NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
639378 | 6qjb | 34354 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 PHE 17 HT1 PHE 17 35.956 13.556 -6.336 2 H2 PHE 17 HT2 PHE 17 35.533 12.774 -7.777 3 H3 PHE 17 HT3 PHE 17 36.938 12.304 -6.924 4 HA PHE 17 HA PHE 17 35.137 10.742 -6.595 5 HB2 PHE 17 HB2 PHE 17 36.956 11.051 -4.945 6 HB3 PHE 17 HB3 PHE 17 36.044 12.405 -4.182 7 HD1 PHE 17 HD1 PHE 17 36.198 11.456 -2.041 8 HD2 PHE 17 HD2 PHE 17 34.304 9.183 -5.162 9 HE1 PHE 17 HE1 PHE 17 35.142 9.985 -0.343 10 HE2 PHE 17 HE2 PHE 17 33.189 7.801 -3.490 11 HZ PHE 17 HZ PHE 17 33.623 8.157 -1.064 12 H ASP 18 H ASP 18 33.006 10.498 -6.910 13 HA ASP 18 HA ASP 18 31.215 11.914 -5.076 14 HB2 ASP 18 HB2 ASP 18 30.602 10.985 -7.962 15 HB3 ASP 18 HB3 ASP 18 29.348 11.549 -6.782 16 H VAL 19 H VAL 19 29.544 10.482 -4.148 17 HA VAL 19 HA VAL 19 30.056 7.627 -4.632 18 HB VAL 19 HB VAL 19 31.098 8.265 -2.505 19 HG11 VAL 19 HG11 VAL 19 28.267 9.119 -1.608 20 HG12 VAL 19 HG12 VAL 19 29.674 10.220 -1.878 21 HG13 VAL 19 HG13 VAL 19 29.727 8.988 -0.568 22 HG21 VAL 19 HG21 VAL 19 28.559 6.539 -2.159 23 HG22 VAL 19 HG22 VAL 19 30.041 6.496 -1.142 24 HG23 VAL 19 HG23 VAL 19 30.123 5.982 -2.869 25 H VAL 20 H VAL 20 28.242 6.421 -4.987 26 HA VAL 20 HA VAL 20 25.639 7.674 -4.485 27 HB VAL 20 HB VAL 20 24.711 6.692 -6.562 28 HG11 VAL 20 HG11 VAL 20 27.080 8.629 -7.033 29 HG12 VAL 20 HG12 VAL 20 25.420 9.096 -6.517 30 HG13 VAL 20 HG13 VAL 20 25.685 8.363 -8.145 31 HG21 VAL 20 HG21 VAL 20 27.665 6.060 -7.231 32 HG22 VAL 20 HG22 VAL 20 26.264 5.894 -8.354 33 HG23 VAL 20 HG23 VAL 20 26.378 4.852 -6.890 34 H SER 21 H SER 21 23.890 6.034 -4.219 35 HA SER 21 HA SER 21 24.902 3.659 -2.947 36 HB2 SER 21 HB2 SER 21 22.546 3.259 -2.324 37 HB3 SER 21 HB3 SER 21 23.110 4.907 -1.872 38 HG SER 21 HG SER 21 21.183 5.208 -2.837 39 H CYS 22 H CYS 22 24.324 1.500 -3.503 40 HA CYS 22 HA CYS 22 23.968 1.115 -6.401 41 HB2 CYS 22 HB2 CYS 22 26.127 0.519 -5.215 42 HB3 CYS 22 HB3 CYS 22 25.230 -0.725 -4.299 43 H ASN 23 H ASN 23 21.984 1.233 -3.945 44 HA ASN 23 HA ASN 23 20.043 0.390 -3.323 45 HB2 ASN 23 HB2 ASN 23 19.727 1.099 -5.778 46 HB3 ASN 23 HB3 ASN 23 19.865 -0.632 -6.222 47 HD21 ASN 23 HD21 ASN 23 18.031 1.187 -3.608 48 HD22 ASN 23 HD22 ASN 23 16.492 0.484 -4.047 49 H LYS 24 H LYS 24 22.006 -1.380 -2.405 50 HA LYS 24 HA LYS 24 20.407 -3.823 -2.321 51 HB2 LYS 24 HB2 LYS 24 22.232 -4.191 -4.039 52 HB3 LYS 24 HB3 LYS 24 23.443 -3.770 -2.796 53 HG2 LYS 24 HG2 LYS 24 23.377 -6.181 -3.026 54 HG3 LYS 24 HG3 LYS 24 22.683 -5.805 -1.429 55 HD2 LYS 24 HD2 LYS 24 20.393 -6.203 -2.306 56 HD3 LYS 24 HD3 LYS 24 21.024 -6.265 -3.987 57 HE2 LYS 24 HE2 LYS 24 22.315 -8.348 -3.451 58 HE3 LYS 24 HE3 LYS 24 21.657 -8.318 -1.760 59 HZ1 LYS 24 HZ1 LYS 24 20.024 -8.422 -4.245 60 HZ2 LYS 24 HZ2 LYS 24 19.462 -8.509 -2.642 61 HZ3 LYS 24 HZ3 LYS 24 20.436 -9.750 -3.270 62 H ASN 25 H ASN 25 20.363 -4.726 -0.279 63 HA ASN 25 HA ASN 25 21.454 -3.103 1.872 64 HB2 ASN 25 HB2 ASN 25 19.004 -3.668 1.755 65 HB3 ASN 25 HB3 ASN 25 19.403 -5.418 1.809 66 HD21 ASN 25 HD21 ASN 25 20.532 -6.184 3.865 67 HD22 ASN 25 HD22 ASN 25 20.094 -5.390 5.358 68 H CYS 26 H CYS 26 23.149 -3.807 3.253 69 HA CYS 26 HA CYS 26 24.126 -6.545 2.678 70 HB2 CYS 26 HB2 CYS 26 26.340 -5.902 2.994 71 HB3 CYS 26 HB3 CYS 26 25.648 -4.592 2.019 72 H THR 27 H THR 27 24.995 -7.769 4.558 73 HA THR 27 HA THR 27 24.144 -6.745 7.166 74 HB THR 27 HB THR 27 23.692 -9.147 7.840 75 HG1 THR 27 HG1 THR 27 23.035 -10.472 6.169 76 HG21 THR 27 HG21 THR 27 22.049 -7.419 7.595 77 HG22 THR 27 HG22 THR 27 21.354 -9.003 7.051 78 HG23 THR 27 HG23 THR 27 21.832 -7.755 5.822 79 H SER 28 H SER 28 25.241 -7.407 8.997 80 HA SER 28 HA SER 28 28.009 -7.612 8.687 81 HB2 SER 28 HB2 SER 28 26.980 -6.644 10.717 82 HB3 SER 28 HB3 SER 28 26.305 -8.255 11.153 83 HG SER 28 HG SER 28 28.500 -7.424 12.010 84 H GLY 29 H GLY 29 29.265 -9.225 8.311 85 HA2 GLY 29 HA2 GLY 29 30.183 -11.348 8.535 86 HA3 GLY 29 HA3 GLY 29 28.586 -11.982 9.067 87 H GLN 30 H GLN 30 27.678 -10.273 6.491 88 HA GLN 30 HA GLN 30 28.334 -12.438 4.555 89 HB2 GLN 30 HB2 GLN 30 25.747 -10.829 4.896 90 HB3 GLN 30 HB3 GLN 30 26.056 -11.979 3.555 91 HG2 GLN 30 HG2 GLN 30 25.940 -12.775 6.545 92 HG3 GLN 30 HG3 GLN 30 24.580 -12.883 5.383 93 HE21 GLN 30 HE21 GLN 30 27.942 -14.161 6.002 94 HE22 GLN 30 HE22 GLN 30 27.628 -15.680 5.204 95 H ASN 31 H ASN 31 27.514 -8.922 4.843 96 HA ASN 31 HA ASN 31 27.723 -7.263 3.433 97 HB2 ASN 31 HB2 ASN 31 30.449 -8.585 3.022 98 HB3 ASN 31 HB3 ASN 31 30.039 -6.957 2.360 99 HD21 ASN 31 HD21 ASN 31 30.977 -8.645 5.293 100 HD22 ASN 31 HD22 ASN 31 31.042 -7.192 6.256 101 H GLU 32 H GLU 32 25.976 -8.916 2.145 102 HA GLU 32 HA GLU 32 26.747 -9.509 -0.500 103 HB2 GLU 32 HB2 GLU 32 24.002 -8.985 0.741 104 HB3 GLU 32 HB3 GLU 32 24.221 -9.542 -0.936 105 HG2 GLU 32 HG2 GLU 32 25.364 -11.650 -0.108 106 HG3 GLU 32 HG3 GLU 32 25.134 -11.101 1.595 107 H CYS 33 H CYS 33 27.281 -8.142 -2.126 108 HA CYS 33 HA CYS 33 25.486 -5.953 -2.711 109 HB2 CYS 33 HB2 CYS 33 28.556 -5.743 -2.895 110 HB3 CYS 33 HB3 CYS 33 27.406 -4.543 -3.556 111 HA PRO 34 HA PRO 34 26.363 -8.051 -6.675 112 HB2 PRO 34 HB2 PRO 34 25.822 -6.074 -8.569 113 HB3 PRO 34 HB3 PRO 34 24.505 -6.864 -7.612 114 HG2 PRO 34 HG2 PRO 34 25.942 -4.234 -6.959 115 HG3 PRO 34 HG3 PRO 34 24.154 -4.495 -7.113 116 HD2 PRO 34 HD2 PRO 34 25.401 -4.569 -4.663 117 HD3 PRO 34 HD3 PRO 34 24.100 -5.786 -5.065 118 H GLU 35 H GLU 35 28.063 -7.974 -8.437 119 HA GLU 35 HA GLU 35 30.471 -7.201 -7.289 120 HB2 GLU 35 HB2 GLU 35 29.856 -8.010 -10.193 121 HB3 GLU 35 HB3 GLU 35 31.493 -7.837 -9.502 122 HG2 GLU 35 HG2 GLU 35 31.165 -10.154 -9.431 123 HG3 GLU 35 HG3 GLU 35 30.851 -9.649 -7.735 124 H GLY 36 H GLY 36 31.859 -5.506 -7.503 125 HA2 GLY 36 HA2 GLY 36 32.742 -3.603 -8.484 126 HA3 GLY 36 HA3 GLY 36 31.220 -3.348 -9.403 127 H CYS 37 H CYS 37 29.873 -4.040 -6.613 128 HA CYS 37 HA CYS 37 30.172 -1.343 -5.465 129 HB2 CYS 37 HB2 CYS 37 27.795 -3.270 -5.398 130 HB3 CYS 37 HB3 CYS 37 27.889 -1.725 -4.477 131 H PHE 38 H PHE 38 29.959 -1.179 -3.097 132 HA PHE 38 HA PHE 38 30.730 -3.561 -1.607 133 HB2 PHE 38 HB2 PHE 38 32.720 -2.489 -0.595 134 HB3 PHE 38 HB3 PHE 38 32.928 -2.424 -2.383 135 HD1 PHE 38 HD1 PHE 38 32.347 -0.253 -3.601 136 HD2 PHE 38 HD2 PHE 38 32.540 -0.502 0.689 137 HE1 PHE 38 HE1 PHE 38 32.217 2.177 -3.464 138 HE2 PHE 38 HE2 PHE 38 32.495 1.973 0.832 139 HZ PHE 38 HZ PHE 38 32.299 3.325 -1.239 140 H CYS 39 H CYS 39 30.589 -2.952 0.877 141 HA CYS 39 HA CYS 39 28.413 -0.942 1.115 142 HB2 CYS 39 HB2 CYS 39 27.675 -3.312 1.336 143 HB3 CYS 39 HB3 CYS 39 28.821 -3.532 2.706 144 H GLY 40 H GLY 40 28.805 0.738 2.441 145 HA2 GLY 40 HA2 GLY 40 31.243 0.747 4.047 146 HA3 GLY 40 HA3 GLY 40 30.077 2.093 3.761 147 H LEU 41 H LEU 41 30.085 -1.172 5.173 148 HA LEU 41 HA LEU 41 27.944 -0.634 6.919 149 HB2 LEU 41 HB2 LEU 41 28.938 -2.888 5.864 150 HB3 LEU 41 HB3 LEU 41 29.866 -2.951 7.378 151 HG LEU 41 HG LEU 41 26.820 -2.930 6.977 152 HD11 LEU 41 HD11 LEU 41 27.889 -5.073 6.444 153 HD12 LEU 41 HD12 LEU 41 26.901 -5.191 7.950 154 HD13 LEU 41 HD13 LEU 41 28.711 -5.123 8.041 155 HD21 LEU 41 HD21 LEU 41 26.687 -3.538 9.490 156 HD22 LEU 41 HD22 LEU 41 26.863 -1.815 9.038 157 HD23 LEU 41 HD23 LEU 41 28.299 -2.735 9.645 158 H LEU 42 H LEU 42 27.884 -0.203 9.156 159 HA LEU 42 HA LEU 42 29.942 1.539 9.944 160 HB2 LEU 42 HB2 LEU 42 27.470 0.574 11.543 161 HB3 LEU 42 HB3 LEU 42 28.439 2.047 11.832 162 HG LEU 42 HG LEU 42 26.491 2.827 10.901 163 HD11 LEU 42 HD11 LEU 42 28.309 3.926 9.676 164 HD12 LEU 42 HD12 LEU 42 26.913 3.622 8.555 165 HD13 LEU 42 HD13 LEU 42 28.364 2.589 8.460 166 HD21 LEU 42 HD21 LEU 42 25.672 0.496 10.226 167 HD22 LEU 42 HD22 LEU 42 26.411 0.801 8.604 168 HD23 LEU 42 HD23 LEU 42 25.119 1.885 9.211 169 H GLY 43 H GLY 43 31.631 -0.297 10.103 170 HA2 GLY 43 HA2 GLY 43 33.111 -1.318 11.511 171 HA3 GLY 43 HA3 GLY 43 32.046 -0.900 12.899 172 H GLN 44 H GLN 44 30.597 -2.543 10.318 173 HA GLN 44 HA GLN 44 29.398 -4.403 10.184 174 HB2 GLN 44 HB2 GLN 44 31.798 -5.712 11.521 175 HB3 GLN 44 HB3 GLN 44 30.446 -6.592 10.734 176 HG2 GLN 44 HG2 GLN 44 30.933 -5.396 8.548 177 HG3 GLN 44 HG3 GLN 44 32.389 -4.654 9.305 178 HE21 GLN 44 HE21 GLN 44 33.860 -6.448 10.471 179 HE22 GLN 44 HE22 GLN 44 34.131 -7.878 9.501 180 H ASN 45 H ASN 45 28.567 -2.799 12.356 181 HA ASN 45 HA ASN 45 28.068 -4.468 14.626 182 HB2 ASN 45 HB2 ASN 45 26.952 -1.771 13.706 183 HB3 ASN 45 HB3 ASN 45 26.231 -2.630 15.113 184 HD21 ASN 45 HD21 ASN 45 29.174 -0.891 14.003 185 HD22 ASN 45 HD22 ASN 45 29.864 -0.817 15.601 186 H LYS 46 H LYS 46 26.007 -3.707 11.772 187 HA LYS 46 HA LYS 46 24.505 -6.108 12.354 188 HB2 LYS 46 HB2 LYS 46 22.291 -4.930 12.574 189 HB3 LYS 46 HB3 LYS 46 23.407 -4.706 13.948 190 HG2 LYS 46 HG2 LYS 46 23.993 -2.446 13.211 191 HG3 LYS 46 HG3 LYS 46 22.929 -2.554 11.765 192 HD2 LYS 46 HD2 LYS 46 20.949 -2.529 13.053 193 HD3 LYS 46 HD3 LYS 46 21.794 -3.023 14.558 194 HE2 LYS 46 HE2 LYS 46 21.092 -0.616 14.626 195 HE3 LYS 46 HE3 LYS 46 22.888 -0.819 14.767 196 HZ1 LYS 46 HZ1 LYS 46 23.115 -0.296 12.486 197 HZ2 LYS 46 HZ2 LYS 46 22.228 0.936 13.253 198 HZ3 LYS 46 HZ3 LYS 46 21.431 -0.188 12.256 199 H LYS 47 H LYS 47 23.998 -3.074 10.369 200 HA LYS 47 HA LYS 47 24.039 -4.657 7.983 201 HB2 LYS 47 HB2 LYS 47 21.715 -4.158 7.331 202 HB3 LYS 47 HB3 LYS 47 21.730 -5.109 8.845 203 HG2 LYS 47 HG2 LYS 47 21.397 -2.980 10.171 204 HG3 LYS 47 HG3 LYS 47 21.279 -2.062 8.632 205 HD2 LYS 47 HD2 LYS 47 19.401 -4.336 9.530 206 HD3 LYS 47 HD3 LYS 47 19.065 -2.575 9.642 207 HE2 LYS 47 HE2 LYS 47 19.200 -2.397 7.122 208 HE3 LYS 47 HE3 LYS 47 19.430 -4.194 7.032 209 HZ1 LYS 47 HZ1 LYS 47 17.328 -4.461 8.162 210 HZ2 LYS 47 HZ2 LYS 47 17.173 -3.561 6.726 211 HZ3 LYS 47 HZ3 LYS 47 17.113 -2.772 8.229 212 H GLY 48 H GLY 48 23.791 -3.290 6.090 213 HA2 GLY 48 HA2 GLY 48 23.694 -0.434 6.416 214 HA3 GLY 48 HA3 GLY 48 25.299 -1.097 5.892 215 H HIS 49 H HIS 49 24.644 0.408 3.919 216 HA HIS 49 HA HIS 49 23.019 -1.199 2.045 217 HB2 HIS 49 HB2 HIS 49 21.791 0.814 3.018 218 HB3 HIS 49 HB3 HIS 49 23.071 1.859 2.335 219 HD2 HIS 49 HD2 HIS 49 22.152 2.959 -0.017 220 HE1 HIS 49 HE1 HIS 49 19.422 -0.139 -0.987 221 HE2 HIS 49 HE2 HIS 49 20.278 2.186 -1.618 222 H CYS 50 H CYS 50 23.904 -1.367 -0.067 223 HA CYS 50 HA CYS 50 26.714 -0.969 -0.164 224 HB2 CYS 50 HB2 CYS 50 24.779 -1.906 -2.340 225 HB3 CYS 50 HB3 CYS 50 26.570 -1.986 -2.464 226 H TYR 51 H TYR 51 28.040 0.254 -1.595 227 HA TYR 51 HA TYR 51 26.702 2.556 -2.887 228 HB2 TYR 51 HB2 TYR 51 29.534 2.712 -1.690 229 HB3 TYR 51 HB3 TYR 51 28.488 4.042 -2.315 230 HD1 TYR 51 HD1 TYR 51 30.054 3.857 0.193 231 HD2 TYR 51 HD2 TYR 51 25.900 3.113 -0.600 232 HE1 TYR 51 HE1 TYR 51 29.543 4.146 2.605 233 HE2 TYR 51 HE2 TYR 51 25.402 3.340 1.798 234 HH TYR 51 HH TYR 51 27.935 3.992 4.221 235 H LYS 52 H LYS 52 27.994 3.543 -4.603 236 HA LYS 52 HA LYS 52 30.171 1.881 -5.695 237 HB2 LYS 52 HB2 LYS 52 28.124 1.792 -7.138 238 HB3 LYS 52 HB3 LYS 52 28.133 3.577 -7.244 239 HG2 LYS 52 HG2 LYS 52 30.418 3.460 -8.376 240 HG3 LYS 52 HG3 LYS 52 30.300 1.671 -8.322 241 HD2 LYS 52 HD2 LYS 52 28.432 3.602 -9.830 242 HD3 LYS 52 HD3 LYS 52 29.693 2.538 -10.537 243 HE2 LYS 52 HE2 LYS 52 28.370 0.511 -9.700 244 HE3 LYS 52 HE3 LYS 52 27.059 1.654 -9.175 245 HZ1 LYS 52 HZ1 LYS 52 26.921 2.438 -11.439 246 HZ2 LYS 52 HZ2 LYS 52 26.655 0.762 -11.341 247 HZ3 LYS 52 HZ3 LYS 52 28.137 1.352 -11.925 248 H ILE 53 H ILE 53 32.106 3.009 -6.052 249 HA ILE 53 HA ILE 53 32.148 5.898 -5.516 250 HB ILE 53 HB ILE 53 34.359 3.829 -5.515 251 HG12 ILE 53 HG12 ILE 53 33.487 5.731 -3.274 252 HG13 ILE 53 HG13 ILE 53 32.802 4.103 -3.464 253 HG21 ILE 53 HG21 ILE 53 35.331 5.820 -6.581 254 HG22 ILE 53 HG22 ILE 53 35.904 5.775 -4.889 255 HG23 ILE 53 HG23 ILE 53 34.580 6.907 -5.353 256 HD11 ILE 53 HD11 ILE 53 34.658 4.071 -1.802 257 HD12 ILE 53 HD12 ILE 53 35.799 4.786 -2.992 258 HD13 ILE 53 HD13 ILE 53 35.149 3.123 -3.253 259 H ILE 54 H ILE 54 32.363 7.285 -7.146 260 HA ILE 54 HA ILE 54 33.627 6.430 -9.618 261 HB ILE 54 HB ILE 54 32.031 7.802 -10.905 262 HG12 ILE 54 HG12 ILE 54 31.154 9.108 -8.857 263 HG13 ILE 54 HG13 ILE 54 30.005 8.636 -10.144 264 HG21 ILE 54 HG21 ILE 54 31.922 5.332 -10.897 265 HG22 ILE 54 HG22 ILE 54 30.274 6.055 -11.046 266 HG23 ILE 54 HG23 ILE 54 30.822 5.358 -9.475 267 HD11 ILE 54 HD11 ILE 54 29.032 8.370 -7.861 268 HD12 ILE 54 HD12 ILE 54 30.238 7.120 -7.427 269 HD13 ILE 54 HD13 ILE 54 29.077 6.819 -8.763 270 H GLY 55 H GLY 55 34.820 8.189 -10.718 271 HA2 GLY 55 HA2 GLY 55 34.864 10.782 -10.078 272 HA3 GLY 55 HA3 GLY 55 35.803 10.006 -8.740 273 H ASN 56 H ASN 56 37.680 11.111 -9.385 274 HA ASN 56 HA ASN 56 38.707 11.112 -11.971 275 HB2 ASN 56 HB2 ASN 56 40.149 11.392 -9.253 276 HB3 ASN 56 HB3 ASN 56 40.880 11.814 -10.849 277 HD21 ASN 56 HD21 ASN 56 39.370 13.240 -8.211 278 HD22 ASN 56 HD22 ASN 56 38.700 14.624 -9.034 Start of MODEL 2 1 H1 PHE 17 HT1 PHE 17 36.674 12.301 -6.792 2 H2 PHE 17 HT2 PHE 17 35.690 13.516 -6.136 3 H3 PHE 17 HT3 PHE 17 35.272 12.807 -7.616 4 HA PHE 17 HA PHE 17 34.885 10.720 -6.554 5 HB2 PHE 17 HB2 PHE 17 36.657 10.858 -4.918 6 HB3 PHE 17 HB3 PHE 17 35.846 12.233 -4.069 7 HD1 PHE 17 HD1 PHE 17 35.565 11.413 -1.929 8 HD2 PHE 17 HD2 PHE 17 34.304 8.917 -5.204 9 HE1 PHE 17 HE1 PHE 17 34.437 9.888 -0.343 10 HE2 PHE 17 HE2 PHE 17 33.134 7.451 -3.632 11 HZ PHE 17 HZ PHE 17 33.208 7.905 -1.190 12 H ASP 18 H ASP 18 32.787 10.319 -6.686 13 HA ASP 18 HA ASP 18 30.952 11.797 -4.948 14 HB2 ASP 18 HB2 ASP 18 30.380 10.803 -7.822 15 HB3 ASP 18 HB3 ASP 18 29.106 11.387 -6.673 16 H VAL 19 H VAL 19 29.207 10.386 -4.082 17 HA VAL 19 HA VAL 19 29.692 7.527 -4.509 18 HB VAL 19 HB VAL 19 30.695 8.101 -2.361 19 HG11 VAL 19 HG11 VAL 19 27.881 9.107 -1.544 20 HG12 VAL 19 HG12 VAL 19 29.342 10.140 -1.785 21 HG13 VAL 19 HG13 VAL 19 29.305 8.921 -0.463 22 HG21 VAL 19 HG21 VAL 19 29.609 5.875 -2.712 23 HG22 VAL 19 HG22 VAL 19 28.060 6.524 -2.046 24 HG23 VAL 19 HG23 VAL 19 29.516 6.421 -0.997 25 H VAL 20 H VAL 20 27.874 6.355 -4.899 26 HA VAL 20 HA VAL 20 25.271 7.572 -4.401 27 HB VAL 20 HB VAL 20 24.345 6.642 -6.512 28 HG11 VAL 20 HG11 VAL 20 26.620 8.709 -6.860 29 HG12 VAL 20 HG12 VAL 20 24.908 9.040 -6.405 30 HG13 VAL 20 HG13 VAL 20 25.295 8.394 -8.044 31 HG21 VAL 20 HG21 VAL 20 26.076 4.875 -6.942 32 HG22 VAL 20 HG22 VAL 20 27.317 6.152 -7.237 33 HG23 VAL 20 HG23 VAL 20 25.912 5.982 -8.349 34 H SER 21 H SER 21 23.517 5.862 -4.304 35 HA SER 21 HA SER 21 24.536 3.528 -2.982 36 HB2 SER 21 HB2 SER 21 22.156 2.999 -2.550 37 HB3 SER 21 HB3 SER 21 22.569 4.680 -2.062 38 HG SER 21 HG SER 21 20.597 4.511 -3.270 39 H CYS 22 H CYS 22 24.101 1.338 -3.567 40 HA CYS 22 HA CYS 22 24.014 0.935 -6.472 41 HB2 CYS 22 HB2 CYS 22 25.937 0.221 -4.888 42 HB3 CYS 22 HB3 CYS 22 24.812 -1.031 -4.277 43 H ASN 23 H ASN 23 21.816 1.089 -4.140 44 HA ASN 23 HA ASN 23 19.813 0.290 -3.625 45 HB2 ASN 23 HB2 ASN 23 19.828 -0.701 -6.539 46 HB3 ASN 23 HB3 ASN 23 18.359 -0.504 -5.507 47 HD21 ASN 23 HD21 ASN 23 20.319 1.076 -7.765 48 HD22 ASN 23 HD22 ASN 23 19.865 2.730 -7.409 49 H LYS 24 H LYS 24 21.777 -1.460 -2.635 50 HA LYS 24 HA LYS 24 20.304 -3.995 -2.717 51 HB2 LYS 24 HB2 LYS 24 22.253 -4.075 -4.361 52 HB3 LYS 24 HB3 LYS 24 23.351 -3.684 -3.012 53 HG2 LYS 24 HG2 LYS 24 23.508 -6.045 -3.400 54 HG3 LYS 24 HG3 LYS 24 22.606 -5.886 -1.868 55 HD2 LYS 24 HD2 LYS 24 20.467 -6.320 -3.043 56 HD3 LYS 24 HD3 LYS 24 21.283 -6.139 -4.633 57 HE2 LYS 24 HE2 LYS 24 22.619 -8.230 -4.194 58 HE3 LYS 24 HE3 LYS 24 21.810 -8.405 -2.579 59 HZ1 LYS 24 HZ1 LYS 24 19.708 -8.571 -3.701 60 HZ2 LYS 24 HZ2 LYS 24 20.789 -9.743 -4.284 61 HZ3 LYS 24 HZ3 LYS 24 20.443 -8.368 -5.220 62 H ASN 25 H ASN 25 20.137 -4.929 -0.678 63 HA ASN 25 HA ASN 25 21.135 -3.368 1.568 64 HB2 ASN 25 HB2 ASN 25 18.700 -4.017 1.449 65 HB3 ASN 25 HB3 ASN 25 19.166 -5.752 1.426 66 HD21 ASN 25 HD21 ASN 25 20.439 -6.461 3.436 67 HD22 ASN 25 HD22 ASN 25 19.872 -5.844 4.969 68 H CYS 26 H CYS 26 22.767 -4.096 2.998 69 HA CYS 26 HA CYS 26 23.613 -6.884 2.683 70 HB2 CYS 26 HB2 CYS 26 25.991 -6.211 2.717 71 HB3 CYS 26 HB3 CYS 26 25.136 -5.583 1.281 72 H THR 27 H THR 27 24.687 -7.790 4.567 73 HA THR 27 HA THR 27 23.807 -6.389 7.033 74 HB THR 27 HB THR 27 23.762 -9.411 6.673 75 HG1 THR 27 HG1 THR 27 22.155 -9.047 5.410 76 HG21 THR 27 HG21 THR 27 22.099 -9.230 8.547 77 HG22 THR 27 HG22 THR 27 22.243 -7.438 8.506 78 HG23 THR 27 HG23 THR 27 23.646 -8.462 9.039 79 H SER 28 H SER 28 25.267 -6.787 8.939 80 HA SER 28 HA SER 28 27.936 -7.418 8.306 81 HB2 SER 28 HB2 SER 28 27.365 -6.082 10.313 82 HB3 SER 28 HB3 SER 28 26.553 -7.511 11.039 83 HG SER 28 HG SER 28 28.858 -7.064 11.612 84 H GLY 29 H GLY 29 29.051 -9.351 8.344 85 HA2 GLY 29 HA2 GLY 29 29.398 -11.598 8.617 86 HA3 GLY 29 HA3 GLY 29 27.679 -11.831 9.082 87 H GLN 30 H GLN 30 27.125 -10.023 6.510 88 HA GLN 30 HA GLN 30 27.328 -12.312 4.626 89 HB2 GLN 30 HB2 GLN 30 25.323 -9.994 4.736 90 HB3 GLN 30 HB3 GLN 30 25.370 -11.267 3.470 91 HG2 GLN 30 HG2 GLN 30 24.874 -13.020 5.193 92 HG3 GLN 30 HG3 