 -18.389 0.140 244 H LYS 32 H LYS 32 -5.579 -15.894 -0.085 245 HA LYS 32 HA LYS 32 -8.058 -17.065 -0.928 246 HB2 LYS 32 HB2 LYS 32 -9.142 -15.278 0.292 247 HB3 LYS 32 HB1 LYS 32 -7.832 -15.946 1.253 248 HG2 LYS 32 HG2 LYS 32 -6.464 -14.053 0.873 249 HG3 LYS 32 HG1 LYS 32 -7.535 -13.450 -0.395 250 HD2 LYS 32 HD2 LYS 32 -9.284 -13.074 1.224 251 HD3 LYS 32 HD1 LYS 32 -8.275 -13.740 2.513 252 HE2 LYS 32 HE2 LYS 32 -6.656 -11.919 2.133 253 HE3 LYS 32 HE1 LYS 32 -7.720 -11.253 0.895 254 HZ1 LYS 32 HZ1 LYS 32 -9.403 -10.873 2.539 255 HZ2 LYS 32 HZ2 LYS 32 -7.965 -10.164 3.076 256 HZ3 LYS 32 HZ3 LYS 32 -8.481 -11.628 3.738 257 H ARG 33 H ARG 33 -5.997 -14.590 -2.118 258 HA ARG 33 HA ARG 33 -7.926 -13.187 -3.656 259 HB2 ARG 33 HB2 ARG 33 -5.601 -12.391 -2.904 260 HB3 ARG 33 HB1 ARG 33 -4.962 -13.327 -4.242 261 HG2 ARG 33 HG2 ARG 33 -7.023 -11.175 -4.648 262 HG3 ARG 33 HG1 ARG 33 -5.296 -10.823 -4.590 263 HD2 ARG 33 HD2 ARG 33 -4.970 -12.448 -6.445 264 HD3 ARG 33 HD1 ARG 33 -6.720 -12.632 -6.538 265 HE ARG 33 HE ARG 33 -6.271 -9.934 -6.750 266 HH11 ARG 33 HH11 ARG 33 -5.302 -12.791 -8.536 267 HH12 ARG 33 HH12 ARG 33 -5.135 -11.955 -10.035 268 HH21 ARG 33 HH21 ARG 33 -6.049 -8.827 -8.762 269 HH22 ARG 33 HH22 ARG 33 -5.551 -9.710 -10.170 270 H GLN 34 H GLN 34 -5.708 -15.866 -4.325 271 HA GLN 34 HA GLN 34 -6.718 -16.070 -7.061 272 HB2 GLN 34 HB2 GLN 34 -4.539 -17.613 -5.658 273 HB3 GLN 34 HB1 GLN 34 -4.997 -17.822 -7.342 274 HG2 GLN 34 HG2 GLN 34 -4.384 -15.467 -7.759 275 HG3 GLN 34 HG1 GLN 34 -3.837 -15.344 -6.090 276 HE21 GLN 34 HE21 GLN 34 -3.426 -18.210 -8.049 277 HE22 GLN 34 HE22 GLN 34 -1.710 -18.095 -8.178 278 H GLY 35 H GLY 35 -7.221 -17.475 -3.997 279 HA2 GLY 35 HA2 GLY 35 -8.892 -18.976 -3.402 280 HA3 GLY 35 HA1 GLY 35 -9.204 -19.264 -5.109 281 H VAL 36 H VAL 36 -6.255 -19.584 -3.180 282 HA VAL 36 HA VAL 36 -6.167 -22.429 -3.940 283 HB VAL 36 HB VAL 36 -3.687 -22.265 -3.991 284 HG11 VAL 36 HG11 VAL 36 -3.500 -21.094 -6.135 285 HG12 VAL 36 HG12 VAL 36 -5.087 -20.369 -5.874 286 HG13 VAL 36 HG13 VAL 36 -4.938 -22.115 -6.074 287 HG21 VAL 36 HG21 VAL 36 -4.150 -19.291 -3.768 288 HG22 VAL 36 HG22 VAL 36 -2.598 -20.080 -4.052 289 HG23 VAL 36 HG23 VAL 36 -3.443 -20.317 -2.519 290 HA PRO 37 HA PRO 37 -5.720 -23.377 0.354 291 HB2 PRO 37 HB2 PRO 37 -3.994 -25.501 0.249 292 HB3 PRO 37 HB1 PRO 37 -5.710 -25.617 -0.154 293 HG2 PRO 37 HG2 PRO 37 -3.351 -25.357 -1.973 294 HG3 PRO 37 HG1 PRO 37 -4.794 -26.372 -2.148 295 HD2 PRO 37 HD2 PRO 37 -4.491 -24.059 -3.493 296 HD3 PRO 37 HD1 PRO 37 -6.077 -24.627 -2.938 297 H ALA 38 H ALA 38 -4.634 -22.034 1.640 298 HA ALA 38 HA ALA 38 -2.036 -21.053 1.071 299 HB1 ALA 38 HB1 ALA 38 -3.712 -19.737 2.261 300 HB2 ALA 38 HB2 ALA 38 -2.210 -19.863 3.177 301 HB3 ALA 38 HB3 ALA 38 -3.605 -20.840 3.632 302 H ASP 39 H ASP 39 -3.196 -23.705 3.017 303 HA ASP 39 HA ASP 39 -0.805 -24.079 4.521 304 HB2 ASP 39 HB2 ASP 39 -2.912 -25.052 5.278 305 HB3 ASP 39 HB1 ASP 39 -2.995 -26.051 3.830 306 H GLN 40 H GLN 40 -1.804 -24.919 1.349 307 HA GLN 40 HA GLN 40 0.566 -26.612 0.979 308 HB2 GLN 40 HB2 GLN 40 -1.979 -26.412 -0.645 309 HB3 GLN 40 HB1 GLN 40 -0.604 -27.426 -1.064 310 HG2 GLN 40 HG2 GLN 40 -0.906 -28.737 0.940 311 HG3 GLN 40 HG1 GLN 40 -2.200 -27.670 1.478 312 HE21 GLN 40 HE21 GLN 40 -4.207 -27.806 0.510 313 HE22 GLN 40 HE22 GLN 40 -4.671 -29.136 -0.490 314 H LEU 41 H LEU 41 0.416 -23.670 1.071 315 HA LEU 41 HA LEU 41 1.421 -23.079 -1.626 316 HB2 LEU 41 HB2 LEU 41 -0.760 -21.984 -0.920 317 HB3 LEU 41 HB1 LEU 41 0.169 -21.119 0.287 318 HG LEU 41 HG LEU 41 1.523 -20.125 -1.541 319 HD11 LEU 41 HD11 LEU 41 0.675 -20.274 -3.822 320 HD12 LEU 41 HD12 LEU 41 -0.539 -21.442 -3.298 321 HD13 LEU 41 HD13 LEU 41 1.174 -21.850 -3.217 322 HD21 LEU 41 HD21 LEU 41 -0.224 -18.572 -2.277 323 HD22 LEU 41 HD22 LEU 41 -0.338 -18.919 -0.551 324 HD23 LEU 41 HD23 LEU 41 -1.454 -19.687 -1.679 325 H ARG 42 H ARG 42 3.365 -21.919 -1.735 326 HA ARG 42 HA ARG 42 4.641 -21.286 0.837 327 HB2 ARG 42 HB2 ARG 42 5.429 -23.492 0.042 328 HB3 ARG 42 HB1 ARG 42 5.976 -22.742 -1.447 329 HG2 ARG 42 HG2 ARG 42 7.835 -23.097 0.068 330 HG3 ARG 42 HG1 ARG 42 7.556 -21.370 -0.176 331 HD2 ARG 42 HD2 ARG 42 7.993 -21.975 2.191 332 HD3 ARG 42 HD1 ARG 42 6.433 -21.190 1.925 333 HE ARG 42 HE ARG 42 5.767 -23.783 1.788 334 HH11 ARG 42 HH11 ARG 42 7.729 -22.099 4.172 335 HH12 ARG 42 HH12 ARG 42 7.239 -23.134 5.460 336 HH21 ARG 42 HH21 ARG 42 5.131 -25.131 3.500 337 HH22 ARG 42 HH22 ARG 42 5.747 -24.858 5.093 338 H VAL 43 H VAL 43 5.792 -19.424 0.875 339 HA VAL 43 HA VAL 43 5.827 -17.871 -1.565 340 HB VAL 43 HB VAL 43 6.556 -15.963 -0.109 341 HG11 VAL 43 HG11 VAL 43 4.025 -17.366 0.729 342 HG12 VAL 43 HG12 VAL 43 4.209 -16.269 -0.639 343 HG13 VAL 43 HG13 VAL 43 4.392 -15.665 1.007 344 HG21 VAL 43 HG21 VAL 43 7.646 -17.258 1.661 345 HG22 VAL 43 HG22 VAL 43 6.085 -17.928 2.137 346 HG23 VAL 43 HG23 VAL 43 6.398 -16.202 2.324 347 H ILE 44 H ILE 44 7.643 -17.262 -2.642 348 HA ILE 44 HA ILE 44 10.203 -18.225 -1.558 349 HB ILE 44 HB ILE 44 9.266 -18.459 -4.430 350 HG12 ILE 44 HG12 ILE 44 8.250 -20.145 -2.961 351 HG13 ILE 44 HG11 ILE 44 9.392 -20.884 -4.076 352 HG21 ILE 44 HG21 ILE 44 11.639 -17.954 -4.334 353 HG22 ILE 44 HG22 ILE 44 11.386 -19.624 -4.843 354 HG23 ILE 44 HG23 ILE 44 11.892 -19.273 -3.192 355 HD11 ILE 44 HD11 ILE 44 11.061 -20.966 -2.277 356 HD12 ILE 44 HD12 ILE 44 9.595 -21.860 -1.875 357 HD13 ILE 44 HD13 ILE 44 9.879 -20.271 -1.167 358 H PHE 45 H PHE 45 11.866 -16.889 -1.732 359 HA PHE 45 HA PHE 45 11.896 -14.709 -3.630 360 HB2 PHE 45 HB2 PHE 45 10.692 -13.704 -1.750 361 HB3 PHE 45 HB1 PHE 45 11.955 -14.226 -0.642 362 HD1 PHE 45 HD1 PHE 45 11.188 -11.955 -3.447 363 HD2 PHE 45 HD2 PHE 45 13.924 -12.950 -0.335 364 HE1 PHE 45 HE1 PHE 45 12.360 -9.823 -3.802 365 HE2 PHE 45 HE2 PHE 45 15.101 -10.814 -0.689 366 HZ PHE 45 HZ PHE 45 14.313 -9.249 -2.424 367 H ALA 46 H ALA 46 13.912 -14.498 -4.365 368 HA ALA 46 HA ALA 46 16.167 -14.680 -4.598 369 HB1 ALA 46 HB1 ALA 46 16.224 -13.208 -2.642 370 HB2 ALA 46 HB2 ALA 46 17.576 -14.342 -2.626 371 HB3 ALA 46 HB3 ALA 46 16.185 -14.615 -1.579 372 H GLY 47 H GLY 47 14.435 -17.116 -4.165 373 HA2 GLY 47 HA2 GLY 47 15.045 -19.337 -4.616 374 HA3 GLY 47 HA1 GLY 47 16.662 -18.994 -4.023 375 H LYS 48 H LYS 48 14.704 -17.727 -1.766 376 HA LYS 48 HA LYS 48 14.470 -20.257 -0.263 377 HB2 LYS 48 HB2 LYS 48 15.037 -18.974 1.775 378 HB3 LYS 48 HB1 LYS 48 16.358 -19.015 0.616 379 HG2 LYS 48 HG2 LYS 48 16.263 -16.793 0.223 380 HG3 LYS 48 HG1 LYS 48 14.513 -16.719 0.438 381 HD2 LYS 48 HD2 LYS 48 14.781 -16.897 2.831 382 HD3 LYS 48 HD1 LYS 48 16.534 -17.030 2.647 383 HE2 LYS 48 HE2 LYS 48 16.584 -14.792 1.664 384 HE3 LYS 48 HE1 LYS 48 14.834 -14.674 1.844 385 HZ1 LYS 48 HZ1 LYS 48 16.039 -13.548 3.621 386 HZ2 LYS 48 HZ2 LYS 48 16.750 -15.011 4.081 387 HZ3 LYS 48 HZ3 LYS 48 15.078 -14.801 4.214 388 H GLU 49 H GLU 49 13.106 -19.576 1.874 389 HA GLU 49 HA GLU 49 10.755 -18.166 0.843 390 HB2 GLU 49 HB2 GLU 49 9.451 -19.341 2.556 391 HB3 GLU 49 HB1 GLU 49 10.268 -20.469 1.490 392 HG2 GLU 49 HG2 GLU 49 11.929 -20.918 3.174 393 HG3 GLU 49 HG1 GLU 49 11.227 -19.695 4.235 394 H LEU 50 H LEU 50 9.886 -16.485 2.011 395 HA LEU 50 HA LEU 50 11.777 -15.124 3.668 396 HB2 LEU 50 HB2 LEU 50 8.970 -14.382 2.892 397 HB3 LEU 50 HB1 LEU 50 10.045 -13.361 3.833 398 HG LEU 50 HG LEU 50 10.459 -14.255 0.997 399 HD11 LEU 50 HD11 LEU 50 8.705 -12.595 1.207 400 HD12 LEU 50 HD12 LEU 50 10.136 -11.890 0.456 401 HD13 LEU 50 HD13 LEU 50 9.775 -11.559 2.150 402 HD21 LEU 50 HD21 LEU 50 12.363 -12.664 1.042 403 HD22 LEU 50 HD22 LEU 50 12.595 -14.050 2.105 404 HD23 LEU 50 HD23 LEU 50 12.132 -12.489 2.782 405 H ARG 51 H ARG 51 11.543 -14.452 5.713 406 HA ARG 51 HA ARG 51 10.493 -16.221 7.599 407 HB2 ARG 51 HB2 ARG 51 10.969 -14.295 9.190 408 HB3 ARG 51 HB1 ARG 51 12.326 -14.861 8.223 409 HG2 ARG 51 HG2 ARG 51 11.642 -12.974 6.596 410 HG3 ARG 51 HG1 ARG 51 10.759 -12.339 7.980 411 HD2 ARG 51 HD2 ARG 51 13.695 -12.973 7.900 412 HD3 ARG 51 HD1 ARG 51 12.990 -11.365 7.767 413 HE ARG 51 HE ARG 51 12.199 -12.716 10.168 414 HH11 ARG 51 HH11 ARG 51 14.757 -10.829 8.698 415 HH12 ARG 51 HH12 ARG 51 15.393 -10.261 10.198 416 HH21 ARG 51 HH21 ARG 51 13.043 -11.971 12.182 417 HH22 ARG 51 HH22 ARG 51 14.415 -10.916 12.194 418 H ASN 52 H ASN 52 8.422 -16.607 7.875 419 HA ASN 52 HA ASN 52 6.310 -15.009 6.974 420 HB2 ASN 52 HB2 ASN 52 4.841 -16.623 7.962 421 HB3 ASN 52 HB1 ASN 52 6.232 -17.476 7.325 422 HD21 ASN 52 HD21 ASN 52 7.642 -18.497 8.726 423 HD22 ASN 52 HD22 ASN 52 7.274 -18.736 10.400 424 H ASP 53 H ASP 53 8.062 -14.897 9.895 425 HA ASP 53 HA ASP 53 6.040 -13.682 11.536 426 HB2 ASP 53 HB2 ASP 53 7.758 -15.087 12.515 427 HB3 ASP 53 HB1 ASP 53 9.017 -14.027 11.907 428 H TRP 54 H TRP 54 8.231 -12.471 9.201 429 HA TRP 54 HA TRP 54 8.456 -9.855 10.485 430 HB2 TRP 54 HB2 TRP 54 10.422 -11.045 9.442 431 HB3 TRP 54 HB1 TRP 54 9.673 -10.748 7.879 432 HD1 TRP 54 HD1 TRP 54 10.995 -8.896 6.739 433 HE1 TRP 54 HE1 TRP 54 11.993 -6.630 7.438 434 HE3 TRP 54 HE3 TRP 54 9.827 -8.988 11.716 435 HZ2 TRP 54 HZ2 TRP 54 12.240 -5.085 9.781 436 HZ3 TRP 54 HZ3 TRP 54 10.478 -7.075 13.113 437 HH2 TRP 54 HH2 TRP 54 11.661 -5.164 12.162 438 H THR 55 H THR 55 8.005 -7.893 9.293 439 HA THR 55 HA THR 55 5.546 -8.093 7.782 440 HB THR 55 HB THR 55 5.552 -6.394 9.489 441 HG1 THR 55 HG1 THR 55 4.853 -4.701 8.247 442 HG21 THR 55 HG21 THR 55 7.982 -5.242 8.104 443 HG22 THR 55 HG22 THR 55 7.958 -6.024 9.685 444 HG23 THR 55 HG23 THR 55 7.117 -4.492 9.446 445 H VAL 56 H VAL 56 5.224 -7.316 5.716 446 HA VAL 56 HA VAL 56 7.420 -7.669 3.947 447 HB VAL 56 HB VAL 56 5.046 -8.312 3.436 448 HG11 VAL 56 HG11 VAL 56 4.647 -5.356 3.042 449 HG12 VAL 56 HG12 VAL 56 3.912 -6.353 4.296 450 HG13 VAL 56 HG13 VAL 56 3.500 -6.621 2.602 451 HG21 VAL 56 HG21 VAL 56 6.690 -8.194 1.660 452 HG22 VAL 56 HG22 VAL 56 6.383 -6.469 1.459 453 HG23 VAL 56 HG23 VAL 56 5.122 -7.641 1.070 454 H GLN 57 H GLN 57 5.856 -4.928 5.413 455 HA GLN 57 HA GLN 57 6.578 -2.960 3.540 456 HB2 GLN 57 HB2 GLN 57 4.840 -2.720 5.290 457 HB3 GLN 57 HB1 GLN 57 6.101 -2.630 6.501 458 HG2 GLN 57 HG2 GLN 57 6.148 -0.676 4.253 459 HG3 GLN 57 HG1 GLN 57 4.961 -0.465 5.534 460 HE21 GLN 57 HE21 GLN 57 5.691 -0.055 7.649 461 HE22 GLN 57 HE22 GLN 57 7.283 0.539 7.952 462 H ASN 58 H ASN 58 8.093 -3.849 6.624 463 HA ASN 58 HA ASN 58 10.228 -1.999 6.302 464 HB2 ASN 58 HB2 ASN 58 9.378 -2.846 8.509 465 HB3 ASN 58 HB1 ASN 58 10.162 -4.381 8.154 466 HD21 ASN 58 HD21 ASN 58 10.619 -1.060 9.003 467 HD22 ASN 58 HD22 ASN 58 12.295 -1.178 9.413 468 H CYS 59 H CYS 59 9.686 -5.186 5.138 469 HA CYS 59 HA CYS 59 12.455 -5.859 4.802 470 HB2 CYS 59 HB2 CYS 59 10.679 -7.589 5.002 471 HB3 CYS 59 HB1 CYS 59 10.034 -7.075 3.448 472 HG CYS 59 HG CYS 59 12.810 -7.585 2.393 473 H ASP 60 H ASP 60 10.237 -3.894 3.190 474 HA ASP 60 HA ASP 60 10.290 -2.629 1.318 475 HB2 ASP 60 HB2 ASP 60 13.257 -2.986 1.724 476 HB3 ASP 60 HB1 ASP 60 12.560 -1.878 0.549 477 H LEU 61 H LEU 61 9.592 -5.122 0.614 478 HA LEU 61 HA LEU 61 11.134 -6.386 -1.355 479 HB2 LEU 61 HB2 LEU 61 8.177 -6.272 -0.854 480 HB3 LEU 61 HB1 LEU 61 8.783 -7.083 -2.279 481 HG LEU 61 HG LEU 61 8.347 -8.710 -0.570 482 HD11 LEU 61 HD11 LEU 61 10.296 -9.088 -1.994 483 HD12 LEU 61 HD12 LEU 61 10.496 -9.797 -0.393 484 HD13 LEU 61 HD13 LEU 61 11.319 -8.292 -0.797 485 HD21 LEU 61 HD21 LEU 61 8.498 -7.236 1.376 486 HD22 LEU 61 HD22 LEU 61 10.250 -7.176 1.186 487 HD23 LEU 61 HD23 LEU 61 9.458 -8.700 1.584 488 H ASP 62 H ASP 62 9.233 -3.510 -1.490 489 HA ASP 62 HA ASP 62 8.917 -3.273 -4.288 490 HB2 ASP 62 HB2 ASP 62 7.581 -1.932 -2.778 491 HB3 ASP 62 HB1 ASP 62 9.021 -1.178 -2.109 492 H GLN 63 H GLN 63 11.582 -2.692 -2.160 493 HA GLN 63 HA GLN 63 13.070 -1.291 -4.265 494 HB2 GLN 63 HB2 GLN 63 13.596 -1.578 -1.306 495 HB3 GLN 63 HB1 GLN 63 14.704 -0.807 -2.428 496 HG2 GLN 63 HG2 GLN 63 13.008 0.867 -2.957 497 HG3 GLN 63 HG1 GLN 63 11.893 0.088 -1.836 498 HE21 GLN 63 HE21 GLN 63 12.192 0.341 0.367 499 HE22 GLN 63 HE22 GLN 63 13.295 1.492 1.027 500 H GLN 64 H GLN 64 12.508 -4.337 -3.548 501 HA GLN 64 HA GLN 64 15.297 -5.180 -3.977 502 HB2 GLN 64 HB2 GLN 64 13.116 -6.725 -2.550 503 HB3 GLN 64 HB1 GLN 64 14.765 -7.267 -2.800 504 HG2 GLN 64 HG2 GLN 64 13.865 -4.960 -1.091 505 HG3 GLN 64 HG1 GLN 64 14.485 -6.514 -0.537 506 HE21 GLN 64 HE21 GLN 64 15.428 -3.812 -0.026 507 HE22 GLN 64 HE22 GLN 64 17.075 -3.753 -0.542 508 H SEP 65 H SEP 65 14.486 -7.922 -4.438 509 HA SEP 65 HA SEP 65 13.748 -7.710 -7.196 510 HB2 SEP 65 HB1 SEP 65 14.210 -10.169 -5.475 511 HB3 SEP 65 HB2 SEP 65 15.439 -9.351 -6.432 512 H ILE 66 H ILE 66 12.145 -9.788 -7.745 513 HA ILE 66 HA ILE 66 9.617 -8.823 -6.673 514 HB ILE 66 HB ILE 66 9.979 -8.992 -9.151 515 HG12 ILE 66 HG12 ILE 66 7.774 -10.792 -8.175 516 HG13 ILE 66 HG11 ILE 66 7.720 -9.035 -8.100 517 HG21 ILE 66 HG21 ILE 66 9.847 -11.166 -10.219 518 HG22 ILE 66 HG22 ILE 66 9.863 -11.945 -8.638 519 HG23 ILE 66 HG23 ILE 66 11.282 -11.044 -9.193 520 HD11 ILE 66 HD11 ILE 66 7.824 -8.897 -10.505 521 HD12 ILE 66 HD12 ILE 66 6.503 -9.966 -10.027 522 HD13 ILE 66 HD13 ILE 66 8.020 -10.644 -10.620 523 H VAL 67 H VAL 67 8.018 -10.205 -5.835 524 HA VAL 67 HA VAL 67 9.093 -12.425 -4.323 525 HB VAL 67 HB VAL 67 6.302 -11.253 -4.367 526 HG11 VAL 67 HG11 VAL 67 5.996 -12.409 -2.219 527 HG12 VAL 67 HG12 VAL 67 7.583 -13.158 -2.408 528 HG13 VAL 67 HG13 VAL 67 6.287 -13.536 -3.543 529 HG21 VAL 67 HG21 VAL 67 8.577 -10.771 -2.449 530 HG22 VAL 67 HG22 VAL 67 6.936 -10.147 -2.274 531 HG23 VAL 67 HG23 VAL 67 7.940 -9.622 -3.626 532 H HIS 68 H HIS 68 8.644 -14.547 -4.642 533 HA HIS 68 HA HIS 68 6.877 -15.234 -6.900 534 HB2 HIS 68 HB2 HIS 68 9.386 -16.608 -5.901 535 HB3 HIS 68 HB1 HIS 68 8.283 -17.331 -7.062 536 HD2 HIS 68 HD2 HIS 68 9.957 -13.740 -7.078 537 HE1 HIS 68 HE1 HIS 68 10.725 -15.732 -10.723 538 HE2 HIS 68 HE2 HIS 68 11.299 -13.730 -9.289 539 H ILE 69 H ILE 69 5.564 -17.106 -6.631 540 HA ILE 69 HA ILE 69 5.491 -18.242 -3.935 541 HB ILE 69 HB ILE 69 3.049 -17.123 -5.339 542 HG12 ILE 69 HG12 ILE 69 4.386 -16.375 -2.728 543 HG13 ILE 69 HG11 ILE 69 4.388 -15.417 -4.203 544 HG21 ILE 69 HG21 ILE 69 2.537 -19.247 -4.257 545 HG22 ILE 69 HG22 ILE 69 1.785 -17.907 -3.391 546 HG23 ILE 69 HG23 ILE 69 3.244 -18.662 -2.751 547 HD11 ILE 69 HD11 ILE 69 1.969 -15.161 -4.026 548 HD12 ILE 69 HD12 ILE 69 2.803 -14.544 -2.599 549 HD13 ILE 69 HD13 ILE 69 1.982 -16.105 -2.536 550 H VAL 70 H VAL 70 5.440 -20.366 -4.010 551 HA VAL 70 HA VAL 70 4.599 -21.618 -6.527 552 HB VAL 70 HB VAL 70 5.984 -23.555 -5.909 553 HG11 VAL 70 HG11 VAL 70 8.192 -22.500 -6.189 554 HG12 VAL 70 HG12 VAL 70 7.464 -20.929 -5.856 555 HG13 VAL 70 HG13 VAL 70 6.986 -21.839 -7.289 556 HG21 VAL 70 HG21 VAL 70 6.818 -21.888 -3.534 557 HG22 VAL 70 HG22 VAL 70 7.551 -23.415 -4.024 558 HG23 VAL 70 HG23 VAL 70 5.872 -23.376 -3.486 559 H GLN 71 H GLN 71 3.220 -23.334 -6.527 560 HA GLN 71 HA GLN 71 1.666 -23.696 -4.080 561 HB2 GLN 71 HB2 GLN 71 0.552 -22.957 -6.220 562 HB3 GLN 71 HB1 GLN 71 0.976 -24.517 -6.905 563 HG2 GLN 71 HG2 GLN 71 -0.397 -25.645 -5.257 564 HG3 GLN 71 HG1 GLN 71 -0.776 -24.102 -4.493 565 HE21 GLN 71 HE21 GLN 71 -2.571 -26.057 -5.667 566 HE22 GLN 71 HE22 GLN 71 -3.448 -25.224 -6.900 567 H ARG 72 H ARG 72 1.970 -25.514 -2.952 568 HA ARG 72 HA ARG 72 2.949 -27.866 -4.407 569 HB2 ARG 72 HB2 ARG 72 4.844 -26.935 -3.208 570 HB3 ARG 72 HB1 ARG 72 3.920 -26.889 -1.716 571 HG2 ARG 72 HG2 ARG 72 5.466 -28.753 -1.701 572 HG3 ARG 72 HG1 ARG 72 3.802 -29.339 -1.714 573 HD2 ARG 72 HD2 ARG 72 3.981 -29.680 -4.154 574 HD3 ARG 72 HD1 ARG 72 5.663 -29.161 -4.075 575 HE ARG 72 HE ARG 72 4.888 -31.416 -2.403 576 HH11 ARG 72 HH11 ARG 72 6.451 -30.284 -5.336 577 HH12 ARG 72 HH12 ARG 72 7.289 -31.769 -5.624 578 HH21 ARG 72 HH21 ARG 72 5.992 -33.379 -2.769 579 HH22 ARG 72 HH22 ARG 72 7.018 -33.550 -4.149 580 HA PRO 73 HA PRO 73 -0.553 -29.320 -1.957 581 HB2 PRO 73 HB2 PRO 73 -2.072 -30.206 -3.961 582 HB3 PRO 73 HB1 PRO 73 -1.989 -28.484 -3.574 583 HG2 PRO 73 HG2 PRO 73 -0.804 -29.962 -5.848 584 HG3 PRO 73 HG1 PRO 73 -1.287 -28.263 -5.742 585 HD2 PRO 73 HD2 PRO 73 1.342 -29.368 -5.447 586 HD3 PRO 73 HD1 PRO 73 0.854 -27.671 -5.284 587 H TRP 74 H TRP 74 -1.229 -31.495 -1.555 588 HA TRP 74 HA TRP 74 0.742 -33.456 -2.313 589 HB2 TRP 74 HB2 TRP 74 -1.646 -33.567 -0.482 590 HB3 TRP 74 HB1 TRP 74 -0.695 -34.996 -0.873 591 HD1 TRP 74 HD1 TRP 74 1.983 -34.842 -0.162 592 HE1 TRP 74 HE1 TRP 74 3.035 -33.757 1.910 593 HE3 TRP 74 HE3 TRP 74 -1.857 -31.740 1.152 594 HZ2 TRP 74 HZ2 TRP 74 2.332 -31.834 3.855 595 HZ3 TRP 74 HZ3 TRP 74 -1.586 -30.311 3.136 596 HH2 TRP 74 HH2 TRP 74 0.464 -30.360 4.457 597 H ARG 75 H ARG 75 0.346 -33.469 -4.534 598 HA ARG 75 HA ARG 75 -0.450 -34.250 -6.473 599 HB2 ARG 75 HB2 ARG 75 -1.590 -36.391 -4.686 600 HB3 ARG 75 HB1 ARG 75 -1.627 -36.463 -6.440 601 HG2 ARG 75 HG2 ARG 75 0.801 -36.469 -4.661 602 HG3 ARG 75 HG1 ARG 75 0.206 -37.781 -5.679 603 HD2 ARG 75 HD2 ARG 75 1.425 -35.165 -6.554 604 HD3 ARG 75 HD1 ARG 75 2.065 -36.783 -6.800 605 HE ARG 75 HE ARG 75 -0.457 -35.929 -8.068 606 HH11 ARG 75 HH11 ARG 75 2.779 -37.283 -8.331 607 HH12 ARG 75 HH12 ARG 75 2.651 -37.579 -10.028 608 HH21 ARG 75 HH21 ARG 75 -0.625 -36.327 -10.301 609 HH22 ARG 75 HH22 ARG 75 0.692 -37.050 -11.153 610 H LYS 76 H LYS 76 -1.694 -32.391 -6.777 611 HA LYS 76 HA LYS 76 -4.554 -33.002 -6.848 612 HB2 LYS 76 HB2 LYS 76 -3.296 -30.349 -6.123 613 HB3 LYS 76 HB1 LYS 76 -4.987 -30.536 -6.554 614 HG2 LYS 76 HG2 LYS 76 -5.203 -32.143 -4.638 615 HG3 LYS 76 HG1 LYS 76 -3.568 -31.687 -4.161 616 HD2 LYS 76 HD2 LYS 76 -5.089 -30.364 -2.869 617 HD3 LYS 76 HD1 LYS 76 -4.357 -29.301 -4.071 618 HE2 LYS 76 HE2 LYS 76 -6.355 -29.561 -5.492 619 HE3 LYS 76 HE1 LYS 76 -7.083 -30.590 -4.262 620 HZ1 LYS 76 HZ1 LYS 76 -6.919 -28.667 -2.721 621 HZ2 LYS 76 HZ2 LYS 76 -7.947 -28.403 -4.028 622 HZ3 LYS 76 HZ3 LYS 76 -6.414 -27.706 -4.021 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 0.013 -1.277 0.899 2 H2 MET 1 HT2 MET 1 -0.198 -0.186 -0.363 3 H3 MET 1 HT3 MET 1 0.586 0.311 1.059 4 HA MET 1 HA MET 1 2.187 -0.048 -0.672 5 HB2 MET 1 HB2 MET 1 2.873 -0.583 1.604 6 HB3 MET 1 HB1 MET 1 2.194 -2.197 1.451 7 HG2 MET 1 HG2 MET 1 3.852 -2.747 -0.242 8 HG3 MET 1 HG1 MET 1 4.517 -1.119 -0.133 9 HE1 MET 1 HE1 MET 1 6.205 -3.835 0.163 10 HE2 MET 1 HE2 MET 1 7.272 -3.425 1.503 11 HE3 MET 1 HE3 MET 1 6.942 -2.235 0.244 12 H ILE 2 H ILE 2 2.335 -0.860 -2.619 13 HA ILE 2 HA ILE 2 1.011 -3.404 -3.217 14 HB ILE 2 HB ILE 2 1.991 -1.226 -5.074 15 HG12 ILE 2 HG12 ILE 2 -0.800 -2.160 -4.404 16 HG13 ILE 2 HG11 ILE 2 -0.055 -0.680 -3.800 17 HG21 ILE 2 HG21 ILE 2 0.576 -3.814 -5.734 18 HG22 ILE 2 HG22 ILE 2 2.247 -3.410 -6.130 19 HG23 ILE 2 HG23 ILE 2 0.923 -2.515 -6.876 20 HD11 ILE 2 HD11 ILE 2 0.083 0.154 -6.102 21 HD12 ILE 2 HD12 ILE 2 -1.576 -0.209 -5.626 22 HD13 ILE 2 HD13 ILE 2 -0.692 -1.322 -6.671 23 H VAL 3 H VAL 3 2.240 -5.132 -3.254 24 HA VAL 3 HA VAL 3 5.034 -4.825 -4.110 25 HB VAL 3 HB VAL 3 5.512 -6.954 -2.961 26 HG11 VAL 3 HG11 VAL 3 5.868 -4.888 -1.753 27 HG12 VAL 3 HG12 VAL 3 5.305 -6.145 -0.649 28 HG13 VAL 3 HG13 VAL 3 4.192 -4.893 -1.204 29 HG21 VAL 3 HG21 VAL 3 3.875 -7.962 -1.460 30 HG22 VAL 3 HG22 VAL 3 3.298 -7.978 -3.126 31 HG23 VAL 3 HG23 VAL 3 2.662 -6.794 -1.982 32 H PHE 4 H PHE 4 5.897 -6.511 -5.470 33 HA PHE 4 HA PHE 4 3.869 -7.407 -7.354 34 HB2 PHE 4 HB2 PHE 4 6.886 -7.411 -7.559 35 HB3 PHE 4 HB1 PHE 4 5.780 -7.896 -8.839 36 HD1 PHE 4 HD1 PHE 4 7.631 -5.237 -7.474 37 HD2 PHE 4 HD2 PHE 4 4.013 -6.113 -9.533 38 HE1 PHE 4 HE1 PHE 4 7.506 -2.906 -8.239 39 HE2 PHE 4 HE2 PHE 4 3.884 -3.790 -10.307 40 HZ PHE 4 HZ PHE 4 5.631 -2.177 -9.658 41 H VAL 5 H VAL 5 3.265 -9.457 -7.573 42 HA VAL 5 HA VAL 5 4.895 -11.545 -6.305 43 HB VAL 5 HB VAL 5 1.931 -11.083 -5.896 44 HG11 VAL 5 HG11 VAL 5 1.890 -13.161 -4.629 45 HG12 VAL 5 HG12 VAL 5 3.562 -13.485 -5.094 46 HG13 VAL 5 HG13 VAL 5 2.293 -13.445 -6.322 47 HG21 VAL 5 HG21 VAL 5 4.224 -11.294 -3.960 48 HG22 VAL 5 HG22 VAL 5 2.529 -11.097 -3.518 49 HG23 VAL 5 HG23 VAL 5 3.367 -9.820 -4.405 50 H ARG 6 H ARG 6 5.166 -13.272 -7.561 51 HA ARG 6 HA ARG 6 3.268 -13.671 -9.768 52 HB2 ARG 6 HB2 ARG 6 5.126 -14.844 -10.967 53 HB3 ARG 6 HB1 ARG 6 5.409 -13.133 -10.718 54 HG2 ARG 6 HG2 ARG 6 6.994 -13.549 -9.024 55 HG3 ARG 6 HG1 ARG 6 6.538 -15.251 -8.923 56 HD2 ARG 6 HD2 ARG 6 8.644 -14.948 -10.152 57 HD3 ARG 6 HD1 ARG 6 7.383 -15.644 -11.166 58 HE ARG 6 HE ARG 6 7.317 -12.886 -11.534 59 HH11 ARG 6 HH11 ARG 6 9.525 -15.552 -12.155 60 HH12 ARG 6 HH12 ARG 6 10.281 -14.776 -13.501 61 HH21 ARG 6 HH21 ARG 6 8.316 -11.875 -13.335 62 HH22 ARG 6 HH22 ARG 6 9.595 -12.686 -14.169 63 H PHE 7 H PHE 7 2.052 -15.378 -9.587 64 HA PHE 7 HA PHE 7 2.680 -17.359 -7.552 65 HB2 PHE 7 HB2 PHE 7 0.413 -16.230 -7.750 66 HB3 PHE 7 HB1 PHE 7 0.172 -17.157 -9.225 67 HD1 PHE 7 HD1 PHE 7 0.380 -17.281 -5.593 68 HD2 PHE 7 HD2 PHE 7 -0.195 -19.553 -9.138 69 HE1 PHE 7 HE1 PHE 7 -0.456 -19.155 -4.252 70 HE2 PHE 7 HE2 PHE 7 -1.030 -21.437 -7.803 71 HZ PHE 7 HZ PHE 7 -1.155 -21.243 -5.357 72 H ASN 8 H ASN 8 2.892 -19.534 -7.942 73 HA ASN 8 HA ASN 8 3.648 -21.382 -9.001 74 HB2 ASN 8 HB2 ASN 8 2.210 -22.331 -10.720 75 HB3 ASN 8 HB1 ASN 8 1.231 -21.566 -9.482 76 HD21 ASN 8 HD21 ASN 8 2.296 -21.445 -12.785 77 HD22 ASN 8 HD22 ASN 8 1.116 -20.305 -13.332 78 H SER 9 H SER 9 5.075 -19.010 -9.690 79 HA SER 9 HA SER 9 6.822 -18.388 -10.990 80 HB2 SER 9 HB2 SER 9 6.483 -21.077 -12.346 81 HB3 SER 9 HB1 SER 9 7.923 -20.055 -12.383 82 HG SER 9 HG SER 9 8.499 -20.922 -10.572 83 H SER 10 H SER 10 3.927 -18.079 -11.839 84 HA SER 10 HA SER 10 4.112 -17.848 -14.724 85 HB2 SER 10 HB2 SER 10 2.015 -18.608 -13.557 86 HB3 SER 10 HB1 SER 10 1.880 -17.006 -12.839 87 HG SER 10 HG SER 10 1.533 -17.808 -15.518 88 H HIS 11 H HIS 11 2.425 -15.432 -14.762 89 HA HIS 11 HA HIS 11 4.520 -13.479 -14.788 90 HB2 HIS 11 HB2 HIS 11 1.547 -13.215 -15.263 91 HB3 HIS 11 HB1 HIS 11 2.708 -11.915 -15.496 92 HD2 HIS 11 HD2 HIS 11 4.906 -13.042 -17.344 93 HE1 HIS 11 HE1 HIS 11 1.811 -14.760 -19.659 94 HE2 HIS 11 HE2 HIS 11 4.278 -14.201 -19.579 95 H GLY 12 H GLY 12 4.358 -11.389 -13.706 96 HA2 GLY 12 HA2 GLY 12 3.619 -11.800 -10.917 97 HA3 GLY 12 HA1 GLY 12 4.647 -10.523 -11.550 98 H PHE 13 H PHE 13 1.980 -10.871 -9.946 99 HA PHE 13 HA PHE 13 0.594 -8.701 -11.349 100 HB2 PHE 13 HB2 PHE 13 -1.474 -9.506 -10.094 101 HB3 PHE 13 HB1 PHE 13 -0.891 -10.556 -11.376 102 HD1 PHE 13 HD1 PHE 13 -1.284 -10.157 -7.750 103 HD2 PHE 13 HD2 PHE 13 0.021 -12.730 -10.880 104 HE1 PHE 13 HE1 PHE 13 -1.241 -12.046 -6.177 105 HE2 PHE 13 HE2 PHE 13 0.069 -14.620 -9.311 106 HZ PHE 13 HZ PHE 13 -0.564 -14.281 -6.956 107 HA PRO 14 HA PRO 14 1.301 -6.261 -7.742 108 HB2 PRO 14 HB2 PRO 14 -1.074 -4.673 -8.135 109 HB3 PRO 14 HB1 PRO 14 0.591 -4.273 -8.564 110 HG2 PRO 14 HG2 PRO 14 -1.396 -4.742 -10.402 111 HG3 PRO 14 HG1 PRO 14 0.330 -4.966 -10.727 112 HD2 PRO 14 HD2 PRO 14 -1.750 -7.000 -10.031 113 HD3 PRO 14 HD1 PRO 14 -0.427 -7.097 -11.213 114 H VAL 15 H VAL 15 0.971 -6.758 -5.678 115 HA VAL 15 HA VAL 15 -1.766 -7.399 -4.809 116 HB VAL 15 HB VAL 15 0.854 -8.292 -3.558 117 HG11 VAL 15 HG11 VAL 15 -0.534 -9.663 -2.089 118 HG12 VAL 15 HG12 VAL 15 -1.989 -8.990 -2.825 119 HG13 VAL 15 HG13 VAL 15 -0.909 -7.950 -1.897 120 HG21 VAL 15 HG21 VAL 15 -1.226 -9.855 -5.081 121 HG22 VAL 15 HG22 VAL 15 0.196 -10.531 -4.287 122 HG23 VAL 15 HG23 VAL 15 0.386 -9.436 -5.657 123 H GLU 16 H GLU 16 -2.691 -5.869 -3.667 124 HA GLU 16 HA GLU 16 -1.092 -3.745 -2.480 125 HB2 GLU 16 HB2 GLU 16 -3.347 -3.628 -3.917 126 HB3 GLU 16 HB1 GLU 16 -4.065 -3.773 -2.325 127 HG2 GLU 16 HG2 GLU 16 -2.089 -1.646 -3.121 128 HG3 GLU 16 HG1 GLU 16 -3.835 -1.440 -3.120 129 H VAL 17 H VAL 17 -0.430 -4.000 -0.474 130 HA VAL 17 HA VAL 17 -2.260 -5.117 1.538 131 HB VAL 17 HB VAL 17 -0.257 -6.146 2.673 132 HG11 VAL 17 HG11 VAL 17 -0.227 -8.146 1.268 133 HG12 VAL 17 HG12 VAL 17 -0.985 -7.234 -0.038 134 HG13 VAL 17 HG13 VAL 17 -1.860 -7.511 1.468 135 HG21 VAL 17 HG21 VAL 17 1.505 -4.912 1.525 136 HG22 VAL 17 HG22 VAL 17 1.048 -5.654 -0.007 137 HG23 VAL 17 HG23 VAL 17 1.715 -6.648 1.287 138 H ASP 18 H ASP 18 -0.877 -4.777 3.776 139 HA ASP 18 HA ASP 18 -0.569 -1.872 3.916 140 HB2 ASP 18 HB2 ASP 18 -0.758 -3.964 6.101 141 HB3 ASP 18 HB1 ASP 18 -0.609 -2.238 6.379 142 H SER 19 H SER 19 1.187 -1.092 5.405 143 HA SER 19 HA SER 19 3.686 -2.346 4.688 144 HB2 SER 19 HB2 SER 19 3.086 0.120 6.345 145 HB3 SER 19 HB1 SER 19 4.698 -0.400 5.854 146 HG SER 19 HG SER 19 4.340 0.277 3.885 147 H ASP 20 H ASP 20 1.494 -3.175 6.798 148 HA ASP 20 HA ASP 20 3.423 -4.029 8.851 149 HB2 ASP 20 HB2 ASP 20 0.489 -3.376 9.236 150 HB3 ASP 20 HB1 ASP 20 1.570 -3.990 10.481 151 H THR 21 H THR 21 1.795 -5.042 6.286 152 HA THR 21 HA THR 21 0.385 -7.315 7.193 153 HB THR 21 HB THR 21 1.601 -6.734 4.480 154 HG1 THR 21 HG1 THR 21 -0.978 -6.281 5.592 155 HG21 THR 21 HG21 THR 21 -0.068 -8.351 3.636 156 HG22 THR 21 HG22 THR 21 -0.499 -8.751 5.301 157 HG23 THR 21 HG23 THR 21 1.122 -9.109 4.695 158 H SER 22 H SER 22 1.303 -8.985 8.197 159 HA SER 22 HA SER 22 4.045 -9.633 7.985 160 HB2 SER 22 HB2 SER 22 1.782 -11.381 8.982 161 HB3 SER 22 HB1 SER 22 3.497 -11.544 9.371 162 HG SER 22 HG SER 22 3.365 -9.920 10.744 163 H ILE 23 H ILE 23 5.003 -11.426 6.953 164 HA ILE 23 HA ILE 23 4.225 -11.868 4.329 165 HB ILE 23 HB ILE 23 6.002 -13.614 6.038 166 HG12 ILE 23 HG12 ILE 23 6.782 -11.313 5.945 167 HG13 ILE 23 HG11 ILE 23 7.844 -12.343 4.993 168 HG21 ILE 23 HG21 ILE 23 5.832 -13.452 3.028 169 HG22 ILE 23 HG22 ILE 23 5.239 -14.786 4.014 170 HG23 ILE 23 HG23 ILE 23 6.965 -14.436 3.953 171 HD11 ILE 23 HD11 ILE 23 7.458 -10.265 3.844 172 HD12 ILE 23 HD12 ILE 23 5.713 -10.493 3.941 173 HD13 ILE 23 HD13 ILE 23 6.691 -11.578 2.951 174 H PHE 24 H PHE 24 3.463 -13.804 7.189 175 HA PHE 24 HA PHE 24 2.309 -15.989 5.818 176 HB2 PHE 24 HB2 PHE 24 2.922 -15.945 8.268 177 HB3 PHE 24 HB1 PHE 24 1.486 -14.969 8.540 178 HD1 PHE 24 HD1 PHE 24 2.619 -18.245 7.240 179 HD2 PHE 24 HD2 PHE 24 -0.603 -15.964 8.824 180 HE1 PHE 24 HE1 PHE 24 1.265 -20.287 7.410 181 HE2 PHE 24 HE2 PHE 24 -1.962 -18.004 9.002 182 HZ PHE 24 HZ PHE 24 -1.030 -20.168 8.293 183 H GLN 25 H GLN 25 0.966 -12.961 7.031 184 HA GLN 25 HA GLN 25 -1.724 -13.490 6.341 185 HB2 GLN 25 HB2 GLN 25 -0.283 -10.842 6.608 186 HB3 GLN 25 HB1 GLN 25 -2.026 -11.035 6.501 187 HG2 GLN 25 HG2 GLN 25 -2.050 -12.248 8.596 188 HG3 GLN 25 HG1 GLN 25 -0.293 -12.157 8.692 189 HE21 GLN 25 HE21 GLN 25 -2.308 -9.527 7.561 190 HE22 GLN 25 HE22 GLN 25 -2.015 -8.479 8.902 191 H LEU 26 H LEU 26 0.956 -11.929 4.677 192 HA LEU 26 HA LEU 26 -0.362 -11.140 2.344 193 HB2 LEU 26 HB2 LEU 26 1.857 -10.368 2.842 194 HB3 LEU 26 HB1 LEU 26 2.485 -12.003 2.831 195 HG LEU 26 HG LEU 26 2.049 -12.125 0.394 196 HD11 LEU 26 HD11 LEU 26 1.533 -10.103 -0.843 197 HD12 LEU 26 HD12 LEU 26 1.386 -9.200 0.662 198 HD13 LEU 26 HD13 LEU 26 0.233 -10.482 0.287 199 HD21 LEU 26 HD21 LEU 26 3.758 -9.824 1.313 200 HD22 LEU 26 HD22 LEU 26 3.875 -10.621 -0.258 201 HD23 LEU 26 HD23 LEU 26 4.248 -11.515 1.216 202 H LYS 27 H LYS 27 1.289 -14.177 3.143 203 HA LYS 27 HA LYS 27 0.840 -15.472 0.695 204 HB2 LYS 27 HB2 LYS 27 2.438 -16.256 2.450 205 HB3 LYS 27 HB1 LYS 27 1.067 -16.751 3.433 206 HG2 LYS 27 HG2 LYS 27 0.420 -18.395 1.816 207 HG3 LYS 27 HG1 LYS 27 1.638 -17.821 0.679 208 HD2 LYS 27 HD2 LYS 27 2.527 -19.784 1.654 209 HD3 LYS 27 HD1 LYS 27 3.364 -18.443 2.429 210 HE2 LYS 27 HE2 LYS 27 2.011 -18.653 4.394 211 HE3 LYS 27 HE1 LYS 27 0.965 -19.835 3.608 212 HZ1 LYS 27 HZ1 LYS 27 2.558 -20.907 5.090 213 HZ2 LYS 27 HZ2 LYS 27 3.843 -20.228 4.236 214 HZ3 LYS 27 HZ3 LYS 27 2.841 -21.359 3.485 215 H GLU 28 H GLU 28 -1.078 -15.263 3.640 216 HA GLU 28 HA GLU 28 -3.129 -17.039 2.867 217 HB2 GLU 28 HB2 GLU 28 -2.537 -15.320 5.071 218 HB3 GLU 28 HB1 GLU 28 -4.189 -15.024 4.556 219 HG2 GLU 28 HG2 GLU 28 -3.133 -17.773 5.115 220 HG3 GLU 28 HG1 GLU 28 -3.875 -16.757 6.349 221 H VAL 29 H VAL 29 -2.626 -13.581 2.355 222 HA VAL 29 HA VAL 29 -5.182 -12.990 1.302 223 HB VAL 29 HB VAL 29 -2.519 -11.631 0.771 224 HG11 VAL 29 HG11 VAL 29 -3.834 -9.722 -0.041 225 HG12 VAL 29 HG12 VAL 29 -5.312 -10.668 0.133 226 HG13 VAL 29 HG13 VAL 29 -4.088 -11.154 -1.040 227 HG21 VAL 29 HG21 VAL 29 -3.218 -11.535 3.103 228 HG22 VAL 29 HG22 VAL 29 -4.792 -10.905 2.619 229 HG23 VAL 29 HG23 VAL 29 -3.339 -9.945 2.352 230 H VAL 30 H VAL 30 -2.113 -13.806 -0.300 231 HA VAL 30 HA VAL 30 -3.176 -13.801 -2.920 232 HB VAL 30 HB VAL 30 -0.775 -15.334 -1.877 233 HG11 VAL 30 HG11 VAL 30 -0.009 -15.302 -4.212 234 HG12 VAL 30 HG12 VAL 30 -1.525 -14.541 -4.694 235 HG13 VAL 30 HG13 VAL 30 -1.530 -16.177 -4.036 236 HG21 VAL 30 HG21 VAL 30 -0.947 -12.592 -3.131 237 HG22 VAL 30 HG22 VAL 30 0.540 -13.433 -2.694 238 HG23 VAL 30 HG23 VAL 30 -0.596 -12.939 -1.439 239 H ALA 31 H ALA 31 -2.890 -16.277 -0.446 240 HA ALA 31 HA ALA 31 -3.546 -18.532 -1.924 241 HB1 ALA 31 HB1 ALA 31 -4.271 -17.952 0.941 242 HB2 ALA 31 HB2 ALA 31 -2.730 -18.605 0.381 243 HB3 ALA 31 HB3 ALA 31 -4.210 -19.543 0.181 244 H LYS 32 H LYS 32 -5.733 -16.421 -0.064 245 HA LYS 32 HA LYS 32 -8.073 -17.770 -0.983 246 HB2 LYS 32 HB2 LYS 32 -9.322 -15.938 0.052 247 HB3 LYS 32 HB1 LYS 32 -8.090 -16.554 1.134 248 HG2 LYS 32 HG2 LYS 32 -6.647 -14.649 0.531 249 HG3 LYS 32 HG1 LYS 32 -7.937 -14.029 -0.498 250 HD2 LYS 32 HD2 LYS 32 -8.279 -12.827 1.427 251 HD3 LYS 32 HD1 LYS 32 -9.366 -14.191 1.676 252 HE2 LYS 32 HE2 LYS 32 -6.574 -13.920 2.823 253 HE3 LYS 32 HE1 LYS 32 -8.074 -13.676 3.709 254 HZ1 LYS 32 HZ1 LYS 32 -7.189 -16.233 2.483 255 HZ2 LYS 32 HZ2 LYS 32 -8.621 -15.999 3.345 256 HZ3 LYS 32 HZ3 LYS 32 -7.132 -15.863 4.130 257 H ARG 33 H ARG 33 -6.184 -15.100 -2.138 258 HA ARG 33 HA ARG 33 -8.076 -13.899 -3.824 259 HB2 ARG 33 HB2 ARG 33 -5.701 -13.114 -3.047 260 HB3 ARG 33 HB1 ARG 33 -5.140 -13.972 -4.471 261 HG2 ARG 33 HG2 ARG 33 -7.236 -11.818 -4.618 262 HG3 ARG 33 HG1 ARG 33 -5.512 -11.468 -4.684 263 HD2 ARG 33 HD2 ARG 33 -5.325 -12.968 -6.642 264 HD3 ARG 33 HD1 ARG 33 -7.071 -13.213 -6.588 265 HE ARG 33 HE ARG 33 -7.108 -10.647 -6.837 266 HH11 ARG 33 HH11 ARG 33 -4.781 -12.800 -8.364 267 HH12 ARG 33 HH12 ARG 33 -4.492 -11.737 -9.698 268 HH21 ARG 33 HH21 ARG 33 -6.710 -9.247 -8.607 269 HH22 ARG 33 HH22 ARG 33 -5.581 -9.716 -9.832 270 H GLN 34 H GLN 34 -5.794 -16.548 -4.298 271 HA GLN 34 HA GLN 34 -6.706 -16.869 -7.060 272 HB2 GLN 34 HB2 GLN 34 -4.437 -18.232 -5.609 273 HB3 GLN 34 HB1 GLN 34 -4.810 -18.399 -7.319 274 HG2 GLN 34 HG2 GLN 34 -4.018 -15.834 -5.955 275 HG3 GLN 34 HG1 GLN 34 -2.939 -16.856 -6.892 276 HE21 GLN 34 HE21 GLN 34 -4.992 -17.472 -8.895 277 HE22 GLN 34 HE22 GLN 34 -5.167 -16.044 -9.849 278 H GLY 35 H GLY 35 -7.098 -18.271 -3.946 279 HA2 GLY 35 HA2 GLY 35 -8.723 -19.855 -3.366 280 HA3 GLY 35 HA1 GLY 35 -8.916 -20.250 -5.069 281 H VAL 36 H VAL 36 -6.051 -20.221 -2.992 282 HA VAL 36 HA VAL 36 -5.671 -23.081 -3.600 283 HB VAL 36 HB VAL 36 -3.242 -22.694 -3.688 284 HG11 VAL 36 HG11 VAL 36 -4.504 -22.616 -5.765 285 HG12 VAL 36 HG12 VAL 36 -3.150 -21.486 -5.817 286 HG13 VAL 36 HG13 VAL 36 -4.788 -20.889 -5.543 287 HG21 VAL 36 HG21 VAL 36 -3.925 -19.767 -3.447 288 HG22 VAL 36 HG22 VAL 36 -2.316 -20.441 -3.708 289 HG23 VAL 36 HG23 VAL 36 -3.166 -20.741 -2.190 290 HA PRO 37 HA PRO 37 -5.204 -23.712 0.751 291 HB2 PRO 37 HB2 PRO 37 -3.291 -25.647 0.870 292 HB3 PRO 37 HB1 PRO 37 -4.951 -25.962 0.353 293 HG2 PRO 37 HG2 PRO 37 -2.495 -25.550 -1.306 294 HG3 PRO 37 HG1 PRO 37 -3.810 -26.722 -1.518 295 HD2 PRO 37 HD2 PRO 37 -3.631 -24.442 -2.970 296 HD3 PRO 37 HD1 PRO 37 -5.183 -25.183 -2.539 297 H ALA 38 H ALA 38 -4.334 -22.127 1.942 298 HA ALA 38 HA ALA 38 -1.832 -20.914 1.439 299 HB1 ALA 38 HB1 ALA 38 -3.500 -20.763 3.947 300 HB2 ALA 38 HB2 ALA 38 -3.691 -19.744 2.521 301 HB3 ALA 38 HB3 ALA 38 -2.214 -19.651 3.477 302 H ASP 39 H ASP 39 -2.771 -23.583 3.466 303 HA ASP 39 HA ASP 39 -0.457 -23.612 5.120 304 HB2 ASP 39 HB2 ASP 39 -2.397 -25.812 4.379 305 HB3 ASP 39 HB1 ASP 39 -1.105 -26.004 5.556 306 H GLN 40 H GLN 40 -1.311 -25.122 2.081 307 HA GLN 40 HA GLN 40 1.310 -26.384 1.914 308 HB2 GLN 40 HB2 GLN 40 -1.121 -26.606 0.134 309 HB3 GLN 40 HB1 GLN 40 0.376 -27.503 -0.088 310 HG2 GLN 40 HG2 GLN 40 0.064 -28.587 2.067 311 HG3 GLN 40 HG1 GLN 40 -1.417 -27.670 2.325 312 HE21 GLN 40 HE21 GLN 40 -0.952 -30.549 2.199 313 HE22 GLN 40 HE22 GLN 40 -2.006 -31.146 0.963 314 H LEU 41 H LEU 41 0.547 -23.440 1.585 315 HA LEU 41 HA LEU 41 1.591 -22.974 -1.099 316 HB2 LEU 41 HB2 LEU 41 -0.499 -21.820 -0.250 317 HB3 LEU 41 HB1 LEU 41 0.531 -20.947 0.865 318 HG LEU 41 HG LEU 41 1.721 -19.928 -1.012 319 HD11 LEU 41 HD11 LEU 41 0.847 -20.215 -3.286 320 HD12 LEU 41 HD12 LEU 41 -0.253 -21.459 -2.696 321 HD13 LEU 41 HD13 LEU 41 1.491 -21.715 -2.630 322 HD21 LEU 41 HD21 LEU 41 -0.093 -18.500 -1.807 323 HD22 LEU 41 HD22 LEU 41 -0.245 -18.805 -0.077 324 HD23 LEU 41 HD23 LEU 41 -1.278 -19.663 -1.218 325 H ARG 42 H ARG 42 3.546 -22.011 -1.437 326 HA ARG 42 HA ARG 42 5.171 -21.488 0.962 327 HB2 ARG 42 HB2 ARG 42 5.707 -23.622 -0.190 328 HB3 ARG 42 HB1 ARG 42 6.087 -22.710 -1.641 329 HG2 ARG 42 HG2 ARG 42 8.092 -23.364 -0.398 330 HG3 ARG 42 HG1 ARG 42 7.918 -21.609 -0.499 331 HD2 ARG 42 HD2 ARG 42 7.307 -21.404 1.690 332 HD3 ARG 42 HD1 ARG 42 6.797 -23.089 1.827 333 HE ARG 42 HE ARG 42 9.455 -22.024 2.216 334 HH11 ARG 42 HH11 ARG 42 7.637 -24.920 1.403 335 HH12 ARG 42 HH12 ARG 42 8.807 -26.001 2.065 336 HH21 ARG 42 HH21 ARG 42 11.014 -23.475 3.122 337 HH22 ARG 42 HH22 ARG 42 10.725 -25.189 3.037 338 H VAL 43 H VAL 43 6.177 -19.562 1.028 339 HA VAL 43 HA VAL 43 6.170 -17.984 -1.418 340 HB VAL 43 HB VAL 43 6.671 -16.010 0.068 341 HG11 VAL 43 HG11 VAL 43 4.144 -17.547 0.643 342 HG12 VAL 43 HG12 VAL 43 4.412 -16.423 -0.686 343 HG13 VAL 43 HG13 VAL 43 4.388 -15.834 0.973 344 HG21 VAL 43 HG21 VAL 43 6.061 -17.965 2.283 345 HG22 VAL 43 HG22 VAL 43 6.277 -16.225 2.471 346 HG23 VAL 43 HG23 VAL 43 7.631 -17.231 1.961 347 H ILE 44 H ILE 44 7.954 -17.900 -2.557 348 HA ILE 44 HA ILE 44 10.520 -18.235 -1.160 349 HB ILE 44 HB ILE 44 9.818 -19.051 -3.993 350 HG12 ILE 44 HG12 ILE 44 8.849 -20.569 -2.343 351 HG13 ILE 44 HG11 ILE 44 10.176 -21.357 -3.189 352 HG21 ILE 44 HG21 ILE 44 12.413 -19.369 -2.478 353 HG22 ILE 44 HG22 ILE 44 12.127 -18.292 -3.844 354 HG23 ILE 44 HG23 ILE 44 12.068 -20.039 -4.072 355 HD11 ILE 44 HD11 ILE 44 11.637 -20.882 -1.259 356 HD12 ILE 44 HD12 ILE 44 10.257 -21.898 -0.847 357 HD13 ILE 44 HD13 ILE 44 10.253 -20.190 -0.414 358 H PHE 45 H PHE 45 12.053 -16.771 -1.506 359 HA PHE 45 HA PHE 45 11.575 -14.744 -3.569 360 HB2 PHE 45 HB2 PHE 45 11.009 -13.945 -1.245 361 HB3 PHE 45 HB1 PHE 45 12.704 -14.176 -0.827 362 HD1 PHE 45 HD1 PHE 45 10.457 -12.383 -3.146 363 HD2 PHE 45 HD2 PHE 45 14.250 -12.499 -1.241 364 HE1 PHE 45 HE1 PHE 45 10.942 -10.133 -3.995 365 HE2 PHE 45 HE2 PHE 45 14.743 -10.248 -2.083 366 HZ PHE 45 HZ PHE 45 13.086 -9.065 -3.464 367 H ALA 46 H ALA 46 13.072 -15.110 -5.024 368 HA ALA 46 HA ALA 46 15.061 -15.376 -6.062 369 HB1 ALA 46 HB1 ALA 46 16.314 -14.699 -3.396 370 HB2 ALA 46 HB2 ALA 46 15.858 -13.534 -4.638 371 HB3 ALA 46 HB3 ALA 46 17.133 -14.710 -4.957 372 H GLY 47 H GLY 47 15.595 -16.668 -2.816 373 HA2 GLY 47 HA2 GLY 47 15.598 -19.385 -3.773 374 HA3 GLY 47 HA1 GLY 47 17.206 -18.804 -3.358 375 H LYS 48 H LYS 48 15.051 -17.187 -1.465 376 HA LYS 48 HA LYS 48 15.337 -19.126 0.727 377 HB2 LYS 48 HB2 LYS 48 15.506 -17.189 2.239 378 HB3 LYS 48 HB1 LYS 48 16.830 -17.256 1.085 379 HG2 LYS 48 HG2 LYS 48 15.978 -15.467 -0.167 380 HG3 LYS 48 HG1 LYS 48 14.390 -15.583 0.593 381 HD2 LYS 48 HD2 LYS 48 15.232 -14.786 2.648 382 HD3 LYS 48 HD1 LYS 48 16.906 -14.861 2.074 383 HE2 LYS 48 HE2 LYS 48 16.289 -13.169 0.332 384 HE3 LYS 48 HE1 LYS 48 14.710 -13.030 1.099 385 HZ1 LYS 48 HZ1 LYS 48 15.823 -12.313 3.135 386 HZ2 LYS 48 HZ2 LYS 48 16.167 -11.287 1.845 387 HZ3 LYS 48 HZ3 LYS 48 17.324 -12.404 2.358 388 H GLU 49 H GLU 49 13.806 -18.336 2.583 389 HA GLU 49 HA GLU 49 11.228 -17.600 1.404 390 HB2 GLU 49 HB2 GLU 49 10.147 -19.026 3.132 391 HB3 GLU 49 HB1 GLU 49 11.116 -19.936 1.985 392 HG2 GLU 49 HG2 GLU 49 12.947 -19.968 3.669 393 HG3 GLU 49 HG1 GLU 49 11.834 -19.221 4.814 394 H LEU 50 H LEU 50 10.226 -15.959 2.314 395 HA LEU 50 HA LEU 50 11.593 -14.338 4.205 396 HB2 LEU 50 HB2 LEU 50 8.728 -14.062 3.349 397 HB3 LEU 50 HB1 LEU 50 9.788 -12.805 3.951 398 HG LEU 50 HG LEU 50 10.076 -14.219 1.310 399 HD11 LEU 50 HD11 LEU 50 8.116 -12.796 1.378 400 HD12 LEU 50 HD12 LEU 50 9.360 -12.116 0.331 401 HD13 LEU 50 HD13 LEU 50 9.102 -11.448 1.944 402 HD21 LEU 50 HD21 LEU 50 11.745 -12.484 0.826 403 HD22 LEU 50 HD22 LEU 50 12.224 -13.477 2.200 404 HD23 LEU 50 HD23 LEU 50 11.568 -11.863 2.467 405 H ARG 51 H ARG 51 11.164 -13.957 6.327 406 HA ARG 51 HA ARG 51 10.050 -15.956 7.927 407 HB2 ARG 51 HB2 ARG 51 10.022 -14.079 9.712 408 HB3 ARG 51 HB1 ARG 51 11.566 -14.579 9.041 409 HG2 ARG 51 HG2 ARG 51 10.280 -12.383 7.593 410 HG3 ARG 51 HG1 ARG 51 10.709 -12.012 9.264 411 HD2 ARG 51 HD2 ARG 51 12.632 -13.242 7.305 412 HD3 ARG 51 HD1 ARG 51 12.474 -11.502 7.537 413 HE ARG 51 HE ARG 51 12.866 -12.815 10.012 414 HH11 ARG 51 HH11 ARG 51 14.609 -11.852 7.127 415 HH12 ARG 51 HH12 ARG 51 16.116 -11.664 7.954 416 HH21 ARG 51 HH21 ARG 51 14.850 -12.546 11.104 417 HH22 ARG 51 HH22 ARG 51 16.253 -12.054 10.218 418 H ASN 52 H ASN 52 8.036 -16.561 8.083 419 HA ASN 52 HA ASN 52 5.884 -15.290 6.892 420 HB2 ASN 52 HB2 ASN 52 4.474 -16.988 7.884 421 HB3 ASN 52 HB1 ASN 52 5.984 -17.704 7.356 422 HD21 ASN 52 HD21 ASN 52 3.960 -16.958 10.055 423 HD22 ASN 52 HD22 ASN 52 4.885 -17.795 11.245 424 H ASP 53 H ASP 53 7.002 -14.908 10.206 425 HA ASP 53 HA ASP 53 4.463 -13.594 10.867 426 HB2 ASP 53 HB2 ASP 53 5.460 -15.414 12.334 427 HB3 ASP 53 HB1 ASP 53 6.687 -14.240 12.795 428 H TRP 54 H TRP 54 6.861 -12.385 9.295 429 HA TRP 54 HA TRP 54 7.126 -10.030 11.035 430 HB2 TRP 54 HB2 TRP 54 9.201 -11.405 10.551 431 HB3 TRP 54 HB1 TRP 54 9.072 -10.832 8.894 432 HD1 TRP 54 HD1 TRP 54 8.733 -8.817 12.200 433 HE1 TRP 54 HE1 TRP 54 10.436 -6.883 12.106 434 HE3 TRP 54 HE3 TRP 54 10.937 -9.935 7.755 435 HZ2 TRP 54 HZ2 TRP 54 12.458 -5.975 10.368 436 HZ3 TRP 54 HZ3 TRP 54 12.759 -8.492 6.937 437 HH2 TRP 54 HH2 TRP 54 13.493 -6.549 8.221 438 H THR 55 H THR 55 7.594 -7.980 9.745 439 HA THR 55 HA THR 55 5.334 -7.494 8.114 440 HB THR 55 HB THR 55 6.131 -5.764 9.600 441 HG1 THR 55 HG1 THR 55 5.564 -4.269 8.212 442 HG21 THR 55 HG21 THR 55 8.642 -5.719 7.907 443 HG22 THR 55 HG22 THR 55 8.529 -6.263 9.581 444 HG23 THR 55 HG23 THR 55 8.248 -4.568 9.184 445 H VAL 56 H VAL 56 5.131 -7.003 5.993 446 HA VAL 56 HA VAL 56 7.080 -8.053 4.169 447 HB VAL 56 HB VAL 56 4.631 -8.306 3.799 448 HG11 VAL 56 HG11 VAL 56 4.666 -5.342 3.260 449 HG12 VAL 56 HG12 VAL 56 3.875 -6.148 4.616 450 HG13 VAL 56 HG13 VAL 56 3.308 -6.429 2.968 451 HG21 VAL 56 HG21 VAL 56 6.129 -8.523 1.916 452 HG22 VAL 56 HG22 VAL 56 6.070 -6.782 1.638 453 HG23 VAL 56 HG23 VAL 56 4.623 -7.762 1.406 454 H GLN 57 H GLN 57 6.366 -4.994 5.538 455 HA GLN 57 HA GLN 57 7.136 -3.220 3.522 456 HB2 GLN 57 HB2 GLN 57 6.031 -2.478 5.553 457 HB3 GLN 57 HB1 GLN 57 7.423 -2.958 6.514 458 HG2 GLN 57 HG2 GLN 57 8.774 -1.287 5.243 459 HG3 GLN 57 HG1 GLN 57 7.277 -0.735 4.494 460 HE21 GLN 57 HE21 GLN 57 9.126 -0.894 7.420 461 HE22 GLN 57 HE22 GLN 57 8.195 0.260 8.308 462 H ASN 58 H ASN 58 9.061 -4.769 6.055 463 HA ASN 58 HA ASN 58 11.477 -3.503 5.090 464 HB2 ASN 58 HB2 ASN 58 10.813 -4.057 7.564 465 HB3 ASN 58 HB1 ASN 58 11.453 -5.650 7.181 466 HD21 ASN 58 HD21 ASN 58 12.454 -3.713 9.085 467 HD22 ASN 58 HD22 ASN 58 14.072 -3.344 8.608 468 H CYS 59 H CYS 59 9.769 -5.894 3.849 469 HA CYS 59 HA CYS 59 12.014 -7.657 3.286 470 HB2 CYS 59 HB2 CYS 59 9.101 -7.812 2.490 471 HB3 CYS 59 HB1 CYS 59 10.318 -8.997 2.027 472 HG CYS 59 HG CYS 59 9.099 -8.380 5.170 473 H ASP 60 H ASP 60 10.458 -4.925 2.059 474 HA ASP 60 HA ASP 60 10.627 -3.682 0.170 475 HB2 ASP 60 HB2 ASP 60 13.321 -4.978 0.365 476 HB3 ASP 60 HB1 ASP 60 12.949 -3.920 -0.991 477 H LEU 61 H LEU 61 9.218 -6.064 -0.213 478 HA LEU 61 HA LEU 61 9.999 -7.420 -2.601 479 HB2 LEU 61 HB2 LEU 61 7.244 -7.231 -1.389 480 HB3 LEU 61 HB1 LEU 61 7.819 -8.465 -2.492 481 HG LEU 61 HG LEU 61 8.723 -8.055 0.358 482 HD11 LEU 61 HD11 LEU 61 6.470 -9.043 0.023 483 HD12 LEU 61 HD12 LEU 61 7.621 -10.082 0.859 484 HD13 LEU 61 HD13 LEU 61 7.245 -10.374 -0.837 485 HD21 LEU 61 HD21 LEU 61 9.588 -10.116 -1.662 486 HD22 LEU 61 HD22 LEU 61 10.027 -10.100 0.046 487 HD23 LEU 61 HD23 LEU 61 10.578 -8.807 -1.018 488 H ASP 62 H ASP 62 9.116 -4.356 -2.232 489 HA ASP 62 HA ASP 62 7.700 -4.144 -4.796 490 HB2 ASP 62 HB2 ASP 62 6.384 -3.059 -3.178 491 HB3 ASP 62 HB1 ASP 62 7.785 -2.412 -2.336 492 H GLN 63 H GLN 63 10.686 -3.629 -3.241 493 HA GLN 63 HA GLN 63 11.463 -1.590 -5.197 494 HB2 GLN 63 HB2 GLN 63 11.665 -0.872 -2.897 495 HB3 GLN 63 HB1 GLN 63 12.690 -2.249 -2.529 496 HG2 GLN 63 HG2 GLN 63 14.415 -1.399 -3.991 497 HG3 GLN 63 HG1 GLN 63 13.378 -0.057 -4.473 498 HE21 GLN 63 HE21 GLN 63 12.319 0.352 -1.806 499 HE22 GLN 63 HE22 GLN 63 13.581 1.081 -0.883 500 H GLN 64 H GLN 64 12.800 -4.512 -3.603 501 HA GLN 64 HA GLN 64 14.977 -4.442 -5.489 502 HB2 GLN 64 HB2 GLN 64 15.787 -6.512 -4.292 503 HB3 GLN 64 HB1 GLN 64 15.689 -5.043 -3.340 504 HG2 GLN 64 HG2 GLN 64 13.592 -5.827 -2.359 505 HG3 GLN 64 HG1 GLN 64 13.713 -7.304 -3.311 506 HE21 GLN 64 HE21 GLN 64 14.975 -5.519 -0.632 507 HE22 GLN 64 HE22 GLN 64 15.901 -6.799 0.057 508 H SEP 65 H SEP 65 12.746 -7.161 -4.702 509 HA SEP 65 HA SEP 65 12.653 -7.707 -7.558 510 HB2 SEP 65 HB1 SEP 65 13.494 -9.794 -5.524 511 HB3 SEP 65 HB2 SEP 65 14.546 -9.051 -6.727 512 H ILE 66 H ILE 66 11.217 -9.798 -7.825 513 HA ILE 66 HA ILE 66 8.673 -9.116 -6.573 514 HB ILE 66 HB ILE 66 8.847 -9.309 -9.062 515 HG12 ILE 66 HG12 ILE 66 7.060 -11.431 -7.881 516 HG13 ILE 66 HG11 ILE 66 6.709 -9.709 -7.836 517 HG21 ILE 66 HG21 ILE 66 9.047 -11.503 -10.098 518 HG22 ILE 66 HG22 ILE 66 9.265 -12.239 -8.514 519 HG23 ILE 66 HG23 ILE 66 10.486 -11.130 -9.143 520 HD11 ILE 66 HD11 ILE 66 5.508 -10.833 -9.614 521 HD12 ILE 66 HD12 ILE 66 7.038 -11.371 -10.311 522 HD13 ILE 66 HD13 ILE 66 6.647 -9.649 -10.256 523 H VAL 67 H VAL 67 7.290 -10.771 -5.692 524 HA VAL 67 HA VAL 67 8.780 -12.820 -4.260 525 HB VAL 67 HB VAL 67 5.812 -12.500 -4.059 526 HG11 VAL 67 HG11 VAL 67 6.199 -13.090 -1.731 527 HG12 VAL 67 HG12 VAL 67 7.938 -13.088 -2.010 528 HG13 VAL 67 HG13 VAL 67 6.917 -14.287 -2.812 529 HG21 VAL 67 HG21 VAL 67 6.654 -10.222 -4.011 530 HG22 VAL 67 HG22 VAL 67 7.815 -10.670 -2.758 531 HG23 VAL 67 HG23 VAL 67 6.081 -10.715 -2.418 532 H HIS 68 H HIS 68 8.708 -14.957 -4.705 533 HA HIS 68 HA HIS 68 6.996 -15.804 -6.943 534 HB2 HIS 68 HB2 HIS 68 9.561 -17.042 -5.883 535 HB3 HIS 68 HB1 HIS 68 8.611 -17.679 -7.218 536 HD2 HIS 68 HD2 HIS 68 9.755 -13.920 -6.807 537 HE1 HIS 68 HE1 HIS 68 11.428 -15.540 -10.325 538 HE2 HIS 68 HE2 HIS 68 11.404 -13.562 -8.770 539 H ILE 69 H ILE 69 5.196 -16.732 -6.207 540 HA ILE 69 HA ILE 69 5.387 -18.259 -3.716 541 HB ILE 69 HB ILE 69 2.921 -17.094 -5.023 542 HG12 ILE 69 HG12 ILE 69 4.572 -16.248 -2.634 543 HG13 ILE 69 HG11 ILE 69 4.313 -15.346 -4.118 544 HG21 ILE 69 HG21 ILE 69 3.256 -18.475 -2.362 545 HG22 ILE 69 HG22 ILE 69 2.461 -19.153 -3.782 546 HG23 ILE 69 HG23 ILE 69 1.771 -17.746 -2.975 547 HD11 ILE 69 HD11 ILE 69 1.956 -15.084 -3.550 548 HD12 ILE 69 HD12 ILE 69 3.008 -14.428 -2.294 549 HD13 ILE 69 HD13 ILE 69 2.215 -15.987 -2.058 550 H VAL 70 H VAL 70 5.345 -20.335 -3.777 551 HA VAL 70 HA VAL 70 4.365 -21.736 -6.184 552 HB VAL 70 HB VAL 70 6.304 -22.766 -4.107 553 HG11 VAL 70 HG11 VAL 70 5.185 -24.501 -5.355 554 HG12 VAL 70 HG12 VAL 70 6.889 -24.422 -5.800 555 HG13 VAL 70 HG13 VAL 70 5.666 -23.749 -6.878 556 HG21 VAL 70 HG21 VAL 70 6.950 -21.471 -6.754 557 HG22 VAL 70 HG22 VAL 70 8.106 -22.306 -5.713 558 HG23 VAL 70 HG23 VAL 70 7.315 -20.835 -5.147 559 H GLN 71 H GLN 71 2.841 -23.368 -5.893 560 HA GLN 71 HA GLN 71 2.094 -23.924 -3.104 561 HB2 GLN 71 HB2 GLN 71 -0.180 -24.339 -3.823 562 HB3 GLN 71 HB1 GLN 71 0.316 -22.735 -4.338 563 HG2 GLN 71 HG2 GLN 71 0.481 -23.390 -6.583 564 HG3 GLN 71 HG1 GLN 71 0.450 -25.105 -6.171 565 HE21 GLN 71 HE21 GLN 71 -1.256 -23.585 -7.983 566 HE22 GLN 71 HE22 GLN 71 -2.871 -23.814 -7.416 567 H ARG 72 H ARG 72 1.800 -26.012 -2.479 568 HA ARG 72 HA ARG 72 2.168 -28.077 -4.528 569 HB2 ARG 72 HB2 ARG 72 3.516 -27.941 -1.829 570 HB3 ARG 72 HB1 ARG 72 3.404 -29.424 -2.762 571 HG2 ARG 72 HG2 ARG 72 4.654 -28.393 -4.581 572 HG3 ARG 72 HG1 ARG 72 4.749 -26.887 -3.668 573 HD2 ARG 72 HD2 ARG 72 6.052 -27.970 -1.945 574 HD3 ARG 72 HD1 ARG 72 5.864 -29.532 -2.741 575 HE ARG 72 HE ARG 72 7.041 -28.183 -4.673 576 HH11 ARG 72 HH11 ARG 72 7.795 -28.147 -1.243 577 HH12 ARG 72 HH12 ARG 72 9.480 -27.849 -1.484 578 HH21 ARG 72 HH21 ARG 72 9.281 -27.799 -4.999 579 HH22 ARG 72 HH22 ARG 72 10.330 -27.659 -3.632 580 HA PRO 73 HA PRO 73 -1.529 -29.065 -2.053 581 HB2 PRO 73 HB2 PRO 73 -3.384 -28.778 -3.928 582 HB3 PRO 73 HB1 PRO 73 -2.660 -27.358 -3.162 583 HG2 PRO 73 HG2 PRO 73 -2.187 -28.493 -5.871 584 HG3 PRO 73 HG1 PRO 73 -2.140 -26.805 -5.334 585 HD2 PRO 73 HD2 PRO 73 0.071 -28.557 -5.681 586 HD3 PRO 73 HD1 PRO 73 0.096 -26.936 -4.959 587 H TRP 74 H TRP 74 -3.002 -30.876 -2.263 588 HA TRP 74 HA TRP 74 -1.986 -32.913 -4.112 589 HB2 TRP 74 HB2 TRP 74 -1.703 -33.479 -1.730 590 HB3 TRP 74 HB1 TRP 74 -3.435 -33.290 -1.478 591 HD1 TRP 74 HD1 TRP 74 -1.194 -35.421 -3.842 592 HE1 TRP 74 HE1 TRP 74 -2.219 -37.778 -3.980 593 HE3 TRP 74 HE3 TRP 74 -5.249 -34.713 -0.814 594 HZ2 TRP 74 HZ2 TRP 74 -4.447 -39.151 -2.933 595 HZ3 TRP 74 HZ3 TRP 74 -6.775 -36.602 -0.431 596 HH2 TRP 74 HH2 TRP 74 -6.381 -38.774 -1.469 597 H ARG 75 H ARG 75 -4.667 -30.989 -3.274 598 HA ARG 75 HA ARG 75 -6.270 -32.389 -5.280 599 HB2 ARG 75 HB2 ARG 75 -7.006 -33.075 -3.000 600 HB3 ARG 75 HB1 ARG 75 -7.350 -31.392 -2.641 601 HG2 ARG 75 HG2 ARG 75 -9.047 -31.349 -4.383 602 HG3 ARG 75 HG1 ARG 75 -8.683 -33.028 -4.791 603 HD2 ARG 75 HD2 ARG 75 -9.735 -32.007 -2.157 604 HD3 ARG 75 HD1 ARG 75 -10.646 -32.912 -3.362 605 HE ARG 75 HE ARG 75 -8.800 -34.672 -2.902 606 HH11 ARG 75 HH11 ARG 75 -10.360 -32.590 -0.551 607 HH12 ARG 75 HH12 ARG 75 -10.108 -33.669 0.777 608 HH21 ARG 75 HH21 ARG 75 -8.488 -36.129 -1.151 609 HH22 ARG 75 HH22 ARG 75 -9.025 -35.688 0.432 610 H LYS 76 H LYS 76 -5.901 -30.793 -6.786 611 HA LYS 76 HA LYS 76 -7.400 -28.353 -6.370 612 HB2 LYS 76 HB2 LYS 76 -5.109 -27.808 -5.580 613 HB3 LYS 76 HB1 LYS 76 -4.479 -28.266 -7.152 614 HG2 LYS 76 HG2 LYS 76 -4.683 -25.829 -6.873 615 HG3 LYS 76 HG1 LYS 76 -5.653 -26.445 -8.211 616 HD2 LYS 76 HD2 LYS 76 -6.878 -24.771 -6.893 617 HD3 LYS 76 HD1 LYS 76 -7.658 -26.350 -6.821 618 HE2 LYS 76 HE2 LYS 76 -6.585 -26.745 -4.631 619 HE3 LYS 76 HE1 LYS 76 -5.875 -25.134 -4.710 620 HZ1 LYS 76 HZ1 LYS 76 -8.073 -24.177 -4.691 621 HZ2 LYS 76 HZ2 LYS 76 -7.911 -25.224 -3.370 622 HZ3 LYS 76 HZ3 LYS 76 -8.787 -25.712 -4.724 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 2.423 -2.472 1.232 2 H2 MET 1 HT2 MET 1 0.765 -2.127 1.182 3 H3 MET 1 HT3 MET 1 1.849 -0.990 1.811 4 HA MET 1 HA MET 1 1.138 -0.360 -0.373 5 HB2 MET 1 HB2 MET 1 3.311 0.037 -1.333 6 HB3 MET 1 HB1 MET 1 3.461 0.146 0.414 7 HG2 MET 1 HG2 MET 1 4.171 -2.280 -1.212 8 HG3 MET 1 HG1 MET 1 5.334 -1.054 -0.695 9 HE1 MET 1 HE1 MET 1 6.944 -2.619 0.619 10 HE2 MET 1 HE2 MET 1 6.025 -3.946 -0.082 11 HE3 MET 1 HE3 MET 1 6.391 -3.944 1.642 12 H ILE 2 H ILE 2 1.906 -0.842 -2.756 13 HA ILE 2 HA ILE 2 0.857 -3.446 -3.410 14 HB ILE 2 HB ILE 2 1.827 -1.182 -5.163 15 HG12 ILE 2 HG12 ILE 2 -0.971 -2.180 -4.589 16 HG13 ILE 2 HG11 ILE 2 -0.245 -0.754 -3.861 17 HG21 ILE 2 HG21 ILE 2 2.130 -3.310 -6.313 18 HG22 ILE 2 HG22 ILE 2 0.803 -2.399 -7.037 19 HG23 ILE 2 HG23 ILE 2 0.457 -3.753 -5.961 20 HD11 ILE 2 HD11 ILE 2 -0.079 0.276 -6.073 21 HD12 ILE 2 HD12 ILE 2 -1.741 -0.150 -5.667 22 HD13 ILE 2 HD13 ILE 2 -0.821 -1.156 -6.786 23 H VAL 3 H VAL 3 2.125 -5.158 -3.353 24 HA VAL 3 HA VAL 3 4.960 -4.863 -4.050 25 HB VAL 3 HB VAL 3 5.305 -7.064 -3.013 26 HG11 VAL 3 HG11 VAL 3 5.564 -5.153 -1.599 27 HG12 VAL 3 HG12 VAL 3 4.795 -6.440 -0.673 28 HG13 VAL 3 HG13 VAL 3 3.832 -5.093 -1.282 29 HG21 VAL 3 HG21 VAL 3 2.364 -6.961 -2.341 30 HG22 VAL 3 HG22 VAL 3 3.516 -8.174 -1.776 31 HG23 VAL 3 HG23 VAL 3 3.127 -8.058 -3.493 32 H PHE 4 H PHE 4 5.890 -6.825 -5.199 33 HA PHE 4 HA PHE 4 4.088 -7.486 -7.413 34 HB2 PHE 4 HB2 PHE 4 7.098 -7.295 -7.251 35 HB3 PHE 4 HB1 PHE 4 6.275 -8.050 -8.609 36 HD1 PHE 4 HD1 PHE 4 6.301 -4.851 -6.668 37 HD2 PHE 4 HD2 PHE 4 5.710 -6.755 -10.431 38 HE1 PHE 4 HE1 PHE 4 6.049 -2.653 -7.737 39 HE2 PHE 4 HE2 PHE 4 5.451 -4.559 -11.504 40 HZ PHE 4 HZ PHE 4 5.622 -2.504 -10.158 41 H VAL 5 H VAL 5 3.415 -9.506 -7.646 42 HA VAL 5 HA VAL 5 4.930 -11.662 -6.334 43 HB VAL 5 HB VAL 5 1.922 -11.266 -6.242 44 HG11 VAL 5 HG11 VAL 5 3.584 -13.520 -5.129 45 HG12 VAL 5 HG12 VAL 5 2.467 -13.620 -6.490 46 HG13 VAL 5 HG13 VAL 5 1.856 -13.283 -4.870 47 HG21 VAL 5 HG21 VAL 5 3.077 -9.840 -4.671 48 HG22 VAL 5 HG22 VAL 5 3.991 -11.215 -4.058 49 HG23 VAL 5 HG23 VAL 5 2.246 -11.135 -3.807 50 H ARG 6 H ARG 6 4.965 -13.596 -7.422 51 HA ARG 6 HA ARG 6 3.355 -13.761 -9.862 52 HB2 ARG 6 HB2 ARG 6 5.262 -14.889 -10.998 53 HB3 ARG 6 HB1 ARG 6 5.535 -13.191 -10.655 54 HG2 ARG 6 HG2 ARG 6 7.017 -13.691 -8.888 55 HG3 ARG 6 HG1 ARG 6 6.554 -15.394 -8.898 56 HD2 ARG 6 HD2 ARG 6 8.754 -14.936 -9.985 57 HD3 ARG 6 HD1 ARG 6 7.587 -15.744 -11.029 58 HE ARG 6 HE ARG 6 7.152 -13.307 -11.826 59 HH11 ARG 6 HH11 ARG 6 10.250 -14.709 -10.988 60 HH12 ARG 6 HH12 ARG 6 11.157 -13.664 -12.024 61 HH21 ARG 6 HH21 ARG 6 8.345 -11.917 -13.212 62 HH22 ARG 6 HH22 ARG 6 10.070 -12.069 -13.286 63 H PHE 7 H PHE 7 2.153 -15.459 -9.882 64 HA PHE 7 HA PHE 7 2.654 -17.654 -8.066 65 HB2 PHE 7 HB2 PHE 7 0.356 -16.604 -8.480 66 HB3 PHE 7 HB1 PHE 7 0.388 -17.383 -10.056 67 HD1 PHE 7 HD1 PHE 7 0.508 -18.043 -6.416 68 HD2 PHE 7 HD2 PHE 7 -0.267 -19.626 -10.287 69 HE1 PHE 7 HE1 PHE 7 -0.410 -20.079 -5.395 70 HE2 PHE 7 HE2 PHE 7 -1.182 -21.670 -9.272 71 HZ PHE 7 HZ PHE 7 -1.256 -21.900 -6.820 72 H ASN 8 H ASN 8 2.851 -19.832 -8.817 73 HA ASN 8 HA ASN 8 4.670 -20.272 -10.845 74 HB2 ASN 8 HB2 ASN 8 4.174 -21.889 -9.054 75 HB3 ASN 8 HB1 ASN 8 2.623 -22.243 -9.804 76 HD21 ASN 8 HD21 ASN 8 2.544 -23.619 -11.549 77 HD22 ASN 8 HD22 ASN 8 3.920 -24.478 -12.140 78 H SER 9 H SER 9 1.241 -19.900 -11.166 79 HA SER 9 HA SER 9 1.310 -20.872 -13.927 80 HB2 SER 9 HB2 SER 9 -1.088 -20.102 -12.257 81 HB3 SER 9 HB1 SER 9 -1.102 -20.942 -13.807 82 HG SER 9 HG SER 9 0.178 -22.601 -12.698 83 H SER 10 H SER 10 2.249 -18.156 -12.745 84 HA SER 10 HA SER 10 0.966 -16.530 -14.811 85 HB2 SER 10 HB2 SER 10 1.293 -15.635 -11.935 86 HB3 SER 10 HB1 SER 10 0.654 -14.661 -13.258 87 HG SER 10 HG SER 10 -1.147 -15.444 -12.393 88 H HIS 11 H HIS 11 2.162 -14.320 -14.897 89 HA HIS 11 HA HIS 11 5.036 -14.884 -14.953 90 HB2 HIS 11 HB2 HIS 11 3.461 -12.586 -16.139 91 HB3 HIS 11 HB1 HIS 11 5.185 -12.856 -16.353 92 HD2 HIS 11 HD2 HIS 11 5.781 -15.244 -17.852 93 HE1 HIS 11 HE1 HIS 11 2.008 -15.163 -19.748 94 HE2 HIS 11 HE2 HIS 11 4.412 -15.908 -19.943 95 H GLY 12 H GLY 12 2.810 -12.313 -13.959 96 HA2 GLY 12 HA2 GLY 12 3.972 -11.857 -11.464 97 HA3 GLY 12 HA1 GLY 12 4.715 -10.747 -12.611 98 H PHE 13 H PHE 13 2.552 -10.750 -10.320 99 HA PHE 13 HA PHE 13 0.947 -8.706 -11.635 100 HB2 PHE 13 HB2 PHE 13 -1.103 -9.583 -10.465 101 HB3 PHE 13 HB1 PHE 13 -0.508 -10.607 -11.761 102 HD1 PHE 13 HD1 PHE 13 -0.949 -10.279 -8.150 103 HD2 PHE 13 HD2 PHE 13 0.419 -12.786 -11.297 104 HE1 PHE 13 HE1 PHE 13 -0.920 -12.197 -6.605 105 HE2 PHE 13 HE2 PHE 13 0.453 -14.707 -9.763 106 HZ PHE 13 HZ PHE 13 -0.219 -14.414 -7.411 107 HA PRO 14 HA PRO 14 1.853 -6.634 -7.852 108 HB2 PRO 14 HB2 PRO 14 0.198 -4.523 -8.099 109 HB3 PRO 14 HB1 PRO 14 1.637 -4.710 -9.108 110 HG2 PRO 14 HG2 PRO 14 -1.222 -5.247 -9.764 111 HG3 PRO 14 HG1 PRO 14 0.048 -4.539 -10.777 112 HD2 PRO 14 HD2 PRO 14 -0.785 -7.167 -10.914 113 HD3 PRO 14 HD1 PRO 14 0.803 -6.589 -11.448 114 H VAL 15 H VAL 15 1.162 -6.764 -5.809 115 HA VAL 15 HA VAL 15 -1.697 -7.275 -5.307 116 HB VAL 15 HB VAL 15 0.637 -8.528 -3.822 117 HG11 VAL 15 HG11 VAL 15 -1.073 -9.810 -2.626 118 HG12 VAL 15 HG12 VAL 15 -2.336 -8.919 -3.474 119 HG13 VAL 15 HG13 VAL 15 -1.263 -8.076 -2.357 120 HG21 VAL 15 HG21 VAL 15 0.315 -9.515 -6.030 121 HG22 VAL 15 HG22 VAL 15 -1.390 -9.783 -5.669 122 HG23 VAL 15 HG23 VAL 15 -0.150 -10.644 -4.758 123 H GLU 16 H GLU 16 -2.554 -5.736 -4.132 124 HA GLU 16 HA GLU 16 -0.884 -3.849 -2.726 125 HB2 GLU 16 HB2 GLU 16 -2.786 -3.089 -4.088 126 HB3 GLU 16 HB1 GLU 16 -3.881 -3.969 -3.033 127 HG2 GLU 16 HG2 GLU 16 -3.163 -2.557 -1.153 128 HG3 GLU 16 HG1 GLU 16 -2.147 -1.640 -2.265 129 H VAL 17 H VAL 17 -0.197 -4.333 -0.754 130 HA VAL 17 HA VAL 17 -2.122 -5.588 1.097 131 HB VAL 17 HB VAL 17 -0.186 -6.495 2.351 132 HG11 VAL 17 HG11 VAL 17 -0.307 -7.336 -0.539 133 HG12 VAL 17 HG12 VAL 17 -1.378 -7.887 0.751 134 HG13 VAL 17 HG13 VAL 17 0.335 -8.296 0.793 135 HG21 VAL 17 HG21 VAL 17 1.421 -5.517 -0.013 136 HG22 VAL 17 HG22 VAL 17 2.023 -6.574 1.263 137 HG23 VAL 17 HG23 VAL 17 1.533 -4.923 1.644 138 H ASP 18 H ASP 18 -1.364 -5.131 3.459 139 HA ASP 18 HA ASP 18 -1.512 -2.285 3.802 140 HB2 ASP 18 HB2 ASP 18 -2.666 -3.936 5.294 141 HB3 ASP 18 HB1 ASP 18 -1.093 -4.440 5.891 142 H SER 19 H SER 19 0.014 -1.092 5.213 143 HA SER 19 HA SER 19 2.688 -1.349 4.393 144 HB2 SER 19 HB2 SER 19 1.617 0.108 6.823 145 HB3 SER 19 HB1 SER 19 3.165 0.395 6.025 146 HG SER 19 HG SER 19 1.321 1.833 5.469 147 H ASP 20 H ASP 20 0.908 -2.784 7.027 148 HA ASP 20 HA ASP 20 3.412 -4.100 7.773 149 HB2 ASP 20 HB2 ASP 20 1.345 -2.950 9.587 150 HB3 ASP 20 HB1 ASP 20 2.235 -4.384 10.099 151 H THR 21 H THR 21 2.673 -5.443 6.073 152 HA THR 21 HA THR 21 0.702 -7.419 6.935 153 HB THR 21 HB THR 21 2.040 -7.117 4.232 154 HG1 THR 21 HG1 THR 21 0.719 -5.355 4.536 155 HG21 THR 21 HG21 THR 21 0.182 -8.556 3.456 156 HG22 THR 21 HG22 THR 21 -0.338 -8.754 5.131 157 HG23 THR 21 HG23 THR 21 1.232 -9.375 4.614 158 H SER 22 H SER 22 1.682 -8.889 8.184 159 HA SER 22 HA SER 22 4.389 -9.593 8.099 160 HB2 SER 22 HB2 SER 22 2.087 -11.321 9.047 161 HB3 SER 22 HB1 SER 22 3.770 -11.418 9.564 162 HG SER 22 HG SER 22 1.801 -9.525 10.212 163 H ILE 23 H ILE 23 5.451 -11.331 7.113 164 HA ILE 23 HA ILE 23 4.696 -11.976 4.522 165 HB ILE 23 HB ILE 23 6.531 -13.614 6.290 166 HG12 ILE 23 HG12 ILE 23 7.221 -11.270 6.246 167 HG13 ILE 23 HG11 ILE 23 8.354 -12.259 5.334 168 HG21 ILE 23 HG21 ILE 23 5.907 -14.811 4.263 169 HG22 ILE 23 HG22 ILE 23 7.596 -14.311 4.185 170 HG23 ILE 23 HG23 ILE 23 6.373 -13.422 3.282 171 HD11 ILE 23 HD11 ILE 23 7.287 -11.517 3.249 172 HD12 ILE 23 HD12 ILE 23 7.935 -10.176 4.192 173 HD13 ILE 23 HD13 ILE 23 6.199 -10.493 4.187 174 H PHE 24 H PHE 24 3.943 -13.648 7.522 175 HA PHE 24 HA PHE 24 2.896 -16.032 6.443 176 HB2 PHE 24 HB2 PHE 24 3.361 -15.550 8.895 177 HB3 PHE 24 HB1 PHE 24 1.880 -14.607 8.907 178 HD1 PHE 24 HD1 PHE 24 3.147 -18.013 8.121 179 HD2 PHE 24 HD2 PHE 24 -0.135 -15.631 9.404 180 HE1 PHE 24 HE1 PHE 24 1.859 -20.049 8.594 181 HE2 PHE 24 HE2 PHE 24 -1.428 -17.670 9.880 182 HZ PHE 24 HZ PHE 24 -0.431 -19.881 9.475 183 H GLN 25 H GLN 25 1.329 -12.969 7.296 184 HA GLN 25 HA GLN 25 -1.265 -13.694 6.419 185 HB2 GLN 25 HB2 GLN 25 -0.001 -10.977 6.813 186 HB3 GLN 25 HB1 GLN 25 -1.707 -11.236 6.486 187 HG2 GLN 25 HG2 GLN 25 -0.202 -12.245 8.888 188 HG3 GLN 25 HG1 GLN 25 -1.284 -10.855 8.852 189 HE21 GLN 25 HE21 GLN 25 -3.505 -11.199 8.607 190 HE22 GLN 25 HE22 GLN 25 -4.225 -12.733 8.938 191 H LEU 26 H LEU 26 1.450 -12.055 4.897 192 HA LEU 26 HA LEU 26 0.252 -11.229 2.521 193 HB2 LEU 26 HB2 LEU 26 2.477 -10.527 3.142 194 HB3 LEU 26 HB1 LEU 26 3.060 -12.178 3.077 195 HG LEU 26 HG LEU 26 2.727 -12.189 0.634 196 HD11 LEU 26 HD11 LEU 26 2.248 -10.117 -0.541 197 HD12 LEU 26 HD12 LEU 26 2.044 -9.278 0.996 198 HD13 LEU 26 HD13 LEU 26 0.909 -10.547 0.525 199 HD21 LEU 26 HD21 LEU 26 4.383 -9.914 1.692 200 HD22 LEU 26 HD22 LEU 26 4.563 -10.662 0.104 201 HD23 LEU 26 HD23 LEU 26 4.885 -11.599 1.565 202 H LYS 27 H LYS 27 1.697 -14.319 3.389 203 HA LYS 27 HA LYS 27 1.462 -15.644 0.941 204 HB2 LYS 27 HB2 LYS 27 2.742 -16.532 2.826 205 HB3 LYS 27 HB1 LYS 27 1.263 -16.700 3.762 206 HG2 LYS 27 HG2 LYS 27 0.473 -18.440 2.308 207 HG3 LYS 27 HG1 LYS 27 1.839 -18.201 1.217 208 HD2 LYS 27 HD2 LYS 27 2.167 -20.153 2.673 209 HD3 LYS 27 HD1 LYS 27 3.383 -18.910 2.960 210 HE2 LYS 27 HE2 LYS 27 2.125 -18.143 4.928 211 HE3 LYS 27 HE1 LYS 27 0.916 -19.392 4.635 212 HZ1 LYS 27 HZ1 LYS 27 2.485 -20.079 6.335 213 HZ2 LYS 27 HZ2 LYS 27 3.780 -19.865 5.272 214 HZ3 LYS 27 HZ3 LYS 27 2.633 -21.064 4.976 215 H GLU 28 H GLU 28 -0.805 -15.263 3.617 216 HA GLU 28 HA GLU 28 -2.822 -16.889 2.464 217 HB2 GLU 28 HB2 GLU 28 -2.734 -14.993 4.769 218 HB3 GLU 28 HB1 GLU 28 -4.257 -15.698 4.246 219 HG2 GLU 28 HG2 GLU 28 -3.222 -17.945 4.536 220 HG3 GLU 28 HG1 GLU 28 -1.810 -17.145 5.221 221 H VAL 29 H VAL 29 -2.080 -13.460 2.328 222 HA VAL 29 HA VAL 29 -4.520 -12.530 1.308 223 HB VAL 29 HB VAL 29 -1.723 -11.509 0.720 224 HG11 VAL 29 HG11 VAL 29 -3.291 -10.753 -0.993 225 HG12 VAL 29 HG12 VAL 29 -2.809 -9.412 0.046 226 HG13 VAL 29 HG13 VAL 29 -4.388 -10.166 0.255 227 HG21 VAL 29 HG21 VAL 29 -3.804 -10.578 2.699 228 HG22 VAL 29 HG22 VAL 29 -2.244 -9.809 2.410 229 HG23 VAL 29 HG23 VAL 29 -2.313 -11.436 3.087 230 H VAL 30 H VAL 30 -1.661 -13.770 -0.391 231 HA VAL 30 HA VAL 30 -2.842 -13.536 -2.975 232 HB VAL 30 HB VAL 30 -0.538 -15.312 -2.132 233 HG11 VAL 30 HG11 VAL 30 -1.351 -14.272 -4.848 234 HG12 VAL 30 HG12 VAL 30 -1.486 -15.938 -4.291 235 HG13 VAL 30 HG13 VAL 30 0.103 -15.207 -4.501 236 HG21 VAL 30 HG21 VAL 30 -0.507 -12.493 -3.217 237 HG22 VAL 30 HG22 VAL 30 0.911 -13.490 -2.895 238 HG23 VAL 30 HG23 VAL 30 -0.119 -12.969 -1.565 239 H ALA 31 H ALA 31 -2.540 -16.142 -0.609 240 HA ALA 31 HA ALA 31 -3.586 -18.236 -2.139 241 HB1 ALA 31 HB1 ALA 31 -4.040 -19.347 -0.035 242 HB2 ALA 31 HB2 ALA 31 -3.909 -17.817 0.831 243 HB3 ALA 31 HB3 ALA 31 -2.486 -18.516 0.061 244 H LYS 32 H LYS 32 -5.183 -15.862 -0.072 245 HA LYS 32 HA LYS 32 -7.813 -16.812 -0.360 246 HB2 LYS 32 HB2 LYS 32 -7.004 -15.293 1.405 247 HB3 LYS 32 HB1 LYS 32 -6.777 -14.035 0.205 248 HG2 LYS 32 HG2 LYS 32 -9.274 -14.270 -0.251 249 HG3 LYS 32 HG1 LYS 32 -9.332 -15.184 1.260 250 HD2 LYS 32 HD2 LYS 32 -8.267 -12.392 0.919 251 HD3 LYS 32 HD1 LYS 32 -9.829 -12.813 1.627 252 HE2 LYS 32 HE2 LYS 32 -7.139 -13.667 2.715 253 HE3 LYS 32 HE1 LYS 32 -8.065 -12.293 3.308 254 HZ1 LYS 32 HZ1 LYS 32 -9.844 -13.819 3.924 255 HZ2 LYS 32 HZ2 LYS 32 -8.396 -14.225 4.691 256 HZ3 LYS 32 HZ3 LYS 32 -8.937 -15.134 3.372 257 H ARG 33 H ARG 33 -5.872 -14.460 -2.118 258 HA ARG 33 HA ARG 33 -7.865 -13.358 -3.761 259 HB2 ARG 33 HB2 ARG 33 -5.440 -12.582 -3.374 260 HB3 ARG 33 HB1 ARG 33 -5.008 -13.746 -4.623 261 HG2 ARG 33 HG2 ARG 33 -6.444 -12.593 -6.210 262 HG3 ARG 33 HG1 ARG 33 -6.908 -11.435 -4.965 263 HD2 ARG 33 HD2 ARG 33 -4.353 -11.023 -4.758 264 HD3 ARG 33 HD1 ARG 33 -4.277 -11.777 -6.351 265 HE ARG 33 HE ARG 33 -6.201 -9.638 -6.078 266 HH11 ARG 33 HH11 ARG 33 -2.956 -10.515 -7.079 267 HH12 ARG 33 HH12 ARG 33 -2.713 -9.059 -7.979 268 HH21 ARG 33 HH21 ARG 33 -5.880 -7.730 -7.260 269 HH22 ARG 33 HH22 ARG 33 -4.388 -7.473 -8.095 270 H GLN 34 H GLN 34 -5.843 -16.198 -4.112 271 HA GLN 34 HA GLN 34 -6.921 -16.755 -6.763 272 HB2 GLN 34 HB2 GLN 34 -4.733 -18.033 -5.139 273 HB3 GLN 34 HB1 GLN 34 -5.259 -18.637 -6.703 274 HG2 GLN 34 HG2 GLN 34 -4.283 -15.834 -6.276 275 HG3 GLN 34 HG1 GLN 34 -3.216 -17.164 -6.710 276 HE21 GLN 34 HE21 GLN 34 -5.725 -15.031 -7.783 277 HE22 GLN 34 HE22 GLN 34 -5.639 -15.432 -9.458 278 H GLY 35 H GLY 35 -7.621 -17.524 -3.558 279 HA2 GLY 35 HA2 GLY 35 -9.142 -18.979 -2.633 280 HA3 GLY 35 HA1 GLY 35 -9.652 -19.384 -4.269 281 H VAL 36 H VAL 36 -6.518 -19.729 -2.669 282 HA VAL 36 HA VAL 36 -6.661 -22.632 -3.175 283 HB VAL 36 HB VAL 36 -4.224 -22.624 -3.581 284 HG11 VAL 36 HG11 VAL 36 -5.714 -22.510 -5.491 285 HG12 VAL 36 HG12 VAL 36 -4.253 -21.573 -5.798 286 HG13 VAL 36 HG13 VAL 36 -5.756 -20.751 -5.377 287 HG21 VAL 36 HG21 VAL 36 -3.628 -20.640 -2.287 288 HG22 VAL 36 HG22 VAL 36 -4.467 -19.619 -3.456 289 HG23 VAL 36 HG23 VAL 36 -3.028 -20.515 -3.943 290 HA PRO 37 HA PRO 37 -5.578 -23.185 1.073 291 HB2 PRO 37 HB2 PRO 37 -4.073 -25.447 0.992 292 HB3 PRO 37 HB1 PRO 37 -5.826 -25.455 0.775 293 HG2 PRO 37 HG2 PRO 37 -3.665 -25.557 -1.287 294 HG3 PRO 37 HG1 PRO 37 -5.178 -26.474 -1.204 295 HD2 PRO 37 HD2 PRO 37 -4.871 -24.310 -2.799 296 HD3 PRO 37 HD1 PRO 37 -6.425 -24.742 -2.061 297 H ALA 38 H ALA 38 -4.163 -22.062 2.222 298 HA ALA 38 HA ALA 38 -1.629 -21.293 1.118 299 HB1 ALA 38 HB1 ALA 38 -2.797 -20.738 3.841 300 HB2 ALA 38 HB2 ALA 38 -2.969 -19.724 2.407 301 HB3 ALA 38 HB3 ALA 38 -1.381 -19.954 3.138 302 H ASP 39 H ASP 39 -2.621 -24.010 2.714 303 HA ASP 39 HA ASP 39 -0.439 -24.494 4.474 304 HB2 ASP 39 HB2 ASP 39 -2.245 -26.502 3.103 305 HB3 ASP 39 HB1 ASP 39 -1.214 -26.818 4.493 306 H GLN 40 H GLN 40 -1.207 -25.636 1.219 307 HA GLN 40 HA GLN 40 1.441 -26.808 0.938 308 HB2 GLN 40 HB2 GLN 40 -0.914 -26.766 -0.954 309 HB3 GLN 40 HB1 GLN 40 0.567 -27.681 -1.189 310 HG2 GLN 40 HG2 GLN 40 0.094 -29.009 0.774 311 HG3 GLN 40 HG1 GLN 40 -1.351 -28.054 1.097 312 HE21 GLN 40 HE21 GLN 40 -1.038 -30.900 0.621 313 HE22 GLN 40 HE22 GLN 40 -2.052 -31.275 -0.724 314 H LEU 41 H LEU 41 0.546 -23.828 0.866 315 HA LEU 41 HA LEU 41 1.613 -23.055 -1.735 316 HB2 LEU 41 HB2 LEU 41 -0.505 -22.073 -0.740 317 HB3 LEU 41 HB1 LEU 41 0.524 -21.273 0.432 318 HG LEU 41 HG LEU 41 1.695 -20.156 -1.483 319 HD11 LEU 41 HD11 LEU 41 0.509 -20.093 -3.624 320 HD12 LEU 41 HD12 LEU 41 -0.605 -21.327 -3.034 321 HD13 LEU 41 HD13 LEU 41 1.106 -21.705 -3.240 322 HD21 LEU 41 HD21 LEU 41 0.000 -19.010 -0.150 323 HD22 LEU 41 HD22 LEU 41 -1.262 -19.649 -1.204 324 HD23 LEU 41 HD23 LEU 41 -0.073 -18.513 -1.841 325 H ARG 42 H ARG 42 3.559 -22.108 -1.977 326 HA ARG 42 HA ARG 42 5.142 -21.567 0.454 327 HB2 ARG 42 HB2 ARG 42 5.964 -23.539 -0.641 328 HB3 ARG 42 HB1 ARG 42 6.015 -22.700 -2.187 329 HG2 ARG 42 HG2 ARG 42 7.617 -21.078 -0.952 330 HG3 ARG 42 HG1 ARG 42 7.804 -22.426 0.176 331 HD2 ARG 42 HD2 ARG 42 8.170 -22.569 -2.782 332 HD3 ARG 42 HD1 ARG 42 9.482 -22.400 -1.615 333 HE ARG 42 HE ARG 42 8.162 -24.599 -0.751 334 HH11 ARG 42 HH11 ARG 42 9.485 -23.742 -3.902 335 HH12 ARG 42 HH12 ARG 42 9.850 -25.379 -4.315 336 HH21 ARG 42 HH21 ARG 42 8.649 -26.745 -1.317 337 HH22 ARG 42 HH22 ARG 42 9.384 -27.090 -2.846 338 H VAL 43 H VAL 43 6.298 -19.693 0.523 339 HA VAL 43 HA VAL 43 6.135 -17.995 -1.853 340 HB VAL 43 HB VAL 43 6.159 -16.002 -0.376 341 HG11 VAL 43 HG11 VAL 43 3.879 -16.208 0.520 342 HG12 VAL 43 HG12 VAL 43 3.944 -17.949 0.249 343 HG13 VAL 43 HG13 VAL 43 4.009 -16.841 -1.119 344 HG21 VAL 43 HG21 VAL 43 5.793 -16.232 2.037 345 HG22 VAL 43 HG22 VAL 43 7.319 -16.971 1.550 346 HG23 VAL 43 HG23 VAL 43 5.919 -17.986 1.891 347 H ILE 44 H ILE 44 7.959 -17.218 -2.678 348 HA ILE 44 HA ILE 44 10.427 -17.534 -1.112 349 HB ILE 44 HB ILE 44 9.998 -18.112 -4.049 350 HG12 ILE 44 HG12 ILE 44 9.341 -19.931 -2.544 351 HG13 ILE 44 HG11 ILE 44 10.761 -20.371 -3.485 352 HG21 ILE 44 HG21 ILE 44 12.602 -18.070 -2.528 353 HG22 ILE 44 HG22 ILE 44 12.111 -16.938 -3.788 354 HG23 ILE 44 HG23 ILE 44 12.390 -18.633 -4.185 355 HD11 ILE 44 HD11 ILE 44 11.018 -21.133 -1.224 356 HD12 ILE 44 HD12 ILE 44 10.704 -19.517 -0.601 357 HD13 ILE 44 HD13 ILE 44 12.169 -19.832 -1.529 358 H PHE 45 H PHE 45 11.714 -15.854 -1.003 359 HA PHE 45 HA PHE 45 11.734 -13.753 -2.994 360 HB2 PHE 45 HB2 PHE 45 9.964 -12.984 -1.463 361 HB3 PHE 45 HB1 PHE 45 11.037 -13.213 -0.089 362 HD1 PHE 45 HD1 PHE 45 10.317 -11.137 -3.028 363 HD2 PHE 45 HD2 PHE 45 12.739 -11.601 0.436 364 HE1 PHE 45 HE1 PHE 45 11.095 -8.817 -3.260 365 HE2 PHE 45 HE2 PHE 45 13.521 -9.283 0.211 366 HZ PHE 45 HZ PHE 45 12.698 -7.887 -1.640 367 H ALA 46 H ALA 46 13.776 -12.910 -3.158 368 HA ALA 46 HA ALA 46 15.979 -12.545 -2.773 369 HB1 ALA 46 HB1 ALA 46 16.894 -12.557 -0.526 370 HB2 ALA 46 HB2 ALA 46 15.489 -13.438 0.071 371 HB3 ALA 46 HB3 ALA 46 15.308 -11.778 -0.505 372 H GLY 47 H GLY 47 14.665 -15.215 -3.356 373 HA2 GLY 47 HA2 GLY 47 15.740 -17.101 -4.249 374 HA3 GLY 47 HA1 GLY 47 17.158 -16.720 -3.291 375 H LYS 48 H LYS 48 14.762 -16.463 -1.130 376 HA LYS 48 HA LYS 48 14.424 -19.300 -0.595 377 HB2 LYS 48 HB2 LYS 48 15.545 -19.374 1.472 378 HB3 LYS 48 HB1 LYS 48 16.643 -18.490 0.434 379 HG2 LYS 48 HG2 LYS 48 14.893 -17.393 2.634 380 HG3 LYS 48 HG1 LYS 48 16.651 -17.430 2.566 381 HD2 LYS 48 HD2 LYS 48 16.466 -15.897 0.565 382 HD3 LYS 48 HD1 LYS 48 14.751 -15.748 0.969 383 HE2 LYS 48 HE2 LYS 48 17.115 -14.941 2.645 384 HE3 LYS 48 HE1 LYS 48 15.876 -13.897 1.959 385 HZ1 LYS 48 HZ1 LYS 48 14.259 -15.162 3.403 386 HZ2 LYS 48 HZ2 LYS 48 15.341 -14.149 4.212 387 HZ3 LYS 48 HZ3 LYS 48 15.601 -15.819 4.194 388 H GLU 49 H GLU 49 13.378 -19.195 1.936 389 HA GLU 49 HA GLU 49 11.002 -17.579 1.457 390 HB2 GLU 49 HB2 GLU 49 10.034 -18.878 3.372 391 HB3 GLU 49 HB1 GLU 49 10.495 -19.848 1.981 392 HG2 GLU 49 HG2 GLU 49 12.490 -20.584 3.103 393 HG3 GLU 49 HG1 GLU 49 12.154 -19.517 4.466 394 H LEU 50 H LEU 50 10.140 -16.187 3.033 395 HA LEU 50 HA LEU 50 12.190 -14.964 4.729 396 HB2 LEU 50 HB2 LEU 50 9.466 -13.965 3.917 397 HB3 LEU 50 HB1 LEU 50 10.601 -13.090 4.924 398 HG LEU 50 HG LEU 50 11.002 -13.834 2.037 399 HD11 LEU 50 HD11 LEU 50 10.465 -11.180 3.358 400 HD12 LEU 50 HD12 LEU 50 9.337 -12.088 2.349 401 HD13 LEU 50 HD13 LEU 50 10.815 -11.428 1.647 402 HD21 LEU 50 HD21 LEU 50 13.114 -13.813 3.230 403 HD22 LEU 50 HD22 LEU 50 12.720 -12.252 3.945 404 HD23 LEU 50 HD23 LEU 50 12.996 -12.381 2.208 405 H ARG 51 H ARG 51 11.675 -14.296 6.833 406 HA ARG 51 HA ARG 51 10.374 -16.195 8.445 407 HB2 ARG 51 HB2 ARG 51 10.604 -14.370 10.206 408 HB3 ARG 51 HB1 ARG 51 12.087 -14.914 9.440 409 HG2 ARG 51 HG2 ARG 51 11.665 -12.918 7.825 410 HG3 ARG 51 HG1 ARG 51 10.630 -12.339 9.128 411 HD2 ARG 51 HD2 ARG 51 13.532 -13.070 9.352 412 HD3 ARG 51 HD1 ARG 51 12.883 -11.436 9.286 413 HE ARG 51 HE ARG 51 11.722 -11.987 11.422 414 HH11 ARG 51 HH11 ARG 51 14.582 -13.812 10.511 415 HH12 ARG 51 HH12 ARG 51 15.060 -14.133 12.137 416 HH21 ARG 51 HH21 ARG 51 12.345 -12.412 13.582 417 HH22 ARG 51 HH22 ARG 51 13.785 -13.322 13.902 418 H ASN 52 H ASN 52 8.309 -16.458 8.876 419 HA ASN 52 HA ASN 52 6.349 -14.957 7.505 420 HB2 ASN 52 HB2 ASN 52 4.813 -16.548 8.210 421 HB3 ASN 52 HB1 ASN 52 6.324 -17.437 8.231 422 HD21 ASN 52 HD21 ASN 52 7.286 -17.933 10.231 423 HD22 ASN 52 HD22 ASN 52 6.368 -17.914 11.695 424 H ASP 53 H ASP 53 7.724 -14.557 10.627 425 HA ASP 53 HA ASP 53 5.435 -13.064 11.663 426 HB2 ASP 53 HB2 ASP 53 8.076 -13.734 12.973 427 HB3 ASP 53 HB1 ASP 53 6.725 -12.934 13.761 428 H TRP 54 H TRP 54 7.407 -12.072 9.474 429 HA TRP 54 HA TRP 54 7.998 -9.540 10.847 430 HB2 TRP 54 HB2 TRP 54 10.009 -10.891 10.190 431 HB3 TRP 54 HB1 TRP 54 9.556 -10.639 8.508 432 HD1 TRP 54 HD1 TRP 54 11.089 -8.868 7.508 433 HE1 TRP 54 HE1 TRP 54 12.118 -6.642 8.279 434 HE3 TRP 54 HE3 TRP 54 9.290 -8.758 12.296 435 HZ2 TRP 54 HZ2 TRP 54 12.154 -5.045 10.603 436 HZ3 TRP 54 HZ3 TRP 54 9.871 -6.839 13.721 437 HH2 TRP 54 HH2 TRP 54 11.273 -5.025 12.893 438 H THR 55 H THR 55 7.769 -7.621 9.676 439 HA THR 55 HA THR 55 5.470 -7.588 8.004 440 HB THR 55 HB THR 55 5.869 -5.820 9.649 441 HG1 THR 55 HG1 THR 55 5.138 -4.221 8.395 442 HG21 THR 55 HG21 THR 55 8.302 -5.706 9.541 443 HG22 THR 55 HG22 THR 55 7.599 -4.113 9.263 444 HG23 THR 55 HG23 THR 55 8.213 -5.054 7.905 445 H VAL 56 H VAL 56 5.280 -6.795 5.890 446 HA VAL 56 HA VAL 56 7.390 -7.630 4.144 447 HB VAL 56 HB VAL 56 5.047 -8.108 3.593 448 HG11 VAL 56 HG11 VAL 56 3.996 -6.125 4.520 449 HG12 VAL 56 HG12 VAL 56 3.530 -6.357 2.834 450 HG13 VAL 56 HG13 VAL 56 4.726 -5.131 3.258 451 HG21 VAL 56 HG21 VAL 56 6.648 -7.986 1.776 452 HG22 VAL 56 HG22 VAL 56 6.353 -6.257 1.605 453 HG23 VAL 56 HG23 VAL 56 5.069 -7.412 1.247 454 H GLN 57 H GLN 57 6.139 -4.557 5.287 455 HA GLN 57 HA GLN 57 7.168 -2.874 3.305 456 HB2 GLN 57 HB2 GLN 57 5.539 -2.180 5.024 457 HB3 GLN 57 HB1 GLN 57 6.798 -2.271 6.243 458 HG2 GLN 57 HG2 GLN 57 6.467 0.017 5.644 459 HG3 GLN 57 HG1 GLN 57 8.037 -0.501 5.032 460 HE21 GLN 57 HE21 GLN 57 8.350 -0.670 2.825 461 HE22 GLN 57 HE22 GLN 57 7.249 -0.009 1.674 462 H ASN 58 H ASN 58 8.686 -4.315 6.102 463 HA ASN 58 HA ASN 58 11.046 -2.672 5.903 464 HB2 ASN 58 HB2 ASN 58 10.171 -3.511 8.078 465 HB3 ASN 58 HB1 ASN 58 10.585 -5.146 7.580 466 HD21 ASN 58 HD21 ASN 58 11.813 -2.051 8.558 467 HD22 ASN 58 HD22 ASN 58 13.423 -2.572 8.905 468 H CYS 59 H CYS 59 9.957 -5.556 4.447 469 HA CYS 59 HA CYS 59 12.680 -6.452 3.859 470 HB2 CYS 59 HB2 CYS 59 10.043 -7.781 3.227 471 HB3 CYS 59 HB1 CYS 59 11.638 -8.484 2.989 472 HG CYS 59 HG CYS 59 9.846 -8.130 5.822 473 H ASP 60 H ASP 60 10.129 -4.688 2.474 474 HA ASP 60 HA ASP 60 9.787 -3.682 0.477 475 HB2 ASP 60 HB2 ASP 60 12.768 -4.086 0.245 476 HB3 ASP 60 HB1 ASP 60 11.820 -3.147 -0.900 477 H LEU 61 H LEU 61 8.648 -5.855 0.106 478 HA LEU 61 HA LEU 61 9.815 -7.486 -1.982 479 HB2 LEU 61 HB2 LEU 61 7.213 -7.570 -0.481 480 HB3 LEU 61 HB1 LEU 61 7.419 -8.519 -1.936 481 HG LEU 61 HG LEU 61 9.314 -9.710 -0.900 482 HD11 LEU 61 HD11 LEU 61 8.637 -8.097 1.543 483 HD12 LEU 61 HD12 LEU 61 10.116 -7.995 0.589 484 HD13 LEU 61 HD13 LEU 61 9.747 -9.466 1.488 485 HD21 LEU 61 HD21 LEU 61 7.047 -10.611 -0.705 486 HD22 LEU 61 HD22 LEU 61 6.832 -9.735 0.807 487 HD23 LEU 61 HD23 LEU 61 8.039 -11.014 0.694 488 H ASP 62 H ASP 62 8.733 -4.536 -2.102 489 HA ASP 62 HA ASP 62 7.359 -4.857 -4.680 490 HB2 ASP 62 HB2 ASP 62 6.296 -2.749 -4.298 491 HB3 ASP 62 HB1 ASP 62 6.088 -3.701 -2.836 492 H GLN 63 H GLN 63 10.287 -4.300 -3.404 493 HA GLN 63 HA GLN 63 11.007 -2.354 -5.493 494 HB2 GLN 63 HB2 GLN 63 11.267 -1.383 -3.273 495 HB3 GLN 63 HB1 GLN 63 12.290 -2.727 -2.787 496 HG2 GLN 63 HG2 GLN 63 13.639 -0.785 -3.273 497 HG3 GLN 63 HG1 GLN 63 13.958 -2.054 -4.451 498 HE21 GLN 63 HE21 GLN 63 14.719 -0.645 -6.000 499 HE22 GLN 63 HE22 GLN 63 13.691 0.457 -6.846 500 H GLN 64 H GLN 64 12.644 -4.792 -3.450 501 HA GLN 64 HA GLN 64 14.762 -5.095 -5.308 502 HB2 GLN 64 HB2 GLN 64 13.995 -6.795 -2.942 503 HB3 GLN 64 HB1 GLN 64 15.484 -6.973 -3.857 504 HG2 GLN 64 HG2 GLN 64 14.632 -4.544 -2.302 505 HG3 GLN 64 HG1 GLN 64 15.869 -5.710 -1.832 506 HE21 GLN 64 HE21 GLN 64 17.842 -5.698 -2.882 507 HE22 GLN 64 HE22 GLN 64 18.359 -4.379 -3.867 508 H SEP 65 H SEP 65 12.956 -7.895 -4.164 509 HA SEP 65 HA SEP 65 12.948 -8.832 -6.933 510 HB2 SEP 65 HB1 SEP 65 12.604 -11.117 -5.661 511 HB3 SEP 65 HB2 SEP 65 13.346 -10.228 -4.332 512 H ILE 66 H ILE 66 11.252 -10.502 -7.325 513 HA ILE 66 HA ILE 66 8.673 -9.490 -6.404 514 HB ILE 66 HB ILE 66 9.049 -9.620 -8.855 515 HG12 ILE 66 HG12 ILE 66 7.051 -11.700 -7.956 516 HG13 ILE 66 HG11 ILE 66 6.770 -9.964 -7.913 517 HG21 ILE 66 HG21 ILE 66 9.336 -12.575 -8.399 518 HG22 ILE 66 HG22 ILE 66 10.619 -11.468 -8.893 519 HG23 ILE 66 HG23 ILE 66 9.253 -11.778 -9.968 520 HD11 ILE 66 HD11 ILE 66 7.292 -11.610 -10.372 521 HD12 ILE 66 HD12 ILE 66 7.004 -9.869 -10.337 522 HD13 ILE 66 HD13 ILE 66 5.728 -10.986 -9.849 523 H VAL 67 H VAL 67 7.090 -11.023 -5.629 524 HA VAL 67 HA VAL 67 8.331 -13.095 -4.055 525 HB VAL 67 HB VAL 67 5.379 -12.550 -4.275 526 HG11 VAL 67 HG11 VAL 67 5.981 -14.626 -3.157 527 HG12 VAL 67 HG12 VAL 67 5.313 -13.470 -2.006 528 HG13 VAL 67 HG13 VAL 67 7.054 -13.745 -2.071 529 HG21 VAL 67 HG21 VAL 67 7.420 -11.197 -2.525 530 HG22 VAL 67 HG22 VAL 67 5.674 -11.079 -2.294 531 HG23 VAL 67 HG23 VAL 67 6.416 -10.445 -3.764 532 H HIS 68 H HIS 68 8.801 -14.954 -4.931 533 HA HIS 68 HA HIS 68 7.291 -16.050 -7.150 534 HB2 HIS 68 HB2 HIS 68 9.693 -17.059 -5.610 535 HB3 HIS 68 HB1 HIS 68 8.959 -17.939 -6.937 536 HD2 HIS 68 HD2 HIS 68 9.978 -14.118 -6.888 537 HE1 HIS 68 HE1 HIS 68 12.057 -16.151 -9.958 538 HE2 HIS 68 HE2 HIS 68 11.833 -13.974 -8.694 539 H ILE 69 H ILE 69 5.409 -17.027 -6.684 540 HA ILE 69 HA ILE 69 5.298 -18.619 -4.215 541 HB ILE 69 HB ILE 69 3.052 -17.192 -5.644 542 HG12 ILE 69 HG12 ILE 69 4.437 -16.757 -2.998 543 HG13 ILE 69 HG11 ILE 69 4.402 -15.669 -4.376 544 HG21 ILE 69 HG21 ILE 69 1.617 -17.979 -3.824 545 HG22 ILE 69 HG22 ILE 69 2.958 -18.925 -3.177 546 HG23 ILE 69 HG23 ILE 69 2.276 -19.325 -4.755 547 HD11 ILE 69 HD11 ILE 69 2.936 -14.917 -2.584 548 HD12 ILE 69 HD12 ILE 69 2.027 -16.426 -2.696 549 HD13 ILE 69 HD13 ILE 69 2.034 -15.297 -4.050 550 H VAL 70 H VAL 70 4.933 -20.706 -4.354 551 HA VAL 70 HA VAL 70 3.792 -21.806 -6.823 552 HB VAL 70 HB VAL 70 6.291 -22.032 -6.858 553 HG11 VAL 70 HG11 VAL 70 7.379 -23.619 -5.356 554 HG12 VAL 70 HG12 VAL 70 5.868 -23.817 -4.469 555 HG13 VAL 70 HG13 VAL 70 6.688 -22.256 -4.473 556 HG21 VAL 70 HG21 VAL 70 6.342 -24.423 -7.433 557 HG22 VAL 70 HG22 VAL 70 4.923 -23.616 -8.100 558 HG23 VAL 70 HG23 VAL 70 4.766 -24.632 -6.668 559 H GLN 71 H GLN 71 2.755 -23.860 -6.537 560 HA GLN 71 HA GLN 71 2.321 -24.703 -3.765 561 HB2 GLN 71 HB2 GLN 71 0.429 -23.241 -4.521 562 HB3 GLN 71 HB1 GLN 71 0.121 -24.385 -5.818 563 HG2 GLN 71 HG2 GLN 71 -0.211 -26.140 -4.046 564 HG3 GLN 71 HG1 GLN 71 -0.161 -24.838 -2.861 565 HE21 GLN 71 HE21 GLN 71 -1.484 -22.994 -4.735 566 HE22 GLN 71 HE22 GLN 71 -3.147 -23.451 -4.734 567 H ARG 72 H ARG 72 1.912 -26.915 -3.555 568 HA ARG 72 HA ARG 72 2.075 -28.451 -6.040 569 HB2 ARG 72 HB2 ARG 72 3.103 -30.226 -4.238 570 HB3 ARG 72 HB1 ARG 72 4.060 -29.214 -5.302 571 HG2 ARG 72 HG2 ARG 72 5.017 -29.022 -3.154 572 HG3 ARG 72 HG1 ARG 72 4.142 -27.520 -3.435 573 HD2 ARG 72 HD2 ARG 72 3.752 -28.283 -1.177 574 HD3 ARG 72 HD1 ARG 72 2.263 -28.406 -2.109 575 HE ARG 72 HE ARG 72 2.702 -30.805 -2.292 576 HH11 ARG 72 HH11 ARG 72 4.401 -29.026 0.227 577 HH12 ARG 72 HH12 ARG 72 4.622 -30.413 1.229 578 HH21 ARG 72 HH21 ARG 72 2.987 -32.634 -0.947 579 HH22 ARG 72 HH22 ARG 72 3.814 -32.465 0.566 580 HA PRO 73 HA PRO 73 -1.777 -29.771 -4.094 581 HB2 PRO 73 HB2 PRO 73 -3.322 -29.552 -6.260 582 HB3 PRO 73 HB1 PRO 73 -2.817 -28.125 -5.347 583 HG2 PRO 73 HG2 PRO 73 -1.834 -29.140 -7.962 584 HG3 PRO 73 HG1 PRO 73 -1.981 -27.473 -7.383 585 HD2 PRO 73 HD2 PRO 73 0.362 -29.044 -7.428 586 HD3 PRO 73 HD1 PRO 73 0.148 -27.487 -6.609 587 H TRP 74 H TRP 74 -3.455 -31.437 -5.025 588 HA TRP 74 HA TRP 74 -2.070 -33.536 -6.528 589 HB2 TRP 74 HB2 TRP 74 -1.914 -33.967 -4.060 590 HB3 TRP 74 HB1 TRP 74 -3.671 -34.019 -4.006 591 HD1 TRP 74 HD1 TRP 74 -0.673 -35.982 -5.388 592 HE1 TRP 74 HE1 TRP 74 -1.401 -38.416 -5.771 593 HE3 TRP 74 HE3 TRP 74 -5.663 -35.501 -4.397 594 HZ2 TRP 74 HZ2 TRP 74 -3.771 -39.934 -5.670 595 HZ3 TRP 74 HZ3 TRP 74 -7.089 -37.496 -4.564 596 HH2 TRP 74 HH2 TRP 74 -6.161 -39.665 -5.187 597 H ARG 75 H ARG 75 -3.254 -33.725 -8.306 598 HA ARG 75 HA ARG 75 -4.983 -34.013 -9.728 599 HB2 ARG 75 HB2 ARG 75 -6.166 -35.175 -7.220 600 HB3 ARG 75 HB1 ARG 75 -7.080 -35.120 -8.721 601 HG2 ARG 75 HG2 ARG 75 -5.339 -36.441 -9.825 602 HG3 ARG 75 HG1 ARG 75 -4.433 -36.499 -8.313 603 HD2 ARG 75 HD2 ARG 75 -5.778 -38.543 -8.763 604 HD3 ARG 75 HD1 ARG 75 -6.172 -37.746 -7.242 605 HE ARG 75 HE ARG 75 -7.823 -37.017 -9.512 606 HH11 ARG 75 HH11 ARG 75 -7.451 -39.139 -6.737 607 HH12 ARG 75 HH12 ARG 75 -9.143 -39.460 -6.602 608 HH21 ARG 75 HH21 ARG 75 -10.076 -37.452 -9.306 609 HH22 ARG 75 HH22 ARG 75 -10.632 -38.498 -8.045 610 H LYS 76 H LYS 76 -4.677 -31.454 -8.725 611 HA LYS 76 HA LYS 76 -7.427 -30.485 -8.433 612 HB2 LYS 76 HB2 LYS 76 -4.775 -29.104 -7.993 613 HB3 LYS 76 HB1 LYS 76 -6.328 -28.294 -7.885 614 HG2 LYS 76 HG2 LYS 76 -5.443 -30.598 -6.153 615 HG3 LYS 76 HG1 LYS 76 -5.420 -28.898 -5.685 616 HD2 LYS 76 HD2 LYS 76 -7.883 -30.479 -6.440 617 HD3 LYS 76 HD1 LYS 76 -7.388 -30.078 -4.796 618 HE2 LYS 76 HE2 LYS 76 -7.583 -27.686 -5.338 619 HE3 LYS 76 HE1 LYS 76 -8.112 -28.107 -6.966 620 HZ1 LYS 76 HZ1 LYS 76 -9.997 -27.616 -5.596 621 HZ2 LYS 76 HZ2 LYS 76 -9.523 -28.748 -4.438 622 HZ3 LYS 76 HZ3 LYS 76 -10.012 -29.264 -5.972 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 2.575 -0.600 0.511 2 H2 MET 1 HT2 MET 1 1.462 0.433 -0.211 3 H3 MET 1 HT3 MET 1 2.907 1.053 0.402 4 HA MET 1 HA MET 1 2.966 0.920 -1.989 5 HB2 MET 1 HB2 MET 1 5.054 -0.339 -2.225 6 HB3 MET 1 HB1 MET 1 5.075 0.620 -0.755 7 HG2 MET 1 HG2 MET 1 4.654 -1.325 0.587 8 HG3 MET 1 HG1 MET 1 4.421 -2.315 -0.852 9 HE1 MET 1 HE1 MET 1 7.801 -3.623 0.715 10 HE2 MET 1 HE2 MET 1 6.171 -4.071 0.211 11 HE3 MET 1 HE3 MET 1 6.403 -3.007 1.598 12 H ILE 2 H ILE 2 3.148 -0.453 -3.856 13 HA ILE 2 HA ILE 2 1.428 -2.826 -3.664 14 HB ILE 2 HB ILE 2 2.218 -1.120 -6.042 15 HG12 ILE 2 HG12 ILE 2 0.511 -0.243 -4.360 16 HG13 ILE 2 HG11 ILE 2 -0.002 -0.287 -6.048 17 HG21 ILE 2 HG21 ILE 2 0.700 -2.493 -7.368 18 HG22 ILE 2 HG22 ILE 2 0.410 -3.528 -5.973 19 HG23 ILE 2 HG23 ILE 2 2.015 -3.458 -6.701 20 HD11 ILE 2 HD11 ILE 2 -0.704 -2.252 -3.893 21 HD12 ILE 2 HD12 ILE 2 -1.209 -2.361 -5.579 22 HD13 ILE 2 HD13 ILE 2 -1.763 -1.019 -4.575 23 H VAL 3 H VAL 3 2.457 -4.734 -3.687 24 HA VAL 3 HA VAL 3 5.193 -4.784 -4.748 25 HB VAL 3 HB VAL 3 5.629 -6.698 -3.361 26 HG11 VAL 3 HG11 VAL 3 4.144 -4.592 -1.800 27 HG12 VAL 3 HG12 VAL 3 5.839 -4.538 -2.278 28 HG13 VAL 3 HG13 VAL 3 5.286 -5.751 -1.123 29 HG21 VAL 3 HG21 VAL 3 3.954 -7.666 -1.866 30 HG22 VAL 3 HG22 VAL 3 3.476 -7.830 -3.556 31 HG23 VAL 3 HG23 VAL 3 2.725 -6.596 -2.542 32 H PHE 4 H PHE 4 5.868 -6.672 -5.948 33 HA PHE 4 HA PHE 4 3.664 -7.708 -7.573 34 HB2 PHE 4 HB2 PHE 4 6.631 -7.642 -8.163 35 HB3 PHE 4 HB1 PHE 4 5.377 -8.218 -9.255 36 HD1 PHE 4 HD1 PHE 4 7.353 -5.472 -8.352 37 HD2 PHE 4 HD2 PHE 4 3.471 -6.487 -9.759 38 HE1 PHE 4 HE1 PHE 4 7.074 -3.191 -9.211 39 HE2 PHE 4 HE2 PHE 4 3.184 -4.210 -10.624 40 HZ PHE 4 HZ PHE 4 4.985 -2.554 -10.352 41 H VAL 5 H VAL 5 3.286 -9.834 -7.790 42 HA VAL 5 HA VAL 5 5.130 -11.698 -6.523 43 HB VAL 5 HB VAL 5 3.510 -11.144 -4.782 44 HG11 VAL 5 HG11 VAL 5 1.675 -10.399 -6.148 45 HG12 VAL 5 HG12 VAL 5 1.141 -11.654 -5.029 46 HG13 VAL 5 HG13 VAL 5 1.415 -12.043 -6.728 47 HG21 VAL 5 HG21 VAL 5 3.011 -13.879 -5.931 48 HG22 VAL 5 HG22 VAL 5 2.669 -13.365 -4.278 49 HG23 VAL 5 HG23 VAL 5 4.335 -13.425 -4.854 50 H ARG 6 H ARG 6 5.400 -13.473 -7.663 51 HA ARG 6 HA ARG 6 3.578 -13.950 -9.912 52 HB2 ARG 6 HB2 ARG 6 5.569 -15.323 -10.802 53 HB3 ARG 6 HB1 ARG 6 5.687 -13.572 -10.842 54 HG2 ARG 6 HG2 ARG 6 7.008 -13.645 -8.768 55 HG3 ARG 6 HG1 ARG 6 6.936 -15.406 -8.815 56 HD2 ARG 6 HD2 ARG 6 7.961 -13.861 -11.158 57 HD3 ARG 6 HD1 ARG 6 9.011 -14.189 -9.785 58 HE ARG 6 HE ARG 6 8.116 -16.632 -10.339 59 HH11 ARG 6 HH11 ARG 6 9.258 -14.127 -12.514 60 HH12 ARG 6 HH12 ARG 6 10.012 -15.236 -13.601 61 HH21 ARG 6 HH21 ARG 6 9.133 -18.117 -11.789 62 HH22 ARG 6 HH22 ARG 6 9.952 -17.506 -13.186 63 H PHE 7 H PHE 7 2.090 -15.307 -9.248 64 HA PHE 7 HA PHE 7 2.693 -17.476 -7.459 65 HB2 PHE 7 HB2 PHE 7 0.521 -16.245 -7.394 66 HB3 PHE 7 HB1 PHE 7 0.141 -16.899 -8.982 67 HD1 PHE 7 HD1 PHE 7 0.600 -17.691 -5.439 68 HD2 PHE 7 HD2 PHE 7 -0.573 -19.171 -9.248 69 HE1 PHE 7 HE1 PHE 7 -0.357 -19.677 -4.366 70 HE2 PHE 7 HE2 PHE 7 -1.533 -21.167 -8.182 71 HZ PHE 7 HZ PHE 7 -1.422 -21.422 -5.737 72 H ASN 8 H ASN 8 3.441 -19.354 -8.068 73 HA ASN 8 HA ASN 8 3.999 -21.188 -9.296 74 HB2 ASN 8 HB2 ASN 8 1.466 -21.298 -9.500 75 HB3 ASN 8 HB1 ASN 8 1.630 -20.503 -11.060 76 HD21 ASN 8 HD21 ASN 8 0.715 -22.260 -12.103 77 HD22 ASN 8 HD22 ASN 8 1.581 -23.737 -12.349 78 H SER 9 H SER 9 4.879 -18.434 -9.971 79 HA SER 9 HA SER 9 6.272 -17.381 -11.401 80 HB2 SER 9 HB2 SER 9 6.412 -20.099 -12.728 81 HB3 SER 9 HB1 SER 9 7.451 -18.732 -13.139 82 HG SER 9 HG SER 9 7.627 -20.476 -11.061 83 H SER 10 H SER 10 3.280 -17.887 -11.971 84 HA SER 10 HA SER 10 3.190 -17.442 -14.836 85 HB2 SER 10 HB2 SER 10 1.612 -19.024 -13.722 86 HB3 SER 10 HB1 SER 10 0.916 -17.662 -12.848 87 HG SER 10 HG SER 10 0.385 -16.751 -14.928 88 H HIS 11 H HIS 11 3.280 -15.487 -15.639 89 HA HIS 11 HA HIS 11 2.940 -13.302 -16.066 90 HB2 HIS 11 HB2 HIS 11 0.724 -13.578 -14.032 91 HB3 HIS 11 HB1 HIS 11 0.965 -12.170 -15.057 92 HD2 HIS 11 HD2 HIS 11 0.181 -12.451 -17.694 93 HE1 HIS 11 HE1 HIS 11 -1.474 -16.312 -17.188 94 HE2 HIS 11 HE2 HIS 11 -1.452 -14.234 -18.631 95 H GLY 12 H GLY 12 2.093 -13.131 -12.640 96 HA2 GLY 12 HA2 GLY 12 3.607 -12.255 -10.961 97 HA3 GLY 12 HA1 GLY 12 4.417 -11.355 -12.243 98 H PHE 13 H PHE 13 1.504 -11.593 -10.329 99 HA PHE 13 HA PHE 13 0.548 -9.077 -11.413 100 HB2 PHE 13 HB2 PHE 13 -1.535 -9.630 -10.055 101 HB3 PHE 13 HB1 PHE 13 -1.168 -10.700 -11.400 102 HD1 PHE 13 HD1 PHE 13 -1.314 -10.387 -7.749 103 HD2 PHE 13 HD2 PHE 13 -0.506 -12.987 -11.022 104 HE1 PHE 13 HE1 PHE 13 -1.432 -12.325 -6.238 105 HE2 PHE 13 HE2 PHE 13 -0.619 -14.924 -9.514 106 HZ PHE 13 HZ PHE 13 -1.084 -14.595 -7.120 107 HA PRO 14 HA PRO 14 1.642 -6.881 -7.746 108 HB2 PRO 14 HB2 PRO 14 -0.262 -4.814 -8.199 109 HB3 PRO 14 HB1 PRO 14 1.425 -4.845 -8.711 110 HG2 PRO 14 HG2 PRO 14 -0.759 -4.914 -10.427 111 HG3 PRO 14 HG1 PRO 14 0.884 -5.431 -10.842 112 HD2 PRO 14 HD2 PRO 14 -1.473 -7.073 -10.019 113 HD3 PRO 14 HD1 PRO 14 -0.231 -7.408 -11.246 114 H VAL 15 H VAL 15 1.105 -6.926 -5.668 115 HA VAL 15 HA VAL 15 -1.732 -7.131 -4.942 116 HB VAL 15 HB VAL 15 0.612 -8.656 -3.751 117 HG11 VAL 15 HG11 VAL 15 -0.932 -9.497 -2.046 118 HG12 VAL 15 HG12 VAL 15 -2.197 -8.426 -2.650 119 HG13 VAL 15 HG13 VAL 15 -0.745 -7.748 -1.912 120 HG21 VAL 15 HG21 VAL 15 -0.788 -10.599 -4.241 121 HG22 VAL 15 HG22 VAL 15 -0.456 -9.661 -5.696 122 HG23 VAL 15 HG23 VAL 15 -2.029 -9.541 -4.909 123 H GLU 16 H GLU 16 -2.443 -5.727 -3.498 124 HA GLU 16 HA GLU 16 -0.645 -3.691 -2.514 125 HB2 GLU 16 HB2 GLU 16 -2.809 -3.094 -3.496 126 HB3 GLU 16 HB1 GLU 16 -3.631 -4.029 -2.259 127 HG2 GLU 16 HG2 GLU 16 -2.851 -2.500 -0.553 128 HG3 GLU 16 HG1 GLU 16 -1.948 -1.590 -1.765 129 H VAL 17 H VAL 17 0.030 -3.470 -0.466 130 HA VAL 17 HA VAL 17 -1.130 -5.251 1.573 131 HB VAL 17 HB VAL 17 1.101 -5.725 2.484 132 HG11 VAL 17 HG11 VAL 17 1.891 -7.254 0.732 133 HG12 VAL 17 HG12 VAL 17 0.825 -6.461 -0.427 134 HG13 VAL 17 HG13 VAL 17 0.142 -7.331 0.946 135 HG21 VAL 17 HG21 VAL 17 3.116 -5.199 1.163 136 HG22 VAL 17 HG22 VAL 17 2.288 -3.754 1.742 137 HG23 VAL 17 HG23 VAL 17 2.124 -4.248 0.055 138 H ASP 18 H ASP 18 -0.262 -4.632 3.811 139 HA ASP 18 HA ASP 18 -0.272 -1.699 4.034 140 HB2 ASP 18 HB2 ASP 18 -2.137 -3.047 5.153 141 HB3 ASP 18 HB1 ASP 18 -0.906 -3.686 6.230 142 H SER 19 H SER 19 0.939 -0.945 6.013 143 HA SER 19 HA SER 19 3.640 -1.656 5.785 144 HB2 SER 19 HB2 SER 19 3.890 -0.149 7.799 145 HB3 SER 19 HB1 SER 19 3.091 0.571 6.403 146 HG SER 19 HG SER 19 1.158 -0.505 7.793 147 H ASP 20 H ASP 20 1.102 -3.011 7.693 148 HA ASP 20 HA ASP 20 3.096 -4.301 9.448 149 HB2 ASP 20 HB2 ASP 20 1.489 -4.471 11.141 150 HB3 ASP 20 HB1 ASP 20 1.154 -2.896 10.432 151 H THR 21 H THR 21 1.693 -4.985 6.653 152 HA THR 21 HA THR 21 0.319 -7.400 7.110 153 HB THR 21 HB THR 21 1.741 -6.414 4.632 154 HG1 THR 21 HG1 THR 21 -0.804 -6.064 5.747 155 HG21 THR 21 HG21 THR 21 0.375 -8.043 3.403 156 HG22 THR 21 HG22 THR 21 -0.266 -8.662 4.928 157 HG23 THR 21 HG23 THR 21 1.446 -8.853 4.546 158 H SER 22 H SER 22 1.177 -9.107 8.065 159 HA SER 22 HA SER 22 3.959 -9.704 8.021 160 HB2 SER 22 HB2 SER 22 1.641 -11.486 8.807 161 HB3 SER 22 HB1 SER 22 3.335 -11.725 9.232 162 HG SER 22 HG SER 22 2.319 -10.771 10.953 163 H ILE 23 H ILE 23 4.966 -11.532 7.032 164 HA ILE 23 HA ILE 23 4.283 -12.014 4.369 165 HB ILE 23 HB ILE 23 5.942 -13.808 6.166 166 HG12 ILE 23 HG12 ILE 23 6.782 -11.505 6.185 167 HG13 ILE 23 HG11 ILE 23 7.886 -12.562 5.314 168 HG21 ILE 23 HG21 ILE 23 5.323 -14.932 4.102 169 HG22 ILE 23 HG22 ILE 23 7.038 -14.517 4.067 170 HG23 ILE 23 HG23 ILE 23 5.882 -13.552 3.155 171 HD11 ILE 23 HD11 ILE 23 6.958 -11.737 3.191 172 HD12 ILE 23 HD12 ILE 23 7.664 -10.451 4.170 173 HD13 ILE 23 HD13 ILE 23 5.912 -10.640 4.095 174 H PHE 24 H PHE 24 3.418 -13.725 7.314 175 HA PHE 24 HA PHE 24 2.231 -16.003 6.194 176 HB2 PHE 24 HB2 PHE 24 2.669 -15.637 8.641 177 HB3 PHE 24 HB1 PHE 24 1.314 -14.523 8.667 178 HD1 PHE 24 HD1 PHE 24 2.154 -18.034 7.783 179 HD2 PHE 24 HD2 PHE 24 -0.800 -15.303 9.155 180 HE1 PHE 24 HE1 PHE 24 0.620 -19.904 8.189 181 HE2 PHE 24 HE2 PHE 24 -2.342 -17.171 9.562 182 HZ PHE 24 HZ PHE 24 -1.631 -19.480 9.080 183 H GLN 25 H GLN 25 0.869 -12.827 6.978 184 HA GLN 25 HA GLN 25 -1.763 -13.371 6.114 185 HB2 GLN 25 HB2 GLN 25 -0.263 -10.755 6.353 186 HB3 GLN 25 HB1 GLN 25 -1.979 -10.874 5.999 187 HG2 GLN 25 HG2 GLN 25 -0.625 -11.847 8.506 188 HG3 GLN 25 HG1 GLN 25 -1.570 -10.368 8.343 189 HE21 GLN 25 HE21 GLN 25 -1.667 -13.806 8.593 190 HE22 GLN 25 HE22 GLN 25 -3.370 -13.958 8.807 191 H LEU 26 H LEU 26 1.041 -11.912 4.517 192 HA LEU 26 HA LEU 26 -0.151 -11.277 2.076 193 HB2 LEU 26 HB2 LEU 26 2.070 -10.503 2.687 194 HB3 LEU 26 HB1 LEU 26 2.677 -12.145 2.671 195 HG LEU 26 HG LEU 26 2.315 -12.257 0.241 196 HD11 LEU 26 HD11 LEU 26 1.791 -10.211 -1.004 197 HD12 LEU 26 HD12 LEU 26 1.486 -9.373 0.519 198 HD13 LEU 26 HD13 LEU 26 0.456 -10.718 0.031 199 HD21 LEU 26 HD21 LEU 26 4.099 -10.693 -0.395 200 HD22 LEU 26 HD22 LEU 26 4.481 -11.568 1.087 201 HD23 LEU 26 HD23 LEU 26 3.936 -9.893 1.170 202 H LYS 27 H LYS 27 1.353 -14.276 3.177 203 HA LYS 27 HA LYS 27 1.159 -15.760 0.821 204 HB2 LYS 27 HB2 LYS 27 2.394 -16.455 2.883 205 HB3 LYS 27 HB1 LYS 27 0.837 -16.763 3.651 206 HG2 LYS 27 HG2 LYS 27 0.358 -18.546 2.131 207 HG3 LYS 27 HG1 LYS 27 1.767 -18.156 1.148 208 HD2 LYS 27 HD2 LYS 27 2.264 -20.085 2.509 209 HD3 LYS 27 HD1 LYS 27 3.219 -18.717 3.079 210 HE2 LYS 27 HE2 LYS 27 1.634 -18.358 4.899 211 HE3 LYS 27 HE1 LYS 27 0.642 -19.691 4.310 212 HZ1 LYS 27 HZ1 LYS 27 2.531 -21.180 4.703 213 HZ2 LYS 27 HZ2 LYS 27 2.020 -20.433 6.122 214 HZ3 LYS 27 HZ3 LYS 27 3.421 -19.894 5.341 215 H GLU 28 H GLU 28 -1.122 -15.356 3.494 216 HA GLU 28 HA GLU 28 -3.124 -17.049 2.481 217 HB2 GLU 28 HB2 GLU 28 -3.166 -14.777 4.431 218 HB3 GLU 28 HB1 GLU 28 -4.606 -15.720 4.066 219 HG2 GLU 28 HG2 GLU 28 -3.270 -17.748 4.774 220 HG3 GLU 28 HG1 GLU 28 -2.059 -16.616 5.376 221 H VAL 29 H VAL 29 -2.528 -13.580 2.118 222 HA VAL 29 HA VAL 29 -4.912 -12.883 0.834 223 HB VAL 29 HB VAL 29 -2.157 -11.676 0.474 224 HG11 VAL 29 HG11 VAL 29 -3.344 -9.692 -0.387 225 HG12 VAL 29 HG12 VAL 29 -4.858 -10.596 -0.331 226 HG13 VAL 29 HG13 VAL 29 -3.572 -11.103 -1.422 227 HG21 VAL 29 HG21 VAL 29 -2.989 -11.558 2.761 228 HG22 VAL 29 HG22 VAL 29 -4.494 -10.840 2.188 229 HG23 VAL 29 HG23 VAL 29 -2.975 -9.959 2.018 230 H VAL 30 H VAL 30 -1.826 -13.924 -0.554 231 HA VAL 30 HA VAL 30 -2.762 -13.852 -3.238 232 HB VAL 30 HB VAL 30 -0.427 -15.398 -2.077 233 HG11 VAL 30 HG11 VAL 30 -1.088 -16.255 -4.263 234 HG12 VAL 30 HG12 VAL 30 0.448 -15.395 -4.371 235 HG13 VAL 30 HG13 VAL 30 -1.035 -14.623 -4.931 236 HG21 VAL 30 HG21 VAL 30 -0.241 -13.008 -1.648 237 HG22 VAL 30 HG22 VAL 30 -0.529 -12.664 -3.353 238 HG23 VAL 30 HG23 VAL 30 0.936 -13.511 -2.860 239 H ALA 31 H ALA 31 -2.589 -16.334 -0.753 240 HA ALA 31 HA ALA 31 -3.235 -18.557 -2.314 241 HB1 ALA 31 HB1 ALA 31 -2.374 -18.689 -0.020 242 HB2 ALA 31 HB2 ALA 31 -3.836 -19.649 -0.243 243 HB3 ALA 31 HB3 ALA 31 -3.922 -18.091 0.578 244 H LYS 32 H LYS 32 -5.395 -16.506 -0.341 245 HA LYS 32 HA LYS 32 -7.753 -17.861 -1.138 246 HB2 LYS 32 HB2 LYS 32 -8.975 -16.031 -0.120 247 HB3 LYS 32 HB1 LYS 32 -7.630 -16.498 0.908 248 HG2 LYS 32 HG2 LYS 32 -6.373 -14.570 0.252 249 HG3 LYS 32 HG1 LYS 32 -7.565 -14.156 -0.984 250 HD2 LYS 32 HD2 LYS 32 -9.232 -13.772 0.714 251 HD3 LYS 32 HD1 LYS 32 -8.096 -14.248 1.979 252 HE2 LYS 32 HE2 LYS 32 -6.646 -12.353 1.311 253 HE3 LYS 32 HE1 LYS 32 -7.869 -11.866 0.139 254 HZ1 LYS 32 HZ1 LYS 32 -8.213 -12.012 3.082 255 HZ2 LYS 32 HZ2 LYS 32 -9.426 -11.597 1.987 256 HZ3 LYS 32 HZ3 LYS 32 -8.075 -10.600 2.165 257 H ARG 33 H ARG 33 -5.936 -15.245 -2.518 258 HA ARG 33 HA ARG 33 -7.965 -14.242 -4.210 259 HB2 ARG 33 HB2 ARG 33 -5.866 -13.024 -3.580 260 HB3 ARG 33 HB1 ARG 33 -4.980 -14.114 -4.643 261 HG2 ARG 33 HG2 ARG 33 -6.099 -13.267 -6.570 262 HG3 ARG 33 HG1 ARG 33 -7.215 -12.327 -5.578 263 HD2 ARG 33 HD2 ARG 33 -4.228 -11.912 -5.740 264 HD3 ARG 33 HD1 ARG 33 -5.447 -10.931 -6.554 265 HE ARG 33 HE ARG 33 -5.780 -11.098 -3.697 266 HH11 ARG 33 HH11 ARG 33 -4.234 -9.326 -6.315 267 HH12 ARG 33 HH12 ARG 33 -4.082 -7.869 -5.399 268 HH21 ARG 33 HH21 ARG 33 -5.566 -9.151 -2.482 269 HH22 ARG 33 HH22 ARG 33 -4.837 -7.771 -3.225 270 H GLN 34 H GLN 34 -5.668 -16.841 -4.445 271 HA GLN 34 HA GLN 34 -6.369 -17.309 -7.249 272 HB2 GLN 34 HB2 GLN 34 -4.148 -18.416 -5.534 273 HB3 GLN 34 HB1 GLN 34 -4.438 -18.883 -7.206 274 HG2 GLN 34 HG2 GLN 34 -3.927 -16.055 -6.337 275 HG3 GLN 34 HG1 GLN 34 -2.656 -17.147 -6.869 276 HE21 GLN 34 HE21 GLN 34 -3.629 -14.629 -8.017 277 HE22 GLN 34 HE22 GLN 34 -4.095 -14.990 -9.640 278 H GLY 35 H GLY 35 -7.407 -18.220 -4.274 279 HA2 GLY 35 HA2 GLY 35 -8.909 -19.839 -3.624 280 HA3 GLY 35 HA1 GLY 35 -8.961 -20.382 -5.294 281 H VAL 36 H VAL 36 -6.059 -20.195 -3.321 282 HA VAL 36 HA VAL 36 -5.902 -23.136 -3.449 283 HB VAL 36 HB VAL 36 -3.471 -22.955 -3.617 284 HG11 VAL 36 HG11 VAL 36 -4.857 -21.229 -5.665 285 HG12 VAL 36 HG12 VAL 36 -4.781 -22.990 -5.677 286 HG13 VAL 36 HG13 VAL 36 -3.308 -22.045 -5.873 287 HG21 VAL 36 HG21 VAL 36 -3.185 -20.871 -2.352 288 HG22 VAL 36 HG22 VAL 36 -3.900 -19.968 -3.689 289 HG23 VAL 36 HG23 VAL 36 -2.361 -20.802 -3.911 290 HA PRO 37 HA PRO 37 -5.336 -23.146 0.946 291 HB2 PRO 37 HB2 PRO 37 -3.692 -25.275 1.300 292 HB3 PRO 37 HB1 PRO 37 -5.391 -25.450 0.850 293 HG2 PRO 37 HG2 PRO 37 -2.952 -25.578 -0.876 294 HG3 PRO 37 HG1 PRO 37 -4.399 -26.603 -0.905 295 HD2 PRO 37 HD2 PRO 37 -3.990 -24.570 -2.656 296 HD3 PRO 37 HD1 PRO 37 -5.605 -25.077 -2.129 297 H ALA 38 H ALA 38 -4.134 -21.861 2.189 298 HA ALA 38 HA ALA 38 -1.518 -21.003 1.323 299 HB1 ALA 38 HB1 ALA 38 -3.084 -20.255 3.791 300 HB2 ALA 38 HB2 ALA 38 -3.114 -19.405 2.245 301 HB3 ALA 38 HB3 ALA 38 -1.631 -19.449 3.197 302 H ASP 39 H ASP 39 -2.786 -23.341 3.443 303 HA ASP 39 HA ASP 39 -0.640 -23.533 5.289 304 HB2 ASP 39 HB2 ASP 39 -2.731 -25.553 4.454 305 HB3 ASP 39 HB1 ASP 39 -1.610 -25.788 5.789 306 H GLN 40 H GLN 40 -1.315 -24.979 2.183 307 HA GLN 40 HA GLN 40 1.254 -26.382 2.270 308 HB2 GLN 40 HB2 GLN 40 -1.194 -26.809 0.550 309 HB3 GLN 40 HB1 GLN 40 0.339 -27.611 0.254 310 HG2 GLN 40 HG2 GLN 40 -1.004 -29.150 1.427 311 HG3 GLN 40 HG1 GLN 40 0.175 -28.541 2.584 312 HE21 GLN 40 HE21 GLN 40 -1.057 -29.035 4.356 313 HE22 GLN 40 HE22 GLN 40 -2.505 -28.187 4.764 314 H LEU 41 H LEU 41 0.798 -23.501 1.764 315 HA LEU 41 HA LEU 41 1.663 -23.304 -1.030 316 HB2 LEU 41 HB2 LEU 41 -0.302 -21.967 -0.283 317 HB3 LEU 41 HB1 LEU 41 0.750 -21.114 0.829 318 HG LEU 41 HG LEU 41 2.049 -20.252 -1.076 319 HD11 LEU 41 HD11 LEU 41 -0.067 -21.612 -2.742 320 HD12 LEU 41 HD12 LEU 41 1.636 -22.064 -2.651 321 HD13 LEU 41 HD13 LEU 41 1.172 -20.512 -3.341 322 HD21 LEU 41 HD21 LEU 41 0.355 -18.689 -1.879 323 HD22 LEU 41 HD22 LEU 41 0.199 -18.953 -0.140 324 HD23 LEU 41 HD23 LEU 41 -0.917 -19.739 -1.255 325 H ARG 42 H ARG 42 3.628 -22.459 -1.566 326 HA ARG 42 HA ARG 42 5.502 -22.049 0.664 327 HB2 ARG 42 HB2 ARG 42 5.920 -23.919 -0.912 328 HB3 ARG 42 HB1 ARG 42 6.089 -22.737 -2.201 329 HG2 ARG 42 HG2 ARG 42 7.872 -21.706 -0.598 330 HG3 ARG 42 HG1 ARG 42 7.895 -23.338 0.075 331 HD2 ARG 42 HD2 ARG 42 8.416 -22.483 -2.735 332 HD3 ARG 42 HD1 ARG 42 9.557 -23.221 -1.608 333 HE ARG 42 HE ARG 42 7.184 -24.707 -2.528 334 HH11 ARG 42 HH11 ARG 42 10.677 -24.456 -2.244 335 HH12 ARG 42 HH12 ARG 42 10.965 -26.039 -2.864 336 HH21 ARG 42 HH21 ARG 42 7.573 -26.807 -3.368 337 HH22 ARG 42 HH22 ARG 42 9.196 -27.388 -3.493 338 H VAL 43 H VAL 43 6.708 -20.215 0.794 339 HA VAL 43 HA VAL 43 6.366 -18.273 -1.363 340 HB VAL 43 HB VAL 43 6.606 -16.453 0.361 341 HG11 VAL 43 HG11 VAL 43 4.408 -17.051 -0.485 342 HG12 VAL 43 HG12 VAL 43 4.313 -16.627 1.224 343 HG13 VAL 43 HG13 VAL 43 4.268 -18.319 0.732 344 HG21 VAL 43 HG21 VAL 43 6.206 -17.004 2.722 345 HG22 VAL 43 HG22 VAL 43 7.692 -17.748 2.128 346 HG23 VAL 43 HG23 VAL 43 6.233 -18.722 2.323 347 H ILE 44 H ILE 44 8.157 -17.822 -2.400 348 HA ILE 44 HA ILE 44 10.718 -18.046 -0.965 349 HB ILE 44 HB ILE 44 10.132 -18.769 -3.850 350 HG12 ILE 44 HG12 ILE 44 9.426 -20.488 -2.251 351 HG13 ILE 44 HG11 ILE 44 10.801 -21.037 -3.202 352 HG21 ILE 44 HG21 ILE 44 12.492 -19.419 -4.012 353 HG22 ILE 44 HG22 ILE 44 12.769 -18.795 -2.385 354 HG23 ILE 44 HG23 ILE 44 12.307 -17.695 -3.684 355 HD11 ILE 44 HD11 ILE 44 10.891 -20.021 -0.370 356 HD12 ILE 44 HD12 ILE 44 12.285 -20.535 -1.318 357 HD13 ILE 44 HD13 ILE 44 11.033 -21.698 -0.888 358 H PHE 45 H PHE 45 12.073 -16.382 -1.147 359 HA PHE 45 HA PHE 45 11.727 -14.463 -3.291 360 HB2 PHE 45 HB2 PHE 45 10.350 -13.505 -1.543 361 HB3 PHE 45 HB1 PHE 45 11.637 -13.725 -0.361 362 HD1 PHE 45 HD1 PHE 45 10.977 -12.044 -3.613 363 HD2 PHE 45 HD2 PHE 45 13.025 -11.954 0.113 364 HE1 PHE 45 HE1 PHE 45 11.849 -9.812 -4.148 365 HE2 PHE 45 HE2 PHE 45 13.896 -9.719 -0.418 366 HZ PHE 45 HZ PHE 45 13.309 -8.650 -2.549 367 H ALA 46 H ALA 46 13.627 -13.964 -4.092 368 HA ALA 46 HA ALA 46 15.855 -13.715 -4.381 369 HB1 ALA 46 HB1 ALA 46 15.921 -13.355 -1.387 370 HB2 ALA 46 HB2 ALA 46 15.611 -12.080 -2.565 371 HB3 ALA 46 HB3 ALA 46 17.181 -12.880 -2.523 372 H GLY 47 H GLY 47 14.657 -16.366 -3.756 373 HA2 GLY 47 HA2 GLY 47 15.696 -18.447 -4.057 374 HA3 GLY 47 HA1 GLY 47 17.197 -17.761 -3.461 375 H LYS 48 H LYS 48 15.117 -16.729 -1.228 376 HA LYS 48 HA LYS 48 15.307 -19.226 0.297 377 HB2 LYS 48 HB2 LYS 48 15.674 -17.780 2.352 378 HB3 LYS 48 HB1 LYS 48 17.011 -17.880 1.223 379 HG2 LYS 48 HG2 LYS 48 16.935 -15.631 1.854 380 HG3 LYS 48 HG1 LYS 48 16.158 -15.663 0.274 381 HD2 LYS 48 HD2 LYS 48 13.955 -15.679 1.396 382 HD3 LYS 48 HD1 LYS 48 14.771 -15.575 2.956 383 HE2 LYS 48 HE2 LYS 48 14.976 -13.539 0.736 384 HE3 LYS 48 HE1 LYS 48 13.956 -13.385 2.162 385 HZ1 LYS 48 HZ1 LYS 48 15.958 -13.449 3.534 386 HZ2 LYS 48 HZ2 LYS 48 15.998 -12.162 2.439 387 HZ3 LYS 48 HZ3 LYS 48 16.921 -13.542 2.145 388 H GLU 49 H GLU 49 13.777 -19.541 1.974 389 HA GLU 49 HA GLU 49 11.149 -18.629 1.266 390 HB2 GLU 49 HB2 GLU 49 11.506 -20.919 2.043 391 HB3 GLU 49 HB1 GLU 49 12.137 -20.325 3.570 392 HG2 GLU 49 HG2 GLU 49 9.909 -19.309 4.016 393 HG3 GLU 49 HG1 GLU 49 9.313 -20.099 2.557 394 H LEU 50 H LEU 50 9.871 -17.191 2.366 395 HA LEU 50 HA LEU 50 11.248 -15.382 4.168 396 HB2 LEU 50 HB2 LEU 50 8.475 -15.288 3.002 397 HB3 LEU 50 HB1 LEU 50 9.162 -14.046 4.031 398 HG LEU 50 HG LEU 50 10.078 -14.818 1.274 399 HD11 LEU 50 HD11 LEU 50 9.357 -12.578 0.660 400 HD12 LEU 50 HD12 LEU 50 8.802 -12.301 2.309 401 HD13 LEU 50 HD13 LEU 50 8.019 -13.525 1.310 402 HD21 LEU 50 HD21 LEU 50 11.192 -12.786 3.204 403 HD22 LEU 50 HD22 LEU 50 11.624 -12.887 1.500 404 HD23 LEU 50 HD23 LEU 50 12.013 -14.219 2.586 405 H ARG 51 H ARG 51 10.959 -15.271 6.306 406 HA ARG 51 HA ARG 51 9.543 -17.257 7.701 407 HB2 ARG 51 HB2 ARG 51 9.984 -15.960 9.730 408 HB3 ARG 51 HB1 ARG 51 11.420 -16.013 8.727 409 HG2 ARG 51 HG2 ARG 51 9.641 -13.682 8.376 410 HG3 ARG 51 HG1 ARG 51 10.529 -13.789 9.897 411 HD2 ARG 51 HD2 ARG 51 11.748 -13.912 7.138 412 HD3 ARG 51 HD1 ARG 51 11.730 -12.493 8.179 413 HE ARG 51 HE ARG 51 12.876 -14.588 9.617 414 HH11 ARG 51 HH11 ARG 51 13.621 -12.628 6.796 415 HH12 ARG 51 HH12 ARG 51 15.332 -12.772 7.001 416 HH21 ARG 51 HH21 ARG 51 15.155 -14.767 9.871 417 HH22 ARG 51 HH22 ARG 51 16.203 -13.982 8.739 418 H ASN 52 H ASN 52 7.496 -17.350 8.449 419 HA ASN 52 HA ASN 52 5.579 -15.761 7.128 420 HB2 ASN 52 HB2 ASN 52 3.894 -17.039 8.322 421 HB3 ASN 52 HB1 ASN 52 5.167 -18.109 7.764 422 HD21 ASN 52 HD21 ASN 52 6.499 -19.105 9.258 423 HD22 ASN 52 HD22 ASN 52 6.141 -19.130 10.951 424 H ASP 53 H ASP 53 7.064 -15.421 10.255 425 HA ASP 53 HA ASP 53 5.095 -13.375 10.951 426 HB2 ASP 53 HB2 ASP 53 5.455 -15.141 12.643 427 HB3 ASP 53 HB1 ASP 53 7.147 -14.664 12.754 428 H TRP 54 H TRP 54 6.129 -12.104 9.297 429 HA TRP 54 HA TRP 54 7.886 -10.190 10.539 430 HB2 TRP 54 HB2 TRP 54 9.460 -11.845 9.513 431 HB3 TRP 54 HB1 TRP 54 8.749 -11.493 7.943 432 HD1 TRP 54 HD1 TRP 54 10.169 -9.859 6.590 433 HE1 TRP 54 HE1 TRP 54 11.769 -7.909 7.117 434 HE3 TRP 54 HE3 TRP 54 9.794 -9.866 11.685 435 HZ2 TRP 54 HZ2 TRP 54 12.733 -6.556 9.399 436 HZ3 TRP 54 HZ3 TRP 54 11.085 -8.209 12.966 437 HH2 TRP 54 HH2 TRP 54 12.522 -6.589 11.842 438 H THR 55 H THR 55 7.851 -8.161 9.454 439 HA THR 55 HA THR 55 5.400 -7.732 8.040 440 HB THR 55 HB THR 55 5.960 -6.056 9.646 441 HG1 THR 55 HG1 THR 55 5.519 -4.357 8.379 442 HG21 THR 55 HG21 THR 55 8.400 -6.385 9.689 443 HG22 THR 55 HG22 THR 55 7.976 -4.684 9.510 444 HG23 THR 55 HG23 THR 55 8.526 -5.604 8.112 445 H VAL 56 H VAL 56 5.070 -7.196 5.991 446 HA VAL 56 HA VAL 56 7.043 -7.893 4.050 447 HB VAL 56 HB VAL 56 4.572 -8.296 3.813 448 HG11 VAL 56 HG11 VAL 56 4.461 -5.335 3.290 449 HG12 VAL 56 HG12 VAL 56 3.771 -6.176 4.677 450 HG13 VAL 56 HG13 VAL 56 3.138 -6.479 3.057 451 HG21 VAL 56 HG21 VAL 56 6.046 -8.407 1.868 452 HG22 VAL 56 HG22 VAL 56 5.821 -6.677 1.601 453 HG23 VAL 56 HG23 VAL 56 4.457 -7.778 1.431 454 H GLN 57 H GLN 57 6.094 -4.976 5.628 455 HA GLN 57 HA GLN 57 6.727 -3.136 3.566 456 HB2 GLN 57 HB2 GLN 57 5.299 -2.664 5.574 457 HB3 GLN 57 HB1 GLN 57 6.771 -2.602 6.532 458 HG2 GLN 57 HG2 GLN 57 6.099 -0.367 5.972 459 HG3 GLN 57 HG1 GLN 57 7.585 -0.758 5.105 460 HE21 GLN 57 HE21 GLN 57 4.208 -0.086 4.833 461 HE22 GLN 57 HE22 GLN 57 4.156 0.066 3.118 462 H ASN 58 H ASN 58 8.564 -4.445 6.282 463 HA ASN 58 HA ASN 58 10.858 -2.806 5.785 464 HB2 ASN 58 HB2 ASN 58 10.239 -3.807 8.024 465 HB3 ASN 58 HB1 ASN 58 10.774 -5.360 7.397 466 HD21 ASN 58 HD21 ASN 58 12.283 -2.240 6.730 467 HD22 ASN 58 HD22 ASN 58 13.760 -2.588 7.551 468 H CYS 59 H CYS 59 9.622 -5.429 4.168 469 HA CYS 59 HA CYS 59 12.187 -6.558 3.421 470 HB2 CYS 59 HB2 CYS 59 9.396 -7.227 2.476 471 HB3 CYS 59 HB1 CYS 59 10.854 -8.124 2.062 472 HG CYS 59 HG CYS 59 9.281 -7.956 5.097 473 H ASP 60 H ASP 60 10.074 -4.106 2.378 474 HA ASP 60 HA ASP 60 9.961 -2.729 0.571 475 HB2 ASP 60 HB2 ASP 60 12.913 -3.304 0.713 476 HB3 ASP 60 HB1 ASP 60 12.240 -2.147 -0.430 477 H LEU 61 H LEU 61 8.976 -5.046 -0.269 478 HA LEU 61 HA LEU 61 10.266 -6.282 -2.439 479 HB2 LEU 61 HB2 LEU 61 7.338 -6.031 -1.791 480 HB3 LEU 61 HB1 LEU 61 7.916 -6.948 -3.161 481 HG LEU 61 HG LEU 61 7.461 -8.500 -1.443 482 HD11 LEU 61 HD11 LEU 61 9.529 -8.910 -2.658 483 HD12 LEU 61 HD12 LEU 61 9.597 -9.528 -1.009 484 HD13 LEU 61 HD13 LEU 61 10.429 -8.029 -1.423 485 HD21 LEU 61 HD21 LEU 61 7.398 -6.930 0.422 486 HD22 LEU 61 HD22 LEU 61 9.159 -6.838 0.399 487 HD23 LEU 61 HD23 LEU 61 8.359 -8.358 0.800 488 H ASP 62 H ASP 62 8.594 -3.281 -2.219 489 HA ASP 62 HA ASP 62 7.967 -2.886 -4.937 490 HB2 ASP 62 HB2 ASP 62 7.009 -1.479 -3.195 491 HB3 ASP 62 HB1 ASP 62 8.605 -0.880 -2.764 492 H GLN 63 H GLN 63 10.912 -2.508 -3.104 493 HA GLN 63 HA GLN 63 12.251 -1.296 -5.412 494 HB2 GLN 63 HB2 GLN 63 12.541 -0.259 -3.167 495 HB3 GLN 63 HB1 GLN 63 13.327 -1.735 -2.627 496 HG2 GLN 63 HG2 GLN 63 15.029 -1.400 -4.418 497 HG3 GLN 63 HG1 GLN 63 14.290 0.164 -4.750 498 HE21 GLN 63 HE21 GLN 63 16.217 -1.687 -2.569 499 HE22 GLN 63 HE22 GLN 63 16.724 -0.371 -1.570 500 H GLN 64 H GLN 64 12.315 -4.155 -3.354 501 HA GLN 64 HA GLN 64 14.703 -5.216 -4.567 502 HB2 GLN 64 HB2 GLN 64 12.697 -6.681 -2.850 503 HB3 GLN 64 HB1 GLN 64 14.364 -7.138 -3.170 504 HG2 GLN 64 HG2 GLN 64 13.446 -4.747 -1.596 505 HG3 GLN 64 HG1 GLN 64 14.121 -6.233 -0.941 506 HE21 GLN 64 HE21 GLN 64 15.013 -3.495 -0.677 507 HE22 GLN 64 HE22 GLN 64 16.646 -3.459 -1.234 508 H SEP 65 H SEP 65 13.943 -7.938 -4.780 509 HA SEP 65 HA SEP 65 13.005 -7.976 -7.468 510 HB2 SEP 65 HB1 SEP 65 13.312 -10.411 -7.291 511 HB3 SEP 65 HB2 SEP 65 13.549 -10.249 -5.550 512 H ILE 66 H ILE 66 11.416 -9.996 -7.899 513 HA ILE 66 HA ILE 66 8.888 -9.208 -6.695 514 HB ILE 66 HB ILE 66 9.058 -9.412 -9.164 515 HG12 ILE 66 HG12 ILE 66 7.235 -11.520 -7.998 516 HG13 ILE 66 HG11 ILE 66 6.889 -9.796 -8.014 517 HG21 ILE 66 HG21 ILE 66 10.686 -11.190 -9.314 518 HG22 ILE 66 HG22 ILE 66 9.221 -11.629 -10.199 519 HG23 ILE 66 HG23 ILE 66 9.534 -12.329 -8.613 520 HD11 ILE 66 HD11 ILE 66 5.717 -10.944 -9.795 521 HD12 ILE 66 HD12 ILE 66 7.247 -11.553 -10.427 522 HD13 ILE 66 HD13 ILE 66 6.907 -9.821 -10.455 523 H VAL 67 H VAL 67 7.449 -10.742 -5.735 524 HA VAL 67 HA VAL 67 8.840 -12.744 -4.193 525 HB VAL 67 HB VAL 67 5.877 -12.136 -4.224 526 HG11 VAL 67 HG11 VAL 67 7.596 -13.475 -2.138 527 HG12 VAL 67 HG12 VAL 67 6.456 -14.284 -3.212 528 HG13 VAL 67 HG13 VAL 67 5.868 -13.145 -2.001 529 HG21 VAL 67 HG21 VAL 67 6.298 -10.718 -2.271 530 HG22 VAL 67 HG22 VAL 67 7.133 -10.117 -3.705 531 HG23 VAL 67 HG23 VAL 67 8.033 -10.982 -2.459 532 H HIS 68 H HIS 68 8.905 -14.869 -4.572 533 HA HIS 68 HA HIS 68 7.362 -15.921 -6.834 534 HB2 HIS 68 HB2 HIS 68 9.842 -16.944 -5.430 535 HB3 HIS 68 HB1 HIS 68 8.974 -17.866 -6.645 536 HD2 HIS 68 HD2 HIS 68 9.979 -14.058 -6.982 537 HE1 HIS 68 HE1 HIS 68 11.913 -16.345 -9.973 538 HE2 HIS 68 HE2 HIS 68 11.532 -14.016 -9.070 539 H ILE 69 H ILE 69 5.477 -16.766 -6.186 540 HA ILE 69 HA ILE 69 5.509 -18.414 -3.752 541 HB ILE 69 HB ILE 69 3.214 -16.817 -4.911 542 HG12 ILE 69 HG12 ILE 69 4.815 -16.592 -2.358 543 HG13 ILE 69 HG11 ILE 69 4.702 -15.416 -3.659 544 HG21 ILE 69 HG21 ILE 69 2.395 -18.954 -4.098 545 HG22 ILE 69 HG22 ILE 69 1.886 -17.650 -3.025 546 HG23 ILE 69 HG23 ILE 69 3.220 -18.706 -2.559 547 HD11 ILE 69 HD11 ILE 69 3.407 -14.693 -1.753 548 HD12 ILE 69 HD12 ILE 69 2.490 -16.201 -1.777 549 HD13 ILE 69 HD13 ILE 69 2.338 -15.058 -3.109 550 H VAL 70 H VAL 70 5.141 -20.494 -4.027 551 HA VAL 70 HA VAL 70 3.655 -21.352 -6.395 552 HB VAL 70 HB VAL 70 6.096 -21.499 -6.882 553 HG11 VAL 70 HG11 VAL 70 7.447 -23.227 -5.788 554 HG12 VAL 70 HG12 VAL 70 6.130 -23.520 -4.652 555 HG13 VAL 70 HG13 VAL 70 6.945 -21.958 -4.672 556 HG21 VAL 70 HG21 VAL 70 4.520 -22.977 -8.017 557 HG22 VAL 70 HG22 VAL 70 4.686 -24.163 -6.722 558 HG23 VAL 70 HG23 VAL 70 6.066 -23.782 -7.754 559 H GLN 71 H GLN 71 2.594 -23.343 -6.167 560 HA GLN 71 HA GLN 71 2.132 -24.103 -3.380 561 HB2 GLN 71 HB2 GLN 71 0.174 -23.457 -4.722 562 HB3 GLN 71 HB1 GLN 71 0.551 -24.718 -5.885 563 HG2 GLN 71 HG2 GLN 71 0.287 -26.367 -3.981 564 HG3 GLN 71 HG1 GLN 71 -0.392 -25.032 -3.050 565 HE21 GLN 71 HE21 GLN 71 -1.635 -23.867 -5.457 566 HE22 GLN 71 HE22 GLN 71 -3.014 -24.854 -5.788 567 H ARG 72 H ARG 72 2.563 -26.123 -2.635 568 HA ARG 72 HA ARG 72 3.639 -28.051 -4.567 569 HB2 ARG 72 HB2 ARG 72 5.247 -27.489 -2.810 570 HB3 ARG 72 HB1 ARG 72 4.061 -27.873 -1.573 571 HG2 ARG 72 HG2 ARG 72 5.686 -29.661 -1.802 572 HG3 ARG 72 HG1 ARG 72 4.076 -30.211 -2.262 573 HD2 ARG 72 HD2 ARG 72 4.735 -29.717 -4.657 574 HD3 ARG 72 HD1 ARG 72 6.383 -29.514 -4.066 575 HE ARG 72 HE ARG 72 5.549 -31.951 -3.111 576 HH11 ARG 72 HH11 ARG 72 5.998 -30.478 -6.259 577 HH12 ARG 72 HH12 ARG 72 6.265 -31.978 -7.072 578 HH21 ARG 72 HH21 ARG 72 5.908 -33.952 -4.184 579 HH22 ARG 72 HH22 ARG 72 6.211 -33.969 -5.886 580 HA PRO 73 HA PRO 73 -0.404 -29.830 -3.580 581 HB2 PRO 73 HB2 PRO 73 0.023 -31.366 -6.030 582 HB3 PRO 73 HB1 PRO 73 -1.258 -30.210 -5.653 583 HG2 PRO 73 HG2 PRO 73 0.689 -29.689 -7.458 584 HG3 PRO 73 HG1 PRO 73 -0.062 -28.424 -6.468 585 HD2 PRO 73 HD2 PRO 73 2.572 -29.800 -6.104 586 HD3 PRO 73 HD1 PRO 73 2.156 -28.083 -5.904 587 H TRP 74 H TRP 74 0.352 -31.035 -1.825 588 HA TRP 74 HA TRP 74 1.895 -33.387 -2.162 589 HB2 TRP 74 HB2 TRP 74 1.404 -33.876 0.171 590 HB3 TRP 74 HB1 TRP 74 1.803 -32.175 -0.008 591 HD1 TRP 74 HD1 TRP 74 -0.890 -30.840 -0.621 592 HE1 TRP 74 HE1 TRP 74 -2.844 -30.879 1.077 593 HE3 TRP 74 HE3 TRP 74 0.524 -34.891 2.142 594 HZ2 TRP 74 HZ2 TRP 74 -3.649 -32.425 3.290 595 HZ3 TRP 74 HZ3 TRP 74 -0.888 -35.584 4.032 596 HH2 TRP 74 HH2 TRP 74 -2.928 -34.374 4.592 597 H ARG 75 H ARG 75 -1.365 -32.610 -2.559 598 HA ARG 75 HA ARG 75 -2.021 -35.415 -3.101 599 HB2 ARG 75 HB2 ARG 75 -3.789 -33.212 -2.018 600 HB3 ARG 75 HB1 ARG 75 -4.423 -34.707 -2.683 601 HG2 ARG 75 HG2 ARG 75 -3.262 -35.970 -0.942 602 HG3 ARG 75 HG1 ARG 75 -2.625 -34.461 -0.279 603 HD2 ARG 75 HD2 ARG 75 -4.877 -33.678 0.167 604 HD3 ARG 75 HD1 ARG 75 -5.553 -35.129 -0.568 605 HE ARG 75 HE ARG 75 -4.055 -36.185 1.358 606 HH11 ARG 75 HH11 ARG 75 -6.296 -33.484 1.463 607 HH12 ARG 75 HH12 ARG 75 -6.747 -33.752 3.106 608 HH21 ARG 75 HH21 ARG 75 -4.653 -36.541 3.539 609 HH22 ARG 75 HH22 ARG 75 -5.804 -35.499 4.301 610 H LYS 76 H LYS 76 -1.628 -35.403 -5.263 611 HA LYS 76 HA LYS 76 -3.299 -33.604 -6.829 612 HB2 LYS 76 HB2 LYS 76 -1.389 -33.501 -8.548 613 HB3 LYS 76 HB1 LYS 76 -1.284 -32.486 -7.126 614 HG2 LYS 76 HG2 LYS 76 0.880 -33.332 -7.442 615 HG3 LYS 76 HG1 LYS 76 0.207 -34.288 -6.125 616 HD2 LYS 76 HD2 LYS 76 1.437 -35.696 -7.695 617 HD3 LYS 76 HD1 LYS 76 -0.276 -36.109 -7.696 618 HE2 LYS 76 HE2 LYS 76 0.728 -36.044 -9.964 619 HE3 LYS 76 HE1 LYS 76 -0.614 -34.922 -9.766 620 HZ1 LYS 76 HZ1 LYS 76 2.230 -34.108 -9.491 621 HZ2 LYS 76 HZ2 LYS 76 0.870 -33.107 -9.639 622 HZ3 LYS 76 HZ3 LYS 76 1.377 -34.033 -10.949 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 1.071 -0.967 0.449 2 H2 MET 1 HT2 MET 1 2.250 0.086 1.035 3 H3 MET 1 HT3 MET 1 2.614 -1.552 0.820 4 HA MET 1 HA MET 1 1.976 0.396 -1.304 5 HB2 MET 1 HB2 MET 1 4.262 0.222 -1.989 6 HB3 MET 1 HB1 MET 1 4.274 0.558 -0.270 7 HG2 MET 1 HG2 MET 1 4.652 -2.161 -1.505 8 HG3 MET 1 HG1 MET 1 5.952 -1.108 -0.951 9 HE1 MET 1 HE1 MET 1 6.012 -3.947 1.719 10 HE2 MET 1 HE2 MET 1 6.984 -2.951 0.636 11 HE3 MET 1 HE3 MET 1 5.785 -4.060 -0.027 12 H ILE 2 H ILE 2 2.706 -0.633 -3.468 13 HA ILE 2 HA ILE 2 1.365 -3.223 -3.605 14 HB ILE 2 HB ILE 2 2.020 -1.175 -5.737 15 HG12 ILE 2 HG12 ILE 2 -0.496 -1.342 -6.100 16 HG13 ILE 2 HG11 ILE 2 -0.562 -2.264 -4.604 17 HG21 ILE 2 HG21 ILE 2 2.437 -3.366 -6.691 18 HG22 ILE 2 HG22 ILE 2 0.971 -2.665 -7.378 19 HG23 ILE 2 HG23 ILE 2 0.855 -3.924 -6.149 20 HD11 ILE 2 HD11 ILE 2 -1.151 0.043 -4.222 21 HD12 ILE 2 HD12 ILE 2 0.382 0.577 -4.912 22 HD13 ILE 2 HD13 ILE 2 0.363 -0.341 -3.405 23 H VAL 3 H VAL 3 2.510 -5.018 -3.808 24 HA VAL 3 HA VAL 3 5.266 -4.811 -4.828 25 HB VAL 3 HB VAL 3 5.802 -6.860 -3.601 26 HG11 VAL 3 HG11 VAL 3 4.532 -4.737 -1.891 27 HG12 VAL 3 HG12 VAL 3 6.210 -4.814 -2.432 28 HG13 VAL 3 HG13 VAL 3 5.598 -6.004 -1.287 29 HG21 VAL 3 HG21 VAL 3 4.247 -7.853 -2.011 30 HG22 VAL 3 HG22 VAL 3 3.614 -7.940 -3.658 31 HG23 VAL 3 HG23 VAL 3 2.984 -6.735 -2.532 32 H PHE 4 H PHE 4 5.999 -6.866 -5.936 33 HA PHE 4 HA PHE 4 3.792 -7.813 -7.625 34 HB2 PHE 4 HB2 PHE 4 6.678 -7.256 -8.261 35 HB3 PHE 4 HB1 PHE 4 5.703 -8.302 -9.283 36 HD1 PHE 4 HD1 PHE 4 5.822 -4.880 -7.844 37 HD2 PHE 4 HD2 PHE 4 4.327 -7.408 -10.915 38 HE1 PHE 4 HE1 PHE 4 4.931 -2.912 -9.017 39 HE2 PHE 4 HE2 PHE 4 3.432 -5.445 -12.098 40 HZ PHE 4 HZ PHE 4 3.733 -3.193 -11.147 41 H VAL 5 H VAL 5 3.476 -9.947 -7.913 42 HA VAL 5 HA VAL 5 5.468 -11.764 -6.776 43 HB VAL 5 HB VAL 5 3.720 -13.158 -5.781 44 HG11 VAL 5 HG11 VAL 5 3.573 -10.316 -4.803 45 HG12 VAL 5 HG12 VAL 5 4.866 -11.453 -4.440 46 HG13 VAL 5 HG13 VAL 5 3.228 -11.770 -3.862 47 HG21 VAL 5 HG21 VAL 5 1.848 -10.927 -6.542 48 HG22 VAL 5 HG22 VAL 5 1.440 -12.310 -5.521 49 HG23 VAL 5 HG23 VAL 5 1.865 -12.558 -7.216 50 H ARG 6 H ARG 6 5.646 -13.703 -7.711 51 HA ARG 6 HA ARG 6 4.223 -14.093 -10.247 52 HB2 ARG 6 HB2 ARG 6 6.793 -15.287 -9.191 53 HB3 ARG 6 HB1 ARG 6 6.071 -15.693 -10.734 54 HG2 ARG 6 HG2 ARG 6 6.305 -13.337 -11.411 55 HG3 ARG 6 HG1 ARG 6 7.157 -13.042 -9.889 56 HD2 ARG 6 HD2 ARG 6 8.897 -14.578 -10.489 57 HD3 ARG 6 HD1 ARG 6 8.003 -15.110 -11.913 58 HE ARG 6 HE ARG 6 8.373 -12.395 -12.207 59 HH11 ARG 6 HH11 ARG 6 10.397 -15.242 -11.954 60 HH12 ARG 6 HH12 ARG 6 11.681 -14.569 -12.897 61 HH21 ARG 6 HH21 ARG 6 10.067 -11.508 -13.461 62 HH22 ARG 6 HH22 ARG 6 11.491 -12.442 -13.768 63 H PHE 7 H PHE 7 3.265 -16.117 -10.646 64 HA PHE 7 HA PHE 7 3.073 -17.864 -8.302 65 HB2 PHE 7 HB2 PHE 7 1.052 -16.317 -8.686 66 HB3 PHE 7 HB1 PHE 7 0.706 -17.324 -10.088 67 HD1 PHE 7 HD1 PHE 7 1.163 -17.391 -6.419 68 HD2 PHE 7 HD2 PHE 7 -0.409 -19.366 -9.837 69 HE1 PHE 7 HE1 PHE 7 -0.002 -18.984 -4.956 70 HE2 PHE 7 HE2 PHE 7 -1.576 -20.966 -8.380 71 HZ PHE 7 HZ PHE 7 -1.371 -20.776 -5.934 72 H ASN 8 H ASN 8 2.954 -20.033 -8.741 73 HA ASN 8 HA ASN 8 4.236 -20.932 -11.062 74 HB2 ASN 8 HB2 ASN 8 3.740 -23.202 -10.270 75 HB3 ASN 8 HB1 ASN 8 4.313 -22.175 -8.964 76 HD21 ASN 8 HD21 ASN 8 1.735 -24.063 -10.167 77 HD22 ASN 8 HD22 ASN 8 0.667 -23.872 -8.822 78 H SER 9 H SER 9 0.877 -20.365 -10.508 79 HA SER 9 HA SER 9 0.170 -21.871 -12.924 80 HB2 SER 9 HB2 SER 9 -1.696 -20.621 -10.907 81 HB3 SER 9 HB1 SER 9 -2.109 -21.779 -12.170 82 HG SER 9 HG SER 9 -0.641 -23.258 -11.064 83 H SER 10 H SER 10 1.370 -18.985 -12.529 84 HA SER 10 HA SER 10 -0.167 -17.810 -14.675 85 HB2 SER 10 HB2 SER 10 -1.406 -17.116 -12.615 86 HB3 SER 10 HB1 SER 10 0.067 -16.361 -12.015 87 HG SER 10 HG SER 10 -1.602 -15.593 -14.149 88 H HIS 11 H HIS 11 0.844 -15.267 -14.597 89 HA HIS 11 HA HIS 11 3.690 -15.728 -15.089 90 HB2 HIS 11 HB2 HIS 11 1.894 -13.385 -15.783 91 HB3 HIS 11 HB1 HIS 11 3.604 -13.480 -16.180 92 HD2 HIS 11 HD2 HIS 11 4.262 -15.320 -18.201 93 HE1 HIS 11 HE1 HIS 11 0.254 -15.821 -19.459 94 HE2 HIS 11 HE2 HIS 11 2.681 -16.076 -20.115 95 H GLY 12 H GLY 12 1.935 -12.889 -13.928 96 HA2 GLY 12 HA2 GLY 12 3.006 -12.882 -11.322 97 HA3 GLY 12 HA1 GLY 12 3.966 -11.837 -12.364 98 H PHE 13 H PHE 13 2.012 -11.338 -10.090 99 HA PHE 13 HA PHE 13 0.545 -9.241 -11.485 100 HB2 PHE 13 HB2 PHE 13 -1.519 -9.757 -10.175 101 HB3 PHE 13 HB1 PHE 13 -1.100 -10.983 -11.361 102 HD1 PHE 13 HD1 PHE 13 -1.674 -10.263 -7.873 103 HD2 PHE 13 HD2 PHE 13 -0.092 -13.134 -10.586 104 HE1 PHE 13 HE1 PHE 13 -1.815 -11.989 -6.128 105 HE2 PHE 13 HE2 PHE 13 -0.231 -14.858 -8.848 106 HZ PHE 13 HZ PHE 13 -1.092 -14.292 -6.617 107 HA PRO 14 HA PRO 14 1.747 -6.881 -7.948 108 HB2 PRO 14 HB2 PRO 14 0.124 -4.757 -8.205 109 HB3 PRO 14 HB1 PRO 14 1.421 -5.076 -9.363 110 HG2 PRO 14 HG2 PRO 14 -1.509 -5.616 -9.604 111 HG3 PRO 14 HG1 PRO 14 -0.381 -4.990 -10.820 112 HD2 PRO 14 HD2 PRO 14 -1.209 -7.610 -10.676 113 HD3 PRO 14 HD1 PRO 14 0.313 -7.082 -11.419 114 H VAL 15 H VAL 15 1.234 -6.755 -5.833 115 HA VAL 15 HA VAL 15 -1.561 -7.238 -5.033 116 HB VAL 15 HB VAL 15 0.911 -8.277 -3.616 117 HG11 VAL 15 HG11 VAL 15 -2.015 -8.714 -3.015 118 HG12 VAL 15 HG12 VAL 15 -0.899 -7.726 -2.071 119 HG13 VAL 15 HG13 VAL 15 -0.663 -9.471 -2.171 120 HG21 VAL 15 HG21 VAL 15 0.137 -10.499 -4.276 121 HG22 VAL 15 HG22 VAL 15 0.466 -9.492 -5.688 122 HG23 VAL 15 HG23 VAL 15 -1.198 -9.772 -5.173 123 H GLU 16 H GLU 16 -2.382 -5.742 -3.765 124 HA GLU 16 HA GLU 16 -0.746 -3.581 -2.769 125 HB2 GLU 16 HB2 GLU 16 -2.910 -3.159 -3.846 126 HB3 GLU 16 HB1 GLU 16 -3.718 -4.093 -2.600 127 HG2 GLU 16 HG2 GLU 16 -3.026 -2.457 -0.933 128 HG3 GLU 16 HG1 GLU 16 -2.208 -1.529 -2.192 129 H VAL 17 H VAL 17 0.217 -3.720 -0.836 130 HA VAL 17 HA VAL 17 -1.187 -5.169 1.312 131 HB VAL 17 HB VAL 17 0.918 -5.948 2.210 132 HG11 VAL 17 HG11 VAL 17 1.661 -7.446 0.382 133 HG12 VAL 17 HG12 VAL 17 0.630 -6.537 -0.723 134 HG13 VAL 17 HG13 VAL 17 -0.086 -7.421 0.626 135 HG21 VAL 17 HG21 VAL 17 3.047 -5.612 1.014 136 HG22 VAL 17 HG22 VAL 17 2.359 -4.098 1.601 137 HG23 VAL 17 HG23 VAL 17 2.227 -4.523 -0.107 138 H ASP 18 H ASP 18 -0.129 -4.556 3.508 139 HA ASP 18 HA ASP 18 0.084 -1.625 3.574 140 HB2 ASP 18 HB2 ASP 18 -0.843 -3.593 5.679 141 HB3 ASP 18 HB1 ASP 18 -0.567 -1.884 5.994 142 H SER 19 H SER 19 1.319 -0.951 5.689 143 HA SER 19 HA SER 19 3.983 -1.836 5.345 144 HB2 SER 19 HB2 SER 19 4.390 -0.350 7.369 145 HB3 SER 19 HB1 SER 19 3.670 0.432 5.963 146 HG SER 19 HG SER 19 2.744 0.452 8.381 147 H ASP 20 H ASP 20 1.455 -2.574 7.640 148 HA ASP 20 HA ASP 20 3.311 -4.122 9.277 149 HB2 ASP 20 HB2 ASP 20 0.453 -3.288 9.753 150 HB3 ASP 20 HB1 ASP 20 1.368 -4.321 10.847 151 H THR 21 H THR 21 1.867 -4.850 6.559 152 HA THR 21 HA THR 21 0.323 -7.136 7.181 153 HB THR 21 HB THR 21 1.819 -6.463 4.635 154 HG1 THR 21 HG1 THR 21 -0.781 -5.901 5.611 155 HG21 THR 21 HG21 THR 21 0.273 -8.037 3.548 156 HG22 THR 21 HG22 THR 21 -0.416 -8.449 5.119 157 HG23 THR 21 HG23 THR 21 1.263 -8.853 4.758 158 H SER 22 H SER 22 1.042 -8.918 8.115 159 HA SER 22 HA SER 22 3.808 -9.564 8.289 160 HB2 SER 22 HB2 SER 22 2.115 -10.153 10.036 161 HB3 SER 22 HB1 SER 22 1.419 -11.321 8.915 162 HG SER 22 HG SER 22 4.041 -11.328 9.998 163 H ILE 23 H ILE 23 4.890 -11.369 7.367 164 HA ILE 23 HA ILE 23 4.388 -11.763 4.635 165 HB ILE 23 HB ILE 23 6.127 -13.367 6.514 166 HG12 ILE 23 HG12 ILE 23 6.769 -11.017 6.331 167 HG13 ILE 23 HG11 ILE 23 7.970 -12.053 5.573 168 HG21 ILE 23 HG21 ILE 23 6.133 -13.374 3.489 169 HG22 ILE 23 HG22 ILE 23 5.594 -14.699 4.519 170 HG23 ILE 23 HG23 ILE 23 7.289 -14.211 4.522 171 HD11 ILE 23 HD11 ILE 23 7.622 -10.107 4.223 172 HD12 ILE 23 HD12 ILE 23 5.884 -10.391 4.183 173 HD13 ILE 23 HD13 ILE 23 6.979 -11.512 3.372 174 H PHE 24 H PHE 24 3.573 -13.788 7.442 175 HA PHE 24 HA PHE 24 2.521 -15.979 5.959 176 HB2 PHE 24 HB2 PHE 24 3.058 -16.007 8.431 177 HB3 PHE 24 HB1 PHE 24 1.603 -15.053 8.686 178 HD1 PHE 24 HD1 PHE 24 2.824 -18.283 7.345 179 HD2 PHE 24 HD2 PHE 24 -0.489 -16.084 8.858 180 HE1 PHE 24 HE1 PHE 24 1.495 -20.347 7.418 181 HE2 PHE 24 HE2 PHE 24 -1.827 -18.148 8.936 182 HZ PHE 24 HZ PHE 24 -0.835 -20.284 8.214 183 H GLN 25 H GLN 25 1.110 -13.007 7.182 184 HA GLN 25 HA GLN 25 -1.538 -13.565 6.380 185 HB2 GLN 25 HB2 GLN 25 -0.131 -10.934 6.850 186 HB3 GLN 25 HB1 GLN 25 -1.859 -11.095 6.579 187 HG2 GLN 25 HG2 GLN 25 -0.314 -12.296 8.866 188 HG3 GLN 25 HG1 GLN 25 -1.337 -10.863 8.945 189 HE21 GLN 25 HE21 GLN 25 -3.569 -11.107 8.793 190 HE22 GLN 25 HE22 GLN 25 -4.339 -12.628 9.064 191 H LEU 26 H LEU 26 1.185 -11.959 4.831 192 HA LEU 26 HA LEU 26 -0.098 -11.100 2.500 193 HB2 LEU 26 HB2 LEU 26 2.086 -10.306 2.985 194 HB3 LEU 26 HB1 LEU 26 2.742 -11.929 3.049 195 HG LEU 26 HG LEU 26 2.432 -12.154 0.624 196 HD11 LEU 26 HD11 LEU 26 1.453 -9.317 0.789 197 HD12 LEU 26 HD12 LEU 26 0.531 -10.730 0.277 198 HD13 LEU 26 HD13 LEU 26 1.876 -10.149 -0.705 199 HD21 LEU 26 HD21 LEU 26 3.944 -9.689 1.461 200 HD22 LEU 26 HD22 LEU 26 4.165 -10.557 -0.058 201 HD23 LEU 26 HD23 LEU 26 4.554 -11.344 1.472 202 H LYS 27 H LYS 27 1.623 -14.135 3.170 203 HA LYS 27 HA LYS 27 1.170 -15.331 0.671 204 HB2 LYS 27 HB2 LYS 27 2.777 -16.169 2.389 205 HB3 LYS 27 HB1 LYS 27 1.413 -16.719 3.352 206 HG2 LYS 27 HG2 LYS 27 0.762 -18.264 1.619 207 HG3 LYS 27 HG1 LYS 27 2.048 -17.670 0.569 208 HD2 LYS 27 HD2 LYS 27 2.843 -19.686 1.510 209 HD3 LYS 27 HD1 LYS 27 3.667 -18.390 2.375 210 HE2 LYS 27 HE2 LYS 27 2.202 -18.635 4.258 211 HE3 LYS 27 HE1 LYS 27 1.180 -19.768 3.373 212 HZ1 LYS 27 HZ1 LYS 27 3.078 -21.292 3.276 213 HZ2 LYS 27 HZ2 LYS 27 2.616 -20.959 4.866 214 HZ3 LYS 27 HZ3 LYS 27 3.990 -20.225 4.219 215 H GLU 28 H GLU 28 -0.725 -15.184 3.601 216 HA GLU 28 HA GLU 28 -2.781 -16.962 2.888 217 HB2 GLU 28 HB2 GLU 28 -2.055 -15.464 5.090 218 HB3 GLU 28 HB1 GLU 28 -3.539 -14.696 4.562 219 HG2 GLU 28 HG2 GLU 28 -3.406 -17.644 4.911 220 HG3 GLU 28 HG1 GLU 28 -3.613 -16.587 6.298 221 H VAL 29 H VAL 29 -2.401 -13.444 2.521 222 HA VAL 29 HA VAL 29 -4.904 -12.875 1.390 223 HB VAL 29 HB VAL 29 -2.262 -11.450 0.975 224 HG11 VAL 29 HG11 VAL 29 -3.597 -9.528 0.232 225 HG12 VAL 29 HG12 VAL 29 -5.059 -10.508 0.332 226 HG13 VAL 29 HG13 VAL 29 -3.805 -10.914 -0.840 227 HG21 VAL 29 HG21 VAL 29 -4.579 -10.851 2.816 228 HG22 VAL 29 HG22 VAL 29 -3.136 -9.854 2.618 229 HG23 VAL 29 HG23 VAL 29 -3.001 -11.476 3.296 230 H VAL 30 H VAL 30 -1.806 -13.603 -0.178 231 HA VAL 30 HA VAL 30 -2.808 -13.450 -2.815 232 HB VAL 30 HB VAL 30 -0.449 -15.062 -1.806 233 HG11 VAL 30 HG11 VAL 30 -1.149 -14.120 -4.585 234 HG12 VAL 30 HG12 VAL 30 -1.169 -15.789 -4.015 235 HG13 VAL 30 HG13 VAL 30 0.359 -14.914 -4.127 236 HG21 VAL 30 HG21 VAL 30 -0.234 -12.701 -1.246 237 HG22 VAL 30 HG22 VAL 30 -0.580 -12.259 -2.916 238 HG23 VAL 30 HG23 VAL 30 0.898 -13.135 -2.525 239 H ALA 31 H ALA 31 -2.615 -16.063 -0.477 240 HA ALA 31 HA ALA 31 -3.269 -18.204 -2.138 241 HB1 ALA 31 HB1 ALA 31 -3.943 -19.364 -0.119 242 HB2 ALA 31 HB2 ALA 31 -3.988 -17.836 0.760 243 HB3 ALA 31 HB3 ALA 31 -2.454 -18.459 0.153 244 H LYS 32 H LYS 32 -5.446 -16.278 -0.059 245 HA LYS 32 HA LYS 32 -7.795 -17.491 -1.075 246 HB2 LYS 32 HB2 LYS 32 -8.989 -15.560 -0.024 247 HB3 LYS 32 HB1 LYS 32 -7.923 -16.438 1.060 248 HG2 LYS 32 HG2 LYS 32 -6.299 -14.707 0.996 249 HG3 LYS 32 HG1 LYS 32 -7.142 -13.884 -0.318 250 HD2 LYS 32 HD2 LYS 32 -8.973 -13.349 1.098 251 HD3 LYS 32 HD1 LYS 32 -8.342 -14.357 2.402 252 HE2 LYS 32 HE2 LYS 32 -6.408 -12.864 2.604 253 HE3 LYS 32 HE1 LYS 32 -7.046 -11.860 1.299 254 HZ1 LYS 32 HZ1 LYS 32 -8.348 -12.344 3.922 255 HZ2 LYS 32 HZ2 LYS 32 -8.977 -11.389 2.684 256 HZ3 LYS 32 HZ3 LYS 32 -7.550 -10.927 3.464 257 H ARG 33 H ARG 33 -5.884 -14.783 -2.119 258 HA ARG 33 HA ARG 33 -7.735 -13.534 -3.820 259 HB2 ARG 33 HB2 ARG 33 -5.289 -12.881 -3.004 260 HB3 ARG 33 HB1 ARG 33 -4.824 -13.633 -4.523 261 HG2 ARG 33 HG2 ARG 33 -6.796 -11.362 -4.289 262 HG3 ARG 33 HG1 ARG 33 -5.077 -11.159 -4.621 263 HD2 ARG 33 HD2 ARG 33 -5.329 -12.509 -6.655 264 HD3 ARG 33 HD1 ARG 33 -7.053 -12.674 -6.323 265 HE ARG 33 HE ARG 33 -6.024 -9.963 -6.521 266 HH11 ARG 33 HH11 ARG 33 -7.669 -12.619 -8.154 267 HH12 ARG 33 HH12 ARG 33 -8.359 -11.598 -9.367 268 HH21 ARG 33 HH21 ARG 33 -6.931 -8.634 -8.143 269 HH22 ARG 33 HH22 ARG 33 -7.941 -9.334 -9.363 270 H GLN 34 H GLN 34 -5.272 -16.011 -4.410 271 HA GLN 34 HA GLN 34 -6.059 -16.402 -7.166 272 HB2 GLN 34 HB2 GLN 34 -4.108 -17.852 -5.377 273 HB3 GLN 34 HB1 GLN 34 -4.352 -18.230 -7.075 274 HG2 GLN 34 HG2 GLN 34 -3.569 -15.493 -6.149 275 HG3 GLN 34 HG1 GLN 34 -2.376 -16.745 -6.472 276 HE21 GLN 34 HE21 GLN 34 -4.733 -14.609 -7.840 277 HE22 GLN 34 HE22 GLN 34 -4.263 -14.804 -9.486 278 H GLY 35 H GLY 35 -7.034 -17.558 -4.142 279 HA2 GLY 35 HA2 GLY 35 -8.737 -19.023 -3.619 280 HA3 GLY 35 HA1 GLY 35 -8.899 -19.390 -5.330 281 H VAL 36 H VAL 36 -5.994 -19.608 -3.397 282 HA VAL 36 HA VAL 36 -5.986 -22.511 -3.863 283 HB VAL 36 HB VAL 36 -3.551 -22.430 -4.005 284 HG11 VAL 36 HG11 VAL 36 -4.844 -20.420 -5.843 285 HG12 VAL 36 HG12 VAL 36 -4.823 -22.168 -6.065 286 HG13 VAL 36 HG13 VAL 36 -3.319 -21.253 -6.138 287 HG21 VAL 36 HG21 VAL 36 -3.823 -19.435 -3.728 288 HG22 VAL 36 HG22 VAL 36 -2.325 -20.313 -4.036 289 HG23 VAL 36 HG23 VAL 36 -3.171 -20.520 -2.501 290 HA PRO 37 HA PRO 37 -5.412 -23.050 0.488 291 HB2 PRO 37 HB2 PRO 37 -3.433 -25.150 0.150 292 HB3 PRO 37 HB1 PRO 37 -5.124 -25.290 0.636 293 HG2 PRO 37 HG2 PRO 37 -4.187 -26.190 -1.756 294 HG3 PRO 37 HG1 PRO 37 -5.847 -25.628 -1.512 295 HD2 PRO 37 HD2 PRO 37 -3.521 -24.199 -2.723 296 HD3 PRO 37 HD1 PRO 37 -5.222 -24.228 -3.236 297 H ALA 38 H ALA 38 -4.342 -21.645 1.717 298 HA ALA 38 HA ALA 38 -1.696 -20.753 1.176 299 HB1 ALA 38 HB1 ALA 38 -3.356 -20.394 3.679 300 HB2 ALA 38 HB2 ALA 38 -3.364 -19.329 2.273 301 HB3 ALA 38 HB3 ALA 38 -1.909 -19.478 3.255 302 H ASP 39 H ASP 39 -3.014 -23.359 2.976 303 HA ASP 39 HA ASP 39 -1.128 -23.848 4.951 304 HB2 ASP 39 HB2 ASP 39 -2.574 -25.922 3.293 305 HB3 ASP 39 HB1 ASP 39 -1.816 -26.194 4.853 306 H GLN 40 H GLN 40 -1.170 -25.115 1.636 307 HA GLN 40 HA GLN 40 1.619 -25.949 2.007 308 HB2 GLN 40 HB2 GLN 40 -0.438 -26.897 0.010 309 HB3 GLN 40 HB1 GLN 40 1.232 -27.443 0.065 310 HG2 GLN 40 HG2 GLN 40 -0.875 -27.845 2.176 311 HG3 GLN 40 HG1 GLN 40 -0.176 -29.073 1.121 312 HE21 GLN 40 HE21 GLN 40 -0.257 -28.928 4.033 313 HE22 GLN 40 HE22 GLN 40 1.384 -28.991 4.565 314 H LEU 41 H LEU 41 0.822 -23.242 1.428 315 HA LEU 41 HA LEU 41 1.754 -22.886 -1.314 316 HB2 LEU 41 HB2 LEU 41 -0.253 -21.641 -0.462 317 HB3 LEU 41 HB1 LEU 41 0.802 -20.804 0.658 318 HG LEU 41 HG LEU 41 2.016 -19.797 -1.224 319 HD11 LEU 41 HD11 LEU 41 1.730 -21.537 -2.876 320 HD12 LEU 41 HD12 LEU 41 1.091 -20.015 -3.496 321 HD13 LEU 41 HD13 LEU 41 -0.011 -21.258 -2.905 322 HD21 LEU 41 HD21 LEU 41 0.095 -18.626 -0.257 323 HD22 LEU 41 HD22 LEU 41 -0.974 -19.436 -1.401 324 HD23 LEU 41 HD23 LEU 41 0.245 -18.303 -1.983 325 H ARG 42 H ARG 42 3.771 -22.200 -1.769 326 HA ARG 42 HA ARG 42 5.496 -21.528 0.518 327 HB2 ARG 42 HB2 ARG 42 6.047 -23.704 -0.434 328 HB3 ARG 42 HB1 ARG 42 6.176 -22.999 -2.034 329 HG2 ARG 42 HG2 ARG 42 8.370 -23.443 -1.074 330 HG3 ARG 42 HG1 ARG 42 8.122 -21.716 -1.337 331 HD2 ARG 42 HD2 ARG 42 9.210 -22.264 0.835 332 HD3 ARG 42 HD1 ARG 42 7.711 -21.353 0.994 333 HE ARG 42 HE ARG 42 6.721 -23.722 1.362 334 HH11 ARG 42 HH11 ARG 42 9.936 -22.730 2.457 335 HH12 ARG 42 HH12 ARG 42 9.865 -23.719 3.871 336 HH21 ARG 42 HH21 ARG 42 6.679 -25.013 3.251 337 HH22 ARG 42 HH22 ARG 42 8.041 -25.004 4.329 338 H VAL 43 H VAL 43 6.289 -19.547 0.510 339 HA VAL 43 HA VAL 43 6.343 -18.068 -2.008 340 HB VAL 43 HB VAL 43 6.645 -16.027 -0.565 341 HG11 VAL 43 HG11 VAL 43 4.321 -15.942 0.198 342 HG12 VAL 43 HG12 VAL 43 4.197 -17.691 0.004 343 HG13 VAL 43 HG13 VAL 43 4.447 -16.665 -1.406 344 HG21 VAL 43 HG21 VAL 43 6.145 -16.200 1.833 345 HG22 VAL 43 HG22 VAL 43 7.595 -17.113 1.416 346 HG23 VAL 43 HG23 VAL 43 6.070 -17.956 1.693 347 H ILE 44 H ILE 44 8.204 -17.825 -3.032 348 HA ILE 44 HA ILE 44 10.679 -18.090 -1.465 349 HB ILE 44 HB ILE 44 10.207 -18.839 -4.359 350 HG12 ILE 44 HG12 ILE 44 9.237 -20.444 -2.778 351 HG13 ILE 44 HG11 ILE 44 10.622 -21.137 -3.612 352 HG21 ILE 44 HG21 ILE 44 12.713 -19.031 -2.690 353 HG22 ILE 44 HG22 ILE 44 12.449 -17.960 -4.066 354 HG23 ILE 44 HG23 ILE 44 12.511 -19.707 -4.306 355 HD11 ILE 44 HD11 ILE 44 12.009 -20.707 -1.634 356 HD12 ILE 44 HD12 ILE 44 10.635 -21.750 -1.273 357 HD13 ILE 44 HD13 ILE 44 10.598 -20.053 -0.801 358 H PHE 45 H PHE 45 12.011 -16.473 -1.463 359 HA PHE 45 HA PHE 45 11.913 -14.469 -3.592 360 HB2 PHE 45 HB2 PHE 45 10.668 -13.534 -1.728 361 HB3 PHE 45 HB1 PHE 45 11.955 -13.966 -0.608 362 HD1 PHE 45 HD1 PHE 45 11.123 -11.798 -3.486 363 HD2 PHE 45 HD2 PHE 45 13.747 -12.513 -0.209 364 HE1 PHE 45 HE1 PHE 45 12.144 -9.589 -3.824 365 HE2 PHE 45 HE2 PHE 45 14.770 -10.304 -0.546 366 HZ PHE 45 HZ PHE 45 13.970 -8.842 -2.353 367 H ALA 46 H ALA 46 13.861 -14.267 -4.463 368 HA ALA 46 HA ALA 46 16.099 -14.261 -4.792 369 HB1 ALA 46 HB1 ALA 46 16.284 -13.894 -1.801 370 HB2 ALA 46 HB2 ALA 46 16.101 -12.598 -2.986 371 HB3 ALA 46 HB3 ALA 46 17.568 -13.580 -2.970 372 H GLY 47 H GLY 47 14.591 -16.789 -3.834 373 HA2 GLY 47 HA2 GLY 47 15.487 -18.971 -4.235 374 HA3 GLY 47 HA1 GLY 47 17.037 -18.409 -3.632 375 H LYS 48 H LYS 48 14.867 -17.192 -1.511 376 HA LYS 48 HA LYS 48 14.779 -19.634 0.136 377 HB2 LYS 48 HB2 LYS 48 15.320 -18.258 2.119 378 HB3 LYS 48 HB1 LYS 48 16.642 -18.347 0.966 379 HG2 LYS 48 HG2 LYS 48 16.498 -16.141 0.414 380 HG3 LYS 48 HG1 LYS 48 14.767 -16.058 0.749 381 HD2 LYS 48 HD2 LYS 48 15.122 -16.002 3.070 382 HD3 LYS 48 HD1 LYS 48 16.836 -16.409 2.903 383 HE2 LYS 48 HE2 LYS 48 17.144 -14.243 1.680 384 HE3 LYS 48 HE1 LYS 48 15.466 -13.851 2.053 385 HZ1 LYS 48 HZ1 LYS 48 17.599 -14.352 4.061 386 HZ2 LYS 48 HZ2 LYS 48 15.998 -13.932 4.403 387 HZ3 LYS 48 HZ3 LYS 48 17.011 -12.830 3.619 388 H GLU 49 H GLU 49 13.290 -19.287 2.062 389 HA GLU 49 HA GLU 49 10.948 -17.809 1.125 390 HB2 GLU 49 HB2 GLU 49 9.700 -19.118 2.885 391 HB3 GLU 49 HB1 GLU 49 10.354 -20.070 1.565 392 HG2 GLU 49 HG2 GLU 49 11.797 -19.779 4.177 393 HG3 GLU 49 HG1 GLU 49 10.552 -21.002 3.922 394 H LEU 50 H LEU 50 10.078 -16.198 2.250 395 HA LEU 50 HA LEU 50 11.737 -14.813 4.087 396 HB2 LEU 50 HB2 LEU 50 8.858 -14.296 3.390 397 HB3 LEU 50 HB1 LEU 50 9.936 -13.182 4.205 398 HG LEU 50 HG LEU 50 10.143 -14.137 1.369 399 HD11 LEU 50 HD11 LEU 50 8.357 -12.534 1.753 400 HD12 LEU 50 HD12 LEU 50 9.664 -11.833 0.801 401 HD13 LEU 50 HD13 LEU 50 9.506 -11.430 2.512 402 HD21 LEU 50 HD21 LEU 50 12.369 -13.831 2.277 403 HD22 LEU 50 HD22 LEU 50 11.912 -12.262 2.937 404 HD23 LEU 50 HD23 LEU 50 11.991 -12.493 1.190 405 H ARG 51 H ARG 51 11.293 -14.228 6.190 406 HA ARG 51 HA ARG 51 10.261 -16.215 7.886 407 HB2 ARG 51 HB2 ARG 51 10.525 -14.380 9.638 408 HB3 ARG 51 HB1 ARG 51 11.972 -14.815 8.740 409 HG2 ARG 51 HG2 ARG 51 11.073 -12.813 7.194 410 HG3 ARG 51 HG1 ARG 51 10.426 -12.311 8.752 411 HD2 ARG 51 HD2 ARG 51 13.306 -12.966 8.165 412 HD3 ARG 51 HD1 ARG 51 12.633 -11.347 8.328 413 HE ARG 51 HE ARG 51 12.073 -12.873 10.640 414 HH11 ARG 51 HH11 ARG 51 14.743 -11.262 9.035 415 HH12 ARG 51 HH12 ARG 51 15.584 -10.919 10.507 416 HH21 ARG 51 HH21 ARG 51 13.196 -12.457 12.579 417 HH22 ARG 51 HH22 ARG 51 14.709 -11.619 12.538 418 H ASN 52 H ASN 52 8.197 -16.719 8.019 419 HA ASN 52 HA ASN 52 6.119 -15.114 6.981 420 HB2 ASN 52 HB2 ASN 52 4.641 -16.890 7.494 421 HB3 ASN 52 HB1 ASN 52 6.168 -17.639 7.057 422 HD21 ASN 52 HD21 ASN 52 7.405 -18.639 8.676 423 HD22 ASN 52 HD22 ASN 52 6.724 -19.073 10.200 424 H ASP 53 H ASP 53 7.523 -15.248 10.091 425 HA ASP 53 HA ASP 53 5.136 -14.265 11.426 426 HB2 ASP 53 HB2 ASP 53 6.280 -14.598 13.474 427 HB3 ASP 53 HB1 ASP 53 6.694 -15.969 12.455 428 H TRP 54 H TRP 54 7.255 -12.746 9.520 429 HA TRP 54 HA TRP 54 7.357 -10.384 11.265 430 HB2 TRP 54 HB2 TRP 54 9.586 -11.404 10.603 431 HB3 TRP 54 HB1 TRP 54 9.219 -10.901 8.954 432 HD1 TRP 54 HD1 TRP 54 10.778 -8.920 8.494 433 HE1 TRP 54 HE1 TRP 54 11.299 -6.689 9.673 434 HE3 TRP 54 HE3 TRP 54 8.135 -9.623 12.826 435 HZ2 TRP 54 HZ2 TRP 54 10.662 -5.408 12.081 436 HZ3 TRP 54 HZ3 TRP 54 8.149 -7.839 14.507 437 HH2 TRP 54 HH2 TRP 54 9.391 -5.775 14.142 438 H THR 55 H THR 55 7.715 -8.305 9.760 439 HA THR 55 HA THR 55 5.241 -8.073 8.303 440 HB THR 55 HB THR 55 5.790 -5.656 8.244 441 HG1 THR 55 HG1 THR 55 7.696 -4.922 9.061 442 HG21 THR 55 HG21 THR 55 5.622 -5.248 10.630 443 HG22 THR 55 HG22 THR 55 6.213 -6.869 10.977 444 HG23 THR 55 HG23 THR 55 4.637 -6.650 10.207 445 H VAL 56 H VAL 56 5.153 -6.954 6.216 446 HA VAL 56 HA VAL 56 7.089 -8.112 4.412 447 HB VAL 56 HB VAL 56 4.685 -8.357 3.937 448 HG11 VAL 56 HG11 VAL 56 3.880 -6.239 4.805 449 HG12 VAL 56 HG12 VAL 56 3.367 -6.467 3.133 450 HG13 VAL 56 HG13 VAL 56 4.702 -5.377 3.505 451 HG21 VAL 56 HG21 VAL 56 6.179 -6.737 1.883 452 HG22 VAL 56 HG22 VAL 56 4.754 -7.725 1.563 453 HG23 VAL 56 HG23 VAL 56 6.256 -8.485 2.095 454 H GLN 57 H GLN 57 6.070 -4.848 5.385 455 HA GLN 57 HA GLN 57 7.461 -3.624 3.235 456 HB2 GLN 57 HB2 GLN 57 5.558 -2.522 4.316 457 HB3 GLN 57 HB1 GLN 57 6.509 -2.325 5.784 458 HG2 GLN 57 HG2 GLN 57 8.015 -0.835 4.697 459 HG3 GLN 57 HG1 GLN 57 7.312 -1.183 3.121 460 HE21 GLN 57 HE21 GLN 57 5.353 -0.268 2.567 461 HE22 GLN 57 HE22 GLN 57 4.665 1.049 3.450 462 H ASN 58 H ASN 58 8.369 -4.462 6.509 463 HA ASN 58 HA ASN 58 10.779 -2.965 6.528 464 HB2 ASN 58 HB2 ASN 58 9.715 -3.905 8.583 465 HB3 ASN 58 HB1 ASN 58 10.183 -5.516 8.050 466 HD21 ASN 58 HD21 ASN 58 12.164 -2.616 7.705 467 HD22 ASN 58 HD22 ASN 58 13.395 -3.115 8.809 468 H CYS 59 H CYS 59 9.835 -5.794 4.894 469 HA CYS 59 HA CYS 59 12.549 -6.737 4.502 470 HB2 CYS 59 HB2 CYS 59 10.686 -8.356 4.763 471 HB3 CYS 59 HB1 CYS 59 9.955 -7.732 3.289 472 HG CYS 59 HG CYS 59 12.629 -8.416 2.014 473 H ASP 60 H ASP 60 10.383 -4.537 3.099 474 HA ASP 60 HA ASP 60 10.412 -3.204 1.259 475 HB2 ASP 60 HB2 ASP 60 13.348 -3.861 1.486 476 HB3 ASP 60 HB1 ASP 60 12.729 -2.735 0.285 477 H LEU 61 H LEU 61 9.458 -5.659 0.604 478 HA LEU 61 HA LEU 61 10.696 -7.135 -1.372 479 HB2 LEU 61 HB2 LEU 61 7.810 -6.609 -0.787 480 HB3 LEU 61 HB1 LEU 61 8.242 -7.507 -2.223 481 HG LEU 61 HG LEU 61 7.695 -9.062 -0.498 482 HD11 LEU 61 HD11 LEU 61 10.693 -8.999 -0.721 483 HD12 LEU 61 HD12 LEU 61 9.609 -9.572 -1.986 484 HD13 LEU 61 HD13 LEU 61 9.666 -10.401 -0.433 485 HD21 LEU 61 HD21 LEU 61 8.055 -7.596 1.426 486 HD22 LEU 61 HD22 LEU 61 9.798 -7.721 1.188 487 HD23 LEU 61 HD23 LEU 61 8.862 -9.151 1.628 488 H ASP 62 H ASP 62 8.434 -4.443 -1.972 489 HA ASP 62 HA ASP 62 8.666 -4.540 -4.762 490 HB2 ASP 62 HB2 ASP 62 6.791 -3.423 -3.692 491 HB3 ASP 62 HB1 ASP 62 7.871 -2.218 -3.001 492 H GLN 63 H GLN 63 10.700 -3.128 -2.382 493 HA GLN 63 HA GLN 63 12.140 -1.510 -4.336 494 HB2 GLN 63 HB2 GLN 63 12.202 -1.728 -1.340 495 HB3 GLN 63 HB1 GLN 63 13.531 -0.970 -2.199 496 HG2 GLN 63 HG2 GLN 63 11.877 0.637 -1.304 497 HG3 GLN 63 HG1 GLN 63 12.079 0.748 -3.047 498 HE21 GLN 63 HE21 GLN 63 10.381 0.270 -4.368 499 HE22 GLN 63 HE22 GLN 63 8.774 -0.020 -3.804 500 H GLN 64 H GLN 64 12.126 -4.634 -3.855 501 HA GLN 64 HA GLN 64 15.049 -4.877 -4.040 502 HB2 GLN 64 HB2 GLN 64 13.165 -6.646 -2.499 503 HB3 GLN 64 HB1 GLN 64 14.786 -7.148 -2.958 504 HG2 GLN 64 HG2 GLN 64 14.095 -4.781 -1.240 505 HG3 GLN 64 HG1 GLN 64 14.715 -6.333 -0.674 506 HE21 GLN 64 HE21 GLN 64 15.814 -3.629 -0.463 507 HE22 GLN 64 HE22 GLN 64 17.390 -3.722 -1.163 508 H SEP 65 H SEP 65 12.271 -7.087 -4.429 509 HA SEP 65 HA SEP 65 12.799 -7.475 -7.208 510 HB2 SEP 65 HB1 SEP 65 13.622 -9.634 -5.241 511 HB3 SEP 65 HB2 SEP 65 14.691 -8.733 -6.307 512 H ILE 66 H ILE 66 11.562 -9.649 -7.857 513 HA ILE 66 HA ILE 66 8.885 -9.296 -6.761 514 HB ILE 66 HB ILE 66 9.290 -9.232 -9.257 515 HG12 ILE 66 HG12 ILE 66 7.454 -11.478 -8.436 516 HG13 ILE 66 HG11 ILE 66 7.073 -9.776 -8.215 517 HG21 ILE 66 HG21 ILE 66 9.575 -11.325 -10.458 518 HG22 ILE 66 HG22 ILE 66 9.740 -12.190 -8.936 519 HG23 ILE 66 HG23 ILE 66 10.957 -10.997 -9.409 520 HD11 ILE 66 HD11 ILE 66 6.015 -10.683 -10.211 521 HD12 ILE 66 HD12 ILE 66 7.597 -11.130 -10.852 522 HD13 ILE 66 HD13 ILE 66 7.185 -9.430 -10.624 523 H VAL 67 H VAL 67 7.706 -10.954 -5.815 524 HA VAL 67 HA VAL 67 9.325 -13.064 -4.644 525 HB VAL 67 HB VAL 67 6.378 -12.580 -4.207 526 HG11 VAL 67 HG11 VAL 67 8.458 -13.948 -2.509 527 HG12 VAL 67 HG12 VAL 67 7.176 -14.734 -3.428 528 HG13 VAL 67 HG13 VAL 67 6.770 -13.695 -2.062 529 HG21 VAL 67 HG21 VAL 67 7.581 -10.512 -3.737 530 HG22 VAL 67 HG22 VAL 67 8.697 -11.389 -2.692 531 HG23 VAL 67 HG23 VAL 67 6.997 -11.248 -2.245 532 H HIS 68 H HIS 68 9.190 -15.196 -5.112 533 HA HIS 68 HA HIS 68 7.460 -15.964 -7.350 534 HB2 HIS 68 HB2 HIS 68 9.889 -17.324 -6.143 535 HB3 HIS 68 HB1 HIS 68 8.943 -17.980 -7.470 536 HD2 HIS 68 HD2 HIS 68 9.866 -14.197 -7.564 537 HE1 HIS 68 HE1 HIS 68 12.277 -16.258 -10.361 538 HE2 HIS 68 HE2 HIS 68 11.745 -14.006 -9.344 539 H ILE 69 H ILE 69 5.550 -16.726 -6.663 540 HA ILE 69 HA ILE 69 5.501 -18.247 -4.158 541 HB ILE 69 HB ILE 69 3.192 -16.930 -5.603 542 HG12 ILE 69 HG12 ILE 69 4.782 -16.012 -3.194 543 HG13 ILE 69 HG11 ILE 69 4.777 -15.262 -4.782 544 HG21 ILE 69 HG21 ILE 69 1.971 -17.323 -3.518 545 HG22 ILE 69 HG22 ILE 69 3.381 -18.140 -2.844 546 HG23 ILE 69 HG23 ILE 69 2.536 -18.833 -4.227 547 HD11 ILE 69 HD11 ILE 69 3.422 -14.019 -3.199 548 HD12 ILE 69 HD12 ILE 69 2.424 -15.444 -2.917 549 HD13 ILE 69 HD13 ILE 69 2.435 -14.672 -4.504 550 H VAL 70 H VAL 70 5.316 -20.358 -4.302 551 HA VAL 70 HA VAL 70 3.930 -21.493 -6.632 552 HB VAL 70 HB VAL 70 5.481 -23.413 -6.595 553 HG11 VAL 70 HG11 VAL 70 7.440 -22.292 -7.538 554 HG12 VAL 70 HG12 VAL 70 6.897 -20.763 -6.850 555 HG13 VAL 70 HG13 VAL 70 5.945 -21.549 -8.105 556 HG21 VAL 70 HG21 VAL 70 7.003 -21.822 -4.524 557 HG22 VAL 70 HG22 VAL 70 7.571 -23.301 -5.301 558 HG23 VAL 70 HG23 VAL 70 6.154 -23.343 -4.252 559 H GLN 71 H GLN 71 2.475 -23.073 -6.231 560 HA GLN 71 HA GLN 71 2.107 -23.832 -3.414 561 HB2 GLN 71 HB2 GLN 71 -0.213 -24.330 -3.977 562 HB3 GLN 71 HB1 GLN 71 0.186 -22.674 -4.404 563 HG2 GLN 71 HG2 GLN 71 0.278 -23.199 -6.716 564 HG3 GLN 71 HG1 GLN 71 0.204 -24.929 -6.389 565 HE21 GLN 71 HE21 GLN 71 -1.858 -24.643 -4.351 566 HE22 GLN 71 HE22 GLN 71 -3.324 -24.313 -5.203 567 H ARG 72 H ARG 72 1.600 -25.981 -2.902 568 HA ARG 72 HA ARG 72 1.843 -27.969 -5.010 569 HB2 ARG 72 HB2 ARG 72 4.137 -27.617 -4.116 570 HB3 ARG 72 HB1 ARG 72 3.553 -28.049 -2.516 571 HG2 ARG 72 HG2 ARG 72 3.040 -30.287 -3.266 572 HG3 ARG 72 HG1 ARG 72 3.499 -29.863 -4.916 573 HD2 ARG 72 HD2 ARG 72 5.329 -29.813 -2.525 574 HD3 ARG 72 HD1 ARG 72 5.269 -31.095 -3.732 575 HE ARG 72 HE ARG 72 5.852 -29.199 -5.354 576 HH11 ARG 72 HH11 ARG 72 6.951 -29.308 -2.030 577 HH12 ARG 72 HH12 ARG 72 8.425 -28.466 -2.351 578 HH21 ARG 72 HH21 ARG 72 7.804 -28.070 -5.780 579 HH22 ARG 72 HH22 ARG 72 8.912 -27.755 -4.487 580 HA PRO 73 HA PRO 73 -1.609 -28.923 -2.184 581 HB2 PRO 73 HB2 PRO 73 -2.558 -30.412 -4.546 582 HB3 PRO 73 HB1 PRO 73 -3.372 -29.149 -3.622 583 HG2 PRO 73 HG2 PRO 73 -2.433 -28.687 -6.084 584 HG3 PRO 73 HG1 PRO 73 -2.383 -27.443 -4.821 585 HD2 PRO 73 HD2 PRO 73 -0.192 -29.231 -5.810 586 HD3 PRO 73 HD1 PRO 73 -0.146 -27.495 -5.422 587 H TRP 74 H TRP 74 -0.343 -30.319 -0.890 588 HA TRP 74 HA TRP 74 0.509 -32.905 -1.585 589 HB2 TRP 74 HB2 TRP 74 -0.357 -31.772 1.085 590 HB3 TRP 74 HB1 TRP 74 0.350 -33.367 0.895 591 HD1 TRP 74 HD1 TRP 74 1.845 -30.484 -1.106 592 HE1 TRP 74 HE1 TRP 74 4.166 -29.932 -0.146 593 HE3 TRP 74 HE3 TRP 74 1.712 -33.426 3.066 594 HZ2 TRP 74 HZ2 TRP 74 5.731 -30.650 2.087 595 HZ3 TRP 74 HZ3 TRP 74 3.661 -33.437 4.562 596 HH2 TRP 74 HH2 TRP 74 5.629 -32.075 4.079 597 H ARG 75 H ARG 75 -2.260 -32.019 0.409 598 HA ARG 75 HA ARG 75 -3.802 -34.230 -0.750 599 HB2 ARG 75 HB2 ARG 75 -4.806 -34.539 1.525 600 HB3 ARG 75 HB1 ARG 75 -3.102 -34.959 1.432 601 HG2 ARG 75 HG2 ARG 75 -2.570 -32.711 2.377 602 HG3 ARG 75 HG1 ARG 75 -4.300 -32.466 2.615 603 HD2 ARG 75 HD2 ARG 75 -2.687 -34.723 3.789 604 HD3 ARG 75 HD1 ARG 75 -3.154 -33.261 4.651 605 HE ARG 75 HE ARG 75 -5.493 -33.978 4.277 606 HH11 ARG 75 HH11 ARG 75 -2.934 -36.390 4.153 607 HH12 ARG 75 HH12 ARG 75 -3.963 -37.683 4.658 608 HH21 ARG 75 HH21 ARG 75 -6.845 -35.695 4.944 609 HH22 ARG 75 HH22 ARG 75 -6.197 -37.291 5.097 610 H LYS 76 H LYS 76 -3.636 -31.376 -1.315 611 HA LYS 76 HA LYS 76 -6.207 -30.349 -0.382 612 HB2 LYS 76 HB2 LYS 76 -3.838 -29.055 -1.723 613 HB3 LYS 76 HB1 LYS 76 -5.367 -28.222 -1.506 614 HG2 LYS 76 HG2 LYS 76 -3.773 -29.386 0.764 615 HG3 LYS 76 HG1 LYS 76 -3.614 -27.720 0.204 616 HD2 LYS 76 HD2 LYS 76 -6.102 -27.482 0.599 617 HD3 LYS 76 HD1 LYS 76 -6.039 -29.048 1.411 618 HE2 LYS 76 HE2 LYS 76 -4.516 -28.207 3.054 619 HE3 LYS 76 HE1 LYS 76 -4.324 -26.692 2.175 620 HZ1 LYS 76 HZ1 LYS 76 -5.779 -26.221 3.906 621 HZ2 LYS 76 HZ2 LYS 76 -6.662 -27.649 3.704 622 HZ3 LYS 76 HZ3 LYS 76 -6.806 -26.403 2.571 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 0.124 -1.381 0.603 2 H2 MET 1 HT2 MET 1 0.194 -0.214 -0.622 3 H3 MET 1 HT3 MET 1 0.952 0.075 0.855 4 HA MET 1 HA MET 1 2.552 -0.502 -0.835 5 HB2 MET 1 HB2 MET 1 2.946 -1.122 1.510 6 HB3 MET 1 HB1 MET 1 2.174 -2.675 1.220 7 HG2 MET 1 HG2 MET 1 3.929 -3.226 -0.395 8 HG3 MET 1 HG1 MET 1 4.705 -1.679 -0.066 9 HE1 MET 1 HE1 MET 1 6.266 -4.347 0.082 10 HE2 MET 1 HE2 MET 1 7.116 -4.273 1.622 11 HE3 MET 1 HE3 MET 1 7.043 -2.847 0.589 12 H ILE 2 H ILE 2 2.384 -1.184 -2.817 13 HA ILE 2 HA ILE 2 1.028 -3.733 -3.352 14 HB ILE 2 HB ILE 2 1.564 -1.366 -5.157 15 HG12 ILE 2 HG12 ILE 2 -0.927 -1.663 -5.601 16 HG13 ILE 2 HG11 ILE 2 -0.943 -2.800 -4.261 17 HG21 ILE 2 HG21 ILE 2 2.158 -3.345 -6.428 18 HG22 ILE 2 HG22 ILE 2 0.648 -2.661 -7.031 19 HG23 ILE 2 HG23 ILE 2 0.619 -4.099 -6.010 20 HD11 ILE 2 HD11 ILE 2 -0.195 0.110 -4.114 21 HD12 ILE 2 HD12 ILE 2 -0.208 -1.023 -2.761 22 HD13 ILE 2 HD13 ILE 2 -1.714 -0.609 -3.581 23 H VAL 3 H VAL 3 2.338 -5.396 -3.491 24 HA VAL 3 HA VAL 3 4.961 -4.991 -4.754 25 HB VAL 3 HB VAL 3 5.749 -7.008 -3.590 26 HG11 VAL 3 HG11 VAL 3 6.100 -4.863 -2.525 27 HG12 VAL 3 HG12 VAL 3 5.815 -6.110 -1.313 28 HG13 VAL 3 HG13 VAL 3 4.531 -4.977 -1.732 29 HG21 VAL 3 HG21 VAL 3 3.653 -8.229 -3.380 30 HG22 VAL 3 HG22 VAL 3 3.042 -7.017 -2.252 31 HG23 VAL 3 HG23 VAL 3 4.417 -8.029 -1.800 32 H PHE 4 H PHE 4 5.720 -6.789 -6.100 33 HA PHE 4 HA PHE 4 3.469 -7.806 -7.642 34 HB2 PHE 4 HB2 PHE 4 6.396 -7.487 -8.266 35 HB3 PHE 4 HB1 PHE 4 5.315 -8.404 -9.304 36 HD1 PHE 4 HD1 PHE 4 6.019 -5.053 -7.932 37 HD2 PHE 4 HD2 PHE 4 3.822 -7.329 -10.773 38 HE1 PHE 4 HE1 PHE 4 5.346 -2.975 -9.067 39 HE2 PHE 4 HE2 PHE 4 3.141 -5.257 -11.914 40 HZ PHE 4 HZ PHE 4 3.905 -3.076 -11.061 41 H VAL 5 H VAL 5 3.016 -9.916 -7.917 42 HA VAL 5 HA VAL 5 4.780 -11.869 -6.609 43 HB VAL 5 HB VAL 5 1.805 -11.527 -6.208 44 HG11 VAL 5 HG11 VAL 5 2.226 -13.882 -6.634 45 HG12 VAL 5 HG12 VAL 5 1.808 -13.603 -4.944 46 HG13 VAL 5 HG13 VAL 5 3.489 -13.890 -5.400 47 HG21 VAL 5 HG21 VAL 5 3.244 -10.228 -4.737 48 HG22 VAL 5 HG22 VAL 5 4.093 -11.696 -4.263 49 HG23 VAL 5 HG23 VAL 5 2.395 -11.488 -3.841 50 H ARG 6 H ARG 6 5.165 -13.610 -7.770 51 HA ARG 6 HA ARG 6 3.542 -14.140 -10.164 52 HB2 ARG 6 HB2 ARG 6 6.274 -15.218 -9.432 53 HB3 ARG 6 HB1 ARG 6 5.445 -15.440 -10.964 54 HG2 ARG 6 HG2 ARG 6 5.558 -13.012 -11.334 55 HG3 ARG 6 HG1 ARG 6 6.477 -12.861 -9.835 56 HD2 ARG 6 HD2 ARG 6 8.015 -12.890 -11.680 57 HD3 ARG 6 HD1 ARG 6 8.179 -14.399 -10.789 58 HE ARG 6 HE ARG 6 6.381 -14.969 -12.759 59 HH11 ARG 6 HH11 ARG 6 9.648 -13.669 -12.726 60 HH12 ARG 6 HH12 ARG 6 10.056 -14.306 -14.278 61 HH21 ARG 6 HH21 ARG 6 6.926 -15.816 -14.827 62 HH22 ARG 6 HH22 ARG 6 8.503 -15.535 -15.476 63 H PHE 7 H PHE 7 1.913 -15.459 -9.566 64 HA PHE 7 HA PHE 7 2.341 -17.475 -7.555 65 HB2 PHE 7 HB2 PHE 7 0.191 -16.222 -7.771 66 HB3 PHE 7 HB1 PHE 7 -0.101 -17.058 -9.295 67 HD1 PHE 7 HD1 PHE 7 0.121 -17.395 -5.660 68 HD2 PHE 7 HD2 PHE 7 -0.780 -19.375 -9.316 69 HE1 PHE 7 HE1 PHE 7 -0.906 -19.234 -4.404 70 HE2 PHE 7 HE2 PHE 7 -1.814 -21.221 -8.066 71 HZ PHE 7 HZ PHE 7 -1.878 -21.154 -5.607 72 H ASN 8 H ASN 8 2.664 -19.571 -7.836 73 HA ASN 8 HA ASN 8 3.204 -21.558 -8.801 74 HB2 ASN 8 HB2 ASN 8 0.921 -21.280 -9.892 75 HB3 ASN 8 HB1 ASN 8 1.746 -20.598 -11.287 76 HD21 ASN 8 HD21 ASN 8 1.004 -22.250 -12.622 77 HD22 ASN 8 HD22 ASN 8 1.650 -23.852 -12.543 78 H SER 9 H SER 9 4.612 -18.903 -9.227 79 HA SER 9 HA SER 9 6.512 -18.096 -10.140 80 HB2 SER 9 HB2 SER 9 7.260 -20.536 -9.691 81 HB3 SER 9 HB1 SER 9 7.030 -20.789 -11.420 82 HG SER 9 HG SER 9 8.616 -18.654 -10.446 83 H SER 10 H SER 10 3.886 -18.340 -11.576 84 HA SER 10 HA SER 10 4.670 -18.249 -14.372 85 HB2 SER 10 HB2 SER 10 2.598 -19.467 -13.575 86 HB3 SER 10 HB1 SER 10 1.917 -17.899 -13.146 87 HG SER 10 HG SER 10 2.772 -18.681 -15.744 88 H HIS 11 H HIS 11 2.373 -16.334 -14.820 89 HA HIS 11 HA HIS 11 3.847 -13.970 -15.056 90 HB2 HIS 11 HB2 HIS 11 0.854 -14.382 -15.049 91 HB3 HIS 11 HB1 HIS 11 1.637 -12.868 -15.485 92 HD2 HIS 11 HD2 HIS 11 1.234 -16.505 -16.870 93 HE1 HIS 11 HE1 HIS 11 2.645 -13.966 -19.945 94 HE2 HIS 11 HE2 HIS 11 2.001 -16.336 -19.341 95 H GLY 12 H GLY 12 3.956 -12.089 -13.912 96 HA2 GLY 12 HA2 GLY 12 3.295 -12.356 -11.082 97 HA3 GLY 12 HA1 GLY 12 4.406 -11.191 -11.786 98 H PHE 13 H PHE 13 1.688 -11.336 -10.158 99 HA PHE 13 HA PHE 13 0.543 -9.011 -11.541 100 HB2 PHE 13 HB2 PHE 13 -1.671 -9.656 -10.722 101 HB3 PHE 13 HB1 PHE 13 -0.975 -10.959 -11.669 102 HD1 PHE 13 HD1 PHE 13 -2.456 -10.026 -8.566 103 HD2 PHE 13 HD2 PHE 13 0.092 -12.909 -10.386 104 HE1 PHE 13 HE1 PHE 13 -2.895 -11.583 -6.713 105 HE2 PHE 13 HE2 PHE 13 -0.343 -14.465 -8.541 106 HZ PHE 13 HZ PHE 13 -1.838 -13.805 -6.698 107 HA PRO 14 HA PRO 14 1.379 -6.767 -7.857 108 HB2 PRO 14 HB2 PRO 14 -0.548 -4.847 -8.004 109 HB3 PRO 14 HB1 PRO 14 0.901 -4.847 -9.014 110 HG2 PRO 14 HG2 PRO 14 -1.874 -5.734 -9.678 111 HG3 PRO 14 HG1 PRO 14 -0.717 -4.832 -10.671 112 HD2 PRO 14 HD2 PRO 14 -1.166 -7.488 -10.975 113 HD3 PRO 14 HD1 PRO 14 0.403 -6.732 -11.315 114 H VAL 15 H VAL 15 0.936 -7.119 -5.810 115 HA VAL 15 HA VAL 15 -1.821 -7.772 -5.012 116 HB VAL 15 HB VAL 15 0.780 -8.759 -3.786 117 HG11 VAL 15 HG11 VAL 15 -2.073 -9.359 -2.996 118 HG12 VAL 15 HG12 VAL 15 -0.931 -8.378 -2.079 119 HG13 VAL 15 HG13 VAL 15 -0.632 -10.101 -2.304 120 HG21 VAL 15 HG21 VAL 15 0.058 -10.962 -4.534 121 HG22 VAL 15 HG22 VAL 15 0.206 -9.855 -5.898 122 HG23 VAL 15 HG23 VAL 15 -1.388 -10.255 -5.257 123 H GLU 16 H GLU 16 -2.723 -6.404 -3.610 124 HA GLU 16 HA GLU 16 -1.075 -4.245 -2.556 125 HB2 GLU 16 HB2 GLU 16 -3.118 -3.683 -3.803 126 HB3 GLU 16 HB1 GLU 16 -4.075 -4.551 -2.610 127 HG2 GLU 16 HG2 GLU 16 -3.206 -2.979 -0.883 128 HG3 GLU 16 HG1 GLU 16 -2.460 -2.055 -2.185 129 H VAL 17 H VAL 17 -0.381 -4.270 -0.549 130 HA VAL 17 HA VAL 17 -2.064 -5.435 1.543 131 HB VAL 17 HB VAL 17 -0.025 -6.357 2.668 132 HG11 VAL 17 HG11 VAL 17 -1.545 -7.818 1.446 133 HG12 VAL 17 HG12 VAL 17 0.121 -8.379 1.317 134 HG13 VAL 17 HG13 VAL 17 -0.635 -7.538 -0.037 135 HG21 VAL 17 HG21 VAL 17 1.985 -6.771 1.309 136 HG22 VAL 17 HG22 VAL 17 1.679 -5.049 1.530 137 HG23 VAL 17 HG23 VAL 17 1.280 -5.825 -0.003 138 H ASP 18 H ASP 18 -1.132 -4.815 3.747 139 HA ASP 18 HA ASP 18 -0.596 -1.958 3.717 140 HB2 ASP 18 HB2 ASP 18 -1.471 -3.925 5.789 141 HB3 ASP 18 HB1 ASP 18 -0.708 -2.429 6.312 142 H SER 19 H SER 19 0.983 -1.147 5.395 143 HA SER 19 HA SER 19 3.561 -2.027 4.737 144 HB2 SER 19 HB2 SER 19 4.243 -0.445 6.580 145 HB3 SER 19 HB1 SER 19 3.203 0.257 5.341 146 HG SER 19 HG SER 19 2.553 -0.484 8.000 147 H ASP 20 H ASP 20 1.519 -2.638 7.526 148 HA ASP 20 HA ASP 20 3.665 -4.045 8.879 149 HB2 ASP 20 HB2 ASP 20 0.883 -3.269 9.732 150 HB3 ASP 20 HB1 ASP 20 1.953 -4.252 10.729 151 H THR 21 H THR 21 2.104 -5.022 6.440 152 HA THR 21 HA THR 21 0.707 -7.364 7.254 153 HB THR 21 HB THR 21 2.003 -6.701 4.596 154 HG1 THR 21 HG1 THR 21 0.494 -5.251 4.649 155 HG21 THR 21 HG21 THR 21 -0.148 -8.718 5.275 156 HG22 THR 21 HG22 THR 21 1.511 -9.086 4.791 157 HG23 THR 21 HG23 THR 21 0.411 -8.320 3.649 158 H SER 22 H SER 22 1.601 -9.213 8.000 159 HA SER 22 HA SER 22 4.441 -9.603 7.825 160 HB2 SER 22 HB2 SER 22 4.005 -11.682 9.081 161 HB3 SER 22 HB1 SER 22 3.215 -10.304 9.842 162 HG SER 22 HG SER 22 1.799 -12.041 9.741 163 H ILE 23 H ILE 23 5.370 -11.612 6.918 164 HA ILE 23 HA ILE 23 4.619 -11.973 4.247 165 HB ILE 23 HB ILE 23 6.300 -13.832 5.950 166 HG12 ILE 23 HG12 ILE 23 7.193 -11.568 5.996 167 HG13 ILE 23 HG11 ILE 23 8.225 -12.588 5.003 168 HG21 ILE 23 HG21 ILE 23 7.280 -14.596 3.855 169 HG22 ILE 23 HG22 ILE 23 6.234 -13.511 2.946 170 HG23 ILE 23 HG23 ILE 23 5.536 -14.860 3.843 171 HD11 ILE 23 HD11 ILE 23 7.169 -11.653 2.988 172 HD12 ILE 23 HD12 ILE 23 7.944 -10.419 3.983 173 HD13 ILE 23 HD13 ILE 23 6.191 -10.600 4.012 174 H PHE 24 H PHE 24 3.655 -13.667 7.162 175 HA PHE 24 HA PHE 24 2.427 -15.884 5.901 176 HB2 PHE 24 HB2 PHE 24 2.929 -15.789 8.340 177 HB3 PHE 24 HB1 PHE 24 1.652 -14.593 8.525 178 HD1 PHE 24 HD1 PHE 24 2.298 -18.069 7.427 179 HD2 PHE 24 HD2 PHE 24 -0.569 -15.251 8.819 180 HE1 PHE 24 HE1 PHE 24 0.645 -19.869 7.654 181 HE2 PHE 24 HE2 PHE 24 -2.227 -17.049 9.052 182 HZ PHE 24 HZ PHE 24 -1.622 -19.362 8.467 183 H GLN 25 H GLN 25 1.186 -12.735 6.989 184 HA GLN 25 HA GLN 25 -1.468 -13.121 6.153 185 HB2 GLN 25 HB2 GLN 25 0.153 -10.586 6.410 186 HB3 GLN 25 HB1 GLN 25 -1.574 -10.615 6.086 187 HG2 GLN 25 HG2 GLN 25 -1.956 -11.725 8.221 188 HG3 GLN 25 HG1 GLN 25 -0.220 -11.701 8.542 189 HE21 GLN 25 HE21 GLN 25 -3.115 -9.802 8.296 190 HE22 GLN 25 HE22 GLN 25 -2.485 -8.378 9.037 191 H LEU 26 H LEU 26 1.355 -11.760 4.544 192 HA LEU 26 HA LEU 26 0.179 -10.997 2.139 193 HB2 LEU 26 HB2 LEU 26 2.440 -10.384 2.769 194 HB3 LEU 26 HB1 LEU 26 2.946 -12.057 2.694 195 HG LEU 26 HG LEU 26 2.640 -12.064 0.268 196 HD11 LEU 26 HD11 LEU 26 1.906 -9.157 0.592 197 HD12 LEU 26 HD12 LEU 26 0.802 -10.452 0.126 198 HD13 LEU 26 HD13 LEU 26 2.137 -10.007 -0.935 199 HD21 LEU 26 HD21 LEU 26 4.271 -9.765 1.317 200 HD22 LEU 26 HD22 LEU 26 4.448 -10.485 -0.286 201 HD23 LEU 26 HD23 LEU 26 4.800 -11.441 1.156 202 H LYS 27 H LYS 27 1.577 -14.117 3.090 203 HA LYS 27 HA LYS 27 1.132 -15.460 0.665 204 HB2 LYS 27 HB2 LYS 27 2.570 -16.347 2.475 205 HB3 LYS 27 HB1 LYS 27 1.141 -16.605 3.467 206 HG2 LYS 27 HG2 LYS 27 0.298 -18.236 1.891 207 HG3 LYS 27 HG1 LYS 27 1.661 -17.937 0.815 208 HD2 LYS 27 HD2 LYS 27 2.077 -19.963 2.040 209 HD3 LYS 27 HD1 LYS 27 3.181 -18.719 2.626 210 HE2 LYS 27 HE2 LYS 27 1.859 -18.381 4.592 211 HE3 LYS 27 HE1 LYS 27 0.573 -19.413 3.967 212 HZ1 LYS 27 HZ1 LYS 27 2.062 -21.299 4.086 213 HZ2 LYS 27 HZ2 LYS 27 1.936 -20.570 5.600 214 HZ3 LYS 27 HZ3 LYS 27 3.315 -20.319 4.654 215 H GLU 28 H GLU 28 -0.867 -15.105 3.552 216 HA GLU 28 HA GLU 28 -3.023 -16.701 2.688 217 HB2 GLU 28 HB2 GLU 28 -2.599 -14.650 4.796 218 HB3 GLU 28 HB1 GLU 28 -4.254 -15.089 4.392 219 HG2 GLU 28 HG2 GLU 28 -2.278 -17.242 4.942 220 HG3 GLU 28 HG1 GLU 28 -2.958 -16.340 6.291 221 H VAL 29 H VAL 29 -2.315 -13.261 2.275 222 HA VAL 29 HA VAL 29 -4.780 -12.482 1.168 223 HB VAL 29 HB VAL 29 -2.009 -11.362 0.620 224 HG11 VAL 29 HG11 VAL 29 -3.165 -9.348 -0.187 225 HG12 VAL 29 HG12 VAL 29 -4.713 -10.176 -0.012 226 HG13 VAL 29 HG13 VAL 29 -3.530 -10.757 -1.185 227 HG21 VAL 29 HG21 VAL 29 -2.658 -9.606 2.196 228 HG22 VAL 29 HG22 VAL 29 -2.694 -11.195 2.958 229 HG23 VAL 29 HG23 VAL 29 -4.198 -10.419 2.467 230 H VAL 30 H VAL 30 -1.818 -13.677 -0.351 231 HA VAL 30 HA VAL 30 -2.866 -13.608 -2.997 232 HB VAL 30 HB VAL 30 -0.533 -15.203 -1.902 233 HG11 VAL 30 HG11 VAL 30 -1.326 -16.108 -4.023 234 HG12 VAL 30 HG12 VAL 30 0.230 -15.303 -4.234 235 HG13 VAL 30 HG13 VAL 30 -1.253 -14.502 -4.749 236 HG21 VAL 30 HG21 VAL 30 -0.611 -12.513 -3.266 237 HG22 VAL 30 HG22 VAL 30 0.849 -13.386 -2.805 238 HG23 VAL 30 HG23 VAL 30 -0.261 -12.805 -1.564 239 H ALA 31 H ALA 31 -2.670 -16.059 -0.479 240 HA ALA 31 HA ALA 31 -3.462 -18.286 -1.944 241 HB1 ALA 31 HB1 ALA 31 -4.063 -17.664 0.943 242 HB2 ALA 31 HB2 ALA 31 -2.596 -18.430 0.330 243 HB3 ALA 31 HB3 ALA 31 -4.149 -19.257 0.189 244 H LYS 32 H LYS 32 -5.515 -16.036 -0.063 245 HA LYS 32 HA LYS 32 -7.940 -17.257 -0.923 246 HB2 LYS 32 HB2 LYS 32 -9.073 -15.300 0.009 247 HB3 LYS 32 HB1 LYS 32 -7.855 -15.906 1.121 248 HG2 LYS 32 HG2 LYS 32 -6.409 -14.109 0.684 249 HG3 LYS 32 HG1 LYS 32 -7.310 -13.629 -0.755 250 HD2 LYS 32 HD2 LYS 32 -9.220 -13.026 0.659 251 HD3 LYS 32 HD1 LYS 32 -8.297 -13.481 2.095 252 HE2 LYS 32 HE2 LYS 32 -8.278 -11.056 1.718 253 HE3 LYS 32 HE1 LYS 32 -6.662 -11.746 1.613 254 HZ1 LYS 32 HZ1 LYS 32 -6.793 -11.655 -0.779 255 HZ2 LYS 32 HZ2 LYS 32 -7.122 -10.123 -0.147 256 HZ3 LYS 32 HZ3 LYS 32 -8.384 -11.091 -0.719 257 H ARG 33 H ARG 33 -5.871 -14.825 -2.246 258 HA ARG 33 HA ARG 33 -7.662 -13.606 -4.058 259 HB2 ARG 33 HB2 ARG 33 -5.154 -13.075 -3.258 260 HB3 ARG 33 HB1 ARG 33 -4.780 -13.892 -4.763 261 HG2 ARG 33 HG2 ARG 33 -6.616 -11.509 -4.572 262 HG3 ARG 33 HG1 ARG 33 -4.885 -11.389 -4.872 263 HD2 ARG 33 HD2 ARG 33 -5.312 -12.967 -6.845 264 HD3 ARG 33 HD1 ARG 33 -7.018 -12.584 -6.614 265 HE ARG 33 HE ARG 33 -5.539 -10.194 -6.733 266 HH11 ARG 33 HH11 ARG 33 -6.671 -12.783 -8.820 267 HH12 ARG 33 HH12 ARG 33 -6.589 -11.832 -10.254 268 HH21 ARG 33 HH21 ARG 33 -5.435 -8.930 -8.650 269 HH22 ARG 33 HH22 ARG 33 -5.889 -9.639 -10.158 270 H GLN 34 H GLN 34 -5.686 -16.492 -4.178 271 HA GLN 34 HA GLN 34 -6.493 -16.992 -6.952 272 HB2 GLN 34 HB2 GLN 34 -4.395 -18.314 -5.231 273 HB3 GLN 34 HB1 GLN 34 -4.754 -18.756 -6.893 274 HG2 GLN 34 HG2 GLN 34 -3.873 -16.005 -6.065 275 HG3 GLN 34 HG1 GLN 34 -2.760 -17.270 -6.579 276 HE21 GLN 34 HE21 GLN 34 -5.310 -15.116 -7.575 277 HE22 GLN 34 HE22 GLN 34 -5.041 -15.271 -9.274 278 H GLY 35 H GLY 35 -7.460 -17.718 -3.860 279 HA2 GLY 35 HA2 GLY 35 -9.034 -19.182 -3.047 280 HA3 GLY 35 HA1 GLY 35 -9.339 -19.676 -4.708 281 H VAL 36 H VAL 36 -6.350 -19.839 -2.833 282 HA VAL 36 HA VAL 36 -6.398 -22.768 -3.150 283 HB VAL 36 HB VAL 36 -3.978 -22.749 -3.484 284 HG11 VAL 36 HG11 VAL 36 -5.399 -20.862 -5.358 285 HG12 VAL 36 HG12 VAL 36 -5.378 -22.622 -5.464 286 HG13 VAL 36 HG13 VAL 36 -3.891 -21.707 -5.706 287 HG21 VAL 36 HG21 VAL 36 -4.189 -19.738 -3.395 288 HG22 VAL 36 HG22 VAL 36 -2.735 -20.660 -3.775 289 HG23 VAL 36 HG23 VAL 36 -3.444 -20.755 -2.162 290 HA PRO 37 HA PRO 37 -5.413 -22.957 1.180 291 HB2 PRO 37 HB2 PRO 37 -3.650 -25.247 0.838 292 HB3 PRO 37 HB1 PRO 37 -5.287 -25.208 1.499 293 HG2 PRO 37 HG2 PRO 37 -4.672 -26.377 -0.886 294 HG3 PRO 37 HG1 PRO 37 -6.256 -25.668 -0.530 295 HD2 PRO 37 HD2 PRO 37 -3.969 -24.521 -2.086 296 HD3 PRO 37 HD1 PRO 37 -5.711 -24.468 -2.435 297 H ALA 38 H ALA 38 -4.025 -21.789 2.359 298 HA ALA 38 HA ALA 38 -1.463 -21.043 1.287 299 HB1 ALA 38 HB1 ALA 38 -2.908 -19.429 2.466 300 HB2 ALA 38 HB2 ALA 38 -1.299 -19.540 3.174 301 HB3 ALA 38 HB3 ALA 38 -2.662 -20.327 3.963 302 H ASP 39 H ASP 39 -2.580 -23.542 3.266 303 HA ASP 39 HA ASP 39 -0.449 -23.955 5.044 304 HB2 ASP 39 HB2 ASP 39 -2.278 -25.971 3.715 305 HB3 ASP 39 HB1 ASP 39 -1.174 -26.356 5.029 306 H GLN 40 H GLN 40 -1.043 -25.523 1.918 307 HA GLN 40 HA GLN 40 1.724 -26.436 1.814 308 HB2 GLN 40 HB2 GLN 40 -0.561 -26.976 -0.087 309 HB3 GLN 40 HB1 GLN 40 0.996 -27.790 -0.074 310 HG2 GLN 40 HG2 GLN 40 -0.959 -27.872 2.210 311 HG3 GLN 40 HG1 GLN 40 -0.879 -29.080 0.933 312 HE21 GLN 40 HE21 GLN 40 -0.424 -30.678 2.438 313 HE22 GLN 40 HE22 GLN 40 1.131 -30.833 3.177 314 H LEU 41 H LEU 41 0.721 -23.607 1.388 315 HA LEU 41 HA LEU 41 1.558 -23.131 -1.355 316 HB2 LEU 41 HB2 LEU 41 -0.438 -21.987 -0.377 317 HB3 LEU 41 HB1 LEU 41 0.636 -21.162 0.735 318 HG LEU 41 HG LEU 41 1.757 -20.079 -1.165 319 HD11 LEU 41 HD11 LEU 41 1.387 -21.722 -2.884 320 HD12 LEU 41 HD12 LEU 41 0.658 -20.198 -3.386 321 HD13 LEU 41 HD13 LEU 41 -0.358 -21.502 -2.776 322 HD21 LEU 41 HD21 LEU 41 -0.094 -18.956 -0.027 323 HD22 LEU 41 HD22 LEU 41 -1.241 -19.725 -1.123 324 HD23 LEU 41 HD23 LEU 41 -0.072 -18.561 -1.744 325 H ARG 42 H ARG 42 3.551 -22.521 -1.852 326 HA ARG 42 HA ARG 42 5.390 -21.937 0.356 327 HB2 ARG 42 HB2 ARG 42 5.948 -23.921 -0.906 328 HB3 ARG 42 HB1 ARG 42 5.897 -23.007 -2.407 329 HG2 ARG 42 HG2 ARG 42 7.713 -21.558 -1.113 330 HG3 ARG 42 HG1 ARG 42 7.982 -23.112 -0.322 331 HD2 ARG 42 HD2 ARG 42 7.946 -22.619 -3.274 332 HD3 ARG 42 HD1 ARG 42 9.400 -22.794 -2.293 333 HE ARG 42 HE ARG 42 7.919 -25.067 -1.828 334 HH11 ARG 42 HH11 ARG 42 9.349 -23.562 -4.671 335 HH12 ARG 42 HH12 ARG 42 9.613 -25.064 -5.480 336 HH21 ARG 42 HH21 ARG 42 8.265 -27.047 -2.910 337 HH22 ARG 42 HH22 ARG 42 9.002 -27.050 -4.479 338 H VAL 43 H VAL 43 6.427 -20.052 0.458 339 HA VAL 43 HA VAL 43 6.160 -18.258 -1.835 340 HB VAL 43 HB VAL 43 6.499 -16.370 -0.243 341 HG11 VAL 43 HG11 VAL 43 4.234 -17.043 -0.832 342 HG12 VAL 43 HG12 VAL 43 4.304 -16.477 0.835 343 HG13 VAL 43 HG13 VAL 43 4.224 -18.204 0.494 344 HG21 VAL 43 HG21 VAL 43 7.763 -17.544 1.488 345 HG22 VAL 43 HG22 VAL 43 6.340 -18.506 1.890 346 HG23 VAL 43 HG23 VAL 43 6.338 -16.766 2.177 347 H ILE 44 H ILE 44 7.926 -17.646 -2.884 348 HA ILE 44 HA ILE 44 10.526 -18.069 -1.584 349 HB ILE 44 HB ILE 44 9.749 -18.662 -4.445 350 HG12 ILE 44 HG12 ILE 44 9.248 -20.449 -2.848 351 HG13 ILE 44 HG11 ILE 44 10.555 -20.925 -3.927 352 HG21 ILE 44 HG21 ILE 44 12.518 -18.646 -3.250 353 HG22 ILE 44 HG22 ILE 44 11.896 -17.526 -4.463 354 HG23 ILE 44 HG23 ILE 44 12.096 -19.233 -4.857 355 HD11 ILE 44 HD11 ILE 44 10.820 -20.016 -1.069 356 HD12 ILE 44 HD12 ILE 44 12.172 -20.358 -2.145 357 HD13 ILE 44 HD13 ILE 44 11.057 -21.647 -1.695 358 H PHE 45 H PHE 45 11.728 -16.358 -1.461 359 HA PHE 45 HA PHE 45 11.527 -14.272 -3.496 360 HB2 PHE 45 HB2 PHE 45 10.233 -13.532 -1.527 361 HB3 PHE 45 HB1 PHE 45 11.637 -13.811 -0.504 362 HD1 PHE 45 HD1 PHE 45 10.393 -11.787 -3.341 363 HD2 PHE 45 HD2 PHE 45 13.252 -12.153 -0.213 364 HE1 PHE 45 HE1 PHE 45 11.139 -9.483 -3.758 365 HE2 PHE 45 HE2 PHE 45 14.000 -9.851 -0.624 366 HZ PHE 45 HZ PHE 45 12.945 -8.515 -2.398 367 H ALA 46 H ALA 46 13.474 -14.004 -4.361 368 HA ALA 46 HA ALA 46 15.722 -13.914 -4.664 369 HB1 ALA 46 HB1 ALA 46 15.753 -12.427 -2.714 370 HB2 ALA 46 HB2 ALA 46 17.194 -13.444 -2.764 371 HB3 ALA 46 HB3 ALA 46 15.884 -13.827 -1.647 372 H GLY 47 H GLY 47 14.191 -16.451 -4.139 373 HA2 GLY 47 HA2 GLY 47 14.848 -18.650 -4.572 374 HA3 GLY 47 HA1 GLY 47 16.509 -18.200 -4.221 375 H LYS 48 H LYS 48 14.356 -17.153 -1.835 376 HA LYS 48 HA LYS 48 14.604 -19.598 -0.259 377 HB2 LYS 48 HB2 LYS 48 15.442 -18.278 1.690 378 HB3 LYS 48 HB1 LYS 48 16.591 -18.390 0.366 379 HG2 LYS 48 HG2 LYS 48 16.759 -16.178 0.330 380 HG3 LYS 48 HG1 LYS 48 15.039 -16.051 -0.034 381 HD2 LYS 48 HD2 LYS 48 14.527 -16.119 2.360 382 HD3 LYS 48 HD1 LYS 48 16.248 -16.242 2.727 383 HE2 LYS 48 HE2 LYS 48 14.941 -13.941 1.277 384 HE3 LYS 48 HE1 LYS 48 15.361 -13.946 2.987 385 HZ1 LYS 48 HZ1 LYS 48 17.692 -14.228 2.357 386 HZ2 LYS 48 HZ2 LYS 48 17.042 -12.825 1.684 387 HZ3 LYS 48 HZ3 LYS 48 17.273 -14.186 0.723 388 H GLU 49 H GLU 49 13.219 -19.554 1.677 389 HA GLU 49 HA GLU 49 10.804 -18.044 1.139 390 HB2 GLU 49 HB2 GLU 49 9.755 -19.409 2.864 391 HB3 GLU 49 HB1 GLU 49 10.602 -20.432 1.717 392 HG2 GLU 49 HG2 GLU 49 12.426 -20.720 3.292 393 HG3 GLU 49 HG1 GLU 49 11.629 -19.637 4.433 394 H LEU 50 H LEU 50 9.837 -16.645 2.639 395 HA LEU 50 HA LEU 50 11.813 -15.282 4.300 396 HB2 LEU 50 HB2 LEU 50 9.083 -14.404 3.398 397 HB3 LEU 50 HB1 LEU 50 10.180 -13.442 4.365 398 HG LEU 50 HG LEU 50 10.626 -14.347 1.532 399 HD11 LEU 50 HD11 LEU 50 8.947 -12.607 1.722 400 HD12 LEU 50 HD12 LEU 50 10.424 -11.976 0.995 401 HD13 LEU 50 HD13 LEU 50 10.053 -11.626 2.684 402 HD21 LEU 50 HD21 LEU 50 12.603 -12.858 1.630 403 HD22 LEU 50 HD22 LEU 50 12.737 -14.245 2.709 404 HD23 LEU 50 HD23 LEU 50 12.331 -12.657 3.362 405 H ARG 51 H ARG 51 11.304 -14.539 6.345 406 HA ARG 51 HA ARG 51 10.122 -16.367 8.099 407 HB2 ARG 51 HB2 ARG 51 10.298 -14.414 9.732 408 HB3 ARG 51 HB1 ARG 51 11.791 -14.913 8.946 409 HG2 ARG 51 HG2 ARG 51 11.226 -13.060 7.227 410 HG3 ARG 51 HG1 ARG 51 10.144 -12.465 8.482 411 HD2 ARG 51 HD2 ARG 51 13.096 -12.957 8.794 412 HD3 ARG 51 HD1 ARG 51 12.344 -11.384 8.546 413 HE ARG 51 HE ARG 51 11.328 -12.819 10.831 414 HH11 ARG 51 HH11 ARG 51 13.787 -10.571 9.712 415 HH12 ARG 51 HH12 ARG 51 14.080 -9.916 11.284 416 HH21 ARG 51 HH21 ARG 51 11.725 -11.955 12.906 417 HH22 ARG 51 HH22 ARG 51 12.919 -10.711 13.103 418 H ASN 52 H ASN 52 8.047 -16.790 8.420 419 HA ASN 52 HA ASN 52 5.978 -15.501 7.069 420 HB2 ASN 52 HB2 ASN 52 4.440 -16.921 8.342 421 HB3 ASN 52 HB1 ASN 52 5.828 -17.834 7.777 422 HD21 ASN 52 HD21 ASN 52 4.152 -16.576 10.549 423 HD22 ASN 52 HD22 ASN 52 5.075 -17.425 11.738 424 H ASP 53 H ASP 53 7.267 -14.820 10.230 425 HA ASP 53 HA ASP 53 5.069 -12.926 10.605 426 HB2 ASP 53 HB2 ASP 53 5.042 -14.600 12.351 427 HB3 ASP 53 HB1 ASP 53 6.733 -14.279 12.722 428 H TRP 54 H TRP 54 6.221 -11.520 9.274 429 HA TRP 54 HA TRP 54 7.631 -9.593 10.826 430 HB2 TRP 54 HB2 TRP 54 9.457 -11.200 10.139 431 HB3 TRP 54 HB1 TRP 54 9.122 -10.750 8.469 432 HD1 TRP 54 HD1 TRP 54 10.775 -9.014 7.609 433 HE1 TRP 54 HE1 TRP 54 12.116 -7.068 8.620 434 HE3 TRP 54 HE3 TRP 54 9.163 -9.342 12.451 435 HZ2 TRP 54 HZ2 TRP 54 12.441 -5.827 11.128 436 HZ3 TRP 54 HZ3 TRP 54 10.038 -7.733 14.091 437 HH2 TRP 54 HH2 TRP 54 11.641 -6.013 13.442 438 H THR 55 H THR 55 7.503 -7.578 9.926 439 HA THR 55 HA THR 55 5.479 -7.079 8.078 440 HB THR 55 HB THR 55 5.854 -5.281 9.477 441 HG1 THR 55 HG1 THR 55 5.696 -4.063 7.734 442 HG21 THR 55 HG21 THR 55 8.807 -5.517 8.883 443 HG22 THR 55 HG22 THR 55 8.001 -5.931 10.394 444 HG23 THR 55 HG23 THR 55 8.084 -4.250 9.872 445 H VAL 56 H VAL 56 5.372 -7.007 5.962 446 HA VAL 56 HA VAL 56 7.525 -7.805 4.316 447 HB VAL 56 HB VAL 56 5.164 -8.305 3.781 448 HG11 VAL 56 HG11 VAL 56 3.690 -6.598 2.850 449 HG12 VAL 56 HG12 VAL 56 4.906 -5.364 3.185 450 HG13 VAL 56 HG13 VAL 56 4.139 -6.229 4.516 451 HG21 VAL 56 HG21 VAL 56 6.530 -6.649 1.665 452 HG22 VAL 56 HG22 VAL 56 5.252 -7.834 1.383 453 HG23 VAL 56 HG23 VAL 56 6.820 -8.355 2.001 454 H GLN 57 H GLN 57 6.353 -4.743 5.393 455 HA GLN 57 HA GLN 57 7.412 -3.138 3.333 456 HB2 GLN 57 HB2 GLN 57 5.674 -2.499 5.107 457 HB3 GLN 57 HB1 GLN 57 7.027 -2.267 6.198 458 HG2 GLN 57 HG2 GLN 57 6.846 -0.831 3.567 459 HG3 GLN 57 HG1 GLN 57 6.064 -0.219 5.018 460 HE21 GLN 57 HE21 GLN 57 8.158 -1.081 6.816 461 HE22 GLN 57 HE22 GLN 57 9.504 -0.032 6.542 462 H ASN 58 H ASN 58 8.649 -4.259 6.432 463 HA ASN 58 HA ASN 58 11.135 -2.849 6.229 464 HB2 ASN 58 HB2 ASN 58 9.924 -3.748 8.349 465 HB3 ASN 58 HB1 ASN 58 10.695 -5.277 7.949 466 HD21 ASN 58 HD21 ASN 58 11.027 -3.541 10.257 467 HD22 ASN 58 HD22 ASN 58 12.705 -3.142 10.323 468 H CYS 59 H CYS 59 9.886 -5.787 4.984 469 HA CYS 59 HA CYS 59 12.419 -7.057 4.531 470 HB2 CYS 59 HB2 CYS 59 9.691 -7.613 3.355 471 HB3 CYS 59 HB1 CYS 59 11.106 -8.638 3.142 472 HG CYS 59 HG CYS 59 9.440 -8.034 6.070 473 H ASP 60 H ASP 60 10.591 -4.625 3.009 474 HA ASP 60 HA ASP 60 11.026 -3.221 1.282 475 HB2 ASP 60 HB2 ASP 60 13.649 -4.708 1.078 476 HB3 ASP 60 HB1 ASP 60 13.261 -3.229 0.213 477 H LEU 61 H LEU 61 9.689 -5.851 0.799 478 HA LEU 61 HA LEU 61 10.524 -6.864 -1.707 479 HB2 LEU 61 HB2 LEU 61 7.996 -7.116 -0.126 480 HB3 LEU 61 HB1 LEU 61 7.983 -7.586 -1.808 481 HG LEU 61 HG LEU 61 9.718 -9.243 -1.417 482 HD11 LEU 61 HD11 LEU 61 10.949 -8.106 0.342 483 HD12 LEU 61 HD12 LEU 61 10.518 -9.748 0.819 484 HD13 LEU 61 HD13 LEU 61 9.611 -8.377 1.458 485 HD21 LEU 61 HD21 LEU 61 7.371 -9.867 -1.095 486 HD22 LEU 61 HD22 LEU 61 7.509 -9.473 0.616 487 HD23 LEU 61 HD23 LEU 61 8.453 -10.796 -0.062 488 H ASP 62 H ASP 62 8.916 -3.986 -0.944 489 HA ASP 62 HA ASP 62 7.515 -3.633 -3.417 490 HB2 ASP 62 HB2 ASP 62 6.812 -2.396 -1.448 491 HB3 ASP 62 HB1 ASP 62 8.395 -1.641 -1.314 492 H GLN 63 H GLN 63 10.642 -2.708 -2.151 493 HA GLN 63 HA GLN 63 11.374 -1.308 -4.585 494 HB2 GLN 63 HB2 GLN 63 12.052 -0.330 -2.490 495 HB3 GLN 63 HB1 GLN 63 12.826 -1.824 -1.990 496 HG2 GLN 63 HG2 GLN 63 14.458 -1.558 -3.808 497 HG3 GLN 63 HG1 GLN 63 13.698 -0.026 -4.238 498 HE21 GLN 63 HE21 GLN 63 16.413 -0.647 -3.312 499 HE22 GLN 63 HE22 GLN 63 16.662 0.344 -1.915 500 H GLN 64 H GLN 64 11.976 -4.354 -2.986 501 HA GLN 64 HA GLN 64 14.196 -5.003 -4.700 502 HB2 GLN 64 HB2 GLN 64 12.836 -6.446 -2.457 503 HB3 GLN 64 HB1 GLN 64 14.057 -7.228 -3.453 504 HG2 GLN 64 HG2 GLN 64 14.426 -4.733 -1.824 505 HG3 GLN 64 HG1 GLN 64 15.033 -6.345 -1.436 506 HE21 GLN 64 HE21 GLN 64 16.439 -3.807 -1.918 507 HE22 GLN 64 HE22 GLN 64 17.576 -4.143 -3.177 508 H SEP 65 H SEP 65 13.820 -7.743 -4.968 509 HA SEP 65 HA SEP 65 12.753 -7.868 -7.523 510 HB2 SEP 65 HB1 SEP 65 13.258 -10.239 -7.366 511 HB3 SEP 65 HB2 SEP 65 13.368 -10.114 -5.611 512 H ILE 66 H ILE 66 11.295 -9.888 -8.045 513 HA ILE 66 HA ILE 66 8.717 -9.276 -6.868 514 HB ILE 66 HB ILE 66 9.118 -9.359 -9.380 515 HG12 ILE 66 HG12 ILE 66 7.016 -11.287 -8.420 516 HG13 ILE 66 HG11 ILE 66 6.872 -9.539 -8.279 517 HG21 ILE 66 HG21 ILE 66 9.119 -12.325 -8.907 518 HG22 ILE 66 HG22 ILE 66 10.523 -11.369 -9.398 519 HG23 ILE 66 HG23 ILE 66 9.127 -11.513 -10.471 520 HD11 ILE 66 HD11 ILE 66 5.669 -10.389 -10.213 521 HD12 ILE 66 HD12 ILE 66 7.166 -11.078 -10.843 522 HD13 ILE 66 HD13 ILE 66 6.992 -9.328 -10.701 523 H VAL 67 H VAL 67 7.347 -10.872 -6.001 524 HA VAL 67 HA VAL 67 8.799 -12.985 -4.636 525 HB VAL 67 HB VAL 67 5.862 -12.393 -4.400 526 HG11 VAL 67 HG11 VAL 67 6.132 -13.287 -2.140 527 HG12 VAL 67 HG12 VAL 67 7.842 -13.575 -2.462 528 HG13 VAL 67 HG13 VAL 67 6.614 -14.456 -3.370 529 HG21 VAL 67 HG21 VAL 67 8.093 -11.045 -2.882 530 HG22 VAL 67 HG22 VAL 67 6.366 -10.858 -2.572 531 HG23 VAL 67 HG23 VAL 67 7.054 -10.289 -4.091 532 H HIS 68 H HIS 68 8.675 -15.108 -5.114 533 HA HIS 68 HA HIS 68 6.773 -15.932 -7.204 534 HB2 HIS 68 HB2 HIS 68 9.435 -17.049 -6.330 535 HB3 HIS 68 HB1 HIS 68 8.304 -18.000 -7.283 536 HD2 HIS 68 HD2 HIS 68 9.645 -14.305 -7.824 537 HE1 HIS 68 HE1 HIS 68 10.131 -16.593 -11.350 538 HE2 HIS 68 HE2 HIS 68 10.697 -14.416 -10.189 539 H ILE 69 H ILE 69 4.985 -16.729 -6.303 540 HA ILE 69 HA ILE 69 5.286 -18.395 -3.895 541 HB ILE 69 HB ILE 69 2.811 -16.971 -4.898 542 HG12 ILE 69 HG12 ILE 69 4.680 -16.330 -2.607 543 HG13 ILE 69 HG11 ILE 69 4.445 -15.379 -4.066 544 HG21 ILE 69 HG21 ILE 69 3.296 -18.502 -2.348 545 HG22 ILE 69 HG22 ILE 69 2.294 -19.025 -3.701 546 HG23 ILE 69 HG23 ILE 69 1.828 -17.611 -2.752 547 HD11 ILE 69 HD11 ILE 69 2.132 -14.954 -3.405 548 HD12 ILE 69 HD12 ILE 69 3.288 -14.371 -2.206 549 HD13 ILE 69 HD13 ILE 69 2.396 -15.868 -1.921 550 H VAL 70 H VAL 70 5.083 -20.493 -4.223 551 HA VAL 70 HA VAL 70 3.610 -21.393 -6.613 552 HB VAL 70 HB VAL 70 5.917 -22.792 -5.234 553 HG11 VAL 70 HG11 VAL 70 4.368 -24.351 -6.286 554 HG12 VAL 70 HG12 VAL 70 5.895 -24.292 -7.168 555 HG13 VAL 70 HG13 VAL 70 4.478 -23.454 -7.801 556 HG21 VAL 70 HG21 VAL 70 7.220 -22.222 -7.237 557 HG22 VAL 70 HG22 VAL 70 6.681 -20.782 -6.371 558 HG23 VAL 70 HG23 VAL 70 5.855 -21.285 -7.847 559 H GLN 71 H GLN 71 2.040 -22.884 -6.367 560 HA GLN 71 HA GLN 71 1.362 -23.674 -3.640 561 HB2 GLN 71 HB2 GLN 71 -0.376 -22.648 -5.103 562 HB3 GLN 71 HB1 GLN 71 -0.220 -24.021 -6.192 563 HG2 GLN 71 HG2 GLN 71 -0.725 -25.401 -4.024 564 HG3 GLN 71 HG1 GLN 71 -1.430 -23.883 -3.477 565 HE21 GLN 71 HE21 GLN 71 -2.746 -26.392 -4.016 566 HE22 GLN 71 HE22 GLN 71 -3.908 -26.071 -5.255 567 H ARG 72 H ARG 72 1.525 -25.729 -2.957 568 HA ARG 72 HA ARG 72 2.472 -27.692 -4.908 569 HB2 ARG 72 HB2 ARG 72 3.798 -27.128 -2.811 570 HB3 ARG 72 HB1 ARG 72 2.526 -27.934 -1.908 571 HG2 ARG 72 HG2 ARG 72 2.993 -30.015 -2.991 572 HG3 ARG 72 HG1 ARG 72 4.146 -29.235 -4.078 573 HD2 ARG 72 HD2 ARG 72 5.540 -28.635 -2.164 574 HD3 ARG 72 HD1 ARG 72 4.390 -29.419 -1.085 575 HE ARG 72 HE ARG 72 5.475 -31.090 -3.174 576 HH11 ARG 72 HH11 ARG 72 5.753 -30.007 0.156 577 HH12 ARG 72 HH12 ARG 72 6.723 -31.353 0.641 578 HH21 ARG 72 HH21 ARG 72 6.755 -32.876 -2.522 579 HH22 ARG 72 HH22 ARG 72 7.294 -32.988 -0.886 580 HA PRO 73 HA PRO 73 -1.805 -29.144 -4.681 581 HB2 PRO 73 HB2 PRO 73 -0.750 -31.122 -6.611 582 HB3 PRO 73 HB1 PRO 73 -2.129 -30.032 -6.762 583 HG2 PRO 73 HG2 PRO 73 0.118 -29.575 -8.109 584 HG3 PRO 73 HG1 PRO 73 -0.815 -28.240 -7.406 585 HD2 PRO 73 HD2 PRO 73 1.687 -29.537 -6.397 586 HD3 PRO 73 HD1 PRO 73 1.243 -27.816 -6.456 587 H TRP 74 H TRP 74 -1.975 -30.103 -2.728 588 HA TRP 74 HA TRP 74 -1.102 -32.908 -2.525 589 HB2 TRP 74 HB2 TRP 74 -1.570 -30.800 -0.428 590 HB3 TRP 74 HB1 TRP 74 -1.662 -32.507 -0.017 591 HD1 TRP 74 HD1 TRP 74 0.869 -29.873 -1.245 592 HE1 TRP 74 HE1 TRP 74 3.231 -30.684 -0.610 593 HE3 TRP 74 HE3 TRP 74 -0.297 -34.519 0.530 594 HZ2 TRP 74 HZ2 TRP 74 4.440 -32.973 0.483 595 HZ3 TRP 74 HZ3 TRP 74 1.521 -35.958 1.353 596 HH2 TRP 74 HH2 TRP 74 3.839 -35.199 1.327 597 H ARG 75 H ARG 75 -3.736 -30.645 -2.299 598 HA ARG 75 HA ARG 75 -5.629 -32.889 -2.091 599 HB2 ARG 75 HB2 ARG 75 -5.535 -31.153 -0.199 600 HB3 ARG 75 HB1 ARG 75 -6.216 -30.021 -1.356 601 HG2 ARG 75 HG2 ARG 75 -8.159 -31.543 -1.623 602 HG3 ARG 75 HG1 ARG 75 -7.486 -32.560 -0.348 603 HD2 ARG 75 HD2 ARG 75 -7.505 -30.547 1.140 604 HD3 ARG 75 HD1 ARG 75 -8.382 -29.696 -0.129 605 HE ARG 75 HE ARG 75 -9.595 -32.174 0.704 606 HH11 ARG 75 HH11 ARG 75 -9.394 -28.719 1.228 607 HH12 ARG 75 HH12 ARG 75 -10.904 -28.613 2.059 608 HH21 ARG 75 HH21 ARG 75 -11.607 -32.063 1.824 609 HH22 ARG 75 HH22 ARG 75 -12.167 -30.535 2.417 610 H LYS 76 H LYS 76 -4.235 -31.342 -4.354 611 HA LYS 76 HA LYS 76 -6.669 -30.703 -5.870 612 HB2 LYS 76 HB2 LYS 76 -3.919 -29.452 -6.136 613 HB3 LYS 76 HB1 LYS 76 -5.243 -29.168 -7.253 614 HG2 LYS 76 HG2 LYS 76 -5.110 -28.392 -4.341 615 HG3 LYS 76 HG1 LYS 76 -5.081 -27.318 -5.739 616 HD2 LYS 76 HD2 LYS 76 -7.405 -29.065 -4.905 617 HD3 LYS 76 HD1 LYS 76 -7.277 -27.331 -4.636 618 HE2 LYS 76 HE2 LYS 76 -7.267 -28.645 -7.354 619 HE3 LYS 76 HE1 LYS 76 -8.695 -27.960 -6.587 620 HZ1 LYS 76 HZ1 LYS 76 -6.246 -26.474 -7.391 621 HZ2 LYS 76 HZ2 LYS 76 -7.553 -25.801 -6.553 622 HZ3 LYS 76 HZ3 LYS 76 -7.773 -26.392 -8.115 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 1.442 0.241 0.668 2 H2 MET 1 HT2 MET 1 0.686 -1.232 0.314 3 H3 MET 1 HT3 MET 1 0.700 0.008 -0.829 4 HA MET 1 HA MET 1 3.066 -0.144 -1.057 5 HB2 MET 1 HB2 MET 1 3.546 -0.853 1.224 6 HB3 MET 1 HB1 MET 1 2.762 -2.396 0.923 7 HG2 MET 1 HG2 MET 1 4.490 -2.911 -0.749 8 HG3 MET 1 HG1 MET 1 5.287 -1.385 -0.362 9 HE1 MET 1 HE1 MET 1 7.594 -2.659 0.206 10 HE2 MET 1 HE2 MET 1 6.801 -4.164 -0.258 11 HE3 MET 1 HE3 MET 1 7.669 -4.063 1.273 12 H ILE 2 H ILE 2 2.991 -0.771 -3.073 13 HA ILE 2 HA ILE 2 1.551 -3.223 -3.749 14 HB ILE 2 HB ILE 2 2.633 -1.053 -5.561 15 HG12 ILE 2 HG12 ILE 2 -0.200 -1.776 -4.777 16 HG13 ILE 2 HG11 ILE 2 0.689 -0.360 -4.230 17 HG21 ILE 2 HG21 ILE 2 2.689 -3.209 -6.691 18 HG22 ILE 2 HG22 ILE 2 1.410 -2.199 -7.364 19 HG23 ILE 2 HG23 ILE 2 1.007 -3.503 -6.249 20 HD11 ILE 2 HD11 ILE 2 0.755 0.483 -6.514 21 HD12 ILE 2 HD12 ILE 2 -0.902 0.193 -5.986 22 HD13 ILE 2 HD13 ILE 2 -0.109 -0.949 -7.070 23 H VAL 3 H VAL 3 2.621 -5.039 -3.968 24 HA VAL 3 HA VAL 3 5.412 -4.886 -4.881 25 HB VAL 3 HB VAL 3 5.876 -6.975 -3.671 26 HG11 VAL 3 HG11 VAL 3 6.357 -4.895 -2.548 27 HG12 VAL 3 HG12 VAL 3 5.788 -6.087 -1.377 28 HG13 VAL 3 HG13 VAL 3 4.706 -4.811 -1.934 29 HG21 VAL 3 HG21 VAL 3 3.071 -6.704 -2.585 30 HG22 VAL 3 HG22 VAL 3 4.282 -7.869 -2.044 31 HG23 VAL 3 HG23 VAL 3 3.645 -7.959 -3.686 32 H PHE 4 H PHE 4 6.110 -6.520 -6.315 33 HA PHE 4 HA PHE 4 3.929 -7.519 -7.961 34 HB2 PHE 4 HB2 PHE 4 6.904 -7.436 -8.504 35 HB3 PHE 4 HB1 PHE 4 5.666 -7.929 -9.653 36 HD1 PHE 4 HD1 PHE 4 7.567 -5.221 -8.395 37 HD2 PHE 4 HD2 PHE 4 3.843 -6.187 -10.207 38 HE1 PHE 4 HE1 PHE 4 7.312 -2.883 -9.107 39 HE2 PHE 4 HE2 PHE 4 3.582 -3.851 -10.927 40 HZ PHE 4 HZ PHE 4 5.319 -2.194 -10.377 41 H VAL 5 H VAL 5 3.579 -9.663 -8.378 42 HA VAL 5 HA VAL 5 5.339 -11.581 -7.061 43 HB VAL 5 HB VAL 5 3.598 -11.054 -5.431 44 HG11 VAL 5 HG11 VAL 5 1.651 -11.946 -7.527 45 HG12 VAL 5 HG12 VAL 5 1.857 -10.308 -6.907 46 HG13 VAL 5 HG13 VAL 5 1.263 -11.584 -5.846 47 HG21 VAL 5 HG21 VAL 5 4.457 -13.334 -5.498 48 HG22 VAL 5 HG22 VAL 5 3.182 -13.778 -6.636 49 HG23 VAL 5 HG23 VAL 5 2.769 -13.276 -4.993 50 H ARG 6 H ARG 6 5.552 -13.471 -8.090 51 HA ARG 6 HA ARG 6 3.943 -13.943 -10.508 52 HB2 ARG 6 HB2 ARG 6 6.789 -14.632 -9.795 53 HB3 ARG 6 HB1 ARG 6 5.954 -15.483 -11.080 54 HG2 ARG 6 HG2 ARG 6 5.571 -13.313 -12.203 55 HG3 ARG 6 HG1 ARG 6 6.533 -12.544 -10.941 56 HD2 ARG 6 HD2 ARG 6 8.484 -13.761 -11.586 57 HD3 ARG 6 HD1 ARG 6 7.551 -14.778 -12.685 58 HE ARG 6 HE ARG 6 7.295 -12.047 -13.396 59 HH11 ARG 6 HH11 ARG 6 9.604 -14.680 -13.514 60 HH12 ARG 6 HH12 ARG 6 10.387 -14.106 -14.941 61 HH21 ARG 6 HH21 ARG 6 8.319 -11.281 -15.285 62 HH22 ARG 6 HH22 ARG 6 9.651 -12.157 -15.961 63 H PHE 7 H PHE 7 2.488 -15.496 -10.285 64 HA PHE 7 HA PHE 7 2.773 -17.421 -8.120 65 HB2 PHE 7 HB2 PHE 7 0.620 -16.218 -8.414 66 HB3 PHE 7 HB1 PHE 7 0.423 -16.986 -9.984 67 HD1 PHE 7 HD1 PHE 7 0.709 -17.671 -6.358 68 HD2 PHE 7 HD2 PHE 7 -0.534 -19.128 -10.158 69 HE1 PHE 7 HE1 PHE 7 -0.379 -19.583 -5.264 70 HE2 PHE 7 HE2 PHE 7 -1.625 -21.044 -9.070 71 HZ PHE 7 HZ PHE 7 -1.545 -21.277 -6.618 72 H ASN 8 H ASN 8 2.586 -19.646 -8.397 73 HA ASN 8 HA ASN 8 4.100 -20.937 -10.262 74 HB2 ASN 8 HB2 ASN 8 3.388 -22.063 -8.269 75 HB3 ASN 8 HB1 ASN 8 1.700 -21.972 -8.748 76 HD21 ASN 8 HD21 ASN 8 0.898 -23.462 -10.189 77 HD22 ASN 8 HD22 ASN 8 1.798 -24.842 -10.711 78 H SER 9 H SER 9 3.984 -21.186 -12.369 79 HA SER 9 HA SER 9 3.261 -21.591 -14.460 80 HB2 SER 9 HB2 SER 9 0.695 -22.510 -13.146 81 HB3 SER 9 HB1 SER 9 1.180 -22.840 -14.810 82 HG SER 9 HG SER 9 3.199 -23.649 -13.517 83 H SER 10 H SER 10 2.513 -19.069 -12.868 84 HA SER 10 HA SER 10 0.748 -17.974 -14.937 85 HB2 SER 10 HB2 SER 10 -0.380 -18.259 -12.680 86 HB3 SER 10 HB1 SER 10 0.784 -17.103 -12.036 87 HG SER 10 HG SER 10 -1.356 -16.710 -13.793 88 H HIS 11 H HIS 11 0.955 -15.353 -14.471 89 HA HIS 11 HA HIS 11 3.844 -14.892 -14.680 90 HB2 HIS 11 HB2 HIS 11 1.535 -13.516 -16.039 91 HB3 HIS 11 HB1 HIS 11 3.146 -12.807 -15.985 92 HD2 HIS 11 HD2 HIS 11 1.279 -15.817 -17.625 93 HE1 HIS 11 HE1 HIS 11 5.099 -15.421 -19.394 94 HE2 HIS 11 HE2 HIS 11 2.974 -16.781 -19.337 95 H GLY 12 H GLY 12 4.094 -12.260 -14.432 96 HA2 GLY 12 HA2 GLY 12 3.779 -11.953 -11.592 97 HA3 GLY 12 HA1 GLY 12 4.615 -10.860 -12.680 98 H PHE 13 H PHE 13 2.314 -10.887 -10.537 99 HA PHE 13 HA PHE 13 0.867 -8.733 -11.877 100 HB2 PHE 13 HB2 PHE 13 -1.235 -9.464 -10.734 101 HB3 PHE 13 HB1 PHE 13 -0.671 -10.589 -11.956 102 HD1 PHE 13 HD1 PHE 13 -1.442 -10.096 -8.453 103 HD2 PHE 13 HD2 PHE 13 0.355 -12.740 -11.259 104 HE1 PHE 13 HE1 PHE 13 -1.611 -11.931 -6.825 105 HE2 PHE 13 HE2 PHE 13 0.198 -14.577 -9.636 106 HZ PHE 13 HZ PHE 13 -0.791 -14.176 -7.414 107 HA PRO 14 HA PRO 14 1.916 -6.656 -8.140 108 HB2 PRO 14 HB2 PRO 14 0.382 -4.463 -8.364 109 HB3 PRO 14 HB1 PRO 14 1.760 -4.756 -9.432 110 HG2 PRO 14 HG2 PRO 14 -1.153 -5.120 -9.954 111 HG3 PRO 14 HG1 PRO 14 0.117 -4.527 -11.037 112 HD2 PRO 14 HD2 PRO 14 -0.903 -7.104 -11.039 113 HD3 PRO 14 HD1 PRO 14 0.670 -6.633 -11.707 114 H VAL 15 H VAL 15 1.321 -6.786 -6.080 115 HA VAL 15 HA VAL 15 -1.535 -7.023 -5.447 116 HB VAL 15 HB VAL 15 0.782 -8.545 -4.197 117 HG11 VAL 15 HG11 VAL 15 -0.833 -9.458 -2.598 118 HG12 VAL 15 HG12 VAL 15 -2.090 -8.405 -3.250 119 HG13 VAL 15 HG13 VAL 15 -0.702 -7.707 -2.417 120 HG21 VAL 15 HG21 VAL 15 -0.546 -10.498 -4.816 121 HG22 VAL 15 HG22 VAL 15 -0.165 -9.509 -6.226 122 HG23 VAL 15 HG23 VAL 15 -1.777 -9.447 -5.515 123 H GLU 16 H GLU 16 -2.286 -5.488 -4.198 124 HA GLU 16 HA GLU 16 -0.521 -3.551 -2.993 125 HB2 GLU 16 HB2 GLU 16 -2.832 -3.200 -4.186 126 HB3 GLU 16 HB1 GLU 16 -3.506 -3.625 -2.624 127 HG2 GLU 16 HG2 GLU 16 -1.568 -1.361 -3.066 128 HG3 GLU 16 HG1 GLU 16 -3.317 -1.178 -3.064 129 H VAL 17 H VAL 17 0.407 -4.063 -1.116 130 HA VAL 17 HA VAL 17 -1.191 -5.502 0.886 131 HB VAL 17 HB VAL 17 0.882 -6.309 1.880 132 HG11 VAL 17 HG11 VAL 17 1.644 -7.790 0.067 133 HG12 VAL 17 HG12 VAL 17 0.730 -6.813 -1.082 134 HG13 VAL 17 HG13 VAL 17 -0.113 -7.699 0.189 135 HG21 VAL 17 HG21 VAL 17 3.044 -5.970 0.726 136 HG22 VAL 17 HG22 VAL 17 2.369 -4.482 1.386 137 HG23 VAL 17 HG23 VAL 17 2.258 -4.807 -0.345 138 H ASP 18 H ASP 18 -0.563 -4.991 3.152 139 HA ASP 18 HA ASP 18 -0.467 -2.087 3.429 140 HB2 ASP 18 HB2 ASP 18 -2.367 -3.260 4.429 141 HB3 ASP 18 HB1 ASP 18 -1.271 -4.259 5.365 142 H SER 19 H SER 19 0.820 -1.145 5.149 143 HA SER 19 HA SER 19 3.493 -2.016 5.133 144 HB2 SER 19 HB2 SER 19 2.175 -0.053 7.016 145 HB3 SER 19 HB1 SER 19 3.904 -0.192 6.700 146 HG SER 19 HG SER 19 2.293 1.360 5.465 147 H ASP 20 H ASP 20 0.906 -3.177 6.983 148 HA ASP 20 HA ASP 20 2.798 -4.230 8.984 149 HB2 ASP 20 HB2 ASP 20 1.096 -2.711 9.949 150 HB3 ASP 20 HB1 ASP 20 -0.175 -3.749 9.319 151 H THR 21 H THR 21 1.484 -5.151 6.243 152 HA THR 21 HA THR 21 0.176 -7.591 6.918 153 HB THR 21 HB THR 21 1.423 -6.666 4.312 154 HG1 THR 21 HG1 THR 21 -0.871 -6.064 5.588 155 HG21 THR 21 HG21 THR 21 1.267 -9.124 4.392 156 HG22 THR 21 HG22 THR 21 0.121 -8.442 3.238 157 HG23 THR 21 HG23 THR 21 -0.442 -8.997 4.816 158 H SER 22 H SER 22 1.262 -9.114 7.996 159 HA SER 22 HA SER 22 4.057 -9.519 7.824 160 HB2 SER 22 HB2 SER 22 2.042 -11.548 8.791 161 HB3 SER 22 HB1 SER 22 3.707 -11.328 9.323 162 HG SER 22 HG SER 22 2.823 -10.163 10.840 163 H ILE 23 H ILE 23 5.151 -11.402 6.971 164 HA ILE 23 HA ILE 23 4.524 -12.011 4.323 165 HB ILE 23 HB ILE 23 6.209 -13.700 6.192 166 HG12 ILE 23 HG12 ILE 23 6.980 -11.394 6.235 167 HG13 ILE 23 HG11 ILE 23 8.123 -12.381 5.332 168 HG21 ILE 23 HG21 ILE 23 6.196 -13.485 3.181 169 HG22 ILE 23 HG22 ILE 23 5.728 -14.890 4.141 170 HG23 ILE 23 HG23 ILE 23 7.410 -14.353 4.119 171 HD11 ILE 23 HD11 ILE 23 7.124 -11.553 3.234 172 HD12 ILE 23 HD12 ILE 23 7.809 -10.270 4.228 173 HD13 ILE 23 HD13 ILE 23 6.063 -10.509 4.181 174 H PHE 24 H PHE 24 3.728 -13.742 7.292 175 HA PHE 24 HA PHE 24 2.593 -16.058 6.162 176 HB2 PHE 24 HB2 PHE 24 3.116 -15.732 8.592 177 HB3 PHE 24 HB1 PHE 24 1.741 -14.646 8.699 178 HD1 PHE 24 HD1 PHE 24 2.664 -18.132 7.833 179 HD2 PHE 24 HD2 PHE 24 -0.383 -15.471 9.156 180 HE1 PHE 24 HE1 PHE 24 1.197 -20.045 8.283 181 HE2 PHE 24 HE2 PHE 24 -1.860 -17.384 9.612 182 HZ PHE 24 HZ PHE 24 -1.072 -19.677 9.177 183 H GLN 25 H GLN 25 1.200 -12.935 7.035 184 HA GLN 25 HA GLN 25 -1.469 -13.518 6.373 185 HB2 GLN 25 HB2 GLN 25 -0.067 -10.837 6.342 186 HB3 GLN 25 HB1 GLN 25 -1.805 -11.089 6.378 187 HG2 GLN 25 HG2 GLN 25 0.129 -11.902 8.536 188 HG3 GLN 25 HG1 GLN 25 -0.915 -10.484 8.572 189 HE21 GLN 25 HE21 GLN 25 -0.764 -12.784 10.373 190 HE22 GLN 25 HE22 GLN 25 -2.348 -13.476 10.387 191 H LEU 26 H LEU 26 1.182 -12.062 4.537 192 HA LEU 26 HA LEU 26 -0.201 -11.437 2.204 193 HB2 LEU 26 HB2 LEU 26 2.031 -10.626 2.580 194 HB3 LEU 26 HB1 LEU 26 2.670 -12.257 2.622 195 HG LEU 26 HG LEU 26 2.236 -12.524 0.238 196 HD11 LEU 26 HD11 LEU 26 1.172 -9.710 0.385 197 HD12 LEU 26 HD12 LEU 26 0.258 -11.166 -0.005 198 HD13 LEU 26 HD13 LEU 26 1.508 -10.587 -1.106 199 HD21 LEU 26 HD21 LEU 26 4.376 -11.604 0.929 200 HD22 LEU 26 HD22 LEU 26 3.701 -9.975 0.899 201 HD23 LEU 26 HD23 LEU 26 3.862 -10.891 -0.601 202 H LYS 27 H LYS 27 1.422 -14.453 3.118 203 HA LYS 27 HA LYS 27 0.979 -15.854 0.726 204 HB2 LYS 27 HB2 LYS 27 2.519 -16.587 2.544 205 HB3 LYS 27 HB1 LYS 27 1.111 -16.976 3.529 206 HG2 LYS 27 HG2 LYS 27 0.497 -18.769 2.141 207 HG3 LYS 27 HG1 LYS 27 1.555 -18.231 0.837 208 HD2 LYS 27 HD2 LYS 27 2.548 -20.146 1.911 209 HD3 LYS 27 HD1 LYS 27 3.510 -18.717 2.285 210 HE2 LYS 27 HE2 LYS 27 3.263 -20.061 4.266 211 HE3 LYS 27 HE1 LYS 27 2.363 -18.560 4.469 212 HZ1 LYS 27 HZ1 LYS 27 0.328 -19.714 4.059 213 HZ2 LYS 27 HZ2 LYS 27 1.177 -20.583 5.222 214 HZ3 LYS 27 HZ3 LYS 27 1.138 -21.134 3.630 215 H GLU 28 H GLU 28 -0.952 -15.549 3.652 216 HA GLU 28 HA GLU 28 -3.042 -17.277 2.864 217 HB2 GLU 28 HB2 GLU 28 -2.756 -15.101 4.897 218 HB3 GLU 28 HB1 GLU 28 -4.301 -15.914 4.662 219 HG2 GLU 28 HG2 GLU 28 -1.895 -17.592 5.073 220 HG3 GLU 28 HG1 GLU 28 -2.514 -16.717 6.460 221 H VAL 29 H VAL 29 -2.495 -13.804 2.458 222 HA VAL 29 HA VAL 29 -5.031 -13.081 1.510 223 HB VAL 29 HB VAL 29 -2.321 -11.875 0.890 224 HG11 VAL 29 HG11 VAL 29 -3.522 -9.905 0.062 225 HG12 VAL 29 HG12 VAL 29 -5.055 -10.754 0.261 226 HG13 VAL 29 HG13 VAL 29 -3.877 -11.329 -0.919 227 HG21 VAL 29 HG21 VAL 29 -3.012 -11.720 3.225 228 HG22 VAL 29 HG22 VAL 29 -4.547 -11.003 2.736 229 HG23 VAL 29 HG23 VAL 29 -3.038 -10.132 2.460 230 H VAL 30 H VAL 30 -2.137 -14.017 -0.327 231 HA VAL 30 HA VAL 30 -3.383 -13.941 -2.861 232 HB VAL 30 HB VAL 30 -1.014 -15.617 -1.984 233 HG11 VAL 30 HG11 VAL 30 -0.397 -15.627 -4.358 234 HG12 VAL 30 HG12 VAL 30 -1.883 -14.759 -4.746 235 HG13 VAL 30 HG13 VAL 30 -1.963 -16.397 -4.096 236 HG21 VAL 30 HG21 VAL 30 -1.113 -12.858 -3.205 237 HG22 VAL 30 HG22 VAL 30 0.353 -13.789 -2.895 238 HG23 VAL 30 HG23 VAL 30 -0.651 -13.251 -1.548 239 H ALA 31 H ALA 31 -3.021 -16.453 -0.437 240 HA ALA 31 HA ALA 31 -3.970 -18.615 -1.940 241 HB1 ALA 31 HB1 ALA 31 -4.131 -18.208 1.037 242 HB2 ALA 31 HB2 ALA 31 -2.747 -18.866 0.161 243 HB3 ALA 31 HB3 ALA 31 -4.276 -19.744 0.183 244 H LYS 32 H LYS 32 -5.716 -16.518 0.383 245 HA LYS 32 HA LYS 32 -8.211 -17.784 -0.038 246 HB2 LYS 32 HB2 LYS 32 -9.219 -15.887 1.127 247 HB3 LYS 32 HB1 LYS 32 -7.789 -16.456 1.972 248 HG2 LYS 32 HG2 LYS 32 -6.511 -14.591 1.225 249 HG3 LYS 32 HG1 LYS 32 -7.787 -14.090 0.112 250 HD2 LYS 32 HD2 LYS 32 -9.255 -13.597 1.968 251 HD3 LYS 32 HD1 LYS 32 -8.046 -14.177 3.119 252 HE2 LYS 32 HE2 LYS 32 -6.533 -12.391 2.449 253 HE3 LYS 32 HE1 LYS 32 -7.690 -11.837 1.240 254 HZ1 LYS 32 HZ1 LYS 32 -8.089 -11.839 4.180 255 HZ2 LYS 32 HZ2 LYS 32 -9.239 -11.352 3.044 256 HZ3 LYS 32 HZ3 LYS 32 -7.804 -10.485 3.213 257 H ARG 33 H ARG 33 -6.625 -15.101 -1.651 258 HA ARG 33 HA ARG 33 -8.845 -14.092 -3.030 259 HB2 ARG 33 HB2 ARG 33 -6.766 -12.841 -2.938 260 HB3 ARG 33 HB1 ARG 33 -5.928 -14.105 -3.829 261 HG2 ARG 33 HG2 ARG 33 -7.482 -13.658 -5.747 262 HG3 ARG 33 HG1 ARG 33 -8.071 -12.258 -4.851 263 HD2 ARG 33 HD2 ARG 33 -5.182 -12.702 -5.584 264 HD3 ARG 33 HD1 ARG 33 -6.308 -11.761 -6.558 265 HE ARG 33 HE ARG 33 -6.043 -10.936 -3.786 266 HH11 ARG 33 HH11 ARG 33 -5.016 -10.477 -7.106 267 HH12 ARG 33 HH12 ARG 33 -4.418 -8.876 -6.843 268 HH21 ARG 33 HH21 ARG 33 -5.240 -8.815 -3.426 269 HH22 ARG 33 HH22 ARG 33 -4.543 -7.929 -4.741 270 H GLN 34 H GLN 34 -6.550 -16.651 -3.874 271 HA GLN 34 HA GLN 34 -7.987 -17.141 -6.366 272 HB2 GLN 34 HB2 GLN 34 -5.465 -18.402 -5.290 273 HB3 GLN 34 HB1 GLN 34 -6.156 -18.694 -6.880 274 HG2 GLN 34 HG2 GLN 34 -5.845 -16.312 -7.425 275 HG3 GLN 34 HG1 GLN 34 -5.092 -16.073 -5.850 276 HE21 GLN 34 HE21 GLN 34 -4.628 -18.955 -7.758 277 HE22 GLN 34 HE22 GLN 34 -2.973 -18.659 -8.148 278 H GLY 35 H GLY 35 -8.160 -18.148 -3.212 279 HA2 GLY 35 HA2 GLY 35 -9.461 -19.769 -2.226 280 HA3 GLY 35 HA1 GLY 35 -10.024 -20.215 -3.828 281 H VAL 36 H VAL 36 -6.721 -20.189 -2.606 282 HA VAL 36 HA VAL 36 -6.633 -23.094 -3.064 283 HB VAL 36 HB VAL 36 -4.231 -22.860 -3.570 284 HG11 VAL 36 HG11 VAL 36 -5.812 -22.831 -5.412 285 HG12 VAL 36 HG12 VAL 36 -4.448 -21.767 -5.758 286 HG13 VAL 36 HG13 VAL 36 -5.993 -21.083 -5.254 287 HG21 VAL 36 HG21 VAL 36 -4.722 -19.886 -3.391 288 HG22 VAL 36 HG22 VAL 36 -3.224 -20.659 -3.907 289 HG23 VAL 36 HG23 VAL 36 -3.784 -20.841 -2.243 290 HA PRO 37 HA PRO 37 -5.481 -23.547 1.168 291 HB2 PRO 37 HB2 PRO 37 -3.647 -25.732 0.550 292 HB3 PRO 37 HB1 PRO 37 -5.221 -25.799 1.346 293 HG2 PRO 37 HG2 PRO 37 -4.785 -26.794 -1.144 294 HG3 PRO 37 HG1 PRO 37 -6.349 -26.142 -0.625 295 HD2 PRO 37 HD2 PRO 37 -4.215 -24.864 -2.288 296 HD3 PRO 37 HD1 PRO 37 -5.981 -24.816 -2.482 297 H ALA 38 H ALA 38 -4.194 -22.088 2.116 298 HA ALA 38 HA ALA 38 -1.660 -21.325 1.114 299 HB1 ALA 38 HB1 ALA 38 -3.073 -19.802 2.413 300 HB2 ALA 38 HB2 ALA 38 -1.469 -19.953 3.127 301 HB3 ALA 38 HB3 ALA 38 -2.836 -20.798 3.846 302 H ASP 39 H ASP 39 -2.657 -23.904 3.118 303 HA ASP 39 HA ASP 39 -0.199 -24.338 4.517 304 HB2 ASP 39 HB2 ASP 39 -2.415 -26.295 3.852 305 HB3 ASP 39 HB1 ASP 39 -1.085 -26.614 4.957 306 H GLN 40 H GLN 40 -1.307 -24.948 1.342 307 HA GLN 40 HA GLN 40 0.944 -26.770 0.812 308 HB2 GLN 40 HB2 GLN 40 -1.518 -26.217 -0.863 309 HB3 GLN 40 HB1 GLN 40 -0.271 -27.400 -1.224 310 HG2 GLN 40 HG2 GLN 40 -2.134 -27.464 1.147 311 HG3 GLN 40 HG1 GLN 40 -2.275 -28.451 -0.306 312 HE21 GLN 40 HE21 GLN 40 -1.969 -29.246 2.482 313 HE22 GLN 40 HE22 GLN 40 -0.541 -30.214 2.558 314 H LEU 41 H LEU 41 0.552 -23.683 0.968 315 HA LEU 41 HA LEU 41 1.563 -22.993 -1.690 316 HB2 LEU 41 HB2 LEU 41 -0.505 -21.883 -0.725 317 HB3 LEU 41 HB1 LEU 41 0.556 -21.116 0.438 318 HG LEU 41 HG LEU 41 1.749 -19.999 -1.402 319 HD11 LEU 41 HD11 LEU 41 1.374 -21.614 -3.169 320 HD12 LEU 41 HD12 LEU 41 0.747 -20.039 -3.650 321 HD13 LEU 41 HD13 LEU 41 -0.361 -21.301 -3.119 322 HD21 LEU 41 HD21 LEU 41 -0.023 -18.425 -1.967 323 HD22 LEU 41 HD22 LEU 41 -0.124 -18.893 -0.270 324 HD23 LEU 41 HD23 LEU 41 -1.238 -19.590 -1.445 325 H ARG 42 H ARG 42 3.533 -22.078 -1.946 326 HA ARG 42 HA ARG 42 5.192 -21.653 0.455 327 HB2 ARG 42 HB2 ARG 42 5.909 -23.691 -0.578 328 HB3 ARG 42 HB1 ARG 42 5.851 -22.973 -2.176 329 HG2 ARG 42 HG2 ARG 42 8.134 -23.222 -1.547 330 HG3 ARG 42 HG1 ARG 42 7.747 -21.506 -1.526 331 HD2 ARG 42 HD2 ARG 42 7.776 -21.416 0.807 332 HD3 ARG 42 HD1 ARG 42 7.623 -23.167 0.972 333 HE ARG 42 HE ARG 42 9.979 -22.704 -0.397 334 HH11 ARG 42 HH11 ARG 42 8.723 -21.898 2.779 335 HH12 ARG 42 HH12 ARG 42 10.274 -21.950 3.532 336 HH21 ARG 42 HH21 ARG 42 12.036 -22.762 0.621 337 HH22 ARG 42 HH22 ARG 42 12.148 -22.441 2.316 338 H VAL 43 H VAL 43 6.264 -19.740 0.535 339 HA VAL 43 HA VAL 43 6.093 -18.045 -1.840 340 HB VAL 43 HB VAL 43 6.410 -16.110 -0.291 341 HG11 VAL 43 HG11 VAL 43 4.044 -17.880 0.306 342 HG12 VAL 43 HG12 VAL 43 4.179 -16.732 -1.024 343 HG13 VAL 43 HG13 VAL 43 4.140 -16.152 0.640 344 HG21 VAL 43 HG21 VAL 43 6.049 -18.190 1.869 345 HG22 VAL 43 HG22 VAL 43 6.071 -16.443 2.117 346 HG23 VAL 43 HG23 VAL 43 7.520 -17.272 1.547 347 H ILE 44 H ILE 44 7.876 -17.442 -2.841 348 HA ILE 44 HA ILE 44 10.444 -17.752 -1.446 349 HB ILE 44 HB ILE 44 9.836 -18.349 -4.355 350 HG12 ILE 44 HG12 ILE 44 9.139 -20.131 -2.800 351 HG13 ILE 44 HG11 ILE 44 10.473 -20.648 -3.825 352 HG21 ILE 44 HG21 ILE 44 12.013 -17.281 -4.127 353 HG22 ILE 44 HG22 ILE 44 12.185 -18.978 -4.572 354 HG23 ILE 44 HG23 ILE 44 12.477 -18.469 -2.909 355 HD11 ILE 44 HD11 ILE 44 12.028 -20.242 -1.970 356 HD12 ILE 44 HD12 ILE 44 10.786 -21.424 -1.560 357 HD13 ILE 44 HD13 ILE 44 10.668 -19.775 -0.949 358 H PHE 45 H PHE 45 11.425 -15.869 -1.233 359 HA PHE 45 HA PHE 45 10.922 -13.807 -3.268 360 HB2 PHE 45 HB2 PHE 45 9.960 -13.125 -1.146 361 HB3 PHE 45 HB1 PHE 45 11.476 -13.459 -0.314 362 HD1 PHE 45 HD1 PHE 45 10.109 -11.381 -3.087 363 HD2 PHE 45 HD2 PHE 45 12.945 -11.724 0.064 364 HE1 PHE 45 HE1 PHE 45 10.832 -9.068 -3.490 365 HE2 PHE 45 HE2 PHE 45 13.673 -9.411 -0.332 366 HZ PHE 45 HZ PHE 45 12.613 -8.082 -2.111 367 H ALA 46 H ALA 46 12.609 -13.510 -4.516 368 HA ALA 46 HA ALA 46 14.729 -13.215 -5.266 369 HB1 ALA 46 HB1 ALA 46 14.870 -11.514 -3.512 370 HB2 ALA 46 HB2 ALA 46 16.415 -12.333 -3.732 371 HB3 ALA 46 HB3 ALA 46 15.391 -12.740 -2.357 372 H GLY 47 H GLY 47 13.727 -15.855 -4.193 373 HA2 GLY 47 HA2 GLY 47 14.690 -17.962 -4.569 374 HA3 GLY 47 HA1 GLY 47 16.283 -17.229 -4.468 375 H LYS 48 H LYS 48 14.484 -16.131 -1.888 376 HA LYS 48 HA LYS 48 15.342 -18.372 -0.180 377 HB2 LYS 48 HB2 LYS 48 15.993 -16.758 1.560 378 HB3 LYS 48 HB1 LYS 48 16.969 -16.600 0.107 379 HG2 LYS 48 HG2 LYS 48 16.109 -14.552 -0.416 380 HG3 LYS 48 HG1 LYS 48 14.570 -14.873 0.384 381 HD2 LYS 48 HD2 LYS 48 15.539 -14.576 2.529 382 HD3 LYS 48 HD1 LYS 48 17.172 -14.478 1.849 383 HE2 LYS 48 HE2 LYS 48 16.472 -12.425 0.622 384 HE3 LYS 48 HE1 LYS 48 14.910 -12.513 1.434 385 HZ1 LYS 48 HZ1 LYS 48 17.544 -12.163 2.757 386 HZ2 LYS 48 HZ2 LYS 48 16.058 -12.258 3.558 387 HZ3 LYS 48 HZ3 LYS 48 16.384 -10.960 2.532 388 H GLU 49 H GLU 49 14.362 -18.156 2.042 389 HA GLU 49 HA GLU 49 11.553 -17.354 1.809 390 HB2 GLU 49 HB2 GLU 49 11.753 -19.711 2.255 391 HB3 GLU 49 HB1 GLU 49 12.933 -19.432 3.523 392 HG2 GLU 49 HG2 GLU 49 10.814 -20.052 4.487 393 HG3 GLU 49 HG1 GLU 49 11.190 -18.383 4.900 394 H LEU 50 H LEU 50 10.670 -16.087 3.379 395 HA LEU 50 HA LEU 50 12.577 -14.556 5.000 396 HB2 LEU 50 HB2 LEU 50 9.682 -13.945 4.392 397 HB3 LEU 50 HB1 LEU 50 10.850 -12.865 5.122 398 HG LEU 50 HG LEU 50 10.914 -13.866 2.280 399 HD11 LEU 50 HD11 LEU 50 9.125 -12.280 2.651 400 HD12 LEU 50 HD12 LEU 50 10.411 -11.549 1.692 401 HD13 LEU 50 HD13 LEU 50 10.253 -11.154 3.404 402 HD21 LEU 50 HD21 LEU 50 12.694 -11.899 3.717 403 HD22 LEU 50 HD22 LEU 50 12.732 -12.240 1.989 404 HD23 LEU 50 HD23 LEU 50 13.161 -13.501 3.143 405 H ARG 51 H ARG 51 10.895 -13.572 6.917 406 HA ARG 51 HA ARG 51 10.208 -15.985 8.405 407 HB2 ARG 51 HB2 ARG 51 10.250 -14.512 10.443 408 HB3 ARG 51 HB1 ARG 51 11.797 -14.716 9.649 409 HG2 ARG 51 HG2 ARG 51 10.102 -12.341 9.045 410 HG3 ARG 51 HG1 ARG 51 11.071 -12.390 10.516 411 HD2 ARG 51 HD2 ARG 51 12.091 -12.681 7.689 412 HD3 ARG 51 HD1 ARG 51 12.265 -11.264 8.719 413 HE ARG 51 HE ARG 51 13.373 -13.777 9.691 414 HH11 ARG 51 HH11 ARG 51 13.948 -10.651 8.212 415 HH12 ARG 51 HH12 ARG 51 15.632 -10.640 8.593 416 HH21 ARG 51 HH21 ARG 51 15.587 -13.779 10.188 417 HH22 ARG 51 HH22 ARG 51 16.577 -12.435 9.729 418 H ASN 52 H ASN 52 8.213 -16.471 8.775 419 HA ASN 52 HA ASN 52 6.160 -15.276 7.363 420 HB2 ASN 52 HB2 ASN 52 4.647 -16.811 8.593 421 HB3 ASN 52 HB1 ASN 52 6.063 -17.598 7.920 422 HD21 ASN 52 HD21 ASN 52 4.410 -16.659 10.826 423 HD22 ASN 52 HD22 ASN 52 5.415 -17.554 11.910 424 H ASP 53 H ASP 53 7.044 -14.676 10.733 425 HA ASP 53 HA ASP 53 4.528 -13.226 11.087 426 HB2 ASP 53 HB2 ASP 53 5.442 -14.842 12.830 427 HB3 ASP 53 HB1 ASP 53 6.634 -13.603 13.207 428 H TRP 54 H TRP 54 6.976 -12.234 9.503 429 HA TRP 54 HA TRP 54 7.233 -9.677 10.936 430 HB2 TRP 54 HB2 TRP 54 9.337 -10.990 10.457 431 HB3 TRP 54 HB1 TRP 54 9.040 -10.689 8.749 432 HD1 TRP 54 HD1 TRP 54 10.657 -8.883 7.963 433 HE1 TRP 54 HE1 TRP 54 11.536 -6.651 8.891 434 HE3 TRP 54 HE3 TRP 54 8.309 -8.904 12.513 435 HZ2 TRP 54 HZ2 TRP 54 11.261 -5.097 11.226 436 HZ3 TRP 54 HZ3 TRP 54 8.670 -7.004 14.028 437 HH2 TRP 54 HH2 TRP 54 10.115 -5.143 13.398 438 H THR 55 H THR 55 7.061 -7.733 9.748 439 HA THR 55 HA THR 55 4.954 -7.727 7.886 440 HB THR 55 HB THR 55 5.203 -5.821 9.321 441 HG1 THR 55 HG1 THR 55 4.898 -4.258 7.788 442 HG21 THR 55 HG21 THR 55 7.629 -5.885 9.645 443 HG22 THR 55 HG22 THR 55 7.109 -4.278 9.140 444 HG23 THR 55 HG23 THR 55 7.872 -5.364 7.977 445 H VAL 56 H VAL 56 4.876 -7.140 5.759 446 HA VAL 56 HA VAL 56 6.978 -8.112 4.109 447 HB VAL 56 HB VAL 56 4.580 -8.399 3.569 448 HG11 VAL 56 HG11 VAL 56 3.761 -6.261 4.395 449 HG12 VAL 56 HG12 VAL 56 3.245 -6.562 2.737 450 HG13 VAL 56 HG13 VAL 56 4.563 -5.433 3.059 451 HG21 VAL 56 HG21 VAL 56 6.201 -8.532 1.774 452 HG22 VAL 56 HG22 VAL 56 6.096 -6.789 1.523 453 HG23 VAL 56 HG23 VAL 56 4.698 -7.813 1.193 454 H GLN 57 H GLN 57 6.027 -5.031 5.339 455 HA GLN 57 HA GLN 57 7.083 -3.334 3.350 456 HB2 GLN 57 HB2 GLN 57 5.560 -2.849 5.432 457 HB3 GLN 57 HB1 GLN 57 7.085 -2.611 6.265 458 HG2 GLN 57 HG2 GLN 57 6.089 -1.056 3.878 459 HG3 GLN 57 HG1 GLN 57 6.143 -0.496 5.545 460 HE21 GLN 57 HE21 GLN 57 8.186 -0.052 6.480 461 HE22 GLN 57 HE22 GLN 57 9.565 0.292 5.493 462 H ASN 58 H ASN 58 8.433 -4.301 6.483 463 HA ASN 58 HA ASN 58 10.942 -3.079 6.113 464 HB2 ASN 58 HB2 ASN 58 9.962 -3.679 8.313 465 HB3 ASN 58 HB1 ASN 58 10.259 -5.374 7.952 466 HD21 ASN 58 HD21 ASN 58 11.701 -2.311 8.705 467 HD22 ASN 58 HD22 ASN 58 13.255 -2.924 9.146 468 H CYS 59 H CYS 59 9.715 -6.017 4.862 469 HA CYS 59 HA CYS 59 12.288 -7.270 4.573 470 HB2 CYS 59 HB2 CYS 59 9.594 -7.987 3.410 471 HB3 CYS 59 HB1 CYS 59 11.050 -8.961 3.232 472 HG CYS 59 HG CYS 59 9.103 -8.495 5.971 473 H ASP 60 H ASP 60 10.716 -4.797 3.008 474 HA ASP 60 HA ASP 60 10.996 -3.642 1.076 475 HB2 ASP 60 HB2 ASP 60 13.781 -4.784 1.355 476 HB3 ASP 60 HB1 ASP 60 13.346 -3.516 0.218 477 H LEU 61 H LEU 61 9.545 -5.621 0.323 478 HA LEU 61 HA LEU 61 10.724 -7.337 -1.612 479 HB2 LEU 61 HB2 LEU 61 7.895 -6.640 -0.916 480 HB3 LEU 61 HB1 LEU 61 8.228 -7.539 -2.378 481 HG LEU 61 HG LEU 61 9.315 -9.304 -1.023 482 HD11 LEU 61 HD11 LEU 61 8.332 -7.697 1.321 483 HD12 LEU 61 HD12 LEU 61 10.015 -7.975 0.876 484 HD13 LEU 61 HD13 LEU 61 9.005 -9.326 1.393 485 HD21 LEU 61 HD21 LEU 61 7.261 -10.207 -0.070 486 HD22 LEU 61 HD22 LEU 61 6.985 -9.492 -1.660 487 HD23 LEU 61 HD23 LEU 61 6.501 -8.621 -0.209 488 H ASP 62 H ASP 62 8.572 -4.553 -2.001 489 HA ASP 62 HA ASP 62 8.600 -4.322 -4.753 490 HB2 ASP 62 HB2 ASP 62 7.046 -2.996 -3.598 491 HB3 ASP 62 HB1 ASP 62 8.277 -2.302 -2.552 492 H GLN 63 H GLN 63 10.990 -3.212 -2.458 493 HA GLN 63 HA GLN 63 12.372 -1.525 -4.304 494 HB2 GLN 63 HB2 GLN 63 12.427 -1.094 -1.899 495 HB3 GLN 63 HB1 GLN 63 13.249 -2.625 -1.635 496 HG2 GLN 63 HG2 GLN 63 15.114 -1.763 -3.070 497 HG3 GLN 63 HG1 GLN 63 14.311 -0.197 -3.051 498 HE21 GLN 63 HE21 GLN 63 16.100 -2.520 -1.224 499 HE22 GLN 63 HE22 GLN 63 16.413 -1.513 0.147 500 H GLN 64 H GLN 64 12.773 -4.855 -3.215 501 HA GLN 64 HA GLN 64 15.353 -4.966 -4.547 502 HB2 GLN 64 HB2 GLN 64 13.993 -6.973 -2.778 503 HB3 GLN 64 HB1 GLN 64 15.585 -7.179 -3.490 504 HG2 GLN 64 HG2 GLN 64 16.403 -5.251 -2.276 505 HG3 GLN 64 HG1 GLN 64 14.798 -4.976 -1.602 506 HE21 GLN 64 HE21 GLN 64 14.009 -6.373 -0.046 507 HE22 GLN 64 HE22 GLN 64 15.048 -7.431 0.839 508 H SEP 65 H SEP 65 12.747 -7.422 -4.423 509 HA SEP 65 HA SEP 65 13.079 -7.747 -7.307 510 HB2 SEP 65 HB1 SEP 65 13.387 -10.187 -7.038 511 HB3 SEP 65 HB2 SEP 65 13.493 -9.955 -5.295 512 H ILE 66 H ILE 66 11.625 -9.733 -8.000 513 HA ILE 66 HA ILE 66 8.965 -9.129 -7.009 514 HB ILE 66 HB ILE 66 9.465 -9.202 -9.490 515 HG12 ILE 66 HG12 ILE 66 7.430 -11.271 -8.680 516 HG13 ILE 66 HG11 ILE 66 7.175 -9.542 -8.481 517 HG21 ILE 66 HG21 ILE 66 9.662 -12.171 -9.018 518 HG22 ILE 66 HG22 ILE 66 10.985 -11.108 -9.506 519 HG23 ILE 66 HG23 ILE 66 9.615 -11.375 -10.589 520 HD11 ILE 66 HD11 ILE 66 7.351 -9.215 -10.870 521 HD12 ILE 66 HD12 ILE 66 6.119 -10.424 -10.504 522 HD13 ILE 66 HD13 ILE 66 7.703 -10.928 -11.096 523 H VAL 67 H VAL 67 7.559 -10.729 -6.227 524 HA VAL 67 HA VAL 67 8.919 -12.819 -4.745 525 HB VAL 67 HB VAL 67 5.961 -12.248 -4.779 526 HG11 VAL 67 HG11 VAL 67 7.749 -13.478 -2.687 527 HG12 VAL 67 HG12 VAL 67 6.606 -14.337 -3.719 528 HG13 VAL 67 HG13 VAL 67 6.018 -13.187 -2.517 529 HG21 VAL 67 HG21 VAL 67 8.027 -10.968 -3.003 530 HG22 VAL 67 HG22 VAL 67 6.279 -10.747 -2.915 531 HG23 VAL 67 HG23 VAL 67 7.172 -10.170 -4.322 532 H HIS 68 H HIS 68 8.727 -14.976 -5.089 533 HA HIS 68 HA HIS 68 7.061 -15.825 -7.361 534 HB2 HIS 68 HB2 HIS 68 9.669 -16.896 -6.289 535 HB3 HIS 68 HB1 HIS 68 8.626 -17.871 -7.314 536 HD2 HIS 68 HD2 HIS 68 9.545 -14.086 -7.948 537 HE1 HIS 68 HE1 HIS 68 10.941 -16.479 -11.144 538 HE2 HIS 68 HE2 HIS 68 10.830 -14.136 -10.205 539 H ILE 69 H ILE 69 5.222 -16.625 -6.593 540 HA ILE 69 HA ILE 69 5.342 -18.189 -4.115 541 HB ILE 69 HB ILE 69 2.957 -16.887 -5.449 542 HG12 ILE 69 HG12 ILE 69 4.487 -16.259 -2.917 543 HG13 ILE 69 HG11 ILE 69 4.364 -15.259 -4.357 544 HG21 ILE 69 HG21 ILE 69 1.685 -17.612 -3.489 545 HG22 ILE 69 HG22 ILE 69 3.102 -18.471 -2.887 546 HG23 ILE 69 HG23 ILE 69 2.330 -18.987 -4.387 547 HD11 ILE 69 HD11 ILE 69 2.119 -15.929 -2.468 548 HD12 ILE 69 HD12 ILE 69 1.970 -14.959 -3.931 549 HD13 ILE 69 HD13 ILE 69 2.963 -14.386 -2.590 550 H VAL 70 H VAL 70 5.275 -20.288 -4.290 551 HA VAL 70 HA VAL 70 4.046 -21.415 -6.693 552 HB VAL 70 HB VAL 70 6.481 -21.627 -6.813 553 HG11 VAL 70 HG11 VAL 70 7.732 -22.997 -5.235 554 HG12 VAL 70 HG12 VAL 70 6.281 -23.188 -4.253 555 HG13 VAL 70 HG13 VAL 70 7.008 -21.593 -4.449 556 HG21 VAL 70 HG21 VAL 70 5.092 -24.255 -6.309 557 HG22 VAL 70 HG22 VAL 70 6.637 -24.067 -7.136 558 HG23 VAL 70 HG23 VAL 70 5.173 -23.383 -7.841 559 H GLN 71 H GLN 71 2.637 -23.044 -6.431 560 HA GLN 71 HA GLN 71 2.090 -23.879 -3.685 561 HB2 GLN 71 HB2 GLN 71 0.247 -22.799 -4.947 562 HB3 GLN 71 HB1 GLN 71 0.337 -24.089 -6.135 563 HG2 GLN 71 HG2 GLN 71 -0.287 -25.716 -4.444 564 HG3 GLN 71 HG1 GLN 71 -0.337 -24.443 -3.225 565 HE21 GLN 71 HE21 GLN 71 -2.438 -26.235 -4.120 566 HE22 GLN 71 HE22 GLN 71 -3.724 -25.228 -4.683 567 H ARG 72 H ARG 72 2.741 -25.817 -3.118 568 HA ARG 72 HA ARG 72 2.809 -27.939 -5.137 569 HB2 ARG 72 HB2 ARG 72 4.967 -27.322 -3.108 570 HB3 ARG 72 HB1 ARG 72 4.873 -28.839 -3.991 571 HG2 ARG 72 HG2 ARG 72 5.089 -27.606 -6.107 572 HG3 ARG 72 HG1 ARG 72 5.224 -26.100 -5.199 573 HD2 ARG 72 HD2 ARG 72 7.258 -26.920 -4.125 574 HD3 ARG 72 HD1 ARG 72 7.113 -28.446 -4.995 575 HE ARG 72 HE ARG 72 7.143 -26.622 -6.985 576 HH11 ARG 72 HH11 ARG 72 9.281 -27.176 -4.262 577 HH12 ARG 72 HH12 ARG 72 10.693 -26.600 -5.070 578 HH21 ARG 72 HH21 ARG 72 9.024 -25.839 -8.072 579 HH22 ARG 72 HH22 ARG 72 10.545 -25.827 -7.256 580 HA PRO 73 HA PRO 73 0.267 -29.246 -1.613 581 HB2 PRO 73 HB2 PRO 73 -1.217 -30.792 -3.580 582 HB3 PRO 73 HB1 PRO 73 -1.770 -29.448 -2.577 583 HG2 PRO 73 HG2 PRO 73 -1.461 -29.256 -5.273 584 HG3 PRO 73 HG1 PRO 73 -1.270 -27.879 -4.172 585 HD2 PRO 73 HD2 PRO 73 0.823 -29.591 -5.450 586 HD3 PRO 73 HD1 PRO 73 0.795 -27.829 -5.214 587 H TRP 74 H TRP 74 1.277 -30.708 -0.447 588 HA TRP 74 HA TRP 74 2.331 -33.140 -1.587 589 HB2 TRP 74 HB2 TRP 74 2.019 -32.384 1.329 590 HB3 TRP 74 HB1 TRP 74 3.026 -33.676 0.685 591 HD1 TRP 74 HD1 TRP 74 5.090 -32.713 -1.030 592 HE1 TRP 74 HE1 TRP 74 6.601 -30.658 -0.638 593 HE3 TRP 74 HE3 TRP 74 2.187 -30.208 2.347 594 HZ2 TRP 74 HZ2 TRP 74 6.556 -28.296 0.900 595 HZ3 TRP 74 HZ3 TRP 74 2.990 -28.059 3.231 596 HH2 TRP 74 HH2 TRP 74 5.130 -27.124 2.522 597 H ARG 75 H ARG 75 -0.536 -32.025 -0.075 598 HA ARG 75 HA ARG 75 -1.888 -34.519 -0.571 599 HB2 ARG 75 HB2 ARG 75 -0.808 -34.697 1.735 600 HB3 ARG 75 HB1 ARG 75 -1.891 -33.410 2.239 601 HG2 ARG 75 HG2 ARG 75 -2.850 -35.460 2.934 602 HG3 ARG 75 HG1 ARG 75 -3.805 -34.876 1.574 603 HD2 ARG 75 HD2 ARG 75 -1.557 -36.844 1.230 604 HD3 ARG 75 HD1 ARG 75 -3.197 -37.361 1.608 605 HE ARG 75 HE ARG 75 -3.724 -35.964 -0.521 606 HH11 ARG 75 HH11 ARG 75 -0.904 -37.999 -0.025 607 HH12 ARG 75 HH12 ARG 75 -0.757 -38.417 -1.698 608 HH21 ARG 75 HH21 ARG 75 -3.503 -36.520 -2.747 609 HH22 ARG 75 HH22 ARG 75 -2.212 -37.561 -3.239 610 H LYS 76 H LYS 76 -3.372 -33.503 -1.865 611 HA LYS 76 HA LYS 76 -4.988 -31.382 -0.616 612 HB2 LYS 76 HB2 LYS 76 -3.530 -30.494 -2.392 613 HB3 LYS 76 HB1 LYS 76 -4.277 -31.608 -3.523 614 HG2 LYS 76 HG2 LYS 76 -6.493 -30.456 -2.729 615 HG3 LYS 76 HG1 LYS 76 -5.399 -29.157 -2.252 616 HD2 LYS 76 HD2 LYS 76 -6.251 -28.765 -4.491 617 HD3 LYS 76 HD1 LYS 76 -4.515 -29.087 -4.545 618 HE2 LYS 76 HE2 LYS 76 -5.703 -30.286 -6.327 619 HE3 LYS 76 HE1 LYS 76 -4.943 -31.385 -5.178 620 HZ1 LYS 76 HZ1 LYS 76 -7.800 -30.627 -5.039 621 HZ2 LYS 76 HZ2 LYS 76 -7.009 -31.863 -4.183 622 HZ3 LYS 76 HZ3 LYS 76 -7.237 -31.996 -5.851 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 0.353 -1.110 0.589 2 H2 MET 1 HT2 MET 1 0.364 0.015 -0.674 3 H3 MET 1 HT3 MET 1 1.113 0.388 0.790 4 HA MET 1 HA MET 1 2.741 -0.168 -0.878 5 HB2 MET 1 HB2 MET 1 3.203 -0.719 1.460 6 HB3 MET 1 HB1 MET 1 2.418 -2.278 1.258 7 HG2 MET 1 HG2 MET 1 4.144 -2.891 -0.389 8 HG3 MET 1 HG1 MET 1 4.949 -1.351 -0.080 9 HE1 MET 1 HE1 MET 1 7.332 -3.946 1.638 10 HE2 MET 1 HE2 MET 1 7.226 -2.602 0.500 11 HE3 MET 1 HE3 MET 1 6.430 -4.132 0.136 12 H ILE 2 H ILE 2 2.742 -0.977 -2.825 13 HA ILE 2 HA ILE 2 1.290 -3.463 -3.366 14 HB ILE 2 HB ILE 2 2.379 -1.383 -5.274 15 HG12 ILE 2 HG12 ILE 2 -0.453 -2.120 -4.524 16 HG13 ILE 2 HG11 ILE 2 0.397 -0.663 -4.027 17 HG21 ILE 2 HG21 ILE 2 0.820 -3.897 -5.871 18 HG22 ILE 2 HG22 ILE 2 2.507 -3.593 -6.286 19 HG23 ILE 2 HG23 ILE 2 1.228 -2.643 -7.042 20 HD11 ILE 2 HD11 ILE 2 -1.174 -0.255 -5.847 21 HD12 ILE 2 HD12 ILE 2 -0.290 -1.396 -6.860 22 HD13 ILE 2 HD13 ILE 2 0.488 0.093 -6.323 23 H VAL 3 H VAL 3 2.365 -5.290 -3.552 24 HA VAL 3 HA VAL 3 5.201 -5.130 -4.296 25 HB VAL 3 HB VAL 3 5.592 -7.211 -3.050 26 HG11 VAL 3 HG11 VAL 3 4.284 -5.057 -1.398 27 HG12 VAL 3 HG12 VAL 3 5.968 -5.101 -1.920 28 HG13 VAL 3 HG13 VAL 3 5.365 -6.307 -0.781 29 HG21 VAL 3 HG21 VAL 3 2.721 -6.944 -2.156 30 HG22 VAL 3 HG22 VAL 3 3.897 -8.100 -1.528 31 HG23 VAL 3 HG23 VAL 3 3.369 -8.204 -3.209 32 H PHE 4 H PHE 4 5.997 -6.676 -5.718 33 HA PHE 4 HA PHE 4 3.949 -7.701 -7.508 34 HB2 PHE 4 HB2 PHE 4 6.942 -7.451 -7.856 35 HB3 PHE 4 HB1 PHE 4 5.825 -8.026 -9.090 36 HD1 PHE 4 HD1 PHE 4 7.067 -5.122 -7.284 37 HD2 PHE 4 HD2 PHE 4 4.269 -6.512 -10.163 38 HE1 PHE 4 HE1 PHE 4 6.657 -2.804 -7.994 39 HE2 PHE 4 HE2 PHE 4 3.854 -4.199 -10.883 40 HZ PHE 4 HZ PHE 4 5.046 -2.342 -9.798 41 H VAL 5 H VAL 5 3.476 -9.780 -7.717 42 HA VAL 5 HA VAL 5 5.311 -11.739 -6.578 43 HB VAL 5 HB VAL 5 3.863 -11.269 -4.742 44 HG11 VAL 5 HG11 VAL 5 2.078 -10.154 -5.907 45 HG12 VAL 5 HG12 VAL 5 1.434 -11.424 -4.868 46 HG13 VAL 5 HG13 VAL 5 1.552 -11.682 -6.610 47 HG21 VAL 5 HG21 VAL 5 2.728 -13.393 -4.377 48 HG22 VAL 5 HG22 VAL 5 4.345 -13.624 -5.049 49 HG23 VAL 5 HG23 VAL 5 2.923 -13.793 -6.083 50 H ARG 6 H ARG 6 5.435 -13.589 -7.636 51 HA ARG 6 HA ARG 6 3.608 -14.101 -9.887 52 HB2 ARG 6 HB2 ARG 6 6.448 -14.982 -9.340 53 HB3 ARG 6 HB1 ARG 6 5.472 -15.664 -10.624 54 HG2 ARG 6 HG2 ARG 6 5.302 -13.464 -11.657 55 HG3 ARG 6 HG1 ARG 6 6.295 -12.797 -10.357 56 HD2 ARG 6 HD2 ARG 6 8.173 -14.125 -11.015 57 HD3 ARG 6 HD1 ARG 6 7.194 -15.039 -12.161 58 HE ARG 6 HE ARG 6 6.929 -12.600 -13.151 59 HH11 ARG 6 HH11 ARG 6 9.823 -14.233 -12.011 60 HH12 ARG 6 HH12 ARG 6 10.883 -13.380 -13.073 61 HH21 ARG 6 HH21 ARG 6 8.342 -11.485 -14.585 62 HH22 ARG 6 HH22 ARG 6 10.037 -11.810 -14.541 63 H PHE 7 H PHE 7 2.026 -15.481 -9.205 64 HA PHE 7 HA PHE 7 2.624 -17.515 -7.255 65 HB2 PHE 7 HB2 PHE 7 0.370 -16.477 -7.321 66 HB3 PHE 7 HB1 PHE 7 0.117 -17.158 -8.928 67 HD1 PHE 7 HD1 PHE 7 0.446 -17.920 -5.361 68 HD2 PHE 7 HD2 PHE 7 -0.388 -19.491 -9.225 69 HE1 PHE 7 HE1 PHE 7 -0.367 -19.998 -4.339 70 HE2 PHE 7 HE2 PHE 7 -1.201 -21.575 -8.207 71 HZ PHE 7 HZ PHE 7 -1.180 -21.835 -5.759 72 H ASN 8 H ASN 8 3.319 -19.494 -7.649 73 HA ASN 8 HA ASN 8 4.001 -21.373 -8.725 74 HB2 ASN 8 HB2 ASN 8 1.564 -21.462 -9.416 75 HB3 ASN 8 HB1 ASN 8 2.010 -20.636 -10.902 76 HD21 ASN 8 HD21 ASN 8 3.885 -23.157 -9.278 77 HD22 ASN 8 HD22 ASN 8 3.724 -24.322 -10.540 78 H SER 9 H SER 9 4.929 -18.529 -9.371 79 HA SER 9 HA SER 9 6.443 -17.451 -10.662 80 HB2 SER 9 HB2 SER 9 7.254 -20.275 -11.395 81 HB3 SER 9 HB1 SER 9 8.221 -18.828 -11.690 82 HG SER 9 HG SER 9 8.535 -18.568 -9.550 83 H SER 10 H SER 10 3.817 -18.037 -11.766 84 HA SER 10 HA SER 10 3.979 -18.768 -14.481 85 HB2 SER 10 HB2 SER 10 1.894 -18.902 -13.204 86 HB3 SER 10 HB1 SER 10 1.864 -17.149 -13.045 87 HG SER 10 HG SER 10 1.385 -16.947 -15.168 88 H HIS 11 H HIS 11 2.901 -15.531 -13.449 89 HA HIS 11 HA HIS 11 4.676 -14.383 -15.474 90 HB2 HIS 11 HB2 HIS 11 2.835 -12.905 -16.241 91 HB3 HIS 11 HB1 HIS 11 2.553 -14.605 -16.574 92 HD2 HIS 11 HD2 HIS 11 0.816 -11.653 -15.099 93 HE1 HIS 11 HE1 HIS 11 -1.239 -15.054 -13.645 94 HE2 HIS 11 HE2 HIS 11 -1.411 -12.576 -14.131 95 H GLY 12 H GLY 12 2.323 -13.324 -12.994 96 HA2 GLY 12 HA2 GLY 12 3.520 -12.274 -11.014 97 HA3 GLY 12 HA1 GLY 12 4.298 -11.276 -12.232 98 H PHE 13 H PHE 13 2.201 -11.019 -9.925 99 HA PHE 13 HA PHE 13 0.649 -9.002 -11.339 100 HB2 PHE 13 HB2 PHE 13 -1.359 -9.703 -9.909 101 HB3 PHE 13 HB1 PHE 13 -0.952 -10.737 -11.268 102 HD1 PHE 13 HD1 PHE 13 -1.048 -10.448 -7.625 103 HD2 PHE 13 HD2 PHE 13 -0.073 -12.965 -10.913 104 HE1 PHE 13 HE1 PHE 13 -0.973 -12.386 -6.116 105 HE2 PHE 13 HE2 PHE 13 0.010 -14.904 -9.407 106 HZ PHE 13 HZ PHE 13 -0.444 -14.616 -7.006 107 HA PRO 14 HA PRO 14 1.745 -6.724 -7.723 108 HB2 PRO 14 HB2 PRO 14 0.341 -4.499 -8.130 109 HB3 PRO 14 HB1 PRO 14 1.630 -4.977 -9.241 110 HG2 PRO 14 HG2 PRO 14 -1.324 -5.176 -9.571 111 HG3 PRO 14 HG1 PRO 14 -0.078 -4.843 -10.784 112 HD2 PRO 14 HD2 PRO 14 -1.306 -7.331 -10.287 113 HD3 PRO 14 HD1 PRO 14 0.148 -7.051 -11.264 114 H VAL 15 H VAL 15 1.080 -7.433 -5.777 115 HA VAL 15 HA VAL 15 -1.763 -7.267 -5.100 116 HB VAL 15 HB VAL 15 0.518 -8.771 -3.771 117 HG11 VAL 15 HG11 VAL 15 -1.102 -9.562 -2.122 118 HG12 VAL 15 HG12 VAL 15 -2.346 -8.530 -2.829 119 HG13 VAL 15 HG13 VAL 15 -0.946 -7.807 -2.037 120 HG21 VAL 15 HG21 VAL 15 -2.054 -9.662 -5.063 121 HG22 VAL 15 HG22 VAL 15 -0.880 -10.718 -4.279 122 HG23 VAL 15 HG23 VAL 15 -0.431 -9.828 -5.733 123 H GLU 16 H GLU 16 -2.498 -5.700 -3.857 124 HA GLU 16 HA GLU 16 -0.569 -3.869 -2.678 125 HB2 GLU 16 HB2 GLU 16 -2.290 -2.934 -4.156 126 HB3 GLU 16 HB1 GLU 16 -3.542 -3.567 -3.099 127 HG2 GLU 16 HG2 GLU 16 -2.884 -2.101 -1.329 128 HG3 GLU 16 HG1 GLU 16 -1.464 -1.577 -2.233 129 H VAL 17 H VAL 17 -0.065 -4.056 -0.649 130 HA VAL 17 HA VAL 17 -2.092 -5.002 1.259 131 HB VAL 17 HB VAL 17 -0.254 -5.996 2.598 132 HG11 VAL 17 HG11 VAL 17 0.077 -7.973 1.215 133 HG12 VAL 17 HG12 VAL 17 -0.418 -7.071 -0.214 134 HG13 VAL 17 HG13 VAL 17 -1.581 -7.388 1.074 135 HG21 VAL 17 HG21 VAL 17 1.611 -4.668 1.797 136 HG22 VAL 17 HG22 VAL 17 1.438 -5.354 0.182 137 HG23 VAL 17 HG23 VAL 17 1.938 -6.380 1.524 138 H ASP 18 H ASP 18 -1.090 -4.477 3.587 139 HA ASP 18 HA ASP 18 -0.815 -1.569 3.606 140 HB2 ASP 18 HB2 ASP 18 -1.306 -3.535 5.852 141 HB3 ASP 18 HB1 ASP 18 -1.246 -1.787 6.040 142 H SER 19 H SER 19 0.615 -0.702 5.422 143 HA SER 19 HA SER 19 3.289 -1.427 4.953 144 HB2 SER 19 HB2 SER 19 2.195 0.113 7.319 145 HB3 SER 19 HB1 SER 19 3.833 0.191 6.665 146 HG SER 19 HG SER 19 2.118 0.686 4.694 147 H ASP 20 H ASP 20 0.991 -2.284 7.464 148 HA ASP 20 HA ASP 20 3.009 -3.941 8.770 149 HB2 ASP 20 HB2 ASP 20 1.621 -2.310 10.143 150 HB3 ASP 20 HB1 ASP 20 0.233 -3.333 9.797 151 H THR 21 H THR 21 2.757 -5.216 6.767 152 HA THR 21 HA THR 21 0.594 -7.180 7.121 153 HB THR 21 HB THR 21 2.048 -6.518 4.548 154 HG1 THR 21 HG1 THR 21 0.692 -4.884 4.735 155 HG21 THR 21 HG21 THR 21 0.307 -7.918 3.497 156 HG22 THR 21 HG22 THR 21 -0.317 -8.326 5.095 157 HG23 THR 21 HG23 THR 21 1.303 -8.842 4.620 158 H SER 22 H SER 22 1.411 -8.927 8.098 159 HA SER 22 HA SER 22 4.171 -9.623 7.961 160 HB2 SER 22 HB2 SER 22 1.827 -11.265 8.954 161 HB3 SER 22 HB1 SER 22 3.530 -11.551 9.313 162 HG SER 22 HG SER 22 3.258 -10.254 10.927 163 H ILE 23 H ILE 23 5.080 -11.489 6.980 164 HA ILE 23 HA ILE 23 4.297 -11.985 4.350 165 HB ILE 23 HB ILE 23 5.970 -13.833 6.078 166 HG12 ILE 23 HG12 ILE 23 6.844 -11.540 6.151 167 HG13 ILE 23 HG11 ILE 23 7.918 -12.591 5.236 168 HG21 ILE 23 HG21 ILE 23 5.309 -14.888 3.999 169 HG22 ILE 23 HG22 ILE 23 7.024 -14.473 3.928 170 HG23 ILE 23 HG23 ILE 23 5.842 -13.479 3.082 171 HD11 ILE 23 HD11 ILE 23 7.697 -10.426 4.170 172 HD12 ILE 23 HD12 ILE 23 5.947 -10.626 4.079 173 HD13 ILE 23 HD13 ILE 23 7.005 -11.689 3.149 174 H PHE 24 H PHE 24 3.485 -13.693 7.311 175 HA PHE 24 HA PHE 24 2.211 -15.975 6.288 176 HB2 PHE 24 HB2 PHE 24 2.708 -15.459 8.713 177 HB3 PHE 24 HB1 PHE 24 1.343 -14.354 8.689 178 HD1 PHE 24 HD1 PHE 24 2.204 -17.911 8.024 179 HD2 PHE 24 HD2 PHE 24 -0.753 -15.119 9.267 180 HE1 PHE 24 HE1 PHE 24 0.709 -19.765 8.610 181 HE2 PHE 24 HE2 PHE 24 -2.257 -16.972 9.857 182 HZ PHE 24 HZ PHE 24 -1.527 -19.299 9.531 183 H GLN 25 H GLN 25 0.879 -12.782 7.034 184 HA GLN 25 HA GLN 25 -1.737 -13.336 6.139 185 HB2 GLN 25 HB2 GLN 25 -0.316 -10.681 6.334 186 HB3 GLN 25 HB1 GLN 25 -2.053 -10.909 6.193 187 HG2 GLN 25 HG2 GLN 25 -2.139 -11.970 8.344 188 HG3 GLN 25 HG1 GLN 25 -0.383 -11.918 8.479 189 HE21 GLN 25 HE21 GLN 25 -3.321 -10.092 8.601 190 HE22 GLN 25 HE22 GLN 25 -2.635 -8.669 9.300 191 H LEU 26 H LEU 26 1.079 -11.861 4.597 192 HA LEU 26 HA LEU 26 -0.075 -11.119 2.168 193 HB2 LEU 26 HB2 LEU 26 2.152 -10.414 2.851 194 HB3 LEU 26 HB1 LEU 26 2.729 -12.064 2.761 195 HG LEU 26 HG LEU 26 2.417 -12.047 0.323 196 HD11 LEU 26 HD11 LEU 26 1.910 -9.966 -0.839 197 HD12 LEU 26 HD12 LEU 26 1.661 -9.154 0.705 198 HD13 LEU 26 HD13 LEU 26 0.569 -10.446 0.203 199 HD21 LEU 26 HD21 LEU 26 4.036 -9.745 1.399 200 HD22 LEU 26 HD22 LEU 26 4.230 -10.474 -0.195 201 HD23 LEU 26 HD23 LEU 26 4.571 -11.420 1.256 202 H LYS 27 H LYS 27 1.375 -14.186 3.159 203 HA LYS 27 HA LYS 27 1.153 -15.565 0.731 204 HB2 LYS 27 HB2 LYS 27 2.473 -16.375 2.653 205 HB3 LYS 27 HB1 LYS 27 0.990 -16.619 3.566 206 HG2 LYS 27 HG2 LYS 27 0.307 -18.395 2.124 207 HG3 LYS 27 HG1 LYS 27 1.632 -18.063 1.006 208 HD2 LYS 27 HD2 LYS 27 2.159 -20.002 2.379 209 HD3 LYS 27 HD1 LYS 27 3.249 -18.672 2.761 210 HE2 LYS 27 HE2 LYS 27 2.534 -19.771 4.800 211 HE3 LYS 27 HE1 LYS 27 1.871 -18.141 4.738 212 HZ1 LYS 27 HZ1 LYS 27 -0.251 -19.006 4.104 213 HZ2 LYS 27 HZ2 LYS 27 0.264 -19.835 5.480 214 HZ3 LYS 27 HZ3 LYS 27 0.359 -20.580 3.967 215 H GLU 28 H GLU 28 -1.057 -15.245 3.450 216 HA GLU 28 HA GLU 28 -3.070 -16.926 2.412 217 HB2 GLU 28 HB2 GLU 28 -2.831 -15.014 4.665 218 HB3 GLU 28 HB1 GLU 28 -4.453 -15.451 4.149 219 HG2 GLU 28 HG2 GLU 28 -3.531 -16.817 6.024 220 HG3 GLU 28 HG1 GLU 28 -4.085 -17.751 4.638 221 H VAL 29 H VAL 29 -2.458 -13.474 2.097 222 HA VAL 29 HA VAL 29 -4.938 -12.745 0.970 223 HB VAL 29 HB VAL 29 -2.199 -11.521 0.512 224 HG11 VAL 29 HG11 VAL 29 -3.398 -9.533 -0.289 225 HG12 VAL 29 HG12 VAL 29 -4.924 -10.406 -0.162 226 HG13 VAL 29 HG13 VAL 29 -3.703 -10.932 -1.319 227 HG21 VAL 29 HG21 VAL 29 -4.467 -10.702 2.329 228 HG22 VAL 29 HG22 VAL 29 -2.955 -9.819 2.109 229 HG23 VAL 29 HG23 VAL 29 -2.941 -11.428 2.835 230 H VAL 30 H VAL 30 -1.918 -13.836 -0.519 231 HA VAL 30 HA VAL 30 -2.915 -13.724 -3.182 232 HB VAL 30 HB VAL 30 -0.613 -15.363 -2.089 233 HG11 VAL 30 HG11 VAL 30 -1.244 -14.516 -4.917 234 HG12 VAL 30 HG12 VAL 30 -1.363 -16.153 -4.275 235 HG13 VAL 30 HG13 VAL 30 0.212 -15.368 -4.400 236 HG21 VAL 30 HG21 VAL 30 -0.639 -12.606 -3.317 237 HG22 VAL 30 HG22 VAL 30 0.807 -13.517 -2.878 238 HG23 VAL 30 HG23 VAL 30 -0.320 -12.992 -1.626 239 H ALA 31 H ALA 31 -2.772 -16.202 -0.701 240 HA ALA 31 HA ALA 31 -3.537 -18.408 -2.236 241 HB1 ALA 31 HB1 ALA 31 -2.630 -18.555 0.038 242 HB2 ALA 31 HB2 ALA 31 -4.129 -19.464 -0.147 243 HB3 ALA 31 HB3 ALA 31 -4.142 -17.900 0.667 244 H LYS 32 H LYS 32 -5.553 -16.147 -0.343 245 HA LYS 32 HA LYS 32 -8.000 -17.412 -1.067 246 HB2 LYS 32 HB2 LYS 32 -9.122 -15.476 -0.120 247 HB3 LYS 32 HB1 LYS 32 -7.792 -15.949 0.926 248 HG2 LYS 32 HG2 LYS 32 -6.460 -14.120 0.203 249 HG3 LYS 32 HG1 LYS 32 -7.580 -13.741 -1.104 250 HD2 LYS 32 HD2 LYS 32 -7.881 -12.157 0.692 251 HD3 LYS 32 HD1 LYS 32 -9.305 -13.192 0.587 252 HE2 LYS 32 HE2 LYS 32 -8.483 -14.525 2.455 253 HE3 LYS 32 HE1 LYS 32 -7.030 -13.532 2.538 254 HZ1 LYS 32 HZ1 LYS 32 -9.814 -12.625 3.042 255 HZ2 LYS 32 HZ2 LYS 32 -8.467 -11.612 3.013 256 HZ3 LYS 32 HZ3 LYS 32 -8.587 -12.811 4.194 257 H ARG 33 H ARG 33 -6.019 -14.964 -2.523 258 HA ARG 33 HA ARG 33 -7.887 -13.870 -4.328 259 HB2 ARG 33 HB2 ARG 33 -5.625 -12.931 -3.712 260 HB3 ARG 33 HB1 ARG 33 -4.915 -14.158 -4.753 261 HG2 ARG 33 HG2 ARG 33 -6.185 -13.218 -6.654 262 HG3 ARG 33 HG1 ARG 33 -6.760 -11.931 -5.591 263 HD2 ARG 33 HD2 ARG 33 -4.336 -11.418 -5.112 264 HD3 ARG 33 HD1 ARG 33 -3.929 -12.516 -6.428 265 HE ARG 33 HE ARG 33 -5.297 -9.933 -6.656 266 HH11 ARG 33 HH11 ARG 33 -3.904 -12.751 -8.242 267 HH12 ARG 33 HH12 ARG 33 -3.726 -11.965 -9.767 268 HH21 ARG 33 HH21 ARG 33 -5.052 -8.885 -8.672 269 HH22 ARG 33 HH22 ARG 33 -4.375 -9.732 -10.019 270 H GLN 34 H GLN 34 -5.428 -16.388 -4.734 271 HA GLN 34 HA GLN 34 -6.323 -16.971 -7.414 272 HB2 GLN 34 HB2 GLN 34 -4.291 -18.436 -5.731 273 HB3 GLN 34 HB1 GLN 34 -4.498 -18.558 -7.473 274 HG2 GLN 34 HG2 GLN 34 -3.627 -16.097 -5.970 275 HG3 GLN 34 HG1 GLN 34 -2.574 -17.168 -6.882 276 HE21 GLN 34 HE21 GLN 34 -4.567 -17.523 -9.009 277 HE22 GLN 34 HE22 GLN 34 -4.558 -16.057 -9.918 278 H GLY 35 H GLY 35 -7.185 -17.995 -4.302 279 HA2 GLY 35 HA2 GLY 35 -8.806 -19.509 -3.650 280 HA3 GLY 35 HA1 GLY 35 -9.055 -19.904 -5.346 281 H VAL 36 H VAL 36 -6.215 -20.120 -3.255 282 HA VAL 36 HA VAL 36 -6.109 -23.008 -3.817 283 HB VAL 36 HB VAL 36 -3.651 -22.851 -3.889 284 HG11 VAL 36 HG11 VAL 36 -5.023 -21.035 -5.861 285 HG12 VAL 36 HG12 VAL 36 -4.869 -22.788 -5.981 286 HG13 VAL 36 HG13 VAL 36 -3.433 -21.768 -6.074 287 HG21 VAL 36 HG21 VAL 36 -2.538 -20.674 -4.046 288 HG22 VAL 36 HG22 VAL 36 -3.373 -20.850 -2.499 289 HG23 VAL 36 HG23 VAL 36 -4.083 -19.865 -3.778 290 HA PRO 37 HA PRO 37 -5.729 -23.701 0.541 291 HB2 PRO 37 HB2 PRO 37 -3.727 -25.619 0.582 292 HB3 PRO 37 HB1 PRO 37 -5.433 -25.953 0.278 293 HG2 PRO 37 HG2 PRO 37 -3.186 -25.628 -1.662 294 HG3 PRO 37 HG1 PRO 37 -4.548 -26.763 -1.700 295 HD2 PRO 37 HD2 PRO 37 -4.494 -24.571 -3.248 296 HD3 PRO 37 HD1 PRO 37 -6.007 -25.172 -2.548 297 H ALA 38 H ALA 38 -4.887 -22.099 1.686 298 HA ALA 38 HA ALA 38 -2.341 -20.936 1.231 299 HB1 ALA 38 HB1 ALA 38 -4.231 -19.701 2.146 300 HB2 ALA 38 HB2 ALA 38 -2.820 -19.604 3.202 301 HB3 ALA 38 HB3 ALA 38 -4.162 -20.676 3.613 302 H ASP 39 H ASP 39 -3.469 -23.481 3.281 303 HA ASP 39 HA ASP 39 -1.316 -23.506 5.131 304 HB2 ASP 39 HB2 ASP 39 -3.439 -24.571 5.656 305 HB3 ASP 39 HB1 ASP 39 -3.241 -25.690 4.315 306 H GLN 40 H GLN 40 -1.793 -24.862 1.975 307 HA GLN 40 HA GLN 40 0.709 -26.390 2.156 308 HB2 GLN 40 HB2 GLN 40 -1.491 -26.449 0.080 309 HB3 GLN 40 HB1 GLN 40 -0.071 -27.485 0.086 310 HG2 GLN 40 HG2 GLN 40 -0.781 -28.614 2.036 311 HG3 GLN 40 HG1 GLN 40 -2.037 -27.421 2.353 312 HE21 GLN 40 HE21 GLN 40 -3.630 -28.955 2.415 313 HE22 GLN 40 HE22 GLN 40 -4.220 -29.752 1.004 314 H LEU 41 H LEU 41 0.338 -23.418 1.808 315 HA LEU 41 HA LEU 41 1.519 -23.054 -0.842 316 HB2 LEU 41 HB2 LEU 41 -0.533 -21.764 -0.114 317 HB3 LEU 41 HB1 LEU 41 0.495 -20.925 1.026 318 HG LEU 41 HG LEU 41 1.814 -20.004 -0.808 319 HD11 LEU 41 HD11 LEU 41 1.599 -21.835 -2.387 320 HD12 LEU 41 HD12 LEU 41 1.079 -20.321 -3.117 321 HD13 LEU 41 HD13 LEU 41 -0.121 -21.494 -2.572 322 HD21 LEU 41 HD21 LEU 41 0.116 -18.528 -1.740 323 HD22 LEU 41 HD22 LEU 41 -0.157 -18.785 -0.016 324 HD23 LEU 41 HD23 LEU 41 -1.151 -19.630 -1.202 325 H ARG 42 H ARG 42 3.482 -21.981 -1.121 326 HA ARG 42 HA ARG 42 5.086 -21.483 1.297 327 HB2 ARG 42 HB2 ARG 42 5.651 -23.691 0.366 328 HB3 ARG 42 HB1 ARG 42 5.948 -22.963 -1.201 329 HG2 ARG 42 HG2 ARG 42 8.021 -23.474 -0.017 330 HG3 ARG 42 HG1 ARG 42 7.839 -21.742 -0.307 331 HD2 ARG 42 HD2 ARG 42 8.663 -22.331 1.967 332 HD3 ARG 42 HD1 ARG 42 7.195 -21.352 1.934 333 HE ARG 42 HE ARG 42 6.320 -23.957 2.071 334 HH11 ARG 42 HH11 ARG 42 8.421 -21.981 4.072 335 HH12 ARG 42 HH12 ARG 42 7.936 -22.744 5.542 336 HH21 ARG 42 HH21 ARG 42 5.686 -24.966 4.032 337 HH22 ARG 42 HH22 ARG 42 6.373 -24.445 5.527 338 H VAL 43 H VAL 43 6.305 -19.620 1.213 339 HA VAL 43 HA VAL 43 6.103 -18.107 -1.280 340 HB VAL 43 HB VAL 43 6.643 -16.082 0.088 341 HG11 VAL 43 HG11 VAL 43 4.239 -17.668 0.978 342 HG12 VAL 43 HG12 VAL 43 4.336 -16.628 -0.443 343 HG13 VAL 43 HG13 VAL 43 4.448 -15.927 1.170 344 HG21 VAL 43 HG21 VAL 43 6.484 -16.210 2.523 345 HG22 VAL 43 HG22 VAL 43 7.819 -17.201 1.930 346 HG23 VAL 43 HG23 VAL 43 6.306 -17.961 2.425 347 H ILE 44 H ILE 44 7.816 -17.802 -2.522 348 HA ILE 44 HA ILE 44 10.493 -18.094 -1.327 349 HB ILE 44 HB ILE 44 9.646 -18.774 -4.161 350 HG12 ILE 44 HG12 ILE 44 8.838 -20.435 -2.533 351 HG13 ILE 44 HG11 ILE 44 10.094 -21.111 -3.562 352 HG21 ILE 44 HG21 ILE 44 12.334 -19.079 -2.820 353 HG22 ILE 44 HG22 ILE 44 11.926 -17.931 -4.094 354 HG23 ILE 44 HG23 ILE 44 11.924 -19.662 -4.433 355 HD11 ILE 44 HD11 ILE 44 10.369 -21.825 -1.266 356 HD12 ILE 44 HD12 ILE 44 10.442 -20.147 -0.733 357 HD13 ILE 44 HD13 ILE 44 11.721 -20.802 -1.757 358 H PHE 45 H PHE 45 11.836 -16.426 -1.595 359 HA PHE 45 HA PHE 45 11.078 -14.355 -3.530 360 HB2 PHE 45 HB2 PHE 45 10.746 -13.634 -1.171 361 HB3 PHE 45 HB1 PHE 45 12.458 -13.924 -0.874 362 HD1 PHE 45 HD1 PHE 45 10.214 -12.029 -3.150 363 HD2 PHE 45 HD2 PHE 45 13.936 -12.168 -1.102 364 HE1 PHE 45 HE1 PHE 45 10.709 -9.746 -3.910 365 HE2 PHE 45 HE2 PHE 45 14.441 -9.883 -1.859 366 HZ PHE 45 HZ PHE 45 12.823 -8.674 -3.266 367 H ALA 46 H ALA 46 12.381 -14.444 -5.163 368 HA ALA 46 HA ALA 46 14.226 -14.438 -6.452 369 HB1 ALA 46 HB1 ALA 46 16.377 -13.765 -5.539 370 HB2 ALA 46 HB2 ALA 46 15.783 -14.014 -3.898 371 HB3 ALA 46 HB3 ALA 46 15.094 -12.737 -4.901 372 H GLY 47 H GLY 47 15.320 -16.079 -3.491 373 HA2 GLY 47 HA2 GLY 47 15.391 -18.626 -4.857 374 HA3 GLY 47 HA1 GLY 47 16.982 -17.956 -4.545 375 H LYS 48 H LYS 48 14.571 -17.167 -2.256 376 HA LYS 48 HA LYS 48 15.125 -19.452 -0.569 377 HB2 LYS 48 HB2 LYS 48 15.705 -17.891 1.376 378 HB3 LYS 48 HB1 LYS 48 16.954 -18.170 0.180 379 HG2 LYS 48 HG2 LYS 48 16.962 -15.850 0.820 380 HG3 LYS 48 HG1 LYS 48 16.412 -15.977 -0.847 381 HD2 LYS 48 HD2 LYS 48 14.144 -15.601 -0.200 382 HD3 LYS 48 HD1 LYS 48 14.540 -15.756 1.508 383 HE2 LYS 48 HE2 LYS 48 15.619 -13.598 -0.303 384 HE3 LYS 48 HE1 LYS 48 14.206 -13.407 0.736 385 HZ1 LYS 48 HZ1 LYS 48 15.638 -13.901 2.648 386 HZ2 LYS 48 HZ2 LYS 48 16.134 -12.518 1.816 387 HZ3 LYS 48 HZ3 LYS 48 16.983 -13.966 1.625 388 H GLU 49 H GLU 49 13.781 -19.355 1.465 389 HA GLU 49 HA GLU 49 11.227 -18.147 0.739 390 HB2 GLU 49 HB2 GLU 49 10.232 -19.638 2.433 391 HB3 GLU 49 HB1 GLU 49 11.098 -20.514 1.186 392 HG2 GLU 49 HG2 GLU 49 12.945 -20.895 2.675 393 HG3 GLU 49 HG1 GLU 49 12.185 -19.898 3.918 394 H LEU 50 H LEU 50 9.907 -17.194 2.456 395 HA LEU 50 HA LEU 50 11.609 -15.578 4.220 396 HB2 LEU 50 HB2 LEU 50 8.802 -15.004 3.293 397 HB3 LEU 50 HB1 LEU 50 9.825 -13.930 4.224 398 HG LEU 50 HG LEU 50 10.188 -14.757 1.356 399 HD11 LEU 50 HD11 LEU 50 8.455 -13.107 1.688 400 HD12 LEU 50 HD12 LEU 50 9.857 -12.379 0.901 401 HD13 LEU 50 HD13 LEU 50 9.564 -12.100 2.619 402 HD21 LEU 50 HD21 LEU 50 12.109 -13.210 1.340 403 HD22 LEU 50 HD22 LEU 50 12.373 -14.585 2.408 404 HD23 LEU 50 HD23 LEU 50 11.948 -13.014 3.085 405 H ARG 51 H ARG 51 10.973 -15.207 6.362 406 HA ARG 51 HA ARG 51 9.618 -17.349 7.659 407 HB2 ARG 51 HB2 ARG 51 9.892 -16.050 9.719 408 HB3 ARG 51 HB1 ARG 51 11.389 -16.056 8.800 409 HG2 ARG 51 HG2 ARG 51 9.618 -13.788 8.234 410 HG3 ARG 51 HG1 ARG 51 10.239 -13.852 9.883 411 HD2 ARG 51 HD2 ARG 51 11.997 -14.115 7.459 412 HD3 ARG 51 HD1 ARG 51 11.630 -12.562 8.206 413 HE ARG 51 HE ARG 51 12.513 -14.079 10.270 414 HH11 ARG 51 HH11 ARG 51 13.870 -13.348 7.121 415 HH12 ARG 51 HH12 ARG 51 15.504 -13.338 7.679 416 HH21 ARG 51 HH21 ARG 51 14.678 -14.081 11.019 417 HH22 ARG 51 HH22 ARG 51 15.966 -13.768 9.913 418 H ASN 52 H ASN 52 7.604 -17.198 8.862 419 HA ASN 52 HA ASN 52 5.669 -15.711 7.323 420 HB2 ASN 52 HB2 ASN 52 3.951 -16.941 8.509 421 HB3 ASN 52 HB1 ASN 52 5.204 -18.050 7.978 422 HD21 ASN 52 HD21 ASN 52 6.386 -19.159 9.486 423 HD22 ASN 52 HD22 ASN 52 6.025 -19.130 11.176 424 H ASP 53 H ASP 53 7.224 -15.339 10.390 425 HA ASP 53 HA ASP 53 5.266 -13.304 11.150 426 HB2 ASP 53 HB2 ASP 53 5.691 -15.044 12.838 427 HB3 ASP 53 HB1 ASP 53 7.392 -14.593 12.871 428 H TRP 54 H TRP 54 6.210 -12.016 9.470 429 HA TRP 54 HA TRP 54 7.862 -10.017 10.645 430 HB2 TRP 54 HB2 TRP 54 9.560 -11.704 9.824 431 HB3 TRP 54 HB1 TRP 54 9.000 -11.371 8.191 432 HD1 TRP 54 HD1 TRP 54 10.717 -9.884 7.031 433 HE1 TRP 54 HE1 TRP 54 12.143 -7.844 7.673 434 HE3 TRP 54 HE3 TRP 54 9.371 -9.461 11.950 435 HZ2 TRP 54 HZ2 TRP 54 12.630 -6.261 9.953 436 HZ3 TRP 54 HZ3 TRP 54 10.364 -7.651 13.288 437 HH2 TRP 54 HH2 TRP 54 11.959 -6.087 12.309 438 H THR 55 H THR 55 7.799 -8.066 9.466 439 HA THR 55 HA THR 55 5.458 -7.864 7.817 440 HB THR 55 HB THR 55 5.770 -6.139 9.461 441 HG1 THR 55 HG1 THR 55 5.294 -4.479 8.154 442 HG21 THR 55 HG21 THR 55 8.384 -5.539 8.071 443 HG22 THR 55 HG22 THR 55 8.194 -6.201 9.694 444 HG23 THR 55 HG23 THR 55 7.667 -4.557 9.345 445 H VAL 56 H VAL 56 5.318 -7.236 5.731 446 HA VAL 56 HA VAL 56 7.486 -7.910 4.012 447 HB VAL 56 HB VAL 56 5.138 -8.353 3.398 448 HG11 VAL 56 HG11 VAL 56 3.659 -6.553 2.690 449 HG12 VAL 56 HG12 VAL 56 4.872 -5.363 3.156 450 HG13 VAL 56 HG13 VAL 56 4.114 -6.374 4.384 451 HG21 VAL 56 HG21 VAL 56 5.240 -7.620 1.084 452 HG22 VAL 56 HG22 VAL 56 6.831 -8.137 1.641 453 HG23 VAL 56 HG23 VAL 56 6.462 -6.421 1.502 454 H GLN 57 H GLN 57 6.315 -4.988 5.441 455 HA GLN 57 HA GLN 57 7.240 -3.124 3.560 456 HB2 GLN 57 HB2 GLN 57 5.669 -2.508 5.304 457 HB3 GLN 57 HB1 GLN 57 6.884 -2.818 6.537 458 HG2 GLN 57 HG2 GLN 57 8.245 -1.004 5.692 459 HG3 GLN 57 HG1 GLN 57 7.085 -0.718 4.399 460 HE21 GLN 57 HE21 GLN 57 6.716 1.370 5.036 461 HE22 GLN 57 HE22 GLN 57 5.813 1.766 6.455 462 H ASN 58 H ASN 58 8.787 -4.483 6.435 463 HA ASN 58 HA ASN 58 11.169 -2.934 6.170 464 HB2 ASN 58 HB2 ASN 58 10.171 -4.240 8.237 465 HB3 ASN 58 HB1 ASN 58 11.129 -5.569 7.603 466 HD21 ASN 58 HD21 ASN 58 13.287 -3.830 6.642 467 HD22 ASN 58 HD22 ASN 58 14.127 -3.298 8.056 468 H CYS 59 H CYS 59 9.970 -5.670 4.570 469 HA CYS 59 HA CYS 59 12.566 -6.694 3.783 470 HB2 CYS 59 HB2 CYS 59 9.789 -7.500 2.907 471 HB3 CYS 59 HB1 CYS 59 11.277 -8.360 2.524 472 HG CYS 59 HG CYS 59 9.607 -8.196 5.484 473 H ASP 60 H ASP 60 10.159 -4.508 2.642 474 HA ASP 60 HA ASP 60 9.967 -3.148 0.841 475 HB2 ASP 60 HB2 ASP 60 12.924 -3.708 0.591 476 HB3 ASP 60 HB1 ASP 60 12.066 -2.501 -0.356 477 H LEU 61 H LEU 61 9.021 -5.612 0.291 478 HA LEU 61 HA LEU 61 10.141 -6.730 -2.090 479 HB2 LEU 61 HB2 LEU 61 7.681 -7.198 -0.490 480 HB3 LEU 61 HB1 LEU 61 7.648 -7.710 -2.161 481 HG LEU 61 HG LEU 61 9.434 -9.261 -1.831 482 HD11 LEU 61 HD11 LEU 61 10.871 -7.923 -0.412 483 HD12 LEU 61 HD12 LEU 61 10.598 -9.512 0.303 484 HD13 LEU 61 HD13 LEU 61 9.740 -8.104 0.928 485 HD21 LEU 61 HD21 LEU 61 8.500 -10.769 -0.225 486 HD22 LEU 61 HD22 LEU 61 7.171 -9.917 -1.017 487 HD23 LEU 61 HD23 LEU 61 7.678 -9.454 0.605 488 H ASP 62 H ASP 62 8.694 -3.859 -1.672 489 HA ASP 62 HA ASP 62 7.289 -3.790 -4.231 490 HB2 ASP 62 HB2 ASP 62 6.543 -1.594 -3.567 491 HB3 ASP 62 HB1 ASP 62 6.339 -2.668 -2.187 492 H GLN 63 H GLN 63 10.304 -3.093 -2.811 493 HA GLN 63 HA GLN 63 11.115 -1.386 -5.058 494 HB2 GLN 63 HB2 GLN 63 11.466 -0.290 -2.960 495 HB3 GLN 63 HB1 GLN 63 12.227 -1.710 -2.269 496 HG2 GLN 63 HG2 GLN 63 13.508 -0.466 -4.639 497 HG3 GLN 63 HG1 GLN 63 13.611 0.383 -3.097 498 HE21 GLN 63 HE21 GLN 63 15.685 -0.929 -4.706 499 HE22 GLN 63 HE22 GLN 63 16.423 -2.096 -3.671 500 H GLN 64 H GLN 64 11.866 -4.314 -3.294 501 HA GLN 64 HA GLN 64 14.224 -4.938 -4.790 502 HB2 GLN 64 HB2 GLN 64 12.456 -6.616 -3.004 503 HB3 GLN 64 HB1 GLN 64 13.953 -7.188 -3.725 504 HG2 GLN 64 HG2 GLN 64 13.803 -4.801 -1.908 505 HG3 GLN 64 HG1 GLN 64 14.108 -6.441 -1.341 506 HE21 GLN 64 HE21 GLN 64 16.054 -7.431 -1.855 507 HE22 GLN 64 HE22 GLN 64 17.425 -6.540 -2.409 508 H SEP 65 H SEP 65 13.860 -7.607 -5.478 509 HA SEP 65 HA SEP 65 12.568 -7.337 -7.996 510 HB2 SEP 65 HB1 SEP 65 13.276 -9.681 -8.343 511 HB3 SEP 65 HB2 SEP 65 13.771 -9.763 -6.650 512 H ILE 66 H ILE 66 11.350 -9.730 -8.505 513 HA ILE 66 HA ILE 66 8.835 -9.270 -7.135 514 HB ILE 66 HB ILE 66 9.010 -9.389 -9.655 515 HG12 ILE 66 HG12 ILE 66 7.162 -11.488 -8.538 516 HG13 ILE 66 HG11 ILE 66 6.896 -9.764 -8.307 517 HG21 ILE 66 HG21 ILE 66 10.562 -11.246 -9.836 518 HG22 ILE 66 HG22 ILE 66 9.055 -11.608 -10.689 519 HG23 ILE 66 HG23 ILE 66 9.369 -12.327 -9.109 520 HD11 ILE 66 HD11 ILE 66 6.696 -9.436 -10.679 521 HD12 ILE 66 HD12 ILE 66 5.596 -10.717 -10.166 522 HD13 ILE 66 HD13 ILE 66 7.111 -11.121 -10.976 523 H VAL 67 H VAL 67 7.628 -10.865 -6.133 524 HA VAL 67 HA VAL 67 9.175 -12.942 -4.826 525 HB VAL 67 HB VAL 67 6.221 -12.433 -4.510 526 HG11 VAL 67 HG11 VAL 67 8.294 -13.526 -2.615 527 HG12 VAL 67 HG12 VAL 67 7.062 -14.456 -3.470 528 HG13 VAL 67 HG13 VAL 67 6.586 -13.282 -2.243 529 HG21 VAL 67 HG21 VAL 67 7.372 -10.293 -4.266 530 HG22 VAL 67 HG22 VAL 67 8.439 -11.002 -3.053 531 HG23 VAL 67 HG23 VAL 67 6.710 -10.855 -2.735 532 H HIS 68 H HIS 68 8.806 -15.143 -5.034 533 HA HIS 68 HA HIS 68 6.920 -15.964 -7.142 534 HB2 HIS 68 HB2 HIS 68 9.619 -17.103 -6.398 535 HB3 HIS 68 HB1 HIS 68 8.455 -17.992 -7.368 536 HD2 HIS 68 HD2 HIS 68 9.689 -14.249 -7.822 537 HE1 HIS 68 HE1 HIS 68 10.332 -16.467 -11.365 538 HE2 HIS 68 HE2 HIS 68 10.868 -14.332 -10.120 539 H ILE 69 H ILE 69 5.192 -16.771 -6.120 540 HA ILE 69 HA ILE 69 5.620 -18.224 -3.629 541 HB ILE 69 HB ILE 69 3.073 -17.178 -4.878 542 HG12 ILE 69 HG12 ILE 69 4.673 -16.388 -2.438 543 HG13 ILE 69 HG11 ILE 69 4.417 -15.434 -3.892 544 HG21 ILE 69 HG21 ILE 69 3.430 -18.665 -2.280 545 HG22 ILE 69 HG22 ILE 69 2.657 -19.293 -3.735 546 HG23 ILE 69 HG23 ILE 69 1.931 -17.940 -2.867 547 HD11 ILE 69 HD11 ILE 69 3.053 -14.624 -2.057 548 HD12 ILE 69 HD12 ILE 69 2.303 -16.214 -1.898 549 HD13 ILE 69 HD13 ILE 69 2.044 -15.258 -3.357 550 H VAL 70 H VAL 70 5.721 -20.311 -3.610 551 HA VAL 70 HA VAL 70 4.769 -21.826 -5.945 552 HB VAL 70 HB VAL 70 6.731 -22.705 -3.820 553 HG11 VAL 70 HG11 VAL 70 7.375 -24.416 -5.438 554 HG12 VAL 70 HG12 VAL 70 6.131 -23.833 -6.546 555 HG13 VAL 70 HG13 VAL 70 5.674 -24.536 -4.992 556 HG21 VAL 70 HG21 VAL 70 8.512 -22.252 -5.451 557 HG22 VAL 70 HG22 VAL 70 7.668 -20.789 -4.947 558 HG23 VAL 70 HG23 VAL 70 7.322 -21.506 -6.523 559 H GLN 71 H GLN 71 3.193 -23.347 -5.648 560 HA GLN 71 HA GLN 71 2.421 -23.883 -2.880 561 HB2 GLN 71 HB2 GLN 71 0.602 -22.953 -4.167 562 HB3 GLN 71 HB1 GLN 71 0.823 -24.163 -5.426 563 HG2 GLN 71 HG2 GLN 71 -0.073 -25.860 -4.142 564 HG3 GLN 71 HG1 GLN 71 0.235 -25.015 -2.628 565 HE21 GLN 71 HE21 GLN 71 -1.172 -23.454 -1.940 566 HE22 GLN 71 HE22 GLN 71 -2.751 -23.276 -2.600 567 H ARG 72 H ARG 72 2.783 -25.774 -2.050 568 HA ARG 72 HA ARG 72 3.345 -28.018 -3.856 569 HB2 ARG 72 HB2 ARG 72 4.484 -27.444 -1.110 570 HB3 ARG 72 HB1 ARG 72 4.762 -28.930 -2.010 571 HG2 ARG 72 HG2 ARG 72 5.939 -27.743 -3.729 572 HG3 ARG 72 HG1 ARG 72 5.521 -26.191 -3.003 573 HD2 ARG 72 HD2 ARG 72 6.839 -26.759 -1.029 574 HD3 ARG 72 HD1 ARG 72 7.248 -28.319 -1.742 575 HE ARG 72 HE ARG 72 8.168 -26.740 -3.619 576 HH11 ARG 72 HH11 ARG 72 8.458 -26.357 -0.134 577 HH12 ARG 72 HH12 ARG 72 9.943 -25.469 -0.225 578 HH21 ARG 72 HH21 ARG 72 10.148 -25.568 -3.733 579 HH22 ARG 72 HH22 ARG 72 10.902 -25.021 -2.275 580 HA PRO 73 HA PRO 73 -0.534 -28.878 -1.680 581 HB2 PRO 73 HB2 PRO 73 -1.610 -30.439 -3.594 582 HB3 PRO 73 HB1 PRO 73 -1.610 -28.674 -3.693 583 HG2 PRO 73 HG2 PRO 73 0.213 -30.644 -5.011 584 HG3 PRO 73 HG1 PRO 73 -0.545 -29.191 -5.692 585 HD2 PRO 73 HD2 PRO 73 2.033 -29.262 -4.837 586 HD3 PRO 73 HD1 PRO 73 1.039 -27.792 -4.787 587 H TRP 74 H TRP 74 -1.289 -30.582 -0.568 588 HA TRP 74 HA TRP 74 0.408 -32.951 -0.470 589 HB2 TRP 74 HB2 TRP 74 -0.128 -31.852 1.662 590 HB3 TRP 74 HB1 TRP 74 -1.849 -32.033 1.340 591 HD1 TRP 74 HD1 TRP 74 1.222 -34.387 1.721 592 HE1 TRP 74 HE1 TRP 74 0.444 -36.500 2.964 593 HE3 TRP 74 HE3 TRP 74 -3.731 -33.242 2.225 594 HZ2 TRP 74 HZ2 TRP 74 -1.957 -37.538 4.027 595 HZ3 TRP 74 HZ3 TRP 74 -5.201 -34.848 3.369 596 HH2 TRP 74 HH2 TRP 74 -4.332 -36.950 4.249 597 H ARG 75 H ARG 75 -3.013 -32.072 -0.725 598 HA ARG 75 HA ARG 75 -3.415 -34.331 -2.512 599 HB2 ARG 75 HB2 ARG 75 -4.974 -33.810 0.002 600 HB3 ARG 75 HB1 ARG 75 -5.716 -34.633 -1.361 601 HG2 ARG 75 HG2 ARG 75 -3.282 -35.541 0.168 602 HG3 ARG 75 HG1 ARG 75 -4.900 -36.240 0.250 603 HD2 ARG 75 HD2 ARG 75 -3.047 -36.214 -2.132 604 HD3 ARG 75 HD1 ARG 75 -3.525 -37.609 -1.173 605 HE ARG 75 HE ARG 75 -5.886 -36.915 -2.004 606 HH11 ARG 75 HH11 ARG 75 -2.907 -36.816 -3.861 607 HH12 ARG 75 HH12 ARG 75 -3.690 -37.035 -5.382 608 HH21 ARG 75 HH21 ARG 75 -6.932 -37.227 -4.037 609 HH22 ARG 75 HH22 ARG 75 -5.985 -37.274 -5.481 610 H LYS 76 H LYS 76 -3.635 -33.090 -4.260 611 HA LYS 76 HA LYS 76 -6.080 -31.529 -4.413 612 HB2 LYS 76 HB2 LYS 76 -3.335 -30.477 -5.073 613 HB3 LYS 76 HB1 LYS 76 -4.778 -29.806 -5.818 614 HG2 LYS 76 HG2 LYS 76 -4.703 -29.988 -2.849 615 HG3 LYS 76 HG1 LYS 76 -3.706 -28.765 -3.631 616 HD2 LYS 76 HD2 LYS 76 -5.820 -27.767 -3.068 617 HD3 LYS 76 HD1 LYS 76 -5.744 -27.947 -4.817 618 HE2 LYS 76 HE2 LYS 76 -7.940 -28.555 -4.015 619 HE3 LYS 76 HE1 LYS 76 -7.129 -29.982 -4.643 620 HZ1 LYS 76 HZ1 LYS 76 -7.328 -29.253 -1.763 621 HZ2 LYS 76 HZ2 LYS 76 -6.637 -30.671 -2.379 622 HZ3 LYS 76 HZ3 LYS 76 -8.295 -30.393 -2.544 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 2.262 -1.329 0.671 2 H2 MET 1 HT2 MET 1 1.262 -0.143 0.012 3 H3 MET 1 HT3 MET 1 2.649 0.306 0.855 4 HA MET 1 HA MET 1 2.868 0.504 -1.559 5 HB2 MET 1 HB2 MET 1 5.046 -0.581 -1.731 6 HB3 MET 1 HB1 MET 1 4.864 0.180 -0.160 7 HG2 MET 1 HG2 MET 1 4.378 -2.006 0.832 8 HG3 MET 1 HG1 MET 1 4.571 -2.758 -0.753 9 HE1 MET 1 HE1 MET 1 7.806 -3.959 1.089 10 HE2 MET 1 HE2 MET 1 6.351 -4.446 0.218 11 HE3 MET 1 HE3 MET 1 6.222 -3.733 1.827 12 H ILE 2 H ILE 2 3.370 -0.704 -3.556 13 HA ILE 2 HA ILE 2 1.660 -3.092 -3.713 14 HB ILE 2 HB ILE 2 2.380 -1.141 -5.917 15 HG12 ILE 2 HG12 ILE 2 -0.246 -1.576 -4.473 16 HG13 ILE 2 HG11 ILE 2 0.824 -0.199 -4.242 17 HG21 ILE 2 HG21 ILE 2 2.068 -3.402 -6.767 18 HG22 ILE 2 HG22 ILE 2 0.723 -2.369 -7.255 19 HG23 ILE 2 HG23 ILE 2 0.517 -3.518 -5.933 20 HD11 ILE 2 HD11 ILE 2 -1.048 0.378 -5.664 21 HD12 ILE 2 HD12 ILE 2 -0.619 -0.914 -6.786 22 HD13 ILE 2 HD13 ILE 2 0.462 0.461 -6.567 23 H VAL 3 H VAL 3 2.829 -4.873 -3.755 24 HA VAL 3 HA VAL 3 5.447 -4.823 -5.076 25 HB VAL 3 HB VAL 3 5.951 -6.896 -3.865 26 HG11 VAL 3 HG11 VAL 3 4.916 -4.695 -2.084 27 HG12 VAL 3 HG12 VAL 3 6.526 -4.806 -2.795 28 HG13 VAL 3 HG13 VAL 3 6.015 -5.979 -1.582 29 HG21 VAL 3 HG21 VAL 3 4.423 -7.748 -2.135 30 HG22 VAL 3 HG22 VAL 3 3.705 -7.847 -3.742 31 HG23 VAL 3 HG23 VAL 3 3.211 -6.568 -2.630 32 H PHE 4 H PHE 4 6.025 -6.794 -6.301 33 HA PHE 4 HA PHE 4 3.682 -7.748 -7.778 34 HB2 PHE 4 HB2 PHE 4 6.576 -7.447 -8.568 35 HB3 PHE 4 HB1 PHE 4 5.433 -8.387 -9.520 36 HD1 PHE 4 HD1 PHE 4 5.939 -4.990 -8.081 37 HD2 PHE 4 HD2 PHE 4 4.140 -7.352 -11.128 38 HE1 PHE 4 HE1 PHE 4 5.204 -2.945 -9.227 39 HE2 PHE 4 HE2 PHE 4 3.403 -5.308 -12.279 40 HZ PHE 4 HZ PHE 4 3.936 -3.101 -11.328 41 H VAL 5 H VAL 5 3.374 -9.939 -8.140 42 HA VAL 5 HA VAL 5 5.202 -11.750 -6.749 43 HB VAL 5 HB VAL 5 3.340 -11.011 -5.224 44 HG11 VAL 5 HG11 VAL 5 1.131 -11.989 -5.517 45 HG12 VAL 5 HG12 VAL 5 1.616 -12.574 -7.108 46 HG13 VAL 5 HG13 VAL 5 1.544 -10.841 -6.790 47 HG21 VAL 5 HG21 VAL 5 4.560 -13.067 -4.824 48 HG22 VAL 5 HG22 VAL 5 3.435 -13.946 -5.864 49 HG23 VAL 5 HG23 VAL 5 2.866 -13.218 -4.359 50 H ARG 6 H ARG 6 5.390 -13.757 -7.648 51 HA ARG 6 HA ARG 6 3.785 -14.304 -10.065 52 HB2 ARG 6 HB2 ARG 6 6.554 -15.246 -9.300 53 HB3 ARG 6 HB1 ARG 6 5.668 -15.858 -10.683 54 HG2 ARG 6 HG2 ARG 6 5.625 -13.587 -11.622 55 HG3 ARG 6 HG1 ARG 6 6.585 -13.039 -10.246 56 HD2 ARG 6 HD2 ARG 6 8.019 -13.443 -12.166 57 HD3 ARG 6 HD1 ARG 6 8.372 -14.594 -10.879 58 HE ARG 6 HE ARG 6 6.479 -15.696 -12.664 59 HH11 ARG 6 HH11 ARG 6 9.885 -14.854 -12.528 60 HH12 ARG 6 HH12 ARG 6 10.373 -16.100 -13.623 61 HH21 ARG 6 HH21 ARG 6 7.144 -17.369 -14.125 62 HH22 ARG 6 HH22 ARG 6 8.820 -17.517 -14.529 63 H PHE 7 H PHE 7 2.077 -15.449 -9.235 64 HA PHE 7 HA PHE 7 2.565 -17.649 -7.420 65 HB2 PHE 7 HB2 PHE 7 0.497 -16.320 -7.188 66 HB3 PHE 7 HB1 PHE 7 0.007 -16.803 -8.808 67 HD1 PHE 7 HD1 PHE 7 0.618 -18.013 -5.386 68 HD2 PHE 7 HD2 PHE 7 -1.008 -18.915 -9.212 69 HE1 PHE 7 HE1 PHE 7 -0.449 -20.018 -4.456 70 HE2 PHE 7 HE2 PHE 7 -2.083 -20.925 -8.286 71 HZ PHE 7 HZ PHE 7 -1.794 -21.482 -5.904 72 H ASN 8 H ASN 8 2.494 -19.811 -7.915 73 HA ASN 8 HA ASN 8 2.605 -21.730 -9.149 74 HB2 ASN 8 HB2 ASN 8 0.308 -21.063 -9.884 75 HB3 ASN 8 HB1 ASN 8 1.012 -20.158 -11.213 76 HD21 ASN 8 HD21 ASN 8 0.387 -23.341 -9.924 77 HD22 ASN 8 HD22 ASN 8 0.602 -24.192 -11.413 78 H SER 9 H SER 9 4.389 -19.274 -9.504 79 HA SER 9 HA SER 9 6.279 -18.680 -10.584 80 HB2 SER 9 HB2 SER 9 6.865 -21.081 -10.278 81 HB3 SER 9 HB1 SER 9 6.120 -21.439 -11.832 82 HG SER 9 HG SER 9 7.662 -19.894 -12.728 83 H SER 10 H SER 10 3.510 -18.459 -11.801 84 HA SER 10 HA SER 10 4.072 -18.359 -14.644 85 HB2 SER 10 HB2 SER 10 1.578 -17.665 -13.073 86 HB3 SER 10 HB1 SER 10 1.698 -17.744 -14.833 87 HG SER 10 HG SER 10 2.549 -19.991 -13.434 88 H HIS 11 H HIS 11 2.382 -16.091 -15.210 89 HA HIS 11 HA HIS 11 4.294 -14.036 -15.170 90 HB2 HIS 11 HB2 HIS 11 2.470 -14.227 -16.854 91 HB3 HIS 11 HB1 HIS 11 1.308 -13.774 -15.613 92 HD2 HIS 11 HD2 HIS 11 4.539 -12.090 -17.159 93 HE1 HIS 11 HE1 HIS 11 1.609 -9.157 -16.331 94 HE2 HIS 11 HE2 HIS 11 4.002 -9.556 -17.036 95 H GLY 12 H GLY 12 4.594 -12.295 -13.882 96 HA2 GLY 12 HA2 GLY 12 3.549 -12.476 -11.214 97 HA3 GLY 12 HA1 GLY 12 4.716 -11.309 -11.817 98 H PHE 13 H PHE 13 2.102 -11.236 -10.225 99 HA PHE 13 HA PHE 13 0.955 -9.010 -11.752 100 HB2 PHE 13 HB2 PHE 13 -1.260 -9.549 -10.805 101 HB3 PHE 13 HB1 PHE 13 -0.632 -10.858 -11.791 102 HD1 PHE 13 HD1 PHE 13 -1.744 -9.843 -8.506 103 HD2 PHE 13 HD2 PHE 13 0.196 -12.936 -10.687 104 HE1 PHE 13 HE1 PHE 13 -2.196 -11.412 -6.674 105 HE2 PHE 13 HE2 PHE 13 -0.249 -14.511 -8.847 106 HZ PHE 13 HZ PHE 13 -1.456 -13.743 -6.838 107 HA PRO 14 HA PRO 14 1.848 -6.588 -8.193 108 HB2 PRO 14 HB2 PRO 14 0.186 -4.504 -8.561 109 HB3 PRO 14 HB1 PRO 14 1.575 -4.796 -9.615 110 HG2 PRO 14 HG2 PRO 14 -1.313 -5.433 -10.069 111 HG3 PRO 14 HG1 PRO 14 -0.127 -4.753 -11.197 112 HD2 PRO 14 HD2 PRO 14 -0.844 -7.390 -11.168 113 HD3 PRO 14 HD1 PRO 14 0.741 -6.811 -11.716 114 H VAL 15 H VAL 15 1.309 -6.725 -6.135 115 HA VAL 15 HA VAL 15 -1.527 -6.946 -5.391 116 HB VAL 15 HB VAL 15 0.824 -8.449 -4.178 117 HG11 VAL 15 HG11 VAL 15 -0.677 -7.640 -2.409 118 HG12 VAL 15 HG12 VAL 15 -0.782 -9.392 -2.592 119 HG13 VAL 15 HG13 VAL 15 -2.050 -8.358 -3.250 120 HG21 VAL 15 HG21 VAL 15 -0.455 -10.428 -4.801 121 HG22 VAL 15 HG22 VAL 15 -0.086 -9.432 -6.211 122 HG23 VAL 15 HG23 VAL 15 -1.703 -9.403 -5.510 123 H GLU 16 H GLU 16 -2.149 -5.288 -4.219 124 HA GLU 16 HA GLU 16 -0.245 -3.515 -2.988 125 HB2 GLU 16 HB2 GLU 16 -2.253 -2.648 -4.129 126 HB3 GLU 16 HB1 GLU 16 -3.268 -3.483 -2.962 127 HG2 GLU 16 HG2 GLU 16 -2.202 -2.116 -1.170 128 HG3 GLU 16 HG1 GLU 16 -1.390 -1.194 -2.436 129 H VAL 17 H VAL 17 0.412 -3.622 -0.953 130 HA VAL 17 HA VAL 17 -1.243 -5.090 0.984 131 HB VAL 17 HB VAL 17 0.750 -6.007 2.040 132 HG11 VAL 17 HG11 VAL 17 0.631 -6.569 -0.914 133 HG12 VAL 17 HG12 VAL 17 -0.276 -7.384 0.360 134 HG13 VAL 17 HG13 VAL 17 1.476 -7.564 0.268 135 HG21 VAL 17 HG21 VAL 17 2.962 -5.822 0.951 136 HG22 VAL 17 HG22 VAL 17 2.355 -4.275 1.541 137 HG23 VAL 17 HG23 VAL 17 2.281 -4.651 -0.182 138 H ASP 18 H ASP 18 -0.861 -4.477 3.205 139 HA ASP 18 HA ASP 18 -0.329 -1.635 3.439 140 HB2 ASP 18 HB2 ASP 18 -1.335 -3.687 5.428 141 HB3 ASP 18 HB1 ASP 18 -1.055 -1.997 5.826 142 H SER 19 H SER 19 1.086 -0.870 5.189 143 HA SER 19 HA SER 19 3.602 -2.148 5.026 144 HB2 SER 19 HB2 SER 19 4.182 -0.371 6.802 145 HB3 SER 19 HB1 SER 19 3.673 0.190 5.208 146 HG SER 19 HG SER 19 2.443 0.455 7.654 147 H ASP 20 H ASP 20 0.955 -2.371 7.211 148 HA ASP 20 HA ASP 20 2.565 -3.645 9.269 149 HB2 ASP 20 HB2 ASP 20 0.727 -2.008 9.815 150 HB3 ASP 20 HB1 ASP 20 -0.424 -3.214 9.252 151 H THR 21 H THR 21 1.277 -4.634 6.433 152 HA THR 21 HA THR 21 -0.042 -7.038 7.178 153 HB THR 21 HB THR 21 1.230 -6.221 4.551 154 HG1 THR 21 HG1 THR 21 -1.346 -5.929 5.682 155 HG21 THR 21 HG21 THR 21 -0.162 -7.968 3.537 156 HG22 THR 21 HG22 THR 21 -0.734 -8.448 5.135 157 HG23 THR 21 HG23 THR 21 0.964 -8.661 4.706 158 H SER 22 H SER 22 0.893 -8.798 7.975 159 HA SER 22 HA SER 22 3.750 -9.111 7.880 160 HB2 SER 22 HB2 SER 22 1.643 -11.001 8.958 161 HB3 SER 22 HB1 SER 22 3.376 -11.071 9.279 162 HG SER 22 HG SER 22 1.779 -8.815 9.903 163 H ILE 23 H ILE 23 4.814 -11.009 7.027 164 HA ILE 23 HA ILE 23 4.171 -11.593 4.381 165 HB ILE 23 HB ILE 23 5.846 -13.281 6.258 166 HG12 ILE 23 HG12 ILE 23 6.640 -10.971 6.182 167 HG13 ILE 23 HG11 ILE 23 7.766 -12.032 5.344 168 HG21 ILE 23 HG21 ILE 23 5.237 -14.492 4.221 169 HG22 ILE 23 HG22 ILE 23 6.958 -14.104 4.238 170 HG23 ILE 23 HG23 ILE 23 5.856 -13.163 3.238 171 HD11 ILE 23 HD11 ILE 23 6.813 -11.306 3.198 172 HD12 ILE 23 HD12 ILE 23 7.483 -9.967 4.129 173 HD13 ILE 23 HD13 ILE 23 5.738 -10.210 4.066 174 H PHE 24 H PHE 24 3.412 -13.360 7.335 175 HA PHE 24 HA PHE 24 2.269 -15.665 6.235 176 HB2 PHE 24 HB2 PHE 24 2.770 -15.307 8.659 177 HB3 PHE 24 HB1 PHE 24 1.406 -14.207 8.738 178 HD1 PHE 24 HD1 PHE 24 2.211 -17.707 7.756 179 HD2 PHE 24 HD2 PHE 24 -0.642 -15.016 9.406 180 HE1 PHE 24 HE1 PHE 24 0.727 -19.595 8.259 181 HE2 PHE 24 HE2 PHE 24 -2.133 -16.904 9.912 182 HZ PHE 24 HZ PHE 24 -1.450 -19.198 9.340 183 H GLN 25 H GLN 25 0.853 -12.526 7.011 184 HA GLN 25 HA GLN 25 -1.796 -13.196 6.284 185 HB2 GLN 25 HB2 GLN 25 -0.489 -10.471 6.333 186 HB3 GLN 25 HB1 GLN 25 -2.218 -10.790 6.306 187 HG2 GLN 25 HG2 GLN 25 -0.300 -11.482 8.514 188 HG3 GLN 25 HG1 GLN 25 -1.509 -10.200 8.527 189 HE21 GLN 25 HE21 GLN 25 -1.146 -12.480 10.300 190 HE22 GLN 25 HE22 GLN 25 -2.641 -13.348 10.263 191 H LEU 26 H LEU 26 0.811 -11.500 4.563 192 HA LEU 26 HA LEU 26 -0.539 -11.028 2.170 193 HB2 LEU 26 HB2 LEU 26 1.588 -9.997 2.562 194 HB3 LEU 26 HB1 LEU 26 2.375 -11.553 2.737 195 HG LEU 26 HG LEU 26 2.150 -11.992 0.364 196 HD11 LEU 26 HD11 LEU 26 0.030 -10.955 -0.094 197 HD12 LEU 26 HD12 LEU 26 1.256 -10.254 -1.153 198 HD13 LEU 26 HD13 LEU 26 0.691 -9.361 0.259 199 HD21 LEU 26 HD21 LEU 26 4.099 -10.742 1.092 200 HD22 LEU 26 HD22 LEU 26 3.212 -9.228 0.920 201 HD23 LEU 26 HD23 LEU 26 3.583 -10.200 -0.506 202 H LYS 27 H LYS 27 1.317 -13.840 3.209 203 HA LYS 27 HA LYS 27 1.139 -15.407 0.917 204 HB2 LYS 27 HB2 LYS 27 2.545 -15.949 2.859 205 HB3 LYS 27 HB1 LYS 27 1.100 -16.235 3.822 206 HG2 LYS 27 HG2 LYS 27 0.519 -18.111 2.338 207 HG3 LYS 27 HG1 LYS 27 2.024 -17.846 1.453 208 HD2 LYS 27 HD2 LYS 27 3.306 -18.273 3.475 209 HD3 LYS 27 HD1 LYS 27 1.816 -18.489 4.395 210 HE2 LYS 27 HE2 LYS 27 1.236 -20.384 2.929 211 HE3 LYS 27 HE1 LYS 27 2.781 -20.188 2.102 212 HZ1 LYS 27 HZ1 LYS 27 2.397 -20.859 4.966 213 HZ2 LYS 27 HZ2 LYS 27 3.892 -20.618 4.220 214 HZ3 LYS 27 HZ3 LYS 27 2.915 -21.918 3.752 215 H GLU 28 H GLU 28 -1.033 -15.186 3.712 216 HA GLU 28 HA GLU 28 -2.896 -17.052 2.715 217 HB2 GLU 28 HB2 GLU 28 -3.057 -14.971 4.864 218 HB3 GLU 28 HB1 GLU 28 -4.405 -16.031 4.485 219 HG2 GLU 28 HG2 GLU 28 -2.671 -17.926 4.852 220 HG3 GLU 28 HG1 GLU 28 -1.756 -16.677 5.696 221 H VAL 29 H VAL 29 -2.666 -13.532 2.491 222 HA VAL 29 HA VAL 29 -5.231 -13.032 1.475 223 HB VAL 29 HB VAL 29 -2.643 -11.539 0.958 224 HG11 VAL 29 HG11 VAL 29 -4.224 -11.079 -0.852 225 HG12 VAL 29 HG12 VAL 29 -4.039 -9.668 0.191 226 HG13 VAL 29 HG13 VAL 29 -5.474 -10.685 0.330 227 HG21 VAL 29 HG21 VAL 29 -3.544 -9.941 2.583 228 HG22 VAL 29 HG22 VAL 29 -3.368 -11.548 3.288 229 HG23 VAL 29 HG23 VAL 29 -4.962 -10.967 2.804 230 H VAL 30 H VAL 30 -2.195 -13.665 -0.279 231 HA VAL 30 HA VAL 30 -3.323 -13.568 -2.861 232 HB VAL 30 HB VAL 30 -0.903 -15.127 -1.912 233 HG11 VAL 30 HG11 VAL 30 -0.185 -15.077 -4.260 234 HG12 VAL 30 HG12 VAL 30 -1.714 -14.317 -4.704 235 HG13 VAL 30 HG13 VAL 30 -1.698 -15.958 -4.058 236 HG21 VAL 30 HG21 VAL 30 0.388 -13.219 -2.755 237 HG22 VAL 30 HG22 VAL 30 -0.711 -12.741 -1.461 238 HG23 VAL 30 HG23 VAL 30 -1.115 -12.378 -3.139 239 H ALA 31 H ALA 31 -2.747 -16.253 -0.640 240 HA ALA 31 HA ALA 31 -3.664 -18.319 -2.301 241 HB1 ALA 31 HB1 ALA 31 -2.322 -18.663 -0.265 242 HB2 ALA 31 HB2 ALA 31 -3.774 -19.661 -0.291 243 HB3 ALA 31 HB3 ALA 31 -3.719 -18.210 0.710 244 H LYS 32 H LYS 32 -5.322 -16.361 0.121 245 HA LYS 32 HA LYS 32 -7.806 -17.669 0.050 246 HB2 LYS 32 HB2 LYS 32 -6.932 -16.161 1.810 247 HB3 LYS 32 HB1 LYS 32 -7.156 -14.806 0.720 248 HG2 LYS 32 HG2 LYS 32 -9.590 -15.357 0.684 249 HG3 LYS 32 HG1 LYS 32 -9.265 -16.541 1.956 250 HD2 LYS 32 HD2 LYS 32 -8.680 -13.597 2.075 251 HD3 LYS 32 HD1 LYS 32 -10.001 -14.414 2.918 252 HE2 LYS 32 HE2 LYS 32 -8.389 -15.685 4.235 253 HE3 LYS 32 HE1 LYS 32 -7.054 -14.969 3.337 254 HZ1 LYS 32 HZ1 LYS 32 -7.734 -12.792 4.210 255 HZ2 LYS 32 HZ2 LYS 32 -7.298 -13.862 5.435 256 HZ3 LYS 32 HZ3 LYS 32 -8.928 -13.539 5.142 257 H ARG 33 H ARG 33 -6.481 -14.900 -1.695 258 HA ARG 33 HA ARG 33 -8.837 -14.020 -2.934 259 HB2 ARG 33 HB2 ARG 33 -6.531 -12.884 -2.776 260 HB3 ARG 33 HB1 ARG 33 -6.112 -13.831 -4.196 261 HG2 ARG 33 HG2 ARG 33 -8.134 -12.814 -5.310 262 HG3 ARG 33 HG1 ARG 33 -8.210 -11.703 -3.942 263 HD2 ARG 33 HD2 ARG 33 -6.944 -10.482 -5.425 264 HD3 ARG 33 HD1 ARG 33 -5.684 -11.315 -4.513 265 HE ARG 33 HE ARG 33 -6.239 -12.969 -6.616 266 HH11 ARG 33 HH11 ARG 33 -5.223 -9.632 -6.273 267 HH12 ARG 33 HH12 ARG 33 -4.381 -9.588 -7.782 268 HH21 ARG 33 HH21 ARG 33 -5.115 -12.931 -8.628 269 HH22 ARG 33 HH22 ARG 33 -4.319 -11.484 -9.135 270 H GLN 34 H GLN 34 -6.338 -16.287 -4.007 271 HA GLN 34 HA GLN 34 -7.742 -16.803 -6.481 272 HB2 GLN 34 HB2 GLN 34 -5.221 -17.996 -5.340 273 HB3 GLN 34 HB1 GLN 34 -5.868 -18.354 -6.937 274 HG2 GLN 34 HG2 GLN 34 -5.647 -15.987 -7.542 275 HG3 GLN 34 HG1 GLN 34 -4.954 -15.659 -5.955 276 HE21 GLN 34 HE21 GLN 34 -4.478 -17.162 -9.028 277 HE22 GLN 34 HE22 GLN 34 -2.769 -17.376 -8.887 278 H GLY 35 H GLY 35 -7.561 -18.161 -3.337 279 HA2 GLY 35 HA2 GLY 35 -9.076 -19.697 -2.458 280 HA3 GLY 35 HA1 GLY 35 -9.571 -20.111 -4.092 281 H VAL 36 H VAL 36 -6.344 -20.121 -2.636 282 HA VAL 36 HA VAL 36 -6.244 -23.016 -3.153 283 HB VAL 36 HB VAL 36 -3.803 -22.791 -3.551 284 HG11 VAL 36 HG11 VAL 36 -3.949 -21.773 -5.777 285 HG12 VAL 36 HG12 VAL 36 -5.527 -21.106 -5.357 286 HG13 VAL 36 HG13 VAL 36 -5.302 -22.852 -5.449 287 HG21 VAL 36 HG21 VAL 36 -3.422 -20.730 -2.289 288 HG22 VAL 36 HG22 VAL 36 -4.341 -19.825 -3.493 289 HG23 VAL 36 HG23 VAL 36 -2.817 -20.593 -3.941 290 HA PRO 37 HA PRO 37 -5.204 -23.617 1.094 291 HB2 PRO 37 HB2 PRO 37 -3.176 -25.609 0.318 292 HB3 PRO 37 HB1 PRO 37 -4.667 -25.832 1.238 293 HG2 PRO 37 HG2 PRO 37 -4.410 -26.743 -1.274 294 HG3 PRO 37 HG1 PRO 37 -5.952 -26.123 -0.657 295 HD2 PRO 37 HD2 PRO 37 -3.940 -24.792 -2.428 296 HD3 PRO 37 HD1 PRO 37 -5.714 -24.775 -2.521 297 H ALA 38 H ALA 38 -4.057 -22.148 2.166 298 HA ALA 38 HA ALA 38 -1.507 -21.218 1.255 299 HB1 ALA 38 HB1 ALA 38 -2.959 -20.638 3.835 300 HB2 ALA 38 HB2 ALA 38 -3.100 -19.714 2.338 301 HB3 ALA 38 HB3 ALA 38 -1.564 -19.758 3.207 302 H ASP 39 H ASP 39 -2.623 -23.609 3.481 303 HA ASP 39 HA ASP 39 -0.270 -23.803 5.076 304 HB2 ASP 39 HB2 ASP 39 -2.391 -25.894 4.554 305 HB3 ASP 39 HB1 ASP 39 -1.194 -25.943 5.845 306 H GLN 40 H GLN 40 -0.990 -24.760 1.923 307 HA GLN 40 HA GLN 40 1.351 -26.542 1.856 308 HB2 GLN 40 HB2 GLN 40 -1.130 -26.535 0.132 309 HB3 GLN 40 HB1 GLN 40 0.294 -27.510 -0.199 310 HG2 GLN 40 HG2 GLN 40 -1.302 -27.686 2.343 311 HG3 GLN 40 HG1 GLN 40 -1.562 -28.720 0.940 312 HE21 GLN 40 HE21 GLN 40 0.627 -27.895 3.526 313 HE22 GLN 40 HE22 GLN 40 1.596 -29.320 3.420 314 H LEU 41 H LEU 41 0.915 -23.565 1.565 315 HA LEU 41 HA LEU 41 1.843 -23.159 -1.181 316 HB2 LEU 41 HB2 LEU 41 -0.124 -21.890 -0.277 317 HB3 LEU 41 HB1 LEU 41 0.965 -21.113 0.850 318 HG LEU 41 HG LEU 41 2.209 -20.155 -1.058 319 HD11 LEU 41 HD11 LEU 41 1.147 -20.233 -3.274 320 HD12 LEU 41 HD12 LEU 41 -0.024 -21.398 -2.660 321 HD13 LEU 41 HD13 LEU 41 1.687 -21.820 -2.737 322 HD21 LEU 41 HD21 LEU 41 0.526 -18.498 -1.643 323 HD22 LEU 41 HD22 LEU 41 0.435 -18.894 0.073 324 HD23 LEU 41 HD23 LEU 41 -0.745 -19.565 -1.052 325 H ARG 42 H ARG 42 3.794 -22.117 -1.604 326 HA ARG 42 HA ARG 42 5.517 -21.572 0.717 327 HB2 ARG 42 HB2 ARG 42 6.176 -23.739 -0.100 328 HB3 ARG 42 HB1 ARG 42 6.213 -23.158 -1.755 329 HG2 ARG 42 HG2 ARG 42 7.974 -21.670 0.015 330 HG3 ARG 42 HG1 ARG 42 8.368 -23.392 -0.079 331 HD2 ARG 42 HD2 ARG 42 8.038 -21.502 -2.408 332 HD3 ARG 42 HD1 ARG 42 9.569 -22.099 -1.767 333 HE ARG 42 HE ARG 42 7.960 -24.288 -2.441 334 HH11 ARG 42 HH11 ARG 42 9.697 -21.689 -4.017 335 HH12 ARG 42 HH12 ARG 42 10.010 -22.581 -5.461 336 HH21 ARG 42 HH21 ARG 42 8.353 -25.478 -4.375 337 HH22 ARG 42 HH22 ARG 42 9.226 -24.742 -5.673 338 H VAL 43 H VAL 43 6.590 -19.692 0.630 339 HA VAL 43 HA VAL 43 6.498 -18.216 -1.902 340 HB VAL 43 HB VAL 43 6.654 -16.154 -0.655 341 HG11 VAL 43 HG11 VAL 43 4.590 -16.204 0.644 342 HG12 VAL 43 HG12 VAL 43 4.643 -17.965 0.670 343 HG13 VAL 43 HG13 VAL 43 4.418 -17.114 -0.856 344 HG21 VAL 43 HG21 VAL 43 6.750 -16.099 1.809 345 HG22 VAL 43 HG22 VAL 43 8.188 -16.835 1.104 346 HG23 VAL 43 HG23 VAL 43 6.944 -17.852 1.825 347 H ILE 44 H ILE 44 8.354 -17.248 -2.727 348 HA ILE 44 HA ILE 44 10.879 -17.814 -1.337 349 HB ILE 44 HB ILE 44 10.238 -18.511 -4.206 350 HG12 ILE 44 HG12 ILE 44 9.767 -20.239 -2.547 351 HG13 ILE 44 HG11 ILE 44 11.098 -20.714 -3.596 352 HG21 ILE 44 HG21 ILE 44 12.613 -19.027 -4.536 353 HG22 ILE 44 HG22 ILE 44 12.973 -18.348 -2.950 354 HG23 ILE 44 HG23 ILE 44 12.344 -17.310 -4.230 355 HD11 ILE 44 HD11 ILE 44 12.679 -20.046 -1.817 356 HD12 ILE 44 HD12 ILE 44 11.594 -21.349 -1.339 357 HD13 ILE 44 HD13 ILE 44 11.303 -19.709 -0.765 358 H PHE 45 H PHE 45 12.238 -16.188 -1.311 359 HA PHE 45 HA PHE 45 12.095 -14.141 -3.385 360 HB2 PHE 45 HB2 PHE 45 10.840 -13.225 -1.504 361 HB3 PHE 45 HB1 PHE 45 12.153 -13.623 -0.404 362 HD1 PHE 45 HD1 PHE 45 11.511 -11.650 -3.506 363 HD2 PHE 45 HD2 PHE 45 13.658 -11.977 0.157 364 HE1 PHE 45 HE1 PHE 45 12.502 -9.429 -3.889 365 HE2 PHE 45 HE2 PHE 45 14.650 -9.760 -0.222 366 HZ PHE 45 HZ PHE 45 14.074 -8.485 -2.242 367 H ALA 46 H ALA 46 14.008 -14.151 -4.306 368 HA ALA 46 HA ALA 46 16.241 -14.115 -4.663 369 HB1 ALA 46 HB1 ALA 46 16.481 -13.604 -1.694 370 HB2 ALA 46 HB2 ALA 46 16.300 -12.366 -2.937 371 HB3 ALA 46 HB3 ALA 46 17.751 -13.368 -2.896 372 H GLY 47 H GLY 47 14.710 -16.548 -3.626 373 HA2 GLY 47 HA2 GLY 47 15.583 -18.752 -3.985 374 HA3 GLY 47 HA1 GLY 47 17.113 -18.214 -3.313 375 H LYS 48 H LYS 48 15.235 -16.859 -1.170 376 HA LYS 48 HA LYS 48 14.928 -19.327 0.394 377 HB2 LYS 48 HB2 LYS 48 15.479 -17.948 2.430 378 HB3 LYS 48 HB1 LYS 48 16.811 -18.212 1.322 379 HG2 LYS 48 HG2 LYS 48 17.012 -15.972 1.972 380 HG3 LYS 48 HG1 LYS 48 16.263 -15.893 0.380 381 HD2 LYS 48 HD2 LYS 48 14.069 -15.595 1.432 382 HD3 LYS 48 HD1 LYS 48 14.821 -15.685 3.026 383 HE2 LYS 48 HE2 LYS 48 15.463 -13.611 0.930 384 HE3 LYS 48 HE1 LYS 48 14.358 -13.364 2.280 385 HZ1 LYS 48 HZ1 LYS 48 16.487 -12.464 2.837 386 HZ2 LYS 48 HZ2 LYS 48 17.277 -13.904 2.450 387 HZ3 LYS 48 HZ3 LYS 48 16.241 -13.840 3.782 388 H GLU 49 H GLU 49 13.283 -19.374 1.993 389 HA GLU 49 HA GLU 49 10.937 -17.890 1.224 390 HB2 GLU 49 HB2 GLU 49 9.826 -19.252 3.019 391 HB3 GLU 49 HB1 GLU 49 10.582 -20.196 1.745 392 HG2 GLU 49 HG2 GLU 49 12.441 -20.728 3.172 393 HG3 GLU 49 HG1 GLU 49 11.835 -19.646 4.424 394 H LEU 50 H LEU 50 9.779 -16.483 2.554 395 HA LEU 50 HA LEU 50 11.474 -14.943 4.334 396 HB2 LEU 50 HB2 LEU 50 8.640 -14.440 3.459 397 HB3 LEU 50 HB1 LEU 50 9.675 -13.302 4.299 398 HG LEU 50 HG LEU 50 10.041 -14.337 1.499 399 HD11 LEU 50 HD11 LEU 50 9.564 -12.062 0.825 400 HD12 LEU 50 HD12 LEU 50 9.326 -11.595 2.509 401 HD13 LEU 50 HD13 LEU 50 8.219 -12.736 1.744 402 HD21 LEU 50 HD21 LEU 50 11.707 -12.406 3.112 403 HD22 LEU 50 HD22 LEU 50 11.871 -12.662 1.379 404 HD23 LEU 50 HD23 LEU 50 12.211 -13.981 2.499 405 H ARG 51 H ARG 51 10.936 -14.416 6.469 406 HA ARG 51 HA ARG 51 9.633 -16.436 7.963 407 HB2 ARG 51 HB2 ARG 51 9.845 -14.828 9.904 408 HB3 ARG 51 HB1 ARG 51 11.351 -15.240 9.110 409 HG2 ARG 51 HG2 ARG 51 9.970 -12.786 8.192 410 HG3 ARG 51 HG1 ARG 51 10.704 -12.752 9.797 411 HD2 ARG 51 HD2 ARG 51 12.104 -13.463 7.215 412 HD3 ARG 51 HD1 ARG 51 12.255 -11.942 8.092 413 HE ARG 51 HE ARG 51 12.911 -13.977 9.865 414 HH11 ARG 51 HH11 ARG 51 14.163 -12.679 6.860 415 HH12 ARG 51 HH12 ARG 51 15.801 -13.085 7.224 416 HH21 ARG 51 HH21 ARG 51 15.076 -14.518 10.345 417 HH22 ARG 51 HH22 ARG 51 16.329 -14.129 9.217 418 H ASN 52 H ASN 52 7.579 -16.717 8.371 419 HA ASN 52 HA ASN 52 5.650 -15.186 7.036 420 HB2 ASN 52 HB2 ASN 52 3.988 -16.660 8.067 421 HB3 ASN 52 HB1 ASN 52 5.349 -17.569 7.437 422 HD21 ASN 52 HD21 ASN 52 3.390 -18.305 9.452 423 HD22 ASN 52 HD22 ASN 52 4.281 -18.689 10.877 424 H ASP 53 H ASP 53 6.436 -15.291 10.503 425 HA ASP 53 HA ASP 53 4.327 -13.367 11.015 426 HB2 ASP 53 HB2 ASP 53 6.179 -14.869 12.850 427 HB3 ASP 53 HB1 ASP 53 5.135 -13.574 13.428 428 H TRP 54 H TRP 54 5.821 -12.059 9.437 429 HA TRP 54 HA TRP 54 6.909 -10.005 11.153 430 HB2 TRP 54 HB2 TRP 54 8.880 -11.397 10.645 431 HB3 TRP 54 HB1 TRP 54 8.585 -11.179 8.922 432 HD1 TRP 54 HD1 TRP 54 10.390 -9.582 8.044 433 HE1 TRP 54 HE1 TRP 54 11.405 -7.341 8.807 434 HE3 TRP 54 HE3 TRP 54 7.976 -9.070 12.530 435 HZ2 TRP 54 HZ2 TRP 54 11.182 -5.584 11.007 436 HZ3 TRP 54 HZ3 TRP 54 8.435 -7.079 13.892 437 HH2 TRP 54 HH2 TRP 54 10.009 -5.375 13.146 438 H THR 55 H THR 55 7.017 -7.957 10.195 439 HA THR 55 HA THR 55 4.898 -7.312 8.484 440 HB THR 55 HB THR 55 5.750 -5.043 8.540 441 HG1 THR 55 HG1 THR 55 8.138 -6.378 8.881 442 HG21 THR 55 HG21 THR 55 4.768 -5.943 10.641 443 HG22 THR 55 HG22 THR 55 5.985 -4.697 10.934 444 HG23 THR 55 HG23 THR 55 6.393 -6.395 11.167 445 H VAL 56 H VAL 56 4.784 -6.777 6.323 446 HA VAL 56 HA VAL 56 6.912 -7.697 4.618 447 HB VAL 56 HB VAL 56 4.486 -7.983 4.041 448 HG11 VAL 56 HG11 VAL 56 3.681 -5.811 4.798 449 HG12 VAL 56 HG12 VAL 56 3.231 -6.134 3.124 450 HG13 VAL 56 HG13 VAL 56 4.559 -5.028 3.483 451 HG21 VAL 56 HG21 VAL 56 4.723 -7.435 1.661 452 HG22 VAL 56 HG22 VAL 56 6.181 -8.180 2.317 453 HG23 VAL 56 HG23 VAL 56 6.127 -6.438 2.042 454 H GLN 57 H GLN 57 5.997 -4.736 6.060 455 HA GLN 57 HA GLN 57 7.019 -2.881 4.210 456 HB2 GLN 57 HB2 GLN 57 5.570 -2.198 6.035 457 HB3 GLN 57 HB1 GLN 57 6.763 -2.714 7.216 458 HG2 GLN 57 HG2 GLN 57 8.289 -0.973 6.431 459 HG3 GLN 57 HG1 GLN 57 7.085 -0.457 5.251 460 HE21 GLN 57 HE21 GLN 57 6.971 1.593 6.138 461 HE22 GLN 57 HE22 GLN 57 6.184 1.907 7.648 462 H ASN 58 H ASN 58 8.511 -4.750 6.758 463 HA ASN 58 HA ASN 58 11.078 -3.432 6.443 464 HB2 ASN 58 HB2 ASN 58 10.245 -4.124 8.680 465 HB3 ASN 58 HB1 ASN 58 10.280 -5.802 8.160 466 HD21 ASN 58 HD21 ASN 58 12.211 -3.011 8.974 467 HD22 ASN 58 HD22 ASN 58 13.682 -3.880 9.259 468 H CYS 59 H CYS 59 9.638 -5.228 4.394 469 HA CYS 59 HA CYS 59 11.899 -6.953 3.798 470 HB2 CYS 59 HB2 CYS 59 8.976 -7.433 3.158 471 HB3 CYS 59 HB1 CYS 59 10.314 -8.475 2.689 472 HG CYS 59 HG CYS 59 8.883 -8.084 5.748 473 H ASP 60 H ASP 60 12.913 -6.173 2.191 474 HA ASP 60 HA ASP 60 11.981 -4.070 0.511 475 HB2 ASP 60 HB2 ASP 60 14.473 -5.763 0.398 476 HB3 ASP 60 HB1 ASP 60 14.153 -4.472 -0.751 477 H LEU 61 H LEU 61 10.110 -5.935 0.082 478 HA LEU 61 HA LEU 61 10.663 -7.512 -2.253 479 HB2 LEU 61 HB2 LEU 61 7.988 -6.754 -1.073 480 HB3 LEU 61 HB1 LEU 61 8.277 -8.024 -2.243 481 HG LEU 61 HG LEU 61 9.194 -7.993 0.630 482 HD11 LEU 61 HD11 LEU 61 7.197 -9.737 -0.783 483 HD12 LEU 61 HD12 LEU 61 6.818 -8.430 0.336 484 HD13 LEU 61 HD13 LEU 61 7.682 -9.859 0.907 485 HD21 LEU 61 HD21 LEU 61 10.854 -9.056 -0.828 486 HD22 LEU 61 HD22 LEU 61 9.598 -10.120 -1.462 487 HD23 LEU 61 HD23 LEU 61 10.061 -10.214 0.235 488 H ASP 62 H ASP 62 9.543 -4.320 -1.610 489 HA ASP 62 HA ASP 62 8.593 -3.890 -4.322 490 HB2 ASP 62 HB2 ASP 62 7.407 -2.771 -2.516 491 HB3 ASP 62 HB1 ASP 62 8.893 -1.998 -1.979 492 H GLN 63 H GLN 63 11.428 -3.362 -2.420 493 HA GLN 63 HA GLN 63 12.586 -1.461 -4.262 494 HB2 GLN 63 HB2 GLN 63 13.735 -2.850 -1.843 495 HB3 GLN 63 HB1 GLN 63 14.599 -1.650 -2.792 496 HG2 GLN 63 HG2 GLN 63 12.005 -1.164 -1.341 497 HG3 GLN 63 HG1 GLN 63 13.603 -0.736 -0.734 498 HE21 GLN 63 HE21 GLN 63 11.302 0.956 -1.339 499 HE22 GLN 63 HE22 GLN 63 11.856 2.121 -2.492 500 H GLN 64 H GLN 64 12.716 -4.885 -3.706 501 HA GLN 64 HA GLN 64 14.918 -5.135 -5.618 502 HB2 GLN 64 HB2 GLN 64 13.737 -7.148 -3.700 503 HB3 GLN 64 HB1 GLN 64 15.051 -7.489 -4.816 504 HG2 GLN 64 HG2 GLN 64 15.163 -5.409 -2.639 505 HG3 GLN 64 HG1 GLN 64 15.790 -7.049 -2.492 506 HE21 GLN 64 HE21 GLN 64 17.882 -6.310 -2.144 507 HE22 GLN 64 HE22 GLN 64 18.846 -5.637 -3.414 508 H SEP 65 H SEP 65 14.251 -7.874 -6.261 509 HA SEP 65 HA SEP 65 12.654 -7.399 -8.548 510 HB2 SEP 65 HB1 SEP 65 13.000 -9.869 -8.930 511 HB3 SEP 65 HB2 SEP 65 13.878 -9.905 -7.402 512 H ILE 66 H ILE 66 11.304 -9.812 -8.830 513 HA ILE 66 HA ILE 66 8.896 -9.148 -7.371 514 HB ILE 66 HB ILE 66 8.919 -9.438 -9.857 515 HG12 ILE 66 HG12 ILE 66 7.179 -11.512 -8.550 516 HG13 ILE 66 HG11 ILE 66 6.883 -9.783 -8.397 517 HG21 ILE 66 HG21 ILE 66 10.504 -11.263 -10.026 518 HG22 ILE 66 HG22 ILE 66 8.971 -11.702 -10.784 519 HG23 ILE 66 HG23 ILE 66 9.378 -12.336 -9.191 520 HD11 ILE 66 HD11 ILE 66 5.520 -10.807 -10.131 521 HD12 ILE 66 HD12 ILE 66 6.985 -11.305 -10.985 522 HD13 ILE 66 HD13 ILE 66 6.614 -9.592 -10.790 523 H VAL 67 H VAL 67 7.700 -10.648 -6.170 524 HA VAL 67 HA VAL 67 9.318 -12.657 -4.839 525 HB VAL 67 HB VAL 67 6.429 -12.048 -4.232 526 HG11 VAL 67 HG11 VAL 67 8.736 -12.941 -2.512 527 HG12 VAL 67 HG12 VAL 67 7.392 -13.943 -3.068 528 HG13 VAL 67 HG13 VAL 67 7.102 -12.617 -1.938 529 HG21 VAL 67 HG21 VAL 67 7.534 -9.892 -4.355 530 HG22 VAL 67 HG22 VAL 67 8.819 -10.466 -3.294 531 HG23 VAL 67 HG23 VAL 67 7.177 -10.296 -2.677 532 H HIS 68 H HIS 68 9.012 -14.845 -5.007 533 HA HIS 68 HA HIS 68 7.085 -15.725 -7.046 534 HB2 HIS 68 HB2 HIS 68 9.637 -16.979 -6.022 535 HB3 HIS 68 HB1 HIS 68 8.506 -17.833 -7.059 536 HD2 HIS 68 HD2 HIS 68 9.690 -14.120 -7.681 537 HE1 HIS 68 HE1 HIS 68 11.020 -16.610 -10.833 538 HE2 HIS 68 HE2 HIS 68 11.142 -14.295 -9.825 539 H ILE 69 H ILE 69 5.565 -17.266 -6.623 540 HA ILE 69 HA ILE 69 5.540 -18.498 -3.960 541 HB ILE 69 HB ILE 69 3.193 -17.095 -5.267 542 HG12 ILE 69 HG12 ILE 69 4.722 -16.589 -2.709 543 HG13 ILE 69 HG11 ILE 69 4.591 -15.529 -4.104 544 HG21 ILE 69 HG21 ILE 69 3.242 -18.774 -2.769 545 HG22 ILE 69 HG22 ILE 69 2.475 -19.192 -4.301 546 HG23 ILE 69 HG23 ILE 69 1.869 -17.833 -3.355 547 HD11 ILE 69 HD11 ILE 69 2.218 -15.204 -3.644 548 HD12 ILE 69 HD12 ILE 69 3.212 -14.741 -2.263 549 HD13 ILE 69 HD13 ILE 69 2.340 -16.275 -2.249 550 H VAL 70 H VAL 70 5.099 -20.633 -4.012 551 HA VAL 70 HA VAL 70 3.876 -21.742 -6.462 552 HB VAL 70 HB VAL 70 6.190 -22.984 -4.942 553 HG11 VAL 70 HG11 VAL 70 6.247 -24.619 -6.767 554 HG12 VAL 70 HG12 VAL 70 4.817 -23.873 -7.478 555 HG13 VAL 70 HG13 VAL 70 4.709 -24.661 -5.903 556 HG21 VAL 70 HG21 VAL 70 6.915 -21.036 -6.221 557 HG22 VAL 70 HG22 VAL 70 6.151 -21.688 -7.670 558 HG23 VAL 70 HG23 VAL 70 7.525 -22.523 -6.946 559 H GLN 71 H GLN 71 2.377 -23.338 -6.177 560 HA GLN 71 HA GLN 71 1.579 -23.977 -3.436 561 HB2 GLN 71 HB2 GLN 71 -0.192 -23.148 -4.864 562 HB3 GLN 71 HB1 GLN 71 0.209 -24.311 -6.114 563 HG2 GLN 71 HG2 GLN 71 -1.770 -25.060 -5.045 564 HG3 GLN 71 HG1 GLN 71 -0.464 -26.129 -4.545 565 HE21 GLN 71 HE21 GLN 71 -0.999 -22.903 -3.285 566 HE22 GLN 71 HE22 GLN 71 -1.439 -23.404 -1.687 567 H ARG 72 H ARG 72 1.884 -25.962 -2.568 568 HA ARG 72 HA ARG 72 2.311 -28.250 -4.326 569 HB2 ARG 72 HB2 ARG 72 4.561 -27.403 -3.913 570 HB3 ARG 72 HB1 ARG 72 4.276 -27.420 -2.182 571 HG2 ARG 72 HG2 ARG 72 5.653 -29.300 -2.878 572 HG3 ARG 72 HG1 ARG 72 4.111 -29.852 -2.220 573 HD2 ARG 72 HD2 ARG 72 3.249 -30.166 -4.469 574 HD3 ARG 72 HD1 ARG 72 4.761 -29.567 -5.150 575 HE ARG 72 HE ARG 72 5.805 -31.543 -3.981 576 HH11 ARG 72 HH11 ARG 72 2.479 -31.577 -5.118 577 HH12 ARG 72 HH12 ARG 72 2.423 -33.292 -5.303 578 HH21 ARG 72 HH21 ARG 72 5.743 -33.824 -4.273 579 HH22 ARG 72 HH22 ARG 72 4.285 -34.576 -4.825 580 HA PRO 73 HA PRO 73 -0.124 -29.495 -0.709 581 HB2 PRO 73 HB2 PRO 73 -2.381 -30.126 -2.023 582 HB3 PRO 73 HB1 PRO 73 -1.962 -28.460 -1.609 583 HG2 PRO 73 HG2 PRO 73 -2.023 -29.748 -4.244 584 HG3 PRO 73 HG1 PRO 73 -1.958 -28.025 -3.846 585 HD2 PRO 73 HD2 PRO 73 0.221 -29.831 -4.581 586 HD3 PRO 73 HD1 PRO 73 0.234 -28.060 -4.455 587 H TRP 74 H TRP 74 0.240 -31.457 0.099 588 HA TRP 74 HA TRP 74 0.447 -33.777 -1.647 589 HB2 TRP 74 HB2 TRP 74 0.912 -33.397 1.315 590 HB3 TRP 74 HB1 TRP 74 0.965 -34.975 0.540 591 HD1 TRP 74 HD1 TRP 74 2.887 -35.134 -1.539 592 HE1 TRP 74 HE1 TRP 74 5.290 -34.210 -1.511 593 HE3 TRP 74 HE3 TRP 74 2.375 -31.656 2.178 594 HZ2 TRP 74 HZ2 TRP 74 6.768 -32.261 -0.106 595 HZ3 TRP 74 HZ3 TRP 74 4.334 -30.307 2.803 596 HH2 TRP 74 HH2 TRP 74 6.482 -30.603 1.685 597 H ARG 75 H ARG 75 -1.406 -34.643 -2.265 598 HA ARG 75 HA ARG 75 -3.523 -35.428 -2.310 599 HB2 ARG 75 HB2 ARG 75 -2.900 -36.079 0.579 600 HB3 ARG 75 HB1 ARG 75 -4.368 -36.597 -0.231 601 HG2 ARG 75 HG2 ARG 75 -3.033 -38.460 -0.431 602 HG3 ARG 75 HG1 ARG 75 -2.728 -37.644 -1.963 603 HD2 ARG 75 HD2 ARG 75 -0.626 -38.354 -1.093 604 HD3 ARG 75 HD1 ARG 75 -0.712 -36.604 -0.903 605 HE ARG 75 HE ARG 75 -1.640 -37.892 1.433 606 HH11 ARG 75 HH11 ARG 75 1.324 -37.175 -0.294 607 HH12 ARG 75 HH12 ARG 75 2.318 -37.236 1.116 608 HH21 ARG 75 HH21 ARG 75 -0.321 -37.980 3.315 609 HH22 ARG 75 HH22 ARG 75 1.382 -37.691 3.181 610 H LYS 76 H LYS 76 -4.227 -33.267 -2.703 611 HA LYS 76 HA LYS 76 -5.971 -32.294 -0.568 612 HB2 LYS 76 HB2 LYS 76 -4.026 -30.815 -0.678 613 HB3 LYS 76 HB1 LYS 76 -4.278 -30.599 -2.403 614 HG2 LYS 76 HG2 LYS 76 -5.197 -28.668 -1.595 615 HG3 LYS 76 HG1 LYS 76 -6.619 -29.703 -1.655 616 HD2 LYS 76 HD2 LYS 76 -4.939 -29.237 0.817 617 HD3 LYS 76 HD1 LYS 76 -6.422 -28.368 0.446 618 HE2 LYS 76 HE2 LYS 76 -6.132 -31.327 0.978 619 HE3 LYS 76 HE1 LYS 76 -6.893 -30.132 2.015 620 HZ1 LYS 76 HZ1 LYS 76 -7.868 -30.984 -0.665 621 HZ2 LYS 76 HZ2 LYS 76 -8.557 -29.760 0.277 622 HZ3 LYS 76 HZ3 LYS 76 -8.566 -31.351 0.834 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 1.094 0.059 0.977 2 H2 MET 1 HT2 MET 1 0.474 -1.505 0.819 3 H3 MET 1 HT3 MET 1 0.258 -0.398 -0.428 4 HA MET 1 HA MET 1 2.680 -0.323 -0.738 5 HB2 MET 1 HB2 MET 1 3.300 -1.042 1.514 6 HB3 MET 1 HB1 MET 1 2.553 -2.608 1.239 7 HG2 MET 1 HG2 MET 1 4.196 -3.013 -0.569 8 HG3 MET 1 HG1 MET 1 4.981 -1.495 -0.141 9 HE1 MET 1 HE1 MET 1 7.296 -2.681 0.209 10 HE2 MET 1 HE2 MET 1 6.565 -4.213 -0.266 11 HE3 MET 1 HE3 MET 1 7.525 -4.116 1.209 12 H ILE 2 H ILE 2 2.922 -1.133 -2.715 13 HA ILE 2 HA ILE 2 1.379 -3.521 -3.442 14 HB ILE 2 HB ILE 2 2.619 -1.374 -5.179 15 HG12 ILE 2 HG12 ILE 2 -0.261 -2.147 -4.693 16 HG13 ILE 2 HG11 ILE 2 0.539 -0.728 -4.028 17 HG21 ILE 2 HG21 ILE 2 1.585 -2.534 -7.089 18 HG22 ILE 2 HG22 ILE 2 1.106 -3.850 -6.018 19 HG23 ILE 2 HG23 ILE 2 2.814 -3.526 -6.303 20 HD11 ILE 2 HD11 ILE 2 -0.863 -0.156 -5.928 21 HD12 ILE 2 HD12 ILE 2 0.038 -1.278 -6.945 22 HD13 ILE 2 HD13 ILE 2 0.836 0.150 -6.288 23 H VAL 3 H VAL 3 2.418 -5.379 -3.632 24 HA VAL 3 HA VAL 3 5.282 -5.273 -4.283 25 HB VAL 3 HB VAL 3 5.569 -7.421 -3.118 26 HG11 VAL 3 HG11 VAL 3 5.306 -6.594 -0.822 27 HG12 VAL 3 HG12 VAL 3 4.301 -5.277 -1.427 28 HG13 VAL 3 HG13 VAL 3 5.996 -5.379 -1.899 29 HG21 VAL 3 HG21 VAL 3 2.691 -7.081 -2.277 30 HG22 VAL 3 HG22 VAL 3 3.807 -8.313 -1.684 31 HG23 VAL 3 HG23 VAL 3 3.312 -8.313 -3.378 32 H PHE 4 H PHE 4 6.090 -6.739 -5.776 33 HA PHE 4 HA PHE 4 4.133 -7.622 -7.715 34 HB2 PHE 4 HB2 PHE 4 7.153 -7.804 -7.778 35 HB3 PHE 4 HB1 PHE 4 6.071 -8.107 -9.131 36 HD1 PHE 4 HD1 PHE 4 8.021 -5.699 -7.423 37 HD2 PHE 4 HD2 PHE 4 4.576 -6.140 -9.877 38 HE1 PHE 4 HE1 PHE 4 8.168 -3.325 -8.047 39 HE2 PHE 4 HE2 PHE 4 4.718 -3.771 -10.510 40 HZ PHE 4 HZ PHE 4 6.517 -2.358 -9.595 41 H VAL 5 H VAL 5 3.454 -9.681 -7.974 42 HA VAL 5 HA VAL 5 4.931 -11.808 -6.583 43 HB VAL 5 HB VAL 5 1.963 -11.244 -6.370 44 HG11 VAL 5 HG11 VAL 5 1.804 -13.247 -4.988 45 HG12 VAL 5 HG12 VAL 5 3.485 -13.637 -5.357 46 HG13 VAL 5 HG13 VAL 5 2.275 -13.634 -6.644 47 HG21 VAL 5 HG21 VAL 5 4.136 -11.409 -4.303 48 HG22 VAL 5 HG22 VAL 5 2.423 -11.130 -3.971 49 HG23 VAL 5 HG23 VAL 5 3.357 -9.939 -4.882 50 H ARG 6 H ARG 6 4.998 -13.731 -7.562 51 HA ARG 6 HA ARG 6 3.528 -14.091 -10.097 52 HB2 ARG 6 HB2 ARG 6 6.205 -15.156 -9.194 53 HB3 ARG 6 HB1 ARG 6 5.391 -15.676 -10.656 54 HG2 ARG 6 HG2 ARG 6 5.507 -13.394 -11.516 55 HG3 ARG 6 HG1 ARG 6 6.349 -12.909 -10.037 56 HD2 ARG 6 HD2 ARG 6 7.837 -13.400 -12.019 57 HD3 ARG 6 HD1 ARG 6 8.220 -14.279 -10.539 58 HE ARG 6 HE ARG 6 6.513 -15.902 -11.996 59 HH11 ARG 6 HH11 ARG 6 9.682 -14.473 -12.513 60 HH12 ARG 6 HH12 ARG 6 10.275 -15.810 -13.434 61 HH21 ARG 6 HH21 ARG 6 7.299 -17.678 -13.231 62 HH22 ARG 6 HH22 ARG 6 8.907 -17.626 -13.855 63 H PHE 7 H PHE 7 2.238 -15.892 -10.235 64 HA PHE 7 HA PHE 7 2.500 -17.804 -8.022 65 HB2 PHE 7 HB2 PHE 7 0.441 -16.509 -7.766 66 HB3 PHE 7 HB1 PHE 7 -0.068 -16.977 -9.387 67 HD1 PHE 7 HD1 PHE 7 0.695 -18.293 -6.014 68 HD2 PHE 7 HD2 PHE 7 -1.174 -19.025 -9.767 69 HE1 PHE 7 HE1 PHE 7 -0.345 -20.323 -5.099 70 HE2 PHE 7 HE2 PHE 7 -2.219 -21.057 -8.852 71 HZ PHE 7 HZ PHE 7 -1.797 -21.711 -6.515 72 H ASN 8 H ASN 8 3.409 -19.530 -8.735 73 HA ASN 8 HA ASN 8 3.728 -21.522 -9.734 74 HB2 ASN 8 HB2 ASN 8 1.262 -21.729 -9.484 75 HB3 ASN 8 HB1 ASN 8 1.076 -21.092 -11.115 76 HD21 ASN 8 HD21 ASN 8 1.594 -22.390 -12.864 77 HD22 ASN 8 HD22 ASN 8 1.891 -24.080 -12.712 78 H SER 9 H SER 9 2.579 -19.111 -12.028 79 HA SER 9 HA SER 9 4.325 -20.296 -14.071 80 HB2 SER 9 HB2 SER 9 2.840 -18.990 -15.666 81 HB3 SER 9 HB1 SER 9 2.066 -20.329 -14.818 82 HG SER 9 HG SER 9 1.346 -18.682 -13.266 83 H SER 10 H SER 10 4.576 -18.272 -15.832 84 HA SER 10 HA SER 10 6.479 -16.562 -14.553 85 HB2 SER 10 HB2 SER 10 6.833 -17.510 -16.823 86 HB3 SER 10 HB1 SER 10 5.479 -16.552 -17.416 87 HG SER 10 HG SER 10 8.032 -15.714 -16.570 88 H HIS 11 H HIS 11 3.154 -16.404 -15.023 89 HA HIS 11 HA HIS 11 2.795 -13.661 -15.566 90 HB2 HIS 11 HB2 HIS 11 0.962 -15.662 -14.235 91 HB3 HIS 11 HB1 HIS 11 0.483 -14.024 -14.666 92 HD2 HIS 11 HD2 HIS 11 1.723 -13.940 -17.686 93 HE1 HIS 11 HE1 HIS 11 -0.760 -17.313 -18.277 94 HE2 HIS 11 HE2 HIS 11 0.386 -15.354 -19.400 95 H GLY 12 H GLY 12 3.021 -11.953 -14.343 96 HA2 GLY 12 HA2 GLY 12 3.162 -12.320 -11.424 97 HA3 GLY 12 HA1 GLY 12 4.163 -11.172 -12.305 98 H PHE 13 H PHE 13 1.960 -11.025 -10.179 99 HA PHE 13 HA PHE 13 0.544 -8.806 -11.457 100 HB2 PHE 13 HB2 PHE 13 -1.523 -9.449 -10.203 101 HB3 PHE 13 HB1 PHE 13 -1.060 -10.604 -11.442 102 HD1 PHE 13 HD1 PHE 13 -1.800 -10.104 -7.976 103 HD2 PHE 13 HD2 PHE 13 0.116 -12.732 -10.718 104 HE1 PHE 13 HE1 PHE 13 -1.899 -11.914 -6.310 105 HE2 PHE 13 HE2 PHE 13 0.024 -14.542 -9.058 106 HZ PHE 13 HZ PHE 13 -0.986 -14.135 -6.851 107 HA PRO 14 HA PRO 14 1.821 -6.697 -7.801 108 HB2 PRO 14 HB2 PRO 14 0.396 -4.437 -8.065 109 HB3 PRO 14 HB1 PRO 14 1.721 -4.834 -9.165 110 HG2 PRO 14 HG2 PRO 14 -1.223 -5.062 -9.582 111 HG3 PRO 14 HG1 PRO 14 0.039 -4.578 -10.727 112 HD2 PRO 14 HD2 PRO 14 -1.113 -7.100 -10.590 113 HD3 PRO 14 HD1 PRO 14 0.450 -6.733 -11.341 114 H VAL 15 H VAL 15 1.236 -7.204 -5.797 115 HA VAL 15 HA VAL 15 -1.620 -7.324 -5.136 116 HB VAL 15 HB VAL 15 0.733 -8.489 -3.610 117 HG11 VAL 15 HG11 VAL 15 -0.941 -9.654 -2.288 118 HG12 VAL 15 HG12 VAL 15 -2.234 -8.898 -3.220 119 HG13 VAL 15 HG13 VAL 15 -1.198 -7.911 -2.191 120 HG21 VAL 15 HG21 VAL 15 -0.074 -10.653 -4.404 121 HG22 VAL 15 HG22 VAL 15 0.387 -9.608 -5.748 122 HG23 VAL 15 HG23 VAL 15 -1.317 -9.844 -5.359 123 H GLU 16 H GLU 16 -2.451 -5.689 -4.065 124 HA GLU 16 HA GLU 16 -0.747 -3.747 -2.743 125 HB2 GLU 16 HB2 GLU 16 -2.943 -3.421 -4.245 126 HB3 GLU 16 HB1 GLU 16 -3.723 -3.566 -2.680 127 HG2 GLU 16 HG2 GLU 16 -1.640 -1.533 -3.452 128 HG3 GLU 16 HG1 GLU 16 -3.366 -1.238 -3.276 129 H VAL 17 H VAL 17 -0.221 -4.039 -0.694 130 HA VAL 17 HA VAL 17 -2.180 -5.269 1.131 131 HB VAL 17 HB VAL 17 -0.266 -6.253 2.402 132 HG11 VAL 17 HG11 VAL 17 -0.536 -7.206 -0.442 133 HG12 VAL 17 HG12 VAL 17 -1.639 -7.591 0.877 134 HG13 VAL 17 HG13 VAL 17 0.028 -8.162 0.927 135 HG21 VAL 17 HG21 VAL 17 1.885 -6.549 1.217 136 HG22 VAL 17 HG22 VAL 17 1.544 -4.857 1.576 137 HG23 VAL 17 HG23 VAL 17 1.310 -5.476 -0.059 138 H ASP 18 H ASP 18 -1.576 -4.814 3.453 139 HA ASP 18 HA ASP 18 -1.434 -1.974 3.776 140 HB2 ASP 18 HB2 ASP 18 -1.517 -4.227 5.784 141 HB3 ASP 18 HB1 ASP 18 -1.513 -2.528 6.233 142 H SER 19 H SER 19 0.036 -0.930 5.328 143 HA SER 19 HA SER 19 2.743 -1.383 4.706 144 HB2 SER 19 HB2 SER 19 3.052 0.270 6.670 145 HB3 SER 19 HB1 SER 19 2.165 0.829 5.251 146 HG SER 19 HG SER 19 0.791 1.357 6.797 147 H ASP 20 H ASP 20 0.659 -2.712 7.068 148 HA ASP 20 HA ASP 20 2.956 -4.063 8.277 149 HB2 ASP 20 HB2 ASP 20 1.982 -2.570 9.942 150 HB3 ASP 20 HB1 ASP 20 0.387 -3.266 9.666 151 H THR 21 H THR 21 2.612 -5.479 6.518 152 HA THR 21 HA THR 21 0.509 -7.460 7.071 153 HB THR 21 HB THR 21 1.813 -6.883 4.394 154 HG1 THR 21 HG1 THR 21 0.464 -5.233 4.570 155 HG21 THR 21 HG21 THR 21 1.072 -9.192 4.575 156 HG22 THR 21 HG22 THR 21 -0.011 -8.302 3.501 157 HG23 THR 21 HG23 THR 21 -0.511 -8.664 5.154 158 H SER 22 H SER 22 1.488 -9.088 8.124 159 HA SER 22 HA SER 22 4.260 -9.617 7.996 160 HB2 SER 22 HB2 SER 22 2.056 -11.480 8.899 161 HB3 SER 22 HB1 SER 22 3.761 -11.562 9.346 162 HG SER 22 HG SER 22 3.093 -9.163 9.973 163 H ILE 23 H ILE 23 5.359 -11.400 7.056 164 HA ILE 23 HA ILE 23 4.667 -11.988 4.421 165 HB ILE 23 HB ILE 23 6.534 -13.490 6.271 166 HG12 ILE 23 HG12 ILE 23 7.175 -11.160 5.953 167 HG13 ILE 23 HG11 ILE 23 8.310 -12.207 5.114 168 HG21 ILE 23 HG21 ILE 23 6.345 -13.655 3.262 169 HG22 ILE 23 HG22 ILE 23 5.871 -14.916 4.402 170 HG23 ILE 23 HG23 ILE 23 7.563 -14.440 4.269 171 HD11 ILE 23 HD11 ILE 23 6.081 -10.603 3.871 172 HD12 ILE 23 HD12 ILE 23 7.129 -11.719 2.997 173 HD13 ILE 23 HD13 ILE 23 7.810 -10.283 3.759 174 H PHE 24 H PHE 24 4.047 -13.811 7.389 175 HA PHE 24 HA PHE 24 2.968 -16.112 6.157 176 HB2 PHE 24 HB2 PHE 24 3.626 -16.042 8.539 177 HB3 PHE 24 HB1 PHE 24 2.304 -14.930 8.867 178 HD1 PHE 24 HD1 PHE 24 2.709 -18.218 7.138 179 HD2 PHE 24 HD2 PHE 24 0.518 -15.883 9.937 180 HE1 PHE 24 HE1 PHE 24 1.229 -20.134 7.568 181 HE2 PHE 24 HE2 PHE 24 -0.970 -17.794 10.371 182 HZ PHE 24 HZ PHE 24 -0.614 -19.923 9.186 183 H GLN 25 H GLN 25 1.506 -13.089 7.257 184 HA GLN 25 HA GLN 25 -1.175 -13.734 6.600 185 HB2 GLN 25 HB2 GLN 25 0.227 -11.061 6.818 186 HB3 GLN 25 HB1 GLN 25 -1.506 -11.246 6.609 187 HG2 GLN 25 HG2 GLN 25 -1.702 -12.321 8.744 188 HG3 GLN 25 HG1 GLN 25 0.049 -12.340 8.940 189 HE21 GLN 25 HE21 GLN 25 -2.057 -11.116 10.585 190 HE22 GLN 25 HE22 GLN 25 -1.634 -9.441 10.702 191 H LEU 26 H LEU 26 1.404 -12.033 4.882 192 HA LEU 26 HA LEU 26 0.057 -11.305 2.571 193 HB2 LEU 26 HB2 LEU 26 2.292 -10.536 3.085 194 HB3 LEU 26 HB1 LEU 26 2.923 -12.162 2.949 195 HG LEU 26 HG LEU 26 2.428 -12.143 0.532 196 HD11 LEU 26 HD11 LEU 26 0.551 -10.573 0.568 197 HD12 LEU 26 HD12 LEU 26 1.802 -10.069 -0.569 198 HD13 LEU 26 HD13 LEU 26 1.660 -9.270 0.997 199 HD21 LEU 26 HD21 LEU 26 4.172 -10.536 -0.093 200 HD22 LEU 26 HD22 LEU 26 4.627 -11.488 1.322 201 HD23 LEU 26 HD23 LEU 26 4.073 -9.825 1.518 202 H LYS 27 H LYS 27 1.722 -14.337 3.323 203 HA LYS 27 HA LYS 27 1.352 -15.644 0.886 204 HB2 LYS 27 HB2 LYS 27 2.785 -16.505 2.703 205 HB3 LYS 27 HB1 LYS 27 1.348 -16.822 3.671 206 HG2 LYS 27 HG2 LYS 27 0.584 -18.432 1.969 207 HG3 LYS 27 HG1 LYS 27 2.071 -18.151 1.063 208 HD2 LYS 27 HD2 LYS 27 1.972 -19.170 3.903 209 HD3 LYS 27 HD1 LYS 27 2.102 -20.204 2.482 210 HE2 LYS 27 HE2 LYS 27 4.200 -19.023 1.874 211 HE3 LYS 27 HE1 LYS 27 4.078 -18.101 3.372 212 HZ1 LYS 27 HZ1 LYS 27 4.268 -20.117 4.627 213 HZ2 LYS 27 HZ2 LYS 27 5.569 -20.047 3.549 214 HZ3 LYS 27 HZ3 LYS 27 4.248 -21.057 3.231 215 H GLU 28 H GLU 28 -0.693 -15.527 3.771 216 HA GLU 28 HA GLU 28 -2.727 -17.177 2.720 217 HB2 GLU 28 HB2 GLU 28 -2.636 -15.261 5.025 218 HB3 GLU 28 HB1 GLU 28 -4.065 -16.213 4.656 219 HG2 GLU 28 HG2 GLU 28 -2.472 -18.234 4.794 220 HG3 GLU 28 HG1 GLU 28 -1.372 -17.116 5.598 221 H VAL 29 H VAL 29 -2.228 -13.684 2.749 222 HA VAL 29 HA VAL 29 -4.773 -12.912 1.839 223 HB VAL 29 HB VAL 29 -2.088 -11.571 1.410 224 HG11 VAL 29 HG11 VAL 29 -4.855 -10.467 0.912 225 HG12 VAL 29 HG12 VAL 29 -3.647 -10.834 -0.319 226 HG13 VAL 29 HG13 VAL 29 -3.355 -9.541 0.846 227 HG21 VAL 29 HG21 VAL 29 -2.863 -10.057 3.189 228 HG22 VAL 29 HG22 VAL 29 -2.766 -11.729 3.744 229 HG23 VAL 29 HG23 VAL 29 -4.332 -11.020 3.352 230 H VAL 30 H VAL 30 -1.814 -13.676 0.023 231 HA VAL 30 HA VAL 30 -2.999 -13.322 -2.528 232 HB VAL 30 HB VAL 30 -0.609 -15.025 -1.763 233 HG11 VAL 30 HG11 VAL 30 -1.481 -13.986 -4.463 234 HG12 VAL 30 HG12 VAL 30 -1.503 -15.670 -3.939 235 HG13 VAL 30 HG13 VAL 30 0.033 -14.826 -4.131 236 HG21 VAL 30 HG21 VAL 30 0.728 -13.107 -2.517 237 HG22 VAL 30 HG22 VAL 30 -0.305 -12.688 -1.150 238 HG23 VAL 30 HG23 VAL 30 -0.753 -12.187 -2.781 239 H ALA 31 H ALA 31 -2.540 -16.126 -0.422 240 HA ALA 31 HA ALA 31 -3.497 -18.091 -2.140 241 HB1 ALA 31 HB1 ALA 31 -3.826 -19.441 -0.150 242 HB2 ALA 31 HB2 ALA 31 -3.703 -18.002 0.863 243 HB3 ALA 31 HB3 ALA 31 -2.302 -18.556 -0.056 244 H LYS 32 H LYS 32 -5.275 -16.280 0.382 245 HA LYS 32 HA LYS 32 -7.792 -17.441 -0.184 246 HB2 LYS 32 HB2 LYS 32 -8.735 -15.775 1.242 247 HB3 LYS 32 HB1 LYS 32 -7.162 -16.179 1.919 248 HG2 LYS 32 HG2 LYS 32 -6.238 -14.165 0.766 249 HG3 LYS 32 HG1 LYS 32 -7.885 -13.738 0.317 250 HD2 LYS 32 HD2 LYS 32 -6.843 -14.055 3.130 251 HD3 LYS 32 HD1 LYS 32 -7.136 -12.532 2.284 252 HE2 LYS 32 HE2 LYS 32 -9.251 -14.594 2.900 253 HE3 LYS 32 HE1 LYS 32 -8.952 -13.140 3.850 254 HZ1 LYS 32 HZ1 LYS 32 -9.448 -11.817 1.875 255 HZ2 LYS 32 HZ2 LYS 32 -10.759 -12.782 2.323 256 HZ3 LYS 32 HZ3 LYS 32 -9.799 -13.222 1.006 257 H ARG 33 H ARG 33 -6.068 -14.719 -1.529 258 HA ARG 33 HA ARG 33 -8.120 -13.380 -2.816 259 HB2 ARG 33 HB2 ARG 33 -5.957 -12.379 -2.666 260 HB3 ARG 33 HB1 ARG 33 -5.210 -13.714 -3.527 261 HG2 ARG 33 HG2 ARG 33 -6.409 -13.050 -5.567 262 HG3 ARG 33 HG1 ARG 33 -7.101 -11.681 -4.691 263 HD2 ARG 33 HD2 ARG 33 -4.910 -10.754 -4.317 264 HD3 ARG 33 HD1 ARG 33 -4.147 -12.171 -5.034 265 HE ARG 33 HE ARG 33 -5.456 -11.427 -7.120 266 HH11 ARG 33 HH11 ARG 33 -4.047 -9.251 -4.752 267 HH12 ARG 33 HH12 ARG 33 -3.812 -7.963 -5.877 268 HH21 ARG 33 HH21 ARG 33 -5.126 -9.720 -8.622 269 HH22 ARG 33 HH22 ARG 33 -4.421 -8.235 -8.090 270 H GLN 34 H GLN 34 -6.101 -16.064 -3.915 271 HA GLN 34 HA GLN 34 -7.598 -16.250 -6.405 272 HB2 GLN 34 HB2 GLN 34 -5.222 -17.826 -5.421 273 HB3 GLN 34 HB1 GLN 34 -5.927 -17.933 -7.029 274 HG2 GLN 34 HG2 GLN 34 -5.378 -15.580 -7.420 275 HG3 GLN 34 HG1 GLN 34 -4.651 -15.494 -5.818 276 HE21 GLN 34 HE21 GLN 34 -4.361 -16.765 -9.023 277 HE22 GLN 34 HE22 GLN 34 -2.693 -17.203 -8.913 278 H GLY 35 H GLY 35 -7.503 -17.669 -3.306 279 HA2 GLY 35 HA2 GLY 35 -9.153 -19.083 -2.431 280 HA3 GLY 35 HA1 GLY 35 -9.639 -19.498 -4.069 281 H VAL 36 H VAL 36 -6.398 -19.611 -2.686 282 HA VAL 36 HA VAL 36 -6.422 -22.521 -3.123 283 HB VAL 36 HB VAL 36 -4.004 -22.387 -3.619 284 HG11 VAL 36 HG11 VAL 36 -5.706 -20.598 -5.351 285 HG12 VAL 36 HG12 VAL 36 -5.586 -22.355 -5.462 286 HG13 VAL 36 HG13 VAL 36 -4.185 -21.351 -5.836 287 HG21 VAL 36 HG21 VAL 36 -4.405 -19.399 -3.502 288 HG22 VAL 36 HG22 VAL 36 -2.941 -20.222 -4.039 289 HG23 VAL 36 HG23 VAL 36 -3.467 -20.363 -2.361 290 HA PRO 37 HA PRO 37 -5.320 -22.970 1.128 291 HB2 PRO 37 HB2 PRO 37 -3.989 -25.316 1.117 292 HB3 PRO 37 HB1 PRO 37 -5.729 -25.212 0.824 293 HG2 PRO 37 HG2 PRO 37 -3.492 -25.496 -1.144 294 HG3 PRO 37 HG1 PRO 37 -5.065 -26.311 -1.115 295 HD2 PRO 37 HD2 PRO 37 -4.515 -24.166 -2.706 296 HD3 PRO 37 HD1 PRO 37 -6.139 -24.539 -2.099 297 H ALA 38 H ALA 38 -3.885 -21.684 2.092 298 HA ALA 38 HA ALA 38 -1.213 -21.315 1.132 299 HB1 ALA 38 HB1 ALA 38 -2.496 -19.487 2.140 300 HB2 ALA 38 HB2 ALA 38 -0.964 -19.757 2.971 301 HB3 ALA 38 HB3 ALA 38 -2.468 -20.332 3.687 302 H ASP 39 H ASP 39 -2.689 -23.533 3.231 303 HA ASP 39 HA ASP 39 -0.649 -23.970 5.129 304 HB2 ASP 39 HB2 ASP 39 -2.820 -25.796 4.111 305 HB3 ASP 39 HB1 ASP 39 -1.716 -26.247 5.406 306 H GLN 40 H GLN 40 -0.893 -24.908 1.835 307 HA GLN 40 HA GLN 40 1.593 -26.451 2.157 308 HB2 GLN 40 HB2 GLN 40 0.881 -27.905 0.317 309 HB3 GLN 40 HB1 GLN 40 -0.240 -27.985 1.668 310 HG2 GLN 40 HG2 GLN 40 -1.801 -26.560 0.511 311 HG3 GLN 40 HG1 GLN 40 -0.661 -26.342 -0.816 312 HE21 GLN 40 HE21 GLN 40 -2.895 -28.485 0.717 313 HE22 GLN 40 HE22 GLN 40 -2.934 -29.666 -0.545 314 H LEU 41 H LEU 41 0.725 -23.628 1.363 315 HA LEU 41 HA LEU 41 1.568 -23.422 -1.388 316 HB2 LEU 41 HB2 LEU 41 -0.255 -22.047 -0.456 317 HB3 LEU 41 HB1 LEU 41 0.894 -21.277 0.620 318 HG LEU 41 HG LEU 41 2.082 -20.366 -1.341 319 HD11 LEU 41 HD11 LEU 41 -0.202 -21.611 -2.860 320 HD12 LEU 41 HD12 LEU 41 1.507 -22.039 -2.976 321 HD13 LEU 41 HD13 LEU 41 0.954 -20.459 -3.526 322 HD21 LEU 41 HD21 LEU 41 0.378 -19.041 -0.196 323 HD22 LEU 41 HD22 LEU 41 -0.866 -19.731 -1.239 324 HD23 LEU 41 HD23 LEU 41 0.391 -18.703 -1.927 325 H ARG 42 H ARG 42 3.564 -22.961 -2.063 326 HA ARG 42 HA ARG 42 5.609 -22.393 -0.036 327 HB2 ARG 42 HB2 ARG 42 5.921 -24.397 -1.434 328 HB3 ARG 42 HB1 ARG 42 5.911 -23.379 -2.867 329 HG2 ARG 42 HG2 ARG 42 7.864 -22.147 -1.642 330 HG3 ARG 42 HG1 ARG 42 8.003 -23.676 -0.771 331 HD2 ARG 42 HD2 ARG 42 8.041 -24.810 -3.012 332 HD3 ARG 42 HD1 ARG 42 8.171 -23.195 -3.717 333 HE ARG 42 HE ARG 42 10.172 -23.547 -1.758 334 HH11 ARG 42 HH11 ARG 42 9.348 -24.555 -5.020 335 HH12 ARG 42 HH12 ARG 42 10.987 -24.825 -5.486 336 HH21 ARG 42 HH21 ARG 42 12.357 -23.920 -2.378 337 HH22 ARG 42 HH22 ARG 42 12.704 -24.477 -3.978 338 H VAL 43 H VAL 43 6.855 -20.582 -0.141 339 HA VAL 43 HA VAL 43 6.509 -18.886 -2.493 340 HB VAL 43 HB VAL 43 6.545 -16.859 -1.107 341 HG11 VAL 43 HG11 VAL 43 4.337 -17.033 -0.078 342 HG12 VAL 43 HG12 VAL 43 4.426 -18.791 -0.181 343 HG13 VAL 43 HG13 VAL 43 4.370 -17.827 -1.652 344 HG21 VAL 43 HG21 VAL 43 6.545 -18.737 1.257 345 HG22 VAL 43 HG22 VAL 43 6.344 -16.986 1.340 346 HG23 VAL 43 HG23 VAL 43 7.864 -17.673 0.767 347 H ILE 44 H ILE 44 8.309 -17.904 -3.260 348 HA ILE 44 HA ILE 44 10.809 -18.407 -1.803 349 HB ILE 44 HB ILE 44 10.279 -18.757 -4.756 350 HG12 ILE 44 HG12 ILE 44 9.740 -20.685 -3.333 351 HG13 ILE 44 HG11 ILE 44 11.108 -21.029 -4.384 352 HG21 ILE 44 HG21 ILE 44 12.945 -18.739 -3.344 353 HG22 ILE 44 HG22 ILE 44 12.374 -17.556 -4.520 354 HG23 ILE 44 HG23 ILE 44 12.679 -19.219 -5.020 355 HD11 ILE 44 HD11 ILE 44 11.217 -20.358 -1.451 356 HD12 ILE 44 HD12 ILE 44 12.624 -20.582 -2.488 357 HD13 ILE 44 HD13 ILE 44 11.520 -21.925 -2.198 358 H PHE 45 H PHE 45 11.775 -16.630 -1.290 359 HA PHE 45 HA PHE 45 11.826 -14.406 -3.203 360 HB2 PHE 45 HB2 PHE 45 10.362 -13.864 -1.270 361 HB3 PHE 45 HB1 PHE 45 11.697 -14.213 -0.181 362 HD1 PHE 45 HD1 PHE 45 10.242 -11.817 -2.480 363 HD2 PHE 45 HD2 PHE 45 13.635 -12.704 -0.068 364 HE1 PHE 45 HE1 PHE 45 10.962 -9.472 -2.633 365 HE2 PHE 45 HE2 PHE 45 14.358 -10.358 -0.216 366 HZ PHE 45 HZ PHE 45 13.021 -8.740 -1.499 367 H ALA 46 H ALA 46 13.846 -14.376 -3.952 368 HA ALA 46 HA ALA 46 16.115 -14.379 -4.071 369 HB1 ALA 46 HB1 ALA 46 16.006 -13.893 -1.089 370 HB2 ALA 46 HB2 ALA 46 15.974 -12.646 -2.335 371 HB3 ALA 46 HB3 ALA 46 17.409 -13.650 -2.129 372 H GLY 47 H GLY 47 14.531 -16.837 -3.369 373 HA2 GLY 47 HA2 GLY 47 15.270 -19.060 -3.493 374 HA3 GLY 47 HA1 GLY 47 16.857 -18.538 -2.955 375 H LYS 48 H LYS 48 14.275 -17.343 -1.067 376 HA LYS 48 HA LYS 48 14.309 -19.597 0.785 377 HB2 LYS 48 HB2 LYS 48 14.911 -18.156 2.688 378 HB3 LYS 48 HB1 LYS 48 16.218 -18.289 1.521 379 HG2 LYS 48 HG2 LYS 48 16.040 -16.102 0.863 380 HG3 LYS 48 HG1 LYS 48 14.330 -16.001 1.285 381 HD2 LYS 48 HD2 LYS 48 14.863 -15.957 3.619 382 HD3 LYS 48 HD1 LYS 48 16.582 -16.191 3.277 383 HE2 LYS 48 HE2 LYS 48 16.643 -14.037 2.124 384 HE3 LYS 48 HE1 LYS 48 14.918 -13.822 2.411 385 HZ1 LYS 48 HZ1 LYS 48 15.366 -13.805 4.794 386 HZ2 LYS 48 HZ2 LYS 48 16.217 -12.583 4.004 387 HZ3 LYS 48 HZ3 LYS 48 17.022 -13.980 4.503 388 H GLU 49 H GLU 49 12.875 -19.028 2.735 389 HA GLU 49 HA GLU 49 10.559 -17.507 1.793 390 HB2 GLU 49 HB2 GLU 49 10.182 -19.862 2.547 391 HB3 GLU 49 HB1 GLU 49 10.774 -19.412 4.139 392 HG2 GLU 49 HG2 GLU 49 8.923 -17.899 4.450 393 HG3 GLU 49 HG1 GLU 49 8.358 -18.208 2.811 394 H LEU 50 H LEU 50 9.854 -15.759 2.940 395 HA LEU 50 HA LEU 50 11.901 -14.459 4.451 396 HB2 LEU 50 HB2 LEU 50 9.175 -13.535 3.625 397 HB3 LEU 50 HB1 LEU 50 10.358 -12.534 4.443 398 HG LEU 50 HG LEU 50 10.659 -13.785 1.734 399 HD11 LEU 50 HD11 LEU 50 10.300 -10.924 2.583 400 HD12 LEU 50 HD12 LEU 50 9.107 -11.927 1.757 401 HD13 LEU 50 HD13 LEU 50 10.603 -11.481 0.938 402 HD21 LEU 50 HD21 LEU 50 12.724 -12.372 1.651 403 HD22 LEU 50 HD22 LEU 50 12.801 -13.728 2.771 404 HD23 LEU 50 HD23 LEU 50 12.532 -12.096 3.385 405 H ARG 51 H ARG 51 10.913 -12.896 6.188 406 HA ARG 51 HA ARG 51 10.591 -14.431 8.520 407 HB2 ARG 51 HB2 ARG 51 9.951 -11.513 8.170 408 HB3 ARG 51 HB1 ARG 51 10.458 -12.319 9.649 409 HG2 ARG 51 HG2 ARG 51 12.157 -12.010 7.189 410 HG3 ARG 51 HG1 ARG 51 12.209 -10.924 8.578 411 HD2 ARG 51 HD2 ARG 51 12.775 -13.888 8.650 412 HD3 ARG 51 HD1 ARG 51 13.998 -12.616 8.639 413 HE ARG 51 HE ARG 51 12.082 -12.364 10.773 414 HH11 ARG 51 HH11 ARG 51 15.132 -13.821 9.828 415 HH12 ARG 51 HH12 ARG 51 15.687 -14.006 11.456 416 HH21 ARG 51 HH21 ARG 51 12.818 -12.615 12.926 417 HH22 ARG 51 HH22 ARG 51 14.368 -13.320 13.226 418 H ASN 52 H ASN 52 8.776 -15.652 8.646 419 HA ASN 52 HA ASN 52 6.276 -15.156 7.598 420 HB2 ASN 52 HB2 ASN 52 7.019 -16.731 10.062 421 HB3 ASN 52 HB1 ASN 52 5.418 -16.752 9.334 422 HD21 ASN 52 HD21 ASN 52 7.385 -18.891 9.707 423 HD22 ASN 52 HD22 ASN 52 7.673 -19.540 8.130 424 H ASP 53 H ASP 53 7.344 -14.437 10.916 425 HA ASP 53 HA ASP 53 4.904 -12.872 11.275 426 HB2 ASP 53 HB2 ASP 53 5.465 -14.581 13.009 427 HB3 ASP 53 HB1 ASP 53 6.927 -13.675 13.376 428 H TRP 54 H TRP 54 6.071 -11.449 9.675 429 HA TRP 54 HA TRP 54 6.928 -9.138 11.109 430 HB2 TRP 54 HB2 TRP 54 9.063 -10.419 10.955 431 HB3 TRP 54 HB1 TRP 54 8.907 -10.392 9.204 432 HD1 TRP 54 HD1 TRP 54 10.548 -8.703 8.245 433 HE1 TRP 54 HE1 TRP 54 11.366 -6.347 8.877 434 HE3 TRP 54 HE3 TRP 54 7.936 -8.075 12.600 435 HZ2 TRP 54 HZ2 TRP 54 10.943 -4.471 10.934 436 HZ3 TRP 54 HZ3 TRP 54 8.199 -5.966 13.836 437 HH2 TRP 54 HH2 TRP 54 9.673 -4.202 13.020 438 H THR 55 H THR 55 6.821 -7.270 9.854 439 HA THR 55 HA THR 55 4.898 -7.378 7.817 440 HB THR 55 HB THR 55 5.005 -5.436 9.235 441 HG1 THR 55 HG1 THR 55 4.871 -3.865 7.608 442 HG21 THR 55 HG21 THR 55 7.421 -5.396 9.662 443 HG22 THR 55 HG22 THR 55 6.857 -3.824 9.099 444 HG23 THR 55 HG23 THR 55 7.712 -4.899 7.995 445 H VAL 56 H VAL 56 4.957 -7.086 5.696 446 HA VAL 56 HA VAL 56 7.222 -7.920 4.223 447 HB VAL 56 HB VAL 56 4.911 -8.405 3.524 448 HG11 VAL 56 HG11 VAL 56 3.489 -6.679 2.552 449 HG12 VAL 56 HG12 VAL 56 4.686 -5.452 2.962 450 HG13 VAL 56 HG13 VAL 56 3.852 -6.331 4.243 451 HG21 VAL 56 HG21 VAL 56 6.633 -8.438 1.839 452 HG22 VAL 56 HG22 VAL 56 6.419 -6.711 1.545 453 HG23 VAL 56 HG23 VAL 56 5.124 -7.842 1.148 454 H GLN 57 H GLN 57 5.965 -4.851 5.204 455 HA GLN 57 HA GLN 57 6.981 -3.175 3.231 456 HB2 GLN 57 HB2 GLN 57 5.379 -2.358 4.807 457 HB3 GLN 57 HB1 GLN 57 6.454 -2.684 6.157 458 HG2 GLN 57 HG2 GLN 57 7.991 -0.969 5.326 459 HG3 GLN 57 HG1 GLN 57 6.880 -0.630 4.003 460 HE21 GLN 57 HE21 GLN 57 7.420 -0.399 7.425 461 HE22 GLN 57 HE22 GLN 57 6.172 0.753 7.747 462 H ASN 58 H ASN 58 8.441 -4.243 6.263 463 HA ASN 58 HA ASN 58 10.788 -2.696 5.987 464 HB2 ASN 58 HB2 ASN 58 10.146 -3.400 8.170 465 HB3 ASN 58 HB1 ASN 58 10.160 -5.094 7.696 466 HD21 ASN 58 HD21 ASN 58 12.136 -2.309 8.406 467 HD22 ASN 58 HD22 ASN 58 13.600 -3.182 8.680 468 H CYS 59 H CYS 59 9.884 -5.757 4.647 469 HA CYS 59 HA CYS 59 12.641 -6.455 4.112 470 HB2 CYS 59 HB2 CYS 59 10.944 -8.204 4.648 471 HB3 CYS 59 HB1 CYS 59 10.146 -7.842 3.121 472 HG CYS 59 HG CYS 59 12.819 -8.366 1.848 473 H ASP 60 H ASP 60 10.279 -4.545 2.710 474 HA ASP 60 HA ASP 60 10.131 -3.349 0.794 475 HB2 ASP 60 HB2 ASP 60 13.088 -3.932 0.762 476 HB3 ASP 60 HB1 ASP 60 12.312 -2.880 -0.413 477 H LEU 61 H LEU 61 9.087 -5.776 0.319 478 HA LEU 61 HA LEU 61 10.254 -7.134 -1.896 479 HB2 LEU 61 HB2 LEU 61 7.483 -7.132 -0.730 480 HB3 LEU 61 HB1 LEU 61 7.827 -7.998 -2.211 481 HG LEU 61 HG LEU 61 9.518 -9.345 -0.995 482 HD11 LEU 61 HD11 LEU 61 10.117 -7.827 0.756 483 HD12 LEU 61 HD12 LEU 61 9.488 -9.317 1.461 484 HD13 LEU 61 HD13 LEU 61 8.482 -7.871 1.406 485 HD21 LEU 61 HD21 LEU 61 7.904 -10.679 0.294 486 HD22 LEU 61 HD22 LEU 61 7.294 -10.216 -1.293 487 HD23 LEU 61 HD23 LEU 61 6.730 -9.372 0.142 488 H ASP 62 H ASP 62 8.696 -4.196 -1.653 489 HA ASP 62 HA ASP 62 7.578 -4.015 -4.278 490 HB2 ASP 62 HB2 ASP 62 6.630 -2.518 -2.740 491 HB3 ASP 62 HB1 ASP 62 8.194 -2.063 -2.076 492 H GLN 63 H GLN 63 10.663 -3.363 -2.805 493 HA GLN 63 HA GLN 63 11.670 -2.136 -5.271 494 HB2 GLN 63 HB2 GLN 63 11.927 -0.875 -3.166 495 HB3 GLN 63 HB1 GLN 63 12.863 -2.201 -2.497 496 HG2 GLN 63 HG2 GLN 63 14.342 -0.454 -3.193 497 HG3 GLN 63 HG1 GLN 63 14.555 -1.848 -4.251 498 HE21 GLN 63 HE21 GLN 63 13.325 1.379 -3.986 499 HE22 GLN 63 HE22 GLN 63 13.155 1.681 -5.678 500 H GLN 64 H GLN 64 12.100 -4.870 -3.127 501 HA GLN 64 HA GLN 64 14.460 -5.699 -4.647 502 HB2 GLN 64 HB2 GLN 64 13.462 -6.521 -1.928 503 HB3 GLN 64 HB1 GLN 64 14.822 -7.280 -2.741 504 HG2 GLN 64 HG2 GLN 64 14.652 -4.371 -1.995 505 HG3 GLN 64 HG1 GLN 64 15.513 -5.613 -1.083 506 HE21 GLN 64 HE21 GLN 64 17.395 -6.490 -1.929 507 HE22 GLN 64 HE22 GLN 64 18.272 -5.724 -3.209 508 H SEP 65 H SEP 65 13.904 -6.893 -6.329 509 HA SEP 65 HA SEP 65 13.245 -8.674 -7.561 510 HB2 SEP 65 HB1 SEP 65 13.154 -10.844 -6.421 511 HB3 SEP 65 HB2 SEP 65 13.099 -10.018 -4.863 512 H ILE 66 H ILE 66 11.551 -10.732 -7.290 513 HA ILE 66 HA ILE 66 8.928 -9.590 -6.675 514 HB ILE 66 HB ILE 66 9.390 -9.664 -9.175 515 HG12 ILE 66 HG12 ILE 66 7.200 -11.566 -8.359 516 HG13 ILE 66 HG11 ILE 66 7.089 -9.824 -8.155 517 HG21 ILE 66 HG21 ILE 66 9.398 -11.798 -10.316 518 HG22 ILE 66 HG22 ILE 66 9.279 -12.643 -8.776 519 HG23 ILE 66 HG23 ILE 66 10.742 -11.726 -9.168 520 HD11 ILE 66 HD11 ILE 66 7.451 -11.264 -10.770 521 HD12 ILE 66 HD12 ILE 66 7.297 -9.520 -10.559 522 HD13 ILE 66 HD13 ILE 66 5.943 -10.580 -10.166 523 H VAL 67 H VAL 67 7.401 -11.140 -5.900 524 HA VAL 67 HA VAL 67 8.669 -13.293 -4.450 525 HB VAL 67 HB VAL 67 5.722 -12.668 -4.546 526 HG11 VAL 67 HG11 VAL 67 7.427 -14.011 -2.452 527 HG12 VAL 67 HG12 VAL 67 6.299 -14.811 -3.545 528 HG13 VAL 67 HG13 VAL 67 5.697 -13.692 -2.323 529 HG21 VAL 67 HG21 VAL 67 6.900 -10.626 -3.980 530 HG22 VAL 67 HG22 VAL 67 7.829 -11.481 -2.749 531 HG23 VAL 67 HG23 VAL 67 6.086 -11.273 -2.555 532 H HIS 68 H HIS 68 8.888 -15.294 -5.208 533 HA HIS 68 HA HIS 68 7.182 -16.169 -7.422 534 HB2 HIS 68 HB2 HIS 68 9.727 -17.315 -6.255 535 HB3 HIS 68 HB1 HIS 68 8.789 -18.121 -7.503 536 HD2 HIS 68 HD2 HIS 68 9.793 -14.312 -7.506 537 HE1 HIS 68 HE1 HIS 68 11.526 -16.263 -10.831 538 HE2 HIS 68 HE2 HIS 68 11.464 -14.132 -9.475 539 H ILE 69 H ILE 69 5.331 -17.038 -6.741 540 HA ILE 69 HA ILE 69 5.398 -18.753 -4.361 541 HB ILE 69 HB ILE 69 3.030 -17.437 -5.709 542 HG12 ILE 69 HG12 ILE 69 4.562 -16.726 -3.199 543 HG13 ILE 69 HG11 ILE 69 4.398 -15.760 -4.655 544 HG21 ILE 69 HG21 ILE 69 1.777 -18.144 -3.729 545 HG22 ILE 69 HG22 ILE 69 3.206 -18.990 -3.134 546 HG23 ILE 69 HG23 ILE 69 2.425 -19.520 -4.624 547 HD11 ILE 69 HD11 ILE 69 2.172 -16.459 -2.755 548 HD12 ILE 69 HD12 ILE 69 2.023 -15.478 -4.212 549 HD13 ILE 69 HD13 ILE 69 3.003 -14.907 -2.861 550 H VAL 70 H VAL 70 5.044 -20.886 -4.582 551 HA VAL 70 HA VAL 70 3.976 -21.840 -7.159 552 HB VAL 70 HB VAL 70 6.230 -23.158 -5.618 553 HG11 VAL 70 HG11 VAL 70 5.024 -23.825 -8.302 554 HG12 VAL 70 HG12 VAL 70 4.852 -24.760 -6.817 555 HG13 VAL 70 HG13 VAL 70 6.432 -24.610 -7.586 556 HG21 VAL 70 HG21 VAL 70 6.333 -21.608 -8.208 557 HG22 VAL 70 HG22 VAL 70 7.676 -22.496 -7.490 558 HG23 VAL 70 HG23 VAL 70 7.004 -21.093 -6.660 559 H GLN 71 H GLN 71 2.437 -23.394 -7.023 560 HA GLN 71 HA GLN 71 2.096 -24.790 -4.475 561 HB2 GLN 71 HB2 GLN 71 0.500 -22.948 -4.487 562 HB3 GLN 71 HB1 GLN 71 -0.093 -23.448 -6.061 563 HG2 GLN 71 HG2 GLN 71 -0.848 -25.567 -5.074 564 HG3 GLN 71 HG1 GLN 71 -0.319 -24.994 -3.494 565 HE21 GLN 71 HE21 GLN 71 -2.601 -24.569 -6.077 566 HE22 GLN 71 HE22 GLN 71 -3.747 -23.645 -5.173 567 H ARG 72 H ARG 72 1.964 -26.902 -4.760 568 HA ARG 72 HA ARG 72 0.833 -27.947 -7.254 569 HB2 ARG 72 HB2 ARG 72 3.288 -29.100 -5.895 570 HB3 ARG 72 HB1 ARG 72 2.551 -29.668 -7.386 571 HG2 ARG 72 HG2 ARG 72 3.151 -27.547 -8.474 572 HG3 ARG 72 HG1 ARG 72 3.918 -27.013 -6.979 573 HD2 ARG 72 HD2 ARG 72 5.656 -27.823 -8.359 574 HD3 ARG 72 HD1 ARG 72 5.379 -29.068 -7.143 575 HE ARG 72 HE ARG 72 3.913 -29.455 -9.594 576 HH11 ARG 72 HH11 ARG 72 6.920 -30.115 -7.897 577 HH12 ARG 72 HH12 ARG 72 7.333 -31.469 -8.890 578 HH21 ARG 72 HH21 ARG 72 4.491 -31.243 -10.931 579 HH22 ARG 72 HH22 ARG 72 5.958 -32.100 -10.618 580 HA PRO 73 HA PRO 73 -1.161 -29.782 -3.546 581 HB2 PRO 73 HB2 PRO 73 -3.658 -29.546 -4.986 582 HB3 PRO 73 HB1 PRO 73 -3.152 -28.711 -3.516 583 HG2 PRO 73 HG2 PRO 73 -3.498 -27.454 -5.917 584 HG3 PRO 73 HG1 PRO 73 -2.377 -26.888 -4.665 585 HD2 PRO 73 HD2 PRO 73 -1.813 -28.478 -7.143 586 HD3 PRO 73 HD1 PRO 73 -0.903 -27.121 -6.445 587 H TRP 74 H TRP 74 -2.286 -31.745 -3.242 588 HA TRP 74 HA TRP 74 -1.714 -33.682 -5.327 589 HB2 TRP 74 HB2 TRP 74 -2.680 -34.034 -2.486 590 HB3 TRP 74 HB1 TRP 74 -2.290 -35.350 -3.584 591 HD1 TRP 74 HD1 TRP 74 0.262 -35.886 -4.001 592 HE1 TRP 74 HE1 TRP 74 2.414 -35.176 -2.783 593 HE3 TRP 74 HE3 TRP 74 -1.610 -32.023 -1.218 594 HZ2 TRP 74 HZ2 TRP 74 3.214 -33.240 -0.894 595 HZ3 TRP 74 HZ3 TRP 74 -0.083 -30.796 0.270 596 HH2 TRP 74 HH2 TRP 74 2.278 -31.393 0.428 597 H ARG 75 H ARG 75 -4.500 -32.584 -3.438 598 HA ARG 75 HA ARG 75 -6.238 -33.989 -5.358 599 HB2 ARG 75 HB2 ARG 75 -7.871 -34.244 -3.516 600 HB3 ARG 75 HB1 ARG 75 -6.355 -35.085 -3.213 601 HG2 ARG 75 HG2 ARG 75 -5.637 -33.242 -1.764 602 HG3 ARG 75 HG1 ARG 75 -7.179 -32.433 -2.044 603 HD2 ARG 75 HD2 ARG 75 -7.264 -33.589 0.063 604 HD3 ARG 75 HD1 ARG 75 -8.331 -34.398 -1.080 605 HE ARG 75 HE ARG 75 -5.733 -35.570 -1.036 606 HH11 ARG 75 HH11 ARG 75 -8.794 -35.448 0.673 607 HH12 ARG 75 HH12 ARG 75 -8.594 -36.992 1.417 608 HH21 ARG 75 HH21 ARG 75 -5.460 -37.620 -0.056 609 HH22 ARG 75 HH22 ARG 75 -6.680 -38.236 1.002 610 H LYS 76 H LYS 76 -5.196 -31.094 -4.967 611 HA LYS 76 HA LYS 76 -7.829 -29.827 -5.271 612 HB2 LYS 76 HB2 LYS 76 -5.353 -28.688 -3.963 613 HB3 LYS 76 HB1 LYS 76 -6.758 -27.725 -4.392 614 HG2 LYS 76 HG2 LYS 76 -6.805 -30.069 -2.501 615 HG3 LYS 76 HG1 LYS 76 -6.696 -28.377 -2.009 616 HD2 LYS 76 HD2 LYS 76 -8.849 -27.904 -2.988 617 HD3 LYS 76 HD1 LYS 76 -8.943 -29.529 -3.665 618 HE2 LYS 76 HE2 LYS 76 -10.314 -29.324 -1.659 619 HE3 LYS 76 HE1 LYS 76 -9.002 -30.473 -1.425 620 HZ1 LYS 76 HZ1 LYS 76 -8.959 -27.655 -0.499 621 HZ2 LYS 76 HZ2 LYS 76 -7.785 -28.831 -0.184 622 HZ3 LYS 76 HZ3 LYS 76 -9.329 -28.981 0.472 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 1.623 -1.675 1.008 2 H2 MET 1 HT2 MET 1 0.544 -0.566 0.343 3 H3 MET 1 HT3 MET 1 1.850 -0.016 1.253 4 HA MET 1 HA MET 1 2.115 0.264 -1.152 5 HB2 MET 1 HB2 MET 1 4.402 -0.473 -1.246 6 HB3 MET 1 HB1 MET 1 4.072 0.042 0.398 7 HG2 MET 1 HG2 MET 1 3.846 -2.294 1.084 8 HG3 MET 1 HG1 MET 1 4.163 -2.810 -0.571 9 HE1 MET 1 HE1 MET 1 7.505 -3.886 1.092 10 HE2 MET 1 HE2 MET 1 6.155 -4.363 0.065 11 HE3 MET 1 HE3 MET 1 5.882 -4.021 1.774 12 H ILE 2 H ILE 2 2.676 -0.790 -3.150 13 HA ILE 2 HA ILE 2 1.201 -3.307 -3.454 14 HB ILE 2 HB ILE 2 2.018 -1.319 -5.576 15 HG12 ILE 2 HG12 ILE 2 -0.681 -1.716 -4.277 16 HG13 ILE 2 HG11 ILE 2 0.414 -0.385 -3.930 17 HG21 ILE 2 HG21 ILE 2 0.386 -2.523 -6.973 18 HG22 ILE 2 HG22 ILE 2 0.133 -3.676 -5.663 19 HG23 ILE 2 HG23 ILE 2 1.709 -3.564 -6.449 20 HD11 ILE 2 HD11 ILE 2 -0.916 -0.974 -6.555 21 HD12 ILE 2 HD12 ILE 2 0.236 0.331 -6.268 22 HD13 ILE 2 HD13 ILE 2 -1.318 0.324 -5.432 23 H VAL 3 H VAL 3 2.365 -5.087 -3.715 24 HA VAL 3 HA VAL 3 5.056 -4.800 -4.860 25 HB VAL 3 HB VAL 3 5.692 -6.864 -3.652 26 HG11 VAL 3 HG11 VAL 3 5.813 -5.881 -1.413 27 HG12 VAL 3 HG12 VAL 3 4.613 -4.677 -1.882 28 HG13 VAL 3 HG13 VAL 3 6.191 -4.702 -2.669 29 HG21 VAL 3 HG21 VAL 3 3.489 -7.890 -3.431 30 HG22 VAL 3 HG22 VAL 3 2.985 -6.602 -2.337 31 HG23 VAL 3 HG23 VAL 3 4.261 -7.720 -1.854 32 H PHE 4 H PHE 4 5.749 -6.332 -6.336 33 HA PHE 4 HA PHE 4 3.584 -7.590 -7.813 34 HB2 PHE 4 HB2 PHE 4 6.492 -7.094 -8.438 35 HB3 PHE 4 HB1 PHE 4 5.455 -8.065 -9.472 36 HD1 PHE 4 HD1 PHE 4 5.710 -4.686 -7.930 37 HD2 PHE 4 HD2 PHE 4 4.189 -7.057 -11.113 38 HE1 PHE 4 HE1 PHE 4 4.935 -2.647 -9.066 39 HE2 PHE 4 HE2 PHE 4 3.406 -5.019 -12.259 40 HZ PHE 4 HZ PHE 4 3.779 -2.813 -11.234 41 H VAL 5 H VAL 5 3.330 -9.735 -8.048 42 HA VAL 5 HA VAL 5 5.295 -11.461 -6.777 43 HB VAL 5 HB VAL 5 3.659 -10.983 -5.046 44 HG11 VAL 5 HG11 VAL 5 1.317 -11.591 -5.270 45 HG12 VAL 5 HG12 VAL 5 1.592 -11.996 -6.967 46 HG13 VAL 5 HG13 VAL 5 1.794 -10.333 -6.412 47 HG21 VAL 5 HG21 VAL 5 3.278 -13.757 -6.146 48 HG22 VAL 5 HG22 VAL 5 2.901 -13.226 -4.505 49 HG23 VAL 5 HG23 VAL 5 4.573 -13.226 -5.069 50 H ARG 6 H ARG 6 5.529 -13.393 -7.665 51 HA ARG 6 HA ARG 6 4.065 -13.992 -10.138 52 HB2 ARG 6 HB2 ARG 6 6.654 -15.128 -9.050 53 HB3 ARG 6 HB1 ARG 6 5.974 -15.454 -10.627 54 HG2 ARG 6 HG2 ARG 6 6.674 -12.671 -9.832 55 HG3 ARG 6 HG1 ARG 6 7.912 -13.789 -10.408 56 HD2 ARG 6 HD2 ARG 6 5.425 -12.929 -11.870 57 HD3 ARG 6 HD1 ARG 6 7.090 -12.470 -12.232 58 HE ARG 6 HE ARG 6 6.756 -15.299 -12.280 59 HH11 ARG 6 HH11 ARG 6 6.288 -12.388 -14.174 60 HH12 ARG 6 HH12 ARG 6 6.271 -13.218 -15.688 61 HH21 ARG 6 HH21 ARG 6 6.736 -16.417 -14.294 62 HH22 ARG 6 HH22 ARG 6 6.521 -15.517 -15.756 63 H PHE 7 H PHE 7 3.072 -16.009 -10.364 64 HA PHE 7 HA PHE 7 3.241 -17.832 -8.089 65 HB2 PHE 7 HB2 PHE 7 1.194 -16.424 -7.814 66 HB3 PHE 7 HB1 PHE 7 0.615 -17.014 -9.366 67 HD1 PHE 7 HD1 PHE 7 1.533 -18.066 -5.944 68 HD2 PHE 7 HD2 PHE 7 -0.526 -19.062 -9.526 69 HE1 PHE 7 HE1 PHE 7 0.506 -19.991 -4.816 70 HE2 PHE 7 HE2 PHE 7 -1.557 -20.991 -8.400 71 HZ PHE 7 HZ PHE 7 -1.036 -21.458 -6.042 72 H ASN 8 H ASN 8 2.816 -19.996 -8.589 73 HA ASN 8 HA ASN 8 3.800 -20.966 -10.979 74 HB2 ASN 8 HB2 ASN 8 3.657 -22.383 -9.024 75 HB3 ASN 8 HB1 ASN 8 1.896 -22.311 -9.057 76 HD21 ASN 8 HD21 ASN 8 1.482 -24.435 -9.361 77 HD22 ASN 8 HD22 ASN 8 1.959 -25.326 -10.761 78 H SER 9 H SER 9 3.065 -21.017 -12.962 79 HA SER 9 HA SER 9 1.731 -21.154 -14.775 80 HB2 SER 9 HB2 SER 9 -0.415 -22.139 -12.885 81 HB3 SER 9 HB1 SER 9 -0.368 -22.363 -14.634 82 HG SER 9 HG SER 9 1.760 -23.265 -13.018 83 H SER 10 H SER 10 1.679 -18.812 -12.824 84 HA SER 10 HA SER 10 -0.697 -17.505 -13.952 85 HB2 SER 10 HB2 SER 10 -0.734 -17.908 -11.439 86 HB3 SER 10 HB1 SER 10 0.638 -16.807 -11.328 87 HG SER 10 HG SER 10 -1.658 -15.986 -11.069 88 H HIS 11 H HIS 11 0.034 -14.921 -13.127 89 HA HIS 11 HA HIS 11 2.449 -14.444 -14.757 90 HB2 HIS 11 HB2 HIS 11 0.019 -12.657 -14.468 91 HB3 HIS 11 HB1 HIS 11 1.439 -12.311 -15.444 92 HD2 HIS 11 HD2 HIS 11 1.773 -14.277 -17.606 93 HE1 HIS 11 HE1 HIS 11 -2.412 -14.888 -17.776 94 HE2 HIS 11 HE2 HIS 11 -0.182 -15.473 -18.816 95 H GLY 12 H GLY 12 3.050 -11.932 -14.276 96 HA2 GLY 12 HA2 GLY 12 3.654 -11.871 -11.423 97 HA3 GLY 12 HA1 GLY 12 4.346 -10.824 -12.661 98 H PHE 13 H PHE 13 1.511 -11.439 -10.709 99 HA PHE 13 HA PHE 13 0.330 -8.933 -11.573 100 HB2 PHE 13 HB2 PHE 13 -1.623 -9.683 -10.148 101 HB3 PHE 13 HB1 PHE 13 -1.247 -10.705 -11.527 102 HD1 PHE 13 HD1 PHE 13 -1.254 -10.455 -7.877 103 HD2 PHE 13 HD2 PHE 13 -0.393 -12.944 -11.215 104 HE1 PHE 13 HE1 PHE 13 -1.168 -12.414 -6.391 105 HE2 PHE 13 HE2 PHE 13 -0.299 -14.906 -9.734 106 HZ PHE 13 HZ PHE 13 -0.690 -14.642 -7.317 107 HA PRO 14 HA PRO 14 1.629 -6.836 -7.921 108 HB2 PRO 14 HB2 PRO 14 0.157 -4.609 -8.157 109 HB3 PRO 14 HB1 PRO 14 1.469 -4.971 -9.286 110 HG2 PRO 14 HG2 PRO 14 -1.478 -5.256 -9.649 111 HG3 PRO 14 HG1 PRO 14 -0.245 -4.748 -10.816 112 HD2 PRO 14 HD2 PRO 14 -1.349 -7.295 -10.647 113 HD3 PRO 14 HD1 PRO 14 0.176 -6.891 -11.454 114 H VAL 15 H VAL 15 1.069 -7.041 -5.859 115 HA VAL 15 HA VAL 15 -1.787 -7.237 -5.176 116 HB VAL 15 HB VAL 15 0.586 -8.636 -3.878 117 HG11 VAL 15 HG11 VAL 15 -0.991 -7.796 -2.176 118 HG12 VAL 15 HG12 VAL 15 -0.986 -9.556 -2.271 119 HG13 VAL 15 HG13 VAL 15 -2.305 -8.637 -2.997 120 HG21 VAL 15 HG21 VAL 15 -0.615 -10.668 -4.464 121 HG22 VAL 15 HG22 VAL 15 -0.287 -9.695 -5.899 122 HG23 VAL 15 HG23 VAL 15 -1.903 -9.710 -5.193 123 H GLU 16 H GLU 16 -2.529 -5.641 -3.957 124 HA GLU 16 HA GLU 16 -0.628 -3.838 -2.710 125 HB2 GLU 16 HB2 GLU 16 -2.431 -2.884 -4.072 126 HB3 GLU 16 HB1 GLU 16 -3.623 -3.612 -3.004 127 HG2 GLU 16 HG2 GLU 16 -2.964 -2.222 -1.191 128 HG3 GLU 16 HG1 GLU 16 -1.565 -1.631 -2.085 129 H VAL 17 H VAL 17 -0.085 -4.029 -0.685 130 HA VAL 17 HA VAL 17 -2.009 -5.130 1.247 131 HB VAL 17 HB VAL 17 -0.096 -6.235 2.422 132 HG11 VAL 17 HG11 VAL 17 -1.621 -7.496 0.946 133 HG12 VAL 17 HG12 VAL 17 0.005 -8.172 0.976 134 HG13 VAL 17 HG13 VAL 17 -0.519 -7.206 -0.401 135 HG21 VAL 17 HG21 VAL 17 1.980 -6.644 1.156 136 HG22 VAL 17 HG22 VAL 17 1.733 -4.927 1.483 137 HG23 VAL 17 HG23 VAL 17 1.396 -5.576 -0.121 138 H ASP 18 H ASP 18 -1.084 -4.713 3.549 139 HA ASP 18 HA ASP 18 -0.545 -1.870 3.726 140 HB2 ASP 18 HB2 ASP 18 -1.123 -4.005 5.777 141 HB3 ASP 18 HB1 ASP 18 -0.654 -2.374 6.232 142 H SER 19 H SER 19 1.171 -1.069 5.139 143 HA SER 19 HA SER 19 3.662 -2.308 4.557 144 HB2 SER 19 HB2 SER 19 3.053 -0.056 6.490 145 HB3 SER 19 HB1 SER 19 4.635 -0.461 5.825 146 HG SER 19 HG SER 19 2.493 0.859 4.659 147 H ASP 20 H ASP 20 1.414 -2.442 7.174 148 HA ASP 20 HA ASP 20 3.335 -3.719 8.944 149 HB2 ASP 20 HB2 ASP 20 1.660 -3.562 10.663 150 HB3 ASP 20 HB1 ASP 20 1.723 -2.019 9.823 151 H THR 21 H THR 21 1.562 -4.735 6.416 152 HA THR 21 HA THR 21 0.261 -7.044 7.388 153 HB THR 21 HB THR 21 1.308 -6.342 4.631 154 HG1 THR 21 HG1 THR 21 -1.210 -6.163 5.922 155 HG21 THR 21 HG21 THR 21 1.154 -8.775 4.799 156 HG22 THR 21 HG22 THR 21 -0.146 -8.151 3.782 157 HG23 THR 21 HG23 THR 21 -0.484 -8.642 5.443 158 H SER 22 H SER 22 1.177 -8.815 8.202 159 HA SER 22 HA SER 22 3.990 -9.251 8.021 160 HB2 SER 22 HB2 SER 22 3.496 -11.296 9.331 161 HB3 SER 22 HB1 SER 22 2.779 -9.851 10.047 162 HG SER 22 HG SER 22 1.293 -11.572 9.992 163 H ILE 23 H ILE 23 4.973 -11.197 7.182 164 HA ILE 23 HA ILE 23 4.182 -11.819 4.562 165 HB ILE 23 HB ILE 23 5.975 -13.496 6.343 166 HG12 ILE 23 HG12 ILE 23 6.755 -11.181 6.313 167 HG13 ILE 23 HG11 ILE 23 7.848 -12.207 5.394 168 HG21 ILE 23 HG21 ILE 23 7.023 -14.203 4.224 169 HG22 ILE 23 HG22 ILE 23 5.813 -13.281 3.336 170 HG23 ILE 23 HG23 ILE 23 5.323 -14.665 4.313 171 HD11 ILE 23 HD11 ILE 23 5.761 -10.350 4.266 172 HD12 ILE 23 HD12 ILE 23 6.794 -11.418 3.315 173 HD13 ILE 23 HD13 ILE 23 7.508 -10.109 4.256 174 H PHE 24 H PHE 24 3.267 -13.132 7.625 175 HA PHE 24 HA PHE 24 2.206 -15.609 6.747 176 HB2 PHE 24 HB2 PHE 24 2.731 -15.070 9.127 177 HB3 PHE 24 HB1 PHE 24 1.381 -13.946 9.138 178 HD1 PHE 24 HD1 PHE 24 1.684 -17.405 7.774 179 HD2 PHE 24 HD2 PHE 24 -0.218 -14.802 10.552 180 HE1 PHE 24 HE1 PHE 24 0.183 -19.231 8.451 181 HE2 PHE 24 HE2 PHE 24 -1.723 -16.625 11.232 182 HZ PHE 24 HZ PHE 24 -1.524 -18.841 10.180 183 H GLN 25 H GLN 25 0.734 -12.421 7.328 184 HA GLN 25 HA GLN 25 -1.882 -13.195 6.463 185 HB2 GLN 25 HB2 GLN 25 -0.626 -10.440 6.612 186 HB3 GLN 25 HB1 GLN 25 -2.339 -10.769 6.397 187 HG2 GLN 25 HG2 GLN 25 -0.692 -11.483 8.813 188 HG3 GLN 25 HG1 GLN 25 -1.821 -10.136 8.687 189 HE21 GLN 25 HE21 GLN 25 -4.026 -10.554 8.664 190 HE22 GLN 25 HE22 GLN 25 -4.680 -12.073 9.168 191 H LEU 26 H LEU 26 0.904 -11.708 4.907 192 HA LEU 26 HA LEU 26 -0.246 -11.159 2.404 193 HB2 LEU 26 HB2 LEU 26 1.902 -10.258 3.022 194 HB3 LEU 26 HB1 LEU 26 2.576 -11.866 3.192 195 HG LEU 26 HG LEU 26 2.343 -12.193 0.747 196 HD11 LEU 26 HD11 LEU 26 1.855 -10.313 -0.690 197 HD12 LEU 26 HD12 LEU 26 1.595 -9.278 0.711 198 HD13 LEU 26 HD13 LEU 26 0.489 -10.614 0.383 199 HD21 LEU 26 HD21 LEU 26 3.894 -9.773 1.624 200 HD22 LEU 26 HD22 LEU 26 4.162 -10.668 0.125 201 HD23 LEU 26 HD23 LEU 26 4.443 -11.448 1.684 202 H LYS 27 H LYS 27 1.256 -14.043 3.723 203 HA LYS 27 HA LYS 27 1.347 -15.738 1.528 204 HB2 LYS 27 HB2 LYS 27 2.118 -16.125 3.944 205 HB3 LYS 27 HB1 LYS 27 0.450 -16.534 4.301 206 HG2 LYS 27 HG2 LYS 27 1.429 -18.599 3.998 207 HG3 LYS 27 HG1 LYS 27 0.732 -18.279 2.409 208 HD2 LYS 27 HD2 LYS 27 2.844 -17.634 1.525 209 HD3 LYS 27 HD1 LYS 27 3.582 -17.632 3.129 210 HE2 LYS 27 HE2 LYS 27 2.466 -20.063 1.740 211 HE3 LYS 27 HE1 LYS 27 4.170 -19.624 1.780 212 HZ1 LYS 27 HZ1 LYS 27 2.518 -20.198 4.189 213 HZ2 LYS 27 HZ2 LYS 27 4.177 -19.890 4.160 214 HZ3 LYS 27 HZ3 LYS 27 3.568 -21.294 3.452 215 H GLU 28 H GLU 28 -1.257 -15.081 3.789 216 HA GLU 28 HA GLU 28 -3.180 -16.798 2.656 217 HB2 GLU 28 HB2 GLU 28 -3.446 -14.370 4.403 218 HB3 GLU 28 HB1 GLU 28 -4.756 -15.477 4.059 219 HG2 GLU 28 HG2 GLU 28 -3.462 -17.279 5.120 220 HG3 GLU 28 HG1 GLU 28 -2.208 -16.102 5.518 221 H VAL 29 H VAL 29 -2.458 -13.352 2.253 222 HA VAL 29 HA VAL 29 -4.709 -12.624 0.770 223 HB VAL 29 HB VAL 29 -1.923 -11.452 0.586 224 HG11 VAL 29 HG11 VAL 29 -4.569 -10.307 -0.320 225 HG12 VAL 29 HG12 VAL 29 -3.267 -10.862 -1.371 226 HG13 VAL 29 HG13 VAL 29 -3.023 -9.458 -0.331 227 HG21 VAL 29 HG21 VAL 29 -2.803 -9.734 2.105 228 HG22 VAL 29 HG22 VAL 29 -2.860 -11.339 2.835 229 HG23 VAL 29 HG23 VAL 29 -4.333 -10.608 2.199 230 H VAL 30 H VAL 30 -1.540 -13.757 -0.407 231 HA VAL 30 HA VAL 30 -2.318 -13.601 -3.145 232 HB VAL 30 HB VAL 30 -0.109 -15.269 -1.913 233 HG11 VAL 30 HG11 VAL 30 0.865 -15.245 -4.174 234 HG12 VAL 30 HG12 VAL 30 -0.554 -14.388 -4.769 235 HG13 VAL 30 HG13 VAL 30 -0.713 -16.031 -4.153 236 HG21 VAL 30 HG21 VAL 30 1.372 -13.424 -2.572 237 HG22 VAL 30 HG22 VAL 30 0.157 -12.896 -1.407 238 HG23 VAL 30 HG23 VAL 30 -0.028 -12.501 -3.116 239 H ALA 31 H ALA 31 -2.349 -16.143 -0.720 240 HA ALA 31 HA ALA 31 -3.003 -18.293 -2.380 241 HB1 ALA 31 HB1 ALA 31 -2.224 -18.550 -0.074 242 HB2 ALA 31 HB2 ALA 31 -3.736 -19.418 -0.350 243 HB3 ALA 31 HB3 ALA 31 -3.748 -17.880 0.513 244 H LYS 32 H LYS 32 -5.146 -16.151 -0.483 245 HA LYS 32 HA LYS 32 -7.535 -17.395 -1.364 246 HB2 LYS 32 HB2 LYS 32 -8.715 -15.521 -0.402 247 HB3 LYS 32 HB1 LYS 32 -7.411 -15.996 0.674 248 HG2 LYS 32 HG2 LYS 32 -6.113 -14.113 0.085 249 HG3 LYS 32 HG1 LYS 32 -7.158 -13.734 -1.286 250 HD2 LYS 32 HD2 LYS 32 -8.990 -13.237 0.244 251 HD3 LYS 32 HD1 LYS 32 -7.953 -13.622 1.621 252 HE2 LYS 32 HE2 LYS 32 -6.465 -11.788 1.030 253 HE3 LYS 32 HE1 LYS 32 -7.441 -11.434 -0.393 254 HZ1 LYS 32 HZ1 LYS 32 -8.398 -11.283 2.408 255 HZ2 LYS 32 HZ2 LYS 32 -9.273 -10.848 1.023 256 HZ3 LYS 32 HZ3 LYS 32 -7.912 -9.958 1.480 257 H ARG 33 H ARG 33 -5.520 -14.926 -2.745 258 HA ARG 33 HA ARG 33 -7.470 -13.839 -4.494 259 HB2 ARG 33 HB2 ARG 33 -5.203 -12.822 -3.813 260 HB3 ARG 33 HB1 ARG 33 -4.521 -13.850 -5.074 261 HG2 ARG 33 HG2 ARG 33 -5.846 -12.778 -6.753 262 HG3 ARG 33 HG1 ARG 33 -6.717 -11.845 -5.539 263 HD2 ARG 33 HD2 ARG 33 -4.424 -10.908 -4.892 264 HD3 ARG 33 HD1 ARG 33 -3.864 -11.575 -6.426 265 HE ARG 33 HE ARG 33 -6.220 -9.939 -6.649 266 HH11 ARG 33 HH11 ARG 33 -2.734 -9.971 -6.746 267 HH12 ARG 33 HH12 ARG 33 -2.601 -8.413 -7.488 268 HH21 ARG 33 HH21 ARG 33 -6.070 -7.904 -7.664 269 HH22 ARG 33 HH22 ARG 33 -4.518 -7.244 -8.038 270 H GLN 34 H GLN 34 -5.165 -16.457 -4.730 271 HA GLN 34 HA GLN 34 -5.897 -16.944 -7.508 272 HB2 GLN 34 HB2 GLN 34 -3.838 -18.241 -5.725 273 HB3 GLN 34 HB1 GLN 34 -4.104 -18.658 -7.411 274 HG2 GLN 34 HG2 GLN 34 -3.344 -15.911 -6.458 275 HG3 GLN 34 HG1 GLN 34 -2.184 -17.109 -7.012 276 HE21 GLN 34 HE21 GLN 34 -4.677 -14.893 -7.919 277 HE22 GLN 34 HE22 GLN 34 -4.423 -14.971 -9.622 278 H GLY 35 H GLY 35 -7.010 -17.810 -4.509 279 HA2 GLY 35 HA2 GLY 35 -8.656 -19.309 -3.904 280 HA3 GLY 35 HA1 GLY 35 -8.733 -19.826 -5.582 281 H VAL 36 H VAL 36 -5.947 -19.840 -3.420 282 HA VAL 36 HA VAL 36 -5.927 -22.777 -3.591 283 HB VAL 36 HB VAL 36 -3.490 -22.750 -3.725 284 HG11 VAL 36 HG11 VAL 36 -4.753 -21.002 -5.830 285 HG12 VAL 36 HG12 VAL 36 -4.713 -22.765 -5.817 286 HG13 VAL 36 HG13 VAL 36 -3.215 -21.851 -5.990 287 HG21 VAL 36 HG21 VAL 36 -2.237 -20.668 -4.055 288 HG22 VAL 36 HG22 VAL 36 -3.058 -20.678 -2.493 289 HG23 VAL 36 HG23 VAL 36 -3.721 -19.740 -3.832 290 HA PRO 37 HA PRO 37 -5.398 -22.609 0.813 291 HB2 PRO 37 HB2 PRO 37 -4.220 -24.994 1.280 292 HB3 PRO 37 HB1 PRO 37 -5.914 -24.866 0.797 293 HG2 PRO 37 HG2 PRO 37 -3.522 -25.555 -0.856 294 HG3 PRO 37 HG1 PRO 37 -5.147 -26.262 -0.886 295 HD2 PRO 37 HD2 PRO 37 -4.264 -24.400 -2.689 296 HD3 PRO 37 HD1 PRO 37 -5.970 -24.613 -2.249 297 H ALA 38 H ALA 38 -3.930 -21.577 2.033 298 HA ALA 38 HA ALA 38 -1.235 -21.220 1.103 299 HB1 ALA 38 HB1 ALA 38 -0.973 -19.775 3.068 300 HB2 ALA 38 HB2 ALA 38 -2.540 -20.314 3.676 301 HB3 ALA 38 HB3 ALA 38 -2.446 -19.391 2.175 302 H ASP 39 H ASP 39 -2.729 -23.623 2.694 303 HA ASP 39 HA ASP 39 -1.094 -24.421 4.797 304 HB2 ASP 39 HB2 ASP 39 -3.260 -25.417 4.410 305 HB3 ASP 39 HB1 ASP 39 -2.745 -26.036 2.849 306 H GLN 40 H GLN 40 -0.963 -25.414 1.383 307 HA GLN 40 HA GLN 40 1.736 -26.504 1.854 308 HB2 GLN 40 HB2 GLN 40 -0.234 -27.158 -0.345 309 HB3 GLN 40 HB1 GLN 40 1.342 -27.906 -0.121 310 HG2 GLN 40 HG2 GLN 40 -0.925 -28.050 1.853 311 HG3 GLN 40 HG1 GLN 40 -0.532 -29.299 0.674 312 HE21 GLN 40 HE21 GLN 40 1.210 -30.621 1.036 313 HE22 GLN 40 HE22 GLN 40 2.076 -30.648 2.530 314 H LEU 41 H LEU 41 1.142 -23.747 1.432 315 HA LEU 41 HA LEU 41 1.987 -23.192 -1.299 316 HB2 LEU 41 HB2 LEU 41 0.079 -21.986 -0.276 317 HB3 LEU 41 HB1 LEU 41 1.168 -21.309 0.913 318 HG LEU 41 HG LEU 41 2.375 -20.138 -0.893 319 HD11 LEU 41 HD11 LEU 41 1.882 -21.682 -2.714 320 HD12 LEU 41 HD12 LEU 41 1.375 -20.043 -3.114 321 HD13 LEU 41 HD13 LEU 41 0.174 -21.243 -2.636 322 HD21 LEU 41 HD21 LEU 41 -0.595 -19.634 -0.826 323 HD22 LEU 41 HD22 LEU 41 0.637 -18.489 -1.355 324 HD23 LEU 41 HD23 LEU 41 0.586 -19.016 0.328 325 H ARG 42 H ARG 42 3.982 -22.414 -1.817 326 HA ARG 42 HA ARG 42 5.901 -22.027 0.389 327 HB2 ARG 42 HB2 ARG 42 6.448 -24.056 -0.745 328 HB3 ARG 42 HB1 ARG 42 6.231 -23.314 -2.320 329 HG2 ARG 42 HG2 ARG 42 8.573 -23.636 -1.916 330 HG3 ARG 42 HG1 ARG 42 8.224 -21.908 -1.886 331 HD2 ARG 42 HD2 ARG 42 9.762 -22.584 -0.093 332 HD3 ARG 42 HD1 ARG 42 8.259 -21.914 0.535 333 HE ARG 42 HE ARG 42 7.727 -23.957 1.428 334 HH11 ARG 42 HH11 ARG 42 10.503 -24.336 -0.705 335 HH12 ARG 42 HH12 ARG 42 10.862 -25.936 -0.165 336 HH21 ARG 42 HH21 ARG 42 8.213 -26.087 2.137 337 HH22 ARG 42 HH22 ARG 42 9.548 -26.938 1.449 338 H VAL 43 H VAL 43 6.871 -20.079 0.474 339 HA VAL 43 HA VAL 43 6.638 -18.340 -1.875 340 HB VAL 43 HB VAL 43 7.180 -16.452 -0.341 341 HG11 VAL 43 HG11 VAL 43 4.812 -18.133 0.452 342 HG12 VAL 43 HG12 VAL 43 4.870 -16.950 -0.852 343 HG13 VAL 43 HG13 VAL 43 5.016 -16.422 0.823 344 HG21 VAL 43 HG21 VAL 43 7.099 -16.780 2.076 345 HG22 VAL 43 HG22 VAL 43 8.415 -17.718 1.367 346 HG23 VAL 43 HG23 VAL 43 6.919 -18.518 1.848 347 H ILE 44 H ILE 44 8.355 -17.728 -3.005 348 HA ILE 44 HA ILE 44 11.020 -18.268 -1.880 349 HB ILE 44 HB ILE 44 10.166 -18.426 -4.786 350 HG12 ILE 44 HG12 ILE 44 9.410 -20.361 -3.464 351 HG13 ILE 44 HG11 ILE 44 10.656 -20.822 -4.617 352 HG21 ILE 44 HG21 ILE 44 12.452 -19.208 -5.228 353 HG22 ILE 44 HG22 ILE 44 12.871 -18.914 -3.541 354 HG23 ILE 44 HG23 ILE 44 12.428 -17.565 -4.586 355 HD11 ILE 44 HD11 ILE 44 12.314 -20.796 -2.803 356 HD12 ILE 44 HD12 ILE 44 11.000 -21.933 -2.498 357 HD13 ILE 44 HD13 ILE 44 11.036 -20.383 -1.660 358 H PHE 45 H PHE 45 11.728 -16.349 -1.246 359 HA PHE 45 HA PHE 45 11.479 -14.095 -3.122 360 HB2 PHE 45 HB2 PHE 45 10.237 -13.794 -0.993 361 HB3 PHE 45 HB1 PHE 45 11.741 -14.009 -0.108 362 HD1 PHE 45 HD1 PHE 45 10.081 -11.862 -2.622 363 HD2 PHE 45 HD2 PHE 45 13.128 -12.189 0.324 364 HE1 PHE 45 HE1 PHE 45 10.500 -9.450 -2.793 365 HE2 PHE 45 HE2 PHE 45 13.551 -9.774 0.163 366 HZ PHE 45 HZ PHE 45 12.234 -8.402 -1.397 367 H ALA 46 H ALA 46 13.352 -13.750 -4.109 368 HA ALA 46 HA ALA 46 15.562 -13.487 -4.521 369 HB1 ALA 46 HB1 ALA 46 17.034 -12.751 -2.730 370 HB2 ALA 46 HB2 ALA 46 15.853 -13.262 -1.525 371 HB3 ALA 46 HB3 ALA 46 15.478 -11.930 -2.617 372 H GLY 47 H GLY 47 14.316 -16.163 -3.644 373 HA2 GLY 47 HA2 GLY 47 15.338 -18.254 -4.171 374 HA3 GLY 47 HA1 GLY 47 16.875 -17.601 -3.628 375 H LYS 48 H LYS 48 14.747 -16.615 -1.357 376 HA LYS 48 HA LYS 48 14.878 -19.110 0.172 377 HB2 LYS 48 HB2 LYS 48 15.559 -17.719 2.196 378 HB3 LYS 48 HB1 LYS 48 16.797 -17.993 0.983 379 HG2 LYS 48 HG2 LYS 48 17.047 -15.743 1.576 380 HG3 LYS 48 HG1 LYS 48 16.154 -15.691 0.056 381 HD2 LYS 48 HD2 LYS 48 14.050 -15.494 1.399 382 HD3 LYS 48 HD1 LYS 48 15.049 -15.350 2.844 383 HE2 LYS 48 HE2 LYS 48 15.123 -13.499 0.458 384 HE3 LYS 48 HE1 LYS 48 14.333 -13.158 1.995 385 HZ1 LYS 48 HZ1 LYS 48 16.494 -13.321 3.076 386 HZ2 LYS 48 HZ2 LYS 48 16.476 -12.108 1.905 387 HZ3 LYS 48 HZ3 LYS 48 17.240 -13.582 1.583 388 H GLU 49 H GLU 49 13.443 -19.167 2.031 389 HA GLU 49 HA GLU 49 10.939 -17.848 1.473 390 HB2 GLU 49 HB2 GLU 49 11.560 -19.529 3.904 391 HB3 GLU 49 HB1 GLU 49 9.993 -19.231 3.173 392 HG2 GLU 49 HG2 GLU 49 10.351 -21.343 2.425 393 HG3 GLU 49 HG1 GLU 49 11.126 -20.454 1.114 394 H LEU 50 H LEU 50 9.765 -16.694 3.260 395 HA LEU 50 HA LEU 50 11.679 -15.003 4.713 396 HB2 LEU 50 HB2 LEU 50 8.868 -14.390 3.842 397 HB3 LEU 50 HB1 LEU 50 9.877 -13.324 4.803 398 HG LEU 50 HG LEU 50 10.401 -14.194 1.972 399 HD11 LEU 50 HD11 LEU 50 9.983 -11.849 1.433 400 HD12 LEU 50 HD12 LEU 50 9.562 -11.544 3.120 401 HD13 LEU 50 HD13 LEU 50 8.567 -12.625 2.143 402 HD21 LEU 50 HD21 LEU 50 11.940 -12.371 3.819 403 HD22 LEU 50 HD22 LEU 50 12.214 -12.493 2.083 404 HD23 LEU 50 HD23 LEU 50 12.498 -13.891 3.119 405 H ARG 51 H ARG 51 10.847 -14.059 6.733 406 HA ARG 51 HA ARG 51 9.782 -16.175 8.363 407 HB2 ARG 51 HB2 ARG 51 10.281 -14.675 10.255 408 HB3 ARG 51 HB1 ARG 51 11.673 -14.932 9.219 409 HG2 ARG 51 HG2 ARG 51 10.655 -12.657 8.152 410 HG3 ARG 51 HG1 ARG 51 10.204 -12.472 9.850 411 HD2 ARG 51 HD2 ARG 51 12.632 -13.133 10.356 412 HD3 ARG 51 HD1 ARG 51 12.925 -12.804 8.649 413 HE ARG 51 HE ARG 51 12.135 -10.845 10.689 414 HH11 ARG 51 HH11 ARG 51 13.190 -11.530 7.410 415 HH12 ARG 51 HH12 ARG 51 13.732 -9.915 7.105 416 HH21 ARG 51 HH21 ARG 51 12.893 -8.692 10.292 417 HH22 ARG 51 HH22 ARG 51 13.572 -8.305 8.747 418 H ASN 52 H ASN 52 7.741 -16.474 8.612 419 HA ASN 52 HA ASN 52 5.706 -14.799 7.663 420 HB2 ASN 52 HB2 ASN 52 4.165 -16.362 8.846 421 HB3 ASN 52 HB1 ASN 52 5.356 -17.171 7.837 422 HD21 ASN 52 HD21 ASN 52 4.295 -16.554 11.092 423 HD22 ASN 52 HD22 ASN 52 5.302 -17.737 11.848 424 H ASP 53 H ASP 53 7.446 -14.531 10.535 425 HA ASP 53 HA ASP 53 5.268 -13.458 12.111 426 HB2 ASP 53 HB2 ASP 53 8.202 -13.787 12.718 427 HB3 ASP 53 HB1 ASP 53 7.024 -13.143 13.852 428 H TRP 54 H TRP 54 7.339 -12.141 9.791 429 HA TRP 54 HA TRP 54 7.251 -9.572 11.197 430 HB2 TRP 54 HB2 TRP 54 9.531 -10.602 10.751 431 HB3 TRP 54 HB1 TRP 54 9.257 -10.211 9.056 432 HD1 TRP 54 HD1 TRP 54 10.700 -8.147 8.567 433 HE1 TRP 54 HE1 TRP 54 11.080 -5.863 9.691 434 HE3 TRP 54 HE3 TRP 54 7.923 -8.836 12.814 435 HZ2 TRP 54 HZ2 TRP 54 10.286 -4.529 12.027 436 HZ3 TRP 54 HZ3 TRP 54 7.783 -6.998 14.430 437 HH2 TRP 54 HH2 TRP 54 8.941 -4.889 14.046 438 H THR 55 H THR 55 7.406 -7.633 9.723 439 HA THR 55 HA THR 55 5.057 -7.637 8.101 440 HB THR 55 HB THR 55 5.436 -5.225 7.908 441 HG1 THR 55 HG1 THR 55 7.424 -4.624 9.372 442 HG21 THR 55 HG21 THR 55 4.435 -6.148 9.992 443 HG22 THR 55 HG22 THR 55 5.313 -4.642 10.259 444 HG23 THR 55 HG23 THR 55 6.048 -6.179 10.712 445 H VAL 56 H VAL 56 4.903 -6.973 5.937 446 HA VAL 56 HA VAL 56 6.897 -8.060 4.227 447 HB VAL 56 HB VAL 56 4.476 -8.172 3.722 448 HG11 VAL 56 HG11 VAL 56 3.297 -6.223 2.845 449 HG12 VAL 56 HG12 VAL 56 4.689 -5.211 3.232 450 HG13 VAL 56 HG13 VAL 56 3.784 -5.999 4.525 451 HG21 VAL 56 HG21 VAL 56 6.076 -8.441 1.922 452 HG22 VAL 56 HG22 VAL 56 6.096 -6.700 1.650 453 HG23 VAL 56 HG23 VAL 56 4.626 -7.626 1.335 454 H GLN 57 H GLN 57 6.190 -4.891 5.424 455 HA GLN 57 HA GLN 57 7.373 -3.363 3.382 456 HB2 GLN 57 HB2 GLN 57 5.865 -2.386 5.016 457 HB3 GLN 57 HB1 GLN 57 7.009 -2.726 6.305 458 HG2 GLN 57 HG2 GLN 57 8.623 -1.202 5.214 459 HG3 GLN 57 HG1 GLN 57 7.384 -0.803 4.024 460 HE21 GLN 57 HE21 GLN 57 7.344 1.347 4.623 461 HE22 GLN 57 HE22 GLN 57 6.644 1.879 6.110 462 H ASN 58 H ASN 58 8.659 -4.522 6.481 463 HA ASN 58 HA ASN 58 11.228 -3.356 5.966 464 HB2 ASN 58 HB2 ASN 58 10.260 -3.574 8.245 465 HB3 ASN 58 HB1 ASN 58 10.457 -5.316 8.124 466 HD21 ASN 58 HD21 ASN 58 12.768 -2.984 6.864 467 HD22 ASN 58 HD22 ASN 58 14.024 -3.362 7.985 468 H CYS 59 H CYS 59 9.745 -6.286 5.087 469 HA CYS 59 HA CYS 59 12.215 -7.750 4.834 470 HB2 CYS 59 HB2 CYS 59 9.428 -8.357 3.829 471 HB3 CYS 59 HB1 CYS 59 10.806 -9.437 3.644 472 HG CYS 59 HG CYS 59 9.036 -8.678 6.428 473 H ASP 60 H ASP 60 10.646 -5.352 3.114 474 HA ASP 60 HA ASP 60 11.086 -4.236 1.213 475 HB2 ASP 60 HB2 ASP 60 13.652 -5.721 1.574 476 HB3 ASP 60 HB1 ASP 60 13.391 -4.776 0.114 477 H LEU 61 H LEU 61 9.309 -6.177 0.705 478 HA LEU 61 HA LEU 61 10.176 -7.740 -1.565 479 HB2 LEU 61 HB2 LEU 61 7.467 -7.338 -0.303 480 HB3 LEU 61 HB1 LEU 61 7.673 -8.249 -1.783 481 HG LEU 61 HG LEU 61 9.242 -9.768 -0.509 482 HD11 LEU 61 HD11 LEU 61 9.014 -9.793 1.923 483 HD12 LEU 61 HD12 LEU 61 8.110 -8.280 1.838 484 HD13 LEU 61 HD13 LEU 61 9.795 -8.331 1.325 485 HD21 LEU 61 HD21 LEU 61 7.022 -10.501 -1.012 486 HD22 LEU 61 HD22 LEU 61 6.358 -9.575 0.327 487 HD23 LEU 61 HD23 LEU 61 7.398 -10.963 0.647 488 H ASP 62 H ASP 62 9.547 -4.596 -1.217 489 HA ASP 62 HA ASP 62 8.173 -4.191 -3.746 490 HB2 ASP 62 HB2 ASP 62 7.424 -2.708 -2.060 491 HB3 ASP 62 HB1 ASP 62 9.062 -2.348 -1.532 492 H GLN 63 H GLN 63 11.345 -3.721 -2.300 493 HA GLN 63 HA GLN 63 12.281 -2.672 -4.877 494 HB2 GLN 63 HB2 GLN 63 12.573 -1.242 -2.864 495 HB3 GLN 63 HB1 GLN 63 13.664 -2.456 -2.214 496 HG2 GLN 63 HG2 GLN 63 15.237 -2.087 -3.956 497 HG3 GLN 63 HG1 GLN 63 14.100 -1.072 -4.839 498 HE21 GLN 63 HE21 GLN 63 13.681 1.009 -4.109 499 HE22 GLN 63 HE22 GLN 63 14.734 1.808 -2.995 500 H GLN 64 H GLN 64 12.820 -5.289 -2.608 501 HA GLN 64 HA GLN 64 15.240 -6.059 -4.010 502 HB2 GLN 64 HB2 GLN 64 13.848 -7.309 -1.645 503 HB3 GLN 64 HB1 GLN 64 15.332 -7.926 -2.357 504 HG2 GLN 64 HG2 GLN 64 14.972 -5.205 -1.124 505 HG3 GLN 64 HG1 GLN 64 15.757 -6.587 -0.361 506 HE21 GLN 64 HE21 GLN 64 16.781 -3.931 -1.038 507 HE22 GLN 64 HE22 GLN 64 18.161 -4.196 -2.042 508 H SEP 65 H SEP 65 14.350 -6.478 -6.046 509 HA SEP 65 HA SEP 65 13.691 -7.854 -7.726 510 HB2 SEP 65 HB1 SEP 65 13.618 -10.109 -5.714 511 HB3 SEP 65 HB2 SEP 65 15.128 -9.472 -6.357 512 H ILE 66 H ILE 66 11.982 -10.024 -7.821 513 HA ILE 66 HA ILE 66 9.458 -8.892 -6.824 514 HB ILE 66 HB ILE 66 9.695 -8.914 -9.342 515 HG12 ILE 66 HG12 ILE 66 7.529 -10.708 -8.244 516 HG13 ILE 66 HG11 ILE 66 7.480 -8.949 -8.286 517 HG21 ILE 66 HG21 ILE 66 9.555 -10.977 -10.552 518 HG22 ILE 66 HG22 ILE 66 9.523 -11.896 -9.054 519 HG23 ILE 66 HG23 ILE 66 10.985 -11.007 -9.512 520 HD11 ILE 66 HD11 ILE 66 6.155 -9.957 -10.076 521 HD12 ILE 66 HD12 ILE 66 7.603 -10.748 -10.698 522 HD13 ILE 66 HD13 ILE 66 7.483 -8.988 -10.713 523 H VAL 67 H VAL 67 7.873 -10.424 -6.087 524 HA VAL 67 HA VAL 67 9.111 -12.578 -4.616 525 HB VAL 67 HB VAL 67 6.170 -11.937 -4.733 526 HG11 VAL 67 HG11 VAL 67 7.884 -13.169 -2.580 527 HG12 VAL 67 HG12 VAL 67 6.751 -14.023 -3.629 528 HG13 VAL 67 HG13 VAL 67 6.154 -12.846 -2.461 529 HG21 VAL 67 HG21 VAL 67 8.211 -10.669 -2.911 530 HG22 VAL 67 HG22 VAL 67 6.467 -10.388 -2.901 531 HG23 VAL 67 HG23 VAL 67 7.434 -9.875 -4.281 532 H HIS 68 H HIS 68 8.988 -14.730 -5.071 533 HA HIS 68 HA HIS 68 7.217 -15.550 -7.278 534 HB2 HIS 68 HB2 HIS 68 9.994 -16.469 -6.556 535 HB3 HIS 68 HB1 HIS 68 8.918 -17.500 -7.485 536 HD2 HIS 68 HD2 HIS 68 9.501 -13.641 -8.081 537 HE1 HIS 68 HE1 HIS 68 10.611 -15.820 -11.526 538 HE2 HIS 68 HE2 HIS 68 10.468 -13.526 -10.489 539 H ILE 69 H ILE 69 5.545 -16.685 -6.547 540 HA ILE 69 HA ILE 69 5.991 -18.327 -4.159 541 HB ILE 69 HB ILE 69 3.421 -17.060 -5.131 542 HG12 ILE 69 HG12 ILE 69 5.219 -16.516 -2.758 543 HG13 ILE 69 HG11 ILE 69 4.922 -15.450 -4.123 544 HG21 ILE 69 HG21 ILE 69 2.420 -17.944 -3.081 545 HG22 ILE 69 HG22 ILE 69 3.931 -18.769 -2.698 546 HG23 ILE 69 HG23 ILE 69 3.004 -19.244 -4.121 547 HD11 ILE 69 HD11 ILE 69 2.858 -16.287 -2.100 548 HD12 ILE 69 HD12 ILE 69 2.633 -15.144 -3.425 549 HD13 ILE 69 HD13 ILE 69 3.731 -14.754 -2.104 550 H VAL 70 H VAL 70 5.753 -20.420 -4.266 551 HA VAL 70 HA VAL 70 4.622 -21.615 -6.717 552 HB VAL 70 HB VAL 70 6.818 -22.748 -4.962 553 HG11 VAL 70 HG11 VAL 70 7.167 -24.333 -6.782 554 HG12 VAL 70 HG12 VAL 70 5.818 -23.618 -7.664 555 HG13 VAL 70 HG13 VAL 70 5.532 -24.445 -6.132 556 HG21 VAL 70 HG21 VAL 70 7.635 -20.756 -6.076 557 HG22 VAL 70 HG22 VAL 70 7.055 -21.358 -7.627 558 HG23 VAL 70 HG23 VAL 70 8.364 -22.193 -6.793 559 H GLN 71 H GLN 71 3.111 -23.241 -6.414 560 HA GLN 71 HA GLN 71 2.460 -23.853 -3.616 561 HB2 GLN 71 HB2 GLN 71 0.648 -22.786 -4.896 562 HB3 GLN 71 HB1 GLN 71 0.709 -24.103 -6.061 563 HG2 GLN 71 HG2 GLN 71 0.168 -25.674 -4.191 564 HG3 GLN 71 HG1 GLN 71 -0.087 -24.266 -3.165 565 HE21 GLN 71 HE21 GLN 71 -0.945 -24.381 -6.553 566 HE22 GLN 71 HE22 GLN 71 -2.654 -24.352 -6.305 567 H ARG 72 H ARG 72 2.873 -25.815 -2.890 568 HA ARG 72 HA ARG 72 2.947 -28.025 -4.815 569 HB2 ARG 72 HB2 ARG 72 4.893 -27.490 -2.570 570 HB3 ARG 72 HB1 ARG 72 4.756 -29.045 -3.376 571 HG2 ARG 72 HG2 ARG 72 5.479 -26.444 -4.713 572 HG3 ARG 72 HG1 ARG 72 6.614 -27.713 -4.244 573 HD2 ARG 72 HD2 ARG 72 5.507 -29.275 -5.753 574 HD3 ARG 72 HD1 ARG 72 4.334 -28.037 -6.196 575 HE ARG 72 HE ARG 72 7.040 -27.236 -6.655 576 HH11 ARG 72 HH11 ARG 72 4.349 -29.024 -8.007 577 HH12 ARG 72 HH12 ARG 72 4.855 -28.794 -9.646 578 HH21 ARG 72 HH21 ARG 72 7.720 -26.943 -8.828 579 HH22 ARG 72 HH22 ARG 72 6.779 -27.624 -10.111 580 HA PRO 73 HA PRO 73 -0.080 -29.021 -1.564 581 HB2 PRO 73 HB2 PRO 73 -1.407 -30.467 -3.731 582 HB3 PRO 73 HB1 PRO 73 -2.027 -29.142 -2.739 583 HG2 PRO 73 HG2 PRO 73 -1.441 -28.827 -5.355 584 HG3 PRO 73 HG1 PRO 73 -1.220 -27.523 -4.174 585 HD2 PRO 73 HD2 PRO 73 0.816 -29.389 -5.338 586 HD3 PRO 73 HD1 PRO 73 0.920 -27.634 -5.065 587 H TRP 74 H TRP 74 1.742 -30.354 -0.802 588 HA TRP 74 HA TRP 74 2.283 -32.920 -1.824 589 HB2 TRP 74 HB2 TRP 74 2.757 -31.822 0.948 590 HB3 TRP 74 HB1 TRP 74 3.422 -33.332 0.339 591 HD1 TRP 74 HD1 TRP 74 4.923 -32.888 -2.100 592 HE1 TRP 74 HE1 TRP 74 6.732 -31.098 -2.442 593 HE3 TRP 74 HE3 TRP 74 3.593 -29.663 1.643 594 HZ2 TRP 74 HZ2 TRP 74 7.500 -28.638 -1.280 595 HZ3 TRP 74 HZ3 TRP 74 4.920 -27.618 1.960 596 HH2 TRP 74 HH2 TRP 74 6.832 -27.117 0.529 597 H ARG 75 H ARG 75 -0.517 -31.924 -0.263 598 HA ARG 75 HA ARG 75 -1.161 -34.716 0.263 599 HB2 ARG 75 HB2 ARG 75 -2.316 -34.174 2.363 600 HB3 ARG 75 HB1 ARG 75 -0.592 -33.878 2.443 601 HG2 ARG 75 HG2 ARG 75 -0.982 -31.479 2.226 602 HG3 ARG 75 HG1 ARG 75 -2.723 -31.771 2.100 603 HD2 ARG 75 HD2 ARG 75 -2.694 -32.826 4.311 604 HD3 ARG 75 HD1 ARG 75 -0.969 -32.510 4.434 605 HE ARG 75 HE ARG 75 -1.885 -30.033 4.127 606 HH11 ARG 75 HH11 ARG 75 -3.170 -32.649 6.078 607 HH12 ARG 75 HH12 ARG 75 -3.724 -31.609 7.341 608 HH21 ARG 75 HH21 ARG 75 -2.604 -28.656 5.809 609 HH22 ARG 75 HH22 ARG 75 -3.410 -29.332 7.188 610 H LYS 76 H LYS 76 -1.836 -32.858 -1.861 611 HA LYS 76 HA LYS 76 -4.752 -33.045 -1.628 612 HB2 LYS 76 HB2 LYS 76 -3.049 -30.931 -2.896 613 HB3 LYS 76 HB1 LYS 76 -4.691 -31.206 -3.451 614 HG2 LYS 76 HG2 LYS 76 -3.983 -30.620 -0.594 615 HG3 LYS 76 HG1 LYS 76 -4.419 -29.380 -1.774 616 HD2 LYS 76 HD2 LYS 76 -6.575 -30.456 -2.127 617 HD3 LYS 76 HD1 LYS 76 -6.139 -31.732 -0.991 618 HE2 LYS 76 HE2 LYS 76 -6.254 -28.824 -0.281 619 HE3 LYS 76 HE1 LYS 76 -7.608 -29.935 -0.067 620 HZ1 LYS 76 HZ1 LYS 76 -6.426 -29.738 1.977 621 HZ2 LYS 76 HZ2 LYS 76 -4.949 -30.080 1.237 622 HZ3 LYS 76 HZ3 LYS 76 -6.132 -31.284 1.362 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 0.627 -1.209 0.968 2 H2 MET 1 HT2 MET 1 0.338 -0.216 -0.353 3 H3 MET 1 HT3 MET 1 1.196 0.385 0.986 4 HA MET 1 HA MET 1 2.762 -0.071 -0.720 5 HB2 MET 1 HB2 MET 1 3.473 -0.659 1.530 6 HB3 MET 1 HB1 MET 1 2.711 -2.235 1.385 7 HG2 MET 1 HG2 MET 1 4.298 -2.775 -0.437 8 HG3 MET 1 HG1 MET 1 5.103 -1.237 -0.135 9 HE1 MET 1 HE1 MET 1 7.573 -3.969 1.292 10 HE2 MET 1 HE2 MET 1 7.437 -2.577 0.216 11 HE3 MET 1 HE3 MET 1 6.544 -4.055 -0.136 12 H ILE 2 H ILE 2 2.785 -0.862 -2.686 13 HA ILE 2 HA ILE 2 1.372 -3.357 -3.270 14 HB ILE 2 HB ILE 2 2.409 -1.170 -5.082 15 HG12 ILE 2 HG12 ILE 2 -0.367 -2.242 -4.595 16 HG13 ILE 2 HG11 ILE 2 0.275 -0.751 -3.915 17 HG21 ILE 2 HG21 ILE 2 1.502 -2.448 -6.973 18 HG22 ILE 2 HG22 ILE 2 1.143 -3.790 -5.888 19 HG23 ILE 2 HG23 ILE 2 2.816 -3.312 -6.171 20 HD11 ILE 2 HD11 ILE 2 0.498 0.159 -6.176 21 HD12 ILE 2 HD12 ILE 2 -1.164 -0.305 -5.811 22 HD13 ILE 2 HD13 ILE 2 -0.165 -1.336 -6.833 23 H VAL 3 H VAL 3 2.456 -5.165 -3.443 24 HA VAL 3 HA VAL 3 5.273 -5.019 -4.266 25 HB VAL 3 HB VAL 3 5.627 -7.181 -3.081 26 HG11 VAL 3 HG11 VAL 3 5.593 -6.257 -0.795 27 HG12 VAL 3 HG12 VAL 3 4.622 -4.906 -1.382 28 HG13 VAL 3 HG13 VAL 3 6.263 -5.141 -1.982 29 HG21 VAL 3 HG21 VAL 3 3.987 -7.945 -1.437 30 HG22 VAL 3 HG22 VAL 3 3.329 -8.001 -3.073 31 HG23 VAL 3 HG23 VAL 3 2.859 -6.701 -1.977 32 H PHE 4 H PHE 4 5.916 -6.257 -5.932 33 HA PHE 4 HA PHE 4 3.846 -7.402 -7.566 34 HB2 PHE 4 HB2 PHE 4 6.818 -7.046 -7.943 35 HB3 PHE 4 HB1 PHE 4 5.811 -7.894 -9.111 36 HD1 PHE 4 HD1 PHE 4 6.222 -4.632 -7.386 37 HD2 PHE 4 HD2 PHE 4 4.640 -6.718 -10.738 38 HE1 PHE 4 HE1 PHE 4 5.643 -2.487 -8.442 39 HE2 PHE 4 HE2 PHE 4 4.062 -4.577 -11.801 40 HZ PHE 4 HZ PHE 4 4.562 -2.458 -10.651 41 H VAL 5 H VAL 5 3.349 -9.499 -7.762 42 HA VAL 5 HA VAL 5 5.115 -11.455 -6.457 43 HB VAL 5 HB VAL 5 2.102 -11.292 -6.169 44 HG11 VAL 5 HG11 VAL 5 2.336 -13.128 -4.588 45 HG12 VAL 5 HG12 VAL 5 4.054 -13.244 -4.971 46 HG13 VAL 5 HG13 VAL 5 2.846 -13.596 -6.211 47 HG21 VAL 5 HG21 VAL 5 3.221 -9.602 -4.850 48 HG22 VAL 5 HG22 VAL 5 4.289 -10.821 -4.157 49 HG23 VAL 5 HG23 VAL 5 2.560 -10.857 -3.798 50 H ARG 6 H ARG 6 5.358 -13.352 -7.506 51 HA ARG 6 HA ARG 6 3.699 -13.815 -9.900 52 HB2 ARG 6 HB2 ARG 6 6.490 -14.845 -9.381 53 HB3 ARG 6 HB1 ARG 6 5.561 -15.032 -10.856 54 HG2 ARG 6 HG2 ARG 6 5.602 -12.523 -11.043 55 HG3 ARG 6 HG1 ARG 6 6.793 -12.546 -9.740 56 HD2 ARG 6 HD2 ARG 6 7.983 -12.503 -11.829 57 HD3 ARG 6 HD1 ARG 6 8.171 -14.109 -11.125 58 HE ARG 6 HE ARG 6 6.049 -13.667 -13.095 59 HH11 ARG 6 HH11 ARG 6 9.175 -15.103 -12.342 60 HH12 ARG 6 HH12 ARG 6 9.128 -16.191 -13.677 61 HH21 ARG 6 HH21 ARG 6 6.001 -15.122 -14.857 62 HH22 ARG 6 HH22 ARG 6 7.310 -16.219 -15.102 63 H PHE 7 H PHE 7 2.602 -15.665 -9.993 64 HA PHE 7 HA PHE 7 3.021 -17.612 -7.849 65 HB2 PHE 7 HB2 PHE 7 0.721 -16.626 -8.166 66 HB3 PHE 7 HB1 PHE 7 0.670 -17.388 -9.750 67 HD1 PHE 7 HD1 PHE 7 1.083 -18.164 -6.146 68 HD2 PHE 7 HD2 PHE 7 -0.146 -19.546 -9.974 69 HE1 PHE 7 HE1 PHE 7 0.188 -20.207 -5.117 70 HE2 PHE 7 HE2 PHE 7 -1.038 -21.597 -8.952 71 HZ PHE 7 HZ PHE 7 -0.871 -21.931 -6.519 72 H ASN 8 H ASN 8 3.167 -19.844 -8.395 73 HA ASN 8 HA ASN 8 4.889 -20.473 -10.472 74 HB2 ASN 8 HB2 ASN 8 4.484 -21.867 -8.449 75 HB3 ASN 8 HB1 ASN 8 2.961 -22.392 -9.154 76 HD21 ASN 8 HD21 ASN 8 6.437 -22.480 -9.467 77 HD22 ASN 8 HD22 ASN 8 6.504 -23.888 -10.471 78 H SER 9 H SER 9 1.475 -20.105 -10.626 79 HA SER 9 HA SER 9 1.492 -21.102 -13.393 80 HB2 SER 9 HB2 SER 9 -0.850 -21.082 -11.473 81 HB3 SER 9 HB1 SER 9 -0.842 -21.739 -13.108 82 HG SER 9 HG SER 9 1.000 -23.080 -12.216 83 H SER 10 H SER 10 2.127 -18.399 -12.426 84 HA SER 10 HA SER 10 0.178 -16.924 -14.021 85 HB2 SER 10 HB2 SER 10 -0.642 -16.709 -11.699 86 HB3 SER 10 HB1 SER 10 0.944 -16.121 -11.199 87 HG SER 10 HG SER 10 -1.079 -14.711 -12.103 88 H HIS 11 H HIS 11 1.019 -14.834 -14.718 89 HA HIS 11 HA HIS 11 3.876 -14.954 -15.095 90 HB2 HIS 11 HB2 HIS 11 2.486 -14.329 -17.001 91 HB3 HIS 11 HB1 HIS 11 1.837 -12.961 -16.109 92 HD2 HIS 11 HD2 HIS 11 3.325 -10.677 -16.172 93 HE1 HIS 11 HE1 HIS 11 6.580 -12.278 -18.342 94 HE2 HIS 11 HE2 HIS 11 5.447 -10.156 -17.560 95 H GLY 12 H GLY 12 1.584 -12.949 -13.332 96 HA2 GLY 12 HA2 GLY 12 3.041 -12.226 -11.230 97 HA3 GLY 12 HA1 GLY 12 3.729 -11.181 -12.465 98 H PHE 13 H PHE 13 1.920 -10.922 -9.971 99 HA PHE 13 HA PHE 13 0.223 -8.882 -11.173 100 HB2 PHE 13 HB2 PHE 13 -1.634 -9.602 -9.572 101 HB3 PHE 13 HB1 PHE 13 -1.364 -10.622 -10.977 102 HD1 PHE 13 HD1 PHE 13 -1.071 -10.361 -7.345 103 HD2 PHE 13 HD2 PHE 13 -0.490 -12.856 -10.735 104 HE1 PHE 13 HE1 PHE 13 -0.836 -12.316 -5.863 105 HE2 PHE 13 HE2 PHE 13 -0.253 -14.814 -9.267 106 HZ PHE 13 HZ PHE 13 -0.425 -14.546 -6.827 107 HA PRO 14 HA PRO 14 1.726 -6.656 -7.654 108 HB2 PRO 14 HB2 PRO 14 0.283 -4.407 -7.932 109 HB3 PRO 14 HB1 PRO 14 1.563 -4.835 -9.072 110 HG2 PRO 14 HG2 PRO 14 -1.393 -5.057 -9.374 111 HG3 PRO 14 HG1 PRO 14 -0.168 -4.650 -10.585 112 HD2 PRO 14 HD2 PRO 14 -1.355 -7.151 -10.253 113 HD3 PRO 14 HD1 PRO 14 0.147 -6.835 -11.132 114 H VAL 15 H VAL 15 1.219 -7.043 -5.587 115 HA VAL 15 HA VAL 15 -1.621 -7.185 -4.840 116 HB VAL 15 HB VAL 15 0.797 -8.356 -3.417 117 HG11 VAL 15 HG11 VAL 15 -0.997 -7.702 -1.868 118 HG12 VAL 15 HG12 VAL 15 -0.809 -9.453 -1.955 119 HG13 VAL 15 HG13 VAL 15 -2.143 -8.664 -2.800 120 HG21 VAL 15 HG21 VAL 15 -1.408 -9.689 -4.984 121 HG22 VAL 15 HG22 VAL 15 -0.128 -10.515 -4.096 122 HG23 VAL 15 HG23 VAL 15 0.273 -9.516 -5.491 123 H GLU 16 H GLU 16 -2.463 -5.680 -3.556 124 HA GLU 16 HA GLU 16 -0.726 -3.613 -2.447 125 HB2 GLU 16 HB2 GLU 16 -3.145 -3.497 -3.728 126 HB3 GLU 16 HB1 GLU 16 -3.636 -3.411 -2.046 127 HG2 GLU 16 HG2 GLU 16 -1.713 -1.561 -3.431 128 HG3 GLU 16 HG1 GLU 16 -3.382 -1.194 -3.007 129 H VAL 17 H VAL 17 -0.063 -3.811 -0.430 130 HA VAL 17 HA VAL 17 -1.889 -4.915 1.583 131 HB VAL 17 HB VAL 17 0.082 -6.041 2.698 132 HG11 VAL 17 HG11 VAL 17 -0.056 -8.049 1.323 133 HG12 VAL 17 HG12 VAL 17 -0.742 -7.105 0.002 134 HG13 VAL 17 HG13 VAL 17 -1.640 -7.298 1.507 135 HG21 VAL 17 HG21 VAL 17 1.345 -5.610 -0.011 136 HG22 VAL 17 HG22 VAL 17 1.981 -6.665 1.250 137 HG23 VAL 17 HG23 VAL 17 1.888 -4.925 1.521 138 H ASP 18 H ASP 18 -1.027 -4.484 3.831 139 HA ASP 18 HA ASP 18 -0.446 -1.656 3.948 140 HB2 ASP 18 HB2 ASP 18 -1.016 -3.670 6.129 141 HB3 ASP 18 HB1 ASP 18 -0.812 -1.943 6.388 142 H SER 19 H SER 19 1.122 -0.878 5.612 143 HA SER 19 HA SER 19 3.693 -1.991 5.061 144 HB2 SER 19 HB2 SER 19 2.866 0.227 6.948 145 HB3 SER 19 HB1 SER 19 4.522 -0.140 6.460 146 HG SER 19 HG SER 19 4.205 0.883 4.672 147 H ASP 20 H ASP 20 1.333 -2.799 7.235 148 HA ASP 20 HA ASP 20 3.300 -3.931 9.105 149 HB2 ASP 20 HB2 ASP 20 0.447 -3.081 9.638 150 HB3 ASP 20 HB1 ASP 20 1.463 -3.937 10.795 151 H THR 21 H THR 21 1.668 -4.793 6.539 152 HA THR 21 HA THR 21 0.184 -7.053 7.337 153 HB THR 21 HB THR 21 1.459 -6.303 4.700 154 HG1 THR 21 HG1 THR 21 -1.206 -6.226 5.708 155 HG21 THR 21 HG21 THR 21 0.069 -8.071 3.673 156 HG22 THR 21 HG22 THR 21 -0.416 -8.611 5.280 157 HG23 THR 21 HG23 THR 21 1.268 -8.741 4.777 158 H SER 22 H SER 22 0.889 -8.915 8.094 159 HA SER 22 HA SER 22 3.688 -9.551 8.120 160 HB2 SER 22 HB2 SER 22 1.334 -11.266 8.950 161 HB3 SER 22 HB1 SER 22 3.022 -11.501 9.405 162 HG SER 22 HG SER 22 2.031 -9.000 9.979 163 H ILE 23 H ILE 23 4.692 -11.275 7.047 164 HA ILE 23 HA ILE 23 3.953 -11.751 4.412 165 HB ILE 23 HB ILE 23 5.710 -13.494 6.155 166 HG12 ILE 23 HG12 ILE 23 6.469 -11.160 6.082 167 HG13 ILE 23 HG11 ILE 23 7.578 -12.213 5.208 168 HG21 ILE 23 HG21 ILE 23 5.057 -14.694 4.157 169 HG22 ILE 23 HG22 ILE 23 6.747 -14.203 4.021 170 HG23 ILE 23 HG23 ILE 23 5.501 -13.318 3.148 171 HD11 ILE 23 HD11 ILE 23 6.525 -11.496 3.095 172 HD12 ILE 23 HD12 ILE 23 7.273 -10.174 3.988 173 HD13 ILE 23 HD13 ILE 23 5.519 -10.371 4.010 174 H PHE 24 H PHE 24 3.197 -13.606 7.311 175 HA PHE 24 HA PHE 24 2.124 -15.890 6.098 176 HB2 PHE 24 HB2 PHE 24 2.591 -15.524 8.568 177 HB3 PHE 24 HB1 PHE 24 1.083 -14.626 8.633 178 HD1 PHE 24 HD1 PHE 24 2.470 -17.939 7.706 179 HD2 PHE 24 HD2 PHE 24 -0.923 -15.732 9.008 180 HE1 PHE 24 HE1 PHE 24 1.248 -20.037 8.051 181 HE2 PHE 24 HE2 PHE 24 -2.153 -17.830 9.354 182 HZ PHE 24 HZ PHE 24 -1.066 -19.987 8.876 183 H GLN 25 H GLN 25 0.645 -12.792 6.931 184 HA GLN 25 HA GLN 25 -1.979 -13.495 6.095 185 HB2 GLN 25 HB2 GLN 25 -0.712 -10.764 6.391 186 HB3 GLN 25 HB1 GLN 25 -2.431 -11.073 6.197 187 HG2 GLN 25 HG2 GLN 25 -0.708 -11.904 8.515 188 HG3 GLN 25 HG1 GLN 25 -1.919 -10.624 8.504 189 HE21 GLN 25 HE21 GLN 25 -4.089 -11.173 8.508 190 HE22 GLN 25 HE22 GLN 25 -4.640 -12.758 8.914 191 H LEU 26 H LEU 26 0.738 -11.815 4.596 192 HA LEU 26 HA LEU 26 -0.434 -11.115 2.168 193 HB2 LEU 26 HB2 LEU 26 1.753 -10.300 2.785 194 HB3 LEU 26 HB1 LEU 26 2.395 -11.929 2.836 195 HG LEU 26 HG LEU 26 2.100 -12.092 0.379 196 HD11 LEU 26 HD11 LEU 26 1.403 -9.167 0.550 197 HD12 LEU 26 HD12 LEU 26 0.275 -10.465 0.155 198 HD13 LEU 26 HD13 LEU 26 1.623 -10.110 -0.924 199 HD21 LEU 26 HD21 LEU 26 3.732 -9.760 1.362 200 HD22 LEU 26 HD22 LEU 26 3.942 -10.573 -0.191 201 HD23 LEU 26 HD23 LEU 26 4.242 -11.448 1.313 202 H LYS 27 H LYS 27 1.112 -14.116 3.185 203 HA LYS 27 HA LYS 27 0.951 -15.528 0.770 204 HB2 LYS 27 HB2 LYS 27 2.240 -16.239 2.796 205 HB3 LYS 27 HB1 LYS 27 0.704 -16.642 3.563 206 HG2 LYS 27 HG2 LYS 27 0.273 -18.291 1.794 207 HG3 LYS 27 HG1 LYS 27 1.837 -17.912 1.074 208 HD2 LYS 27 HD2 LYS 27 2.045 -19.918 2.393 209 HD3 LYS 27 HD1 LYS 27 2.924 -18.615 3.193 210 HE2 LYS 27 HE2 LYS 27 1.153 -18.314 4.782 211 HE3 LYS 27 HE1 LYS 27 0.111 -19.434 3.904 212 HZ1 LYS 27 HZ1 LYS 27 1.104 -20.464 5.848 213 HZ2 LYS 27 HZ2 LYS 27 2.655 -20.155 5.250 214 HZ3 LYS 27 HZ3 LYS 27 1.631 -21.219 4.433 215 H GLU 28 H GLU 28 -1.289 -15.337 3.519 216 HA GLU 28 HA GLU 28 -3.207 -17.080 2.444 217 HB2 GLU 28 HB2 GLU 28 -3.373 -14.948 4.546 218 HB3 GLU 28 HB1 GLU 28 -4.749 -15.959 4.121 219 HG2 GLU 28 HG2 GLU 28 -3.104 -17.912 4.621 220 HG3 GLU 28 HG1 GLU 28 -2.199 -16.678 5.496 221 H VAL 29 H VAL 29 -2.776 -13.583 2.165 222 HA VAL 29 HA VAL 29 -5.241 -12.955 0.987 223 HB VAL 29 HB VAL 29 -2.534 -11.663 0.517 224 HG11 VAL 29 HG11 VAL 29 -4.035 -11.158 -1.343 225 HG12 VAL 29 HG12 VAL 29 -3.774 -9.727 -0.344 226 HG13 VAL 29 HG13 VAL 29 -5.280 -10.635 -0.207 227 HG21 VAL 29 HG21 VAL 29 -3.303 -11.539 2.828 228 HG22 VAL 29 HG22 VAL 29 -4.843 -10.869 2.291 229 HG23 VAL 29 HG23 VAL 29 -3.357 -9.949 2.067 230 H VAL 30 H VAL 30 -2.163 -13.828 -0.555 231 HA VAL 30 HA VAL 30 -3.134 -13.796 -3.202 232 HB VAL 30 HB VAL 30 -0.820 -15.383 -2.058 233 HG11 VAL 30 HG11 VAL 30 -1.521 -16.257 -4.221 234 HG12 VAL 30 HG12 VAL 30 0.031 -15.428 -4.360 235 HG13 VAL 30 HG13 VAL 30 -1.443 -14.637 -4.914 236 HG21 VAL 30 HG21 VAL 30 -0.883 -12.662 -3.367 237 HG22 VAL 30 HG22 VAL 30 0.572 -13.533 -2.883 238 HG23 VAL 30 HG23 VAL 30 -0.577 -12.992 -1.661 239 H ALA 31 H ALA 31 -2.723 -16.435 -0.872 240 HA ALA 31 HA ALA 31 -3.576 -18.526 -2.523 241 HB1 ALA 31 HB1 ALA 31 -3.888 -19.798 -0.477 242 HB2 ALA 31 HB2 ALA 31 -3.827 -18.312 0.473 243 HB3 ALA 31 HB3 ALA 31 -2.397 -18.859 -0.402 244 H LYS 32 H LYS 32 -5.409 -16.445 -0.309 245 HA LYS 32 HA LYS 32 -7.902 -17.723 -0.578 246 HB2 LYS 32 HB2 LYS 32 -7.179 -16.108 1.191 247 HB3 LYS 32 HB1 LYS 32 -7.319 -14.827 0.004 248 HG2 LYS 32 HG2 LYS 32 -9.730 -15.462 -0.245 249 HG3 LYS 32 HG1 LYS 32 -9.511 -16.520 1.154 250 HD2 LYS 32 HD2 LYS 32 -9.031 -13.556 1.059 251 HD3 LYS 32 HD1 LYS 32 -10.391 -14.357 1.858 252 HE2 LYS 32 HE2 LYS 32 -7.462 -14.575 2.580 253 HE3 LYS 32 HE1 LYS 32 -8.697 -13.704 3.484 254 HZ1 LYS 32 HZ1 LYS 32 -9.792 -15.780 3.959 255 HZ2 LYS 32 HZ2 LYS 32 -8.181 -15.868 4.448 256 HZ3 LYS 32 HZ3 LYS 32 -8.673 -16.639 3.029 257 H ARG 33 H ARG 33 -6.287 -15.160 -2.338 258 HA ARG 33 HA ARG 33 -8.483 -14.245 -3.847 259 HB2 ARG 33 HB2 ARG 33 -6.241 -13.114 -3.437 260 HB3 ARG 33 HB1 ARG 33 -5.596 -14.154 -4.694 261 HG2 ARG 33 HG2 ARG 33 -7.162 -13.192 -6.296 262 HG3 ARG 33 HG1 ARG 33 -7.812 -12.150 -5.027 263 HD2 ARG 33 HD2 ARG 33 -5.477 -11.264 -4.716 264 HD3 ARG 33 HD1 ARG 33 -5.034 -12.138 -6.179 265 HE ARG 33 HE ARG 33 -7.244 -10.227 -6.303 266 HH11 ARG 33 HH11 ARG 33 -3.953 -11.079 -7.177 267 HH12 ARG 33 HH12 ARG 33 -3.805 -9.805 -8.339 268 HH21 ARG 33 HH21 ARG 33 -7.024 -8.538 -7.836 269 HH22 ARG 33 HH22 ARG 33 -5.542 -8.365 -8.713 270 H GLN 34 H GLN 34 -6.186 -16.845 -4.327 271 HA GLN 34 HA GLN 34 -7.298 -17.392 -6.977 272 HB2 GLN 34 HB2 GLN 34 -4.909 -18.559 -5.556 273 HB3 GLN 34 HB1 GLN 34 -5.446 -19.036 -7.161 274 HG2 GLN 34 HG2 GLN 34 -5.104 -16.727 -7.934 275 HG3 GLN 34 HG1 GLN 34 -4.497 -16.304 -6.335 276 HE21 GLN 34 HE21 GLN 34 -3.887 -18.046 -9.258 277 HE22 GLN 34 HE22 GLN 34 -2.204 -18.318 -8.986 278 H GLY 35 H GLY 35 -7.709 -18.347 -3.784 279 HA2 GLY 35 HA2 GLY 35 -9.230 -19.861 -2.931 280 HA3 GLY 35 HA1 GLY 35 -9.555 -20.408 -4.566 281 H VAL 36 H VAL 36 -6.321 -20.308 -3.261 282 HA VAL 36 HA VAL 36 -6.278 -23.243 -3.410 283 HB VAL 36 HB VAL 36 -3.835 -23.072 -3.727 284 HG11 VAL 36 HG11 VAL 36 -5.431 -21.416 -5.678 285 HG12 VAL 36 HG12 VAL 36 -5.274 -23.173 -5.679 286 HG13 VAL 36 HG13 VAL 36 -3.864 -22.163 -6.000 287 HG21 VAL 36 HG21 VAL 36 -3.449 -20.971 -2.529 288 HG22 VAL 36 HG22 VAL 36 -4.305 -20.091 -3.795 289 HG23 VAL 36 HG23 VAL 36 -2.785 -20.905 -4.161 290 HA PRO 37 HA PRO 37 -5.364 -23.602 0.910 291 HB2 PRO 37 HB2 PRO 37 -3.347 -25.668 0.308 292 HB3 PRO 37 HB1 PRO 37 -4.876 -25.821 1.178 293 HG2 PRO 37 HG2 PRO 37 -4.542 -26.869 -1.268 294 HG3 PRO 37 HG1 PRO 37 -6.093 -26.181 -0.749 295 HD2 PRO 37 HD2 PRO 37 -3.968 -24.976 -2.481 296 HD3 PRO 37 HD1 PRO 37 -5.733 -24.956 -2.681 297 H ALA 38 H ALA 38 -4.179 -22.198 2.035 298 HA ALA 38 HA ALA 38 -1.684 -21.195 1.044 299 HB1 ALA 38 HB1 ALA 38 -1.746 -19.686 2.933 300 HB2 ALA 38 HB2 ALA 38 -3.058 -20.614 3.662 301 HB3 ALA 38 HB3 ALA 38 -3.323 -19.748 2.148 302 H ASP 39 H ASP 39 -2.586 -23.719 3.165 303 HA ASP 39 HA ASP 39 -0.110 -23.747 4.652 304 HB2 ASP 39 HB2 ASP 39 -2.284 -25.847 4.446 305 HB3 ASP 39 HB1 ASP 39 -0.924 -25.908 5.558 306 H GLN 40 H GLN 40 -0.963 -24.561 1.578 307 HA GLN 40 HA GLN 40 1.208 -26.543 1.324 308 HB2 GLN 40 HB2 GLN 40 -1.148 -26.016 -0.500 309 HB3 GLN 40 HB1 GLN 40 0.120 -27.193 -0.801 310 HG2 GLN 40 HG2 GLN 40 -0.565 -28.476 1.127 311 HG3 GLN 40 HG1 GLN 40 -1.777 -27.261 1.535 312 HE21 GLN 40 HE21 GLN 40 -3.458 -28.732 1.388 313 HE22 GLN 40 HE22 GLN 40 -4.021 -29.340 -0.129 314 H LEU 41 H LEU 41 0.949 -23.455 1.302 315 HA LEU 41 HA LEU 41 2.081 -22.943 -1.349 316 HB2 LEU 41 HB2 LEU 41 -0.015 -21.761 -0.511 317 HB3 LEU 41 HB1 LEU 41 1.036 -20.910 0.600 318 HG LEU 41 HG LEU 41 2.272 -19.971 -1.307 319 HD11 LEU 41 HD11 LEU 41 1.334 -20.204 -3.553 320 HD12 LEU 41 HD12 LEU 41 0.161 -21.372 -2.943 321 HD13 LEU 41 HD13 LEU 41 1.884 -21.750 -2.918 322 HD21 LEU 41 HD21 LEU 41 0.530 -18.434 -2.038 323 HD22 LEU 41 HD22 LEU 41 0.396 -18.750 -0.308 324 HD23 LEU 41 HD23 LEU 41 -0.708 -19.536 -1.436 325 H ARG 42 H ARG 42 4.058 -21.961 -1.575 326 HA ARG 42 HA ARG 42 5.587 -21.463 0.894 327 HB2 ARG 42 HB2 ARG 42 6.358 -23.507 -0.203 328 HB3 ARG 42 HB1 ARG 42 6.557 -22.643 -1.716 329 HG2 ARG 42 HG2 ARG 42 8.697 -23.020 -0.625 330 HG3 ARG 42 HG1 ARG 42 8.336 -21.298 -0.732 331 HD2 ARG 42 HD2 ARG 42 9.274 -21.909 1.453 332 HD3 ARG 42 HD1 ARG 42 7.638 -21.268 1.587 333 HE ARG 42 HE ARG 42 7.167 -23.896 1.488 334 HH11 ARG 42 HH11 ARG 42 9.480 -22.070 3.408 335 HH12 ARG 42 HH12 ARG 42 9.471 -23.196 4.716 336 HH21 ARG 42 HH21 ARG 42 7.152 -25.376 3.228 337 HH22 ARG 42 HH22 ARG 42 8.142 -25.085 4.614 338 H VAL 43 H VAL 43 6.559 -19.529 1.053 339 HA VAL 43 HA VAL 43 6.359 -17.747 -1.247 340 HB VAL 43 HB VAL 43 6.760 -15.900 0.450 341 HG11 VAL 43 HG11 VAL 43 4.541 -16.389 -0.418 342 HG12 VAL 43 HG12 VAL 43 4.451 -15.952 1.287 343 HG13 VAL 43 HG13 VAL 43 4.321 -17.643 0.800 344 HG21 VAL 43 HG21 VAL 43 6.312 -16.431 2.808 345 HG22 VAL 43 HG22 VAL 43 7.758 -17.256 2.226 346 HG23 VAL 43 HG23 VAL 43 6.249 -18.148 2.405 347 H ILE 44 H ILE 44 8.093 -17.489 -2.423 348 HA ILE 44 HA ILE 44 10.753 -17.581 -1.149 349 HB ILE 44 HB ILE 44 9.961 -18.294 -3.993 350 HG12 ILE 44 HG12 ILE 44 9.329 -20.024 -2.371 351 HG13 ILE 44 HG11 ILE 44 10.626 -20.583 -3.419 352 HG21 ILE 44 HG21 ILE 44 12.286 -18.958 -4.336 353 HG22 ILE 44 HG22 ILE 44 12.692 -18.402 -2.715 354 HG23 ILE 44 HG23 ILE 44 12.166 -17.245 -3.936 355 HD11 ILE 44 HD11 ILE 44 10.926 -19.610 -0.583 356 HD12 ILE 44 HD12 ILE 44 12.244 -20.132 -1.630 357 HD13 ILE 44 HD13 ILE 44 11.003 -21.283 -1.132 358 H PHE 45 H PHE 45 12.232 -16.010 -1.764 359 HA PHE 45 HA PHE 45 11.284 -13.898 -3.562 360 HB2 PHE 45 HB2 PHE 45 10.847 -13.169 -1.242 361 HB3 PHE 45 HB1 PHE 45 12.544 -13.423 -0.853 362 HD1 PHE 45 HD1 PHE 45 10.458 -11.593 -3.332 363 HD2 PHE 45 HD2 PHE 45 13.919 -11.589 -0.865 364 HE1 PHE 45 HE1 PHE 45 10.931 -9.282 -4.010 365 HE2 PHE 45 HE2 PHE 45 14.400 -9.273 -1.538 366 HZ PHE 45 HZ PHE 45 12.898 -8.119 -3.112 367 H ALA 46 H ALA 46 12.655 -14.079 -5.185 368 HA ALA 46 HA ALA 46 14.557 -14.046 -6.415 369 HB1 ALA 46 HB1 ALA 46 15.928 -13.281 -3.831 370 HB2 ALA 46 HB2 ALA 46 15.274 -12.164 -5.029 371 HB3 ALA 46 HB3 ALA 46 16.644 -13.196 -5.439 372 H GLY 47 H GLY 47 15.526 -15.353 -3.279 373 HA2 GLY 47 HA2 GLY 47 15.762 -18.029 -4.314 374 HA3 GLY 47 HA1 GLY 47 17.315 -17.275 -3.976 375 H LYS 48 H LYS 48 15.098 -15.947 -1.913 376 HA LYS 48 HA LYS 48 15.911 -17.754 0.270 377 HB2 LYS 48 HB2 LYS 48 15.684 -15.898 1.757 378 HB3 LYS 48 HB1 LYS 48 16.648 -15.358 0.389 379 HG2 LYS 48 HG2 LYS 48 14.964 -14.025 -0.452 380 HG3 LYS 48 HG1 LYS 48 13.697 -14.929 0.376 381 HD2 LYS 48 HD2 LYS 48 13.877 -12.859 1.495 382 HD3 LYS 48 HD1 LYS 48 14.648 -14.069 2.520 383 HE2 LYS 48 HE2 LYS 48 16.829 -13.352 1.849 384 HE3 LYS 48 HE1 LYS 48 16.156 -12.283 0.618 385 HZ1 LYS 48 HZ1 LYS 48 15.807 -11.988 3.552 386 HZ2 LYS 48 HZ2 LYS 48 15.148 -10.967 2.381 387 HZ3 LYS 48 HZ3 LYS 48 16.824 -11.052 2.577 388 H GLU 49 H GLU 49 14.291 -17.757 2.090 389 HA GLU 49 HA GLU 49 11.561 -17.678 1.031 390 HB2 GLU 49 HB2 GLU 49 11.006 -19.361 2.787 391 HB3 GLU 49 HB1 GLU 49 12.119 -19.953 1.564 392 HG2 GLU 49 HG2 GLU 49 13.984 -19.632 3.094 393 HG3 GLU 49 HG1 GLU 49 12.878 -19.008 4.317 394 H LEU 50 H LEU 50 9.968 -16.774 2.347 395 HA LEU 50 HA LEU 50 11.032 -14.804 4.218 396 HB2 LEU 50 HB2 LEU 50 8.250 -15.062 3.112 397 HB3 LEU 50 HB1 LEU 50 8.893 -13.703 4.015 398 HG LEU 50 HG LEU 50 9.741 -14.570 1.263 399 HD11 LEU 50 HD11 LEU 50 8.703 -12.518 0.512 400 HD12 LEU 50 HD12 LEU 50 8.206 -12.157 2.164 401 HD13 LEU 50 HD13 LEU 50 7.532 -13.556 1.327 402 HD21 LEU 50 HD21 LEU 50 10.639 -12.223 2.933 403 HD22 LEU 50 HD22 LEU 50 11.063 -12.494 1.243 404 HD23 LEU 50 HD23 LEU 50 11.621 -13.618 2.482 405 H ARG 51 H ARG 51 10.343 -14.591 6.311 406 HA ARG 51 HA ARG 51 9.261 -16.957 7.541 407 HB2 ARG 51 HB2 ARG 51 9.539 -15.749 9.675 408 HB3 ARG 51 HB1 ARG 51 11.014 -15.759 8.726 409 HG2 ARG 51 HG2 ARG 51 9.235 -13.420 8.407 410 HG3 ARG 51 HG1 ARG 51 10.086 -13.583 9.946 411 HD2 ARG 51 HD2 ARG 51 11.347 -13.548 7.199 412 HD3 ARG 51 HD1 ARG 51 11.356 -12.223 8.361 413 HE ARG 51 HE ARG 51 12.544 -14.788 9.130 414 HH11 ARG 51 HH11 ARG 51 12.991 -11.419 8.260 415 HH12 ARG 51 HH12 ARG 51 14.597 -11.338 8.877 416 HH21 ARG 51 HH21 ARG 51 14.668 -14.701 9.928 417 HH22 ARG 51 HH22 ARG 51 15.576 -13.233 9.827 418 H ASN 52 H ASN 52 7.350 -16.970 8.866 419 HA ASN 52 HA ASN 52 5.184 -15.787 7.441 420 HB2 ASN 52 HB2 ASN 52 3.727 -17.020 8.993 421 HB3 ASN 52 HB1 ASN 52 4.982 -18.050 8.320 422 HD21 ASN 52 HD21 ASN 52 3.361 -18.256 10.784 423 HD22 ASN 52 HD22 ASN 52 4.501 -18.414 12.068 424 H ASP 53 H ASP 53 6.618 -15.138 10.613 425 HA ASP 53 HA ASP 53 4.565 -13.100 11.038 426 HB2 ASP 53 HB2 ASP 53 4.833 -14.855 12.809 427 HB3 ASP 53 HB1 ASP 53 6.461 -14.254 13.095 428 H TRP 54 H TRP 54 5.646 -11.782 9.529 429 HA TRP 54 HA TRP 54 7.349 -9.903 10.865 430 HB2 TRP 54 HB2 TRP 54 8.917 -11.692 9.983 431 HB3 TRP 54 HB1 TRP 54 8.458 -11.179 8.365 432 HD1 TRP 54 HD1 TRP 54 10.273 -9.676 7.386 433 HE1 TRP 54 HE1 TRP 54 11.860 -7.861 8.282 434 HE3 TRP 54 HE3 TRP 54 8.890 -9.755 12.306 435 HZ2 TRP 54 HZ2 TRP 54 12.436 -6.620 10.756 436 HZ3 TRP 54 HZ3 TRP 54 10.005 -8.218 13.868 437 HH2 TRP 54 HH2 TRP 54 11.739 -6.685 13.099 438 H THR 55 H THR 55 7.513 -7.907 9.745 439 HA THR 55 HA THR 55 5.233 -7.298 8.160 440 HB THR 55 HB THR 55 5.887 -5.556 9.607 441 HG1 THR 55 HG1 THR 55 5.617 -4.080 8.118 442 HG21 THR 55 HG21 THR 55 8.664 -5.720 8.415 443 HG22 THR 55 HG22 THR 55 8.198 -6.236 10.036 444 HG23 THR 55 HG23 THR 55 8.130 -4.530 9.601 445 H VAL 56 H VAL 56 5.027 -6.870 6.039 446 HA VAL 56 HA VAL 56 6.923 -8.032 4.272 447 HB VAL 56 HB VAL 56 4.516 -8.214 3.861 448 HG11 VAL 56 HG11 VAL 56 3.200 -6.324 3.089 449 HG12 VAL 56 HG12 VAL 56 4.570 -5.246 3.359 450 HG13 VAL 56 HG13 VAL 56 3.802 -6.057 4.726 451 HG21 VAL 56 HG21 VAL 56 5.934 -6.655 1.709 452 HG22 VAL 56 HG22 VAL 56 4.493 -7.647 1.481 453 HG23 VAL 56 HG23 VAL 56 6.015 -8.396 1.967 454 H GLN 57 H GLN 57 6.300 -4.791 5.375 455 HA GLN 57 HA GLN 57 7.405 -3.461 3.140 456 HB2 GLN 57 HB2 GLN 57 5.922 -2.298 4.690 457 HB3 GLN 57 HB1 GLN 57 7.112 -2.466 5.975 458 HG2 GLN 57 HG2 GLN 57 8.641 -1.022 4.846 459 HG3 GLN 57 HG1 GLN 57 7.626 -0.990 3.407 460 HE21 GLN 57 HE21 GLN 57 8.031 0.150 6.653 461 HE22 GLN 57 HE22 GLN 57 6.863 1.419 6.566 462 H ASN 58 H ASN 58 8.786 -4.788 6.040 463 HA ASN 58 HA ASN 58 11.354 -3.544 5.572 464 HB2 ASN 58 HB2 ASN 58 10.398 -4.007 7.866 465 HB3 ASN 58 HB1 ASN 58 10.698 -5.713 7.566 466 HD21 ASN 58 HD21 ASN 58 12.116 -5.816 9.292 467 HD22 ASN 58 HD22 ASN 58 13.706 -5.152 9.219 468 H CYS 59 H CYS 59 9.754 -6.165 4.300 469 HA CYS 59 HA CYS 59 12.051 -7.905 4.036 470 HB2 CYS 59 HB2 CYS 59 9.264 -8.097 2.887 471 HB3 CYS 59 HB1 CYS 59 10.508 -9.326 2.691 472 HG CYS 59 HG CYS 59 9.033 -8.385 5.640 473 H ASP 60 H ASP 60 10.819 -5.221 2.397 474 HA ASP 60 HA ASP 60 11.401 -4.133 0.475 475 HB2 ASP 60 HB2 ASP 60 13.751 -5.560 1.316 476 HB3 ASP 60 HB1 ASP 60 13.704 -5.460 -0.437 477 H LEU 61 H LEU 61 9.611 -6.334 0.219 478 HA LEU 61 HA LEU 61 10.305 -8.020 -1.956 479 HB2 LEU 61 HB2 LEU 61 7.565 -7.313 -0.926 480 HB3 LEU 61 HB1 LEU 61 7.926 -8.631 -2.013 481 HG LEU 61 HG LEU 61 8.634 -8.384 0.897 482 HD11 LEU 61 HD11 LEU 61 7.144 -10.519 -0.597 483 HD12 LEU 61 HD12 LEU 61 6.381 -9.174 0.241 484 HD13 LEU 61 HD13 LEU 61 7.322 -10.357 1.151 485 HD21 LEU 61 HD21 LEU 61 10.595 -9.256 -0.247 486 HD22 LEU 61 HD22 LEU 61 9.599 -10.462 -1.062 487 HD23 LEU 61 HD23 LEU 61 9.804 -10.523 0.688 488 H ASP 62 H ASP 62 9.472 -4.783 -1.926 489 HA ASP 62 HA ASP 62 8.478 -4.922 -4.684 490 HB2 ASP 62 HB2 ASP 62 6.931 -3.717 -3.368 491 HB3 ASP 62 HB1 ASP 62 8.197 -2.820 -2.545 492 H GLN 63 H GLN 63 11.143 -3.902 -2.751 493 HA GLN 63 HA GLN 63 12.070 -2.031 -4.771 494 HB2 GLN 63 HB2 GLN 63 12.296 -1.384 -2.442 495 HB3 GLN 63 HB1 GLN 63 13.293 -2.796 -2.123 496 HG2 GLN 63 HG2 GLN 63 14.645 -0.785 -2.331 497 HG3 GLN 63 HG1 GLN 63 15.017 -1.938 -3.611 498 HE21 GLN 63 HE21 GLN 63 15.836 -0.397 -4.987 499 HE22 GLN 63 HE22 GLN 63 14.851 0.781 -5.780 500 H GLN 64 H GLN 64 13.332 -5.012 -3.271 501 HA GLN 64 HA GLN 64 15.649 -4.980 -4.943 502 HB2 GLN 64 HB2 GLN 64 14.577 -7.183 -3.186 503 HB3 GLN 64 HB1 GLN 64 16.163 -7.164 -3.944 504 HG2 GLN 64 HG2 GLN 64 15.151 -5.204 -1.901 505 HG3 GLN 64 HG1 GLN 64 16.300 -6.512 -1.617 506 HE21 GLN 64 HE21 GLN 64 16.530 -3.594 -1.317 507 HE22 GLN 64 HE22 GLN 64 17.921 -3.149 -2.250 508 H SEP 65 H SEP 65 13.206 -7.547 -4.712 509 HA SEP 65 HA SEP 65 13.295 -7.795 -7.624 510 HB2 SEP 65 HB1 SEP 65 13.419 -10.262 -7.392 511 HB3 SEP 65 HB2 SEP 65 13.641 -10.067 -5.656 512 H ILE 66 H ILE 66 11.635 -9.838 -8.016 513 HA ILE 66 HA ILE 66 9.138 -8.880 -6.859 514 HB ILE 66 HB ILE 66 9.396 -9.089 -9.364 515 HG12 ILE 66 HG12 ILE 66 7.276 -10.956 -8.330 516 HG13 ILE 66 HG11 ILE 66 7.189 -9.210 -8.125 517 HG21 ILE 66 HG21 ILE 66 10.744 -11.100 -9.439 518 HG22 ILE 66 HG22 ILE 66 9.253 -11.308 -10.363 519 HG23 ILE 66 HG23 ILE 66 9.405 -12.031 -8.764 520 HD11 ILE 66 HD11 ILE 66 7.326 -10.664 -10.756 521 HD12 ILE 66 HD12 ILE 66 7.206 -8.919 -10.539 522 HD13 ILE 66 HD13 ILE 66 5.880 -9.965 -10.032 523 H VAL 67 H VAL 67 7.598 -10.436 -5.988 524 HA VAL 67 HA VAL 67 8.954 -12.441 -4.408 525 HB VAL 67 HB VAL 67 5.976 -11.969 -4.498 526 HG11 VAL 67 HG11 VAL 67 6.740 -13.957 -3.289 527 HG12 VAL 67 HG12 VAL 67 6.039 -12.761 -2.195 528 HG13 VAL 67 HG13 VAL 67 7.789 -12.944 -2.294 529 HG21 VAL 67 HG21 VAL 67 7.045 -9.811 -4.172 530 HG22 VAL 67 HG22 VAL 67 8.025 -10.481 -2.867 531 HG23 VAL 67 HG23 VAL 67 6.275 -10.349 -2.678 532 H HIS 68 H HIS 68 8.867 -14.611 -4.639 533 HA HIS 68 HA HIS 68 7.457 -15.616 -7.021 534 HB2 HIS 68 HB2 HIS 68 9.899 -16.806 -5.683 535 HB3 HIS 68 HB1 HIS 68 9.172 -17.322 -7.197 536 HD2 HIS 68 HD2 HIS 68 9.014 -14.365 -8.632 537 HE1 HIS 68 HE1 HIS 68 13.194 -14.392 -7.985 538 HE2 HIS 68 HE2 HIS 68 11.280 -13.167 -9.066 539 H ILE 69 H ILE 69 5.638 -16.581 -6.375 540 HA ILE 69 HA ILE 69 5.723 -18.126 -3.892 541 HB ILE 69 HB ILE 69 3.408 -16.870 -5.361 542 HG12 ILE 69 HG12 ILE 69 4.599 -16.493 -2.607 543 HG13 ILE 69 HG11 ILE 69 4.613 -15.339 -3.937 544 HG21 ILE 69 HG21 ILE 69 1.939 -17.828 -3.661 545 HG22 ILE 69 HG22 ILE 69 3.300 -18.731 -2.997 546 HG23 ILE 69 HG23 ILE 69 2.722 -19.080 -4.625 547 HD11 ILE 69 HD11 ILE 69 2.174 -16.287 -2.449 548 HD12 ILE 69 HD12 ILE 69 2.188 -15.123 -3.772 549 HD13 ILE 69 HD13 ILE 69 2.977 -14.730 -2.244 550 H VAL 70 H VAL 70 5.649 -20.239 -3.959 551 HA VAL 70 HA VAL 70 4.634 -21.530 -6.392 552 HB VAL 70 HB VAL 70 7.115 -21.664 -6.285 553 HG11 VAL 70 HG11 VAL 70 6.669 -23.229 -3.752 554 HG12 VAL 70 HG12 VAL 70 7.423 -21.639 -3.881 555 HG13 VAL 70 HG13 VAL 70 8.207 -23.048 -4.594 556 HG21 VAL 70 HG21 VAL 70 5.702 -24.304 -5.916 557 HG22 VAL 70 HG22 VAL 70 7.305 -24.093 -6.620 558 HG23 VAL 70 HG23 VAL 70 5.892 -23.416 -7.430 559 H GLN 71 H GLN 71 3.385 -23.353 -6.093 560 HA GLN 71 HA GLN 71 2.593 -23.866 -3.311 561 HB2 GLN 71 HB2 GLN 71 0.850 -22.947 -4.863 562 HB3 GLN 71 HB1 GLN 71 1.008 -24.410 -5.825 563 HG2 GLN 71 HG2 GLN 71 0.336 -25.730 -3.837 564 HG3 GLN 71 HG1 GLN 71 0.060 -24.216 -2.975 565 HE21 GLN 71 HE21 GLN 71 -1.823 -26.316 -3.610 566 HE22 GLN 71 HE22 GLN 71 -3.064 -25.582 -4.560 567 H ARG 72 H ARG 72 2.637 -25.910 -2.530 568 HA ARG 72 HA ARG 72 3.500 -28.026 -4.387 569 HB2 ARG 72 HB2 ARG 72 4.292 -27.621 -1.499 570 HB3 ARG 72 HB1 ARG 72 4.641 -29.075 -2.418 571 HG2 ARG 72 HG2 ARG 72 5.976 -27.732 -3.992 572 HG3 ARG 72 HG1 ARG 72 5.658 -26.304 -3.008 573 HD2 ARG 72 HD2 ARG 72 6.789 -27.295 -1.123 574 HD3 ARG 72 HD1 ARG 72 6.994 -28.808 -2.002 575 HE ARG 72 HE ARG 72 8.178 -26.709 -3.453 576 HH11 ARG 72 HH11 ARG 72 8.670 -28.588 -0.531 577 HH12 ARG 72 HH12 ARG 72 10.389 -28.417 -0.560 578 HH21 ARG 72 HH21 ARG 72 10.472 -26.496 -3.487 579 HH22 ARG 72 HH22 ARG 72 11.414 -27.230 -2.239 580 HA PRO 73 HA PRO 73 -0.351 -29.526 -2.499 581 HB2 PRO 73 HB2 PRO 73 -1.736 -29.925 -4.727 582 HB3 PRO 73 HB1 PRO 73 -1.510 -28.299 -4.077 583 HG2 PRO 73 HG2 PRO 73 -0.258 -29.567 -6.448 584 HG3 PRO 73 HG1 PRO 73 -0.577 -27.857 -6.126 585 HD2 PRO 73 HD2 PRO 73 1.889 -29.281 -5.778 586 HD3 PRO 73 HD1 PRO 73 1.553 -27.580 -5.394 587 H TRP 74 H TRP 74 -1.124 -31.621 -2.286 588 HA TRP 74 HA TRP 74 0.396 -33.670 -3.738 589 HB2 TRP 74 HB2 TRP 74 0.837 -33.733 -1.360 590 HB3 TRP 74 HB1 TRP 74 -0.885 -33.755 -1.001 591 HD1 TRP 74 HD1 TRP 74 1.553 -36.024 -3.016 592 HE1 TRP 74 HE1 TRP 74 0.942 -38.467 -2.512 593 HE3 TRP 74 HE3 TRP 74 -2.391 -35.224 0.130 594 HZ2 TRP 74 HZ2 TRP 74 -0.969 -39.873 -0.974 595 HZ3 TRP 74 HZ3 TRP 74 -3.556 -37.172 1.078 596 HH2 TRP 74 HH2 TRP 74 -2.859 -39.443 0.540 597 H ARG 75 H ARG 75 -2.788 -32.465 -3.095 598 HA ARG 75 HA ARG 75 -3.902 -34.821 -4.447 599 HB2 ARG 75 HB2 ARG 75 -5.183 -32.946 -2.475 600 HB3 ARG 75 HB1 ARG 75 -6.116 -34.058 -3.464 601 HG2 ARG 75 HG2 ARG 75 -3.946 -34.873 -1.530 602 HG3 ARG 75 HG1 ARG 75 -5.676 -34.914 -1.191 603 HD2 ARG 75 HD2 ARG 75 -4.972 -37.134 -1.800 604 HD3 ARG 75 HD1 ARG 75 -5.952 -36.485 -3.114 605 HE ARG 75 HE ARG 75 -3.098 -36.119 -3.432 606 HH11 ARG 75 HH11 ARG 75 -5.823 -38.241 -4.085 607 HH12 ARG 75 HH12 ARG 75 -5.047 -39.015 -5.423 608 HH21 ARG 75 HH21 ARG 75 -2.097 -37.136 -5.217 609 HH22 ARG 75 HH22 ARG 75 -2.938 -38.394 -6.064 610 H LYS 76 H LYS 76 -2.804 -32.092 -5.381 611 HA LYS 76 HA LYS 76 -5.056 -31.508 -7.163 612 HB2 LYS 76 HB2 LYS 76 -2.719 -29.770 -6.356 613 HB3 LYS 76 HB1 LYS 76 -3.811 -29.363 -7.664 614 HG2 LYS 76 HG2 LYS 76 -5.024 -29.944 -5.018 615 HG3 LYS 76 HG1 LYS 76 -4.133 -28.432 -5.197 616 HD2 LYS 76 HD2 LYS 76 -6.477 -28.044 -5.680 617 HD3 LYS 76 HD1 LYS 76 -5.543 -27.880 -7.165 618 HE2 LYS 76 HE2 LYS 76 -6.201 -30.149 -7.814 619 HE3 LYS 76 HE1 LYS 76 -7.143 -30.305 -6.334 620 HZ1 LYS 76 HZ1 LYS 76 -8.547 -29.727 -8.200 621 HZ2 LYS 76 HZ2 LYS 76 -7.624 -28.349 -8.518 622 HZ3 LYS 76 HZ3 LYS 76 -8.518 -28.452 -7.091 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 0.402 -1.413 0.799 2 H2 MET 1 HT2 MET 1 0.453 -0.103 -0.273 3 H3 MET 1 HT3 MET 1 1.242 -0.002 1.217 4 HA MET 1 HA MET 1 2.794 -0.359 -0.571 5 HB2 MET 1 HB2 MET 1 3.246 -1.268 1.688 6 HB3 MET 1 HB1 MET 1 2.480 -2.778 1.223 7 HG2 MET 1 HG2 MET 1 4.200 -3.184 -0.420 8 HG3 MET 1 HG1 MET 1 4.927 -1.615 -0.083 9 HE1 MET 1 HE1 MET 1 7.296 -2.696 0.301 10 HE2 MET 1 HE2 MET 1 6.631 -4.286 -0.066 11 HE3 MET 1 HE3 MET 1 7.597 -4.050 1.389 12 H ILE 2 H ILE 2 2.945 -1.013 -2.578 13 HA ILE 2 HA ILE 2 1.289 -3.273 -3.466 14 HB ILE 2 HB ILE 2 2.491 -0.971 -5.018 15 HG12 ILE 2 HG12 ILE 2 0.397 -0.544 -3.712 16 HG13 ILE 2 HG11 ILE 2 0.250 -0.269 -5.443 17 HG21 ILE 2 HG21 ILE 2 1.427 -1.907 -7.024 18 HG22 ILE 2 HG22 ILE 2 0.966 -3.335 -6.097 19 HG23 ILE 2 HG23 ILE 2 2.671 -2.976 -6.373 20 HD11 ILE 2 HD11 ILE 2 -1.706 -1.379 -4.549 21 HD12 ILE 2 HD12 ILE 2 -0.695 -2.695 -3.950 22 HD13 ILE 2 HD13 ILE 2 -0.851 -2.423 -5.685 23 H VAL 3 H VAL 3 2.422 -5.102 -3.507 24 HA VAL 3 HA VAL 3 5.219 -4.969 -4.405 25 HB VAL 3 HB VAL 3 5.603 -7.098 -3.242 26 HG11 VAL 3 HG11 VAL 3 5.436 -6.286 -0.936 27 HG12 VAL 3 HG12 VAL 3 4.357 -5.000 -1.477 28 HG13 VAL 3 HG13 VAL 3 6.029 -5.041 -2.036 29 HG21 VAL 3 HG21 VAL 3 3.921 -8.025 -1.725 30 HG22 VAL 3 HG22 VAL 3 3.365 -8.050 -3.401 31 HG23 VAL 3 HG23 VAL 3 2.754 -6.827 -2.284 32 H PHE 4 H PHE 4 5.953 -6.577 -5.865 33 HA PHE 4 HA PHE 4 3.796 -7.561 -7.563 34 HB2 PHE 4 HB2 PHE 4 6.760 -7.298 -8.101 35 HB3 PHE 4 HB1 PHE 4 5.585 -7.914 -9.252 36 HD1 PHE 4 HD1 PHE 4 7.259 -5.038 -8.088 37 HD2 PHE 4 HD2 PHE 4 3.591 -6.337 -9.798 38 HE1 PHE 4 HE1 PHE 4 6.807 -2.742 -8.852 39 HE2 PHE 4 HE2 PHE 4 3.131 -4.046 -10.568 40 HZ PHE 4 HZ PHE 4 4.741 -2.245 -10.093 41 H VAL 5 H VAL 5 3.439 -9.673 -7.931 42 HA VAL 5 HA VAL 5 5.277 -11.578 -6.702 43 HB VAL 5 HB VAL 5 3.612 -11.174 -5.003 44 HG11 VAL 5 HG11 VAL 5 1.865 -10.242 -6.360 45 HG12 VAL 5 HG12 VAL 5 1.246 -11.548 -5.349 46 HG13 VAL 5 HG13 VAL 5 1.541 -11.825 -7.067 47 HG21 VAL 5 HG21 VAL 5 2.664 -13.383 -4.696 48 HG22 VAL 5 HG22 VAL 5 4.342 -13.485 -5.235 49 HG23 VAL 5 HG23 VAL 5 3.027 -13.789 -6.373 50 H ARG 6 H ARG 6 5.549 -13.407 -7.753 51 HA ARG 6 HA ARG 6 4.017 -13.885 -10.213 52 HB2 ARG 6 HB2 ARG 6 6.797 -14.703 -9.368 53 HB3 ARG 6 HB1 ARG 6 6.007 -15.350 -10.791 54 HG2 ARG 6 HG2 ARG 6 5.858 -13.090 -11.715 55 HG3 ARG 6 HG1 ARG 6 6.692 -12.478 -10.283 56 HD2 ARG 6 HD2 ARG 6 8.197 -12.802 -12.220 57 HD3 ARG 6 HD1 ARG 6 8.656 -13.757 -10.814 58 HE ARG 6 HE ARG 6 7.762 -15.705 -11.922 59 HH11 ARG 6 HH11 ARG 6 8.097 -12.867 -13.960 60 HH12 ARG 6 HH12 ARG 6 8.219 -13.772 -15.426 61 HH21 ARG 6 HH21 ARG 6 7.908 -16.910 -13.866 62 HH22 ARG 6 HH22 ARG 6 8.117 -16.088 -15.372 63 H PHE 7 H PHE 7 2.446 -15.299 -9.805 64 HA PHE 7 HA PHE 7 2.866 -17.443 -7.903 65 HB2 PHE 7 HB2 PHE 7 0.692 -16.194 -8.007 66 HB3 PHE 7 HB1 PHE 7 0.429 -16.868 -9.611 67 HD1 PHE 7 HD1 PHE 7 0.852 -17.745 -6.048 68 HD2 PHE 7 HD2 PHE 7 -0.494 -19.016 -9.878 69 HE1 PHE 7 HE1 PHE 7 -0.189 -19.716 -5.021 70 HE2 PHE 7 HE2 PHE 7 -1.538 -20.997 -8.858 71 HZ PHE 7 HZ PHE 7 -1.384 -21.349 -6.426 72 H ASN 8 H ASN 8 2.702 -19.639 -8.466 73 HA ASN 8 HA ASN 8 4.203 -20.647 -10.469 74 HB2 ASN 8 HB2 ASN 8 3.327 -22.024 -8.661 75 HB3 ASN 8 HB1 ASN 8 1.707 -21.926 -9.339 76 HD21 ASN 8 HD21 ASN 8 1.210 -23.125 -11.203 77 HD22 ASN 8 HD22 ASN 8 2.215 -24.421 -11.740 78 H SER 9 H SER 9 0.698 -20.122 -10.757 79 HA SER 9 HA SER 9 0.871 -20.763 -13.615 80 HB2 SER 9 HB2 SER 9 -1.586 -20.501 -11.868 81 HB3 SER 9 HB1 SER 9 -1.523 -21.128 -13.517 82 HG SER 9 HG SER 9 -1.511 -22.675 -11.638 83 H SER 10 H SER 10 1.780 -18.213 -12.542 84 HA SER 10 HA SER 10 -0.025 -16.455 -14.029 85 HB2 SER 10 HB2 SER 10 1.176 -15.788 -11.337 86 HB3 SER 10 HB1 SER 10 0.144 -14.739 -12.305 87 HG SER 10 HG SER 10 -1.290 -16.811 -12.121 88 H HIS 11 H HIS 11 1.135 -14.209 -14.240 89 HA HIS 11 HA HIS 11 3.835 -14.773 -15.237 90 HB2 HIS 11 HB2 HIS 11 1.988 -12.448 -15.837 91 HB3 HIS 11 HB1 HIS 11 3.561 -12.719 -16.571 92 HD2 HIS 11 HD2 HIS 11 0.032 -14.461 -16.530 93 HE1 HIS 11 HE1 HIS 11 2.061 -15.392 -20.119 94 HE2 HIS 11 HE2 HIS 11 -0.076 -15.714 -18.793 95 H GLY 12 H GLY 12 2.079 -12.107 -13.658 96 HA2 GLY 12 HA2 GLY 12 3.765 -11.754 -11.496 97 HA3 GLY 12 HA1 GLY 12 4.432 -10.774 -12.798 98 H PHE 13 H PHE 13 1.969 -11.069 -10.446 99 HA PHE 13 HA PHE 13 0.687 -8.633 -11.475 100 HB2 PHE 13 HB2 PHE 13 -1.360 -9.394 -10.243 101 HB3 PHE 13 HB1 PHE 13 -0.894 -10.432 -11.583 102 HD1 PHE 13 HD1 PHE 13 -1.348 -10.190 -7.984 103 HD2 PHE 13 HD2 PHE 13 0.091 -12.645 -11.146 104 HE1 PHE 13 HE1 PHE 13 -1.388 -12.137 -6.487 105 HE2 PHE 13 HE2 PHE 13 0.060 -14.592 -9.649 106 HZ PHE 13 HZ PHE 13 -0.683 -14.340 -7.316 107 HA PRO 14 HA PRO 14 1.777 -6.787 -7.602 108 HB2 PRO 14 HB2 PRO 14 0.300 -4.559 -7.737 109 HB3 PRO 14 HB1 PRO 14 1.664 -4.826 -8.828 110 HG2 PRO 14 HG2 PRO 14 -1.261 -5.115 -9.344 111 HG3 PRO 14 HG1 PRO 14 0.010 -4.487 -10.408 112 HD2 PRO 14 HD2 PRO 14 -1.044 -7.055 -10.518 113 HD3 PRO 14 HD1 PRO 14 0.520 -6.564 -11.193 114 H VAL 15 H VAL 15 1.112 -7.055 -5.571 115 HA VAL 15 HA VAL 15 -1.768 -7.363 -5.055 116 HB VAL 15 HB VAL 15 0.584 -8.765 -3.731 117 HG11 VAL 15 HG11 VAL 15 -0.988 -7.946 -1.999 118 HG12 VAL 15 HG12 VAL 15 -0.967 -9.704 -2.118 119 HG13 VAL 15 HG13 VAL 15 -2.299 -8.787 -2.821 120 HG21 VAL 15 HG21 VAL 15 -1.925 -9.793 -5.042 121 HG22 VAL 15 HG22 VAL 15 -0.634 -10.774 -4.350 122 HG23 VAL 15 HG23 VAL 15 -0.317 -9.773 -5.766 123 H GLU 16 H GLU 16 -2.673 -6.023 -3.636 124 HA GLU 16 HA GLU 16 -0.992 -3.959 -2.477 125 HB2 GLU 16 HB2 GLU 16 -2.978 -3.273 -3.737 126 HB3 GLU 16 HB1 GLU 16 -3.998 -4.179 -2.629 127 HG2 GLU 16 HG2 GLU 16 -3.291 -2.723 -0.792 128 HG3 GLU 16 HG1 GLU 16 -2.288 -1.809 -1.918 129 H VAL 17 H VAL 17 -0.205 -4.269 -0.562 130 HA VAL 17 HA VAL 17 -1.943 -5.420 1.505 131 HB VAL 17 HB VAL 17 0.076 -6.412 2.575 132 HG11 VAL 17 HG11 VAL 17 0.249 -8.336 1.118 133 HG12 VAL 17 HG12 VAL 17 -0.393 -7.405 -0.230 134 HG13 VAL 17 HG13 VAL 17 -1.420 -7.766 1.158 135 HG21 VAL 17 HG21 VAL 17 1.432 -5.661 -0.019 136 HG22 VAL 17 HG22 VAL 17 2.121 -6.698 1.231 137 HG23 VAL 17 HG23 VAL 17 1.789 -5.002 1.579 138 H ASP 18 H ASP 18 -0.887 -4.932 3.734 139 HA ASP 18 HA ASP 18 -0.531 -2.054 3.850 140 HB2 ASP 18 HB2 ASP 18 -0.757 -4.135 6.044 141 HB3 ASP 18 HB1 ASP 18 -0.674 -2.399 6.305 142 H SER 19 H SER 19 1.185 -1.234 5.363 143 HA SER 19 HA SER 19 3.710 -2.255 4.537 144 HB2 SER 19 HB2 SER 19 3.100 -0.217 6.691 145 HB3 SER 19 HB1 SER 19 4.650 -0.457 5.881 146 HG SER 19 HG SER 19 2.326 0.774 4.978 147 H ASP 20 H ASP 20 1.733 -2.562 7.393 148 HA ASP 20 HA ASP 20 3.851 -3.919 8.844 149 HB2 ASP 20 HB2 ASP 20 1.039 -3.159 9.640 150 HB3 ASP 20 HB1 ASP 20 2.135 -4.058 10.681 151 H THR 21 H THR 21 1.891 -4.866 6.476 152 HA THR 21 HA THR 21 0.648 -7.187 7.426 153 HB THR 21 HB THR 21 1.677 -6.503 4.662 154 HG1 THR 21 HG1 THR 21 -1.024 -6.714 5.089 155 HG21 THR 21 HG21 THR 21 0.222 -8.325 3.843 156 HG22 THR 21 HG22 THR 21 -0.106 -8.800 5.510 157 HG23 THR 21 HG23 THR 21 1.528 -8.935 4.858 158 H SER 22 H SER 22 1.472 -8.995 8.143 159 HA SER 22 HA SER 22 4.289 -9.507 7.958 160 HB2 SER 22 HB2 SER 22 2.096 -11.246 9.105 161 HB3 SER 22 HB1 SER 22 3.826 -11.396 9.409 162 HG SER 22 HG SER 22 2.637 -8.926 9.936 163 H ILE 23 H ILE 23 5.240 -11.354 6.986 164 HA ILE 23 HA ILE 23 4.351 -12.009 4.424 165 HB ILE 23 HB ILE 23 6.161 -13.735 6.139 166 HG12 ILE 23 HG12 ILE 23 6.972 -11.437 6.196 167 HG13 ILE 23 HG11 ILE 23 8.033 -12.418 5.194 168 HG21 ILE 23 HG21 ILE 23 7.194 -14.350 3.973 169 HG22 ILE 23 HG22 ILE 23 5.948 -13.418 3.145 170 HG23 ILE 23 HG23 ILE 23 5.502 -14.840 4.089 171 HD11 ILE 23 HD11 ILE 23 7.669 -10.250 4.189 172 HD12 ILE 23 HD12 ILE 23 5.924 -10.503 4.215 173 HD13 ILE 23 HD13 ILE 23 6.946 -11.510 3.188 174 H PHE 24 H PHE 24 3.690 -13.456 7.502 175 HA PHE 24 HA PHE 24 2.535 -15.900 6.918 176 HB2 PHE 24 HB2 PHE 24 2.935 -15.017 9.183 177 HB3 PHE 24 HB1 PHE 24 1.668 -13.826 8.947 178 HD1 PHE 24 HD1 PHE 24 2.276 -17.477 9.063 179 HD2 PHE 24 HD2 PHE 24 -0.504 -14.307 9.574 180 HE1 PHE 24 HE1 PHE 24 0.656 -19.053 10.004 181 HE2 PHE 24 HE2 PHE 24 -2.136 -15.880 10.517 182 HZ PHE 24 HZ PHE 24 -1.558 -18.264 10.736 183 H GLN 25 H GLN 25 0.859 -12.762 7.184 184 HA GLN 25 HA GLN 25 -1.599 -13.774 6.147 185 HB2 GLN 25 HB2 GLN 25 -0.609 -11.003 6.769 186 HB3 GLN 25 HB1 GLN 25 -2.190 -11.295 6.058 187 HG2 GLN 25 HG2 GLN 25 -1.261 -12.482 8.658 188 HG3 GLN 25 HG1 GLN 25 -2.216 -11.006 8.516 189 HE21 GLN 25 HE21 GLN 25 -2.220 -14.469 8.135 190 HE22 GLN 25 HE22 GLN 25 -3.928 -14.653 8.029 191 H LEU 26 H LEU 26 1.107 -11.956 4.819 192 HA LEU 26 HA LEU 26 0.060 -11.212 2.360 193 HB2 LEU 26 HB2 LEU 26 2.236 -10.460 3.081 194 HB3 LEU 26 HB1 LEU 26 2.842 -12.104 3.103 195 HG LEU 26 HG LEU 26 2.649 -12.192 0.642 196 HD11 LEU 26 HD11 LEU 26 2.238 -10.172 -0.625 197 HD12 LEU 26 HD12 LEU 26 1.971 -9.268 0.863 198 HD13 LEU 26 HD13 LEU 26 0.844 -10.541 0.391 199 HD21 LEU 26 HD21 LEU 26 4.520 -10.676 0.181 200 HD22 LEU 26 HD22 LEU 26 4.753 -11.588 1.673 201 HD23 LEU 26 HD23 LEU 26 4.253 -9.897 1.744 202 H LYS 27 H LYS 27 1.492 -14.276 3.347 203 HA LYS 27 HA LYS 27 1.419 -15.626 0.896 204 HB2 LYS 27 HB2 LYS 27 2.596 -16.430 2.939 205 HB3 LYS 27 HB1 LYS 27 1.029 -16.742 3.669 206 HG2 LYS 27 HG2 LYS 27 0.536 -18.435 2.024 207 HG3 LYS 27 HG1 LYS 27 2.037 -18.080 1.169 208 HD2 LYS 27 HD2 LYS 27 2.459 -20.035 2.438 209 HD3 LYS 27 HD1 LYS 27 3.251 -18.722 3.302 210 HE2 LYS 27 HE2 LYS 27 0.490 -19.713 4.006 211 HE3 LYS 27 HE1 LYS 27 1.950 -20.407 4.701 212 HZ1 LYS 27 HZ1 LYS 27 0.947 -17.628 5.021 213 HZ2 LYS 27 HZ2 LYS 27 2.498 -18.114 5.484 214 HZ3 LYS 27 HZ3 LYS 27 1.150 -18.811 6.208 215 H GLU 28 H GLU 28 -0.984 -15.309 3.463 216 HA GLU 28 HA GLU 28 -2.864 -17.054 2.253 217 HB2 GLU 28 HB2 GLU 28 -3.036 -15.101 4.525 218 HB3 GLU 28 HB1 GLU 28 -4.406 -16.083 4.016 219 HG2 GLU 28 HG2 GLU 28 -3.078 -18.107 4.434 220 HG3 GLU 28 HG1 GLU 28 -1.744 -17.097 4.983 221 H VAL 29 H VAL 29 -2.256 -13.622 2.045 222 HA VAL 29 HA VAL 29 -4.727 -12.874 0.884 223 HB VAL 29 HB VAL 29 -1.990 -11.612 0.528 224 HG11 VAL 29 HG11 VAL 29 -4.720 -10.498 -0.130 225 HG12 VAL 29 HG12 VAL 29 -3.504 -11.001 -1.300 226 HG13 VAL 29 HG13 VAL 29 -3.193 -9.623 -0.245 227 HG21 VAL 29 HG21 VAL 29 -2.796 -9.974 2.170 228 HG22 VAL 29 HG22 VAL 29 -2.762 -11.607 2.842 229 HG23 VAL 29 HG23 VAL 29 -4.294 -10.891 2.339 230 H VAL 30 H VAL 30 -1.611 -13.795 -0.547 231 HA VAL 30 HA VAL 30 -2.482 -13.665 -3.230 232 HB VAL 30 HB VAL 30 -0.278 -15.393 -2.072 233 HG11 VAL 30 HG11 VAL 30 0.651 -15.361 -4.346 234 HG12 VAL 30 HG12 VAL 30 -0.754 -14.454 -4.903 235 HG13 VAL 30 HG13 VAL 30 -0.948 -16.103 -4.312 236 HG21 VAL 30 HG21 VAL 30 0.049 -13.035 -1.535 237 HG22 VAL 30 HG22 VAL 30 -0.167 -12.606 -3.231 238 HG23 VAL 30 HG23 VAL 30 1.226 -13.567 -2.736 239 H ALA 31 H ALA 31 -2.398 -16.273 -0.852 240 HA ALA 31 HA ALA 31 -3.288 -18.364 -2.490 241 HB1 ALA 31 HB1 ALA 31 -2.367 -18.670 -0.223 242 HB2 ALA 31 HB2 ALA 31 -3.910 -19.493 -0.439 243 HB3 ALA 31 HB3 ALA 31 -3.840 -17.973 0.449 244 H LYS 32 H LYS 32 -5.038 -15.904 -0.683 245 HA LYS 32 HA LYS 32 -7.648 -16.870 -1.092 246 HB2 LYS 32 HB2 LYS 32 -7.143 -15.228 0.602 247 HB3 LYS 32 HB1 LYS 32 -6.567 -14.093 -0.604 248 HG2 LYS 32 HG2 LYS 32 -8.905 -14.081 -1.541 249 HG3 LYS 32 HG1 LYS 32 -9.393 -14.976 -0.101 250 HD2 LYS 32 HD2 LYS 32 -7.891 -12.382 0.096 251 HD3 LYS 32 HD1 LYS 32 -9.643 -12.411 -0.081 252 HE2 LYS 32 HE2 LYS 32 -9.185 -12.228 2.247 253 HE3 LYS 32 HE1 LYS 32 -9.714 -13.883 1.965 254 HZ1 LYS 32 HZ1 LYS 32 -6.880 -13.028 2.222 255 HZ2 LYS 32 HZ2 LYS 32 -7.445 -14.623 2.103 256 HZ3 LYS 32 HZ3 LYS 32 -7.802 -13.697 3.463 257 H ARG 33 H ARG 33 -5.638 -14.564 -2.864 258 HA ARG 33 HA ARG 33 -7.562 -13.758 -4.755 259 HB2 ARG 33 HB2 ARG 33 -5.384 -12.603 -4.204 260 HB3 ARG 33 HB1 ARG 33 -4.576 -13.838 -5.167 261 HG2 ARG 33 HG2 ARG 33 -5.760 -13.125 -7.148 262 HG3 ARG 33 HG1 ARG 33 -6.683 -11.950 -6.209 263 HD2 ARG 33 HD2 ARG 33 -4.581 -10.799 -5.636 264 HD3 ARG 33 HD1 ARG 33 -3.696 -11.953 -6.631 265 HE ARG 33 HE ARG 33 -5.535 -10.935 -8.340 266 HH11 ARG 33 HH11 ARG 33 -3.183 -9.454 -6.224 267 HH12 ARG 33 HH12 ARG 33 -2.908 -8.086 -7.245 268 HH21 ARG 33 HH21 ARG 33 -5.207 -9.129 -9.701 269 HH22 ARG 33 HH22 ARG 33 -4.080 -7.899 -9.244 270 H GLN 34 H GLN 34 -5.276 -16.406 -4.700 271 HA GLN 34 HA GLN 34 -5.857 -17.135 -7.450 272 HB2 GLN 34 HB2 GLN 34 -3.998 -18.315 -5.392 273 HB3 GLN 34 HB1 GLN 34 -4.155 -18.906 -7.043 274 HG2 GLN 34 HG2 GLN 34 -3.441 -16.066 -6.401 275 HG3 GLN 34 HG1 GLN 34 -2.228 -17.326 -6.580 276 HE21 GLN 34 HE21 GLN 34 -2.679 -14.926 -8.163 277 HE22 GLN 34 HE22 GLN 34 -2.920 -15.462 -9.787 278 H GLY 35 H GLY 35 -6.810 -18.061 -4.264 279 HA2 GLY 35 HA2 GLY 35 -8.585 -19.427 -3.668 280 HA3 GLY 35 HA1 GLY 35 -8.765 -19.883 -5.356 281 H VAL 36 H VAL 36 -5.968 -20.117 -3.209 282 HA VAL 36 HA VAL 36 -6.070 -23.042 -3.508 283 HB VAL 36 HB VAL 36 -3.627 -23.125 -3.703 284 HG11 VAL 36 HG11 VAL 36 -4.900 -21.370 -5.800 285 HG12 VAL 36 HG12 VAL 36 -4.952 -23.132 -5.743 286 HG13 VAL 36 HG13 VAL 36 -3.416 -22.303 -6.002 287 HG21 VAL 36 HG21 VAL 36 -3.070 -21.045 -2.546 288 HG22 VAL 36 HG22 VAL 36 -3.762 -20.110 -3.871 289 HG23 VAL 36 HG23 VAL 36 -2.322 -21.090 -4.142 290 HA PRO 37 HA PRO 37 -5.494 -23.160 0.878 291 HB2 PRO 37 HB2 PRO 37 -4.035 -25.481 1.104 292 HB3 PRO 37 HB1 PRO 37 -5.784 -25.437 0.877 293 HG2 PRO 37 HG2 PRO 37 -3.624 -25.916 -1.125 294 HG3 PRO 37 HG1 PRO 37 -5.217 -26.680 -0.988 295 HD2 PRO 37 HD2 PRO 37 -4.672 -24.744 -2.800 296 HD3 PRO 37 HD1 PRO 37 -6.277 -24.944 -2.078 297 H ALA 38 H ALA 38 -4.153 -21.849 1.903 298 HA ALA 38 HA ALA 38 -1.525 -21.265 0.988 299 HB1 ALA 38 HB1 ALA 38 -2.854 -20.491 3.581 300 HB2 ALA 38 HB2 ALA 38 -2.947 -19.594 2.064 301 HB3 ALA 38 HB3 ALA 38 -1.401 -19.762 2.894 302 H ASP 39 H ASP 39 -2.803 -23.599 3.109 303 HA ASP 39 HA ASP 39 -0.618 -24.027 4.836 304 HB2 ASP 39 HB2 ASP 39 -2.734 -24.994 5.399 305 HB3 ASP 39 HB1 ASP 39 -2.819 -25.860 3.870 306 H GLN 40 H GLN 40 -1.182 -24.939 1.541 307 HA GLN 40 HA GLN 40 1.210 -26.655 1.575 308 HB2 GLN 40 HB2 GLN 40 -0.933 -26.495 -0.551 309 HB3 GLN 40 HB1 GLN 40 0.360 -27.680 -0.444 310 HG2 GLN 40 HG2 GLN 40 -0.613 -28.517 1.653 311 HG3 GLN 40 HG1 GLN 40 -1.935 -27.366 1.475 312 HE21 GLN 40 HE21 GLN 40 -2.010 -30.240 1.623 313 HE22 GLN 40 HE22 GLN 40 -2.773 -30.791 0.178 314 H LEU 41 H LEU 41 0.502 -23.578 1.099 315 HA LEU 41 HA LEU 41 1.667 -23.146 -1.506 316 HB2 LEU 41 HB2 LEU 41 -0.252 -21.832 -0.554 317 HB3 LEU 41 HB1 LEU 41 0.884 -21.103 0.563 318 HG LEU 41 HG LEU 41 2.123 -20.165 -1.361 319 HD11 LEU 41 HD11 LEU 41 -0.160 -21.317 -2.955 320 HD12 LEU 41 HD12 LEU 41 1.535 -21.798 -3.047 321 HD13 LEU 41 HD13 LEU 41 1.047 -20.187 -3.564 322 HD21 LEU 41 HD21 LEU 41 0.411 -18.852 -0.202 323 HD22 LEU 41 HD22 LEU 41 -0.813 -19.486 -1.304 324 HD23 LEU 41 HD23 LEU 41 0.478 -18.457 -1.920 325 H ARG 42 H ARG 42 3.691 -22.414 -1.944 326 HA ARG 42 HA ARG 42 5.479 -22.057 0.366 327 HB2 ARG 42 HB2 ARG 42 5.922 -24.110 -0.942 328 HB3 ARG 42 HB1 ARG 42 6.166 -23.125 -2.374 329 HG2 ARG 42 HG2 ARG 42 8.280 -23.842 -1.353 330 HG3 ARG 42 HG1 ARG 42 8.104 -22.084 -1.378 331 HD2 ARG 42 HD2 ARG 42 8.998 -22.994 0.767 332 HD3 ARG 42 HD1 ARG 42 7.529 -22.031 0.933 333 HE ARG 42 HE ARG 42 6.620 -24.595 0.714 334 HH11 ARG 42 HH11 ARG 42 8.884 -22.980 2.873 335 HH12 ARG 42 HH12 ARG 42 8.553 -24.051 4.195 336 HH21 ARG 42 HH21 ARG 42 6.179 -25.977 2.475 337 HH22 ARG 42 HH22 ARG 42 7.012 -25.751 3.977 338 H VAL 43 H VAL 43 6.473 -20.156 0.545 339 HA VAL 43 HA VAL 43 6.343 -18.350 -1.749 340 HB VAL 43 HB VAL 43 6.625 -16.487 -0.113 341 HG11 VAL 43 HG11 VAL 43 4.302 -18.331 0.434 342 HG12 VAL 43 HG12 VAL 43 4.396 -17.127 -0.849 343 HG13 VAL 43 HG13 VAL 43 4.366 -16.616 0.839 344 HG21 VAL 43 HG21 VAL 43 6.328 -18.669 1.959 345 HG22 VAL 43 HG22 VAL 43 6.321 -16.937 2.284 346 HG23 VAL 43 HG23 VAL 43 7.779 -17.710 1.663 347 H ILE 44 H ILE 44 8.137 -17.678 -2.725 348 HA ILE 44 HA ILE 44 10.714 -18.063 -1.347 349 HB ILE 44 HB ILE 44 10.127 -18.474 -4.295 350 HG12 ILE 44 HG12 ILE 44 9.338 -20.339 -2.886 351 HG13 ILE 44 HG11 ILE 44 10.684 -20.825 -3.909 352 HG21 ILE 44 HG21 ILE 44 12.327 -17.497 -3.979 353 HG22 ILE 44 HG22 ILE 44 12.470 -19.181 -4.488 354 HG23 ILE 44 HG23 ILE 44 12.732 -18.745 -2.798 355 HD11 ILE 44 HD11 ILE 44 10.904 -21.770 -1.692 356 HD12 ILE 44 HD12 ILE 44 10.822 -20.164 -0.972 357 HD13 ILE 44 HD13 ILE 44 12.196 -20.606 -1.986 358 H PHE 45 H PHE 45 11.960 -16.296 -1.248 359 HA PHE 45 HA PHE 45 11.548 -14.156 -3.200 360 HB2 PHE 45 HB2 PHE 45 10.241 -13.579 -1.179 361 HB3 PHE 45 HB1 PHE 45 11.703 -13.721 -0.209 362 HD1 PHE 45 HD1 PHE 45 10.202 -11.848 -3.023 363 HD2 PHE 45 HD2 PHE 45 13.134 -11.898 0.057 364 HE1 PHE 45 HE1 PHE 45 10.721 -9.495 -3.484 365 HE2 PHE 45 HE2 PHE 45 13.656 -9.540 -0.396 366 HZ PHE 45 HZ PHE 45 12.445 -8.338 -2.171 367 H ALA 46 H ALA 46 13.410 -13.612 -4.076 368 HA ALA 46 HA ALA 46 15.610 -13.269 -4.461 369 HB1 ALA 46 HB1 ALA 46 15.880 -13.119 -1.461 370 HB2 ALA 46 HB2 ALA 46 15.435 -11.775 -2.509 371 HB3 ALA 46 HB3 ALA 46 17.033 -12.509 -2.648 372 H GLY 47 H GLY 47 14.494 -16.012 -3.791 373 HA2 GLY 47 HA2 GLY 47 15.570 -18.054 -4.309 374 HA3 GLY 47 HA1 GLY 47 17.095 -17.353 -3.794 375 H LYS 48 H LYS 48 15.074 -16.453 -1.437 376 HA LYS 48 HA LYS 48 15.297 -18.972 0.041 377 HB2 LYS 48 HB2 LYS 48 15.944 -17.575 2.072 378 HB3 LYS 48 HB1 LYS 48 17.180 -17.805 0.852 379 HG2 LYS 48 HG2 LYS 48 17.372 -15.557 1.469 380 HG3 LYS 48 HG1 LYS 48 16.472 -15.511 -0.045 381 HD2 LYS 48 HD2 LYS 48 14.371 -15.339 1.255 382 HD3 LYS 48 HD1 LYS 48 15.324 -15.293 2.740 383 HE2 LYS 48 HE2 LYS 48 15.508 -13.300 0.481 384 HE3 LYS 48 HE1 LYS 48 14.631 -13.051 1.986 385 HZ1 LYS 48 HZ1 LYS 48 16.688 -13.198 3.196 386 HZ2 LYS 48 HZ2 LYS 48 16.829 -12.023 1.985 387 HZ3 LYS 48 HZ3 LYS 48 17.547 -13.536 1.778 388 H GLU 49 H GLU 49 14.151 -18.516 2.335 389 HA GLU 49 HA GLU 49 11.508 -17.471 1.615 390 HB2 GLU 49 HB2 GLU 49 12.307 -19.415 3.783 391 HB3 GLU 49 HB1 GLU 49 10.673 -18.828 3.512 392 HG2 GLU 49 HG2 GLU 49 10.721 -19.830 1.264 393 HG3 GLU 49 HG1 GLU 49 12.323 -20.478 1.613 394 H LEU 50 H LEU 50 10.290 -16.488 3.432 395 HA LEU 50 HA LEU 50 12.089 -14.802 5.043 396 HB2 LEU 50 HB2 LEU 50 9.289 -14.146 4.148 397 HB3 LEU 50 HB1 LEU 50 10.406 -13.083 4.974 398 HG LEU 50 HG LEU 50 10.733 -14.130 2.166 399 HD11 LEU 50 HD11 LEU 50 10.293 -11.837 1.487 400 HD12 LEU 50 HD12 LEU 50 9.990 -11.395 3.168 401 HD13 LEU 50 HD13 LEU 50 8.922 -12.534 2.348 402 HD21 LEU 50 HD21 LEU 50 12.576 -12.515 2.027 403 HD22 LEU 50 HD22 LEU 50 12.883 -13.760 3.237 404 HD23 LEU 50 HD23 LEU 50 12.374 -12.146 3.739 405 H ARG 51 H ARG 51 11.388 -14.262 7.135 406 HA ARG 51 HA ARG 51 10.061 -16.299 8.543 407 HB2 ARG 51 HB2 ARG 51 10.221 -14.860 10.489 408 HB3 ARG 51 HB1 ARG 51 11.717 -14.766 9.584 409 HG2 ARG 51 HG2 ARG 51 9.520 -12.717 9.443 410 HG3 ARG 51 HG1 ARG 51 10.925 -12.589 10.502 411 HD2 ARG 51 HD2 ARG 51 10.848 -12.583 7.485 412 HD3 ARG 51 HD1 ARG 51 11.312 -11.259 8.549 413 HE ARG 51 HE ARG 51 13.014 -13.427 9.041 414 HH11 ARG 51 HH11 ARG 51 12.334 -11.072 6.514 415 HH12 ARG 51 HH12 ARG 51 13.925 -11.152 5.843 416 HH21 ARG 51 HH21 ARG 51 15.115 -13.516 8.164 417 HH22 ARG 51 HH22 ARG 51 15.523 -12.544 6.794 418 H ASN 52 H ASN 52 7.955 -16.523 9.147 419 HA ASN 52 HA ASN 52 6.067 -15.166 7.507 420 HB2 ASN 52 HB2 ASN 52 4.376 -16.578 8.495 421 HB3 ASN 52 HB1 ASN 52 5.807 -17.542 8.160 422 HD21 ASN 52 HD21 ASN 52 3.719 -16.269 10.591 423 HD22 ASN 52 HD22 ASN 52 4.408 -17.123 11.924 424 H ASP 53 H ASP 53 7.081 -14.734 10.820 425 HA ASP 53 HA ASP 53 4.888 -12.838 11.182 426 HB2 ASP 53 HB2 ASP 53 5.038 -14.571 12.911 427 HB3 ASP 53 HB1 ASP 53 6.676 -14.058 13.291 428 H TRP 54 H TRP 54 6.103 -11.485 9.719 429 HA TRP 54 HA TRP 54 7.269 -9.385 11.230 430 HB2 TRP 54 HB2 TRP 54 9.278 -10.821 10.895 431 HB3 TRP 54 HB1 TRP 54 9.056 -10.677 9.155 432 HD1 TRP 54 HD1 TRP 54 10.864 -9.108 8.274 433 HE1 TRP 54 HE1 TRP 54 11.840 -6.842 8.964 434 HE3 TRP 54 HE3 TRP 54 8.309 -8.426 12.656 435 HZ2 TRP 54 HZ2 TRP 54 11.550 -4.992 11.086 436 HZ3 TRP 54 HZ3 TRP 54 8.720 -6.378 13.950 437 HH2 TRP 54 HH2 TRP 54 10.311 -4.700 13.181 438 H THR 55 H THR 55 7.653 -7.467 9.901 439 HA THR 55 HA THR 55 5.431 -7.069 8.198 440 HB THR 55 HB THR 55 6.161 -4.773 8.047 441 HG1 THR 55 HG1 THR 55 8.400 -4.769 9.489 442 HG21 THR 55 HG21 THR 55 6.360 -4.210 10.403 443 HG22 THR 55 HG22 THR 55 6.821 -5.864 10.782 444 HG23 THR 55 HG23 THR 55 5.191 -5.515 10.196 445 H VAL 56 H VAL 56 5.314 -6.669 6.042 446 HA VAL 56 HA VAL 56 7.380 -7.783 4.400 447 HB VAL 56 HB VAL 56 4.989 -8.154 3.897 448 HG11 VAL 56 HG11 VAL 56 3.602 -6.412 2.946 449 HG12 VAL 56 HG12 VAL 56 4.887 -5.228 3.202 450 HG13 VAL 56 HG13 VAL 56 4.105 -5.996 4.585 451 HG21 VAL 56 HG21 VAL 56 6.505 -6.679 1.748 452 HG22 VAL 56 HG22 VAL 56 5.072 -7.669 1.470 453 HG23 VAL 56 HG23 VAL 56 6.549 -8.410 2.087 454 H GLN 57 H GLN 57 6.544 -4.638 5.540 455 HA GLN 57 HA GLN 57 7.674 -3.147 3.393 456 HB2 GLN 57 HB2 GLN 57 7.411 -1.205 4.738 457 HB3 GLN 57 HB1 GLN 57 6.007 -2.224 5.010 458 HG2 GLN 57 HG2 GLN 57 6.878 -2.948 7.121 459 HG3 GLN 57 HG1 GLN 57 8.392 -2.096 6.827 460 HE21 GLN 57 HE21 GLN 57 6.485 -1.783 9.026 461 HE22 GLN 57 HE22 GLN 57 5.990 -0.129 8.996 462 H ASN 58 H ASN 58 8.970 -4.604 6.270 463 HA ASN 58 HA ASN 58 11.442 -3.120 6.092 464 HB2 ASN 58 HB2 ASN 58 10.294 -4.085 8.227 465 HB3 ASN 58 HB1 ASN 58 11.075 -5.588 7.758 466 HD21 ASN 58 HD21 ASN 58 13.448 -4.246 6.670 467 HD22 ASN 58 HD22 ASN 58 14.340 -3.692 8.042 468 H CYS 59 H CYS 59 10.228 -6.308 5.265 469 HA CYS 59 HA CYS 59 12.752 -7.370 4.477 470 HB2 CYS 59 HB2 CYS 59 9.972 -8.250 3.654 471 HB3 CYS 59 HB1 CYS 59 11.447 -9.195 3.499 472 HG CYS 59 HG CYS 59 9.650 -8.482 6.297 473 H ASP 60 H ASP 60 10.235 -5.541 2.950 474 HA ASP 60 HA ASP 60 9.995 -4.480 0.991 475 HB2 ASP 60 HB2 ASP 60 12.252 -3.560 1.533 476 HB3 ASP 60 HB1 ASP 60 12.963 -4.846 0.565 477 H LEU 61 H LEU 61 8.735 -5.961 0.037 478 HA LEU 61 HA LEU 61 10.050 -7.708 -1.920 479 HB2 LEU 61 HB2 LEU 61 7.324 -7.831 -0.611 480 HB3 LEU 61 HB1 LEU 61 7.701 -8.763 -2.042 481 HG LEU 61 HG LEU 61 9.465 -9.970 -0.784 482 HD11 LEU 61 HD11 LEU 61 9.561 -9.775 1.655 483 HD12 LEU 61 HD12 LEU 61 8.465 -8.396 1.577 484 HD13 LEU 61 HD13 LEU 61 10.062 -8.294 0.844 485 HD21 LEU 61 HD21 LEU 61 6.742 -10.012 0.506 486 HD22 LEU 61 HD22 LEU 61 7.968 -11.270 0.656 487 HD23 LEU 61 HD23 LEU 61 7.245 -10.930 -0.912 488 H ASP 62 H ASP 62 9.435 -4.832 -1.849 489 HA ASP 62 HA ASP 62 7.534 -4.501 -4.038 490 HB2 ASP 62 HB2 ASP 62 6.986 -3.028 -2.312 491 HB3 ASP 62 HB1 ASP 62 8.668 -2.691 -1.932 492 H GLN 63 H GLN 63 10.861 -3.631 -3.094 493 HA GLN 63 HA GLN 63 11.313 -2.880 -5.906 494 HB2 GLN 63 HB2 GLN 63 11.314 -0.953 -4.362 495 HB3 GLN 63 HB1 GLN 63 12.645 -1.687 -3.483 496 HG2 GLN 63 HG2 GLN 63 14.098 -1.466 -5.370 497 HG3 GLN 63 HG1 GLN 63 12.764 -0.927 -6.390 498 HE21 GLN 63 HE21 GLN 63 14.962 -0.059 -3.852 499 HE22 GLN 63 HE22 GLN 63 14.658 1.644 -3.905 500 H GLN 64 H GLN 64 12.628 -4.498 -3.092 501 HA GLN 64 HA GLN 64 15.195 -5.012 -4.052 502 HB2 GLN 64 HB2 GLN 64 13.435 -6.652 -2.244 503 HB3 GLN 64 HB1 GLN 64 15.130 -7.019 -2.541 504 HG2 GLN 64 HG2 GLN 64 14.081 -4.449 -1.401 505 HG3 GLN 64 HG1 GLN 64 14.765 -5.776 -0.457 506 HE21 GLN 64 HE21 GLN 64 16.971 -6.178 -0.587 507 HE22 GLN 64 HE22 GLN 64 18.084 -5.008 -1.199 508 H SEP 65 H SEP 65 12.382 -7.181 -4.231 509 HA SEP 65 HA SEP 65 13.103 -8.001 -6.884 510 HB2 SEP 65 HB1 SEP 65 12.944 -10.503 -5.922 511 HB3 SEP 65 HB2 SEP 65 13.690 -9.715 -4.533 512 H ILE 66 H ILE 66 11.581 -9.778 -7.613 513 HA ILE 66 HA ILE 66 8.921 -9.104 -6.657 514 HB ILE 66 HB ILE 66 9.407 -9.079 -9.124 515 HG12 ILE 66 HG12 ILE 66 7.384 -11.198 -8.418 516 HG13 ILE 66 HG11 ILE 66 7.116 -9.476 -8.170 517 HG21 ILE 66 HG21 ILE 66 9.601 -11.165 -10.338 518 HG22 ILE 66 HG22 ILE 66 9.622 -12.058 -8.820 519 HG23 ILE 66 HG23 ILE 66 10.950 -10.958 -9.214 520 HD11 ILE 66 HD11 ILE 66 6.087 -10.302 -10.231 521 HD12 ILE 66 HD12 ILE 66 7.681 -10.777 -10.821 522 HD13 ILE 66 HD13 ILE 66 7.315 -9.076 -10.543 523 H VAL 67 H VAL 67 7.487 -10.672 -5.881 524 HA VAL 67 HA VAL 67 8.821 -12.764 -4.406 525 HB VAL 67 HB VAL 67 5.848 -12.320 -4.529 526 HG11 VAL 67 HG11 VAL 67 5.903 -13.163 -2.235 527 HG12 VAL 67 HG12 VAL 67 7.653 -13.347 -2.346 528 HG13 VAL 67 HG13 VAL 67 6.598 -14.321 -3.370 529 HG21 VAL 67 HG21 VAL 67 7.844 -10.805 -2.859 530 HG22 VAL 67 HG22 VAL 67 6.091 -10.752 -2.646 531 HG23 VAL 67 HG23 VAL 67 6.819 -10.148 -4.133 532 H HIS 68 H HIS 68 8.863 -14.885 -4.891 533 HA HIS 68 HA HIS 68 7.246 -15.779 -7.179 534 HB2 HIS 68 HB2 HIS 68 9.910 -16.714 -6.118 535 HB3 HIS 68 HB1 HIS 68 8.947 -17.711 -7.199 536 HD2 HIS 68 HD2 HIS 68 9.938 -13.884 -7.503 537 HE1 HIS 68 HE1 HIS 68 10.929 -15.959 -11.049 538 HE2 HIS 68 HE2 HIS 68 11.171 -13.787 -9.778 539 H ILE 69 H ILE 69 5.524 -16.908 -6.620 540 HA ILE 69 HA ILE 69 5.710 -18.520 -4.171 541 HB ILE 69 HB ILE 69 3.290 -17.063 -5.243 542 HG12 ILE 69 HG12 ILE 69 4.969 -16.678 -2.756 543 HG13 ILE 69 HG11 ILE 69 4.844 -15.576 -4.121 544 HG21 ILE 69 HG21 ILE 69 2.126 -17.903 -3.269 545 HG22 ILE 69 HG22 ILE 69 3.554 -18.840 -2.825 546 HG23 ILE 69 HG23 ILE 69 2.675 -19.222 -4.305 547 HD11 ILE 69 HD11 ILE 69 3.553 -14.796 -2.212 548 HD12 ILE 69 HD12 ILE 69 2.612 -16.289 -2.236 549 HD13 ILE 69 HD13 ILE 69 2.513 -15.163 -3.587 550 H VAL 70 H VAL 70 5.606 -20.590 -4.508 551 HA VAL 70 HA VAL 70 4.200 -21.556 -6.892 552 HB VAL 70 HB VAL 70 5.616 -23.595 -6.752 553 HG11 VAL 70 HG11 VAL 70 7.682 -22.555 -7.584 554 HG12 VAL 70 HG12 VAL 70 7.129 -20.996 -6.973 555 HG13 VAL 70 HG13 VAL 70 6.238 -21.805 -8.263 556 HG21 VAL 70 HG21 VAL 70 6.176 -23.546 -4.390 557 HG22 VAL 70 HG22 VAL 70 7.085 -22.052 -4.610 558 HG23 VAL 70 HG23 VAL 70 7.650 -23.546 -5.357 559 H GLN 71 H GLN 71 2.743 -23.195 -6.697 560 HA GLN 71 HA GLN 71 1.874 -23.739 -3.960 561 HB2 GLN 71 HB2 GLN 71 0.175 -22.673 -5.305 562 HB3 GLN 71 HB1 GLN 71 0.386 -23.852 -6.588 563 HG2 GLN 71 HG2 GLN 71 -1.654 -24.291 -5.350 564 HG3 GLN 71 HG1 GLN 71 -0.506 -25.606 -5.130 565 HE21 GLN 71 HE21 GLN 71 -2.769 -24.793 -3.482 566 HE22 GLN 71 HE22 GLN 71 -2.124 -24.477 -1.906 567 H ARG 72 H ARG 72 1.850 -25.732 -3.163 568 HA ARG 72 HA ARG 72 2.537 -27.948 -4.978 569 HB2 ARG 72 HB2 ARG 72 2.862 -27.814 -1.967 570 HB3 ARG 72 HB1 ARG 72 3.382 -29.130 -3.009 571 HG2 ARG 72 HG2 ARG 72 4.483 -26.326 -2.990 572 HG3 ARG 72 HG1 ARG 72 5.270 -27.771 -2.354 573 HD2 ARG 72 HD2 ARG 72 5.335 -28.733 -4.591 574 HD3 ARG 72 HD1 ARG 72 4.502 -27.319 -5.236 575 HE ARG 72 HE ARG 72 6.917 -26.654 -3.856 576 HH11 ARG 72 HH11 ARG 72 5.607 -27.758 -6.903 577 HH12 ARG 72 HH12 ARG 72 6.935 -27.175 -7.846 578 HH21 ARG 72 HH21 ARG 72 8.690 -25.857 -5.103 579 HH22 ARG 72 HH22 ARG 72 8.686 -26.069 -6.818 580 HA PRO 73 HA PRO 73 -1.831 -28.439 -3.781 581 HB2 PRO 73 HB2 PRO 73 -2.278 -29.625 -6.375 582 HB3 PRO 73 HB1 PRO 73 -2.883 -28.094 -5.741 583 HG2 PRO 73 HG2 PRO 73 -1.039 -28.293 -7.758 584 HG3 PRO 73 HG1 PRO 73 -1.187 -26.891 -6.683 585 HD2 PRO 73 HD2 PRO 73 0.750 -29.161 -6.591 586 HD3 PRO 73 HD1 PRO 73 1.014 -27.432 -6.269 587 H TRP 74 H TRP 74 -1.551 -30.064 -2.309 588 HA TRP 74 HA TRP 74 -1.326 -32.783 -3.342 589 HB2 TRP 74 HB2 TRP 74 -0.107 -32.066 -1.235 590 HB3 TRP 74 HB1 TRP 74 -1.676 -31.906 -0.459 591 HD1 TRP 74 HD1 TRP 74 0.520 -34.621 -2.105 592 HE1 TRP 74 HE1 TRP 74 -0.051 -36.877 -1.025 593 HE3 TRP 74 HE3 TRP 74 -3.317 -33.127 0.919 594 HZ2 TRP 74 HZ2 TRP 74 -1.880 -37.900 0.859 595 HZ3 TRP 74 HZ3 TRP 74 -4.419 -34.811 2.332 596 HH2 TRP 74 HH2 TRP 74 -3.718 -37.145 2.302 597 H ARG 75 H ARG 75 -3.554 -30.435 -2.300 598 HA ARG 75 HA ARG 75 -5.758 -32.063 -3.166 599 HB2 ARG 75 HB2 ARG 75 -7.137 -31.554 -1.132 600 HB3 ARG 75 HB1 ARG 75 -5.814 -32.670 -0.837 601 HG2 ARG 75 HG2 ARG 75 -4.536 -30.990 0.264 602 HG3 ARG 75 HG1 ARG 75 -5.665 -29.728 -0.231 603 HD2 ARG 75 HD2 ARG 75 -6.014 -30.305 2.094 604 HD3 ARG 75 HD1 ARG 75 -7.413 -30.777 1.135 605 HE ARG 75 HE ARG 75 -6.168 -33.076 1.173 606 HH11 ARG 75 HH11 ARG 75 -6.506 -30.763 3.790 607 HH12 ARG 75 HH12 ARG 75 -6.397 -31.947 5.042 608 HH21 ARG 75 HH21 ARG 75 -6.058 -34.675 2.821 609 HH22 ARG 75 HH22 ARG 75 -6.130 -34.202 4.479 610 H LYS 76 H LYS 76 -5.911 -30.594 -4.847 611 HA LYS 76 HA LYS 76 -7.192 -28.076 -4.165 612 HB2 LYS 76 HB2 LYS 76 -4.694 -27.657 -4.397 613 HB3 LYS 76 HB1 LYS 76 -4.858 -28.121 -6.083 614 HG2 LYS 76 HG2 LYS 76 -6.847 -26.226 -5.716 615 HG3 LYS 76 HG1 LYS 76 -5.483 -25.608 -4.786 616 HD2 LYS 76 HD2 LYS 76 -5.332 -24.744 -7.022 617 HD3 LYS 76 HD1 LYS 76 -4.050 -25.934 -6.803 618 HE2 LYS 76 HE2 LYS 76 -5.162 -26.171 -8.980 619 HE3 LYS 76 HE1 LYS 76 -5.367 -27.604 -7.975 620 HZ1 LYS 76 HZ1 LYS 76 -7.600 -26.890 -7.427 621 HZ2 LYS 76 HZ2 LYS 76 -7.416 -26.952 -9.106 622 HZ3 LYS 76 HZ3 LYS 76 -7.401 -25.460 -8.318 Start of MODEL 21 1 H1 MET 1 HT1 MET 1 0.437 -1.154 1.219 2 H2 MET 1 HT2 MET 1 0.443 0.222 0.247 3 H3 MET 1 HT3 MET 1 1.204 0.257 1.757 4 HA MET 1 HA MET 1 2.788 0.084 -0.075 5 HB2 MET 1 HB2 MET 1 3.319 -0.904 2.135 6 HB3 MET 1 HB1 MET 1 2.595 -2.419 1.617 7 HG2 MET 1 HG2 MET 1 4.291 -2.492 -0.225 8 HG3 MET 1 HG1 MET 1 5.074 -1.110 0.538 9 HE1 MET 1 HE1 MET 1 7.373 -2.391 0.755 10 HE2 MET 1 HE2 MET 1 6.634 -3.743 -0.099 11 HE3 MET 1 HE3 MET 1 7.512 -4.023 1.404 12 H ILE 2 H ILE 2 3.475 -0.987 -1.945 13 HA ILE 2 HA ILE 2 1.681 -3.122 -2.881 14 HB ILE 2 HB ILE 2 2.854 -0.927 -4.602 15 HG12 ILE 2 HG12 ILE 2 0.061 -1.356 -3.540 16 HG13 ILE 2 HG11 ILE 2 1.136 -0.023 -3.159 17 HG21 ILE 2 HG21 ILE 2 2.578 -3.034 -5.803 18 HG22 ILE 2 HG22 ILE 2 1.395 -1.846 -6.356 19 HG23 ILE 2 HG23 ILE 2 0.903 -3.136 -5.259 20 HD11 ILE 2 HD11 ILE 2 -0.080 -0.582 -5.849 21 HD12 ILE 2 HD12 ILE 2 0.985 0.768 -5.454 22 HD13 ILE 2 HD13 ILE 2 -0.608 0.648 -4.701 23 H VAL 3 H VAL 3 2.640 -4.897 -3.634 24 HA VAL 3 HA VAL 3 5.485 -4.770 -4.357 25 HB VAL 3 HB VAL 3 5.893 -6.940 -3.256 26 HG11 VAL 3 HG11 VAL 3 4.813 -4.825 -1.401 27 HG12 VAL 3 HG12 VAL 3 6.457 -4.933 -2.035 28 HG13 VAL 3 HG13 VAL 3 5.858 -6.164 -0.922 29 HG21 VAL 3 HG21 VAL 3 4.274 -7.864 -1.668 30 HG22 VAL 3 HG22 VAL 3 3.622 -7.834 -3.307 31 HG23 VAL 3 HG23 VAL 3 3.109 -6.622 -2.131 32 H PHE 4 H PHE 4 6.178 -6.536 -5.734 33 HA PHE 4 HA PHE 4 4.001 -7.419 -7.468 34 HB2 PHE 4 HB2 PHE 4 6.959 -7.090 -7.874 35 HB3 PHE 4 HB1 PHE 4 6.006 -8.077 -8.974 36 HD1 PHE 4 HD1 PHE 4 6.243 -4.671 -7.522 37 HD2 PHE 4 HD2 PHE 4 4.814 -7.105 -10.702 38 HE1 PHE 4 HE1 PHE 4 5.570 -2.657 -8.753 39 HE2 PHE 4 HE2 PHE 4 4.135 -5.092 -11.943 40 HZ PHE 4 HZ PHE 4 4.510 -2.864 -10.968 41 H VAL 5 H VAL 5 3.584 -9.541 -7.893 42 HA VAL 5 HA VAL 5 5.194 -11.493 -6.423 43 HB VAL 5 HB VAL 5 3.255 -10.834 -5.037 44 HG11 VAL 5 HG11 VAL 5 1.686 -10.253 -6.758 45 HG12 VAL 5 HG12 VAL 5 0.996 -11.475 -5.691 46 HG13 VAL 5 HG13 VAL 5 1.600 -11.932 -7.286 47 HG21 VAL 5 HG21 VAL 5 2.417 -13.056 -4.552 48 HG22 VAL 5 HG22 VAL 5 4.165 -13.067 -4.796 49 HG23 VAL 5 HG23 VAL 5 3.090 -13.656 -6.068 50 H ARG 6 H ARG 6 5.541 -13.347 -7.427 51 HA ARG 6 HA ARG 6 4.242 -13.849 -10.019 52 HB2 ARG 6 HB2 ARG 6 6.864 -14.785 -8.854 53 HB3 ARG 6 HB1 ARG 6 6.187 -15.426 -10.338 54 HG2 ARG 6 HG2 ARG 6 6.840 -12.536 -9.904 55 HG3 ARG 6 HG1 ARG 6 7.947 -13.702 -10.636 56 HD2 ARG 6 HD2 ARG 6 5.242 -12.858 -11.658 57 HD3 ARG 6 HD1 ARG 6 6.808 -12.487 -12.368 58 HE ARG 6 HE ARG 6 6.175 -15.309 -12.141 59 HH11 ARG 6 HH11 ARG 6 6.171 -12.458 -14.168 60 HH12 ARG 6 HH12 ARG 6 6.018 -13.339 -15.644 61 HH21 ARG 6 HH21 ARG 6 5.945 -16.489 -14.093 62 HH22 ARG 6 HH22 ARG 6 5.886 -15.644 -15.596 63 H PHE 7 H PHE 7 2.463 -15.067 -9.495 64 HA PHE 7 HA PHE 7 2.807 -17.291 -7.664 65 HB2 PHE 7 HB2 PHE 7 0.680 -15.939 -7.690 66 HB3 PHE 7 HB1 PHE 7 0.350 -16.582 -9.295 67 HD1 PHE 7 HD1 PHE 7 0.765 -17.485 -5.745 68 HD2 PHE 7 HD2 PHE 7 -0.564 -18.752 -9.581 69 HE1 PHE 7 HE1 PHE 7 -0.291 -19.452 -4.721 70 HE2 PHE 7 HE2 PHE 7 -1.627 -20.726 -8.564 71 HZ PHE 7 HZ PHE 7 -1.487 -21.080 -6.129 72 H ASN 8 H ASN 8 2.644 -19.451 -8.276 73 HA ASN 8 HA ASN 8 3.929 -20.244 -10.586 74 HB2 ASN 8 HB2 ASN 8 3.579 -21.687 -8.600 75 HB3 ASN 8 HB1 ASN 8 1.889 -21.869 -9.051 76 HD21 ASN 8 HD21 ASN 8 4.655 -21.823 -11.243 77 HD22 ASN 8 HD22 ASN 8 4.470 -23.448 -11.795 78 H SER 9 H SER 9 3.394 -20.319 -12.643 79 HA SER 9 HA SER 9 2.247 -20.501 -14.580 80 HB2 SER 9 HB2 SER 9 -0.123 -21.374 -12.908 81 HB3 SER 9 HB1 SER 9 0.089 -21.619 -14.642 82 HG SER 9 HG SER 9 1.992 -22.867 -14.084 83 H SER 10 H SER 10 2.069 -18.123 -12.644 84 HA SER 10 HA SER 10 0.003 -16.711 -14.170 85 HB2 SER 10 HB2 SER 10 -0.643 -17.189 -11.749 86 HB3 SER 10 HB1 SER 10 0.681 -16.125 -11.281 87 HG SER 10 HG SER 10 -1.749 -15.414 -11.833 88 H HIS 11 H HIS 11 0.458 -14.192 -13.631 89 HA HIS 11 HA HIS 11 3.254 -13.801 -14.433 90 HB2 HIS 11 HB2 HIS 11 1.358 -13.073 -15.971 91 HB3 HIS 11 HB1 HIS 11 0.963 -11.850 -14.771 92 HD2 HIS 11 HD2 HIS 11 2.227 -9.512 -15.144 93 HE1 HIS 11 HE1 HIS 11 5.313 -10.959 -17.648 94 HE2 HIS 11 HE2 HIS 11 4.172 -8.895 -16.753 95 H GLY 12 H GLY 12 4.048 -11.483 -13.767 96 HA2 GLY 12 HA2 GLY 12 3.864 -11.404 -10.876 97 HA3 GLY 12 HA1 GLY 12 4.979 -10.487 -11.877 98 H PHE 13 H PHE 13 1.715 -10.674 -10.677 99 HA PHE 13 HA PHE 13 1.182 -7.968 -11.584 100 HB2 PHE 13 HB2 PHE 13 -1.111 -8.394 -10.576 101 HB3 PHE 13 HB1 PHE 13 -0.671 -9.412 -11.937 102 HD1 PHE 13 HD1 PHE 13 -1.175 -9.319 -8.291 103 HD2 PHE 13 HD2 PHE 13 -0.435 -11.776 -11.685 104 HE1 PHE 13 HE1 PHE 13 -1.713 -11.317 -6.961 105 HE2 PHE 13 HE2 PHE 13 -0.966 -13.776 -10.360 106 HZ PHE 13 HZ PHE 13 -1.609 -13.549 -7.994 107 HA PRO 14 HA PRO 14 2.152 -6.230 -7.653 108 HB2 PRO 14 HB2 PRO 14 0.924 -3.845 -7.866 109 HB3 PRO 14 HB1 PRO 14 2.351 -4.249 -8.827 110 HG2 PRO 14 HG2 PRO 14 -0.523 -4.223 -9.626 111 HG3 PRO 14 HG1 PRO 14 0.904 -3.725 -10.552 112 HD2 PRO 14 HD2 PRO 14 -0.392 -6.150 -10.839 113 HD3 PRO 14 HD1 PRO 14 1.293 -5.848 -11.297 114 H VAL 15 H VAL 15 1.319 -6.700 -5.742 115 HA VAL 15 HA VAL 15 -1.599 -6.667 -5.417 116 HB VAL 15 HB VAL 15 0.513 -8.271 -3.929 117 HG11 VAL 15 HG11 VAL 15 -2.458 -8.119 -3.379 118 HG12 VAL 15 HG12 VAL 15 -1.191 -7.464 -2.344 119 HG13 VAL 15 HG13 VAL 15 -1.311 -9.207 -2.594 120 HG21 VAL 15 HG21 VAL 15 -1.846 -9.092 -5.614 121 HG22 VAL 15 HG22 VAL 15 -0.733 -10.182 -4.788 122 HG23 VAL 15 HG23 VAL 15 -0.152 -9.154 -6.098 123 H GLU 16 H GLU 16 -2.503 -5.274 -4.058 124 HA GLU 16 HA GLU 16 -0.808 -3.410 -2.659 125 HB2 GLU 16 HB2 GLU 16 -3.781 -3.537 -3.141 126 HB3 GLU 16 HB1 GLU 16 -3.022 -2.309 -2.139 127 HG2 GLU 16 HG2 GLU 16 -1.743 -1.513 -3.982 128 HG3 GLU 16 HG1 GLU 16 -2.341 -2.804 -5.017 129 H VAL 17 H VAL 17 -0.267 -3.594 -0.665 130 HA VAL 17 HA VAL 17 -1.944 -5.157 1.186 131 HB VAL 17 HB VAL 17 0.105 -6.020 2.288 132 HG11 VAL 17 HG11 VAL 17 -1.071 -7.410 0.664 133 HG12 VAL 17 HG12 VAL 17 0.666 -7.705 0.619 134 HG13 VAL 17 HG13 VAL 17 -0.092 -6.729 -0.637 135 HG21 VAL 17 HG21 VAL 17 1.532 -4.806 -0.080 136 HG22 VAL 17 HG22 VAL 17 2.258 -5.911 1.086 137 HG23 VAL 17 HG23 VAL 17 1.696 -4.324 1.608 138 H ASP 18 H ASP 18 -0.845 -4.781 3.531 139 HA ASP 18 HA ASP 18 -1.074 -1.900 3.893 140 HB2 ASP 18 HB2 ASP 18 -1.075 -4.147 5.921 141 HB3 ASP 18 HB1 ASP 18 -1.288 -2.444 6.306 142 H SER 19 H SER 19 0.294 -1.011 5.730 143 HA SER 19 HA SER 19 3.052 -1.449 5.073 144 HB2 SER 19 HB2 SER 19 3.282 0.366 6.920 145 HB3 SER 19 HB1 SER 19 2.527 0.801 5.385 146 HG SER 19 HG SER 19 1.431 0.660 7.908 147 H ASP 20 H ASP 20 0.992 -3.066 7.000 148 HA ASP 20 HA ASP 20 3.148 -3.932 8.797 149 HB2 ASP 20 HB2 ASP 20 0.271 -3.380 9.553 150 HB3 ASP 20 HB1 ASP 20 1.370 -4.313 10.559 151 H THR 21 H THR 21 1.957 -4.931 6.244 152 HA THR 21 HA THR 21 0.492 -7.290 6.937 153 HB THR 21 HB THR 21 1.804 -6.446 4.337 154 HG1 THR 21 HG1 THR 21 -0.837 -6.314 5.368 155 HG21 THR 21 HG21 THR 21 1.580 -8.889 4.421 156 HG22 THR 21 HG22 THR 21 0.433 -8.192 3.278 157 HG23 THR 21 HG23 THR 21 -0.120 -8.723 4.867 158 H SER 22 H SER 22 1.396 -9.001 7.838 159 HA SER 22 HA SER 22 4.221 -9.444 7.728 160 HB2 SER 22 HB2 SER 22 2.031 -11.250 8.778 161 HB3 SER 22 HB1 SER 22 3.756 -11.397 9.113 162 HG SER 22 HG SER 22 3.405 -9.056 9.863 163 H ILE 23 H ILE 23 5.215 -11.367 6.887 164 HA ILE 23 HA ILE 23 4.632 -11.903 4.229 165 HB ILE 23 HB ILE 23 6.167 -13.642 6.168 166 HG12 ILE 23 HG12 ILE 23 7.114 -11.433 6.119 167 HG13 ILE 23 HG11 ILE 23 8.160 -12.493 5.183 168 HG21 ILE 23 HG21 ILE 23 6.175 -13.628 3.153 169 HG22 ILE 23 HG22 ILE 23 5.623 -14.929 4.214 170 HG23 ILE 23 HG23 ILE 23 7.331 -14.497 4.160 171 HD11 ILE 23 HD11 ILE 23 6.164 -10.520 4.090 172 HD12 ILE 23 HD12 ILE 23 7.130 -11.628 3.117 173 HD13 ILE 23 HD13 ILE 23 7.922 -10.374 4.069 174 H PHE 24 H PHE 24 3.656 -13.674 7.119 175 HA PHE 24 HA PHE 24 2.506 -15.880 5.792 176 HB2 PHE 24 HB2 PHE 24 3.057 -15.816 8.210 177 HB3 PHE 24 HB1 PHE 24 1.707 -14.720 8.466 178 HD1 PHE 24 HD1 PHE 24 2.513 -18.091 7.124 179 HD2 PHE 24 HD2 PHE 24 -0.388 -15.575 8.947 180 HE1 PHE 24 HE1 PHE 24 1.011 -20.018 7.379 181 HE2 PHE 24 HE2 PHE 24 -1.900 -17.499 9.208 182 HZ PHE 24 HZ PHE 24 -1.201 -19.724 8.422 183 H GLN 25 H GLN 25 1.261 -12.709 6.650 184 HA GLN 25 HA GLN 25 -1.455 -13.270 6.032 185 HB2 GLN 25 HB2 GLN 25 0.004 -10.627 6.098 186 HB3 GLN 25 HB1 GLN 25 -1.741 -10.818 6.010 187 HG2 GLN 25 HG2 GLN 25 -1.684 -11.979 8.181 188 HG3 GLN 25 HG1 GLN 25 0.048 -11.658 8.272 189 HE21 GLN 25 HE21 GLN 25 -3.123 -10.327 8.460 190 HE22 GLN 25 HE22 GLN 25 -2.662 -8.779 9.076 191 H LEU 26 H LEU 26 1.207 -11.772 4.244 192 HA LEU 26 HA LEU 26 -0.161 -11.228 1.862 193 HB2 LEU 26 HB2 LEU 26 2.044 -10.330 2.285 194 HB3 LEU 26 HB1 LEU 26 2.731 -11.937 2.373 195 HG LEU 26 HG LEU 26 2.338 -12.250 -0.029 196 HD11 LEU 26 HD11 LEU 26 1.346 -9.407 0.014 197 HD12 LEU 26 HD12 LEU 26 0.357 -10.839 -0.268 198 HD13 LEU 26 HD13 LEU 26 1.612 -10.391 -1.423 199 HD21 LEU 26 HD21 LEU 26 3.792 -9.705 0.663 200 HD22 LEU 26 HD22 LEU 26 3.990 -10.624 -0.831 201 HD23 LEU 26 HD23 LEU 26 4.463 -11.336 0.713 202 H LYS 27 H LYS 27 1.460 -14.105 3.034 203 HA LYS 27 HA LYS 27 1.250 -15.761 0.804 204 HB2 LYS 27 HB2 LYS 27 2.528 -16.270 2.875 205 HB3 LYS 27 HB1 LYS 27 1.000 -16.499 3.719 206 HG2 LYS 27 HG2 LYS 27 0.474 -18.395 2.310 207 HG3 LYS 27 HG1 LYS 27 1.961 -18.147 1.393 208 HD2 LYS 27 HD2 LYS 27 3.271 -18.545 3.433 209 HD3 LYS 27 HD1 LYS 27 1.773 -18.830 4.328 210 HE2 LYS 27 HE2 LYS 27 1.258 -20.701 2.837 211 HE3 LYS 27 HE1 LYS 27 2.765 -20.418 1.971 212 HZ1 LYS 27 HZ1 LYS 27 3.951 -20.875 4.065 213 HZ2 LYS 27 HZ2 LYS 27 3.056 -22.191 3.511 214 HZ3 LYS 27 HZ3 LYS 27 2.476 -21.270 4.803 215 H GLU 28 H GLU 28 -0.966 -15.306 3.539 216 HA GLU 28 HA GLU 28 -2.992 -17.050 2.749 217 HB2 GLU 28 HB2 GLU 28 -3.019 -14.530 4.362 218 HB3 GLU 28 HB1 GLU 28 -4.456 -15.517 4.142 219 HG2 GLU 28 HG2 GLU 28 -3.244 -17.397 5.193 220 HG3 GLU 28 HG1 GLU 28 -1.883 -16.312 5.482 221 H VAL 29 H VAL 29 -2.584 -13.578 2.120 222 HA VAL 29 HA VAL 29 -4.987 -13.075 0.817 223 HB VAL 29 HB VAL 29 -2.289 -11.795 0.292 224 HG11 VAL 29 HG11 VAL 29 -5.056 -10.822 -0.421 225 HG12 VAL 29 HG12 VAL 29 -3.823 -11.372 -1.555 226 HG13 VAL 29 HG13 VAL 29 -3.562 -9.904 -0.613 227 HG21 VAL 29 HG21 VAL 29 -3.021 -11.596 2.612 228 HG22 VAL 29 HG22 VAL 29 -4.569 -10.945 2.075 229 HG23 VAL 29 HG23 VAL 29 -3.086 -10.034 1.794 230 H VAL 30 H VAL 30 -1.867 -13.980 -0.640 231 HA VAL 30 HA VAL 30 -2.916 -14.116 -3.272 232 HB VAL 30 HB VAL 30 -0.416 -15.427 -2.173 233 HG11 VAL 30 HG11 VAL 30 -1.205 -14.783 -5.016 234 HG12 VAL 30 HG12 VAL 30 -1.106 -16.396 -4.305 235 HG13 VAL 30 HG13 VAL 30 0.354 -15.425 -4.502 236 HG21 VAL 30 HG21 VAL 30 0.750 -13.456 -3.067 237 HG22 VAL 30 HG22 VAL 30 -0.409 -13.018 -1.814 238 HG23 VAL 30 HG23 VAL 30 -0.802 -12.749 -3.512 239 H ALA 31 H ALA 31 -2.516 -16.472 -0.692 240 HA ALA 31 HA ALA 31 -3.042 -18.807 -2.151 241 HB1 ALA 31 HB1 ALA 31 -3.735 -18.266 0.731 242 HB2 ALA 31 HB2 ALA 31 -2.152 -18.773 0.150 243 HB3 ALA 31 HB3 ALA 31 -3.541 -19.847 -0.026 244 H LYS 32 H LYS 32 -5.271 -16.785 -0.238 245 HA LYS 32 HA LYS 32 -7.571 -18.277 -0.998 246 HB2 LYS 32 HB2 LYS 32 -8.871 -16.492 0.028 247 HB3 LYS 32 HB1 LYS 32 -7.510 -16.924 1.054 248 HG2 LYS 32 HG2 LYS 32 -6.301 -14.960 0.348 249 HG3 LYS 32 HG1 LYS 32 -7.570 -14.555 -0.804 250 HD2 LYS 32 HD2 LYS 32 -7.815 -13.184 1.149 251 HD3 LYS 32 HD1 LYS 32 -9.150 -14.332 1.085 252 HE2 LYS 32 HE2 LYS 32 -8.022 -15.746 2.727 253 HE3 LYS 32 HE1 LYS 32 -6.660 -14.629 2.765 254 HZ1 LYS 32 HZ1 LYS 32 -8.122 -14.253 4.633 255 HZ2 LYS 32 HZ2 LYS 32 -9.443 -14.018 3.607 256 HZ3 LYS 32 HZ3 LYS 32 -8.171 -12.914 3.603 257 H ARG 33 H ARG 33 -5.875 -15.578 -2.377 258 HA ARG 33 HA ARG 33 -7.872 -14.622 -4.114 259 HB2 ARG 33 HB2 ARG 33 -5.782 -13.400 -3.590 260 HB3 ARG 33 HB1 ARG 33 -4.872 -14.609 -4.488 261 HG2 ARG 33 HG2 ARG 33 -5.954 -13.957 -6.542 262 HG3 ARG 33 HG1 ARG 33 -6.971 -12.807 -5.669 263 HD2 ARG 33 HD2 ARG 33 -5.020 -11.532 -5.022 264 HD3 ARG 33 HD1 ARG 33 -3.963 -12.707 -5.802 265 HE ARG 33 HE ARG 33 -5.324 -12.020 -7.893 266 HH11 ARG 33 HH11 ARG 33 -4.388 -9.861 -5.289 267 HH12 ARG 33 HH12 ARG 33 -4.264 -8.479 -6.318 268 HH21 ARG 33 HH21 ARG 33 -5.171 -10.181 -9.246 269 HH22 ARG 33 HH22 ARG 33 -4.705 -8.656 -8.565 270 H GLN 34 H GLN 34 -5.447 -17.133 -4.426 271 HA GLN 34 HA GLN 34 -6.267 -17.738 -7.153 272 HB2 GLN 34 HB2 GLN 34 -4.085 -18.849 -5.392 273 HB3 GLN 34 HB1 GLN 34 -4.385 -19.366 -7.047 274 HG2 GLN 34 HG2 GLN 34 -3.846 -16.503 -6.345 275 HG3 GLN 34 HG1 GLN 34 -2.546 -17.642 -6.673 276 HE21 GLN 34 HE21 GLN 34 -3.329 -15.243 -8.126 277 HE22 GLN 34 HE22 GLN 34 -3.680 -15.754 -9.740 278 H GLY 35 H GLY 35 -7.214 -18.581 -4.086 279 HA2 GLY 35 HA2 GLY 35 -8.709 -20.161 -3.339 280 HA3 GLY 35 HA1 GLY 35 -8.900 -20.683 -5.006 281 H VAL 36 H VAL 36 -5.911 -20.595 -3.145 282 HA VAL 36 HA VAL 36 -5.801 -23.531 -3.357 283 HB VAL 36 HB VAL 36 -3.373 -23.388 -3.537 284 HG11 VAL 36 HG11 VAL 36 -4.761 -21.631 -5.557 285 HG12 VAL 36 HG12 VAL 36 -4.658 -23.390 -5.600 286 HG13 VAL 36 HG13 VAL 36 -3.198 -22.418 -5.784 287 HG21 VAL 36 HG21 VAL 36 -3.012 -21.335 -2.251 288 HG22 VAL 36 HG22 VAL 36 -3.744 -20.390 -3.548 289 HG23 VAL 36 HG23 VAL 36 -2.224 -21.240 -3.829 290 HA PRO 37 HA PRO 37 -5.314 -23.687 1.027 291 HB2 PRO 37 HB2 PRO 37 -3.647 -25.857 1.254 292 HB3 PRO 37 HB1 PRO 37 -5.380 -25.982 0.946 293 HG2 PRO 37 HG2 PRO 37 -3.100 -26.158 -0.973 294 HG3 PRO 37 HG1 PRO 37 -4.593 -27.113 -0.914 295 HD2 PRO 37 HD2 PRO 37 -4.231 -25.084 -2.659 296 HD3 PRO 37 HD1 PRO 37 -5.821 -25.479 -1.983 297 H ALA 38 H ALA 38 -4.134 -22.280 2.125 298 HA ALA 38 HA ALA 38 -1.598 -21.354 1.278 299 HB1 ALA 38 HB1 ALA 38 -2.984 -20.937 3.926 300 HB2 ALA 38 HB2 ALA 38 -3.174 -19.936 2.484 301 HB3 ALA 38 HB3 ALA 38 -1.618 -20.003 3.310 302 H ASP 39 H ASP 39 -2.597 -23.898 3.368 303 HA ASP 39 HA ASP 39 -0.205 -24.172 4.874 304 HB2 ASP 39 HB2 ASP 39 -2.374 -26.168 4.206 305 HB3 ASP 39 HB1 ASP 39 -1.038 -26.509 5.300 306 H GLN 40 H GLN 40 -1.096 -25.050 1.675 307 HA GLN 40 HA GLN 40 1.281 -26.767 1.421 308 HB2 GLN 40 HB2 GLN 40 -1.105 -26.545 -0.418 309 HB3 GLN 40 HB1 GLN 40 0.220 -27.688 -0.563 310 HG2 GLN 40 HG2 GLN 40 -1.779 -27.575 1.688 311 HG3 GLN 40 HG1 GLN 40 -1.766 -28.744 0.368 312 HE21 GLN 40 HE21 GLN 40 -1.568 -29.108 3.272 313 HE22 GLN 40 HE22 GLN 40 -0.098 -29.981 3.543 314 H LEU 41 H LEU 41 0.742 -23.724 1.253 315 HA LEU 41 HA LEU 41 1.760 -23.207 -1.433 316 HB2 LEU 41 HB2 LEU 41 -0.211 -21.958 -0.503 317 HB3 LEU 41 HB1 LEU 41 0.870 -21.245 0.675 318 HG LEU 41 HG LEU 41 2.163 -20.232 -1.183 319 HD11 LEU 41 HD11 LEU 41 -0.104 -21.310 -2.857 320 HD12 LEU 41 HD12 LEU 41 1.590 -21.797 -2.946 321 HD13 LEU 41 HD13 LEU 41 1.117 -20.164 -3.406 322 HD21 LEU 41 HD21 LEU 41 0.425 -18.980 0.011 323 HD22 LEU 41 HD22 LEU 41 -0.774 -19.557 -1.147 324 HD23 LEU 41 HD23 LEU 41 0.530 -18.500 -1.682 325 H ARG 42 H ARG 42 3.727 -22.173 -1.782 326 HA ARG 42 HA ARG 42 5.442 -21.882 0.592 327 HB2 ARG 42 HB2 ARG 42 5.998 -23.876 -0.806 328 HB3 ARG 42 HB1 ARG 42 6.309 -22.794 -2.155 329 HG2 ARG 42 HG2 ARG 42 8.370 -23.515 -1.023 330 HG3 ARG 42 HG1 ARG 42 8.140 -21.764 -0.962 331 HD2 ARG 42 HD2 ARG 42 8.903 -22.799 1.193 332 HD3 ARG 42 HD1 ARG 42 7.417 -21.852 1.295 333 HE ARG 42 HE ARG 42 6.670 -24.491 0.823 334 HH11 ARG 42 HH11 ARG 42 8.356 -22.752 3.397 335 HH12 ARG 42 HH12 ARG 42 7.732 -23.775 4.639 336 HH21 ARG 42 HH21 ARG 42 5.868 -25.825 2.476 337 HH22 ARG 42 HH22 ARG 42 6.317 -25.534 4.118 338 H VAL 43 H VAL 43 6.403 -19.957 0.826 339 HA VAL 43 HA VAL 43 6.231 -18.120 -1.431 340 HB VAL 43 HB VAL 43 6.499 -16.272 0.230 341 HG11 VAL 43 HG11 VAL 43 4.235 -16.429 1.157 342 HG12 VAL 43 HG12 VAL 43 4.186 -18.140 0.728 343 HG13 VAL 43 HG13 VAL 43 4.286 -16.916 -0.537 344 HG21 VAL 43 HG21 VAL 43 6.187 -18.474 2.273 345 HG22 VAL 43 HG22 VAL 43 6.193 -16.744 2.613 346 HG23 VAL 43 HG23 VAL 43 7.648 -17.527 1.994 347 H ILE 44 H ILE 44 7.988 -17.551 -2.465 348 HA ILE 44 HA ILE 44 10.593 -17.896 -1.134 349 HB ILE 44 HB ILE 44 9.889 -18.256 -4.057 350 HG12 ILE 44 HG12 ILE 44 9.221 -20.158 -2.654 351 HG13 ILE 44 HG11 ILE 44 10.548 -20.596 -3.723 352 HG21 ILE 44 HG21 ILE 44 12.231 -18.898 -4.384 353 HG22 ILE 44 HG22 ILE 44 12.575 -18.470 -2.709 354 HG23 ILE 44 HG23 ILE 44 12.074 -17.225 -3.852 355 HD11 ILE 44 HD11 ILE 44 10.868 -21.548 -1.523 356 HD12 ILE 44 HD12 ILE 44 10.758 -19.951 -0.788 357 HD13 ILE 44 HD13 ILE 44 12.114 -20.341 -1.846 358 H PHE 45 H PHE 45 11.850 -16.178 -1.033 359 HA PHE 45 HA PHE 45 11.281 -13.877 -2.760 360 HB2 PHE 45 HB2 PHE 45 10.365 -13.365 -0.575 361 HB3 PHE 45 HB1 PHE 45 11.863 -13.852 0.207 362 HD1 PHE 45 HD1 PHE 45 10.640 -11.453 -2.370 363 HD2 PHE 45 HD2 PHE 45 13.351 -12.213 0.818 364 HE1 PHE 45 HE1 PHE 45 11.454 -9.141 -2.514 365 HE2 PHE 45 HE2 PHE 45 14.171 -9.899 0.681 366 HZ PHE 45 HZ PHE 45 13.221 -8.361 -0.986 367 H ALA 46 H ALA 46 12.966 -13.599 -4.017 368 HA ALA 46 HA ALA 46 15.068 -13.294 -4.778 369 HB1 ALA 46 HB1 ALA 46 16.815 -12.564 -3.262 370 HB2 ALA 46 HB2 ALA 46 15.873 -13.112 -1.876 371 HB3 ALA 46 HB3 ALA 46 15.292 -11.771 -2.862 372 H GLY 47 H GLY 47 14.094 -16.033 -3.413 373 