GLN 30 24.797 -11.746 6.466 93 HE21 GLN 30 HE21 GLN 30 22.550 -13.394 5.926 94 HE22 GLN 30 HE22 GLN 30 21.300 -12.403 5.212 95 H ASN 31 H ASN 31 27.341 -8.674 4.668 96 HA ASN 31 HA ASN 31 28.018 -7.206 3.131 97 HB2 ASN 31 HB2 ASN 31 30.454 -9.061 3.257 98 HB3 ASN 31 HB3 ASN 31 30.477 -7.498 2.360 99 HD21 ASN 31 HD21 ASN 31 30.223 -8.876 5.679 100 HD22 ASN 31 HD22 ASN 31 30.614 -7.322 6.424 101 H GLU 32 H GLU 32 26.189 -8.855 1.796 102 HA GLU 32 HA GLU 32 27.354 -9.578 -0.749 103 HB2 GLU 32 HB2 GLU 32 24.491 -9.531 0.316 104 HB3 GLU 32 HB3 GLU 32 24.877 -10.040 -1.342 105 HG2 GLU 32 HG2 GLU 32 26.029 -11.423 1.199 106 HG3 GLU 32 HG3 GLU 32 24.548 -11.965 0.316 107 H CYS 33 H CYS 33 27.884 -8.053 -2.236 108 HA CYS 33 HA CYS 33 25.805 -6.166 -2.987 109 HB2 CYS 33 HB2 CYS 33 28.812 -5.495 -2.839 110 HB3 CYS 33 HB3 CYS 33 27.556 -4.440 -3.553 111 HA PRO 34 HA PRO 34 27.352 -7.946 -6.888 112 HB2 PRO 34 HB2 PRO 34 26.582 -6.035 -8.774 113 HB3 PRO 34 HB3 PRO 34 25.376 -7.094 -7.942 114 HG2 PRO 34 HG2 PRO 34 26.238 -4.266 -7.128 115 HG3 PRO 34 HG3 PRO 34 24.547 -4.856 -7.413 116 HD2 PRO 34 HD2 PRO 34 25.638 -4.764 -4.886 117 HD3 PRO 34 HD3 PRO 34 24.602 -6.184 -5.382 118 H GLU 35 H GLU 35 29.112 -7.482 -8.537 119 HA GLU 35 HA GLU 35 31.234 -6.257 -7.201 120 HB2 GLU 35 HB2 GLU 35 32.603 -6.784 -9.163 121 HB3 GLU 35 HB3 GLU 35 31.545 -8.154 -8.721 122 HG2 GLU 35 HG2 GLU 35 29.945 -7.532 -10.608 123 HG3 GLU 35 HG3 GLU 35 31.027 -6.163 -11.051 124 H GLY 36 H GLY 36 32.461 -4.401 -7.506 125 HA2 GLY 36 HA2 GLY 36 32.944 -2.316 -8.375 126 HA3 GLY 36 HA3 GLY 36 31.375 -2.294 -9.250 127 H CYS 37 H CYS 37 30.293 -3.383 -6.469 128 HA CYS 37 HA CYS 37 30.081 -0.743 -5.184 129 HB2 CYS 37 HB2 CYS 37 28.068 -3.056 -5.271 130 HB3 CYS 37 HB3 CYS 37 27.868 -1.540 -4.320 131 H PHE 38 H PHE 38 29.915 -0.733 -2.831 132 HA PHE 38 HA PHE 38 31.045 -3.126 -1.537 133 HB2 PHE 38 HB2 PHE 38 32.574 -1.794 -0.167 134 HB3 PHE 38 HB3 PHE 38 32.916 -1.435 -1.895 135 HD1 PHE 38 HD1 PHE 38 31.990 -0.043 1.331 136 HD2 PHE 38 HD2 PHE 38 31.863 0.711 -2.898 137 HE1 PHE 38 HE1 PHE 38 31.615 2.362 1.772 138 HE2 PHE 38 HE2 PHE 38 31.370 3.089 -2.450 139 HZ PHE 38 HZ PHE 38 31.312 3.942 -0.147 140 H CYS 39 H CYS 39 30.625 -3.162 0.852 141 HA CYS 39 HA CYS 39 27.874 -2.337 1.251 142 HB2 CYS 39 HB2 CYS 39 28.586 -4.684 1.685 143 HB3 CYS 39 HB3 CYS 39 29.762 -4.098 2.895 144 H GLY 40 H GLY 40 27.250 -0.551 2.445 145 HA2 GLY 40 HA2 GLY 40 29.269 0.968 3.790 146 HA3 GLY 40 HA3 GLY 40 27.509 1.327 3.602 147 H LEU 41 H LEU 41 29.700 -0.909 5.284 148 HA LEU 41 HA LEU 41 28.129 -0.582 7.752 149 HB2 LEU 41 HB2 LEU 41 30.030 -2.791 6.858 150 HB3 LEU 41 HB3 LEU 41 29.538 -2.586 8.577 151 HG LEU 41 HG LEU 41 27.498 -2.946 6.320 152 HD11 LEU 41 HD11 LEU 41 28.611 -5.129 8.195 153 HD12 LEU 41 HD12 LEU 41 29.098 -4.932 6.459 154 HD13 LEU 41 HD13 LEU 41 27.393 -5.321 6.879 155 HD21 LEU 41 HD21 LEU 41 27.432 -3.203 9.405 156 HD22 LEU 41 HD22 LEU 41 26.102 -3.743 8.332 157 HD23 LEU 41 HD23 LEU 41 26.542 -1.996 8.393 158 H LEU 42 H LEU 42 28.972 0.353 9.480 159 HA LEU 42 HA LEU 42 31.008 2.162 9.049 160 HB2 LEU 42 HB2 LEU 42 29.686 1.263 11.702 161 HB3 LEU 42 HB3 LEU 42 30.536 2.802 11.394 162 HG LEU 42 HG LEU 42 28.343 3.420 11.359 163 HD11 LEU 42 HD11 LEU 42 29.563 4.080 9.132 164 HD12 LEU 42 HD12 LEU 42 27.759 4.234 9.180 165 HD13 LEU 42 HD13 LEU 42 28.520 2.833 8.355 166 HD21 LEU 42 HD21 LEU 42 27.306 1.215 9.509 167 HD22 LEU 42 HD22 LEU 42 26.420 2.252 10.667 168 HD23 LEU 42 HD23 LEU 42 27.486 0.926 11.279 169 H GLY 43 H GLY 43 30.862 -0.671 11.133 170 HA2 GLY 43 HA2 GLY 43 33.590 -1.398 10.577 171 HA3 GLY 43 HA3 GLY 43 33.239 -0.965 12.304 172 H GLN 44 H GLN 44 31.432 -2.562 9.720 173 HA GLN 44 HA GLN 44 30.035 -4.301 9.654 174 HB2 GLN 44 HB2 GLN 44 32.324 -5.673 11.143 175 HB3 GLN 44 HB3 GLN 44 30.956 -6.504 10.336 176 HG2 GLN 44 HG2 GLN 44 32.719 -6.681 8.794 177 HG3 GLN 44 HG3 GLN 44 31.634 -5.417 8.116 178 HE21 GLN 44 HE21 GLN 44 32.842 -3.751 7.218 179 HE22 GLN 44 HE22 GLN 44 34.384 -3.199 7.823 180 H ASN 45 H ASN 45 28.840 -2.735 11.470 181 HA ASN 45 HA ASN 45 28.739 -4.099 14.038 182 HB2 ASN 45 HB2 ASN 45 27.359 -1.508 13.056 183 HB3 ASN 45 HB3 ASN 45 27.420 -2.085 14.759 184 HD21 ASN 45 HD21 ASN 45 30.319 -2.914 14.669 185 HD22 ASN 45 HD22 ASN 45 31.142 -1.386 14.758 186 H LYS 46 H LYS 46 26.241 -3.036 11.619 187 HA LYS 46 HA LYS 46 24.439 -5.100 12.725 188 HB2 LYS 46 HB2 LYS 46 23.668 -2.189 12.022 189 HB3 LYS 46 HB3 LYS 46 22.527 -3.509 12.456 190 HG2 LYS 46 HG2 LYS 46 23.597 -3.687 14.711 191 HG3 LYS 46 HG3 LYS 46 24.712 -2.353 14.262 192 HD2 LYS 46 HD2 LYS 46 22.763 -0.813 13.944 193 HD3 LYS 46 HD3 LYS 46 21.635 -2.152 14.351 194 HE2 LYS 46 HE2 LYS 46 22.624 -2.299 16.656 195 HE3 LYS 46 HE3 LYS 46 23.742 -0.923 16.257 196 HZ1 LYS 46 HZ1 LYS 46 20.770 -0.855 16.225 197 HZ2 LYS 46 HZ2 LYS 46 21.802 0.435 15.826 198 HZ3 LYS 46 HZ3 LYS 46 21.789 -0.186 17.406 199 H LYS 47 H LYS 47 23.457 -2.757 10.311 200 HA LYS 47 HA LYS 47 23.882 -4.586 8.118 201 HB2 LYS 47 HB2 LYS 47 21.547 -4.383 7.372 202 HB3 LYS 47 HB3 LYS 47 21.579 -5.112 9.007 203 HG2 LYS 47 HG2 LYS 47 21.080 -2.815 9.997 204 HG3 LYS 47 HG3 LYS 47 20.905 -2.174 8.334 205 HD2 LYS 47 HD2 LYS 47 19.233 -4.345 9.705 206 HD3 LYS 47 HD3 LYS 47 18.702 -2.679 9.323 207 HE2 LYS 47 HE2 LYS 47 19.344 -4.865 7.220 208 HE3 LYS 47 HE3 LYS 47 17.700 -4.309 7.724 209 HZ1 LYS 47 HZ1 LYS 47 18.098 -2.200 6.828 210 HZ2 LYS 47 HZ2 LYS 47 18.671 -3.293 5.662 211 HZ3 LYS 47 HZ3 LYS 47 19.766 -2.485 6.649 212 H GLY 48 H GLY 48 23.696 -3.369 6.046 213 HA2 GLY 48 HA2 GLY 48 23.682 -0.475 6.282 214 HA3 GLY 48 HA3 GLY 48 25.196 -1.303 5.729 215 H HIS 49 H HIS 49 24.569 0.150 3.736 216 HA HIS 49 HA HIS 49 22.858 -1.519 2.004 217 HB2 HIS 49 HB2 HIS 49 21.677 0.608 2.988 218 HB3 HIS 49 HB3 HIS 49 22.839 1.558 2.015 219 HD2 HIS 49 HD2 HIS 49 21.593 2.174 -0.470 220 HE1 HIS 49 HE1 HIS 49 18.953 -1.158 -0.428 221 HE2 HIS 49 HE2 HIS 49 19.595 1.029 -1.636 222 H CYS 50 H CYS 50 23.672 -1.577 -0.191 223 HA CYS 50 HA CYS 50 26.499 -1.194 -0.218 224 HB2 CYS 50 HB2 CYS 50 24.590 -2.053 -2.435 225 HB3 CYS 50 HB3 CYS 50 26.383 -2.101 -2.568 226 H TYR 51 H TYR 51 27.786 0.231 -1.344 227 HA TYR 51 HA TYR 51 26.454 2.478 -2.740 228 HB2 TYR 51 HB2 TYR 51 29.002 2.628 -1.023 229 HB3 TYR 51 HB3 TYR 51 28.198 4.007 -1.866 230 HD1 TYR 51 HD1 TYR 51 25.239 3.230 -0.855 231 HD2 TYR 51 HD2 TYR 51 29.098 3.656 0.987 232 HE1 TYR 51 HE1 TYR 51 24.159 3.672 1.327 233 HE2 TYR 51 HE2 TYR 51 28.038 4.086 3.151 234 HH TYR 51 HH TYR 51 26.049 4.032 4.323 235 H LYS 52 H LYS 52 27.794 3.506 -4.391 236 HA LYS 52 HA LYS 52 29.925 1.751 -5.460 237 HB2 LYS 52 HB2 LYS 52 27.885 1.965 -6.889 238 HB3 LYS 52 HB3 LYS 52 28.099 3.741 -6.908 239 HG2 LYS 52 HG2 LYS 52 30.346 3.430 -8.056 240 HG3 LYS 52 HG3 LYS 52 30.061 1.660 -8.066 241 HD2 LYS 52 HD2 LYS 52 28.345 3.796 -9.482 242 HD3 LYS 52 HD3 LYS 52 29.560 2.718 -10.247 243 HE2 LYS 52 HE2 LYS 52 28.154 0.706 -9.585 244 HE3 LYS 52 HE3 LYS 52 26.894 1.848 -8.945 245 HZ1 LYS 52 HZ1 LYS 52 26.432 1.165 -11.175 246 HZ2 LYS 52 HZ2 LYS 52 27.930 1.746 -11.727 247 HZ3 LYS 52 HZ3 LYS 52 26.764 2.831 -11.130 248 H ILE 53 H ILE 53 31.990 2.638 -5.754 249 HA ILE 53 HA ILE 53 32.394 5.462 -5.052 250 HB ILE 53 HB ILE 53 34.407 3.245 -5.632 251 HG12 ILE 53 HG12 ILE 53 33.325 2.895 -3.443 252 HG13 ILE 53 HG13 ILE 53 35.054 3.317 -3.297 253 HG21 ILE 53 HG21 ILE 53 34.852 6.203 -4.844 254 HG22 ILE 53 HG22 ILE 53 35.398 5.387 -6.357 255 HG23 ILE 53 HG23 ILE 53 36.120 4.927 -4.784 256 HD11 ILE 53 HD11 ILE 53 34.451 5.658 -2.623 257 HD12 ILE 53 HD12 ILE 53 33.690 4.444 -1.544 258 HD13 ILE 53 HD13 ILE 53 32.694 5.263 -2.799 259 H ILE 54 H ILE 54 32.384 6.955 -6.709 260 HA ILE 54 HA ILE 54 33.686 6.132 -9.188 261 HB ILE 54 HB ILE 54 32.272 7.688 -10.454 262 HG12 ILE 54 HG12 ILE 54 31.315 8.887 -8.381 263 HG13 ILE 54 HG13 ILE 54 30.245 8.568 -9.782 264 HG21 ILE 54 HG21 ILE 54 30.449 6.017 -10.815 265 HG22 ILE 54 HG22 ILE 54 30.900 5.194 -9.273 266 HG23 ILE 54 HG23 ILE 54 32.065 5.233 -10.640 267 HD11 ILE 54 HD11 ILE 54 30.230 6.929 -7.144 268 HD12 ILE 54 HD12 ILE 54 29.188 6.635 -8.586 269 HD13 ILE 54 HD13 ILE 54 29.041 8.164 -7.658 270 H GLY 55 H GLY 55 35.196 7.517 -10.026 271 HA2 GLY 55 HA2 GLY 55 35.513 10.170 -9.667 272 HA3 GLY 55 HA3 GLY 55 36.290 9.362 -8.231 273 H ASN 56 H ASN 56 38.229 10.468 -9.539 274 HA ASN 56 HA ASN 56 39.197 8.504 -11.502 275 HB2 ASN 56 HB2 ASN 56 40.602 10.348 -12.427 276 HB3 ASN 56 HB3 ASN 56 38.837 10.705 -12.499 277 HD21 ASN 56 HD21 ASN 56 39.712 12.968 -12.773 278 HD22 ASN 56 HD22 ASN 56 40.066 13.882 -11.324 Start of MODEL 3 1 H1 PHE 17 HT1 PHE 17 35.182 13.982 -6.567 2 H2 PHE 17 HT2 PHE 17 34.971 13.073 -7.983 3 H3 PHE 17 HT3 PHE 17 36.273 12.737 -6.943 4 HA PHE 17 HA PHE 17 34.524 11.116 -6.712 5 HB2 PHE 17 HB2 PHE 17 36.047 11.488 -4.929 6 HB3 PHE 17 HB3 PHE 17 35.176 12.978 -4.370 7 HD1 PHE 17 HD1 PHE 17 33.834 9.493 -5.129 8 HD2 PHE 17 HD2 PHE 17 34.679 12.485 -2.163 9 HE1 PHE 17 HE1 PHE 17 32.688 8.133 -3.427 10 HE2 PHE 17 HE2 PHE 17 33.572 11.093 -0.443 11 HZ PHE 17 HZ PHE 17 32.581 8.901 -1.069 12 H ASP 18 H ASP 18 32.525 10.749 -7.324 13 HA ASP 18 HA ASP 18 30.401 12.108 -5.801 14 HB2 ASP 18 HB2 ASP 18 30.209 10.682 -8.540 15 HB3 ASP 18 HB3 ASP 18 28.784 11.251 -7.574 16 H VAL 19 H VAL 19 28.865 10.633 -4.765 17 HA VAL 19 HA VAL 19 29.633 7.808 -4.849 18 HB VAL 19 HB VAL 19 30.482 8.756 -2.747 19 HG11 VAL 19 HG11 VAL 19 28.892 10.657 -2.443 20 HG12 VAL 19 HG12 VAL 19 28.943 9.594 -0.993 21 HG13 VAL 19 HG13 VAL 19 27.547 9.495 -2.122 22 HG21 VAL 19 HG21 VAL 19 28.049 6.891 -2.352 23 HG22 VAL 19 HG22 VAL 19 29.451 7.084 -1.243 24 HG23 VAL 19 HG23 VAL 19 29.696 6.380 -2.884 25 H VAL 20 H VAL 20 27.885 6.422 -5.112 26 HA VAL 20 HA VAL 20 25.204 7.563 -4.850 27 HB VAL 20 HB VAL 20 24.362 6.474 -6.878 28 HG11 VAL 20 HG11 VAL 20 25.308 8.059 -8.548 29 HG12 VAL 20 HG12 VAL 20 26.687 8.431 -7.444 30 HG13 VAL 20 HG13 VAL 20 25.013 8.879 -6.966 31 HG21 VAL 20 HG21 VAL 20 27.331 5.836 -7.462 32 HG22 VAL 20 HG22 VAL 20 25.957 5.595 -8.604 33 HG23 VAL 20 HG23 VAL 20 26.050 4.633 -7.086 34 H SER 21 H SER 21 23.524 5.826 -4.624 35 HA SER 21 HA SER 21 24.577 3.545 -3.219 36 HB2 SER 21 HB2 SER 21 22.201 3.043 -2.738 37 HB3 SER 21 HB3 SER 21 22.628 4.736 -2.303 38 HG SER 21 HG SER 21 20.623 4.474 -3.514 39 H CYS 22 H CYS 22 24.178 1.327 -3.775 40 HA CYS 22 HA CYS 22 23.553 0.844 -6.620 41 HB2 CYS 22 HB2 CYS 22 24.872 -0.982 -4.543 42 HB3 CYS 22 HB3 CYS 22 24.506 -1.432 -6.244 43 H ASN 23 H ASN 23 21.815 1.150 -3.951 44 HA ASN 23 HA ASN 23 19.904 0.413 -3.099 45 HB2 ASN 23 HB2 ASN 23 19.437 -0.540 -5.981 46 HB3 ASN 23 HB3 ASN 23 18.146 -0.345 -4.729 47 HD21 ASN 23 HD21 ASN 23 19.458 1.262 -7.330 48 HD22 ASN 23 HD22 ASN 23 19.150 2.904 -6.816 49 H LYS 24 H LYS 24 21.933 -1.339 -2.440 50 HA LYS 24 HA LYS 24 20.370 -3.773 -2.019 51 HB2 LYS 24 HB2 LYS 24 23.307 -3.605 -2.858 52 HB3 LYS 24 HB3 LYS 24 22.639 -5.063 -2.062 53 HG2 LYS 24 HG2 LYS 24 21.510 -3.926 -4.701 54 HG3 LYS 24 HG3 LYS 24 22.810 -5.153 -4.603 55 HD2 LYS 24 HD2 LYS 24 21.255 -6.550 -3.113 56 HD3 LYS 24 HD3 LYS 24 19.915 -5.468 -3.609 57 HE2 LYS 24 HE2 LYS 24 21.730 -7.033 -5.585 58 HE3 LYS 24 HE3 LYS 24 20.166 -7.666 -4.929 59 HZ1 LYS 24 HZ1 LYS 24 19.060 -5.752 -5.852 60 HZ2 LYS 24 HZ2 LYS 24 19.912 -6.584 -7.067 61 HZ3 LYS 24 HZ3 LYS 24 20.522 -5.127 -6.433 62 H ASN 25 H ASN 25 20.537 -4.684 -0.025 63 HA ASN 25 HA ASN 25 21.677 -3.079 2.107 64 HB2 ASN 25 HB2 ASN 25 19.313 -3.935 2.239 65 HB3 ASN 25 HB3 ASN 25 19.912 -5.622 2.085 66 HD21 ASN 25 HD21 ASN 25 20.870 -6.624 3.950 67 HD22 ASN 25 HD22 ASN 25 20.769 -5.905 5.528 68 H CYS 26 H CYS 26 23.547 -3.720 3.291 69 HA CYS 26 HA CYS 26 24.571 -6.431 2.666 70 HB2 CYS 26 HB2 CYS 26 26.788 -5.831 3.071 71 HB3 CYS 26 HB3 CYS 26 26.156 -4.553 2.012 72 H THR 27 H THR 27 25.400 -7.630 4.531 73 HA THR 27 HA THR 27 24.200 -6.789 7.095 74 HB THR 27 HB THR 27 24.197 -9.604 5.907 75 HG1 THR 27 HG1 THR 27 22.211 -9.298 5.383 76 HG21 THR 27 HG21 THR 27 22.619 -10.080 7.829 77 HG22 THR 27 HG22 THR 27 22.856 -8.394 8.417 78 HG23 THR 27 HG23 THR 27 24.230 -9.575 8.444 79 H SER 28 H SER 28 25.523 -7.376 8.943 80 HA SER 28 HA SER 28 28.249 -7.530 8.542 81 HB2 SER 28 HB2 SER 28 27.221 -6.711 10.642 82 HB3 SER 28 HB3 SER 28 26.602 -8.360 11.000 83 HG SER 28 HG SER 28 28.729 -7.528 11.936 84 H GLY 29 H GLY 29 29.831 -9.108 8.606 85 HA2 GLY 29 HA2 GLY 29 30.779 -11.129 8.409 86 HA3 GLY 29 HA3 GLY 29 29.230 -11.903 8.905 87 H GLN 30 H GLN 30 27.567 -11.139 7.110 88 HA GLN 30 HA GLN 30 27.925 -12.890 4.932 89 HB2 GLN 30 HB2 GLN 30 25.825 -12.543 6.125 90 HB3 GLN 30 HB3 GLN 30 25.825 -10.808 5.699 91 HG2 GLN 30 HG2 GLN 30 25.440 -11.293 3.357 92 HG3 GLN 30 HG3 GLN 30 25.580 -13.089 3.596 93 HE21 GLN 30 HE21 GLN 30 23.853 -14.131 4.925 94 HE22 GLN 30 HE22 GLN 30 22.276 -13.380 5.010 95 H ASN 31 H ASN 31 27.740 -9.322 4.988 96 HA ASN 31 HA ASN 31 28.444 -7.726 3.622 97 HB2 ASN 31 HB2 ASN 31 30.637 -9.787 2.967 98 HB3 ASN 31 HB3 ASN 31 30.743 -8.028 2.605 99 HD21 ASN 31 HD21 ASN 31 29.213 -8.064 5.612 100 HD22 ASN 31 HD22 ASN 31 30.647 -8.056 6.603 101 H GLU 32 H GLU 32 26.313 -8.997 2.242 102 HA GLU 32 HA GLU 32 27.129 -9.555 -0.445 103 HB2 GLU 32 HB2 GLU 32 24.425 -9.032 0.846 104 HB3 GLU 32 HB3 GLU 32 24.580 -9.348 -0.902 105 HG2 GLU 32 HG2 GLU 32 25.554 -11.326 1.277 106 HG3 GLU 32 HG3 GLU 32 23.916 -11.372 0.506 107 H CYS 33 H CYS 33 27.837 -8.103 -1.912 108 HA CYS 33 HA CYS 33 25.934 -6.063 -2.581 109 HB2 CYS 33 HB2 CYS 33 28.973 -5.545 -2.636 110 HB3 CYS 33 HB3 CYS 33 27.756 -4.501 -3.426 111 HA PRO 34 HA PRO 34 27.069 -8.099 -6.477 112 HB2 PRO 34 HB2 PRO 34 26.289 -6.212 -8.387 113 HB3 PRO 34 HB3 PRO 34 25.085 -7.141 -7.411 114 HG2 PRO 34 HG2 PRO 34 26.208 -4.350 -6.795 115 HG3 PRO 34 HG3 PRO 34 24.463 -4.832 -6.924 116 HD2 PRO 34 HD2 PRO 34 25.733 -4.735 -4.489 117 HD3 PRO 34 HD3 PRO 34 24.603 -6.121 -4.861 118 H GLU 35 H GLU 35 28.668 -7.862 -8.294 119 HA GLU 35 HA GLU 35 31.050 -6.796 -7.309 120 HB2 GLU 35 HB2 GLU 35 30.891 -8.772 -8.794 121 HB3 GLU 35 HB3 GLU 35 30.291 -7.733 -10.124 122 HG2 GLU 35 HG2 GLU 35 32.517 -6.538 -10.223 123 HG3 GLU 35 HG3 GLU 35 33.117 -7.540 -8.841 124 H GLY 36 H GLY 36 32.128 -4.893 -7.552 125 HA2 GLY 36 HA2 GLY 36 32.709 -2.918 -8.641 126 HA3 GLY 36 HA3 GLY 36 31.119 -2.897 -9.477 127 H CYS 37 H CYS 37 30.064 -3.724 -6.585 128 HA CYS 37 HA CYS 37 30.013 -0.976 -5.515 129 HB2 CYS 37 HB2 CYS 37 27.957 -3.232 -5.234 130 HB3 CYS 37 HB3 CYS 37 27.854 -1.622 -4.433 131 H PHE 38 H PHE 38 29.979 -0.800 -3.136 132 HA PHE 38 HA PHE 38 30.962 -3.133 -1.686 133 HB2 PHE 38 HB2 PHE 38 32.887 -1.954 -0.702 134 HB3 PHE 38 HB3 PHE 38 33.047 -1.799 -2.489 135 HD1 PHE 38 HD1 PHE 38 32.779 -0.036 0.654 136 HD2 PHE 38 HD2 PHE 38 32.072 0.373 -3.566 137 HE1 PHE 38 HE1 PHE 38 32.490 2.404 0.942 138 HE2 PHE 38 HE2 PHE 38 31.655 2.764 -3.265 139 HZ PHE 38 HZ PHE 38 31.899 3.816 -1.015 140 H CYS 39 H CYS 39 30.751 -2.614 0.799 141 HA CYS 39 HA CYS 39 28.653 -0.546 1.165 142 HB2 CYS 39 HB2 CYS 39 27.664 -2.748 1.138 143 HB3 CYS 39 HB3 CYS 39 28.850 -3.357 2.356 144 H GLY 40 H GLY 40 29.177 0.993 2.574 145 HA2 GLY 40 HA2 GLY 40 31.535 0.668 4.253 146 HA3 GLY 40 HA3 GLY 40 30.526 2.144 4.005 147 H LEU 41 H LEU 41 30.214 -1.170 5.275 148 HA LEU 41 HA LEU 41 28.123 -0.538 7.067 149 HB2 LEU 41 HB2 LEU 41 28.948 -2.824 5.941 150 HB3 LEU 41 HB3 LEU 41 29.884 -2.991 7.445 151 HG LEU 41 HG LEU 41 26.838 -2.793 7.077 152 HD11 LEU 41 HD11 LEU 41 28.054 -4.989 6.548 153 HD12 LEU 41 HD12 LEU 41 26.769 -5.110 7.803 154 HD13 LEU 41 HD13 LEU 41 28.501 -5.044 8.305 155 HD21 LEU 41 HD21 LEU 41 27.043 -1.730 9.212 156 HD22 LEU 41 HD22 LEU 41 28.374 -2.854 9.741 157 HD23 LEU 41 HD23 LEU 41 26.684 -3.449 9.560 158 H LEU 42 H LEU 42 28.137 -0.238 9.344 159 HA LEU 42 HA LEU 42 30.269 1.420 10.095 160 HB2 LEU 42 HB2 LEU 42 27.824 0.507 11.764 161 HB3 LEU 42 HB3 LEU 42 28.837 1.954 12.023 162 HG LEU 42 HG LEU 42 26.875 2.781 11.154 163 HD11 LEU 42 HD11 LEU 42 28.669 3.861 9.884 164 HD12 LEU 42 HD12 LEU 42 27.252 3.565 8.787 165 HD13 LEU 42 HD13 LEU 42 28.692 2.521 8.670 166 HD21 LEU 42 HD21 LEU 42 25.424 1.866 9.531 167 HD22 LEU 42 HD22 LEU 42 26.026 0.444 10.472 168 HD23 LEU 42 HD23 LEU 42 26.683 0.803 8.826 169 H GLY 43 H GLY 43 31.856 -0.523 10.131 170 HA2 GLY 43 HA2 GLY 43 33.367 -1.626 11.428 171 HA3 GLY 43 HA3 GLY 43 32.457 -1.099 12.886 172 H GLN 44 H GLN 44 30.887 -2.867 10.348 173 HA GLN 44 HA GLN 44 29.752 -4.785 10.293 174 HB2 GLN 44 HB2 GLN 44 32.152 -5.815 11.878 175 HB3 GLN 44 HB3 GLN 44 30.906 -6.895 11.203 176 HG2 GLN 44 HG2 GLN 44 32.628 -5.019 9.450 177 HG3 GLN 44 HG3 GLN 44 33.033 -6.728 9.841 178 HE21 GLN 44 HE21 GLN 44 31.353 -4.756 7.564 179 HE22 GLN 44 HE22 GLN 44 30.433 -6.064 6.836 180 H ASN 45 H ASN 45 28.944 -2.985 12.490 181 HA ASN 45 HA ASN 45 28.260 -4.723 14.688 182 HB2 ASN 45 HB2 ASN 45 27.406 -1.880 13.895 183 HB3 ASN 45 HB3 ASN 45 26.689 -2.736 15.310 184 HD21 ASN 45 HD21 ASN 