HA2 GLY 47 HA2 GLY 47 15.216 -18.014 -4.454 374 HA3 GLY 47 HA1 GLY 47 16.708 -17.358 -3.798 375 H LYS 48 H LYS 48 15.076 -16.547 -1.350 376 HA LYS 48 HA LYS 48 15.143 -19.199 -0.055 377 HB2 LYS 48 HB2 LYS 48 15.602 -17.977 2.031 378 HB3 LYS 48 HB1 LYS 48 16.842 -17.711 0.812 379 HG2 LYS 48 HG2 LYS 48 16.289 -15.520 0.520 380 HG3 LYS 48 HG1 LYS 48 14.601 -15.775 0.962 381 HD2 LYS 48 HD2 LYS 48 15.193 -15.985 3.275 382 HD3 LYS 48 HD1 LYS 48 16.916 -15.859 2.890 383 HE2 LYS 48 HE2 LYS 48 16.531 -13.595 2.007 384 HE3 LYS 48 HE1 LYS 48 14.826 -13.728 2.422 385 HZ1 LYS 48 HZ1 LYS 48 16.019 -12.487 4.088 386 HZ2 LYS 48 HZ2 LYS 48 17.099 -13.753 4.336 387 HZ3 LYS 48 HZ3 LYS 48 15.473 -13.937 4.760 388 H GLU 49 H GLU 49 13.701 -19.251 1.942 389 HA GLU 49 HA GLU 49 11.169 -17.950 1.257 390 HB2 GLU 49 HB2 GLU 49 10.059 -19.621 2.615 391 HB3 GLU 49 HB1 GLU 49 11.107 -20.417 1.456 392 HG2 GLU 49 HG2 GLU 49 12.752 -20.827 3.180 393 HG3 GLU 49 HG1 GLU 49 11.768 -19.950 4.351 394 H LEU 50 H LEU 50 10.178 -16.595 2.664 395 HA LEU 50 HA LEU 50 11.844 -15.559 4.783 396 HB2 LEU 50 HB2 LEU 50 9.168 -14.643 3.761 397 HB3 LEU 50 HB1 LEU 50 10.090 -13.825 5.008 398 HG LEU 50 HG LEU 50 10.848 -14.163 2.120 399 HD11 LEU 50 HD11 LEU 50 10.158 -11.724 3.739 400 HD12 LEU 50 HD12 LEU 50 9.156 -12.475 2.496 401 HD13 LEU 50 HD13 LEU 50 10.692 -11.726 2.058 402 HD21 LEU 50 HD21 LEU 50 12.854 -14.328 3.439 403 HD22 LEU 50 HD22 LEU 50 12.376 -12.937 4.410 404 HD23 LEU 50 HD23 LEU 50 12.793 -12.722 2.710 405 H ARG 51 H ARG 51 10.692 -14.873 6.810 406 HA ARG 51 HA ARG 51 9.495 -17.248 7.957 407 HB2 ARG 51 HB2 ARG 51 9.964 -16.181 10.103 408 HB3 ARG 51 HB1 ARG 51 11.397 -16.194 9.092 409 HG2 ARG 51 HG2 ARG 51 10.474 -13.787 8.439 410 HG3 ARG 51 HG1 ARG 51 9.769 -13.924 10.051 411 HD2 ARG 51 HD2 ARG 51 12.679 -14.181 9.317 412 HD3 ARG 51 HD1 ARG 51 11.928 -12.851 10.192 413 HE ARG 51 HE ARG 51 11.343 -14.892 11.796 414 HH11 ARG 51 HH11 ARG 51 14.377 -14.017 10.254 415 HH12 ARG 51 HH12 ARG 51 15.354 -14.746 11.483 416 HH21 ARG 51 HH21 ARG 51 12.640 -15.837 13.428 417 HH22 ARG 51 HH22 ARG 51 14.369 -15.783 13.290 418 H ASN 52 H ASN 52 7.590 -17.054 9.343 419 HA ASN 52 HA ASN 52 5.567 -15.632 7.921 420 HB2 ASN 52 HB2 ASN 52 3.990 -16.656 9.584 421 HB3 ASN 52 HB1 ASN 52 4.987 -17.802 8.699 422 HD21 ASN 52 HD21 ASN 52 4.264 -16.391 11.758 423 HD22 ASN 52 HD22 ASN 52 5.222 -17.460 12.717 424 H ASP 53 H ASP 53 7.070 -15.158 11.087 425 HA ASP 53 HA ASP 53 5.327 -12.878 11.586 426 HB2 ASP 53 HB2 ASP 53 7.385 -14.278 13.281 427 HB3 ASP 53 HB1 ASP 53 6.784 -12.686 13.722 428 H TRP 54 H TRP 54 6.320 -12.056 9.556 429 HA TRP 54 HA TRP 54 8.358 -10.119 10.302 430 HB2 TRP 54 HB2 TRP 54 9.618 -11.979 9.337 431 HB3 TRP 54 HB1 TRP 54 8.607 -11.940 7.902 432 HD1 TRP 54 HD1 TRP 54 10.062 -11.078 6.002 433 HE1 TRP 54 HE1 TRP 54 11.718 -9.148 5.672 434 HE3 TRP 54 HE3 TRP 54 10.111 -9.224 10.768 435 HZ2 TRP 54 HZ2 TRP 54 12.879 -7.095 7.219 436 HZ3 TRP 54 HZ3 TRP 54 11.519 -7.273 11.253 437 HH2 TRP 54 HH2 TRP 54 12.877 -6.233 9.515 438 H THR 55 H THR 55 7.939 -8.173 9.469 439 HA THR 55 HA THR 55 5.543 -7.828 7.924 440 HB THR 55 HB THR 55 5.981 -6.224 9.684 441 HG1 THR 55 HG1 THR 55 5.610 -4.363 8.489 442 HG21 THR 55 HG21 THR 55 8.418 -6.297 9.714 443 HG22 THR 55 HG22 THR 55 7.856 -4.636 9.531 444 HG23 THR 55 HG23 THR 55 8.474 -5.515 8.133 445 H VAL 56 H VAL 56 5.326 -7.145 5.874 446 HA VAL 56 HA VAL 56 7.500 -7.671 4.092 447 HB VAL 56 HB VAL 56 5.094 -8.219 3.602 448 HG11 VAL 56 HG11 VAL 56 4.058 -6.184 4.418 449 HG12 VAL 56 HG12 VAL 56 3.625 -6.485 2.736 450 HG13 VAL 56 HG13 VAL 56 4.829 -5.258 3.130 451 HG21 VAL 56 HG21 VAL 56 5.198 -7.556 1.215 452 HG22 VAL 56 HG22 VAL 56 6.700 -8.252 1.823 453 HG23 VAL 56 HG23 VAL 56 6.565 -6.508 1.605 454 H GLN 57 H GLN 57 6.180 -4.873 5.613 455 HA GLN 57 HA GLN 57 6.921 -2.944 3.673 456 HB2 GLN 57 HB2 GLN 57 5.189 -2.562 5.384 457 HB3 GLN 57 HB1 GLN 57 6.434 -2.558 6.624 458 HG2 GLN 57 HG2 GLN 57 5.770 -0.299 6.069 459 HG3 GLN 57 HG1 GLN 57 7.447 -0.583 5.604 460 HE21 GLN 57 HE21 GLN 57 7.982 -0.685 3.426 461 HE22 GLN 57 HE22 GLN 57 6.918 -0.121 2.187 462 H ASN 58 H ASN 58 8.517 -4.121 6.598 463 HA ASN 58 HA ASN 58 10.699 -2.263 6.342 464 HB2 ASN 58 HB2 ASN 58 9.932 -3.163 8.540 465 HB3 ASN 58 HB1 ASN 58 10.529 -4.747 8.064 466 HD21 ASN 58 HD21 ASN 58 11.412 -1.502 8.955 467 HD22 ASN 58 HD22 ASN 58 13.066 -1.836 9.322 468 H CYS 59 H CYS 59 9.938 -5.292 4.997 469 HA CYS 59 HA CYS 59 12.703 -5.989 4.447 470 HB2 CYS 59 HB2 CYS 59 10.976 -7.707 5.057 471 HB3 CYS 59 HB1 CYS 59 10.197 -7.387 3.513 472 HG CYS 59 HG CYS 59 12.762 -8.012 2.183 473 H ASP 60 H ASP 60 9.841 -4.835 2.794 474 HA ASP 60 HA ASP 60 9.437 -3.940 0.779 475 HB2 ASP 60 HB2 ASP 60 11.411 -2.480 1.360 476 HB3 ASP 60 HB1 ASP 60 12.415 -3.577 0.413 477 H LEU 61 H LEU 61 8.606 -5.646 -0.216 478 HA LEU 61 HA LEU 61 10.403 -7.397 -1.725 479 HB2 LEU 61 HB2 LEU 61 7.573 -7.703 -0.739 480 HB3 LEU 61 HB1 LEU 61 8.178 -8.721 -2.025 481 HG LEU 61 HG LEU 61 9.908 -9.615 -0.504 482 HD11 LEU 61 HD11 LEU 61 8.588 -7.886 1.572 483 HD12 LEU 61 HD12 LEU 61 10.236 -7.746 0.964 484 HD13 LEU 61 HD13 LEU 61 9.759 -9.160 1.902 485 HD21 LEU 61 HD21 LEU 61 8.397 -10.873 0.990 486 HD22 LEU 61 HD22 LEU 61 7.838 -10.827 -0.679 487 HD23 LEU 61 HD23 LEU 61 7.083 -9.791 0.531 488 H ASP 62 H ASP 62 9.677 -4.677 -2.414 489 HA ASP 62 HA ASP 62 8.244 -5.139 -4.942 490 HB2 ASP 62 HB2 ASP 62 6.943 -3.607 -3.741 491 HB3 ASP 62 HB1 ASP 62 8.352 -2.783 -3.092 492 H GLN 63 H GLN 63 10.907 -3.423 -3.394 493 HA GLN 63 HA GLN 63 11.986 -2.662 -5.998 494 HB2 GLN 63 HB2 GLN 63 12.884 -2.055 -3.180 495 HB3 GLN 63 HB1 GLN 63 13.755 -1.531 -4.614 496 HG2 GLN 63 HG2 GLN 63 10.930 -0.770 -3.904 497 HG3 GLN 63 HG1 GLN 63 12.357 0.241 -3.674 498 HE21 GLN 63 HE21 GLN 63 10.058 -1.000 -5.920 499 HE22 GLN 63 HE22 GLN 63 10.573 -0.068 -7.286 500 H GLN 64 H GLN 64 12.789 -4.684 -3.233 501 HA GLN 64 HA GLN 64 15.191 -5.611 -4.571 502 HB2 GLN 64 HB2 GLN 64 14.054 -6.419 -1.891 503 HB3 GLN 64 HB1 GLN 64 15.635 -6.858 -2.519 504 HG2 GLN 64 HG2 GLN 64 14.673 -4.128 -1.716 505 HG3 GLN 64 HG1 GLN 64 15.933 -5.097 -0.955 506 HE21 GLN 64 HE21 GLN 64 17.927 -5.315 -2.003 507 HE22 GLN 64 HE22 GLN 64 18.432 -4.199 -3.225 508 H SEP 65 H SEP 65 14.472 -6.772 -6.293 509 HA SEP 65 HA SEP 65 13.828 -8.611 -7.445 510 HB2 SEP 65 HB1 SEP 65 13.561 -10.777 -6.130 511 HB3 SEP 65 HB2 SEP 65 13.930 -9.836 -4.684 512 H ILE 66 H ILE 66 12.014 -10.569 -7.089 513 HA ILE 66 HA ILE 66 9.533 -9.177 -6.391 514 HB ILE 66 HB ILE 66 9.885 -9.305 -8.886 515 HG12 ILE 66 HG12 ILE 66 7.565 -10.982 -7.930 516 HG13 ILE 66 HG11 ILE 66 7.619 -9.223 -7.859 517 HG21 ILE 66 HG21 ILE 66 9.648 -11.429 -10.012 518 HG22 ILE 66 HG22 ILE 66 9.581 -12.258 -8.458 519 HG23 ILE 66 HG23 ILE 66 11.066 -11.437 -8.958 520 HD11 ILE 66 HD11 ILE 66 7.720 -9.087 -10.263 521 HD12 ILE 66 HD12 ILE 66 6.343 -10.083 -9.785 522 HD13 ILE 66 HD13 ILE 66 7.816 -10.841 -10.389 523 H VAL 67 H VAL 67 7.819 -10.616 -5.692 524 HA VAL 67 HA VAL 67 8.890 -12.757 -4.084 525 HB VAL 67 HB VAL 67 5.980 -12.034 -4.382 526 HG11 VAL 67 HG11 VAL 67 7.537 -13.239 -2.099 527 HG12 VAL 67 HG12 VAL 67 6.446 -14.098 -3.185 528 HG13 VAL 67 HG13 VAL 67 5.812 -12.870 -2.090 529 HG21 VAL 67 HG21 VAL 67 8.055 -10.727 -2.640 530 HG22 VAL 67 HG22 VAL 67 6.314 -10.520 -2.440 531 HG23 VAL 67 HG23 VAL 67 7.107 -9.971 -3.919 532 H HIS 68 H HIS 68 8.837 -14.863 -4.544 533 HA HIS 68 HA HIS 68 7.269 -15.726 -6.877 534 HB2 HIS 68 HB2 HIS 68 9.721 -16.948 -5.589 535 HB3 HIS 68 HB1 HIS 68 8.809 -17.709 -6.884 536 HD2 HIS 68 HD2 HIS 68 8.756 -14.358 -8.184 537 HE1 HIS 68 HE1 HIS 68 12.652 -15.704 -9.137 538 HE2 HIS 68 HE2 HIS 68 10.961 -13.859 -9.465 539 H ILE 69 H ILE 69 5.403 -16.608 -6.285 540 HA ILE 69 HA ILE 69 5.390 -18.230 -3.837 541 HB ILE 69 HB ILE 69 3.134 -16.634 -5.062 542 HG12 ILE 69 HG12 ILE 69 4.664 -16.416 -2.465 543 HG13 ILE 69 HG11 ILE 69 4.647 -15.260 -3.789 544 HG21 ILE 69 HG21 ILE 69 1.757 -17.437 -3.203 545 HG22 ILE 69 HG22 ILE 69 3.071 -18.497 -2.692 546 HG23 ILE 69 HG23 ILE 69 2.281 -18.756 -4.248 547 HD11 ILE 69 HD11 ILE 69 2.328 -15.937 -1.992 548 HD12 ILE 69 HD12 ILE 69 2.287 -14.801 -3.340 549 HD13 ILE 69 HD13 ILE 69 3.306 -14.467 -1.938 550 H VAL 70 H VAL 70 5.111 -20.302 -4.089 551 HA VAL 70 HA VAL 70 3.749 -21.261 -6.507 552 HB VAL 70 HB VAL 70 6.173 -21.503 -6.811 553 HG11 VAL 70 HG11 VAL 70 6.105 -23.202 -4.326 554 HG12 VAL 70 HG12 VAL 70 6.867 -21.620 -4.489 555 HG13 VAL 70 HG13 VAL 70 7.493 -22.997 -5.396 556 HG21 VAL 70 HG21 VAL 70 4.761 -23.174 -7.841 557 HG22 VAL 70 HG22 VAL 70 4.751 -24.121 -6.355 558 HG23 VAL 70 HG23 VAL 70 6.247 -23.927 -7.266 559 H GLN 71 H GLN 71 2.523 -23.120 -6.265 560 HA GLN 71 HA GLN 71 1.948 -23.870 -3.506 561 HB2 GLN 71 HB2 GLN 71 0.062 -23.275 -5.012 562 HB3 GLN 71 HB1 GLN 71 0.509 -24.612 -6.062 563 HG2 GLN 71 HG2 GLN 71 0.116 -26.159 -4.149 564 HG3 GLN 71 HG1 GLN 71 -0.485 -24.783 -3.228 565 HE21 GLN 71 HE21 GLN 71 -1.036 -25.222 -6.658 566 HE22 GLN 71 HE22 GLN 71 -2.735 -25.502 -6.527 567 H ARG 72 H ARG 72 2.730 -25.696 -2.686 568 HA ARG 72 HA ARG 72 3.341 -27.911 -4.468 569 HB2 ARG 72 HB2 ARG 72 5.393 -26.310 -3.999 570 HB3 ARG 72 HB1 ARG 72 5.437 -27.159 -2.463 571 HG2 ARG 72 HG2 ARG 72 5.537 -28.524 -5.147 572 HG3 ARG 72 HG1 ARG 72 6.959 -28.078 -4.208 573 HD2 ARG 72 HD2 ARG 72 6.325 -29.543 -2.433 574 HD3 ARG 72 HD1 ARG 72 4.762 -29.869 -3.184 575 HE ARG 72 HE ARG 72 6.200 -30.831 -5.060 576 HH11 ARG 72 HH11 ARG 72 7.024 -30.981 -1.643 577 HH12 ARG 72 HH12 ARG 72 8.001 -32.395 -1.807 578 HH21 ARG 72 HH21 ARG 72 7.461 -32.728 -5.281 579 HH22 ARG 72 HH22 ARG 72 8.251 -33.402 -3.899 580 HA PRO 73 HA PRO 73 1.452 -29.312 -0.597 581 HB2 PRO 73 HB2 PRO 73 -0.435 -30.855 -1.681 582 HB3 PRO 73 HB1 PRO 73 -0.602 -29.099 -1.635 583 HG2 PRO 73 HG2 PRO 73 0.086 -30.874 -3.913 584 HG3 PRO 73 HG1 PRO 73 -0.813 -29.347 -3.907 585 HD2 PRO 73 HD2 PRO 73 1.898 -29.695 -4.583 586 HD3 PRO 73 HD1 PRO 73 1.077 -28.153 -4.283 587 H TRP 74 H TRP 74 1.944 -31.073 0.538 588 HA TRP 74 HA TRP 74 2.974 -33.423 -0.909 589 HB2 TRP 74 HB2 TRP 74 4.600 -32.293 0.622 590 HB3 TRP 74 HB1 TRP 74 3.517 -32.647 1.963 591 HD1 TRP 74 HD1 TRP 74 3.407 -35.134 2.819 592 HE1 TRP 74 HE1 TRP 74 4.942 -37.174 2.466 593 HE3 TRP 74 HE3 TRP 74 6.103 -33.417 -1.150 594 HZ2 TRP 74 HZ2 TRP 74 7.021 -37.941 0.724 595 HZ3 TRP 74 HZ3 TRP 74 7.846 -34.863 -2.109 596 HH2 TRP 74 HH2 TRP 74 8.294 -37.077 -1.191 597 H ARG 75 H ARG 75 1.186 -32.447 1.990 598 HA ARG 75 HA ARG 75 -0.210 -35.000 1.940 599 HB2 ARG 75 HB2 ARG 75 -0.249 -32.734 3.938 600 HB3 ARG 75 HB1 ARG 75 -1.248 -34.175 4.072 601 HG2 ARG 75 HG2 ARG 75 1.764 -34.144 4.033 602 HG3 ARG 75 HG1 ARG 75 0.759 -34.292 5.475 603 HD2 ARG 75 HD2 ARG 75 -0.172 -36.375 4.645 604 HD3 ARG 75 HD1 ARG 75 0.740 -36.216 3.146 605 HE ARG 75 HE ARG 75 2.491 -36.159 5.348 606 HH11 ARG 75 HH11 ARG 75 0.453 -38.401 3.571 607 HH12 ARG 75 HH12 ARG 75 1.449 -39.774 3.912 608 HH21 ARG 75 HH21 ARG 75 3.810 -37.998 5.799 609 HH22 ARG 75 HH22 ARG 75 3.351 -39.543 5.172 610 H LYS 76 H LYS 76 -1.274 -34.615 -0.002 611 HA LYS 76 HA LYS 76 -3.826 -33.344 0.314 612 HB2 LYS 76 HB2 LYS 76 -2.416 -31.445 -0.431 613 HB3 LYS 76 HB1 LYS 76 -1.913 -32.375 -1.830 614 HG2 LYS 76 HG2 LYS 76 -3.616 -30.731 -2.413 615 HG3 LYS 76 HG1 LYS 76 -4.193 -32.376 -2.682 616 HD2 LYS 76 HD2 LYS 76 -5.924 -30.995 -1.644 617 HD3 LYS 76 HD1 LYS 76 -5.420 -32.292 -0.563 618 HE2 LYS 76 HE2 LYS 76 -3.988 -30.723 0.653 619 HE3 LYS 76 HE1 LYS 76 -4.479 -29.428 -0.437 620 HZ1 LYS 76 HZ1 LYS 76 -6.739 -29.665 0.341 621 HZ2 LYS 76 HZ2 LYS 76 -5.709 -29.388 1.650 622 HZ3 LYS 76 HZ3 LYS 76 -6.298 -30.941 1.354 Start of MODEL 22 1 H1 MET 1 HT1 MET 1 -0.064 -1.552 0.108 2 H2 MET 1 HT2 MET 1 -0.022 -0.297 -1.028 3 H3 MET 1 HT3 MET 1 0.638 -0.063 0.509 4 HA MET 1 HA MET 1 2.352 -0.390 -1.131 5 HB2 MET 1 HB2 MET 1 2.660 -1.204 1.208 6 HB3 MET 1 HB1 MET 1 2.068 -2.781 0.706 7 HG2 MET 1 HG2 MET 1 3.960 -2.944 -0.878 8 HG3 MET 1 HG1 MET 1 4.567 -1.409 -0.259 9 HE1 MET 1 HE1 MET 1 6.924 -2.403 0.370 10 HE2 MET 1 HE2 MET 1 6.400 -3.918 -0.363 11 HE3 MET 1 HE3 MET 1 7.136 -3.922 1.240 12 H ILE 2 H ILE 2 2.938 -1.292 -3.010 13 HA ILE 2 HA ILE 2 1.357 -3.583 -3.969 14 HB ILE 2 HB ILE 2 2.730 -1.375 -5.518 15 HG12 ILE 2 HG12 ILE 2 0.526 -0.847 -4.450 16 HG13 ILE 2 HG11 ILE 2 0.526 -0.703 -6.206 17 HG21 ILE 2 HG21 ILE 2 3.011 -3.464 -6.714 18 HG22 ILE 2 HG22 ILE 2 1.843 -2.439 -7.550 19 HG23 ILE 2 HG23 ILE 2 1.285 -3.799 -6.576 20 HD11 ILE 2 HD11 ILE 2 -1.501 -1.740 -5.409 21 HD12 ILE 2 HD12 ILE 2 -0.560 -2.992 -4.598 22 HD13 ILE 2 HD13 ILE 2 -0.552 -2.886 -6.357 23 H VAL 3 H VAL 3 2.501 -5.416 -3.806 24 HA VAL 3 HA VAL 3 5.384 -5.272 -4.328 25 HB VAL 3 HB VAL 3 5.594 -7.438 -3.169 26 HG11 VAL 3 HG11 VAL 3 5.116 -6.633 -0.889 27 HG12 VAL 3 HG12 VAL 3 4.180 -5.305 -1.579 28 HG13 VAL 3 HG13 VAL 3 5.913 -5.420 -1.891 29 HG21 VAL 3 HG21 VAL 3 3.709 -8.340 -1.881 30 HG22 VAL 3 HG22 VAL 3 3.390 -8.360 -3.617 31 HG23 VAL 3 HG23 VAL 3 2.647 -7.125 -2.597 32 H PHE 4 H PHE 4 6.334 -6.665 -5.784 33 HA PHE 4 HA PHE 4 4.528 -7.603 -7.867 34 HB2 PHE 4 HB2 PHE 4 7.555 -7.587 -7.830 35 HB3 PHE 4 HB1 PHE 4 6.519 -7.802 -9.236 36 HD1 PHE 4 HD1 PHE 4 8.504 -5.532 -7.528 37 HD2 PHE 4 HD2 PHE 4 4.769 -5.790 -9.549 38 HE1 PHE 4 HE1 PHE 4 8.538 -3.100 -7.892 39 HE2 PHE 4 HE2 PHE 4 4.799 -3.356 -9.922 40 HZ PHE 4 HZ PHE 4 6.685 -2.009 -9.093 41 H VAL 5 H VAL 5 3.970 -9.647 -8.128 42 HA VAL 5 HA VAL 5 5.568 -11.717 -6.790 43 HB VAL 5 HB VAL 5 2.566 -11.362 -6.689 44 HG11 VAL 5 HG11 VAL 5 2.464 -13.450 -5.443 45 HG12 VAL 5 HG12 VAL 5 4.190 -13.704 -5.708 46 HG13 VAL 5 HG13 VAL 5 3.075 -13.712 -7.077 47 HG21 VAL 5 HG21 VAL 5 4.605 -11.545 -4.486 48 HG22 VAL 5 HG22 VAL 5 2.873 -11.276 -4.293 49 HG23 VAL 5 HG23 VAL 5 3.878 -10.057 -5.084 50 H ARG 6 H ARG 6 5.939 -13.470 -7.964 51 HA ARG 6 HA ARG 6 4.469 -13.787 -10.486 52 HB2 ARG 6 HB2 ARG 6 7.178 -14.855 -9.679 53 HB3 ARG 6 HB1 ARG 6 6.384 -15.169 -11.216 54 HG2 ARG 6 HG2 ARG 6 6.407 -12.748 -11.675 55 HG3 ARG 6 HG1 ARG 6 7.302 -12.513 -10.173 56 HD2 ARG 6 HD2 ARG 6 9.120 -13.892 -11.012 57 HD3 ARG 6 HD1 ARG 6 8.215 -14.218 -12.490 58 HE ARG 6 HE ARG 6 8.451 -11.456 -12.269 59 HH11 ARG 6 HH11 ARG 6 10.548 -14.229 -12.711 60 HH12 ARG 6 HH12 ARG 6 11.771 -13.337 -13.546 61 HH21 ARG 6 HH21 ARG 6 10.062 -10.263 -13.375 62 HH22 ARG 6 HH22 ARG 6 11.476 -11.067 -13.954 63 H PHE 7 H PHE 7 2.773 -15.032 -10.003 64 HA PHE 7 HA PHE 7 3.059 -17.227 -8.148 65 HB2 PHE 7 HB2 PHE 7 1.045 -15.739 -8.184 66 HB3 PHE 7 HB1 PHE 7 0.640 -16.397 -9.764 67 HD1 PHE 7 HD1 PHE 7 1.442 -17.559 -6.321 68 HD2 PHE 7 HD2 PHE 7 -0.862 -18.135 -9.846 69 HE1 PHE 7 HE1 PHE 7 0.217 -19.377 -5.218 70 HE2 PHE 7 HE2 PHE 7 -2.093 -19.959 -8.747 71 HZ PHE 7 HZ PHE 7 -1.547 -20.582 -6.429 72 H ASN 8 H ASN 8 3.983 -19.001 -8.876 73 HA ASN 8 HA ASN 8 3.906 -19.745 -11.654 74 HB2 ASN 8 HB2 ASN 8 5.917 -20.142 -10.262 75 HB3 ASN 8 HB1 ASN 8 5.003 -21.296 -9.300 76 HD21 ASN 8 HD21 ASN 8 4.387 -23.271 -10.258 77 HD22 ASN 8 HD22 ASN 8 5.187 -23.888 -11.659 78 H SER 9 H SER 9 1.815 -20.057 -12.107 79 HA SER 9 HA SER 9 0.702 -22.538 -12.133 80 HB2 SER 9 HB2 SER 9 0.518 -22.371 -9.642 81 HB3 SER 9 HB1 SER 9 -0.490 -20.939 -9.837 82 HG SER 9 HG SER 9 -1.711 -22.866 -9.532 83 H SER 10 H SER 10 0.185 -19.107 -11.782 84 HA SER 10 HA SER 10 -1.853 -19.238 -13.885 85 HB2 SER 10 HB2 SER 10 -2.885 -18.650 -11.711 86 HB3 SER 10 HB1 SER 10 -1.774 -17.292 -11.556 87 HG SER 10 HG SER 10 -3.527 -17.585 -13.761 88 H HIS 11 H HIS 11 -0.199 -16.507 -12.306 89 HA HIS 11 HA HIS 11 1.660 -15.997 -14.355 90 HB2 HIS 11 HB2 HIS 11 -0.429 -15.464 -15.628 91 HB3 HIS 11 HB1 HIS 11 -0.824 -14.250 -14.422 92 HD2 HIS 11 HD2 HIS 11 -0.191 -11.828 -15.305 93 HE1 HIS 11 HE1 HIS 11 3.178 -12.903 -17.626 94 HE2 HIS 11 HE2 HIS 11 1.646 -11.008 -16.949 95 H GLY 12 H GLY 12 2.570 -13.702 -14.064 96 HA2 GLY 12 HA2 GLY 12 2.797 -13.214 -11.213 97 HA3 GLY 12 HA1 GLY 12 3.757 -12.455 -12.479 98 H PHE 13 H PHE 13 1.848 -11.617 -10.119 99 HA PHE 13 HA PHE 13 0.693 -9.394 -11.590 100 HB2 PHE 13 HB2 PHE 13 -1.491 -9.635 -10.528 101 HB3 PHE 13 HB1 PHE 13 -1.106 -11.083 -11.445 102 HD1 PHE 13 HD1 PHE 13 -2.160 -9.787 -8.318 103 HD2 PHE 13 HD2 PHE 13 -0.144 -13.083 -10.105 104 HE1 PHE 13 HE1 PHE 13 -2.629 -11.149 -6.328 105 HE2 PHE 13 HE2 PHE 13 -0.611 -14.449 -8.115 106 HZ PHE 13 HZ PHE 13 -1.856 -13.481 -6.224 107 HA PRO 14 HA PRO 14 2.097 -7.200 -8.014 108 HB2 PRO 14 HB2 PRO 14 0.551 -4.978 -8.177 109 HB3 PRO 14 HB1 PRO 14 1.900 -5.276 -9.276 110 HG2 PRO 14 HG2 PRO 14 -1.028 -5.675 -9.713 111 HG3 PRO 14 HG1 PRO 14 0.194 -5.030 -10.824 112 HD2 PRO 14 HD2 PRO 14 -0.740 -7.589 -10.941 113 HD3 PRO 14 HD1 PRO 14 0.886 -7.119 -11.470 114 H VAL 15 H VAL 15 1.587 -7.724 -5.987 115 HA VAL 15 HA VAL 15 -1.221 -8.128 -5.299 116 HB VAL 15 HB VAL 15 1.279 -8.862 -3.744 117 HG11 VAL 15 HG11 VAL 15 -1.611 -9.534 -3.182 118 HG12 VAL 15 HG12 VAL 15 -0.626 -8.391 -2.272 119 HG13 VAL 15 HG13 VAL 15 -0.213 -10.107 -2.269 120 HG21 VAL 15 HG21 VAL 15 -0.666 -10.556 -5.305 121 HG22 VAL 15 HG22 VAL 15 0.665 -11.167 -4.322 122 HG23 VAL 15 HG23 VAL 15 0.999 -10.192 -5.754 123 H GLU 16 H GLU 16 -2.302 -6.619 -4.338 124 HA GLU 16 HA GLU 16 -0.930 -4.330 -3.204 125 HB2 GLU 16 HB2 GLU 16 -2.723 -3.936 -4.790 126 HB3 GLU 16 HB1 GLU 16 -3.845 -4.846 -3.785 127 HG2 GLU 16 HG2 GLU 16 -3.454 -3.129 -1.995 128 HG3 GLU 16 HG1 GLU 16 -2.566 -2.195 -3.202 129 H VAL 17 H VAL 17 -0.391 -4.419 -1.163 130 HA VAL 17 HA VAL 17 -2.312 -5.529 0.774 131 HB VAL 17 HB VAL 17 -0.360 -6.203 2.191 132 HG11 VAL 17 HG11 VAL 17 -1.610 -7.833 0.883 133 HG12 VAL 17 HG12 VAL 17 0.097 -8.260 0.974 134 HG13 VAL 17 HG13 VAL 17 -0.552 -7.539 -0.498 135 HG21 VAL 17 HG21 VAL 17 1.362 -4.806 1.183 136 HG22 VAL 17 HG22 VAL 17 1.209 -5.681 -0.340 137 HG23 VAL 17 HG23 VAL 17 1.826 -6.504 1.093 138 H ASP 18 H ASP 18 -1.343 -4.832 3.085 139 HA ASP 18 HA ASP 18 -1.411 -1.913 3.016 140 HB2 ASP 18 HB2 ASP 18 -2.901 -3.386 4.510 141 HB3 ASP 18 HB1 ASP 18 -1.451 -3.696 5.452 142 H SER 19 H SER 19 0.109 -0.728 4.482 143 HA SER 19 HA SER 19 2.791 -1.503 4.055 144 HB2 SER 19 HB2 SER 19 1.748 0.494 6.082 145 HB3 SER 19 HB1 SER 19 3.392 0.398 5.451 146 HG SER 19 HG SER 19 1.026 1.209 4.143 147 H ASP 20 H ASP 20 0.498 -2.236 6.526 148 HA ASP 20 HA ASP 20 2.634 -3.493 8.107 149 HB2 ASP 20 HB2 ASP 20 1.286 -1.788 9.330 150 HB3 ASP 20 HB1 ASP 20 -0.153 -2.759 9.037 151 H THR 21 H THR 21 2.391 -5.036 6.248 152 HA THR 21 HA THR 21 0.328 -7.035 6.897 153 HB THR 21 HB THR 21 1.779 -6.692 4.256 154 HG1 THR 21 HG1 THR 21 0.398 -5.025 4.324 155 HG21 THR 21 HG21 THR 21 0.028 -8.221 3.405 156 HG22 THR 21 HG22 THR 21 -0.560 -8.437 5.056 157 HG23 THR 21 HG23 THR 21 1.060 -8.984 4.615 158 H SER 22 H SER 22 1.185 -8.648 8.045 159 HA SER 22 HA SER 22 3.973 -9.196 8.120 160 HB2 SER 22 HB2 SER 22 1.658 -10.904 9.061 161 HB3 SER 22 HB1 SER 22 3.347 -11.101 9.527 162 HG SER 22 HG SER 22 2.127 -8.603 9.920 163 H ILE 23 H ILE 23 5.089 -11.023 7.307 164 HA ILE 23 HA ILE 23 4.545 -11.735 4.677 165 HB ILE 23 HB ILE 23 6.203 -13.341 6.644 166 HG12 ILE 23 HG12 ILE 23 6.922 -10.996 6.581 167 HG13 ILE 23 HG11 ILE 23 8.118 -12.035 5.817 168 HG21 ILE 23 HG21 ILE 23 6.217 -13.261 3.627 169 HG22 ILE 23 HG22 ILE 23 5.803 -14.635 4.654 170 HG23 ILE 23 HG23 ILE 23 7.464 -14.036 4.601 171 HD11 ILE 23 HD11 ILE 23 6.109 -10.282 4.411 172 HD12 ILE 23 HD12 ILE 23 7.247 -11.368 3.612 173 HD13 ILE 23 HD13 ILE 23 7.846 -10.001 4.551 174 H PHE 24 H PHE 24 3.727 -13.481 7.658 175 HA PHE 24 HA PHE 24 2.636 -15.798 6.478 176 HB2 PHE 24 HB2 PHE 24 3.131 -15.503 8.918 177 HB3 PHE 24 HB1 PHE 24 1.724 -14.457 9.029 178 HD1 PHE 24 HD1 PHE 24 2.766 -17.897 8.128 179 HD2 PHE 24 HD2 PHE 24 -0.395 -15.348 9.402 180 HE1 PHE 24 HE1 PHE 24 1.337 -19.861 8.496 181 HE2 PHE 24 HE2 PHE 24 -1.832 -17.310 9.775 182 HZ PHE 24 HZ PHE 24 -0.966 -19.572 9.324 183 H GLN 25 H GLN 25 1.110 -12.754 7.449 184 HA GLN 25 HA GLN 25 -1.494 -13.425 6.622 185 HB2 GLN 25 HB2 GLN 25 -0.203 -10.698 6.849 186 HB3 GLN 25 HB1 GLN 25 -1.928 -10.994 6.689 187 HG2 GLN 25 HG2 GLN 25 -0.190 -11.871 8.984 188 HG3 GLN 25 HG1 GLN 25 -1.323 -10.520 8.992 189 HE21 GLN 25 HE21 GLN 25 -3.528 -10.943 9.025 190 HE22 GLN 25 HE22 GLN 25 -4.159 -12.491 9.463 191 H LEU 26 H LEU 26 1.190 -11.829 5.004 192 HA LEU 26 HA LEU 26 -0.038 -11.110 2.610 193 HB2 LEU 26 HB2 LEU 26 2.152 -10.322 3.147 194 HB3 LEU 26 HB1 LEU 26 2.781 -11.952 3.243 195 HG LEU 26 HG LEU 26 2.464 -12.189 0.798 196 HD11 LEU 26 HD11 LEU 26 0.650 -10.556 0.534 197 HD12 LEU 26 HD12 LEU 26 1.999 -10.237 -0.556 198 HD13 LEU 26 HD13 LEU 26 1.789 -9.258 0.895 199 HD21 LEU 26 HD21 LEU 26 4.113 -9.838 1.691 200 HD22 LEU 26 HD22 LEU 26 4.310 -10.711 0.169 201 HD23 LEU 26 HD23 LEU 26 4.611 -11.530 1.702 202 H LYS 27 H LYS 27 1.621 -14.115 3.490 203 HA LYS 27 HA LYS 27 1.299 -15.468 1.066 204 HB2 LYS 27 HB2 LYS 27 2.782 -16.240 2.869 205 HB3 LYS 27 HB1 LYS 27 1.385 -16.592 3.874 206 HG2 LYS 27 HG2 LYS 27 0.660 -18.284 2.265 207 HG3 LYS 27 HG1 LYS 27 2.074 -17.933 1.271 208 HD2 LYS 27 HD2 LYS 27 3.528 -18.592 3.148 209 HD3 LYS 27 HD1 LYS 27 2.091 -18.988 4.099 210 HE2 LYS 27 HE2 LYS 27 1.448 -20.650 2.431 211 HE3 LYS 27 HE1 LYS 27 2.877 -20.253 1.480 212 HZ1 LYS 27 HZ1 LYS 27 2.839 -21.443 4.198 213 HZ2 LYS 27 HZ2 LYS 27 4.234 -20.961 3.386 214 HZ3 LYS 27 HZ3 LYS 27 3.285 -22.215 2.758 215 H GLU 28 H GLU 28 -0.761 -15.301 3.923 216 HA GLU 28 HA GLU 28 -2.769 -17.053 3.013 217 HB2 GLU 28 HB2 GLU 28 -2.282 -15.360 5.280 218 HB3 GLU 28 HB1 GLU 28 -3.936 -15.148 4.723 219 HG2 GLU 28 HG2 GLU 28 -2.769 -17.860 5.188 220 HG3 GLU 28 HG1 GLU 28 -3.497 -16.924 6.489 221 H VAL 29 H VAL 29 -2.286 -13.577 2.656 222 HA VAL 29 HA VAL 29 -4.787 -12.930 1.537 223 HB VAL 29 HB VAL 29 -2.084 -11.616 1.153 224 HG11 VAL 29 HG11 VAL 29 -4.806 -10.606 0.326 225 HG12 VAL 29 HG12 VAL 29 -3.503 -11.092 -0.759 226 HG13 VAL 29 HG13 VAL 29 -3.308 -9.675 0.274 227 HG21 VAL 29 HG21 VAL 29 -4.470 -10.863 2.844 228 HG22 VAL 29 HG22 VAL 29 -2.986 -9.923 2.686 229 HG23 VAL 29 HG23 VAL 29 -2.942 -11.520 3.431 230 H VAL 30 H VAL 30 -1.697 -13.740 -0.026 231 HA VAL 30 HA VAL 30 -2.659 -13.626 -2.669 232 HB VAL 30 HB VAL 30 -0.400 -15.336 -1.593 233 HG11 VAL 30 HG11 VAL 30 -0.944 -14.362 -4.398 234 HG12 VAL 30 HG12 VAL 30 -1.120 -16.021 -3.829 235 HG13 VAL 30 HG13 VAL 30 0.475 -15.269 -3.880 236 HG21 VAL 30 HG21 VAL 30 1.062 -13.483 -2.283 237 HG22 VAL 30 HG22 VAL 30 -0.074 -12.996 -1.025 238 HG23 VAL 30 HG23 VAL 30 -0.363 -12.530 -2.702 239 H ALA 31 H ALA 31 -2.524 -16.224 -0.305 240 HA ALA 31 HA ALA 31 -3.289 -18.347 -1.937 241 HB1 ALA 31 HB1 ALA 31 -3.869 -17.962 0.992 242 HB2 ALA 31 HB2 ALA 31 -2.387 -18.634 0.313 243 HB3 ALA 31 HB3 ALA 31 -3.917 -19.491 0.115 244 H LYS 32 H LYS 32 -5.327 -16.280 0.129 245 HA LYS 32 HA LYS 32 -7.746 -17.528 -0.707 246 HB2 LYS 32 HB2 LYS 32 -8.881 -15.692 0.459 247 HB3 LYS 32 HB1 LYS 32 -7.617 -16.408 1.440 248 HG2 LYS 32 HG2 LYS 32 -6.131 -14.537 0.841 249 HG3 LYS 32 HG1 LYS 32 -7.446 -13.820 -0.084 250 HD2 LYS 32 HD2 LYS 32 -7.561 -12.687 1.929 251 HD3 LYS 32 HD1 LYS 32 -8.766 -13.954 2.132 252 HE2 LYS 32 HE2 LYS 32 -5.921 -14.153 3.141 253 HE3 LYS 32 HE1 LYS 32 -7.270 -13.595 4.123 254 HZ1 LYS 32 HZ1 LYS 32 -7.020 -16.289 2.888 255 HZ2 LYS 32 HZ2 LYS 32 -8.323 -15.755 3.820 256 HZ3 LYS 32 HZ3 LYS 32 -6.794 -15.930 4.520 257 H ARG 33 H ARG 33 -5.941 -14.746 -1.825 258 HA ARG 33 HA ARG 33 -7.992 -13.585 -3.377 259 HB2 ARG 33 HB2 ARG 33 -5.867 -12.463 -2.603 260 HB3 ARG 33 HB1 ARG 33 -5.023 -13.360 -3.864 261 HG2 ARG 33 HG2 ARG 33 -6.206 -12.218 -5.582 262 HG3 ARG 33 HG1 ARG 33 -7.308 -11.480 -4.418 263 HD2 ARG 33 HD2 ARG 33 -5.447 -10.239 -3.437 264 HD3 ARG 33 HD1 ARG 33 -4.335 -10.989 -4.579 265 HE ARG 33 HE ARG 33 -5.629 -9.835 -6.360 266 HH11 ARG 33 HH11 ARG 33 -5.732 -8.568 -3.074 267 HH12 ARG 33 HH12 ARG 33 -6.050 -6.948 -3.568 268 HH21 ARG 33 HH21 ARG 33 -6.042 -7.667 -7.010 269 HH22 ARG 33 HH22 ARG 33 -6.219 -6.429 -5.818 270 H GLN 34 H GLN 34 -5.695 -16.136 -3.984 271 HA GLN 34 HA GLN 34 -6.488 -16.231 -6.805 272 HB2 GLN 34 HB2 GLN 34 -4.172 -17.484 -5.340 273 HB3 GLN 34 HB1 GLN 34 -4.538 -17.782 -7.037 274 HG2 GLN 34 HG2 GLN 34 -4.054 -15.043 -5.914 275 HG3 GLN 34 HG1 GLN 34 -2.772 -16.042 -6.579 276 HE21 GLN 34 HE21 GLN 34 -5.636 -14.204 -7.271 277 HE22 GLN 34 HE22 GLN 34 -5.428 -14.141 -8.983 278 H GLY 35 H GLY 35 -7.281 -17.626 -3.905 279 HA2 GLY 35 HA2 GLY 35 -8.691 -19.372 -3.407 280 HA3 GLY 35 HA1 GLY 35 -8.918 -19.610 -5.134 281 H VAL 36 H VAL 36 -6.198 -19.878 -2.876 282 HA VAL 36 HA VAL 36 -5.860 -22.673 -3.681 283 HB VAL 36 HB VAL 36 -3.444 -22.430 -3.911 284 HG11 VAL 36 HG11 VAL 36 -3.318 -21.088 -5.939 285 HG12 VAL 36 HG12 VAL 36 -4.864 -20.339 -5.551 286 HG13 VAL 36 HG13 VAL 36 -4.785 -22.063 -5.912 287 HG21 VAL 36 HG21 VAL 36 -2.322 -20.273 -3.800 288 HG22 VAL 36 HG22 VAL 36 -3.133 -20.617 -2.268 289 HG23 VAL 36 HG23 VAL 36 -3.849 -19.484 -3.415 290 HA PRO 37 HA PRO 37 -5.346 -23.273 0.668 291 HB2 PRO 37 HB2 PRO 37 -3.723 -25.446 0.745 292 HB3 PRO 37 HB1 PRO 37 -5.421 -25.544 0.263 293 HG2 PRO 37 HG2 PRO 37 -2.972 -25.428 -1.455 294 HG3 PRO 37 HG1 PRO 37 -4.405 -26.456 -1.623 295 HD2 PRO 37 HD2 PRO 37 -4.034 -24.217 -3.096 296 HD3 PRO 37 HD1 PRO 37 -5.645 -24.775 -2.602 297 H ALA 38 H ALA 38 -4.198 -21.881 1.862 298 HA ALA 38 HA ALA 38 -1.607 -20.973 1.228 299 HB1 ALA 38 HB1 ALA 38 -3.056 -20.795 3.876 300 HB2 ALA 38 HB2 ALA 38 -3.195 -19.645 2.546 301 HB3 ALA 38 HB3 ALA 38 -1.661 -19.831 3.389 302 H ASP 39 H ASP 39 -2.774 -23.572 3.223 303 HA ASP 39 HA ASP 39 -0.415 -24.130 4.668 304 HB2 ASP 39 HB2 ASP 39 -2.666 -25.071 5.191 305 HB3 ASP 39 HB1 ASP 39 -2.529 -26.100 3.773 306 H GLN 40 H GLN 40 -1.538 -25.110 1.493 307 HA GLN 40 HA GLN 40 0.895 -26.696 1.116 308 HB2 GLN 40 HB2 GLN 40 -1.613 -26.650 -0.572 309 HB3 GLN 40 HB1 GLN 40 -0.258 -27.758 -0.748 310 HG2 GLN 40 HG2 GLN 40 -0.718 -28.570 1.563 311 HG3 GLN 40 HG1 GLN 40 -2.172 -27.582 1.562 312 HE21 GLN 40 HE21 GLN 40 -1.840 -30.429 1.835 313 HE22 GLN 40 HE22 GLN 40 -2.769 -31.168 0.581 314 H LEU 41 H LEU 41 0.468 -23.719 0.978 315 HA LEU 41 HA LEU 41 1.346 -23.193 -1.770 316 HB2 LEU 41 HB2 LEU 41 -0.519 -21.849 -0.843 317 HB3 LEU 41 HB1 LEU 41 0.531 -21.298 0.443 318 HG LEU 41 HG LEU 41 1.965 -20.197 -1.278 319 HD11 LEU 41 HD11 LEU 41 1.032 -19.851 -3.500 320 HD12 LEU 41 HD12 LEU 41 -0.298 -20.946 -3.116 321 HD13 LEU 41 HD13 LEU 41 1.356 -21.556 -3.190 322 HD21 LEU 41 HD21 LEU 41 -0.930 -19.356 -1.209 323 HD22 LEU 41 HD22 LEU 41 0.429 -18.334 -1.675 324 HD23 LEU 41 HD23 LEU 41 0.303 -18.934 -0.021 325 H ARG 42 H ARG 42 3.316 -21.999 -2.112 326 HA ARG 42 HA ARG 42 5.105 -21.872 0.225 327 HB2 ARG 42 HB2 ARG 42 5.608 -23.848 -1.199 328 HB3 ARG 42 HB1 ARG 42 5.917 -22.748 -2.538 329 HG2 ARG 42 HG2 ARG 42 7.555 -21.642 -0.801 330 HG3 ARG 42 HG1 ARG 42 7.514 -23.258 -0.095 331 HD2 ARG 42 HD2 ARG 42 8.217 -22.537 -2.915 332 HD3 ARG 42 HD1 ARG 42 9.345 -23.042 -1.658 333 HE ARG 42 HE ARG 42 7.235 -24.794 -2.764 334 HH11 ARG 42 HH11 ARG 42 10.475 -24.330 -1.487 335 HH12 ARG 42 HH12 ARG 42 10.948 -25.970 -1.741 336 HH21 ARG 42 HH21 ARG 42 7.860 -26.980 -3.089 337 HH22 ARG 42 HH22 ARG 42 9.453 -27.483 -2.661 338 H VAL 43 H VAL 43 6.331 -20.056 0.367 339 HA VAL 43 HA VAL 43 6.221 -18.256 -1.940 340 HB VAL 43 HB VAL 43 6.267 -16.316 -0.414 341 HG11 VAL 43 HG11 VAL 43 4.002 -18.220 0.153 342 HG12 VAL 43 HG12 VAL 43 4.116 -17.116 -1.215 343 HG13 VAL 43 HG13 VAL 43 3.971 -16.479 0.422 344 HG21 VAL 43 HG21 VAL 43 5.936 -18.337 1.807 345 HG22 VAL 43 HG22 VAL 43 5.871 -16.585 1.983 346 HG23 VAL 43 HG23 VAL 43 7.376 -17.368 1.504 347 H ILE 44 H ILE 44 8.065 -17.573 -2.743 348 HA ILE 44 HA ILE 44 10.516 -17.878 -1.140 349 HB ILE 44 HB ILE 44 10.147 -18.376 -4.110 350 HG12 ILE 44 HG12 ILE 44 9.404 -20.241 -2.685 351 HG13 ILE 44 HG11 ILE 44 10.835 -20.671 -3.613 352 HG21 ILE 44 HG21 ILE 44 12.530 -18.929 -4.182 353 HG22 ILE 44 HG22 ILE 44 12.691 -18.454 -2.492 354 HG23 ILE 44 HG23 ILE 44 12.267 -17.249 -3.708 355 HD11 ILE 44 HD11 ILE 44 10.755 -19.913 -0.699 356 HD12 ILE 44 HD12 ILE 44 12.216 -20.272 -1.617 357 HD13 ILE 44 HD13 ILE 44 11.004 -21.527 -1.365 358 H PHE 45 H PHE 45 11.765 -16.110 -1.027 359 HA PHE 45 HA PHE 45 11.289 -13.943 -2.941 360 HB2 PHE 45 HB2 PHE 45 10.033 -13.387 -0.931 361 HB3 PHE 45 HB1 PHE 45 11.463 -13.653 0.060 362 HD1 PHE 45 HD1 PHE 45 10.180 -11.565 -2.716 363 HD2 PHE 45 HD2 PHE 45 12.891 -11.893 0.536 364 HE1 PHE 45 HE1 PHE 45 10.791 -9.207 -2.995 365 HE2 PHE 45 HE2 PHE 45 13.506 -9.528 0.274 366 HZ PHE 45 HZ PHE 45 12.454 -8.182 -1.496 367 H ALA 46 H ALA 46 13.105 -13.319 -3.849 368 HA ALA 46 HA ALA 46 15.289 -12.887 -4.267 369 HB1 ALA 46 HB1 ALA 46 15.148 -11.454 -2.298 370 HB2 ALA 46 HB2 ALA 46 16.733 -12.221 -2.406 371 HB3 ALA 46 HB3 ALA 46 15.539 -12.827 -1.260 372 H GLY 47 H GLY 47 14.281 -15.673 -3.798 373 HA2 GLY 47 HA2 GLY 47 15.339 -17.704 -4.276 374 HA3 GLY 47 HA1 GLY 47 16.887 -16.948 -3.929 375 H LYS 48 H LYS 48 14.608 -16.370 -1.497 376 HA LYS 48 HA LYS 48 15.345 -18.753 0.032 377 HB2 LYS 48 HB2 LYS 48 15.899 -17.340 2.000 378 HB3 LYS 48 HB1 LYS 48 17.045 -17.198 0.674 379 HG2 LYS 48 HG2 LYS 48 16.415 -15.051 0.174 380 HG3 LYS 48 HG1 LYS 48 14.806 -15.250 0.865 381 HD2 LYS 48 HD2 LYS 48 15.603 -15.096 3.052 382 HD3 LYS 48 HD1 LYS 48 17.289 -15.297 2.545 383 HE2 LYS 48 HE2 LYS 48 15.505 -12.940 1.910 384 HE3 LYS 48 HE1 LYS 48 16.771 -12.962 3.134 385 HZ1 LYS 48 HZ1 LYS 48 17.181 -13.290 0.206 386 HZ2 LYS 48 HZ2 LYS 48 18.397 -13.359 1.368 387 HZ3 LYS 48 HZ3 LYS 48 17.557 -11.917 1.117 388 H GLU 49 H GLU 49 14.244 -18.424 2.345 389 HA GLU 49 HA GLU 49 11.493 -17.555 1.818 390 HB2 GLU 49 HB2 GLU 49 10.785 -19.163 3.530 391 HB3 GLU 49 HB1 GLU 49 11.667 -19.963 2.240 392 HG2 GLU 49 HG2 GLU 49 13.651 -20.072 3.632 393 HG3 GLU 49 HG1 GLU 49 12.813 -19.205 4.919 394 H LEU 50 H LEU 50 10.550 -16.153 3.203 395 HA LEU 50 HA LEU 50 12.297 -14.785 5.075 396 HB2 LEU 50 HB2 LEU 50 9.476 -14.122 4.250 397 HB3 LEU 50 HB1 LEU 50 10.547 -13.097 5.181 398 HG LEU 50 HG LEU 50 10.873 -13.889 2.304 399 HD11 LEU 50 HD11 LEU 50 10.543 -11.510 1.872 400 HD12 LEU 50 HD12 LEU 50 10.255 -11.242 3.590 401 HD13 LEU 50 HD13 LEU 50 9.140 -12.239 2.653 402 HD21 LEU 50 HD21 LEU 50 13.053 -13.739 3.318 403 HD22 LEU 50 HD22 LEU 50 12.625 -12.215 4.094 404 HD23 LEU 50 HD23 LEU 50 12.784 -12.296 2.343 405 H ARG 51 H ARG 51 11.375 -14.090 7.165 406 HA ARG 51 HA ARG 51 10.263 -16.295 8.594 407 HB2 ARG 51 HB2 ARG 51 10.337 -14.877 10.560 408 HB3 ARG 51 HB1 ARG 51 11.832 -14.658 9.663 409 HG2 ARG 51 HG2 ARG 51 9.596 -12.772 9.149 410 HG3 ARG 51 HG1 ARG 51 10.481 -12.630 10.667 411 HD2 ARG 51 HD2 ARG 51 11.925 -12.776 8.045 412 HD3 ARG 51 HD1 ARG 51 11.267 -11.252 8.633 413 HE ARG 51 HE ARG 51 12.781 -12.429 10.677 414 HH11 ARG 51 HH11 ARG 51 13.277 -11.039 7.511 415 HH12 ARG 51 HH12 ARG 51 14.805 -10.338 7.903 416 HH21 ARG 51 HH21 ARG 51 14.817 -11.531 11.213 417 HH22 ARG 51 HH22 ARG 51 15.699 -10.625 10.029 418 H ASN 52 H ASN 52 8.183 -16.489 9.419 419 HA ASN 52 HA ASN 52 6.161 -15.327 7.761 420 HB2 ASN 52 HB2 ASN 52 5.950 -17.109 10.191 421 HB3 ASN 52 HB1 ASN 52 4.597 -16.663 9.165 422 HD21 ASN 52 HD21 ASN 52 5.820 -19.266 9.800 423 HD22 ASN 52 HD22 ASN 52 6.203 -19.974 8.269 424 H ASP 53 H ASP 53 7.480 -14.597 10.863 425 HA ASP 53 HA ASP 53 5.193 -12.897 11.507 426 HB2 ASP 53 HB2 ASP 53 7.414 -13.917 13.279 427 HB3 ASP 53 HB1 ASP 53 6.155 -12.806 13.806 428 H TRP 54 H TRP 54 6.190 -11.513 9.734 429 HA TRP 54 HA TRP 54 7.399 -9.272 11.062 430 HB2 TRP 54 HB2 TRP 54 9.358 -10.761 10.435 431 HB3 TRP 54 HB1 TRP 54 8.953 -10.449 8.753 432 HD1 TRP 54 HD1 TRP 54 10.648 -8.779 7.832 433 HE1 TRP 54 HE1 TRP 54 11.760 -6.617 8.651 434 HE3 TRP 54 HE3 TRP 54 8.641 -8.583 12.534 435 HZ2 TRP 54 HZ2 TRP 54 11.768 -5.019 10.998 436 HZ3 TRP 54 HZ3 TRP 54 9.251 -6.704 13.996 437 HH2 TRP 54 HH2 TRP 54 10.782 -4.961 13.242 438 H THR 55 H THR 55 7.297 -7.344 9.828 439 HA THR 55 HA THR 55 5.090 -7.285 8.029 440 HB THR 55 HB THR 55 5.376 -5.436 9.555 441 HG1 THR 55 HG1 THR 55 4.980 -3.841 8.108 442 HG21 THR 55 HG21 THR 55 7.991 -4.891 8.136 443 HG22 THR 55 HG22 THR 55 7.813 -5.476 9.791 444 HG23 THR 55 HG23 THR 55 7.252 -3.861 9.361 445 H VAL 56 H VAL 56 5.007 -6.850 5.888 446 HA VAL 56 HA VAL 56 7.204 -7.662 4.278 447 HB VAL 56 HB VAL 56 4.853 -8.126 3.665 448 HG11 VAL 56 HG11 VAL 56 4.652 -5.163 3.148 449 HG12 VAL 56 HG12 VAL 56 3.831 -6.056 4.427 450 HG13 VAL 56 HG13 VAL 56 3.431 -6.368 2.738 451 HG21 VAL 56 HG21 VAL 56 6.336 -6.442 1.651 452 HG22 VAL 56 HG22 VAL 56 5.002 -7.535 1.279 453 HG23 VAL 56 HG23 VAL 56 6.518 -8.176 1.913 454 H GLN 57 H GLN 57 6.028 -4.615 5.416 455 HA GLN 57 HA GLN 57 6.944 -2.889 3.424 456 HB2 GLN 57 HB2 GLN 57 5.445 -2.180 5.225 457 HB3 GLN 57 HB1 GLN 57 6.740 -2.385 6.394 458 HG2 GLN 57 HG2 GLN 57 6.551 -0.064 5.944 459 HG3 GLN 57 HG1 GLN 57 8.027 -0.631 5.162 460 HE21 GLN 57 HE21 GLN 57 8.065 1.050 3.688 461 HE22 GLN 57 HE22 GLN 57 6.939 1.170 2.386 462 H ASN 58 H ASN 58 8.612 -4.197 6.256 463 HA ASN 58 HA ASN 58 11.015 -2.701 5.586 464 HB2 ASN 58 HB2 ASN 58 10.195 -3.049 7.974 465 HB3 ASN 58 HB1 ASN 58 10.713 -4.723 7.814 466 HD21 ASN 58 HD21 ASN 58 12.231 -4.465 9.470 467 HD22 ASN 58 HD22 ASN 58 13.702 -3.598 9.240 468 H CYS 59 H CYS 59 9.672 -5.472 4.484 469 HA CYS 59 HA CYS 59 12.199 -6.914 4.215 470 HB2 CYS 59 HB2 CYS 59 9.379 -7.706 3.468 471 HB3 CYS 59 HB1 CYS 59 10.797 -8.717 3.225 472 HG CYS 59 HG CYS 59 9.243 -7.889 6.132 473 H ASP 60 H ASP 60 10.156 -4.802 2.501 474 HA ASP 60 HA ASP 60 10.251 -3.822 0.454 475 HB2 ASP 60 HB2 ASP 60 13.101 -4.820 0.532 476 HB3 ASP 60 HB1 ASP 60 12.475 -3.662 -0.633 477 H LEU 61 H LEU 61 8.881 -6.030 0.144 478 HA LEU 61 HA LEU 61 10.018 -7.803 -1.807 479 HB2 LEU 61 HB2 LEU 61 7.320 -7.528 -0.558 480 HB3 LEU 61 HB1 LEU 61 7.484 -8.480 -2.017 481 HG LEU 61 HG LEU 61 9.135 -9.921 -0.873 482 HD11 LEU 61 HD11 LEU 61 9.329 -9.782 1.570 483 HD12 LEU 61 HD12 LEU 61 8.462 -8.245 1.525 484 HD13 LEU 61 HD13 LEU 61 10.029 -8.398 0.733 485 HD21 LEU 61 HD21 LEU 61 7.541 -11.036 0.638 486 HD22 LEU 61 HD22 LEU 61 6.832 -10.616 -0.920 487 HD23 LEU 61 HD23 LEU 61 6.470 -9.642 0.503 488 H ASP 62 H ASP 62 9.048 -4.728 -2.063 489 HA ASP 62 HA ASP 62 7.986 -5.002 -4.785 490 HB2 ASP 62 HB2 ASP 62 7.170 -2.774 -4.566 491 HB3 ASP 62 HB1 ASP 62 6.773 -3.592 -3.057 492 H GLN 63 H GLN 63 10.850 -4.531 -3.157 493 HA GLN 63 HA GLN 63 11.961 -2.898 -5.340 494 HB2 GLN 63 HB2 GLN 63 11.949 -1.684 -3.225 495 HB3 GLN 63 HB1 GLN 63 12.839 -2.989 -2.458 496 HG2 GLN 63 HG2 GLN 63 14.727 -2.570 -3.962 497 HG3 GLN 63 HG1 GLN 63 13.840 -1.230 -4.683 498 HE21 GLN 63 HE21 GLN 63 15.365 0.271 -4.085 499 HE22 GLN 63 HE22 GLN 63 15.584 0.774 -2.445 500 H GLN 64 H GLN 64 12.969 -5.269 -2.870 501 HA GLN 64 HA GLN 64 15.309 -5.928 -4.412 502 HB2 GLN 64 HB2 GLN 64 14.224 -7.226 -1.910 503 HB3 GLN 64 HB1 GLN 64 15.810 -7.505 -2.609 504 HG2 GLN 64 HG2 GLN 64 14.795 -4.930 -1.424 505 HG3 GLN 64 HG1 GLN 64 15.985 -6.022 -0.719 506 HE21 GLN 64 HE21 GLN 64 16.237 -3.216 -1.363 507 HE22 GLN 64 HE22 GLN 64 17.546 -3.081 -2.485 508 H SEP 65 H SEP 65 14.932 -7.007 -6.249 509 HA SEP 65 HA SEP 65 14.320 -8.663 -7.686 510 HB2 SEP 65 HB1 SEP 65 14.115 -10.955 -6.750 511 HB3 SEP 65 HB2 SEP 65 14.075 -10.275 -5.124 512 H ILE 66 H ILE 66 12.418 -10.822 -7.038 513 HA ILE 66 HA ILE 66 9.961 -9.353 -6.576 514 HB ILE 66 HB ILE 66 10.355 -9.449 -9.054 515 HG12 ILE 66 HG12 ILE 66 8.032 -11.180 -8.248 516 HG13 ILE 66 HG11 ILE 66 8.069 -9.440 -7.991 517 HG21 ILE 66 HG21 ILE 66 10.042 -12.410 -8.674 518 HG22 ILE 66 HG22 ILE 66 11.537 -11.582 -9.126 519 HG23 ILE 66 HG23 ILE 66 10.145 -11.564 -10.216 520 HD11 ILE 66 HD11 ILE 66 6.839 -10.062 -10.003 521 HD12 ILE 66 HD12 ILE 66 8.299 -10.816 -10.648 522 HD13 ILE 66 HD13 ILE 66 8.253 -9.075 -10.375 523 H VAL 67 H VAL 67 8.194 -10.784 -5.961 524 HA VAL 67 HA VAL 67 9.186 -12.976 -4.368 525 HB VAL 67 HB VAL 67 6.299 -12.247 -4.722 526 HG11 VAL 67 HG11 VAL 67 6.101 -13.051 -2.419 527 HG12 VAL 67 HG12 VAL 67 7.831 -13.394 -2.395 528 HG13 VAL 67 HG13 VAL 67 6.770 -14.286 -3.485 529 HG21 VAL 67 HG21 VAL 67 8.233 -10.914 -2.832 530 HG22 VAL 67 HG22 VAL 67 6.494 -10.631 -2.919 531 HG23 VAL 67 HG23 VAL 67 7.530 -10.176 -4.269 532 H HIS 68 H HIS 68 9.103 -15.059 -4.878 533 HA HIS 68 HA HIS 68 7.577 -15.858 -7.260 534 HB2 HIS 68 HB2 HIS 68 10.027 -17.051 -5.951 535 HB3 HIS 68 HB1 HIS 68 9.090 -17.912 -7.163 536 HD2 HIS 68 HD2 HIS 68 10.305 -14.154 -7.360 537 HE1 HIS 68 HE1 HIS 68 11.904 -16.374 -10.587 538 HE2 HIS 68 HE2 HIS 68 11.982 -14.180 -9.332 539 H ILE 69 H ILE 69 5.668 -16.660 -6.688 540 HA ILE 69 HA ILE 69 5.565 -18.336 -4.274 541 HB ILE 69 HB ILE 69 3.357 -16.631 -5.456 542 HG12 ILE 69 HG12 ILE 69 4.962 -16.388 -2.903 543 HG13 ILE 69 HG11 ILE 69 4.996 -15.293 -4.278 544 HG21 ILE 69 HG21 ILE 69 3.325 -18.426 -3.030 545 HG22 ILE 69 HG22 ILE 69 2.455 -18.694 -4.541 546 HG23 ILE 69 HG23 ILE 69 2.030 -17.327 -3.511 547 HD11 ILE 69 HD11 ILE 69 3.721 -14.358 -2.437 548 HD12 ILE 69 HD12 ILE 69 2.648 -15.757 -2.453 549 HD13 ILE 69 HD13 ILE 69 2.682 -14.657 -3.828 550 H VAL 70 H VAL 70 4.920 -20.362 -4.500 551 HA VAL 70 HA VAL 70 3.501 -21.122 -6.941 552 HB VAL 70 HB VAL 70 5.937 -21.590 -7.238 553 HG11 VAL 70 HG11 VAL 70 6.560 -22.061 -4.955 554 HG12 VAL 70 HG12 VAL 70 6.976 -23.425 -5.993 555 HG13 VAL 70 HG13 VAL 70 5.552 -23.509 -4.954 556 HG21 VAL 70 HG21 VAL 70 5.669 -23.908 -8.014 557 HG22 VAL 70 HG22 VAL 70 4.293 -22.895 -8.458 558 HG23 VAL 70 HG23 VAL 70 4.158 -24.022 -7.109 559 H GLN 71 H GLN 71 2.185 -22.967 -6.713 560 HA GLN 71 HA GLN 71 1.641 -23.667 -3.910 561 HB2 GLN 71 HB2 GLN 71 -0.651 -24.181 -4.636 562 HB3 GLN 71 HB1 GLN 71 -0.224 -22.505 -4.951 563 HG2 GLN 71 HG2 GLN 71 0.064 -22.941 -7.281 564 HG3 GLN 71 HG1 GLN 71 -0.107 -24.675 -7.030 565 HE21 GLN 71 HE21 GLN 71 -2.300 -24.330 -5.139 566 HE22 GLN 71 HE22 GLN 71 -3.684 -23.925 -6.080 567 H ARG 72 H ARG 72 0.982 -25.830 -3.463 568 HA ARG 72 HA ARG 72 1.336 -27.805 -5.560 569 HB2 ARG 72 HB2 ARG 72 3.556 -27.408 -4.293 570 HB3 ARG 72 HB1 ARG 72 2.763 -28.183 -2.932 571 HG2 ARG 72 HG2 ARG 72 4.153 -29.749 -4.184 572 HG3 ARG 72 HG1 ARG 72 2.448 -30.208 -4.245 573 HD2 ARG 72 HD2 ARG 72 2.220 -29.410 -6.465 574 HD3 ARG 72 HD1 ARG 72 3.772 -28.580 -6.402 575 HE ARG 72 HE ARG 72 4.661 -30.987 -6.141 576 HH11 ARG 72 HH11 ARG 72 1.899 -30.066 -8.106 577 HH12 ARG 72 HH12 ARG 72 2.170 -31.292 -9.293 578 HH21 ARG 72 HH21 ARG 72 5.007 -32.631 -7.722 579 HH22 ARG 72 HH22 ARG 72 3.921 -32.763 -9.060 580 HA PRO 73 HA PRO 73 -2.062 -28.641 -2.623 581 HB2 PRO 73 HB2 PRO 73 -4.039 -28.512 -4.570 582 HB3 PRO 73 HB1 PRO 73 -3.563 -27.194 -3.495 583 HG2 PRO 73 HG2 PRO 73 -3.222 -27.337 -6.317 584 HG3 PRO 73 HG1 PRO 73 -2.632 -26.079 -5.223 585 HD2 PRO 73 HD2 PRO 73 -1.201 -28.388 -6.398 586 HD3 PRO 73 HD1 PRO 73 -0.566 -26.819 -5.853 587 H TRP 74 H TRP 74 -2.273 -30.691 -2.125 588 HA TRP 74 HA TRP 74 -2.562 -32.671 -4.267 589 HB2 TRP 74 HB2 TRP 74 -0.804 -33.033 -2.510 590 HB3 TRP 74 HB1 TRP 74 -2.087 -33.155 -1.314 591 HD1 TRP 74 HD1 TRP 74 -0.384 -35.108 -4.091 592 HE1 TRP 74 HE1 TRP 74 -1.221 -37.540 -4.051 593 HE3 TRP 74 HE3 TRP 74 -4.179 -34.618 -0.696 594 HZ2 TRP 74 HZ2 TRP 74 -3.220 -39.043 -2.758 595 HZ3 TRP 74 HZ3 TRP 74 -5.502 -36.602 -0.115 596 HH2 TRP 74 HH2 TRP 74 -5.033 -38.767 -1.126 597 H ARG 75 H ARG 75 -4.160 -31.225 -1.544 598 HA ARG 75 HA ARG 75 -6.451 -33.019 -1.849 599 HB2 ARG 75 HB2 ARG 75 -7.272 -32.008 0.256 600 HB3 ARG 75 HB1 ARG 75 -5.694 -32.761 0.428 601 HG2 ARG 75 HG2 ARG 75 -4.640 -30.545 0.286 602 HG3 ARG 75 HG1 ARG 75 -6.238 -29.810 0.156 603 HD2 ARG 75 HD2 ARG 75 -5.347 -29.702 2.445 604 HD3 ARG 75 HD1 ARG 75 -6.833 -30.644 2.353 605 HE ARG 75 HE ARG 75 -5.012 -32.571 2.158 606 HH11 ARG 75 HH11 ARG 75 -5.133 -29.836 4.355 607 HH12 ARG 75 HH12 ARG 75 -4.323 -30.668 5.633 608 HH21 ARG 75 HH21 ARG 75 -3.985 -33.682 3.864 609 HH22 ARG 75 HH22 ARG 75 -3.681 -32.872 5.363 610 H LYS 76 H LYS 76 -5.495 -30.484 -3.403 611 HA LYS 76 HA LYS 76 -8.202 -29.394 -3.681 612 HB2 LYS 76 HB2 LYS 76 -5.642 -27.773 -3.698 613 HB3 LYS 76 HB1 LYS 76 -7.228 -27.148 -4.113 614 HG2 LYS 76 HG2 LYS 76 -6.429 -28.237 -1.420 615 HG3 LYS 76 HG1 LYS 76 -6.550 -26.530 -1.845 616 HD2 LYS 76 HD2 LYS 76 -8.931 -26.798 -2.291 617 HD3 LYS 76 HD1 LYS 76 -8.816 -28.519 -1.917 618 HE2 LYS 76 HE2 LYS 76 -8.049 -27.916 0.362 619 HE3 LYS 76 HE1 LYS 76 -8.327 -26.221 -0.029 620 HZ1 LYS 76 HZ1 LYS 76 -10.186 -27.195 1.182 621 HZ2 LYS 76 HZ2 LYS 76 -10.406 -28.345 -0.033 622 HZ3 LYS 76 HZ3 LYS 76 -10.663 -26.709 -0.365 Start of MODEL 23 1 H1 MET 1 HT1 MET 1 2.395 -1.884 0.894 2 H2 MET 1 HT2 MET 1 0.782 -1.428 0.685 3 H3 MET 1 HT3 MET 1 1.901 -0.320 1.299 4 HA MET 1 HA MET 1 1.444 0.190 -0.975 5 HB2 MET 1 HB2 MET 1 3.711 0.242 -1.811 6 HB3 MET 1 HB1 MET 1 3.744 0.524 -0.079 7 HG2 MET 1 HG2 MET 1 4.338 -2.112 -1.410 8 HG3 MET 1 HG1 MET 1 5.556 -0.956 -0.871 9 HE1 MET 1 HE1 MET 1 6.809 -2.712 0.610 10 HE2 MET 1 HE2 MET 1 5.701 -3.954 0.027 11 HE3 MET 1 HE3 MET 1 6.009 -3.789 1.756 12 H ILE 2 H ILE 2 2.483 -0.643 -3.247 13 HA ILE 2 HA ILE 2 1.117 -3.170 -3.750 14 HB ILE 2 HB ILE 2 2.241 -1.062 -5.605 15 HG12 ILE 2 HG12 ILE 2 0.091 -0.588 -4.407 16 HG13 ILE 2 HG11 ILE 2 -0.041 -0.573 -6.163 17 HG21 ILE 2 HG21 ILE 2 1.288 -2.340 -7.471 18 HG22 ILE 2 HG22 ILE 2 0.887 -3.645 -6.355 19 HG23 ILE 2 HG23 ILE 2 2.573 -3.224 -6.650 20 HD11 ILE 2 HD11 ILE 2 -0.872 -2.802 -4.328 21 HD12 ILE 2 HD12 ILE 2 -0.990 -2.823 -6.085 22 HD13 ILE 2 HD13 ILE 2 -1.941 -1.668 -5.150 23 H VAL 3 H VAL 3 2.224 -5.034 -3.886 24 HA VAL 3 HA VAL 3 5.085 -4.906 -4.602 25 HB VAL 3 HB VAL 3 5.444 -6.993 -3.382 26 HG11 VAL 3 HG11 VAL 3 5.795 -5.032 -2.092 27 HG12 VAL 3 HG12 VAL 3 4.984 -6.208 -1.062 28 HG13 VAL 3 HG13 VAL 3 4.072 -4.868 -1.756 29 HG21 VAL 3 HG21 VAL 3 3.240 -8.005 -3.706 30 HG22 VAL 3 HG22 VAL 3 2.538 -6.841 -2.580 31 HG23 VAL 3 HG23 VAL 3 3.722 -8.020 -2.011 32 H PHE 4 H PHE 4 5.876 -6.737 -5.884 33 HA PHE 4 HA PHE 4 3.780 -7.656 -7.714 34 HB2 PHE 4 HB2 PHE 4 6.766 -7.416 -8.094 35 HB3 PHE 4 HB1 PHE 4 5.684 -8.147 -9.273 36 HD1 PHE 4 HD1 PHE 4 7.234 -5.173 -8.241 37 HD2 PHE 4 HD2 PHE 4 3.675 -6.668 -10.017 38 HE1 PHE 4 HE1 PHE 4 6.778 -2.950 -9.194 39 HE2 PHE 4 HE2 PHE 4 3.213 -4.454 -10.980 40 HZ PHE 4 HZ PHE 4 4.765 -2.589 -10.567 41 H VAL 5 H VAL 5 3.309 -9.754 -7.967 42 HA VAL 5 HA VAL 5 5.040 -11.727 -6.640 43 HB VAL 5 HB VAL 5 2.029 -11.551 -6.328 44 HG11 VAL 5 HG11 VAL 5 3.971 -13.533 -5.161 45 HG12 VAL 5 HG12 VAL 5 2.766 -13.861 -6.410 46 HG13 VAL 5 HG13 VAL 5 2.254 -13.416 -4.780 47 HG21 VAL 5 HG21 VAL 5 3.159 -9.889 -4.991 48 HG22 VAL 5 HG22 VAL 5 4.240 -11.115 -4.337 49 HG23 VAL 5 HG23 VAL 5 2.519 -11.160 -3.950 50 H ARG 6 H ARG 6 5.189 -13.676 -7.613 51 HA ARG 6 HA ARG 6 3.587 -14.146 -10.047 52 HB2 ARG 6 HB2 ARG 6 6.346 -15.203 -9.384 53 HB3 ARG 6 HB1 ARG 6 5.457 -15.505 -10.868 54 HG2 ARG 6 HG2 ARG 6 5.530 -13.074 -11.336 55 HG3 ARG 6 HG1 ARG 6 6.558 -12.883 -9.914 56 HD2 ARG 6 HD2 ARG 6 7.932 -13.007 -11.914 57 HD3 ARG 6 HD1 ARG 6 8.195 -14.437 -10.918 58 HE ARG 6 HE ARG 6 6.174 -14.952 -12.822 59 HH11 ARG 6 HH11 ARG 6 9.650 -14.501 -12.633 60 HH12 ARG 6 HH12 ARG 6 9.979 -15.468 -14.025 61 HH21 ARG 6 HH21 ARG 6 6.614 -16.250 -14.662 62 HH22 ARG 6 HH22 ARG 6 8.248 -16.465 -15.190 63 H PHE 7 H PHE 7 2.168 -15.747 -9.825 64 HA PHE 7 HA PHE 7 2.570 -17.653 -7.636 65 HB2 PHE 7 HB2 PHE 7 0.457 -16.348 -7.691 66 HB3 PHE 7 HB1 PHE 7 0.058 -17.105 -9.229 67 HD1 PHE 7 HD1 PHE 7 0.484 -17.643 -5.631 68 HD2 PHE 7 HD2 PHE 7 -0.754 -19.354 -9.324 69 HE1 PHE 7 HE1 PHE 7 -0.558 -19.503 -4.415 70 HE2 PHE 7 HE2 PHE 7 -1.797 -21.220 -8.112 71 HZ PHE 7 HZ PHE 7 -1.696 -21.295 -5.655 72 H ASN 8 H ASN 8 3.472 -19.479 -8.173 73 HA ASN 8 HA ASN 8 4.078 -21.371 -9.256 74 HB2 ASN 8 HB2 ASN 8 1.588 -21.741 -8.982 75 HB3 ASN 8 HB1 ASN 8 1.402 -21.219 -10.653 76 HD21 ASN 8 HD21 ASN 8 0.600 -23.201 -11.287 77 HD22 ASN 8 HD22 ASN 8 1.592 -24.615 -11.422 78 H SER 9 H SER 9 5.204 -19.223 -10.345 79 HA SER 9 HA SER 9 6.501 -18.644 -12.091 80 HB2 SER 9 HB2 SER 9 6.846 -21.038 -12.464 81 HB3 SER 9 HB1 SER 9 5.383 -21.114 -13.443 82 HG SER 9 HG SER 9 6.435 -19.516 -14.819 83 H SER 10 H SER 10 3.375 -18.078 -12.011 84 HA SER 10 HA SER 10 2.717 -17.477 -14.694 85 HB2 SER 10 HB2 SER 10 1.019 -15.891 -13.651 86 HB3 SER 10 HB1 SER 10 0.905 -17.575 -13.142 87 HG SER 10 HG SER 10 1.470 -17.057 -11.210 88 H HIS 11 H HIS 11 2.277 -15.134 -15.399 89 HA HIS 11 HA HIS 11 4.679 -13.867 -15.862 90 HB2 HIS 11 HB2 HIS 11 1.922 -12.627 -15.864 91 HB3 HIS 11 HB1 HIS 11 3.350 -11.935 -16.627 92 HD2 HIS 11 HD2 HIS 11 4.251 -13.296 -18.928 93 HE1 HIS 11 HE1 HIS 11 0.674 -15.512 -19.361 94 HE2 HIS 11 HE2 HIS 11 2.935 -15.002 -20.368 95 H GLY 12 H GLY 12 2.137 -12.412 -13.822 96 HA2 GLY 12 HA2 GLY 12 3.370 -11.977 -11.494 97 HA3 GLY 12 HA1 GLY 12 4.161 -10.791 -12.523 98 H PHE 13 H PHE 13 2.047 -10.880 -10.237 99 HA PHE 13 HA PHE 13 0.369 -8.821 -11.461 100 HB2 PHE 13 HB2 PHE 13 -1.505 -9.667 -9.947 101 HB3 PHE 13 HB1 PHE 13 -1.114 -10.653 -11.348 102 HD1 PHE 13 HD1 PHE 13 -0.874 -10.399 -7.695 103 HD2 PHE 13 HD2 PHE 13 -0.237 -12.860 -11.102 104 HE1 PHE 13 HE1 PHE 13 -0.590 -12.352 -6.229 105 HE2 PHE 13 HE2 PHE 13 0.048 -14.816 -9.642 106 HZ PHE 13 HZ PHE 13 -0.131 -14.558 -7.198 107 HA PRO 14 HA PRO 14 1.587 -6.524 -7.908 108 HB2 PRO 14 HB2 PRO 14 -0.058 -4.419 -8.155 109 HB3 PRO 14 HB1 PRO 14 1.250 -4.717 -9.305 110 HG2 PRO 14 HG2 PRO 14 -1.673 -5.212 -9.588 111 HG3 PRO 14 HG1 PRO 14 -0.500 -4.673 -10.802 112 HD2 PRO 14 HD2 PRO 14 -1.443 -7.278 -10.499 113 HD3 PRO 14 HD1 PRO 14 0.021 -6.805 -11.380 114 H VAL 15 H VAL 15 1.128 -7.235 -5.938 115 HA VAL 15 HA VAL 15 -1.665 -7.512 -5.100 116 HB VAL 15 HB VAL 15 0.870 -8.583 -3.811 117 HG11 VAL 15 HG11 VAL 15 -0.629 -9.816 -2.317 118 HG12 VAL 15 HG12 VAL 15 -2.021 -9.013 -3.042 119 HG13 VAL 15 HG13 VAL 15 -0.838 -8.075 -2.131 120 HG21 VAL 15 HG21 VAL 15 0.021 -10.764 -4.496 121 HG22 VAL 15 HG22 VAL 15 0.289 -9.711 -5.883 122 HG23 VAL 15 HG23 VAL 15 -1.348 -9.987 -5.289 123 H GLU 16 H GLU 16 -2.538 -6.085 -3.795 124 HA GLU 16 HA GLU 16 -0.958 -3.934 -2.726 125 HB2 GLU 16 HB2 GLU 16 -3.117 -3.438 -3.714 126 HB3 GLU 16 HB1 GLU 16 -3.917 -4.524 -2.586 127 HG2 GLU 16 HG2 GLU 16 -3.275 -3.068 -0.735 128 HG3 GLU 16 HG1 GLU 16 -2.462 -1.994 -1.875 129 H VAL 17 H VAL 17 0.005 -4.014 -0.845 130 HA VAL 17 HA VAL 17 -1.225 -5.628 1.290 131 HB VAL 17 HB VAL 17 1.013 -6.019 2.221 132 HG11 VAL 17 HG11 VAL 17 0.759 -6.832 -0.668 133 HG12 VAL 17 HG12 VAL 17 0.120 -7.695 0.733 134 HG13 VAL 17 HG13 VAL 17 1.865 -7.554 0.501 135 HG21 VAL 17 HG21 VAL 17 2.016 -4.593 -0.242 136 HG22 VAL 17 HG22 VAL 17 3.025 -5.478 0.900 137 HG23 VAL 17 HG23 VAL 17 2.156 -4.036 1.426 138 H ASP 18 H ASP 18 -0.427 -4.868 3.498 139 HA ASP 18 HA ASP 18 -0.614 -1.937 3.560 140 HB2 ASP 18 HB2 ASP 18 -1.231 -3.989 5.705 141 HB3 ASP 18 HB1 ASP 18 -1.369 -2.247 5.906 142 H SER 19 H SER 19 0.527 -0.975 5.549 143 HA SER 19 HA SER 19 3.287 -1.540 5.347 144 HB2 SER 19 HB2 SER 19 3.473 0.097 7.248 145 HB3 SER 19 HB1 SER 19 2.575 0.697 5.856 146 HG SER 19 HG SER 19 1.456 -0.353 8.266 147 H ASP 20 H ASP 20 0.813 -2.889 7.239 148 HA ASP 20 HA ASP 20 2.784 -4.079 9.054 149 HB2 ASP 20 HB2 ASP 20 -0.123 -3.421 9.525 150 HB3 ASP 20 HB1 ASP 20 0.831 -4.420 10.615 151 H THR 21 H THR 21 1.869 -4.980 6.364 152 HA THR 21 HA THR 21 0.443 -7.429 6.975 153 HB THR 21 HB THR 21 1.557 -6.345 4.372 154 HG1 THR 21 HG1 THR 21 -0.865 -6.193 5.712 155 HG21 THR 21 HG21 THR 21 0.312 -8.152 3.263 156 HG22 THR 21 HG22 THR 21 -0.143 -8.808 4.835 157 HG23 THR 21 HG23 THR 21 1.548 -8.807 4.338 158 H SER 22 H SER 22 1.540 -9.095 7.786 159 HA SER 22 HA SER 22 4.382 -9.330 7.459 160 HB2 SER 22 HB2 SER 22 4.068 -11.434 8.765 161 HB3 SER 22 HB1 SER 22 3.375 -10.022 9.557 162 HG SER 22 HG SER 22 1.615 -11.156 9.606 163 H ILE 23 H ILE 23 5.329 -11.434 6.694 164 HA ILE 23 HA ILE 23 4.472 -12.064 4.082 165 HB ILE 23 HB ILE 23 6.225 -13.760 5.888 166 HG12 ILE 23 HG12 ILE 23 7.115 -11.497 5.757 167 HG13 ILE 23 HG11 ILE 23 8.125 -12.595 4.825 168 HG21 ILE 23 HG21 ILE 23 5.465 -14.967 3.915 169 HG22 ILE 23 HG22 ILE 23 7.187 -14.603 3.780 170 HG23 ILE 23 HG23 ILE 23 6.014 -13.649 2.877 171 HD11 ILE 23 HD11 ILE 23 6.082 -10.677 3.719 172 HD12 ILE 23 HD12 ILE 23 7.041 -11.810 2.766 173 HD13 ILE 23 HD13 ILE 23 7.837 -10.507 3.648 174 H PHE 24 H PHE 24 3.758 -13.339 7.223 175 HA PHE 24 HA PHE 24 2.464 -15.738 6.603 176 HB2 PHE 24 HB2 PHE 24 3.051 -14.944 8.894 177 HB3 PHE 24 HB1 PHE 24 1.792 -13.727 8.767 178 HD1 PHE 24 HD1 PHE 24 2.242 -17.408 8.484 179 HD2 PHE 24 HD2 PHE 24 -0.262 -14.186 9.671 180 HE1 PHE 24 HE1 PHE 24 0.640 -19.004 9.409 181 HE2 PHE 24 HE2 PHE 24 -1.883 -15.781 10.602 182 HZ PHE 24 HZ PHE 24 -1.434 -18.198 10.476 183 H GLN 25 H GLN 25 1.170 -12.457 7.008 184 HA GLN 25 HA GLN 25 -1.474 -13.081 6.223 185 HB2 GLN 25 HB2 GLN 25 -0.007 -10.438 6.242 186 HB3 GLN 25 HB1 GLN 25 -1.738 -10.617 5.992 187 HG2 GLN 25 HG2 GLN 25 -0.225 -11.418 8.464 188 HG3 GLN 25 HG1 GLN 25 -1.205 -9.965 8.276 189 HE21 GLN 25 HE21 GLN 25 -3.433 -10.145 8.231 190 HE22 GLN 25 HE22 GLN 25 -4.257 -11.575 8.747 191 H LEU 26 H LEU 26 1.290 -11.707 4.479 192 HA LEU 26 HA LEU 26 0.036 -11.183 2.050 193 HB2 LEU 26 HB2 LEU 26 2.258 -10.374 2.513 194 HB3 LEU 26 HB1 LEU 26 2.874 -12.009 2.638 195 HG LEU 26 HG LEU 26 2.560 -12.347 0.245 196 HD11 LEU 26 HD11 LEU 26 1.890 -10.483 -1.203 197 HD12 LEU 26 HD12 LEU 26 1.523 -9.518 0.226 198 HD13 LEU 26 HD13 LEU 26 0.595 -10.976 -0.114 199 HD21 LEU 26 HD21 LEU 26 4.665 -11.412 1.006 200 HD22 LEU 26 HD22 LEU 26 3.996 -9.783 0.905 201 HD23 LEU 26 HD23 LEU 26 4.224 -10.736 -0.563 202 H LYS 27 H LYS 27 1.564 -14.162 3.197 203 HA LYS 27 HA LYS 27 1.266 -15.703 0.891 204 HB2 LYS 27 HB2 LYS 27 2.592 -16.387 2.856 205 HB3 LYS 27 HB1 LYS 27 1.105 -16.579 3.778 206 HG2 LYS 27 HG2 LYS 27 0.417 -18.416 2.402 207 HG3 LYS 27 HG1 LYS 27 1.770 -18.153 1.299 208 HD2 LYS 27 HD2 LYS 27 2.242 -20.022 2.778 209 HD3 LYS 27 HD1 LYS 27 3.336 -18.682 3.121 210 HE2 LYS 27 HE2 LYS 27 2.535 -19.684 5.187 211 HE3 LYS 27 HE1 LYS 27 1.932 -18.036 5.030 212 HZ1 LYS 27 HZ1 LYS 27 0.284 -19.738 5.792 213 HZ2 LYS 27 HZ2 LYS 27 0.349 -20.421 4.251 214 HZ3 LYS 27 HZ3 LYS 27 -0.199 -18.837 4.450 215 H GLU 28 H GLU 28 -0.929 -15.220 3.629 216 HA GLU 28 HA GLU 28 -2.979 -16.898 2.655 217 HB2 GLU 28 HB2 GLU 28 -2.838 -14.740 4.711 218 HB3 GLU 28 HB1 GLU 28 -4.392 -15.430 4.269 219 HG2 GLU 28 HG2 GLU 28 -3.471 -17.671 4.851 220 HG3 GLU 28 HG1 GLU 28 -2.022 -16.858 5.444 221 H VAL 29 H VAL 29 -2.328 -13.444 2.307 222 HA VAL 29 HA VAL 29 -4.738 -12.704 1.093 223 HB VAL 29 HB VAL 29 -1.972 -11.525 0.698 224 HG11 VAL 29 HG11 VAL 29 -4.658 -10.392 -0.098 225 HG12 VAL 29 HG12 VAL 29 -3.400 -10.952 -1.199 226 HG13 VAL 29 HG13 VAL 29 -3.117 -9.538 -0.184 227 HG21 VAL 29 HG21 VAL 29 -4.299 -10.654 2.412 228 HG22 VAL 29 HG22 VAL 29 -2.772 -9.789 2.235 229 HG23 VAL 29 HG23 VAL 29 -2.800 -11.385 2.987 230 H VAL 30 H VAL 30 -1.659 -13.636 -0.452 231 HA VAL 30 HA VAL 30 -2.672 -13.548 -3.080 232 HB VAL 30 HB VAL 30 -0.375 -15.216 -2.020 233 HG11 VAL 30 HG11 VAL 30 -1.145 -16.011 -4.198 234 HG12 VAL 30 HG12 VAL 30 0.424 -15.219 -4.345 235 HG13 VAL 30 HG13 VAL 30 -1.040 -14.374 -4.845 236 HG21 VAL 30 HG21 VAL 30 1.039 -13.372 -2.822 237 HG22 VAL 30 HG22 VAL 30 -0.081 -12.843 -1.566 238 HG23 VAL 30 HG23 VAL 30 -0.409 -12.463 -3.256 239 H ALA 31 H ALA 31 -2.554 -16.114 -0.682 240 HA ALA 31 HA ALA 31 -3.374 -18.242 -2.314 241 HB1 ALA 31 HB1 ALA 31 -3.887 -19.409 -0.279 242 HB2 ALA 31 HB2 ALA 31 -3.942 -17.894 0.619 243 HB3 ALA 31 HB3 ALA 31 -2.413 -18.469 -0.039 244 H LYS 32 H LYS 32 -5.246 -15.967 -0.339 245 HA LYS 32 HA LYS 32 -7.749 -17.201 -0.861 246 HB2 LYS 32 HB2 LYS 32 -8.720 -15.462 0.367 247 HB3 LYS 32 HB1 LYS 32 -7.114 -15.609 1.066 248 HG2 LYS 32 HG2 LYS 32 -6.449 -13.743 -0.546 249 HG3 LYS 32 HG1 LYS 32 -8.176 -13.497 -0.773 250 HD2 LYS 32 HD2 LYS 32 -6.660 -13.315 1.831 251 HD3 LYS 32 HD1 LYS 32 -7.290 -11.975 0.873 252 HE2 LYS 32 HE2 LYS 32 -8.887 -12.214 2.551 253 HE3 LYS 32 HE1 LYS 32 -9.585 -13.109 1.207 254 HZ1 LYS 32 HZ1 LYS 32 -8.103 -14.321 3.486 255 HZ2 LYS 32 HZ2 LYS 32 -8.838 -15.168 2.221 256 HZ3 LYS 32 HZ3 LYS 32 -9.784 -14.296 3.309 257 H ARG 33 H ARG 33 -5.868 -14.763 -2.505 258 HA ARG 33 HA ARG 33 -7.913 -13.683 -4.104 259 HB2 ARG 33 HB2 ARG 33 -4.961 -13.956 -4.705 260 HB3 ARG 33 HB1 ARG 33 -6.082 -12.975 -5.634 261 HG2 ARG 33 HG2 ARG 33 -6.480 -11.559 -3.701 262 HG3 ARG 33 HG1 ARG 33 -5.404 -12.565 -2.730 263 HD2 ARG 33 HD2 ARG 33 -4.075 -10.748 -3.377 264 HD3 ARG 33 HD1 ARG 33 -3.622 -12.045 -4.480 265 HE ARG 33 HE ARG 33 -5.242 -9.683 -5.129 266 HH11 ARG 33 HH11 ARG 33 -3.529 -12.550 -6.234 267 HH12 ARG 33 HH12 ARG 33 -3.484 -12.029 -7.883 268 HH21 ARG 33 HH21 ARG 33 -5.160 -9.007 -7.317 269 HH22 ARG 33 HH22 ARG 33 -4.408 -10.024 -8.495 270 H GLN 34 H GLN 34 -5.649 -16.329 -4.552 271 HA GLN 34 HA GLN 34 -6.605 -16.966 -7.195 272 HB2 GLN 34 HB2 GLN 34 -4.712 -18.483 -5.399 273 HB3 GLN 34 HB1 GLN 34 -4.950 -18.746 -7.121 274 HG2 GLN 34 HG2 GLN 34 -3.885 -16.213 -5.896 275 HG3 GLN 34 HG1 GLN 34 -2.892 -17.481 -6.602 276 HE21 GLN 34 HE21 GLN 34 -3.008 -17.819 -8.850 277 HE22 GLN 34 HE22 GLN 34 -3.577 -16.589 -9.919 278 H GLY 35 H GLY 35 -7.021 -18.158 -3.927 279 HA2 GLY 35 HA2 GLY 35 -8.878 -19.412 -3.197 280 HA3 GLY 35 HA1 GLY 35 -9.183 -19.887 -4.867 281 H VAL 36 H VAL 36 -6.191 -20.017 -3.026 282 HA VAL 36 HA VAL 36 -6.157 -22.939 -3.410 283 HB VAL 36 HB VAL 36 -3.724 -22.826 -3.681 284 HG11 VAL 36 HG11 VAL 36 -3.617 -21.633 -5.837 285 HG12 VAL 36 HG12 VAL 36 -5.192 -20.918 -5.495 286 HG13 VAL 36 HG13 VAL 36 -5.037 -22.662 -5.693 287 HG21 VAL 36 HG21 VAL 36 -2.550 -20.687 -3.834 288 HG22 VAL 36 HG22 VAL 36 -3.301 -20.874 -2.250 289 HG23 VAL 36 HG23 VAL 36 -4.044 -19.832 -3.461 290 HA PRO 37 HA PRO 37 -5.521 -23.402 0.960 291 HB2 PRO 37 HB2 PRO 37 -3.625 -25.395 1.014 292 HB3 PRO 37 HB1 PRO 37 -5.348 -25.680 0.741 293 HG2 PRO 37 HG2 PRO 37 -3.121 -25.480 -1.246 294 HG3 PRO 37 HG1 PRO 37 -4.490 -26.604 -1.209 295 HD2 PRO 37 HD2 PRO 37 -4.456 -24.475 -2.841 296 HD3 PRO 37 HD1 PRO 37 -5.957 -25.043 -2.085 297 H ALA 38 H ALA 38 -4.484 -21.948 2.137 298 HA ALA 38 HA ALA 38 -1.986 -20.827 1.318 299 HB1 ALA 38 HB1 ALA 38 -2.241 -19.354 3.233 300 HB2 ALA 38 HB2 ALA 38 -3.572 -20.345 3.831 301 HB3 ALA 38 HB3 ALA 38 -3.744 -19.463 2.314 302 H ASP 39 H ASP 39 -2.873 -23.378 3.461 303 HA ASP 39 HA ASP 39 -0.636 -23.182 5.207 304 HB2 ASP 39 HB2 ASP 39 -2.664 -24.384 5.866 305 HB3 ASP 39 HB1 ASP 39 -2.375 -25.576 4.608 306 H GLN 40 H GLN 40 -1.297 -25.331 2.434 307 HA GLN 40 HA GLN 40 1.477 -26.191 2.498 308 HB2 GLN 40 HB2 GLN 40 0.882 -27.830 0.840 309 HB3 GLN 40 HB1 GLN 40 -0.338 -27.841 2.100 310 HG2 GLN 40 HG2 GLN 40 -1.750 -26.408 0.597 311 HG3 GLN 40 HG1 GLN 40 -0.559 -26.702 -0.671 312 HE21 GLN 40 HE21 GLN 40 -3.101 -28.045 1.218 313 HE22 GLN 40 HE22 GLN 40 -3.241 -29.538 0.363 314 H LEU 41 H LEU 41 0.586 -23.441 1.768 315 HA LEU 41 HA LEU 41 1.529 -23.185 -0.977 316 HB2 LEU 41 HB2 LEU 41 -0.449 -21.899 -0.159 317 HB3 LEU 41 HB1 LEU 41 0.601 -21.068 0.969 318 HG LEU 41 HG LEU 41 1.868 -20.137 -0.954 319 HD11 LEU 41 HD11 LEU 41 -0.332 -21.421 -2.562 320 HD12 LEU 41 HD12 LEU 41 1.384 -21.837 -2.601 321 HD13 LEU 41 HD13 LEU 41 0.845 -20.262 -3.176 322 HD21 LEU 41 HD21 LEU 41 -1.088 -19.578 -1.007 323 HD22 LEU 41 HD22 LEU 41 0.190 -18.506 -1.579 324 HD23 LEU 41 HD23 LEU 41 0.057 -18.886 0.139 325 H ARG 42 H ARG 42 3.500 -22.263 -1.501 326 HA ARG 42 HA ARG 42 5.267 -21.704 0.785 327 HB2 ARG 42 HB2 ARG 42 5.849 -23.821 -0.232 328 HB3 ARG 42 HB1 ARG 42 5.914 -23.078 -1.822 329 HG2 ARG 42 HG2 ARG 42 8.140 -23.507 -0.894 330 HG3 ARG 42 HG1 ARG 42 7.857 -21.791 -1.183 331 HD2 ARG 42 HD2 ARG 42 9.001 -22.326 0.985 332 HD3 ARG 42 HD1 ARG 42 7.529 -21.372 1.138 333 HE ARG 42 HE ARG 42 6.397 -23.466 1.779 334 HH11 ARG 42 HH11 ARG 42 9.897 -23.322 2.089 335 HH12 ARG 42 HH12 ARG 42 9.950 -24.509 3.338 336 HH21 ARG 42 HH21 ARG 42 6.470 -25.007 3.436 337 HH22 ARG 42 HH22 ARG 42 7.989 -25.476 4.116 338 H VAL 43 H VAL 43 6.113 -19.759 0.848 339 HA VAL 43 HA VAL 43 6.091 -18.091 -1.546 340 HB VAL 43 HB VAL 43 6.602 -16.208 0.006 341 HG11 VAL 43 HG11 VAL 43 4.285 -16.706 -0.536 342 HG12 VAL 43 HG12 VAL 43 4.423 -16.140 1.128 343 HG13 VAL 43 HG13 VAL 43 4.205 -17.857 0.795 344 HG21 VAL 43 HG21 VAL 43 7.804 -17.459 1.734 345 HG22 VAL 43 HG22 VAL 43 6.312 -18.287 2.182 346 HG23 VAL 43 HG23 VAL 43 6.465 -16.549 2.432 347 H ILE 44 H ILE 44 7.936 -17.462 -2.549 348 HA ILE 44 HA ILE 44 10.492 -18.175 -1.287 349 HB ILE 44 HB ILE 44 9.656 -18.748 -4.140 350 HG12 ILE 44 HG12 ILE 44 8.921 -20.412 -2.481 351 HG13 ILE 44 HG11 ILE 44 10.119 -21.077 -3.586 352 HG21 ILE 44 HG21 ILE 44 11.919 -19.633 -4.486 353 HG22 ILE 44 HG22 ILE 44 12.382 -19.047 -2.888 354 HG23 ILE 44 HG23 ILE 44 11.927 -17.902 -4.149 355 HD11 ILE 44 HD11 ILE 44 10.643 -20.134 -0.772 356 HD12 ILE 44 HD12 ILE 44 11.843 -20.805 -1.877 357 HD13 ILE 44 HD13 ILE 44 10.512 -21.808 -1.305 358 H PHE 45 H PHE 45 12.060 -16.719 -1.480 359 HA PHE 45 HA PHE 45 11.856 -14.623 -3.491 360 HB2 PHE 45 HB2 PHE 45 10.862 -13.707 -1.418 361 HB3 PHE 45 HB1 PHE 45 12.337 -14.105 -0.546 362 HD1 PHE 45 HD1 PHE 45 11.082 -12.102 -3.413 363 HD2 PHE 45 HD2 PHE 45 14.045 -12.546 -0.391 364 HE1 PHE 45 HE1 PHE 45 12.007 -9.899 -4.000 365 HE2 PHE 45 HE2 PHE 45 14.974 -10.345 -0.971 366 HZ PHE 45 HZ PHE 45 13.954 -9.021 -2.776 367 H ALA 46 H ALA 46 13.662 -14.816 -4.607 368 HA ALA 46 HA ALA 46 15.841 -15.015 -5.188 369 HB1 ALA 46 HB1 ALA 46 17.568 -14.289 -3.632 370 HB2 ALA 46 HB2 ALA 46 16.420 -14.371 -2.295 371 HB3 ALA 46 HB3 ALA 46 16.190 -13.189 -3.584 372 H GLY 47 H GLY 47 14.288 -17.311 -4.034 373 HA2 GLY 47 HA2 GLY 47 15.015 -19.570 -4.337 374 HA3 GLY 47 HA1 GLY 47 16.606 -19.096 -3.777 375 H LYS 48 H LYS 48 15.017 -17.588 -1.546 376 HA LYS 48 HA LYS 48 14.619 -19.990 0.106 377 HB2 LYS 48 HB2 LYS 48 15.439 -18.580 2.047 378 HB3 LYS 48 HB1 LYS 48 16.653 -19.043 0.867 379 HG2 LYS 48 HG2 LYS 48 17.144 -16.817 1.338 380 HG3 LYS 48 HG1 LYS 48 16.245 -16.730 -0.175 381 HD2 LYS 48 HD2 LYS 48 14.190 -16.247 1.169 382 HD3 LYS 48 HD1 LYS 48 15.215 -16.158 2.603 383 HE2 LYS 48 HE2 LYS 48 15.447 -14.425 0.143 384 HE3 LYS 48 HE1 LYS 48 14.755 -13.937 1.686 385 HZ1 LYS 48 HZ1 LYS 48 17.012 -13.158 1.457 386 HZ2 LYS 48 HZ2 LYS 48 17.575 -14.729 1.218 387 HZ3 LYS 48 HZ3 LYS 48 16.919 -14.286 2.712 388 H GLU 49 H GLU 49 13.157 -19.734 1.946 389 HA GLU 49 HA GLU 49 10.925 -18.033 1.180 390 HB2 GLU 49 HB2 GLU 49 9.617 -19.291 2.867 391 HB3 GLU 49 HB1 GLU 49 10.332 -20.334 1.650 392 HG2 GLU 49 HG2 GLU 49 11.562 -19.901 4.357 393 HG3 GLU 49 HG1 GLU 49 10.379 -21.164 4.030 394 H LEU 50 H LEU 50 9.944 -16.570 2.580 395 HA LEU 50 HA LEU 50 11.827 -15.343 4.432 396 HB2 LEU 50 HB2 LEU 50 9.122 -14.350 3.547 397 HB3 LEU 50 HB1 LEU 50 10.354 -13.434 4.385 398 HG LEU 50 HG LEU 50 10.542 -14.477 1.569 399 HD11 LEU 50 HD11 LEU 50 10.431 -12.129 0.928 400 HD12 LEU 50 HD12 LEU 50 10.196 -11.678 2.618 401 HD13 LEU 50 HD13 LEU 50 8.975 -12.640 1.782 402 HD21 LEU 50 HD21 LEU 50 12.599 -13.134 1.447 403 HD22 LEU 50 HD22 LEU 50 12.727 -14.432 2.634 404 HD23 LEU 50 HD23 LEU 50 12.450 -12.774 3.168 405 H ARG 51 H ARG 51 11.300 -14.866 6.584 406 HA ARG 51 HA ARG 51 9.759 -16.788 7.927 407 HB2 ARG 51 HB2 ARG 51 10.092 -15.464 9.965 408 HB3 ARG 51 HB1 ARG 51 11.590 -15.652 9.078 409 HG2 ARG 51 HG2 ARG 51 9.920 -13.183 8.781 410 HG3 ARG 51 HG1 ARG 51 11.040 -13.374 10.132 411 HD2 ARG 51 HD2 ARG 51 11.689 -13.362 7.186 412 HD3 ARG 51 HD1 ARG 51 12.154 -12.167 8.392 413 HE ARG 51 HE ARG 51 13.210 -14.521 9.299 414 HH11 ARG 51 HH11 ARG 51 13.522 -12.605 6.376 415 HH12 ARG 51 HH12 ARG 51 15.118 -13.169 6.029 416 HH21 ARG 51 HH21 ARG 51 15.308 -15.274 8.833 417 HH22 ARG 51 HH22 ARG 51 16.135 -14.700 7.431 418 H ASN 52 H ASN 52 7.735 -16.859 8.592 419 HA ASN 52 HA ASN 52 5.819 -15.297 7.261 420 HB2 ASN 52 HB2 ASN 52 4.154 -16.546 8.573 421 HB3 ASN 52 HB1 ASN 52 5.376 -17.609 7.896 422 HD21 ASN 52 HD21 ASN 52 3.575 -17.978 10.168 423 HD22 ASN 52 HD22 ASN 52 4.583 -18.315 11.533 424 H ASP 53 H ASP 53 7.045 -15.143 10.560 425 HA ASP 53 HA ASP 53 5.151 -13.047 11.210 426 HB2 ASP 53 HB2 ASP 53 5.528 -14.791 12.897 427 HB3 ASP 53 HB1 ASP 53 7.238 -14.382 12.950 428 H TRP 54 H TRP 54 6.195 -11.811 9.500 429 HA TRP 54 HA TRP 54 7.766 -9.774 10.740 430 HB2 TRP 54 HB2 TRP 54 9.501 -11.453 10.049 431 HB3 TRP 54 HB1 TRP 54 9.023 -11.178 8.379 432 HD1 TRP 54 HD1 TRP 54 10.699 -9.616 7.230 433 HE1 TRP 54 HE1 TRP 54 12.103 -7.580 7.917 434 HE3 TRP 54 HE3 TRP 54 9.291 -9.280 12.135 435 HZ2 TRP 54 HZ2 TRP 54 12.545 -6.022 10.232 436 HZ3 TRP 54 HZ3 TRP 54 10.248 -7.483 13.514 437 HH2 TRP 54 HH2 TRP 54 11.840 -5.890 12.577 438 H THR 55 H THR 55 7.393 -7.852 9.827 439 HA THR 55 HA THR 55 5.280 -7.600 7.986 440 HB THR 55 HB THR 55 5.567 -5.887 9.635 441 HG1 THR 55 HG1 THR 55 5.021 -4.322 8.291 442 HG21 THR 55 HG21 THR 55 8.243 -5.302 8.349 443 HG22 THR 55 HG22 THR 55 7.998 -6.018 9.941 444 HG23 THR 55 HG23 THR 55 7.498 -4.356 9.635 445 H VAL 56 H VAL 56 5.174 -7.083 5.884 446 HA VAL 56 HA VAL 56 7.385 -7.703 4.204 447 HB VAL 56 HB VAL 56 4.997 -8.141 3.588 448 HG11 VAL 56 HG11 VAL 56 3.614 -6.356 2.716 449 HG12 VAL 56 HG12 VAL 56 4.847 -5.169 3.141 450 HG13 VAL 56 HG13 VAL 56 4.016 -6.072 4.409 451 HG21 VAL 56 HG21 VAL 56 6.498 -6.396 1.641 452 HG22 VAL 56 HG22 VAL 56 5.210 -7.531 1.233 453 HG23 VAL 56 HG23 VAL 56 6.740 -8.126 1.880 454 H GLN 57 H GLN 57 6.236 -4.859 5.702 455 HA GLN 57 HA GLN 57 7.121 -2.895 3.912 456 HB2 GLN 57 HB2 GLN 57 5.596 -2.426 5.773 457 HB3 GLN 57 HB1 GLN 57 6.852 -2.823 6.929 458 HG2 GLN 57 HG2 GLN 57 7.394 -0.630 5.001 459 HG3 GLN 57 HG1 GLN 57 6.233 -0.328 6.294 460 HE21 GLN 57 HE21 GLN 57 6.947 -0.387 8.445 461 HE22 GLN 57 HE22 GLN 57 8.626 -0.241 8.846 462 H ASN 58 H ASN 58 8.770 -4.748 6.391 463 HA ASN 58 HA ASN 58 11.245 -3.248 6.016 464 HB2 ASN 58 HB2 ASN 58 10.254 -4.232 8.261 465 HB3 ASN 58 HB1 ASN 58 11.044 -5.706 7.723 466 HD21 ASN 58 HD21 ASN 58 13.293 -4.301 6.483 467 HD22 ASN 58 HD22 ASN 58 14.268 -3.717 7.785 468 H CYS 59 H CYS 59 9.692 -5.666 4.442 469 HA CYS 59 HA CYS 59 12.087 -7.192 3.758 470 HB2 CYS 59 HB2 CYS 59 9.222 -7.572 2.852 471 HB3 CYS 59 HB1 CYS 59 10.560 -8.668 2.528 472 HG CYS 59 HG CYS 59 9.237 -8.002 5.627 473 H ASP 60 H ASP 60 9.829 -4.864 2.472 474 HA ASP 60 HA ASP 60 9.846 -3.497 0.664 475 HB2 ASP 60 HB2 ASP 60 12.763 -4.273 0.539 476 HB3 ASP 60 HB1 ASP 60 12.029 -2.993 -0.418 477 H LEU 61 H LEU 61 8.878 -6.019 0.216 478 HA LEU 61 HA LEU 61 10.006 -7.292 -2.053 479 HB2 LEU 61 HB2 LEU 61 7.211 -7.409 -0.933 480 HB3 LEU 61 HB1 LEU 61 7.810 -8.474 -2.184 481 HG LEU 61 HG LEU 61 8.761 -8.327 0.680 482 HD11 LEU 61 HD11 LEU 61 7.913 -10.580 0.853 483 HD12 LEU 61 HD12 LEU 61 7.409 -10.544 -0.834 484 HD13 LEU 61 HD13 LEU 61 6.630 -9.483 0.340 485 HD21 LEU 61 HD21 LEU 61 10.234 -10.208 0.104 486 HD22 LEU 61 HD22 LEU 61 10.668 -8.733 -0.756 487 HD23 LEU 61 HD23 LEU 61 9.797 -10.015 -1.594 488 H ASP 62 H ASP 62 8.723 -4.313 -1.929 489 HA ASP 62 HA ASP 62 7.432 -4.441 -4.554 490 HB2 ASP 62 HB2 ASP 62 6.520 -2.287 -4.077 491 HB3 ASP 62 HB1 ASP 62 6.293 -3.262 -2.634 492 H GLN 63 H GLN 63 10.216 -3.228 -2.863 493 HA GLN 63 HA GLN 63 11.103 -1.755 -5.236 494 HB2 GLN 63 HB2 GLN 63 11.965 -1.659 -2.356 495 HB3 GLN 63 HB1 GLN 63 12.857 -0.857 -3.643 496 HG2 GLN 63 HG2 GLN 63 11.047 0.580 -4.125 497 HG3 GLN 63 HG1 GLN 63 9.947 -0.354 -3.114 498 HE21 GLN 63 HE21 GLN 63 9.988 -0.094 -0.929 499 HE22 GLN 63 HE22 GLN 63 10.838 1.192 -0.144 500 H