45 29.598 -0.995 14.217 185 HD22 ASN 45 HD22 ASN 45 30.399 -1.134 15.756 186 H LYS 46 H LYS 46 26.330 -3.445 11.936 187 HA LYS 46 HA LYS 46 24.282 -5.467 12.546 188 HB2 LYS 46 HB2 LYS 46 23.785 -2.451 12.179 189 HB3 LYS 46 HB3 LYS 46 22.481 -3.698 12.121 190 HG2 LYS 46 HG2 LYS 46 24.262 -3.138 14.568 191 HG3 LYS 46 HG3 LYS 46 22.638 -2.436 14.279 192 HD2 LYS 46 HD2 LYS 46 21.652 -4.741 14.176 193 HD3 LYS 46 HD3 LYS 46 23.252 -5.443 14.573 194 HE2 LYS 46 HE2 LYS 46 21.688 -3.486 16.398 195 HE3 LYS 46 HE3 LYS 46 21.728 -5.292 16.565 196 HZ1 LYS 46 HZ1 LYS 46 24.016 -3.418 16.763 197 HZ2 LYS 46 HZ2 LYS 46 24.154 -5.107 16.728 198 HZ3 LYS 46 HZ3 LYS 46 23.318 -4.350 18.002 199 H LYS 47 H LYS 47 23.690 -2.853 10.313 200 HA LYS 47 HA LYS 47 24.297 -4.477 8.002 201 HB2 LYS 47 HB2 LYS 47 21.981 -4.288 7.156 202 HB3 LYS 47 HB3 LYS 47 22.003 -5.160 8.716 203 HG2 LYS 47 HG2 LYS 47 21.351 -2.921 9.862 204 HG3 LYS 47 HG3 LYS 47 21.175 -2.239 8.212 205 HD2 LYS 47 HD2 LYS 47 18.962 -2.875 8.773 206 HD3 LYS 47 HD3 LYS 47 19.552 -4.197 7.725 207 HE2 LYS 47 HE2 LYS 47 18.389 -5.263 9.568 208 HE3 LYS 47 HE3 LYS 47 20.152 -5.480 9.945 209 HZ1 LYS 47 HZ1 LYS 47 20.003 -3.531 11.353 210 HZ2 LYS 47 HZ2 LYS 47 18.932 -4.758 11.845 211 HZ3 LYS 47 HZ3 LYS 47 18.341 -3.389 11.028 212 H GLY 48 H GLY 48 24.012 -3.154 6.030 213 HA2 GLY 48 HA2 GLY 48 23.869 -0.278 6.329 214 HA3 GLY 48 HA3 GLY 48 25.481 -0.965 5.857 215 H HIS 49 H HIS 49 24.798 0.548 3.831 216 HA HIS 49 HA HIS 49 23.168 -1.135 2.020 217 HB2 HIS 49 HB2 HIS 49 22.018 0.942 3.054 218 HB3 HIS 49 HB3 HIS 49 23.203 1.930 2.157 219 HD2 HIS 49 HD2 HIS 49 22.219 2.627 -0.389 220 HE1 HIS 49 HE1 HIS 49 19.083 -0.224 -0.414 221 HE2 HIS 49 HE2 HIS 49 20.052 1.824 -1.561 222 H CYS 50 H CYS 50 23.965 -1.284 -0.128 223 HA CYS 50 HA CYS 50 26.790 -0.867 -0.322 224 HB2 CYS 50 HB2 CYS 50 24.808 -1.917 -2.404 225 HB3 CYS 50 HB3 CYS 50 26.595 -1.964 -2.580 226 H TYR 51 H TYR 51 28.022 0.458 -1.681 227 HA TYR 51 HA TYR 51 26.562 2.597 -3.102 228 HB2 TYR 51 HB2 TYR 51 29.276 3.042 -1.700 229 HB3 TYR 51 HB3 TYR 51 28.163 4.263 -2.390 230 HD1 TYR 51 HD1 TYR 51 29.517 3.906 0.415 231 HD2 TYR 51 HD2 TYR 51 25.515 3.300 -1.041 232 HE1 TYR 51 HE1 TYR 51 28.639 4.209 2.705 233 HE2 TYR 51 HE2 TYR 51 24.664 3.472 1.264 234 HH TYR 51 HH TYR 51 26.815 4.148 4.036 235 H LYS 52 H LYS 52 27.860 3.667 -4.769 236 HA LYS 52 HA LYS 52 30.260 2.197 -5.675 237 HB2 LYS 52 HB2 LYS 52 28.409 2.064 -7.371 238 HB3 LYS 52 HB3 LYS 52 28.323 3.851 -7.394 239 HG2 LYS 52 HG2 LYS 52 30.755 3.902 -8.206 240 HG3 LYS 52 HG3 LYS 52 30.716 2.110 -8.261 241 HD2 LYS 52 HD2 LYS 52 29.027 4.076 -9.927 242 HD3 LYS 52 HD3 LYS 52 30.428 3.101 -10.481 243 HE2 LYS 52 HE2 LYS 52 29.051 0.982 -9.989 244 HE3 LYS 52 HE3 LYS 52 27.642 2.088 -9.649 245 HZ1 LYS 52 HZ1 LYS 52 29.195 1.945 -12.176 246 HZ2 LYS 52 HZ2 LYS 52 27.885 2.982 -11.856 247 HZ3 LYS 52 HZ3 LYS 52 27.649 1.299 -11.898 248 H ILE 53 H ILE 53 32.134 3.444 -5.842 249 HA ILE 53 HA ILE 53 32.011 6.332 -5.321 250 HB ILE 53 HB ILE 53 34.294 4.327 -5.293 251 HG12 ILE 53 HG12 ILE 53 33.326 6.152 -3.028 252 HG13 ILE 53 HG13 ILE 53 32.707 4.502 -3.274 253 HG21 ILE 53 HG21 ILE 53 35.191 6.394 -6.324 254 HG22 ILE 53 HG22 ILE 53 35.803 6.248 -4.654 255 HG23 ILE 53 HG23 ILE 53 34.461 7.398 -5.008 256 HD11 ILE 53 HD11 ILE 53 35.082 3.605 -3.045 257 HD12 ILE 53 HD12 ILE 53 34.507 4.472 -1.576 258 HD13 ILE 53 HD13 ILE 53 35.655 5.280 -2.698 259 H ILE 54 H ILE 54 32.184 7.719 -7.084 260 HA ILE 54 HA ILE 54 33.082 6.471 -9.621 261 HB ILE 54 HB ILE 54 31.300 8.933 -9.332 262 HG12 ILE 54 HG12 ILE 54 29.584 7.263 -10.452 263 HG13 ILE 54 HG13 ILE 54 30.529 5.972 -9.642 264 HG21 ILE 54 HG21 ILE 54 32.685 8.684 -11.483 265 HG22 ILE 54 HG22 ILE 54 30.915 8.569 -11.752 266 HG23 ILE 54 HG23 ILE 54 31.896 7.065 -11.717 267 HD11 ILE 54 HD11 ILE 54 29.696 6.576 -7.541 268 HD12 ILE 54 HD12 ILE 54 28.402 7.390 -8.504 269 HD13 ILE 54 HD13 ILE 54 29.824 8.331 -7.889 270 H GLY 55 H GLY 55 34.982 7.258 -10.400 271 HA2 GLY 55 HA2 GLY 55 35.806 9.542 -11.102 272 HA3 GLY 55 HA3 GLY 55 36.032 9.796 -9.330 273 H ASN 56 H ASN 56 37.122 7.705 -8.314 274 HA ASN 56 HA ASN 56 39.627 7.346 -9.819 275 HB2 ASN 56 HB2 ASN 56 40.635 6.695 -7.628 276 HB3 ASN 56 HB3 ASN 56 39.952 8.357 -7.651 277 HD21 ASN 56 HD21 ASN 56 38.908 8.836 -5.755 278 HD22 ASN 56 HD22 ASN 56 38.026 7.689 -4.778 Start of MODEL 4 1 H1 PHE 17 HT1 PHE 17 34.253 13.655 -8.307 2 H2 PHE 17 HT2 PHE 17 35.770 13.139 -7.744 3 H3 PHE 17 HT3 PHE 17 34.842 14.225 -6.826 4 HA PHE 17 HA PHE 17 34.157 11.431 -7.427 5 HB2 PHE 17 HB2 PHE 17 36.040 11.522 -5.949 6 HB3 PHE 17 HB3 PHE 17 35.288 12.830 -4.955 7 HD1 PHE 17 HD1 PHE 17 33.827 9.472 -6.076 8 HD2 PHE 17 HD2 PHE 17 35.155 11.968 -2.833 9 HE1 PHE 17 HE1 PHE 17 32.782 7.941 -4.469 10 HE2 PHE 17 HE2 PHE 17 34.216 10.353 -1.213 11 HZ PHE 17 HZ PHE 17 33.018 8.339 -2.023 12 H ASP 18 H ASP 18 32.124 10.807 -7.362 13 HA ASP 18 HA ASP 18 30.310 12.037 -5.414 14 HB2 ASP 18 HB2 ASP 18 29.587 10.956 -8.224 15 HB3 ASP 18 HB3 ASP 18 28.376 11.416 -6.957 16 H VAL 19 H VAL 19 28.982 10.441 -4.275 17 HA VAL 19 HA VAL 19 29.612 7.648 -4.926 18 HB VAL 19 HB VAL 19 30.823 8.177 -2.892 19 HG11 VAL 19 HG11 VAL 19 28.078 8.969 -1.690 20 HG12 VAL 19 HG12 VAL 19 29.448 10.095 -2.037 21 HG13 VAL 19 HG13 VAL 19 29.627 8.808 -0.793 22 HG21 VAL 19 HG21 VAL 19 28.329 6.467 -2.262 23 HG22 VAL 19 HG22 VAL 19 29.956 6.348 -1.510 24 HG23 VAL 19 HG23 VAL 19 29.726 5.888 -3.238 25 H VAL 20 H VAL 20 27.886 6.354 -5.176 26 HA VAL 20 HA VAL 20 25.248 7.311 -4.390 27 HB VAL 20 HB VAL 20 24.273 6.398 -6.509 28 HG11 VAL 20 HG11 VAL 20 24.676 8.879 -6.214 29 HG12 VAL 20 HG12 VAL 20 24.873 8.360 -7.931 30 HG13 VAL 20 HG13 VAL 20 26.325 8.689 -6.916 31 HG21 VAL 20 HG21 VAL 20 25.727 5.904 -8.426 32 HG22 VAL 20 HG22 VAL 20 26.413 4.959 -7.045 33 HG23 VAL 20 HG23 VAL 20 27.183 6.492 -7.546 34 H SER 21 H SER 21 23.680 5.462 -4.169 35 HA SER 21 HA SER 21 25.100 3.148 -3.186 36 HB2 SER 21 HB2 SER 21 22.996 2.363 -2.286 37 HB3 SER 21 HB3 SER 21 23.256 4.083 -1.852 38 HG SER 21 HG SER 21 21.175 3.887 -2.538 39 H CYS 22 H CYS 22 24.601 0.971 -3.803 40 HA CYS 22 HA CYS 22 23.938 0.626 -6.636 41 HB2 CYS 22 HB2 CYS 22 25.203 -1.245 -4.561 42 HB3 CYS 22 HB3 CYS 22 24.871 -1.695 -6.278 43 H ASN 23 H ASN 23 22.171 1.022 -4.129 44 HA ASN 23 HA ASN 23 20.150 0.532 -3.358 45 HB2 ASN 23 HB2 ASN 23 19.799 -0.841 -6.096 46 HB3 ASN 23 HB3 ASN 23 18.453 -0.470 -4.971 47 HD21 ASN 23 HD21 ASN 23 20.221 2.302 -4.474 48 HD22 ASN 23 HD22 ASN 23 19.540 3.231 -5.775 49 H LYS 24 H LYS 24 22.324 -1.551 -2.933 50 HA LYS 24 HA LYS 24 20.565 -3.768 -2.117 51 HB2 LYS 24 HB2 LYS 24 23.472 -3.752 -3.049 52 HB3 LYS 24 HB3 LYS 24 22.777 -5.144 -2.171 53 HG2 LYS 24 HG2 LYS 24 21.560 -4.021 -4.769 54 HG3 LYS 24 HG3 LYS 24 22.810 -5.302 -4.764 55 HD2 LYS 24 HD2 LYS 24 20.156 -5.572 -3.229 56 HD3 LYS 24 HD3 LYS 24 20.382 -6.108 -4.930 57 HE2 LYS 24 HE2 LYS 24 22.161 -7.707 -4.255 58 HE3 LYS 24 HE3 LYS 24 22.041 -7.154 -2.534 59 HZ1 LYS 24 HZ1 LYS 24 19.739 -7.846 -2.540 60 HZ2 LYS 24 HZ2 LYS 24 20.801 -9.115 -2.847 61 HZ3 LYS 24 HZ3 LYS 24 19.892 -8.450 -4.126 62 H ASN 25 H ASN 25 20.735 -4.637 -0.133 63 HA ASN 25 HA ASN 25 22.053 -3.058 1.931 64 HB2 ASN 25 HB2 ASN 25 19.595 -3.383 2.113 65 HB3 ASN 25 HB3 ASN 25 19.796 -5.164 2.002 66 HD21 ASN 25 HD21 ASN 25 21.031 -6.189 3.742 67 HD22 ASN 25 HD22 ASN 25 20.980 -5.577 5.361 68 H CYS 26 H CYS 26 23.786 -3.885 3.089 69 HA CYS 26 HA CYS 26 24.457 -6.735 2.720 70 HB2 CYS 26 HB2 CYS 26 26.713 -6.306 3.260 71 HB3 CYS 26 HB3 CYS 26 26.275 -5.059 2.063 72 H THR 27 H THR 27 25.120 -7.903 4.839 73 HA THR 27 HA THR 27 23.952 -6.587 7.208 74 HB THR 27 HB THR 27 23.507 -9.516 6.461 75 HG1 THR 27 HG1 THR 27 22.200 -8.225 5.219 76 HG21 THR 27 HG21 THR 27 23.567 -9.020 8.978 77 HG22 THR 27 HG22 THR 27 21.913 -9.437 8.405 78 HG23 THR 27 HG23 THR 27 22.351 -7.716 8.700 79 H SER 28 H SER 28 25.212 -7.101 9.193 80 HA SER 28 HA SER 28 27.848 -7.843 8.711 81 HB2 SER 28 HB2 SER 28 27.224 -6.601 10.725 82 HB3 SER 28 HB3 SER 28 26.327 -8.016 11.363 83 HG SER 28 HG SER 28 28.701 -7.583 11.937 84 H GLY 29 H GLY 29 28.986 -9.702 8.703 85 HA2 GLY 29 HA2 GLY 29 29.449 -11.920 8.909 86 HA3 GLY 29 HA3 GLY 29 27.718 -12.282 9.246 87 H GLN 30 H GLN 30 27.118 -10.454 6.725 88 HA GLN 30 HA GLN 30 28.325 -12.042 4.637 89 HB2 GLN 30 HB2 GLN 30 26.181 -12.740 3.606 90 HB3 GLN 30 HB3 GLN 30 26.486 -13.490 5.201 91 HG2 GLN 30 HG2 GLN 30 24.910 -11.823 6.287 92 HG3 GLN 30 HG3 GLN 30 24.492 -11.179 4.657 93 HE21 GLN 30 HE21 GLN 30 23.739 -12.991 3.025 94 HE22 GLN 30 HE22 GLN 30 22.684 -14.204 3.711 95 H ASN 31 H ASN 31 29.305 -10.336 3.693 96 HA ASN 31 HA ASN 31 27.978 -7.856 3.369 97 HB2 ASN 31 HB2 ASN 31 30.621 -8.916 2.194 98 HB3 ASN 31 HB3 ASN 31 30.082 -7.194 2.121 99 HD21 ASN 31 HD21 ASN 31 29.576 -6.134 4.357 100 HD22 ASN 31 HD22 ASN 31 30.650 -6.608 5.649 101 H GLU 32 H GLU 32 26.066 -8.471 2.202 102 HA GLU 32 HA GLU 32 26.211 -9.797 -0.271 103 HB2 GLU 32 HB2 GLU 32 24.336 -9.827 1.571 104 HB3 GLU 32 HB3 GLU 32 23.801 -8.296 0.879 105 HG2 GLU 32 HG2 GLU 32 23.406 -9.328 -1.375 106 HG3 GLU 32 HG3 GLU 32 24.026 -10.910 -0.768 107 H CYS 33 H CYS 33 27.678 -8.200 -1.463 108 HA CYS 33 HA CYS 33 26.029 -6.090 -2.712 109 HB2 CYS 33 HB2 CYS 33 29.085 -6.173 -2.450 110 HB3 CYS 33 HB3 CYS 33 28.163 -4.922 -3.334 111 HA PRO 34 HA PRO 34 27.165 -8.167 -6.564 112 HB2 PRO 34 HB2 PRO 34 26.664 -6.131 -8.411 113 HB3 PRO 34 HB3 PRO 34 25.327 -7.006 -7.565 114 HG2 PRO 34 HG2 PRO 34 26.614 -4.345 -6.748 115 HG3 PRO 34 HG3 PRO 34 24.848 -4.688 -6.987 116 HD2 PRO 34 HD2 PRO 34 26.034 -4.784 -4.499 117 HD3 PRO 34 HD3 PRO 34 24.769 -6.019 -4.955 118 H GLU 35 H GLU 35 28.933 -7.954 -8.230 119 HA GLU 35 HA GLU 35 31.282 -6.983 -7.059 120 HB2 GLU 35 HB2 GLU 35 31.175 -8.944 -8.594 121 HB3 GLU 35 HB3 GLU 35 30.689 -7.867 -9.930 122 HG2 GLU 35 HG2 GLU 35 33.055 -8.512 -10.176 123 HG3 GLU 35 HG3 GLU 35 32.961 -6.742 -9.883 124 H GLY 36 H GLY 36 32.544 -5.179 -7.356 125 HA2 GLY 36 HA2 GLY 36 33.190 -3.187 -8.331 126 HA3 GLY 36 HA3 GLY 36 31.629 -3.089 -9.215 127 H CYS 37 H CYS 37 30.552 -3.878 -6.278 128 HA CYS 37 HA CYS 37 30.479 -1.082 -5.327 129 HB2 CYS 37 HB2 CYS 37 28.441 -3.337 -4.918 130 HB3 CYS 37 HB3 CYS 37 28.322 -1.674 -4.239 131 H PHE 38 H PHE 38 30.527 -0.784 -2.958 132 HA PHE 38 HA PHE 38 31.545 -3.108 -1.451 133 HB2 PHE 38 HB2 PHE 38 33.244 -1.811 -0.300 134 HB3 PHE 38 HB3 PHE 38 33.497 -1.463 -2.042 135 HD1 PHE 38 HD1 PHE 38 32.520 0.799 -2.971 136 HD2 PHE 38 HD2 PHE 38 32.765 -0.122 1.221 137 HE1 PHE 38 HE1 PHE 38 32.149 3.177 -2.415 138 HE2 PHE 38 HE2 PHE 38 32.424 2.252 1.777 139 HZ PHE 38 HZ PHE 38 32.140 3.924 -0.051 140 H CYS 39 H CYS 39 30.981 -2.742 1.021 141 HA CYS 39 HA CYS 39 28.624 -0.924 1.161 142 HB2 CYS 39 HB2 CYS 39 27.948 -3.235 1.256 143 HB3 CYS 39 HB3 CYS 39 29.117 -3.583 2.595 144 H GLY 40 H GLY 40 28.712 0.697 2.543 145 HA2 GLY 40 HA2 GLY 40 31.099 1.041 4.169 146 HA3 GLY 40 HA3 GLY 40 29.743 2.199 3.895 147 H LEU 41 H LEU 41 30.232 -1.034 5.307 148 HA LEU 41 HA LEU 41 28.091 -0.611 7.171 149 HB2 LEU 41 HB2 LEU 41 28.943 -2.811 5.895 150 HB3 LEU 41 HB3 LEU 41 29.973 -2.994 7.335 151 HG LEU 41 HG LEU 41 26.912 -2.938 7.118 152 HD11 LEU 41 HD11 LEU 41 27.076 -5.203 8.139 153 HD12 LEU 41 HD12 LEU 41 28.885 -5.113 8.073 154 HD13 LEU 41 HD13 LEU 41 27.925 -5.104 6.551 155 HD21 LEU 41 HD21 LEU 41 28.500 -2.868 9.740 156 HD22 LEU 41 HD22 LEU 41 26.821 -3.515 9.593 157 HD23 LEU 41 HD23 LEU 41 27.137 -1.799 9.194 158 H LEU 42 H LEU 42 28.236 -0.226 9.365 159 HA LEU 42 HA LEU 42 30.447 1.325 10.108 160 HB2 LEU 42 HB2 LEU 42 28.045 0.446 11.859 161 HB3 LEU 42 HB3 LEU 42 29.108 1.858 12.091 162 HG LEU 42 HG LEU 42 27.139 2.760 11.333 163 HD11 LEU 42 HD11 LEU 42 27.394 3.534 8.939 164 HD12 LEU 42 HD12 LEU 42 28.815 2.476 8.757 165 HD13 LEU 42 HD13 LEU 42 28.865 3.816 9.970 166 HD21 LEU 42 HD21 LEU 42 26.744 0.804 9.010 167 HD22 LEU 42 HD22 LEU 42 25.571 1.923 9.777 168 HD23 LEU 42 HD23 LEU 42 26.144 0.481 10.687 169 H GLY 43 H GLY 43 32.019 -0.616 10.063 170 HA2 GLY 43 HA2 GLY 43 33.536 -1.787 11.296 171 HA3 GLY 43 HA3 GLY 43 32.629 -1.345 12.784 172 H GLN 44 H GLN 44 30.985 -2.888 10.205 173 HA GLN 44 HA GLN 44 29.713 -4.695 10.073 174 HB2 GLN 44 HB2 GLN 44 32.052 -6.126 11.426 175 HB3 GLN 44 HB3 GLN 44 30.670 -6.931 10.597 176 HG2 GLN 44 HG2 GLN 44 31.298 -5.875 8.414 177 HG3 GLN 44 HG3 GLN 44 32.699 -5.067 9.213 178 HE21 GLN 44 HE21 GLN 44 31.327 -8.454 9.263 179 HE22 GLN 44 HE22 GLN 44 32.839 -9.215 8.832 180 H ASN 45 H ASN 45 29.091 -3.068 12.359 181 HA ASN 45 HA ASN 45 28.342 -4.923 14.454 182 HB2 ASN 45 HB2 ASN 45 27.701 -1.959 13.950 183 HB3 ASN 45 HB3 ASN 45 27.007 -2.893 15.331 184 HD21 ASN 45 HD21 ASN 45 29.981 -1.360 14.131 185 HD22 ASN 45 HD22 ASN 45 30.878 -1.656 15.598 186 H LYS 46 H LYS 46 26.466 -3.339 11.789 187 HA LYS 46 HA LYS 46 24.183 -5.055 12.579 188 HB2 LYS 46 HB2 LYS 46 24.087 -2.071 11.849 189 HB3 LYS 46 HB3 LYS 46 22.650 -3.138 12.094 190 HG2 LYS 46 HG2 LYS 46 23.407 -3.561 14.453 191 HG3 LYS 46 HG3 LYS 46 24.730 -2.368 14.207 192 HD2 LYS 46 HD2 LYS 46 23.021 -0.605 13.638 193 HD3 LYS 46 HD3 LYS 46 21.713 -1.775 14.006 194 HE2 LYS 46 HE2 LYS 46 23.859 -0.769 16.002 195 HE3 LYS 46 HE3 LYS 46 22.124 -0.241 15.937 196 HZ1 LYS 46 HZ1 LYS 46 22.567 -1.949 17.591 197 HZ2 LYS 46 HZ2 LYS 46 23.060 -3.023 16.366 198 HZ3 LYS 46 HZ3 LYS 46 21.456 -2.468 16.413 199 H LYS 47 H LYS 47 23.684 -2.667 10.098 200 HA LYS 47 HA LYS 47 24.240 -4.471 7.936 201 HB2 LYS 47 HB2 LYS 47 22.019 -4.481 7.007 202 HB3 LYS 47 HB3 LYS 47 21.848 -5.046 8.690 203 HG2 LYS 47 HG2 LYS 47 21.110 -2.271 7.561 204 HG3 LYS 47 HG3 LYS 47 20.005 -3.602 7.985 205 HD2 LYS 47 HD2 LYS 47 20.878 -3.405 10.417 206 HD3 LYS 47 HD3 LYS 47 21.601 -1.837 9.894 207 HE2 LYS 47 HE2 LYS 47 18.596 -2.577 9.739 208 HE3 LYS 47 HE3 LYS 47 19.368 -1.532 11.005 209 HZ1 LYS 47 HZ1 LYS 47 18.362 -0.251 9.253 210 HZ2 LYS 47 HZ2 LYS 47 19.335 -1.011 8.085 211 HZ3 LYS 47 HZ3 LYS 47 20.049 -0.026 9.269 212 H GLY 48 H GLY 48 23.844 -3.155 5.827 213 HA2 GLY 48 HA2 GLY 48 23.536 -0.348 6.070 214 HA3 GLY 48 HA3 GLY 48 25.270 -0.840 5.836 215 H HIS 49 H HIS 49 24.433 0.631 3.768 216 HA HIS 49 HA HIS 49 23.524 -1.301 1.748 217 HB2 HIS 49 HB2 HIS 49 23.120 1.633 2.065 218 HB3 HIS 49 HB3 HIS 49 23.209 0.978 0.379 219 HD2 HIS 49 HD2 HIS 49 20.911 0.345 -0.586 220 HE1 HIS 49 HE1 HIS 49 18.916 -0.769 2.979 221 HE2 HIS 49 HE2 HIS 49 18.699 -0.517 0.460 222 H CYS 50 H CYS 50 24.359 -1.469 -0.243 223 HA CYS 50 HA CYS 50 27.216 -1.215 -0.391 224 HB2 CYS 50 HB2 CYS 50 25.172 -2.248 -2.432 225 HB3 CYS 50 HB3 CYS 50 26.954 -2.396 -2.600 226 H TYR 51 H TYR 51 28.402 0.229 -1.640 227 HA TYR 51 HA TYR 51 26.914 2.287 -3.154 228 HB2 TYR 51 HB2 TYR 51 29.531 2.841 -1.609 229 HB3 TYR 51 HB3 TYR 51 28.383 4.008 -2.377 230 HD1 TYR 51 HD1 TYR 51 29.664 4.021 0.357 231 HD2 TYR 51 HD2 TYR 51 25.778 2.746 -0.970 232 HE1 TYR 51 HE1 TYR 51 28.788 4.323 2.645 233 HE2 TYR 51 HE2 TYR 51 24.951 2.908 1.339 234 HH TYR 51 HH TYR 51 27.022 3.973 4.038 235 H LYS 52 H LYS 52 28.260 3.333 -4.861 236 HA LYS 52 HA LYS 52 30.776 1.902 -5.411 237 HB2 LYS 52 HB2 LYS 52 30.475 2.082 -7.829 238 HB3 LYS 52 HB3 LYS 52 29.203 1.078 -7.087 239 HG2 LYS 52 HG2 LYS 52 27.579 2.924 -7.243 240 HG3 LYS 52 HG3 LYS 52 28.819 4.037 -7.913 241 HD2 LYS 52 HD2 LYS 52 29.072 2.695 -9.919 242 HD3 LYS 52 HD3 LYS 52 28.080 1.361 -9.256 243 HE2 LYS 52 HE2 LYS 52 26.943 4.191 -9.788 244 HE3 LYS 52 HE3 LYS 52 26.910 2.839 -10.997 245 HZ1 LYS 52 HZ1 LYS 52 25.739 2.743 -8.271 246 HZ2 LYS 52 HZ2 LYS 52 25.726 1.501 -9.423 247 HZ3 LYS 52 HZ3 LYS 52 24.890 2.951 -9.727 248 H ILE 53 H ILE 53 32.399 3.097 -6.527 249 HA ILE 53 HA ILE 53 32.372 5.929 -5.752 250 HB ILE 53 HB ILE 53 34.649 3.974 -6.310 251 HG12 ILE 53 HG12 ILE 53 33.574 3.447 -4.164 252 HG13 ILE 53 HG13 ILE 53 35.222 4.099 -3.948 253 HG21 ILE 53 HG21 ILE 53 36.151 5.813 -5.437 254 HG22 ILE 53 HG22 ILE 53 34.751 6.946 -5.468 255 HG23 ILE 53 HG23 ILE 53 35.370 6.219 -7.001 256 HD11 ILE 53 HD11 ILE 53 32.601 5.690 -3.501 257 HD12 ILE 53 HD12 ILE 53 34.281 6.325 -3.277 258 HD13 ILE 53 HD13 ILE 53 33.672 5.007 -2.226 259 H ILE 54 H ILE 54 32.134 7.405 -7.423 260 HA ILE 54 HA ILE 54 33.345 6.687 -9.988 261 HB ILE 54 HB ILE 54 31.620 7.930 -11.182 262 HG12 ILE 54 HG12 ILE 54 30.721 9.178 -9.100 263 HG13 ILE 54 HG13 ILE 54 29.581 8.638 -10.368 264 HG21 ILE 54 HG21 ILE 54 29.975 6.047 -11.219 265 HG22 ILE 54 HG22 ILE 54 30.671 5.405 -9.684 266 HG23 ILE 54 HG23 ILE 54 31.681 5.460 -11.170 267 HD11 ILE 54 HD11 ILE 54 28.823 6.736 -8.985 268 HD12 ILE 54 HD12 ILE 54 28.667 8.276 -8.073 269 HD13 ILE 54 HD13 ILE 54 29.996 7.138 -7.681 270 H GLY 55 H GLY 55 34.248 8.382 -11.195 271 HA2 GLY 55 HA2 GLY 55 34.929 10.525 -11.572 272 HA3 GLY 55 HA3 GLY 55 34.360 11.028 -9.949 273 H ASN 56 H ASN 56 36.047 8.341 -9.258 274 HA ASN 56 HA ASN 56 38.415 9.832 -8.522 275 HB2 ASN 56 HB2 ASN 56 37.271 8.163 -6.995 276 HB3 ASN 56 HB3 ASN 