GLN 64 H GLN 64 11.587 -4.654 -3.593 501 HA GLN 64 HA GLN 64 14.268 -5.028 -4.679 502 HB2 GLN 64 HB2 GLN 64 12.553 -6.784 -2.907 503 HB3 GLN 64 HB1 GLN 64 14.162 -7.210 -3.460 504 HG2 GLN 64 HG2 GLN 64 13.464 -4.865 -1.709 505 HG3 GLN 64 HG1 GLN 64 14.200 -6.376 -1.179 506 HE21 GLN 64 HE21 GLN 64 14.693 -3.372 -2.825 507 HE22 GLN 64 HE22 GLN 64 16.416 -3.458 -2.903 508 H SEP 65 H SEP 65 13.920 -7.904 -5.027 509 HA SEP 65 HA SEP 65 13.053 -7.964 -7.717 510 HB2 SEP 65 HB1 SEP 65 13.527 -10.342 -7.606 511 HB3 SEP 65 HB2 SEP 65 13.495 -10.300 -5.844 512 H ILE 66 H ILE 66 11.494 -10.033 -8.235 513 HA ILE 66 HA ILE 66 8.966 -9.240 -7.045 514 HB ILE 66 HB ILE 66 9.240 -9.442 -9.553 515 HG12 ILE 66 HG12 ILE 66 7.140 -11.323 -8.495 516 HG13 ILE 66 HG11 ILE 66 7.035 -9.576 -8.311 517 HG21 ILE 66 HG21 ILE 66 9.244 -12.386 -8.969 518 HG22 ILE 66 HG22 ILE 66 10.611 -11.454 -9.588 519 HG23 ILE 66 HG23 ILE 66 9.149 -11.641 -10.563 520 HD11 ILE 66 HD11 ILE 66 7.028 -9.308 -10.726 521 HD12 ILE 66 HD12 ILE 66 5.725 -10.376 -10.205 522 HD13 ILE 66 HD13 ILE 66 7.184 -11.052 -10.930 523 H VAL 67 H VAL 67 7.557 -10.658 -6.022 524 HA VAL 67 HA VAL 67 8.901 -12.714 -4.505 525 HB VAL 67 HB VAL 67 5.966 -12.064 -4.382 526 HG11 VAL 67 HG11 VAL 67 6.695 -14.023 -3.137 527 HG12 VAL 67 HG12 VAL 67 6.192 -12.733 -2.042 528 HG13 VAL 67 HG13 VAL 67 7.907 -13.052 -2.299 529 HG21 VAL 67 HG21 VAL 67 7.172 -9.951 -4.262 530 HG22 VAL 67 HG22 VAL 67 8.194 -10.597 -2.978 531 HG23 VAL 67 HG23 VAL 67 6.467 -10.364 -2.701 532 H HIS 68 H HIS 68 8.777 -14.850 -4.830 533 HA HIS 68 HA HIS 68 6.984 -15.803 -6.948 534 HB2 HIS 68 HB2 HIS 68 9.407 -17.145 -5.724 535 HB3 HIS 68 HB1 HIS 68 8.442 -17.780 -7.048 536 HD2 HIS 68 HD2 HIS 68 8.474 -14.660 -8.544 537 HE1 HIS 68 HE1 HIS 68 12.532 -15.768 -8.982 538 HE2 HIS 68 HE2 HIS 68 10.733 -14.162 -9.726 539 H ILE 69 H ILE 69 5.304 -17.053 -6.411 540 HA ILE 69 HA ILE 69 5.406 -18.421 -3.815 541 HB ILE 69 HB ILE 69 3.017 -16.952 -4.960 542 HG12 ILE 69 HG12 ILE 69 4.710 -16.489 -2.496 543 HG13 ILE 69 HG11 ILE 69 4.595 -15.447 -3.905 544 HG21 ILE 69 HG21 ILE 69 1.820 -17.665 -2.949 545 HG22 ILE 69 HG22 ILE 69 3.218 -18.623 -2.458 546 HG23 ILE 69 HG23 ILE 69 2.329 -19.045 -3.923 547 HD11 ILE 69 HD11 ILE 69 3.340 -14.533 -2.051 548 HD12 ILE 69 HD12 ILE 69 2.395 -16.017 -1.936 549 HD13 ILE 69 HD13 ILE 69 2.256 -14.993 -3.364 550 H VAL 70 H VAL 70 4.934 -20.517 -3.902 551 HA VAL 70 HA VAL 70 3.578 -21.506 -6.310 552 HB VAL 70 HB VAL 70 6.001 -21.936 -6.505 553 HG11 VAL 70 HG11 VAL 70 6.588 -22.066 -4.157 554 HG12 VAL 70 HG12 VAL 70 7.124 -23.512 -5.014 555 HG13 VAL 70 HG13 VAL 70 5.684 -23.572 -3.998 556 HG21 VAL 70 HG21 VAL 70 4.335 -24.412 -6.072 557 HG22 VAL 70 HG22 VAL 70 5.874 -24.364 -6.931 558 HG23 VAL 70 HG23 VAL 70 4.481 -23.489 -7.567 559 H GLN 71 H GLN 71 2.119 -23.114 -6.022 560 HA GLN 71 HA GLN 71 1.471 -23.808 -3.243 561 HB2 GLN 71 HB2 GLN 71 -0.758 -24.361 -4.074 562 HB3 GLN 71 HB1 GLN 71 -0.327 -22.719 -4.534 563 HG2 GLN 71 HG2 GLN 71 0.070 -23.349 -6.781 564 HG3 GLN 71 HG1 GLN 71 0.013 -25.062 -6.384 565 HE21 GLN 71 HE21 GLN 71 -2.336 -24.770 -4.677 566 HE22 GLN 71 HE22 GLN 71 -3.671 -24.522 -5.742 567 H ARG 72 H ARG 72 0.839 -25.989 -2.787 568 HA ARG 72 HA ARG 72 2.104 -27.952 -4.539 569 HB2 ARG 72 HB2 ARG 72 2.408 -27.823 -1.943 570 HB3 ARG 72 HB1 ARG 72 0.810 -28.547 -1.877 571 HG2 ARG 72 HG2 ARG 72 3.122 -29.785 -3.361 572 HG3 ARG 72 HG1 ARG 72 2.752 -30.135 -1.676 573 HD2 ARG 72 HD2 ARG 72 0.860 -30.553 -3.988 574 HD3 ARG 72 HD1 ARG 72 1.846 -31.814 -3.255 575 HE ARG 72 HE ARG 72 -0.202 -30.314 -1.744 576 HH11 ARG 72 HH11 ARG 72 1.313 -33.348 -2.685 577 HH12 ARG 72 HH12 ARG 72 0.327 -34.309 -1.638 578 HH21 ARG 72 HH21 ARG 72 -1.499 -31.595 -0.352 579 HH22 ARG 72 HH22 ARG 72 -1.284 -33.310 -0.314 580 HA PRO 73 HA PRO 73 -2.199 -28.257 -5.909 581 HB2 PRO 73 HB2 PRO 73 -1.167 -29.565 -8.284 582 HB3 PRO 73 HB1 PRO 73 -1.936 -27.984 -8.137 583 HG2 PRO 73 HG2 PRO 73 0.700 -28.314 -8.740 584 HG3 PRO 73 HG1 PRO 73 0.060 -26.890 -7.900 585 HD2 PRO 73 HD2 PRO 73 1.435 -29.295 -6.777 586 HD3 PRO 73 HD1 PRO 73 1.635 -27.578 -6.358 587 H TRP 74 H TRP 74 -2.994 -29.823 -4.563 588 HA TRP 74 HA TRP 74 -2.267 -32.587 -4.925 589 HB2 TRP 74 HB2 TRP 74 -2.855 -31.862 -2.699 590 HB3 TRP 74 HB1 TRP 74 -4.434 -31.320 -3.266 591 HD1 TRP 74 HD1 TRP 74 -6.291 -32.989 -3.179 592 HE1 TRP 74 HE1 TRP 74 -6.526 -35.524 -2.711 593 HE3 TRP 74 HE3 TRP 74 -1.368 -34.194 -3.102 594 HZ2 TRP 74 HZ2 TRP 74 -4.794 -37.735 -2.379 595 HZ3 TRP 74 HZ3 TRP 74 -0.724 -36.532 -2.717 596 HH2 TRP 74 HH2 TRP 74 -2.401 -38.260 -2.361 597 H ARG 75 H ARG 75 -2.701 -33.148 -6.969 598 HA ARG 75 HA ARG 75 -3.898 -33.853 -8.764 599 HB2 ARG 75 HB2 ARG 75 -6.077 -34.104 -6.681 600 HB3 ARG 75 HB1 ARG 75 -6.162 -34.784 -8.301 601 HG2 ARG 75 HG2 ARG 75 -4.210 -36.175 -7.816 602 HG3 ARG 75 HG1 ARG 75 -4.138 -35.500 -6.190 603 HD2 ARG 75 HD2 ARG 75 -6.296 -36.428 -5.664 604 HD3 ARG 75 HD1 ARG 75 -6.492 -36.998 -7.321 605 HE ARG 75 HE ARG 75 -4.178 -38.005 -5.876 606 HH11 ARG 75 HH11 ARG 75 -7.485 -38.566 -6.897 607 HH12 ARG 75 HH12 ARG 75 -7.383 -40.281 -6.723 608 HH21 ARG 75 HH21 ARG 75 -4.034 -40.267 -5.648 609 HH22 ARG 75 HH22 ARG 75 -5.403 -41.259 -6.014 610 H LYS 76 H LYS 76 -3.655 -31.138 -8.452 611 HA LYS 76 HA LYS 76 -6.245 -29.928 -9.030 612 HB2 LYS 76 HB2 LYS 76 -4.097 -29.065 -7.568 613 HB3 LYS 76 HB1 LYS 76 -3.794 -28.284 -9.104 614 HG2 LYS 76 HG2 LYS 76 -6.362 -28.010 -7.543 615 HG3 LYS 76 HG1 LYS 76 -5.015 -26.883 -7.448 616 HD2 LYS 76 HD2 LYS 76 -6.337 -25.820 -8.994 617 HD3 LYS 76 HD1 LYS 76 -5.339 -26.800 -10.069 618 HE2 LYS 76 HE2 LYS 76 -7.091 -28.459 -10.240 619 HE3 LYS 76 HE1 LYS 76 -8.068 -27.597 -9.052 620 HZ1 LYS 76 HZ1 LYS 76 -8.851 -27.121 -11.251 621 HZ2 LYS 76 HZ2 LYS 76 -7.315 -26.626 -11.755 622 HZ3 LYS 76 HZ3 LYS 76 -8.161 -25.716 -10.610 Start of MODEL 24 1 H1 MET 1 HT1 MET 1 2.840 -1.293 0.882 2 H2 MET 1 HT2 MET 1 1.305 -0.674 0.568 3 H3 MET 1 HT3 MET 1 2.543 0.364 1.065 4 HA MET 1 HA MET 1 2.194 0.621 -1.275 5 HB2 MET 1 HB2 MET 1 4.436 0.263 -2.068 6 HB3 MET 1 HB1 MET 1 4.541 0.696 -0.372 7 HG2 MET 1 HG2 MET 1 4.720 -2.103 -1.467 8 HG3 MET 1 HG1 MET 1 6.094 -1.098 -1.008 9 HE1 MET 1 HE1 MET 1 5.795 -3.985 0.089 10 HE2 MET 1 HE2 MET 1 6.078 -3.787 1.815 11 HE3 MET 1 HE3 MET 1 7.075 -2.912 0.652 12 H ILE 2 H ILE 2 2.811 -0.510 -3.444 13 HA ILE 2 HA ILE 2 1.313 -3.013 -3.498 14 HB ILE 2 HB ILE 2 2.167 -1.112 -5.696 15 HG12 ILE 2 HG12 ILE 2 -0.360 -1.172 -6.131 16 HG13 ILE 2 HG11 ILE 2 -0.497 -1.967 -4.571 17 HG21 ILE 2 HG21 ILE 2 0.843 -3.797 -6.040 18 HG22 ILE 2 HG22 ILE 2 2.474 -3.358 -6.547 19 HG23 ILE 2 HG23 ILE 2 1.079 -2.597 -7.310 20 HD11 ILE 2 HD11 ILE 2 0.513 -0.024 -3.498 21 HD12 ILE 2 HD12 ILE 2 -0.947 0.399 -4.391 22 HD13 ILE 2 HD13 ILE 2 0.640 0.770 -5.068 23 H VAL 3 H VAL 3 2.291 -4.915 -3.674 24 HA VAL 3 HA VAL 3 5.113 -4.900 -4.487 25 HB VAL 3 HB VAL 3 5.415 -6.952 -3.187 26 HG11 VAL 3 HG11 VAL 3 4.157 -4.711 -1.616 27 HG12 VAL 3 HG12 VAL 3 5.851 -4.839 -2.096 28 HG13 VAL 3 HG13 VAL 3 5.171 -5.985 -0.939 29 HG21 VAL 3 HG21 VAL 3 3.668 -7.753 -1.670 30 HG22 VAL 3 HG22 VAL 3 3.167 -7.875 -3.358 31 HG23 VAL 3 HG23 VAL 3 2.543 -6.572 -2.345 32 H PHE 4 H PHE 4 5.854 -6.552 -5.850 33 HA PHE 4 HA PHE 4 3.777 -7.555 -7.621 34 HB2 PHE 4 HB2 PHE 4 6.787 -7.595 -7.940 35 HB3 PHE 4 HB1 PHE 4 5.613 -8.044 -9.169 36 HD1 PHE 4 HD1 PHE 4 7.704 -5.508 -8.079 37 HD2 PHE 4 HD2 PHE 4 3.784 -6.133 -9.607 38 HE1 PHE 4 HE1 PHE 4 7.631 -3.172 -8.838 39 HE2 PHE 4 HE2 PHE 4 3.704 -3.798 -10.373 40 HZ PHE 4 HZ PHE 4 5.631 -2.313 -9.987 41 H VAL 5 H VAL 5 3.208 -9.637 -7.753 42 HA VAL 5 HA VAL 5 4.873 -11.623 -6.378 43 HB VAL 5 HB VAL 5 1.911 -11.159 -5.964 44 HG11 VAL 5 HG11 VAL 5 3.566 -13.492 -5.015 45 HG12 VAL 5 HG12 VAL 5 2.293 -13.552 -6.236 46 HG13 VAL 5 HG13 VAL 5 1.895 -13.148 -4.565 47 HG21 VAL 5 HG21 VAL 5 2.563 -11.019 -3.600 48 HG22 VAL 5 HG22 VAL 5 3.360 -9.798 -4.599 49 HG23 VAL 5 HG23 VAL 5 4.250 -11.229 -4.083 50 H ARG 6 H ARG 6 5.056 -13.509 -7.379 51 HA ARG 6 HA ARG 6 3.473 -13.969 -9.811 52 HB2 ARG 6 HB2 ARG 6 6.143 -15.034 -8.908 53 HB3 ARG 6 HB1 ARG 6 5.289 -15.616 -10.325 54 HG2 ARG 6 HG2 ARG 6 5.405 -13.357 -11.279 55 HG3 ARG 6 HG1 ARG 6 6.330 -12.850 -9.858 56 HD2 ARG 6 HD2 ARG 6 7.654 -13.524 -11.958 57 HD3 ARG 6 HD1 ARG 6 8.156 -14.215 -10.413 58 HE ARG 6 HE ARG 6 6.269 -15.883 -11.751 59 HH11 ARG 6 HH11 ARG 6 9.662 -14.972 -11.822 60 HH12 ARG 6 HH12 ARG 6 10.190 -16.513 -12.399 61 HH21 ARG 6 HH21 ARG 6 6.971 -17.928 -12.495 62 HH22 ARG 6 HH22 ARG 6 8.655 -18.203 -12.789 63 H PHE 7 H PHE 7 2.403 -15.898 -10.063 64 HA PHE 7 HA PHE 7 2.640 -17.828 -7.879 65 HB2 PHE 7 HB2 PHE 7 0.593 -16.445 -7.531 66 HB3 PHE 7 HB1 PHE 7 0.004 -16.981 -9.102 67 HD1 PHE 7 HD1 PHE 7 0.802 -18.028 -5.681 68 HD2 PHE 7 HD2 PHE 7 -0.925 -19.164 -9.397 69 HE1 PHE 7 HE1 PHE 7 -0.158 -20.021 -4.621 70 HE2 PHE 7 HE2 PHE 7 -1.892 -21.162 -8.341 71 HZ PHE 7 HZ PHE 7 -1.501 -21.593 -5.948 72 H ASN 8 H ASN 8 3.476 -19.537 -8.788 73 HA ASN 8 HA ASN 8 3.772 -21.356 -10.085 74 HB2 ASN 8 HB2 ASN 8 1.489 -21.929 -9.893 75 HB3 ASN 8 HB1 ASN 8 0.987 -20.645 -10.985 76 HD21 ASN 8 HD21 ASN 8 0.938 -21.022 -13.132 77 HD22 ASN 8 HD22 ASN 8 1.315 -22.543 -13.861 78 H SER 9 H SER 9 2.257 -18.952 -12.249 79 HA SER 9 HA SER 9 4.015 -19.752 -14.395 80 HB2 SER 9 HB2 SER 9 1.981 -17.519 -14.287 81 HB3 SER 9 HB1 SER 9 2.767 -18.147 -15.736 82 HG SER 9 HG SER 9 1.776 -20.180 -15.274 83 H SER 10 H SER 10 4.887 -17.777 -15.742 84 HA SER 10 HA SER 10 6.864 -16.517 -14.092 85 HB2 SER 10 HB2 SER 10 6.335 -16.128 -17.042 86 HB3 SER 10 HB1 SER 10 7.828 -15.772 -16.172 87 HG SER 10 HG SER 10 8.348 -17.819 -16.193 88 H HIS 11 H HIS 11 3.783 -15.695 -15.283 89 HA HIS 11 HA HIS 11 4.019 -12.888 -15.433 90 HB2 HIS 11 HB2 HIS 11 2.159 -14.069 -16.478 91 HB3 HIS 11 HB1 HIS 11 1.601 -14.633 -14.910 92 HD2 HIS 11 HD2 HIS 11 -0.155 -13.000 -13.658 93 HE1 HIS 11 HE1 HIS 11 0.332 -9.673 -16.226 94 HE2 HIS 11 HE2 HIS 11 -1.143 -10.747 -14.474 95 H GLY 12 H GLY 12 3.782 -11.321 -13.942 96 HA2 GLY 12 HA2 GLY 12 3.364 -12.176 -11.152 97 HA3 GLY 12 HA1 GLY 12 4.521 -10.933 -11.613 98 H PHE 13 H PHE 13 1.735 -11.259 -10.137 99 HA PHE 13 HA PHE 13 0.477 -8.940 -11.395 100 HB2 PHE 13 HB2 PHE 13 -1.539 -9.619 -9.981 101 HB3 PHE 13 HB1 PHE 13 -1.104 -10.703 -11.294 102 HD1 PHE 13 HD1 PHE 13 -1.224 -10.270 -7.658 103 HD2 PHE 13 HD2 PHE 13 -0.245 -12.915 -10.844 104 HE1 PHE 13 HE1 PHE 13 -1.147 -12.149 -6.073 105 HE2 PHE 13 HE2 PHE 13 -0.166 -14.796 -9.265 106 HZ PHE 13 HZ PHE 13 -0.618 -14.417 -6.876 107 HA PRO 14 HA PRO 14 1.546 -6.579 -7.822 108 HB2 PRO 14 HB2 PRO 14 -0.379 -4.560 -8.284 109 HB3 PRO 14 HB1 PRO 14 1.272 -4.609 -8.901 110 HG2 PRO 14 HG2 PRO 14 -1.066 -4.800 -10.437 111 HG3 PRO 14 HG1 PRO 14 0.573 -5.201 -10.972 112 HD2 PRO 14 HD2 PRO 14 -1.609 -6.997 -10.032 113 HD3 PRO 14 HD1 PRO 14 -0.364 -7.274 -11.268 114 H VAL 15 H VAL 15 1.061 -6.886 -5.762 115 HA VAL 15 HA VAL 15 -1.773 -7.002 -4.972 116 HB VAL 15 HB VAL 15 0.596 -8.325 -3.603 117 HG11 VAL 15 HG11 VAL 15 -1.120 -7.620 -2.012 118 HG12 VAL 15 HG12 VAL 15 -1.083 -9.376 -2.162 119 HG13 VAL 15 HG13 VAL 15 -2.353 -8.450 -2.962 120 HG21 VAL 15 HG21 VAL 15 -0.443 -10.432 -4.294 121 HG22 VAL 15 HG22 VAL 15 0.004 -9.443 -5.684 122 HG23 VAL 15 HG23 VAL 15 -1.681 -9.532 -5.171 123 H GLU 16 H GLU 16 -2.419 -5.299 -3.844 124 HA GLU 16 HA GLU 16 -0.494 -3.450 -2.757 125 HB2 GLU 16 HB2 GLU 16 -2.561 -2.725 -3.964 126 HB3 GLU 16 HB1 GLU 16 -3.507 -3.338 -2.616 127 HG2 GLU 16 HG2 GLU 16 -2.429 -1.751 -1.120 128 HG3 GLU 16 HG1 GLU 16 -1.447 -1.150 -2.454 129 H VAL 17 H VAL 17 0.254 -3.522 -0.771 130 HA VAL 17 HA VAL 17 -1.382 -4.801 1.311 131 HB VAL 17 HB VAL 17 0.740 -5.565 2.379 132 HG11 VAL 17 HG11 VAL 17 1.141 -7.442 0.856 133 HG12 VAL 17 HG12 VAL 17 0.238 -6.604 -0.405 134 HG13 VAL 17 HG13 VAL 17 -0.581 -7.121 1.070 135 HG21 VAL 17 HG21 VAL 17 2.779 -5.666 0.982 136 HG22 VAL 17 HG22 VAL 17 2.298 -4.014 1.366 137 HG23 VAL 17 HG23 VAL 17 1.968 -4.678 -0.233 138 H ASP 18 H ASP 18 -0.474 -4.204 3.544 139 HA ASP 18 HA ASP 18 -0.261 -1.303 3.615 140 HB2 ASP 18 HB2 ASP 18 -0.832 -3.351 5.767 141 HB3 ASP 18 HB1 ASP 18 -0.630 -1.634 6.094 142 H SER 19 H SER 19 1.127 -0.547 5.602 143 HA SER 19 HA SER 19 3.805 -1.122 4.920 144 HB2 SER 19 HB2 SER 19 4.351 0.359 6.847 145 HB3 SER 19 HB1 SER 19 3.183 1.072 5.733 146 HG SER 19 HG SER 19 2.802 0.067 8.340 147 H ASP 20 H ASP 20 1.688 -2.226 7.490 148 HA ASP 20 HA ASP 20 3.924 -3.790 8.566 149 HB2 ASP 20 HB2 ASP 20 1.472 -2.726 9.952 150 HB3 ASP 20 HB1 ASP 20 2.586 -3.876 10.688 151 H THR 21 H THR 21 2.006 -4.494 6.359 152 HA THR 21 HA THR 21 0.385 -6.628 7.285 153 HB THR 21 HB THR 21 1.613 -6.140 4.553 154 HG1 THR 21 HG1 THR 21 -0.852 -5.449 5.765 155 HG21 THR 21 HG21 THR 21 -0.634 -8.017 5.331 156 HG22 THR 21 HG22 THR 21 0.988 -8.504 4.836 157 HG23 THR 21 HG23 THR 21 -0.074 -7.696 3.687 158 H SER 22 H SER 22 1.167 -8.403 8.263 159 HA SER 22 HA SER 22 3.873 -9.201 8.129 160 HB2 SER 22 HB2 SER 22 1.437 -10.742 9.055 161 HB3 SER 22 HB1 SER 22 3.108 -11.233 9.330 162 HG SER 22 HG SER 22 1.965 -8.782 10.219 163 H ILE 23 H ILE 23 4.838 -10.969 7.106 164 HA ILE 23 HA ILE 23 4.099 -11.424 4.460 165 HB ILE 23 HB ILE 23 5.908 -13.058 6.245 166 HG12 ILE 23 HG12 ILE 23 6.634 -10.751 5.876 167 HG13 ILE 23 HG11 ILE 23 7.716 -11.888 5.079 168 HG21 ILE 23 HG21 ILE 23 5.589 -13.224 3.245 169 HG22 ILE 23 HG22 ILE 23 5.165 -14.476 4.410 170 HG23 ILE 23 HG23 ILE 23 6.853 -14.021 4.178 171 HD11 ILE 23 HD11 ILE 23 7.347 -10.018 3.638 172 HD12 ILE 23 HD12 ILE 23 5.598 -10.185 3.785 173 HD13 ILE 23 HD13 ILE 23 6.535 -11.422 2.947 174 H PHE 24 H PHE 24 3.325 -13.287 7.363 175 HA PHE 24 HA PHE 24 2.189 -15.534 6.116 176 HB2 PHE 24 HB2 PHE 24 2.616 -15.362 8.572 177 HB3 PHE 24 HB1 PHE 24 1.268 -14.242 8.692 178 HD1 PHE 24 HD1 PHE 24 2.167 -17.709 7.791 179 HD2 PHE 24 HD2 PHE 24 -0.941 -15.008 8.853 180 HE1 PHE 24 HE1 PHE 24 0.613 -19.593 8.026 181 HE2 PHE 24 HE2 PHE 24 -2.501 -16.888 9.093 182 HZ PHE 24 HZ PHE 24 -1.728 -19.188 8.680 183 H GLN 25 H GLN 25 0.808 -12.419 7.002 184 HA GLN 25 HA GLN 25 -1.844 -12.963 6.268 185 HB2 GLN 25 HB2 GLN 25 -0.316 -10.363 6.370 186 HB3 GLN 25 HB1 GLN 25 -2.045 -10.464 6.073 187 HG2 GLN 25 HG2 GLN 25 -0.614 -11.398 8.551 188 HG3 GLN 25 HG1 GLN 25 -1.575 -9.928 8.393 189 HE21 GLN 25 HE21 GLN 25 -1.643 -13.372 8.687 190 HE22 GLN 25 HE22 GLN 25 -3.341 -13.519 8.960 191 H LEU 26 H LEU 26 0.840 -11.512 4.475 192 HA LEU 26 HA LEU 26 -0.577 -11.069 2.087 193 HB2 LEU 26 HB2 LEU 26 1.536 -9.973 2.530 194 HB3 LEU 26 HB1 LEU 26 2.366 -11.515 2.575 195 HG LEU 26 HG LEU 26 2.047 -11.823 0.199 196 HD11 LEU 26 HD11 LEU 26 1.012 -10.047 -1.171 197 HD12 LEU 26 HD12 LEU 26 0.489 -9.246 0.313 198 HD13 LEU 26 HD13 LEU 26 -0.133 -10.843 -0.092 199 HD21 LEU 26 HD21 LEU 26 3.977 -10.535 0.906 200 HD22 LEU 26 HD22 LEU 26 3.022 -9.055 0.867 201 HD23 LEU 26 HD23 LEU 26 3.361 -9.925 -0.631 202 H LYS 27 H LYS 27 1.347 -13.813 3.214 203 HA LYS 27 HA LYS 27 1.227 -15.400 0.923 204 HB2 LYS 27 HB2 LYS 27 2.656 -15.908 2.851 205 HB3 LYS 27 HB1 LYS 27 1.236 -16.235 3.831 206 HG2 LYS 27 HG2 LYS 27 0.681 -18.118 2.341 207 HG3 LYS 27 HG1 LYS 27 2.168 -17.809 1.441 208 HD2 LYS 27 HD2 LYS 27 3.481 -18.216 3.448 209 HD3 LYS 27 HD1 LYS 27 2.002 -18.487 4.377 210 HE2 LYS 27 HE2 LYS 27 1.470 -20.368 2.855 211 HE3 LYS 27 HE1 LYS 27 3.030 -20.130 2.071 212 HZ1 LYS 27 HZ1 LYS 27 3.218 -21.863 3.677 213 HZ2 LYS 27 HZ2 LYS 27 2.560 -20.898 4.896 214 HZ3 LYS 27 HZ3 LYS 27 4.076 -20.525 4.249 215 H GLU 28 H GLU 28 -0.956 -15.198 3.698 216 HA GLU 28 HA GLU 28 -2.833 -17.096 2.831 217 HB2 GLU 28 HB2 GLU 28 -2.795 -14.883 4.808 218 HB3 GLU 28 HB1 GLU 28 -4.359 -15.536 4.341 219 HG2 GLU 28 HG2 GLU 28 -2.247 -17.464 5.083 220 HG3 GLU 28 HG1 GLU 28 -2.962 -16.508 6.376 221 H VAL 29 H VAL 29 -2.628 -13.594 2.330 222 HA VAL 29 HA VAL 29 -5.075 -13.208 1.046 223 HB VAL 29 HB VAL 29 -2.438 -11.764 0.643 224 HG11 VAL 29 HG11 VAL 29 -5.175 -10.981 -0.358 225 HG12 VAL 29 HG12 VAL 29 -3.810 -11.483 -1.354 226 HG13 VAL 29 HG13 VAL 29 -3.726 -9.979 -0.436 227 HG21 VAL 29 HG21 VAL 29 -4.929 -11.023 2.174 228 HG22 VAL 29 HG22 VAL 29 -3.492 -10.016 1.998 229 HG23 VAL 29 HG23 VAL 29 -3.396 -11.545 2.871 230 H VAL 30 H VAL 30 -1.902 -13.988 -0.361 231 HA VAL 30 HA VAL 30 -2.855 -14.153 -3.025 232 HB VAL 30 HB VAL 30 -0.412 -15.476 -1.815 233 HG11 VAL 30 HG11 VAL 30 -1.036 -16.493 -3.941 234 HG12 VAL 30 HG12 VAL 30 0.437 -15.543 -4.119 235 HG13 VAL 30 HG13 VAL 30 -1.099 -14.903 -4.699 236 HG21 VAL 30 HG21 VAL 30 0.818 -13.553 -2.698 237 HG22 VAL 30 HG22 VAL 30 -0.399 -13.048 -1.527 238 HG23 VAL 30 HG23 VAL 30 -0.694 -12.835 -3.252 239 H ALA 31 H ALA 31 -2.416 -16.546 -0.468 240 HA ALA 31 HA ALA 31 -2.909 -18.862 -1.933 241 HB1 ALA 31 HB1 ALA 31 -3.634 -18.335 0.944 242 HB2 ALA 31 HB2 ALA 31 -2.044 -18.835 0.366 243 HB3 ALA 31 HB3 ALA 31 -3.427 -19.916 0.188 244 H LYS 32 H LYS 32 -5.226 -16.966 -0.003 245 HA LYS 32 HA LYS 32 -7.470 -18.511 -0.803 246 HB2 LYS 32 HB2 LYS 32 -8.819 -16.786 0.254 247 HB3 LYS 32 HB1 LYS 32 -7.436 -17.183 1.261 248 HG2 LYS 32 HG2 LYS 32 -6.281 -15.177 0.457 249 HG3 LYS 32 HG1 LYS 32 -7.689 -14.774 -0.525 250 HD2 LYS 32 HD2 LYS 32 -7.707 -13.498 1.530 251 HD3 LYS 32 HD1 LYS 32 -9.047 -14.644 1.509 252 HE2 LYS 32 HE2 LYS 32 -7.823 -16.158 2.954 253 HE3 LYS 32 HE1 LYS 32 -6.412 -15.102 2.912 254 HZ1 LYS 32 HZ1 LYS 32 -7.724 -13.398 4.021 255 HZ2 LYS 32 HZ2 LYS 32 -7.665 -14.808 4.941 256 HZ3 LYS 32 HZ3 LYS 32 -9.062 -14.426 4.077 257 H ARG 33 H ARG 33 -5.867 -15.740 -2.165 258 HA ARG 33 HA ARG 33 -8.008 -14.899 -3.823 259 HB2 ARG 33 HB2 ARG 33 -6.056 -13.479 -3.134 260 HB3 ARG 33 HB1 ARG 33 -5.064 -14.409 -4.251 261 HG2 ARG 33 HG2 ARG 33 -6.189 -13.567 -6.128 262 HG3 ARG 33 HG1 ARG 33 -7.522 -12.945 -5.152 263 HD2 ARG 33 HD2 ARG 33 -4.677 -11.939 -5.103 264 HD3 ARG 33 HD1 ARG 33 -6.038 -11.145 -5.897 265 HE ARG 33 HE ARG 33 -6.525 -11.639 -3.124 266 HH11 ARG 33 HH11 ARG 33 -4.975 -9.411 -5.354 267 HH12 ARG 33 HH12 ARG 33 -5.064 -8.066 -4.276 268 HH21 ARG 33 HH21 ARG 33 -6.651 -9.856 -1.695 269 HH22 ARG 33 HH22 ARG 33 -6.029 -8.317 -2.179 270 H GLN 34 H GLN 34 -5.536 -17.304 -4.087 271 HA GLN 34 HA GLN 34 -6.209 -17.727 -6.914 272 HB2 GLN 34 HB2 GLN 34 -3.817 -18.701 -5.349 273 HB3 GLN 34 HB1 GLN 34 -4.098 -18.960 -7.067 274 HG2 GLN 34 HG2 GLN 34 -3.818 -16.254 -5.781 275 HG3 GLN 34 HG1 GLN 34 -2.500 -17.117 -6.561 276 HE21 GLN 34 HE21 GLN 34 -5.493 -15.405 -7.034 277 HE22 GLN 34 HE22 GLN 34 -5.324 -15.172 -8.736 278 H GLY 35 H GLY 35 -7.189 -18.761 -4.036 279 HA2 GLY 35 HA2 GLY 35 -8.461 -20.553 -3.385 280 HA3 GLY 35 HA1 GLY 35 -8.466 -21.064 -5.063 281 H VAL 36 H VAL 36 -5.798 -20.738 -2.718 282 HA VAL 36 HA VAL 36 -5.424 -23.647 -2.877 283 HB VAL 36 HB VAL 36 -2.967 -23.353 -2.932 284 HG11 VAL 36 HG11 VAL 36 -4.370 -22.066 -5.266 285 HG12 VAL 36 HG12 VAL 36 -4.214 -23.800 -4.975 286 HG13 VAL 36 HG13 VAL 36 -2.779 -22.832 -5.282 287 HG21 VAL 36 HG21 VAL 36 -2.008 -21.185 -3.569 288 HG22 VAL 36 HG22 VAL 36 -2.818 -21.104 -2.004 289 HG23 VAL 36 HG23 VAL 36 -3.603 -20.445 -3.439 290 HA PRO 37 HA PRO 37 -4.947 -23.359 1.511 291 HB2 PRO 37 HB2 PRO 37 -3.496 -25.592 1.999 292 HB3 PRO 37 HB1 PRO 37 -5.200 -25.652 1.536 293 HG2 PRO 37 HG2 PRO 37 -2.765 -26.069 -0.151 294 HG3 PRO 37 HG1 PRO 37 -4.283 -26.984 -0.136 295 HD2 PRO 37 HD2 PRO 37 -3.715 -25.090 -1.997 296 HD3 PRO 37 HD1 PRO 37 -5.366 -25.448 -1.453 297 H ALA 38 H ALA 38 -3.661 -21.894 2.440 298 HA ALA 38 HA ALA 38 -1.043 -21.301 1.585 299 HB1 ALA 38 HB1 ALA 38 -2.481 -19.654 2.660 300 HB2 ALA 38 HB2 ALA 38 -0.937 -19.793 3.499 301 HB3 ALA 38 HB3 ALA 38 -2.381 -20.539 4.181 302 H ASP 39 H ASP 39 -2.244 -23.590 3.871 303 HA ASP 39 HA ASP 39 0.086 -23.914 5.446 304 HB2 ASP 39 HB2 ASP 39 -2.171 -25.825 4.830 305 HB3 ASP 39 HB1 ASP 39 -0.876 -26.191 5.966 306 H GLN 40 H GLN 40 -0.710 -24.940 2.266 307 HA GLN 40 HA GLN 40 1.714 -26.616 2.188 308 HB2 GLN 40 HB2 GLN 40 -0.790 -26.858 0.508 309 HB3 GLN 40 HB1 GLN 40 0.645 -27.858 0.345 310 HG2 GLN 40 HG2 GLN 40 0.301 -28.707 2.620 311 HG3 GLN 40 HG1 GLN 40 -1.157 -27.725 2.753 312 HE21 GLN 40 HE21 GLN 40 -2.994 -28.321 1.602 313 HE22 GLN 40 HE22 GLN 40 -3.167 -29.885 0.904 314 H LEU 41 H LEU 41 1.301 -23.713 1.774 315 HA LEU 41 HA LEU 41 1.930 -23.437 -1.072 316 HB2 LEU 41 HB2 LEU 41 0.071 -22.099 -0.126 317 HB3 LEU 41 HB1 LEU 41 1.207 -21.328 0.959 318 HG LEU 41 HG LEU 41 2.389 -20.385 -0.997 319 HD11 LEU 41 HD11 LEU 41 1.266 -20.454 -3.182 320 HD12 LEU 41 HD12 LEU 41 0.089 -21.594 -2.531 321 HD13 LEU 41 HD13 LEU 41 1.787 -22.053 -2.655 322 HD21 LEU 41 HD21 LEU 41 -0.558 -19.762 -0.868 323 HD22 LEU 41 HD22 LEU 41 0.695 -18.716 -1.536 324 HD23 LEU 41 HD23 LEU 41 0.685 -19.093 0.187 325 H ARG 42 H ARG 42 3.844 -22.599 -1.761 326 HA ARG 42 HA ARG 42 5.923 -22.143 0.276 327 HB2 ARG 42 HB2 ARG 42 6.350 -24.104 -1.115 328 HB3 ARG 42 HB1 ARG 42 6.122 -23.153 -2.574 329 HG2 ARG 42 HG2 ARG 42 8.471 -23.561 -2.201 330 HG3 ARG 42 HG1 ARG 42 8.122 -21.841 -2.011 331 HD2 ARG 42 HD2 ARG 42 9.634 -22.635 -0.271 332 HD3 ARG 42 HD1 ARG 42 8.096 -22.103 0.406 333 HE ARG 42 HE ARG 42 8.572 -24.950 -0.125 334 HH11 ARG 42 HH11 ARG 42 7.876 -22.351 2.126 335 HH12 ARG 42 HH12 ARG 42 7.550 -23.418 3.452 336 HH21 ARG 42 HH21 ARG 42 8.132 -26.363 1.633 337 HH22 ARG 42 HH22 ARG 42 7.687 -25.709 3.168 338 H VAL 43 H VAL 43 6.928 -20.172 0.305 339 HA VAL 43 HA VAL 43 6.397 -18.416 -1.985 340 HB VAL 43 HB VAL 43 6.432 -16.458 -0.441 341 HG11 VAL 43 HG11 VAL 43 4.306 -17.412 -1.145 342 HG12 VAL 43 HG12 VAL 43 4.201 -16.801 0.504 343 HG13 VAL 43 HG13 VAL 43 4.347 -18.534 0.214 344 HG21 VAL 43 HG21 VAL 43 6.136 -16.824 1.980 345 HG22 VAL 43 HG22 VAL 43 7.703 -17.399 1.410 346 HG23 VAL 43 HG23 VAL 43 6.409 -18.550 1.737 347 H ILE 44 H ILE 44 8.188 -18.267 -3.114 348 HA ILE 44 HA ILE 44 10.742 -18.117 -1.679 349 HB ILE 44 HB ILE 44 10.200 -18.829 -4.571 350 HG12 ILE 44 HG12 ILE 44 9.545 -20.605 -3.021 351 HG13 ILE 44 HG11 ILE 44 10.972 -21.077 -3.935 352 HG21 ILE 44 HG21 ILE 44 12.811 -18.747 -3.061 353 HG22 ILE 44 HG22 ILE 44 12.322 -17.667 -4.368 354 HG23 ILE 44 HG23 ILE 44 12.594 -19.378 -4.693 355 HD11 ILE 44 HD11 ILE 44 10.916 -20.098 -1.085 356 HD12 ILE 44 HD12 ILE 44 12.372 -20.501 -1.995 357 HD13 ILE 44 HD13 ILE 44 11.186 -21.754 -1.630 358 H PHE 45 H PHE 45 11.079 -16.039 -1.261 359 HA PHE 45 HA PHE 45 10.614 -14.046 -3.328 360 HB2 PHE 45 HB2 PHE 45 9.953 -13.532 -1.017 361 HB3 PHE 45 HB1 PHE 45 11.620 -13.751 -0.494 362 HD1 PHE 45 HD1 PHE 45 9.732 -11.818 -3.055 363 HD2 PHE 45 HD2 PHE 45 12.852 -11.838 -0.170 364 HE1 PHE 45 HE1 PHE 45 10.145 -9.438 -3.493 365 HE2 PHE 45 HE2 PHE 45 13.274 -9.457 -0.606 366 HZ PHE 45 HZ PHE 45 11.914 -8.255 -2.269 367 H ALA 46 H ALA 46 12.104 -13.823 -4.794 368 HA ALA 46 HA ALA 46 14.081 -13.586 -5.849 369 HB1 ALA 46 HB1 ALA 46 15.305 -13.323 -3.098 370 HB2 ALA 46 HB2 ALA 46 14.670 -11.994 -4.068 371 HB3 ALA 46 HB3 ALA 46 16.075 -12.903 -4.626 372 H GLY 47 H GLY 47 14.845 -15.470 -2.917 373 HA2 GLY 47 HA2 GLY 47 15.185 -17.863 -4.480 374 HA3 GLY 47 HA1 GLY 47 16.704 -17.187 -3.918 375 H LYS 48 H LYS 48 14.086 -16.616 -1.762 376 HA LYS 48 HA LYS 48 14.401 -19.092 -0.342 377 HB2 LYS 48 HB2 LYS 48 15.190 -17.895 1.781 378 HB3 LYS 48 HB1 LYS 48 16.377 -18.224 0.535 379 HG2 LYS 48 HG2 LYS 48 16.778 -16.031 1.406 380 HG3 LYS 48 HG1 LYS 48 16.145 -15.859 -0.228 381 HD2 LYS 48 HD2 LYS 48 13.993 -15.237 0.604 382 HD3 LYS 48 HD1 LYS 48 14.454 -15.642 2.257 383 HE2 LYS 48 HE2 LYS 48 15.718 -13.467 0.591 384 HE3 LYS 48 HE1 LYS 48 14.467 -13.205 1.806 385 HZ1 LYS 48 HZ1 LYS 48 16.684 -12.774 2.676 386 HZ2 LYS 48 HZ2 LYS 48 17.159 -14.353 2.332 387 HZ3 LYS 48 HZ3 LYS 48 15.961 -14.066 3.490 388 H GLU 49 H GLU 49 13.226 -19.129 1.740 389 HA GLU 49 HA GLU 49 10.592 -18.053 1.449 390 HB2 GLU 49 HB2 GLU 49 12.022 -19.803 3.384 391 HB3 GLU 49 HB1 GLU 49 10.548 -19.022 3.924 392 HG2 GLU 49 HG2 GLU 49 10.433 -20.443 1.337 393 HG3 GLU 49 HG1 GLU 49 10.596 -21.429 2.791 394 H LEU 50 H LEU 50 9.538 -16.706 3.048 395 HA LEU 50 HA LEU 50 11.423 -14.806 4.250 396 HB2 LEU 50 HB2 LEU 50 8.564 -14.397 3.421 397 HB3 LEU 50 HB1 LEU 50 9.543 -13.195 4.238 398 HG LEU 50 HG LEU 50 9.909 -14.293 1.465 399 HD11 LEU 50 HD11 LEU 50 8.181 -12.612 1.665 400 HD12 LEU 50 HD12 LEU 50 9.573 -11.965 0.796 401 HD13 LEU 50 HD13 LEU 50 9.305 -11.527 2.484 402 HD21 LEU 50 HD21 LEU 50 11.700 -12.449 3.046 403 HD22 LEU 50 HD22 LEU 50 11.820 -12.708 1.310 404 HD23 LEU 50 HD23 LEU 50 12.112 -14.045 2.417 405 H ARG 51 H ARG 51 10.731 -13.765 6.192 406 HA ARG 51 HA ARG 51 9.812 -15.612 8.140 407 HB2 ARG 51 HB2 ARG 51 10.208 -13.830 9.748 408 HB3 ARG 51 HB1 ARG 51 11.555 -13.920 8.632 409 HG2 ARG 51 HG2 ARG 51 9.323 -11.911 8.500 410 HG3 ARG 51 HG1 ARG 51 10.904 -11.604 9.218 411 HD2 ARG 51 HD2 ARG 51 10.255 -12.176 6.324 412 HD3 ARG 51 HD1 ARG 51 10.790 -10.648 7.006 413 HE ARG 51 HE ARG 51 12.717 -12.659 7.517 414 HH11 ARG 51 HH11 ARG 51 11.444 -10.670 4.922 415 HH12 ARG 51 HH12 ARG 51 12.912 -10.697 4.006 416 HH21 ARG 51 HH21 ARG 51 14.672 -12.668 6.315 417 HH22 ARG 51 HH22 ARG 51 14.760 -11.830 4.807 418 H ASN 52 H ASN 52 7.757 -16.146 8.274 419 HA ASN 52 HA ASN 52 5.651 -14.711 7.076 420 HB2 ASN 52 HB2 ASN 52 5.640 -17.015 9.014 421 HB3 ASN 52 HB1 ASN 52 4.172 -16.353 8.318 422 HD21 ASN 52 HD21 ASN 52 7.027 -18.213 7.748 423 HD22 ASN 52 HD22 ASN 52 6.593 -18.766 6.170 424 H ASP 53 H ASP 53 6.941 -14.549 10.286 425 HA ASP 53 HA ASP 53 4.523 -13.423 11.397 426 HB2 ASP 53 HB2 ASP 53 7.236 -13.926 12.605 427 HB3 ASP 53 HB1 ASP 53 5.886 -13.221 13.489 428 H TRP 54 H TRP 54 7.263 -12.129 9.823 429 HA TRP 54 HA TRP 54 6.917 -9.583 11.222 430 HB2 TRP 54 HB2 TRP 54 9.217 -10.633 10.976 431 HB3 TRP 54 HB1 TRP 54 9.110 -10.237 9.268 432 HD1 TRP 54 HD1 TRP 54 10.708 -8.276 8.920 433 HE1 TRP 54 HE1 TRP 54 11.102 -5.998 10.050 434 HE3 TRP 54 HE3 TRP 54 7.488 -8.739 12.870 435 HZ2 TRP 54 HZ2 TRP 54 10.165 -4.581 12.287 436 HZ3 TRP 54 HZ3 TRP 54 7.300 -6.876 14.447 437 HH2 TRP 54 HH2 TRP 54 8.611 -4.838 14.167 438 H THR 55 H THR 55 7.395 -7.619 9.669 439 HA THR 55 HA THR 55 5.079 -7.545 8.009 440 HB THR 55 HB THR 55 5.555 -5.161 7.781 441 HG1 THR 55 HG1 THR 55 7.462 -4.401 9.013 442 HG21 THR 55 HG21 THR 55 6.046 -6.155 10.595 443 HG22 THR 55 HG22 THR 55 4.463 -5.986 9.836 444 HG23 THR 55 HG23 THR 55 5.447 -4.558 10.151 445 H VAL 56 H VAL 56 4.965 -6.856 5.862 446 HA VAL 56 HA VAL 56 6.849 -8.096 4.132 447 HB VAL 56 HB VAL 56 4.462 -8.126 3.627 448 HG11 VAL 56 HG11 VAL 56 3.252 -6.143 2.930 449 HG12 VAL 56 HG12 VAL 56 4.673 -5.146 3.239 450 HG13 VAL 56 HG13 VAL 56 3.857 -5.957 4.576 451 HG21 VAL 56 HG21 VAL 56 6.035 -6.555 1.596 452 HG22 VAL 56 HG22 VAL 56 4.537 -7.428 1.275 453 HG23 VAL 56 HG23 VAL 56 5.987 -8.310 1.757 454 H GLN 57 H GLN 57 6.266 -4.821 5.194 455 HA GLN 57 HA GLN 57 7.600 -3.501 3.107 456 HB2 GLN 57 HB2 GLN 57 6.092 -2.349 4.662 457 HB3 GLN 57 HB1 GLN 57 7.244 -2.610 5.966 458 HG2 GLN 57 HG2 GLN 57 8.879 -1.221 4.817 459 HG3 GLN 57 HG1 GLN 57 7.750 -0.981 3.486 460 HE21 GLN 57 HE21 GLN 57 6.728 -1.073 6.817 461 HE22 GLN 57 HE22 GLN 57 6.338 0.604 6.936 462 H ASN 58 H ASN 58 8.733 -4.850 6.149 463 HA ASN 58 HA ASN 58 11.359 -3.770 5.971 464 HB2 ASN 58 HB2 ASN 58 10.308 -4.554 8.088 465 HB3 ASN 58 HB1 ASN 58 10.438 -6.208 7.504 466 HD21 ASN 58 HD21 ASN 58 12.412 -7.240 7.568 467 HD22 ASN 58 HD22 ASN 58 13.800 -6.560 8.335 468 H CYS 59 H CYS 59 9.796 -6.427 4.479 469 HA CYS 59 HA CYS 59 12.205 -7.900 3.918 470 HB2 CYS 59 HB2 CYS 59 9.430 -8.214 2.766 471 HB3 CYS 59 HB1 CYS 59 10.747 -9.371 2.623 472 HG CYS 59 HG CYS 59 8.938 -8.592 5.423 473 H ASP 60 H ASP 60 10.407 -5.351 2.482 474 HA ASP 60 HA ASP 60 10.737 -4.014 0.702 475 HB2 ASP 60 HB2 ASP 60 13.441 -5.296 0.818 476 HB3 ASP 60 HB1 ASP 60 13.042 -4.132 -0.427 477 H LEU 61 H LEU 61 9.079 -5.740 -0.079 478 HA LEU 61 HA LEU 61 9.958 -7.371 -2.267 479 HB2 LEU 61 HB2 LEU 61 7.266 -6.623 -1.180 480 HB3 LEU 61 HB1 LEU 61 7.404 -7.451 -2.715 481 HG LEU 61 HG LEU 61 8.480 -9.357 -1.605 482 HD11 LEU 61 HD11 LEU 61 8.004 -7.822 0.942 483 HD12 LEU 61 HD12 LEU 61 9.573 -8.195 0.226 484 HD13 LEU 61 HD13 LEU 61 8.545 -9.497 0.830 485 HD21 LEU 61 HD21 LEU 61 5.891 -8.500 -0.332 486 HD22 LEU 61 HD22 LEU 61 6.524 -10.145 -0.370 487 HD23 LEU 61 HD23 LEU 61 6.070 -9.339 -1.871 488 H ASP 62 H ASP 62 8.936 -4.118 -1.896 489 HA ASP 62 HA ASP 62 8.364 -3.744 -4.709 490 HB2 ASP 62 HB2 ASP 62 7.070 -2.442 -3.127 491 HB3 ASP 62 HB1 ASP 62 8.538 -1.776 -2.420 492 H GLN 63 H GLN 63 11.003 -3.287 -2.499 493 HA GLN 63 HA GLN 63 12.539 -1.713 -4.380 494 HB2 GLN 63 HB2 GLN 63 12.799 -1.173 -2.054 495 HB3 GLN 63 HB1 GLN 63 13.210 -2.831 -1.664 496 HG2 GLN 63 HG2 GLN 63 15.255 -2.586 -3.059 497 HG3 GLN 63 HG1 GLN 63 14.858 -0.881 -3.248 498 HE21 GLN 63 HE21 GLN 63 15.070 0.492 -1.486 499 HE22 GLN 63 HE22 GLN 63 15.951 0.045 -0.067 500 H GLN 64 H GLN 64 12.752 -4.986 -2.971 501 HA GLN 64 HA GLN 64 15.004 -5.600 -4.688 502 HB2 GLN 64 HB2 GLN 64 13.538 -7.339 -2.700 503 HB3 GLN 64 HB1 GLN 64 15.021 -7.775 -3.529 504 HG2 GLN 64 HG2 GLN 64 16.083 -5.765 -2.448 505 HG3 GLN 64 HG1 GLN 64 14.624 -5.630 -1.468 506 HE21 GLN 64 HE21 GLN 64 17.351 -6.142 -0.632 507 HE22 GLN 64 HE22 GLN 64 17.335 -7.658 0.195 508 H SEP 65 H SEP 65 14.246 -8.435 -4.925 509 HA SEP 65 HA SEP 65 13.116 -8.310 -7.512 510 HB2 SEP 65 HB1 SEP 65 13.216 -10.829 -7.344 511 HB3 SEP 65 HB2 SEP 65 13.842 -10.609 -5.711 512 H ILE 66 H ILE 66 11.495 -10.348 -7.908 513 HA ILE 66 HA ILE 66 9.024 -9.507 -6.601 514 HB ILE 66 HB ILE 66 9.239 -9.574 -9.134 515 HG12 ILE 66 HG12 ILE 66 7.106 -11.427 -8.082 516 HG13 ILE 66 HG11 ILE 66 7.051 -9.676 -7.897 517 HG21 ILE 66 HG21 ILE 66 10.543 -11.640 -9.278 518 HG22 ILE 66 HG22 ILE 66 9.073 -11.708 -10.255 519 HG23 ILE 66 HG23 ILE 66 9.137 -12.543 -8.707 520 HD11 ILE 66 HD11 ILE 66 5.694 -10.469 -9.774 521 HD12 ILE 66 HD12 ILE 66 7.143 -11.140 -10.527 522 HD13 ILE 66 HD13 ILE 66 6.993 -9.399 -10.299 523 H VAL 67 H VAL 67 7.488 -11.178 -5.899 524 HA VAL 67 HA VAL 67 8.862 -13.313 -4.489 525 HB VAL 67 HB VAL 67 5.893 -12.830 -4.477 526 HG11 VAL 67 HG11 VAL 67 7.776 -13.966 -2.416 527 HG12 VAL 67 HG12 VAL 67 6.667 -14.883 -3.435 528 HG13 VAL 67 HG13 VAL 67 6.034 -13.769 -2.223 529 HG21 VAL 67 HG21 VAL 67 7.019 -10.693 -4.033 530 HG22 VAL 67 HG22 VAL 67 7.903 -11.453 -2.708 531 HG23 VAL 67 HG23 VAL 67 6.151 -11.308 -2.629 532 H HIS 68 H HIS 68 8.954 -15.367 -5.174 533 HA HIS 68 HA HIS 68 7.208 -16.177 -7.391 534 HB2 HIS 68 HB2 HIS 68 9.683 -17.517 -6.245 535 HB3 HIS 68 HB1 HIS 68 8.747 -18.125 -7.601 536 HD2 HIS 68 HD2 HIS 68 9.080 -14.436 -8.103 537 HE1 HIS 68 HE1 HIS 68 12.454 -16.167 -9.980 538 HE2 HIS 68 HE2 HIS 68 11.202 -14.014 -9.544 539 H ILE 69 H ILE 69 5.337 -16.971 -6.626 540 HA ILE 69 HA ILE 69 5.475 -18.648 -4.233 541 HB ILE 69 HB ILE 69 3.113 -17.140 -5.371 542 HG12 ILE 69 HG12 ILE 69 4.841 -16.705 -2.928 543 HG13 ILE 69 HG11 ILE 69 4.687 -15.647 -4.321 544 HG21 ILE 69 HG21 ILE 69 1.922 -17.853 -3.351 545 HG22 ILE 69 HG22 ILE 69 3.310 -18.838 -2.886 546 HG23 ILE 69 HG23 ILE 69 2.403 -19.226 -4.348 547 HD11 ILE 69 HD11 ILE 69 3.478 -14.801 -2.373 548 HD12 ILE 69 HD12 ILE 69 2.487 -16.262 -2.361 549 HD13 ILE 69 HD13 ILE 69 2.399 -15.146 -3.723 550 H VAL 70 H VAL 70 4.951 -20.689 -4.316 551 HA VAL 70 HA VAL 70 3.403 -21.748 -6.543 552 HB VAL 70 HB VAL 70 5.801 -21.893 -7.216 553 HG11 VAL 70 HG11 VAL 70 7.325 -23.386 -6.064 554 HG12 VAL 70 HG12 VAL 70 6.101 -23.719 -4.841 555 HG13 VAL 70 HG13 VAL 70 6.780 -22.098 -4.990 556 HG21 VAL 70 HG21 VAL 70 4.210 -23.528 -8.069 557 HG22 VAL 70 HG22 VAL 70 4.494 -24.558 -6.667 558 HG23 VAL 70 HG23 VAL 70 5.792 -24.268 -7.825 559 H GLN 71 H GLN 71 2.456 -23.808 -6.024 560 HA GLN 71 HA GLN 71 2.285 -24.202 -3.124 561 HB2 GLN 71 HB2 GLN 71 0.235 -23.704 -4.523 562 HB3 GLN 71 HB1 GLN 71 0.449 -25.292 -5.241 563 HG2 GLN 71 HG2 GLN 71 0.411 -26.125 -2.790 564 HG3 GLN 71 HG1 GLN 71 -0.352 -24.567 -2.468 565 HE21 GLN 71 HE21 GLN 71 -1.495 -27.159 -2.191 566 HE22 GLN 71 HE22 GLN 71 -2.858 -27.234 -3.251 567 H ARG 72 H ARG 72 2.475 -26.251 -2.210 568 HA ARG 72 HA ARG 72 3.223 -28.455 -3.988 569 HB2 ARG 72 HB2 ARG 72 5.304 -27.498 -3.001 570 HB3 ARG 72 HB1 ARG 72 4.654 -27.814 -1.399 571 HG2 ARG 72 HG2 ARG 72 4.535 -30.242 -2.022 572 HG3 ARG 72 HG1 ARG 72 5.415 -29.837 -3.496 573 HD2 ARG 72 HD2 ARG 72 7.251 -28.944 -2.132 574 HD3 ARG 72 HD1 ARG 72 6.367 -29.384 -0.674 575 HE ARG 72 HE ARG 72 7.137 -31.431 -2.630 576 HH11 ARG 72 HH11 ARG 72 7.290 -30.133 0.641 577 HH12 ARG 72 HH12 ARG 72 8.083 -31.525 1.284 578 HH21 ARG 72 HH21 ARG 72 8.217 -33.271 -1.749 579 HH22 ARG 72 HH22 ARG 72 8.602 -33.296 -0.064 580 HA PRO 73 HA PRO 73 0.030 -29.763 -1.040 581 HB2 PRO 73 HB2 PRO 73 -1.578 -30.982 -2.780 582 HB3 PRO 73 HB1 PRO 73 -1.560 -29.220 -2.628 583 HG2 PRO 73 HG2 PRO 73 -0.336 -30.960 -4.718 584 HG3 PRO 73 HG1 PRO 73 -1.099 -29.369 -4.884 585 HD2 PRO 73 HD2 PRO 73 1.642 -29.848 -4.755 586 HD3 PRO 73 HD1 PRO 73 0.852 -28.283 -4.471 587 H TRP 74 H TRP 74 -0.005 -31.625 0.031 588 HA TRP 74 HA TRP 74 1.077 -34.004 -1.303 589 HB2 TRP 74 HB2 TRP 74 2.635 -33.082 0.418 590 HB3 TRP 74 HB1 TRP 74 1.374 -33.303 1.628 591 HD1 TRP 74 HD1 TRP 74 3.040 -35.622 -1.018 592 HE1 TRP 74 HE1 TRP 74 3.532 -37.879 0.109 593 HE3 TRP 74 HE3 TRP 74 1.230 -34.606 3.656 594 HZ2 TRP 74 HZ2 TRP 74 3.202 -39.072 2.640 595 HZ3 TRP 74 HZ3 TRP 74 1.360 -36.365 5.372 596 HH2 TRP 74 HH2 TRP 74 2.326 -38.549 4.872 597 H ARG 75 H ARG 75 -0.361 -35.537 -1.512 598 HA ARG 75 HA ARG 75 -2.087 -36.957 -1.163 599 HB2 ARG 75 HB2 ARG 75 -2.214 -35.777 1.619 600 HB3 ARG 75 HB1 ARG 75 -3.114 -37.181 1.079 601 HG2 ARG 75 HG2 ARG 75 -0.139 -36.920 1.435 602 HG3 ARG 75 HG1 ARG 75 -1.254 -37.964 2.316 603 HD2 ARG 75 HD2 ARG 75 -0.395 -38.194 -0.560 604 HD3 ARG 75 HD1 ARG 75 -0.069 -39.314 0.760 605 HE ARG 75 HE ARG 75 -2.853 -39.030 0.408 606 HH11 ARG 75 HH11 ARG 75 -0.036 -40.524 -1.055 607 HH12 ARG 75 HH12 ARG 75 -0.950 -41.738 -1.877 608 HH21 ARG 75 HH21 ARG 75 -4.065 -40.637 -0.700 609 HH22 ARG 75 HH22 ARG 75 -3.242 -41.799 -1.678 610 H LYS 76 H LYS 76 -2.340 -33.998 -1.881 611 HA LYS 76 HA LYS 76 -5.108 -33.521 -1.232 612 HB2 LYS 76 HB2 LYS 76 -3.280 -31.748 -1.120 613 HB3 LYS 76 HB1 LYS 76 -3.267 -31.801 -2.878 614 HG2 LYS 76 HG2 LYS 76 -4.616 -29.969 -2.113 615 HG3 LYS 76 HG1 LYS 76 -5.631 -31.182 -2.899 616 HD2 LYS 76 HD2 LYS 76 -6.228 -32.081 -0.694 617 HD3 LYS 76 HD1 LYS 76 -5.251 -30.824 0.067 618 HE2 LYS 76 HE2 LYS 76 -7.527 -30.160 0.104 619 HE3 LYS 76 HE1 LYS 76 -6.647 -29.148 -1.045 620 HZ1 LYS 76 HZ1 LYS 76 -8.818 -29.882 -1.898 621 HZ2 LYS 76 HZ2 LYS 76 -8.318 -31.490 -1.780 622 HZ3 LYS 76 HZ3 LYS 76 -7.544 -30.448 -2.857 Start of MODEL 25 1 H1 MET 1 HT1 MET 1 2.721 -0.829 0.915 2 H2 MET 1 HT2 MET 1 1.693 0.198 0.057 3 H3 MET 1 HT3 MET 1 3.008 0.837 0.893 4 HA MET 1 HA MET 1 3.391 0.777 -1.469 5 HB2 MET 1 HB2 MET 1 5.573 -0.264 -1.431 6 HB3 MET 1 HB1 MET 1 5.298 0.513 0.116 7 HG2 MET 1 HG2 MET 1 4.789 -1.652 1.119 8 HG3 MET 1 HG1 MET 1 5.025 -2.435 -0.444 9 HE1 MET 1 HE1 MET 1 6.785 -4.121 0.434 10 HE2 MET 1 HE2 MET 1 6.626 -3.509 2.086 11 HE3 MET 1 HE3 MET 1 8.224 -3.687 1.352 12 H ILE 2 H ILE 2 3.698 -0.443 -3.368 13 HA ILE 2 HA ILE 2 2.100 -2.897 -3.390 14 HB ILE 2 HB ILE 2 2.818 -1.035 -5.664 15 HG12 ILE 2 HG12 ILE 2 0.194 -1.476 -4.221 16 HG13 ILE 2 HG11 ILE 2 1.225 -0.060 -4.064 17 HG21 ILE 2 HG21 ILE 2 1.039 -3.473 -5.618 18 HG22 ILE 2 HG22 ILE 2 2.582 -3.316 -6.458 19 HG23 ILE 2 HG23 ILE 2 1.195 -2.354 -6.972 20 HD11 ILE 2 HD11 ILE 2 -0.172 -0.945 -6.575 21 HD12 ILE 2 HD12 ILE 2 0.831 0.495 -6.396 22 HD13 ILE 2 HD13 ILE 2 -0.685 0.357 -5.503 23 H VAL 3 H VAL 3 3.186 -4.724 -3.502 24 HA VAL 3 HA VAL 3 5.867 -4.686 -4.694 25 HB VAL 3 HB VAL 3 6.309 -6.774 -3.502 26 HG11 VAL 3 HG11 VAL 3 5.159 -4.646 -1.703 27 HG12 VAL 3 HG12 VAL 3 6.800 -4.701 -2.346 28 HG13 VAL 3 HG13 VAL 3 6.261 -5.926 -1.198 29 HG21 VAL 3 HG21 VAL 3 4.068 -7.735 -3.525 30 HG22 VAL 3 HG22 VAL 3 3.512 -6.494 -2.401 31 HG23 VAL 3 HG23 VAL 3 4.708 -7.681 -1.883 32 H PHE 4 H PHE 4 6.445 -6.756 -5.862 33 HA PHE 4 HA PHE 4 4.153 -7.511 -7.535 34 HB2 PHE 4 HB2 PHE 4 7.094 -7.489 -8.243 35 HB3 PHE 4 HB1 PHE 4 5.786 -7.966 -9.319 36 HD1 PHE 4 HD1 PHE 4 7.781 -5.282 -8.157 37 HD2 PHE 4 HD2 PHE 4 3.965 -6.212 -9.785 38 HE1 PHE 4 HE1 PHE 4 7.506 -2.935 -8.843 39 HE2 PHE 4 HE2 PHE 4 3.684 -3.873 -10.484 40 HZ PHE 4 HZ PHE 4 5.453 -2.232 -10.012 41 H VAL 5 H VAL 5 3.742 -9.648 -7.973 42 HA VAL 5 HA VAL 5 5.486 -11.598 -6.680 43 HB VAL 5 HB VAL 5 3.725 -10.981 -5.067 44 HG11 VAL 5 HG11 VAL 5 1.402 -11.591 -5.456 45 HG12 VAL 5 HG12 VAL 5 1.799 -12.015 -7.122 46 HG13 VAL 5 HG13 VAL 5 1.969 -10.347 -6.571 47 HG21 VAL 5 HG21 VAL 5 4.644 -13.225 -4.993 48 HG22 VAL 5 HG22 VAL 5 3.413 -13.775 -6.134 49 HG23 VAL 5 HG23 VAL 5 2.943 -13.210 -4.529 50 H ARG 6 H ARG 6 5.527 -13.594 -7.576 51 HA ARG 6 HA ARG 6 4.068 -14.007 -10.115 52 HB2 ARG 6 HB2 ARG 6 6.738 -15.126 -9.226 53 HB3 ARG 6 HB1 ARG 6 5.964 -15.425 -10.772 54 HG2 ARG 6 HG2 ARG 6 6.432 -12.603 -10.092 55 HG3 ARG 6 HG1 ARG 6 7.869 -13.587 -10.373 56 HD2 ARG 6 HD2 ARG 6 5.530 -13.355 -12.260 57 HD3 ARG 6 HD1 ARG 6 7.046 -12.465 -12.408 58 HE ARG 6 HE ARG 6 7.149 -15.386 -12.341 59 HH11 ARG 6 HH11 ARG 6 7.410 -12.435 -14.233 60 HH12 ARG 6 HH12 ARG 6 8.241 -13.205 -15.538 61 HH21 ARG 6 HH21 ARG 6 8.250 -16.389 -14.070 62 HH22 ARG 6 HH22 ARG 6 8.716 -15.454 -15.451 63 H PHE 7 H PHE 7 2.448 -15.447 -9.736 64 HA PHE 7 HA PHE 7 2.888 -17.523 -7.733 65 HB2 PHE 7 HB2 PHE 7 0.724 -16.218 -7.770 66 HB3 PHE 7 HB1 PHE 7 0.354 -16.997 -9.303 67 HD1 PHE 7 HD1 PHE 7 0.790 -17.516 -5.704 68 HD2 PHE 7 HD2 PHE 7 -0.349 -19.285 -9.397 69 HE1 PHE 7 HE1 PHE 7 -0.149 -19.433 -4.493 70 HE2 PHE 7 HE2 PHE 7 -1.290 -21.210 -8.188 71 HZ PHE 7 HZ PHE 7 -1.181 -21.291 -5.736 72 H ASN 8 H ASN 8 3.000 -19.669 -8.194 73 HA ASN 8 HA ASN 8 4.179 -20.571 -10.492 74 HB2 ASN 8 HB2 ASN 8 4.143 -21.909 -8.477 75 HB3 ASN 8 HB1 ASN 8 2.402 -22.134 -8.613 76 HD21 ASN 8 HD21 ASN 8 1.594 -23.619 -10.089 77 HD22 ASN 8 HD22 ASN 8 2.603 -24.760 -10.901 78 H SER 9 H SER 9 0.705 -20.793 -9.797 79 HA SER 9 HA SER 9 0.214 -21.735 -12.511 80 HB2 SER 9 HB2 SER 9 -1.722 -21.384 -10.218 81 HB3 SER 9 HB1 SER 9 -2.011 -22.263 -11.720 82 HG SER 9 HG SER 9 -0.737 -23.857 -11.077 83 H SER 10 H SER 10 1.020 -18.933 -12.004 84 HA SER 10 HA SER 10 -1.116 -17.677 -13.487 85 HB2 SER 10 HB2 SER 10 -1.531 -17.404 -10.926 86 HB3 SER 10 HB1 SER 10 -0.163 -16.294 -10.990 87 HG SER 10 HG SER 10 -2.728 -15.936 -11.775 88 H HIS 11 H HIS 11 -0.246 -15.102 -13.376 89 HA HIS 11 HA HIS 11 2.525 -15.299 -14.301 90 HB2 HIS 11 HB2 HIS 11 0.301 -13.469 -15.226 91 HB3 HIS 11 HB1 HIS 11 1.987 -13.253 -15.686 92 HD2 HIS 11 HD2 HIS 11 3.014 -15.797 -16.926 93 HE1 HIS 11 HE1 HIS 11 -0.765 -16.397 -18.725 94 HE2 HIS 11 HE2 HIS 11 1.717 -16.861 -18.896 95 H GLY 12 H GLY 12 3.268 -12.694 -14.362 96 HA2 GLY 12 HA2 GLY 12 3.576 -12.149 -11.552 97 HA3 GLY 12 HA1 GLY 12 4.299 -11.246 -12.875 98 H PHE 13 H PHE 13 2.241 -10.981 -10.374 99 HA PHE 13 HA PHE 13 0.953 -8.679 -11.621 100 HB2 PHE 13 HB2 PHE 13 -1.167 -9.184 -10.377 101 HB3 PHE 13 HB1 PHE 13 -0.799 -10.317 -11.664 102 HD1 PHE 13 HD1 PHE 13 -1.071 -9.857 -8.036 103 HD2 PHE 13 HD2 PHE 13 -0.269 -12.621 -11.170 104 HE1 PHE 13 HE1 PHE 13 -1.366 -11.725 -6.464 105 HE2 PHE 13 HE2 PHE 13 -0.554 -14.490 -9.600 106 HZ PHE 13 HZ PHE 13 -1.106 -14.045 -7.246 107 HA PRO 14 HA PRO 14 2.227 -6.717 -7.892 108 HB2 PRO 14 HB2 PRO 14 0.806 -4.459 -7.998 109 HB3 PRO 14 HB1 PRO 14 2.064 -4.806 -9.190 110 HG2 PRO 14 HG2 PRO 14 -0.903 -5.056 -9.439 111 HG3 PRO 14 HG1 PRO 14 0.277 -4.467 -10.622 112 HD2 PRO 14 HD2 PRO 14 -0.800 -7.017 -10.601 113 HD3 PRO 14 HD1 PRO 14 0.730 -6.570 -11.381 114 H VAL 15 H VAL 15 1.680 -6.556 -5.784 115 HA VAL 15 HA VAL 15 -1.147 -6.752 -5.043 116 HB VAL 15 HB VAL 15 1.107 -8.443 -3.894 117 HG11 VAL 15 HG11 VAL 15 -1.712 -8.102 -2.848 118 HG12 VAL 15 HG12 VAL 15 -0.242 -7.536 -2.056 119 HG13 VAL 15 HG13 VAL 15 -0.526 -9.265 -2.256 120 HG21 VAL 15 HG21 VAL 15 -1.547 -9.170 -5.134 121 HG22 VAL 15 HG22 VAL 15 -0.367 -10.306 -4.480 122 HG23 VAL 15 HG23 VAL 15 0.035 -9.335 -5.896 123 H GLU 16 H GLU 16 -1.670 -5.088 -3.862 124 HA GLU 16 HA GLU 16 0.353 -3.472 -2.599 125 HB2 GLU 16 HB2 GLU 16 -1.541 -2.431 -3.798 126 HB3 GLU 16 HB1 GLU 16 -2.650 -3.143 -2.637 127 HG2 GLU 16 HG2 GLU 16 -1.743 -1.817 -0.862 128 HG3 GLU 16 HG1 GLU 16 -0.460 -1.222 -1.914 129 H VAL 17 H VAL 17 0.912 -3.536 -0.545 130 HA VAL 17 HA VAL 17 -0.727 -5.173 1.270 131 HB VAL 17 HB VAL 17 1.316 -5.808 2.442 132 HG11 VAL 17 HG11 VAL 17 0.565 -7.241 0.631 133 HG12 VAL 17 HG12 VAL 17 2.327 -7.223 0.693 134 HG13 VAL 17 HG13 VAL 17 1.479 -6.286 -0.536 135 HG21 VAL 17 HG21 VAL 17 2.740 -4.175 0.335 136 HG22 VAL 17 HG22 VAL 17 3.528 -5.253 1.488 137 HG23 VAL 17 HG23 VAL 17 2.660 -3.831 2.064 138 H ASP 18 H ASP 18 -0.326 -4.643 3.614 139 HA ASP 18 HA ASP 18 -0.354 -1.724 3.930 140 HB2 ASP 18 HB2 ASP 18 -1.505 -3.934 5.638 141 HB3 ASP 18 HB1 ASP 18 -1.465 -2.247 6.132 142 H SER 19 H SER 19 0.208 -1.271 6.434 143 HA SER 19 HA SER 19 3.012 -1.794 6.586 144 HB2 SER 19 HB2 SER 19 1.212 -0.380 8.561 145 HB3 SER 19 HB1 SER 19 2.975 -0.320 8.528 146 HG SER 19 HG SER 19 1.103 0.870 6.825 147 H ASP 20 H ASP 20 0.279 -3.417 7.693 148 HA ASP 20 HA ASP 20 1.889 -4.817 9.721 149 HB2 ASP 20 HB2 ASP 20 -1.032 -4.111 9.716 150 HB3 ASP 20 HB1 ASP 20 -0.421 -5.440 10.694 151 H THR 21 H THR 21 1.345 -5.296 6.752 152 HA THR 21 HA THR 21 -0.105 -7.772 6.802 153 HB THR 21 HB THR 21 1.556 -6.560 4.580 154 HG1 THR 21 HG1 THR 21 -1.275 -6.495 4.878 155 HG21 THR 21 HG21 THR 21 -0.605 -8.678 4.507 156 HG22 THR 21 HG22 THR 21 1.123 -8.971 4.307 157 HG23 THR 21 HG23 THR 21 0.246 -8.016 3.111 158 H SER 22 H SER 22 0.962 -9.285 8.008 159 HA SER 22 HA SER 22 3.765 -9.656 7.911 160 HB2 SER 22 HB2 SER 22 1.610 -11.630 8.711 161 HB3 SER 22 HB1 SER 22 3.322 -11.740 9.115 162 HG SER 22 HG SER 22 3.132 -9.974 10.422 163 H ILE 23 H ILE 23 4.926 -11.331 6.857 164 HA ILE 23 HA ILE 23 4.248 -11.731 4.174 165 HB ILE 23 HB ILE 23 6.151 -13.298 5.915 166 HG12 ILE 23 HG12 ILE 23 6.698 -10.920 5.715 167 HG13 ILE 23 HG11 ILE 23 7.892 -11.921 4.896 168 HG21 ILE 23 HG21 ILE 23 5.901 -13.287 2.909 169 HG22 ILE 23 HG22 ILE 23 5.553 -14.643 3.984 170 HG23 ILE 23 HG23 ILE 23 7.203 -14.046 3.820 171 HD11 ILE 23 HD11 ILE 23 7.394 -9.965 3.586 172 HD12 ILE 23 HD12 ILE 23 5.675 -10.351 3.599 173 HD13 ILE 23 HD13 ILE 23 6.809 -11.403 2.750 174 H PHE 24 H PHE 24 3.639 -13.696 7.006 175 HA PHE 24 HA PHE 24 2.686 -16.035 5.778 176 HB2 PHE 24 HB2 PHE 24 3.208 -15.733 8.220 177 HB3 PHE 24 HB1 PHE 24 1.718 -14.813 8.373 178 HD1 PHE 24 HD1 PHE 24 3.076 -18.133 7.486 179 HD2 PHE 24 HD2 PHE 24 -0.332 -15.895 8.696 180 HE1 PHE 24 HE1 PHE 24 1.852 -20.220 7.878 181 HE2 PHE 24 HE2 PHE 24 -1.567 -17.983 9.093 182 HZ PHE 24 HZ PHE 24 -0.476 -20.152 8.687 183 H GLN 25 H GLN 25 1.069 -13.039 6.727 184 HA GLN 25 HA GLN 25 -1.537 -13.820 5.924 185 HB2 GLN 25 HB2 GLN 25 -0.361 -11.052 6.228 186 HB3 GLN 25 HB1 GLN 25 -2.069 -11.418 6.060 187 HG2 GLN 25 HG2 GLN 25 -2.027 -12.628 8.170 188 HG3 GLN 25 HG1 GLN 25 -0.304 -12.287 8.334 189 HE21 GLN 25 HE21 GLN 25 -3.508 -10.984 8.473 190 HE22 GLN 25 HE22 GLN 25 -3.081 -9.483 9.217 191 H LEU 26 H LEU 26 1.060 -11.966 4.387 192 HA LEU 26 HA LEU 26 -0.218 -11.293 2.001 193 HB2 LEU 26 HB2 LEU 26 1.946 -10.377 2.591 194 HB3 LEU 26 HB1 LEU 26 2.678 -11.966 2.521 195 HG LEU 26 HG LEU 26 2.311 -12.036 0.093 196 HD11 LEU 26 HD11 LEU 26 1.245 -9.243 0.456 197 HD12 LEU 26 HD12 LEU 26 0.327 -10.657 -0.061 198 HD13 LEU 26 HD13 LEU 26 1.602 -10.008 -1.090 199 HD21 LEU 26 HD21 LEU 26 3.955 -10.322 -0.519 200 HD22 LEU 26 HD22 LEU 26 4.421 -11.184 0.947 201 HD23 LEU 26 HD23 LEU 26 3.739 -9.561 1.057 202 H LYS 27 H LYS 27 1.561 -14.191 2.886 203 HA LYS 27 HA LYS 27 1.422 -15.609 0.494 204 HB2 LYS 27 HB2 LYS 27 2.753 -16.271 2.470 205 HB3 LYS 27 HB1 LYS 27 1.254 -16.633 3.323 206 HG2 LYS 27 HG2 LYS 27 0.774 -18.442 1.810 207 HG3 LYS 27 HG1 LYS 27 2.183 -18.039 0.825 208 HD2 LYS 27 HD2 LYS 27 2.657 -19.935 2.290 209 HD3 LYS 27 HD1 LYS 27 3.652 -18.544 2.721 210 HE2 LYS 27 HE2 LYS 27 2.780 -19.642 4.716 211 HE3 LYS 27 HE1 LYS 27 2.118 -18.018 4.558 212 HZ1 LYS 27 HZ1 LYS 27 0.079 -18.963 3.685 213 HZ2 LYS 27 HZ2 LYS 27 0.425 -19.647 5.185 214 HZ3 LYS 27 HZ3 LYS 27 0.719 -20.523 3.776 215 H GLU 28 H GLU 28 -0.845 -15.411 3.200 216 HA GLU 28 HA GLU 28 -2.715 -17.230 2.090 217 HB2 GLU 28 HB2 GLU 28 -2.941 -15.191 4.279 218 HB3 GLU 28 HB1 GLU 28 -4.217 -16.337 3.881 219 HG2 GLU 28 HG2 GLU 28 -2.373 -18.114 4.264 220 HG3 GLU 28 HG1 GLU 28 -1.533 -16.812 5.099 221 H VAL 29 H VAL 29 -2.292 -13.749 1.943 222 HA VAL 29 HA VAL 29 -4.793 -13.089 0.836 223 HB VAL 29 HB VAL 29 -2.097 -11.739 0.507 224 HG11 VAL 29 HG11 VAL 29 -4.823 -10.707 -0.281 225 HG12 VAL 29 HG12 VAL 29 -3.530 -11.163 -1.390 226 HG13 VAL 29 HG13 VAL 29 -3.323 -9.781 -0.314 227 HG21 VAL 29 HG21 VAL 29 -3.021 -10.114 2.101 228 HG22 VAL 29 HG22 VAL 29 -2.967 -11.740 2.782 229 HG23 VAL 29 HG23 VAL 29 -4.496 -11.075 2.212 230 H VAL 30 H VAL 30 -1.701 -13.896 -0.711 231 HA VAL 30 HA VAL 30 -2.668 -13.747 -3.360 232 HB VAL 30 HB VAL 30 -0.347 -15.373 -2.283 233 HG11 VAL 30 HG11 VAL 30 0.501 -15.322 -4.587 234 HG12 VAL 30 HG12 VAL 30 -0.974 -14.507 -5.107 235 HG13 VAL 30 HG13 VAL 30 -1.050 -16.155 -4.485 236 HG21 VAL 30 HG21 VAL 30 1.038 -13.486 -3.029 237 HG22 VAL 30 HG22 VAL 30 -0.118 -12.998 -1.791 238 HG23 VAL 30 HG23 VAL 30 -0.420 -12.605 -3.483 239 H ALA 31 H ALA 31 -2.411 -16.406 -1.045 240 HA ALA 31 HA ALA 31 -3.277 -18.483 -2.732 241 HB1 ALA 31 HB1 ALA 31 -3.698 -19.731 -0.717 242 HB2 ALA 31 HB2 ALA 31 -3.724 -18.247 0.233 243 HB3 ALA 31 HB3 ALA 31 -2.221 -18.789 -0.505 244 H LYS 32 H LYS 32 -5.018 -16.295 -0.609 245 HA LYS 32 HA LYS 32 -7.610 -17.319 -0.942 246 HB2 LYS 32 HB2 LYS 32 -6.846 -15.730 0.805 247 HB3 LYS 32 HB1 LYS 32 -6.710 -14.488 -0.418 248 HG2 LYS 32 HG2 LYS 32 -9.129 -14.684 -0.835 249 HG3 LYS 32 HG1 LYS 32 -9.231 -15.842 0.494 250 HD2 LYS 32 HD2 LYS 32 -8.016 -13.134 0.883 251 HD3 LYS 32 HD1 LYS 32 -9.763 -13.357 0.964 252 HE2 LYS 32 HE2 LYS 32 -8.916 -13.464 3.206 253 HE3 LYS 32 HE1 LYS 32 -9.376 -15.097 2.740 254 HZ1 LYS 32 HZ1 LYS 32 -7.053 -15.628 2.387 255 HZ2 LYS 32 HZ2 LYS 32 -7.256 -15.001 3.936 256 HZ3 LYS 32 HZ3 LYS 32 -6.599 -14.031 2.726 257 H ARG 33 H ARG 33 -5.748 -14.880 -2.643 258 HA ARG 33 HA ARG 33 -7.786 -13.937 -4.338 259 HB2 ARG 33 HB2 ARG 33 -5.551 -12.852 -3.757 260 HB3 ARG 33 HB1 ARG 33 -4.836 -13.940 -4.942 261 HG2 ARG 33 HG2 ARG 33 -6.078 -12.942 -6.712 262 HG3 ARG 33 HG1 ARG 33 -7.030 -11.981 -5.578 263 HD2 ARG 33 HD2 ARG 33 -4.955 -10.839 -4.865 264 HD3 ARG 33 HD1 ARG 33 -4.064 -11.749 -6.085 265 HE ARG 33 HE ARG 33 -5.811 -10.617 -7.648 266 HH11 ARG 33 HH11 ARG 33 -4.251 -9.139 -4.864 267 HH12 ARG 33 HH12 ARG 33 -4.279 -7.544 -5.525 268 HH21 ARG 33 HH21 ARG 33 -5.867 -8.491 -8.518 269 HH22 ARG 33 HH22 ARG 33 -5.209 -7.174 -7.612 270 H GLN 34 H GLN 34 -5.554 -16.605 -4.533 271 HA GLN 34 HA GLN 34 -6.269 -17.155 -7.310 272 HB2 GLN 34 HB2 GLN 34 -4.193 -18.348 -5.483 273 HB3 GLN 34 HB1 GLN 34 -4.486 -18.897 -7.126 274 HG2 GLN 34 HG2 GLN 34 -3.773 -16.065 -6.448 275 HG3 GLN 34 HG1 GLN 34 -2.567 -17.286 -6.822 276 HE21 GLN 34 HE21 GLN 34 -5.084 -15.269 -8.053 277 HE22 GLN 34 HE22 GLN 34 -4.781 -15.552 -9.727 278 H GLY 35 H GLY 35 -7.267 -18.030 -4.226 279 HA2 GLY 35 HA2 GLY 35 -8.826 -19.555 -3.515 280 HA3 GLY 35 HA1 GLY 35 -9.112 -19.956 -5.202 281 H VAL 36 H VAL 36 -6.230 -20.236 -3.151 282 HA VAL 36 HA VAL 36 -6.273 -23.146 -3.600 283 HB VAL 36 HB VAL 36 -3.819 -23.145 -3.865 284 HG11 VAL 36 HG11 VAL 36 -3.706 -22.199 -6.123 285 HG12 VAL 36 HG12 VAL 36 -5.222 -21.343 -5.835 286 HG13 VAL 36 HG13 VAL 36 -5.198 -23.106 -5.866 287 HG21 VAL 36 HG21 VAL 36 -4.065 -20.136 -3.897 288 HG22 VAL 36 HG22 VAL 36 -2.596 -21.058 -4.226 289 HG23 VAL 36 HG23 VAL 36 -3.322 -21.098 -2.618 290 HA PRO 37 HA PRO 37 -5.585 -23.613 0.749 291 HB2 PRO 37 HB2 PRO 37 -3.628 -25.579 0.771 292 HB3 PRO 37 HB1 PRO 37 -5.359 -25.886 0.600 293 HG2 PRO 37 HG2 PRO 37 -3.247 -25.724 -1.507 294 HG3 PRO 37 HG1 PRO 37 -4.622 -26.835 -1.381 295 HD2 PRO 37 HD2 PRO 37 -4.659 -24.748 -3.056 296 HD3 PRO 37 HD1 PRO 37 -6.122 -25.265 -2.198 297 H ALA 38 H ALA 38 -4.621 -21.977 1.737 298 HA ALA 38 HA ALA 38 -2.123 -20.882 0.963 299 HB1 ALA 38 HB1 ALA 38 -2.420 -19.360 2.798 300 HB2 ALA 38 HB2 ALA 38 -3.688 -20.378 3.485 301 HB3 ALA 38 HB3 ALA 38 -3.946 -19.562 1.941 302 H ASP 39 H ASP 39 -3.088 -23.207 3.360 303 HA ASP 39 HA ASP 39 -0.757 -23.067 4.966 304 HB2 ASP 39 HB2 ASP 39 -2.870 -24.090 5.737 305 HB3 ASP 39 HB1 ASP 39 -2.650 -25.396 4.577 306 H GLN 40 H GLN 40 -1.535 -24.736 2.018 307 HA GLN 40 HA GLN 40 0.958 -26.264 2.109 308 HB2 GLN 40 HB2 GLN 40 -1.343 -26.323 0.155 309 HB3 GLN 40 HB1 GLN 40 0.088 -27.337 0.042 310 HG2 GLN 40 HG2 GLN 40 -0.474 -28.353 2.198 311 HG3 GLN 40 HG1 GLN 40 -1.922 -27.349 2.282 312 HE21 GLN 40 HE21 GLN 40 -0.376 -30.017 0.696 313 HE22 GLN 40 HE22 GLN 40 -1.791 -30.640 -0.070 314 H LEU 41 H LEU 41 0.319 -23.253 1.440 315 HA LEU 41 HA LEU 41 1.673 -23.095 -1.137 316 HB2 LEU 41 HB2 LEU 41 -0.423 -21.787 -0.606 317 HB3 LEU 41 HB1 LEU 41 0.538 -20.849 0.519 318 HG LEU 41 HG LEU 41 1.972 -20.123 -1.361 319 HD11 LEU 41 HD11 LEU 41 -0.072 -21.571 -3.033 320 HD12 LEU 41 HD12 LEU 41 1.622 -22.021 -2.833 321 HD13 LEU 41 HD13 LEU 41 1.203 -20.519 -3.645 322 HD21 LEU 41 HD21 LEU 41 0.069 -18.769 -0.596 323 HD22 LEU 41 HD22 LEU 41 -0.964 -19.595 -1.767 324 HD23 LEU 41 HD23 LEU 41 0.367 -18.584 -2.325 325 H ARG 42 H ARG 42 3.677 -22.112 -1.397 326 HA ARG 42 HA ARG 42 5.078 -21.348 1.087 327 HB2 ARG 42 HB2 ARG 42 5.703 -23.620 0.205 328 HB3 ARG 42 HB1 ARG 42 6.316 -22.816 -1.232 329 HG2 ARG 42 HG2 ARG 42 7.623 -21.425 0.654 330 HG3 ARG 42 HG1 ARG 42 7.451 -22.976 1.480 331 HD2 ARG 42 HD2 ARG 42 8.301 -24.003 -0.703 332 HD3 ARG 42 HD1 ARG 42 8.776 -22.360 -1.122 333 HE ARG 42 HE ARG 42 10.133 -22.410 0.978 334 HH11 ARG 42 HH11 ARG 42 9.276 -25.407 -0.630 335 HH12 ARG 42 HH12 ARG 42 10.689 -26.253 -0.108 336 HH21 ARG 42 HH21 ARG 42 12.016 -23.546 1.716 337 HH22 ARG 42 HH22 ARG 42 12.252 -25.188 1.214 338 H VAL 43 H VAL 43 6.655 -19.719 0.871 339 HA VAL 43 HA VAL 43 6.458 -18.224 -1.638 340 HB VAL 43 HB VAL 43 7.090 -16.200 -0.359 341 HG11 VAL 43 HG11 VAL 43 4.731 -16.689 -0.690 342 HG12 VAL 43 HG12 VAL 43 4.989 -15.926 0.877 343 HG13 VAL 43 HG13 VAL 43 4.710 -17.664 0.777 344 HG21 VAL 43 HG21 VAL 43 6.903 -17.996 2.065 345 HG22 VAL 43 HG22 VAL 43 7.102 -16.244 2.098 346 HG23 VAL 43 HG23 VAL 43 8.375 -17.264 1.429 347 H ILE 44 H ILE 44 8.256 -17.497 -2.681 348 HA ILE 44 HA ILE 44 10.874 -18.248 -1.572 349 HB ILE 44 HB ILE 44 9.921 -18.685 -4.416 350 HG12 ILE 44 HG12 ILE 44 9.249 -20.448 -2.820 351 HG13 ILE 44 HG11 ILE 44 10.401 -21.047 -4.007 352 HG21 ILE 44 HG21 ILE 44 12.192 -17.821 -4.445 353 HG22 ILE 44 HG22 ILE 44 12.175 -19.523 -4.903 354 HG23 ILE 44 HG23 ILE 44 12.695 -19.050 -3.286 355 HD11 ILE 44 HD11 ILE 44 10.921 -21.926 -1.824 356 HD12 ILE 44 HD12 ILE 44 10.995 -20.300 -1.149 357 HD13 ILE 44 HD13 ILE 44 12.197 -20.821 -2.331 358 H PHE 45 H PHE 45 12.084 -16.514 -1.388 359 HA PHE 45 HA PHE 45 12.025 -14.467 -3.475 360 HB2 PHE 45 HB2 PHE 45 10.608 -13.632 -1.644 361 HB3 PHE 45 HB1 PHE 45 11.909 -13.922 -0.497 362 HD1 PHE 45 HD1 PHE 45 11.018 -11.943 -3.508 363 HD2 PHE 45 HD2 PHE 45 13.485 -12.260 -0.055 364 HE1 PHE 45 HE1 PHE 45 11.848 -9.661 -3.895 365 HE2 PHE 45 HE2 PHE 45 14.319 -9.979 -0.437 366 HZ PHE 45 HZ PHE 45 13.502 -8.677 -2.359 367 H ALA 46 H ALA 46 14.015 -14.116 -4.184 368 HA ALA 46 HA ALA 46 16.274 -13.995 -4.342 369 HB1 ALA 46 HB1 ALA 46 17.603 -13.484 -2.355 370 HB2 ALA 46 HB2 ALA 46 16.233 -13.896 -1.324 371 HB3 ALA 46 HB3 ALA 46 16.135 -12.504 -2.402 372 H GLY 47 H GLY 47 14.777 -16.582 -3.898 373 HA2 GLY 47 HA2 GLY 47 15.565 -18.758 -4.283 374 HA3 GLY 47 HA1 GLY 47 17.163 -18.247 -3.766 375 H LYS 48 H LYS 48 14.796 -17.256 -1.583 376 HA LYS 48 HA LYS 48 14.898 -19.727 -0.047 377 HB2 LYS 48 HB2 LYS 48 15.578 -18.424 2.012 378 HB3 LYS 48 HB1 LYS 48 16.839 -18.658 0.814 379 HG2 LYS 48 HG2 LYS 48 17.137 -16.449 1.418 380 HG3 LYS 48 HG1 LYS 48 16.133 -16.296 -0.021 381 HD2 LYS 48 HD2 LYS 48 14.145 -16.102 1.442 382 HD3 LYS 48 HD1 LYS 48 15.208 -16.160 2.849 383 HE2 LYS 48 HE2 LYS 48 15.247 -14.070 0.670 384 HE3 LYS 48 HE1 LYS 48 14.607 -13.856 2.296 385 HZ1 LYS 48 HZ1 LYS 48 16.815 -12.925 2.093 386 HZ2 LYS 48 HZ2 LYS 48 17.447 -14.412 1.611 387 HZ3 LYS 48 HZ3 LYS 48 16.828 -14.222 3.173 388 H GLU 49 H GLU 49 13.477 -19.610 1.889 389 HA GLU 49 HA GLU 49 11.071 -18.148 1.170 390 HB2 GLU 49 HB2 GLU 49 9.958 -19.499 2.924 391 HB3 GLU 49 HB1 GLU 49 10.744 -20.494 1.711 392 HG2 GLU 49 HG2 GLU 49 11.971 -19.852 4.379 393 HG3 GLU 49 HG1 GLU 49 10.968 -21.269 4.082 394 H LEU 50 H LEU 50 9.926 -16.912 2.766 395 HA LEU 50 HA LEU 50 11.811 -15.252 4.199 396 HB2 LEU 50 HB2 LEU 50 8.868 -14.930 3.704 397 HB3 LEU 50 HB1 LEU 50 9.892 -13.725 4.460 398 HG LEU 50 HG LEU 50 10.044 -14.696 1.604 399 HD11 LEU 50 HD11 LEU 50 9.347 -12.014 2.768 400 HD12 LEU 50 HD12 LEU 50 8.233 -13.150 2.005 401 HD13 LEU 50 HD13 LEU 50 9.504 -12.385 1.051 402 HD21 LEU 50 HD21 LEU 50 11.838 -12.765 3.074 403 HD22 LEU 50 HD22 LEU 50 11.820 -12.992 1.329 404 HD23 LEU 50 HD23 LEU 50 12.300 -14.320 2.383 405 H ARG 51 H ARG 51 10.603 -14.211 6.262 406 HA ARG 51 HA ARG 51 10.666 -16.373 8.168 407 HB2 ARG 51 HB2 ARG 51 10.568 -14.562 9.861 408 HB3 ARG 51 HB1 ARG 51 11.886 -14.388 8.715 409 HG2 ARG 51 HG2 ARG 51 10.055 -12.891 7.481 410 HG3 ARG 51 HG1 ARG 51 9.497 -12.710 9.144 411 HD2 ARG 51 HD2 ARG 51 12.285 -12.157 8.137 412 HD3 ARG 51 HD1 ARG 51 11.072 -10.943 8.537 413 HE ARG 51 HE ARG 51 11.349 -12.428 10.821 414 HH11 ARG 51 HH11 ARG 51 13.537 -10.583 8.779 415 HH12 ARG 51 HH12 ARG 51 14.613 -10.188 10.071 416 HH21 ARG 51 HH21 ARG 51 12.781 -11.892 12.538 417 HH22 ARG 51 HH22 ARG 51 14.184 -10.933 12.214 418 H ASN 52 H ASN 52 8.230 -14.729 6.502 419 HA ASN 52 HA ASN 52 5.981 -14.979 6.433 420 HB2 ASN 52 HB2 ASN 52 6.650 -17.263 8.242 421 HB3 ASN 52 HB1 ASN 52 4.973 -16.855 7.898 422 HD21 ASN 52 HD21 ASN 52 6.582 -19.208 7.184 423 HD22 ASN 52 HD22 ASN 52 6.476 -19.341 5.461 424 H ASP 53 H ASP 53 6.858 -15.286 9.869 425 HA ASP 53 HA ASP 53 4.361 -14.294 10.796 426 HB2 ASP 53 HB2 ASP 53 5.636 -15.754 12.198 427 HB3 ASP 53 HB1 ASP 53 7.015 -14.663 12.177 428 H TRP 54 H TRP 54 7.398 -12.755 10.113 429 HA TRP 54 HA TRP 54 6.799 -10.390 11.589 430 HB2 TRP 54 HB2 TRP 54 9.050 -11.529 11.041 431 HB3 TRP 54 HB1 TRP 54 8.945 -10.640 9.533 432 HD1 TRP 54 HD1 TRP 54 8.429 -9.682 13.263 433 HE1 TRP 54 HE1 TRP 54 9.731 -7.516 13.708 434 HE3 TRP 54 HE3 TRP 54 10.375 -8.987 8.629 435 HZ2 TRP 54 HZ2 TRP 54 11.384 -5.747 12.274 436 HZ3 TRP 54 HZ3 TRP 54 11.825 -7.030 8.235 437 HH2 TRP 54 HH2 TRP 54 12.308 -5.448 10.027 438 H THR 55 H THR 55 6.945 -8.185 10.481 439 HA THR 55 HA THR 55 4.806 -8.060 8.586 440 HB THR 55 HB THR 55 4.920 -6.387 10.344 441 HG1 THR 55 HG1 THR 55 4.423 -4.672 9.059 442 HG21 THR 55 HG21 THR 55 7.349 -6.275 10.640 443 HG22 THR 55 HG22 THR 55 6.682 -4.665 10.367 444 HG23 THR 55 HG23 THR 55 7.518 -5.505 9.060 445 H VAL 56 H VAL 56 4.815 -7.057 6.553 446 HA VAL 56 HA VAL 56 7.246 -7.519 5.042 447 HB VAL 56 HB VAL 56 4.952 -8.242 4.231 448 HG11 VAL 56 HG11 VAL 56 4.618 -5.305 3.696 449 HG12 VAL 56 HG12 VAL 56 3.714 -6.259 4.871 450 HG13 VAL 56 HG13 VAL 56 3.544 -6.591 3.146 451 HG21 VAL 56 HG21 VAL 56 6.864 -8.124 2.711 452 HG22 VAL 56 HG22 VAL 56 6.532 -6.416 2.421 453 HG23 VAL 56 HG23 VAL 56 5.380 -7.640 1.888 454 H GLN 57 H GLN 57 5.673 -4.893 6.563 455 HA GLN 57 HA GLN 57 6.259 -2.839 4.723 456 HB2 GLN 57 HB2 GLN 57 4.675 -2.651 6.638 457 HB3 GLN 57 HB1 GLN 57 6.053 -2.558 7.721 458 HG2 GLN 57 HG2 GLN 57 5.142 -0.347 7.247 459 HG3 GLN 57 HG1 GLN 57 6.791 -0.504 6.647 460 HE21 GLN 57 HE21 GLN 57 3.450 -0.122 5.789 461 HE22 GLN 57 HE22 GLN 57 3.710 0.171 4.105 462 H ASN 58 H ASN 58 8.136 -4.259 7.326 463 HA ASN 58 HA ASN 58 10.332 -2.399 6.871 464 HB2 ASN 58 HB2 ASN 58 9.532 -3.411 9.177 465 HB3 ASN 58 HB1 ASN 58 10.521 -4.776 8.689 466 HD21 ASN 58 HD21 ASN 58 12.771 -4.515 8.511 467 HD22 ASN 58 HD22 ASN 58 13.595 -3.186 9.243 468 H CYS 59 H CYS 59 9.245 -4.800 5.159 469 HA CYS 59 HA CYS 59 11.872 -5.933 4.543 470 HB2 CYS 59 HB2 CYS 59 9.152 -7.214 4.174 471 HB3 CYS 59 HB1 CYS 59 10.690 -7.926 3.707 472 HG CYS 59 HG CYS 59 9.193 -7.833 6.692 473 H ASP 60 H ASP 60 12.411 -4.477 3.024 474 HA ASP 60 HA ASP 60 10.678 -3.435 1.077 475 HB2 ASP 60 HB2 ASP 60 12.710 -2.264 1.590 476 HB3 ASP 60 HB1 ASP 60 13.684 -3.641 1.081 477 H LEU 61 H LEU 61 9.545 -4.965 0.071 478 HA LEU 61 HA LEU 61 10.981 -6.742 -1.774 479 HB2 LEU 61 HB2 LEU 61 8.286 -6.862 -0.458 480 HB3 LEU 61 HB1 LEU 61 8.510 -7.662 -1.995 481 HG LEU 61 HG LEU 61 10.162 -9.154 -1.041 482 HD11 LEU 61 HD11 LEU 61 10.725 -9.126 1.332 483 HD12 LEU 61 HD12 LEU 61 9.788 -7.646 1.536 484 HD13 LEU 61 HD13 LEU 61 11.235 -7.641 0.529 485 HD21 LEU 61 HD21 LEU 61 7.740 -8.923 0.736 486 HD22 LEU 61 HD22 LEU 61 8.759 -10.351 0.559 487 HD23 LEU 61 HD23 LEU 61 7.815 -9.764 -0.810 488 H ASP 62 H ASP 62 9.713 -3.816 -1.606 489 HA ASP 62 HA ASP 62 8.228 -3.759 -4.090 490 HB2 ASP 62 HB2 ASP 62 7.275 -2.326 -2.527 491 HB3 ASP 62 HB1 ASP 62 8.834 -1.793 -1.916 492 H GLN 63 H GLN 63 11.307 -2.587 -2.805 493 HA GLN 63 HA GLN 63 12.026 -1.749 -5.543 494 HB2 GLN 63 HB2 GLN 63 13.175 -0.961 -2.874 495 HB3 GLN 63 HB1 GLN 63 13.949 -0.569 -4.401 496 HG2 GLN 63 HG2 GLN 63 11.888 0.636 -5.071 497 HG3 GLN 63 HG1 GLN 63 11.239 0.336 -3.460 498 HE21 GLN 63 HE21 GLN 63 14.610 1.013 -4.089 499 HE22 GLN 63 HE22 GLN 63 14.632 2.571 -3.343 500 H GLN 64 H GLN 64 12.032 -4.493 -4.542 501 HA GLN 64 HA GLN 64 14.857 -5.093 -5.080 502 HB2 GLN 64 HB2 GLN 64 13.028 -6.393 -3.065 503 HB3 GLN 64 HB1 GLN 64 14.522 -7.139 -3.615 504 HG2 GLN 64 HG2 GLN 64 14.346 -4.442 -2.300 505 HG3 GLN 64 HG1 GLN 64 14.734 -5.947 -1.468 506 HE21 GLN 64 HE21 GLN 64 15.838 -3.561 -3.740 507 HE22 GLN 64 HE22 GLN 64 17.502 -4.042 -3.726 508 H SEP 65 H SEP 65 14.479 -7.904 -5.118 509 HA SEP 65 HA SEP 65 13.590 -8.281 -7.758 510 HB2 SEP 65 HB1 SEP 65 14.045 -10.379 -5.619 511 HB3 SEP 65 HB2 SEP 65 15.315 -9.683 -6.622 512 H ILE 66 H ILE 66 11.958 -10.155 -8.197 513 HA ILE 66 HA ILE 66 9.480 -9.295 -6.929 514 HB ILE 66 HB ILE 66 9.658 -9.338 -9.425 515 HG12 ILE 66 HG12 ILE 66 7.590 -11.300 -8.450 516 HG13 ILE 66 HG11 ILE 66 7.479 -9.564 -8.174 517 HG21 ILE 66 HG21 ILE 66 9.704 -12.318 -9.074 518 HG22 ILE 66 HG22 ILE 66 11.040 -11.320 -9.660 519 HG23 ILE 66 HG23 ILE 66 9.551 -11.455 -10.604 520 HD11 ILE 66 HD11 ILE 66 7.432 -9.175 -10.575 521 HD12 ILE 66 HD12 ILE 66 6.138 -10.269 -10.083 522 HD13 ILE 66 HD13 ILE 66 7.584 -10.906 -10.867 523 H VAL 67 H VAL 67 8.053 -10.698 -5.914 524 HA VAL 67 HA VAL 67 9.340 -12.919 -4.593 525 HB VAL 67 HB VAL 67 6.475 -12.002 -4.318 526 HG11 VAL 67 HG11 VAL 67 6.909 -14.205 -3.383 527 HG12 VAL 67 HG12 VAL 67 6.616 -13.032 -2.098 528 HG13 VAL 67 HG13 VAL 67 8.261 -13.561 -2.452 529 HG21 VAL 67 HG21 VAL 67 8.009 -10.131 -3.925 530 HG22 VAL 67 HG22 VAL 67 8.874 -11.096 -2.727 531 HG23 VAL 67 HG23 VAL 67 7.193 -10.637 -2.448 532 H HIS 68 H HIS 68 9.092 -15.023 -5.054 533 HA HIS 68 HA HIS 68 7.096 -15.764 -7.082 534 HB2 HIS 68 HB2 HIS 68 9.678 -17.091 -6.225 535 HB3 HIS 68 HB1 HIS 68 8.493 -17.889 -7.246 536 HD2 HIS 68 HD2 HIS 68 8.954 -14.206 -8.183 537 HE1 HIS 68 HE1 HIS 68 11.360 -16.504 -10.792 538 HE2 HIS 68 HE2 HIS 68 10.681 -14.173 -10.122 539 H ILE 69 H ILE 69 5.517 -17.217 -6.579 540 HA ILE 69 HA ILE 69 5.677 -18.459 -3.923 541 HB ILE 69 HB ILE 69 3.237 -17.120 -5.110 542 HG12 ILE 69 HG12 ILE 69 4.951 -16.504 -2.695 543 HG13 ILE 69 HG11 ILE 69 4.759 -15.517 -4.136 544 HG21 ILE 69 HG21 ILE 69 2.095 -17.776 -3.049 545 HG22 ILE 69 HG22 ILE 69 3.522 -18.687 -2.554 546 HG23 ILE 69 HG23 ILE 69 2.615 -19.176 -3.987 547 HD11 ILE 69 HD11 ILE 69 2.421 -15.123 -3.553 548 HD12 ILE 69 HD12 ILE 69 3.512 -14.598 -2.271 549 HD13 ILE 69 HD13 ILE 69 2.618 -16.110 -2.105 550 H VAL 70 H VAL 70 5.470 -20.563 -3.961 551 HA VAL 70 HA VAL 70 4.148 -21.815 -6.270 552 HB VAL 70 HB VAL 70 5.684 -23.753 -5.967 553 HG11 VAL 70 HG11 VAL 70 7.662 -22.685 -6.962 554 HG12 VAL 70 HG12 VAL 70 7.031 -21.106 -6.496 555 HG13 VAL 70 HG13 VAL 70 6.160 -22.090 -7.672 556 HG21 VAL 70 HG21 VAL 70 6.283 -23.400 -3.625 557 HG22 VAL 70 HG22 VAL 70 7.129 -21.915 -4.053 558 HG23 VAL 70 HG23 VAL 70 7.728 -23.467 -4.635 559 H GLN 71 H GLN 71 2.837 -23.565 -5.911 560 HA GLN 71 HA GLN 71 1.952 -23.961 -3.147 561 HB2 GLN 71 HB2 GLN 71 0.328 -23.260 -4.910 562 HB3 GLN 71 HB1 GLN 71 0.657 -24.765 -5.749 563 HG2 GLN 71 HG2 GLN 71 -0.172 -25.985 -3.746 564 HG3 GLN 71 HG1 GLN 71 -0.644 -24.429 -3.061 565 HE21 GLN 71 HE21 GLN 71 -2.318 -26.684 -3.777 566 HE22 GLN 71 HE22 GLN 71 -3.450 -26.098 -4.942 567 H ARG 72 H ARG 72 2.068 -25.955 -2.166 568 HA ARG 72 HA ARG 72 3.136 -28.147 -3.813 569 HB2 ARG 72 HB2 ARG 72 4.813 -27.410 -2.213 570 HB3 ARG 72 HB1 ARG 72 3.667 -27.586 -0.891 571 HG2 ARG 72 HG2 ARG 72 3.619 -29.972 -1.174 572 HG3 ARG 72 HG1 ARG 72 4.614 -29.859 -2.625 573 HD2 ARG 72 HD2 ARG 72 5.491 -28.994 0.125 574 HD3 ARG 72 HD1 ARG 72 5.868 -30.555 -0.601 575 HE ARG 72 HE ARG 72 6.655 -28.470 -2.331 576 HH11 ARG 72 HH11 ARG 72 7.590 -29.982 0.696 577 HH12 ARG 72 HH12 ARG 72 9.273 -29.622 0.505 578 HH21 ARG 72 HH21 ARG 72 8.893 -27.990 -2.585 579 HH22 ARG 72 HH22 ARG 72 10.008 -28.489 -1.361 580 HA PRO 73 HA PRO 73 -0.773 -29.843 -2.304 581 HB2 PRO 73 HB2 PRO 73 -1.536 -30.955 -4.620 582 HB3 PRO 73 HB1 PRO 73 -1.680 -29.215 -4.343 583 HG2 PRO 73 HG2 PRO 73 0.272 -30.714 -6.001 584 HG3 PRO 73 HG1 PRO 73 -0.365 -29.078 -6.216 585 HD2 PRO 73 HD2 PRO 73 2.130 -29.814 -5.076 586 HD3 PRO 73 HD1 PRO 73 1.409 -28.193 -5.124 587 H TRP 74 H TRP 74 -1.642 -32.149 -2.468 588 HA TRP 74 HA TRP 74 0.517 -33.974 -1.922 589 HB2 TRP 74 HB2 TRP 74 -2.480 -34.331 -1.825 590 HB3 TRP 74 HB1 TRP 74 -1.340 -35.618 -1.450 591 HD1 TRP 74 HD1 TRP 74 -2.701 -32.338 -0.081 592 HE1 TRP 74 HE1 TRP 74 -2.077 -32.143 2.408 593 HE3 TRP 74 HE3 TRP 74 0.389 -36.380 0.278 594 HZ2 TRP 74 HZ2 TRP 74 -0.478 -33.527 4.277 595 HZ3 TRP 74 HZ3 TRP 74 1.429 -36.879 2.452 596 HH2 TRP 74 HH2 TRP 74 1.004 -35.481 4.408 597 H ARG 75 H ARG 75 1.415 -33.917 -4.070 598 HA ARG 75 HA ARG 75 1.840 -34.746 -6.128 599 HB2 ARG 75 HB2 ARG 75 0.243 -37.038 -5.008 600 HB3 ARG 75 HB1 ARG 75 1.072 -37.108 -6.555 601 HG2 ARG 75 HG2 ARG 75 3.201 -36.712 -5.437 602 HG3 ARG 75 HG1 ARG 75 2.368 -36.633 -3.884 603 HD2 ARG 75 HD2 ARG 75 1.647 -38.925 -4.117 604 HD3 ARG 75 HD1 ARG 75 2.346 -39.010 -5.732 605 HE ARG 75 HE ARG 75 4.503 -38.972 -4.779 606 HH11 ARG 75 HH11 ARG 75 1.949 -39.128 -2.371 607 HH12 ARG 75 HH12 ARG 75 2.984 -39.751 -1.135 608 HH21 ARG 75 HH21 ARG 75 5.868 -39.797 -3.135 609 HH22 ARG 75 HH22 ARG 75 5.214 -40.141 -1.567 610 H LYS 76 H LYS 76 0.670 -33.111 -7.222 611 HA LYS 76 HA LYS 76 -1.863 -34.063 -8.348 612 HB2 LYS 76 HB2 LYS 76 -0.873 -31.254 -7.899 613 HB3 LYS 76 HB1 LYS 76 -2.253 -31.622 -8.923 614 HG2 LYS 76 HG2 LYS 76 -2.034 -32.333 -6.006 615 HG3 LYS 76 HG1 LYS 76 -2.895 -30.931 -6.647 616 HD2 LYS 76 HD2 LYS 76 -4.359 -32.428 -7.919 617 HD3 LYS 76 HD1 LYS 76 -3.502 -33.825 -7.263 618 HE2 LYS 76 HE2 LYS 76 -4.178 -33.165 -5.002 619 HE3 LYS 76 HE1 LYS 76 -5.047 -31.785 -5.668 620 HZ1 LYS 76 HZ1 LYS 76 -6.547 -33.608 -5.236 621 HZ2 LYS 76 HZ2 LYS 76 -5.631 -34.640 -6.212 622 HZ3 LYS 76 HZ3 LYS 76 -6.445 -33.331 -6.904
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