56 37.742 6.852 -8.133 277 HD21 ASN 56 HD21 ASN 56 38.704 8.521 -5.296 278 HD22 ASN 56 HD22 ASN 56 40.382 8.034 -5.313 Start of MODEL 5 1 H1 PHE 17 HT1 PHE 17 35.741 12.795 -7.346 2 H2 PHE 17 HT2 PHE 17 37.068 12.423 -6.341 3 H3 PHE 17 HT3 PHE 17 36.015 13.686 -5.931 4 HA PHE 17 HA PHE 17 35.317 10.830 -6.049 5 HB2 PHE 17 HB2 PHE 17 36.885 11.366 -4.210 6 HB3 PHE 17 HB3 PHE 17 35.842 12.745 -3.696 7 HD1 PHE 17 HD1 PHE 17 35.409 12.106 -1.468 8 HD2 PHE 17 HD2 PHE 17 34.637 9.275 -4.610 9 HE1 PHE 17 HE1 PHE 17 34.133 10.677 0.117 10 HE2 PHE 17 HE2 PHE 17 33.312 7.912 -3.058 11 HZ PHE 17 HZ PHE 17 33.085 8.584 -0.677 12 H ASP 18 H ASP 18 33.220 10.505 -6.687 13 HA ASP 18 HA ASP 18 31.264 11.771 -4.917 14 HB2 ASP 18 HB2 ASP 18 30.855 10.984 -7.874 15 HB3 ASP 18 HB3 ASP 18 29.500 11.378 -6.734 16 H VAL 19 H VAL 19 29.747 10.307 -4.009 17 HA VAL 19 HA VAL 19 30.098 7.485 -4.662 18 HB VAL 19 HB VAL 19 31.325 7.768 -2.621 19 HG11 VAL 19 HG11 VAL 19 30.172 8.633 -0.532 20 HG12 VAL 19 HG12 VAL 19 28.796 9.203 -1.549 21 HG13 VAL 19 HG13 VAL 19 30.471 9.867 -1.804 22 HG21 VAL 19 HG21 VAL 19 29.873 5.706 -2.877 23 HG22 VAL 19 HG22 VAL 19 28.564 6.549 -1.969 24 HG23 VAL 19 HG23 VAL 19 30.130 6.200 -1.164 25 H VAL 20 H VAL 20 28.270 6.366 -4.930 26 HA VAL 20 HA VAL 20 25.717 7.681 -4.353 27 HB VAL 20 HB VAL 20 24.784 6.770 -6.482 28 HG11 VAL 20 HG11 VAL 20 27.178 8.709 -6.824 29 HG12 VAL 20 HG12 VAL 20 25.505 9.166 -6.341 30 HG13 VAL 20 HG13 VAL 20 25.816 8.488 -7.985 31 HG21 VAL 20 HG21 VAL 20 26.622 4.956 -6.749 32 HG22 VAL 20 HG22 VAL 20 27.755 6.254 -7.194 33 HG23 VAL 20 HG23 VAL 20 26.322 5.936 -8.241 34 H SER 21 H SER 21 23.890 6.096 -4.210 35 HA SER 21 HA SER 21 24.760 3.706 -2.894 36 HB2 SER 21 HB2 SER 21 22.322 3.315 -2.543 37 HB3 SER 21 HB3 SER 21 22.832 4.959 -2.029 38 HG SER 21 HG SER 21 21.659 4.340 -4.554 39 H CYS 22 H CYS 22 24.602 1.557 -3.590 40 HA CYS 22 HA CYS 22 24.223 1.157 -6.446 41 HB2 CYS 22 HB2 CYS 22 26.170 0.259 -5.057 42 HB3 CYS 22 HB3 CYS 22 25.001 -0.845 -4.273 43 H ASN 23 H ASN 23 22.210 1.329 -3.887 44 HA ASN 23 HA ASN 23 20.180 0.708 -3.316 45 HB2 ASN 23 HB2 ASN 23 19.803 1.509 -5.721 46 HB3 ASN 23 HB3 ASN 23 19.782 -0.225 -6.213 47 HD21 ASN 23 HD21 ASN 23 17.634 -0.745 -6.582 48 HD22 ASN 23 HD22 ASN 23 16.291 -0.281 -5.557 49 H LYS 24 H LYS 24 21.975 -1.193 -2.444 50 HA LYS 24 HA LYS 24 20.276 -3.563 -2.516 51 HB2 LYS 24 HB2 LYS 24 22.133 -3.894 -4.230 52 HB3 LYS 24 HB3 LYS 24 23.325 -3.636 -2.927 53 HG2 LYS 24 HG2 LYS 24 23.138 -6.022 -3.300 54 HG3 LYS 24 HG3 LYS 24 22.360 -5.710 -1.726 55 HD2 LYS 24 HD2 LYS 24 20.108 -5.771 -2.816 56 HD3 LYS 24 HD3 LYS 24 20.887 -5.881 -4.428 57 HE2 LYS 24 HE2 LYS 24 21.844 -8.128 -3.838 58 HE3 LYS 24 HE3 LYS 24 21.041 -8.034 -2.210 59 HZ1 LYS 24 HZ1 LYS 24 19.712 -9.261 -3.734 60 HZ2 LYS 24 HZ2 LYS 24 19.713 -7.998 -4.870 61 HZ3 LYS 24 HZ3 LYS 24 18.928 -7.795 -3.378 62 H ASN 25 H ASN 25 20.169 -4.600 -0.528 63 HA ASN 25 HA ASN 25 21.315 -3.223 1.742 64 HB2 ASN 25 HB2 ASN 25 18.886 -3.806 1.779 65 HB3 ASN 25 HB3 ASN 25 19.289 -5.532 1.497 66 HD21 ASN 25 HD21 ASN 25 20.982 -3.329 3.936 67 HD22 ASN 25 HD22 ASN 25 20.728 -4.522 5.166 68 H CYS 26 H CYS 26 22.978 -3.980 3.026 69 HA CYS 26 HA CYS 26 23.717 -6.790 2.758 70 HB2 CYS 26 HB2 CYS 26 26.119 -6.190 2.783 71 HB3 CYS 26 HB3 CYS 26 25.288 -5.572 1.328 72 H THR 27 H THR 27 24.857 -7.645 4.646 73 HA THR 27 HA THR 27 24.505 -6.074 7.085 74 HB THR 27 HB THR 27 23.897 -8.185 8.303 75 HG1 THR 27 HG1 THR 27 23.049 -9.830 7.117 76 HG21 THR 27 HG21 THR 27 22.295 -6.467 7.847 77 HG22 THR 27 HG22 THR 27 21.495 -8.075 7.660 78 HG23 THR 27 HG23 THR 27 21.931 -7.119 6.189 79 H SER 28 H SER 28 25.672 -6.903 8.938 80 HA SER 28 HA SER 28 28.371 -7.118 8.511 81 HB2 SER 28 HB2 SER 28 27.323 -6.299 10.606 82 HB3 SER 28 HB3 SER 28 26.640 -7.928 10.925 83 HG SER 28 HG SER 28 28.727 -7.167 11.945 84 H GLY 29 H GLY 29 29.870 -8.764 8.382 85 HA2 GLY 29 HA2 GLY 29 30.641 -10.869 8.088 86 HA3 GLY 29 HA3 GLY 29 29.031 -11.544 8.540 87 H GLN 30 H GLN 30 27.302 -10.692 6.840 88 HA GLN 30 HA GLN 30 27.762 -12.212 4.556 89 HB2 GLN 30 HB2 GLN 30 25.654 -10.215 5.423 90 HB3 GLN 30 HB3 GLN 30 25.472 -10.930 3.823 91 HG2 GLN 30 HG2 GLN 30 25.669 -12.533 6.491 92 HG3 GLN 30 HG3 GLN 30 24.135 -12.114 5.641 93 HE21 GLN 30 HE21 GLN 30 24.268 -12.708 3.130 94 HE22 GLN 30 HE22 GLN 30 25.023 -14.233 2.729 95 H ASN 31 H ASN 31 27.642 -8.584 4.673 96 HA ASN 31 HA ASN 31 28.131 -7.075 3.088 97 HB2 ASN 31 HB2 ASN 31 30.507 -9.003 2.872 98 HB3 ASN 31 HB3 ASN 31 30.492 -7.374 2.101 99 HD21 ASN 31 HD21 ASN 31 30.433 -9.019 5.313 100 HD22 ASN 31 HD22 ASN 31 31.072 -7.613 6.138 101 H GLU 32 H GLU 32 26.179 -8.825 1.881 102 HA GLU 32 HA GLU 32 27.160 -9.562 -0.707 103 HB2 GLU 32 HB2 GLU 32 24.373 -9.536 0.530 104 HB3 GLU 32 HB3 GLU 32 24.658 -10.084 -1.137 105 HG2 GLU 32 HG2 GLU 32 26.033 -11.375 1.337 106 HG3 GLU 32 HG3 GLU 32 24.500 -11.972 0.579 107 H CYS 33 H CYS 33 27.425 -8.305 -2.399 108 HA CYS 33 HA CYS 33 25.456 -6.244 -2.993 109 HB2 CYS 33 HB2 CYS 33 28.505 -5.829 -3.176 110 HB3 CYS 33 HB3 CYS 33 27.274 -4.679 -3.780 111 HA PRO 34 HA PRO 34 26.397 -8.158 -7.017 112 HB2 PRO 34 HB2 PRO 34 25.692 -6.157 -8.835 113 HB3 PRO 34 HB3 PRO 34 24.448 -7.055 -7.874 114 HG2 PRO 34 HG2 PRO 34 25.742 -4.367 -7.164 115 HG3 PRO 34 HG3 PRO 34 23.969 -4.729 -7.296 116 HD2 PRO 34 HD2 PRO 34 25.262 -4.810 -4.873 117 HD3 PRO 34 HD3 PRO 34 24.036 -6.096 -5.292 118 H GLU 35 H GLU 35 28.033 -7.904 -8.830 119 HA GLU 35 HA GLU 35 30.412 -6.990 -7.699 120 HB2 GLU 35 HB2 GLU 35 31.507 -7.664 -9.789 121 HB3 GLU 35 HB3 GLU 35 30.325 -8.889 -9.246 122 HG2 GLU 35 HG2 GLU 35 28.646 -8.027 -10.964 123 HG3 GLU 35 HG3 GLU 35 29.855 -6.813 -11.514 124 H GLY 36 H GLY 36 31.834 -5.306 -8.091 125 HA2 GLY 36 HA2 GLY 36 32.527 -3.301 -8.991 126 HA3 GLY 36 HA3 GLY 36 30.923 -3.067 -9.764 127 H CYS 37 H CYS 37 29.898 -3.991 -6.891 128 HA CYS 37 HA CYS 37 30.136 -1.336 -5.635 129 HB2 CYS 37 HB2 CYS 37 27.830 -3.351 -5.531 130 HB3 CYS 37 HB3 CYS 37 27.914 -1.823 -4.583 131 H PHE 38 H PHE 38 30.145 -1.269 -3.308 132 HA PHE 38 HA PHE 38 30.955 -3.754 -1.979 133 HB2 PHE 38 HB2 PHE 38 32.610 -2.441 -0.586 134 HB3 PHE 38 HB3 PHE 38 33.062 -2.474 -2.335 135 HD1 PHE 38 HD1 PHE 38 31.514 -0.345 0.358 136 HD2 PHE 38 HD2 PHE 38 33.029 -0.505 -3.661 137 HE1 PHE 38 HE1 PHE 38 31.017 2.055 0.069 138 HE2 PHE 38 HE2 PHE 38 32.664 1.918 -3.900 139 HZ PHE 38 HZ PHE 38 31.581 3.195 -2.051 140 H CYS 39 H CYS 39 30.676 -3.636 0.418 141 HA CYS 39 HA CYS 39 28.064 -2.519 0.964 142 HB2 CYS 39 HB2 CYS 39 28.606 -4.886 1.500 143 HB3 CYS 39 HB3 CYS 39 29.933 -4.341 2.562 144 H GLY 40 H GLY 40 27.717 -0.573 2.048 145 HA2 GLY 40 HA2 GLY 40 29.933 0.606 3.541 146 HA3 GLY 40 HA3 GLY 40 28.326 1.316 3.119 147 H LEU 41 H LEU 41 30.020 -0.995 5.223 148 HA LEU 41 HA LEU 41 27.687 -1.068 7.006 149 HB2 LEU 41 HB2 LEU 41 29.185 -3.166 6.073 150 HB3 LEU 41 HB3 LEU 41 30.129 -2.786 7.527 151 HG LEU 41 HG LEU 41 28.628 -4.467 8.191 152 HD11 LEU 41 HD11 LEU 41 27.023 -3.655 9.779 153 HD12 LEU 41 HD12 LEU 41 26.855 -2.072 8.952 154 HD13 LEU 41 HD13 LEU 41 28.396 -2.486 9.816 155 HD21 LEU 41 HD21 LEU 41 26.113 -4.365 7.701 156 HD22 LEU 41 HD22 LEU 41 27.210 -4.738 6.309 157 HD23 LEU 41 HD23 LEU 41 26.498 -3.091 6.484 158 H LEU 42 H LEU 42 27.837 -0.258 9.135 159 HA LEU 42 HA LEU 42 29.849 1.693 9.612 160 HB2 LEU 42 HB2 LEU 42 27.653 0.604 11.494 161 HB3 LEU 42 HB3 LEU 42 28.587 2.114 11.704 162 HG LEU 42 HG LEU 42 26.493 2.805 11.056 163 HD11 LEU 42 HD11 LEU 42 27.961 2.776 8.354 164 HD12 LEU 42 HD12 LEU 42 28.281 3.943 9.700 165 HD13 LEU 42 HD13 LEU 42 26.674 3.916 8.880 166 HD21 LEU 42 HD21 LEU 42 26.298 0.842 8.693 167 HD22 LEU 42 HD22 LEU 42 25.019 1.881 9.401 168 HD23 LEU 42 HD23 LEU 42 25.693 0.501 10.353 169 H GLY 43 H GLY 43 31.601 -0.132 9.539 170 HA2 GLY 43 HA2 GLY 43 33.278 -1.173 10.672 171 HA3 GLY 43 HA3 GLY 43 32.547 -0.571 12.206 172 H GLN 44 H GLN 44 30.699 -2.464 10.039 173 HA GLN 44 HA GLN 44 29.529 -4.323 10.239 174 HB2 GLN 44 HB2 GLN 44 32.140 -5.449 11.295 175 HB3 GLN 44 HB3 GLN 44 30.715 -6.442 10.858 176 HG2 GLN 44 HG2 GLN 44 30.737 -5.374 8.522 177 HG3 GLN 44 HG3 GLN 44 32.330 -4.638 8.932 178 HE21 GLN 44 HE21 GLN 44 34.080 -6.251 9.609 179 HE22 GLN 44 HE22 GLN 44 34.065 -7.814 8.830 180 H ASN 45 H ASN 45 29.155 -2.498 12.504 181 HA ASN 45 HA ASN 45 28.509 -4.126 14.745 182 HB2 ASN 45 HB2 ASN 45 27.530 -1.383 13.763 183 HB3 ASN 45 HB3 ASN 45 26.904 -2.143 15.278 184 HD21 ASN 45 HD21 ASN 45 29.687 -0.406 13.912 185 HD22 ASN 45 HD22 ASN 45 30.551 -0.365 15.423 186 H LYS 46 H LYS 46 26.500 -3.167 11.894 187 HA LYS 46 HA LYS 46 24.667 -5.313 12.573 188 HB2 LYS 46 HB2 LYS 46 22.671 -3.801 12.662 189 HB3 LYS 46 HB3 LYS 46 23.806 -3.650 14.023 190 HG2 LYS 46 HG2 LYS 46 24.686 -1.545 13.227 191 HG3 LYS 46 HG3 LYS 46 23.730 -1.577 11.713 192 HD2 LYS 46 HD2 LYS 46 21.638 -1.366 12.933 193 HD3 LYS 46 HD3 LYS 46 22.435 -1.735 14.496 194 HE2 LYS 46 HE2 LYS 46 21.877 0.664 14.362 195 HE3 LYS 46 HE3 LYS 46 23.670 0.435 14.431 196 HZ1 LYS 46 HZ1 LYS 46 23.715 0.684 12.032 197 HZ2 LYS 46 HZ2 LYS 46 23.034 2.042 12.792 198 HZ3 LYS 46 HZ3 LYS 46 22.033 0.927 11.992 199 H LYS 47 H LYS 47 23.315 -2.794 10.603 200 HA LYS 47 HA LYS 47 23.758 -4.443 8.209 201 HB2 LYS 47 HB2 LYS 47 21.496 -3.844 7.469 202 HB3 LYS 47 HB3 LYS 47 21.431 -4.663 9.058 203 HG2 LYS 47 HG2 LYS 47 21.137 -2.459 10.207 204 HG3 LYS 47 HG3 LYS 47 21.210 -1.615 8.623 205 HD2 LYS 47 HD2 LYS 47 19.221 -2.914 7.841 206 HD3 LYS 47 HD3 LYS 47 19.103 -3.717 9.438 207 HE2 LYS 47 HE2 LYS 47 18.886 -0.654 8.983 208 HE3 LYS 47 HE3 LYS 47 17.477 -1.787 9.118 209 HZ1 LYS 47 HZ1 LYS 47 18.235 -2.399 11.302 210 HZ2 LYS 47 HZ2 LYS 47 17.974 -0.724 11.189 211 HZ3 LYS 47 HZ3 LYS 47 19.558 -1.338 11.184 212 H GLY 48 H GLY 48 23.708 -3.261 6.134 213 HA2 GLY 48 HA2 GLY 48 23.874 -0.375 6.278 214 HA3 GLY 48 HA3 GLY 48 25.371 -1.265 5.799 215 H HIS 49 H HIS 49 25.061 0.054 3.755 216 HA HIS 49 HA HIS 49 23.148 -1.321 1.977 217 HB2 HIS 49 HB2 HIS 49 22.247 0.927 3.005 218 HB3 HIS 49 HB3 HIS 49 23.524 1.727 2.038 219 HD2 HIS 49 HD2 HIS 49 22.417 2.561 -0.414 220 HE1 HIS 49 HE1 HIS 49 19.223 -0.222 -0.430 221 HE2 HIS 49 HE2 HIS 49 20.223 1.803 -1.573 222 H CYS 50 H CYS 50 23.930 -1.464 -0.200 223 HA CYS 50 HA CYS 50 26.784 -1.250 -0.351 224 HB2 CYS 50 HB2 CYS 50 24.736 -2.005 -2.493 225 HB3 CYS 50 HB3 CYS 50 26.520 -2.178 -2.666 226 H TYR 51 H TYR 51 28.089 0.129 -1.636 227 HA TYR 51 HA TYR 51 26.686 2.386 -2.959 228 HB2 TYR 51 HB2 TYR 51 29.391 2.665 -1.529 229 HB3 TYR 51 HB3 TYR 51 28.458 3.948 -2.353 230 HD1 TYR 51 HD1 TYR 51 29.689 4.096 0.275 231 HD2 TYR 51 HD2 TYR 51 25.672 3.060 -0.858 232 HE1 TYR 51 HE1 TYR 51 28.878 4.844 2.485 233 HE2 TYR 51 HE2 TYR 51 24.866 3.797 1.358 234 HH TYR 51 HH TYR 51 27.093 4.919 3.902 235 H LYS 52 H LYS 52 27.999 3.458 -4.615 236 HA LYS 52 HA LYS 52 30.263 1.883 -5.647 237 HB2 LYS 52 HB2 LYS 52 28.272 1.582 -7.134 238 HB3 LYS 52 HB3 LYS 52 28.127 3.358 -7.281 239 HG2 LYS 52 HG2 LYS 52 30.380 3.435 -8.432 240 HG3 LYS 52 HG3 LYS 52 30.528 1.659 -8.211 241 HD2 LYS 52 HD2 LYS 52 29.847 2.074 -10.481 242 HD3 LYS 52 HD3 LYS 52 28.458 1.336 -9.615 243 HE2 LYS 52 HE2 LYS 52 27.368 3.605 -9.432 244 HE3 LYS 52 HE3 LYS 52 28.799 4.350 -10.262 245 HZ1 LYS 52 HZ1 LYS 52 28.352 2.943 -12.157 246 HZ2 LYS 52 HZ2 LYS 52 27.008 3.909 -11.773 247 HZ3 LYS 52 HZ3 LYS 52 27.007 2.258 -11.376 248 H ILE 53 H ILE 53 32.127 3.135 -6.112 249 HA ILE 53 HA ILE 53 31.928 6.021 -5.545 250 HB ILE 53 HB ILE 53 34.345 4.203 -5.293 251 HG12 ILE 53 HG12 ILE 53 32.817 5.818 -3.159 252 HG13 ILE 53 HG13 ILE 53 32.601 4.079 -3.492 253 HG21 ILE 53 HG21 ILE 53 34.026 7.249 -4.913 254 HG22 ILE 53 HG22 ILE 53 35.028 6.468 -6.163 255 HG23 ILE 53 HG23 ILE 53 35.511 6.319 -4.445 256 HD11 ILE 53 HD11 ILE 53 35.053 3.679 -2.937 257 HD12 ILE 53 HD12 ILE 53 34.114 4.347 -1.553 258 HD13 ILE 53 HD13 ILE 53 35.211 5.419 -2.489 259 H ILE 54 H ILE 54 32.404 7.417 -7.087 260 HA ILE 54 HA ILE 54 33.703 6.524 -9.529 261 HB ILE 54 HB ILE 54 32.095 7.959 -10.789 262 HG12 ILE 54 HG12 ILE 54 31.244 9.069 -8.567 263 HG13 ILE 54 HG13 ILE 54 30.127 8.799 -9.949 264 HG21 ILE 54 HG21 ILE 54 32.051 5.497 -10.916 265 HG22 ILE 54 HG22 ILE 54 30.377 6.165 -10.983 266 HG23 ILE 54 HG23 ILE 54 30.990 5.404 -9.468 267 HD11 ILE 54 HD11 ILE 54 29.042 8.278 -7.787 268 HD12 ILE 54 HD12 ILE 54 30.248 7.018 -7.389 269 HD13 ILE 54 HD13 ILE 54 29.158 6.805 -8.805 270 H GLY 55 H GLY 55 34.869 8.149 -10.678 271 HA2 GLY 55 HA2 GLY 55 35.222 10.632 -10.697 272 HA3 GLY 55 HA3 GLY 55 35.661 10.388 -8.957 273 H ASN 56 H ASN 56 37.826 11.116 -9.448 274 HA ASN 56 HA ASN 56 39.959 10.801 -9.840 275 HB2 ASN 56 HB2 ASN 56 39.356 8.987 -8.159 276 HB3 ASN 56 HB3 ASN 56 39.314 7.811 -9.526 277 HD21 ASN 56 HD21 ASN 56 41.057 6.655 -8.390 278 HD22 ASN 56 HD22 ASN 56 42.704 7.239 -8.494 Start of MODEL 6 1 H1 PHE 17 HT1 PHE 17 36.356 12.857 -7.093 2 H2 PHE 17 HT2 PHE 17 35.233 14.064 -6.693 3 H3 PHE 17 HT3 PHE 17 35.046 13.183 -8.130 4 HA PHE 17 HA PHE 17 34.675 11.182 -6.900 5 HB2 PHE 17 HB2 PHE 17 36.247 11.715 -5.093 6 HB3 PHE 17 HB3 PHE 17 35.154 13.014 -4.485 7 HD1 PHE 17 HD1 PHE 17 35.021 12.213 -2.281 8 HD2 PHE 17 HD2 PHE 17 33.935 9.556 -5.491 9 HE1 PHE 17 HE1 PHE 17 33.944 10.682 -0.663 10 HE2 PHE 17 HE2 PHE 17 32.771 8.112 -3.901 11 HZ PHE 17 HZ PHE 17 32.807 8.628 -1.467 12 H ASP 18 H ASP 18 32.614 10.677 -7.345 13 HA ASP 18 HA ASP 18 30.557 12.051 -5.769 14 HB2 ASP 18 HB2 ASP 18 30.229 10.884 -8.614 15 HB3 ASP 18 HB3 ASP 18 28.854 11.401 -7.553 16 H VAL 19 H VAL 19 29.031 10.583 -4.774 17 HA VAL 19 HA VAL 19 29.684 7.739 -5.071 18 HB VAL 19 HB VAL 19 30.649 8.534 -2.958 19 HG11 VAL 19 HG11 VAL 19 29.137 10.470 -2.484 20 HG12 VAL 19 HG12 VAL 19 29.213 9.324 -1.098 21 HG13 VAL 19 HG13 VAL 19 27.769 9.332 -2.169 22 HG21 VAL 19 HG21 VAL 19 28.162 6.742 -2.566 23 HG22 VAL 19 HG22 VAL 19 29.609 6.823 -1.502 24 HG23 VAL 19 HG23 VAL 19 29.768 6.198 -3.186 25 H VAL 20 H VAL 20 27.910 6.455 -5.403 26 HA VAL 20 HA VAL 20 25.261 7.661 -5.038 27 HB VAL 20 HB VAL 20 24.451 6.630 -7.155 28 HG11 VAL 20 HG11 VAL 20 26.761 8.660 -7.523 29 HG12 VAL 20 HG12 VAL 20 25.072 9.074 -7.051 30 HG13 VAL 20 HG13 VAL 20 25.409 8.355 -8.674 31 HG21 VAL 20 HG21 VAL 20 26.302 4.903 -7.385 32 HG22 VAL 20 HG22 VAL 20 27.468 6.223 -7.726 33 HG23 VAL 20 HG23 VAL 20 26.110 5.911 -8.870 34 H SER 21 H SER 21 23.519 6.077 -4.794 35 HA SER 21 HA SER 21 24.396 3.735 -3.397 36 HB2 SER 21 HB2 SER 21 21.971 3.425 -2.915 37 HB3 SER 21 HB3 SER 21 22.553 5.073 -2.494 38 HG SER 21 HG SER 21 21.193 4.362 -4.900 39 H CYS 22 H CYS 22 23.971 1.557 -3.881 40 HA CYS 22 HA CYS 22 23.613 0.995 -6.731 41 HB2 CYS 22 HB2 CYS 22 25.645 0.370 -5.297 42 HB3 CYS 22 HB3 CYS 22 24.584 -0.799 -4.460 43 H ASN 23 H ASN 23 21.643 1.108 -4.075 44 HA ASN 23 HA ASN 23 19.699 0.304 -3.441 45 HB2 ASN 23 HB2 ASN 23 19.187 1.111 -5.820 46 HB3 ASN 23 HB3 ASN 23 19.300 -0.605 -6.353 47 HD21 ASN 23 HD21 ASN 23 17.169 -1.237 -6.736 48 HD22 ASN 23 HD22 ASN 23 15.830 -0.934 -5.652 49 H LYS 24 H LYS 24 21.699 -1.421 -2.733 50 HA LYS 24 HA LYS 24 20.216 -3.874 -2.419 51 HB2 LYS 24 HB2 LYS 24 21.910 -4.292 -4.334 52 HB3 LYS 24 HB3 LYS 24 23.202 -3.769 -3.225 53 HG2 LYS 24 HG2 LYS 24 23.314 -6.155 -3.132 54 HG3 LYS 24 HG3 LYS 24 22.424 -5.725 -1.657 55 HD2 LYS 24 HD2 LYS 24 21.157 -7.506 -2.526 56 HD3 LYS 24 HD3 LYS 24 20.253 -6.072 -3.146 57 HE2 LYS 24 HE2 LYS 24 21.402 -6.321 -5.376 58 HE3 LYS 24 HE3 LYS 24 22.289 -7.771 -4.741 59 HZ1 LYS 24 HZ1 LYS 24 20.160 -8.811 -4.329 60 HZ2 LYS 24 HZ2 LYS 24 20.329 -8.373 -5.962 61 HZ3 LYS 24 HZ3 LYS 24 19.342 -7.450 -4.935 62 H ASN 25 H ASN 25 20.746 -4.632 -0.108 63 HA ASN 25 HA ASN 25 22.778 -2.893 1.159 64 HB2 ASN 25 HB2 ASN 25 21.580 -2.810 3.248 65 HB3 ASN 25 HB3 ASN 25 20.443 -2.299 1.965 66 HD21 ASN 25 HD21 ASN 25 21.169 -4.665 4.402 67 HD22 ASN 25 HD22 ASN 25 19.682 -5.574 4.298 68 H CYS 26 H CYS 26 23.729 -3.876 3.126 69 HA CYS 26 HA CYS 26 23.986 -6.803 2.887 70 HB2 CYS 26 HB2 CYS 26 26.050 -4.919 4.201 71 HB3 CYS 26 HB3 CYS 26 26.174 -6.688 3.879 72 H THR 27 H THR 27 24.316 -7.885 4.994 73 HA THR 27 HA THR 27 23.393 -6.340 7.344 74 HB THR 27 HB THR 27 23.422 -9.389 7.094 75 HG1 THR 27 HG1 THR 27 21.185 -9.193 6.907 76 HG21 THR 27 HG21 THR 27 23.457 -8.519 9.463 77 HG22 THR 27 HG22 THR 27 21.856 -9.222 9.080 78 HG23 THR 27 HG23 THR 27 22.059 -7.434 9.069 79 H SER 28 H SER 28 24.862 -6.849 9.277 80 HA SER 28 HA SER 28 27.536 -6.857 8.666 81 HB2 SER 28 HB2 SER 28 26.637 -6.020 10.803 82 HB3 SER 28 HB3 SER 28 26.110 -7.666 11.269 83 HG SER 28 HG SER 28 28.015 -7.289 12.245 84 H GLY 29 H GLY 29 29.247 -8.319 8.883 85 HA2 GLY 29 HA2 GLY 29 30.289 -10.324 8.726 86 HA3 GLY 29 HA3 GLY 29 28.720 -11.174 8.973 87 H GLN 30 H GLN 30 27.169 -10.417 7.051 88 HA GLN 30 HA GLN 30 27.959 -12.154 5.044 89 HB2 GLN 30 HB2 GLN 30 25.672 -10.113 5.163 90 HB3 GLN 30 HB3 GLN 30 25.792 -11.359 3.884 91 HG2 GLN 30 HG2 GLN 30 25.532 -11.950 6.918 92 HG3 GLN 30 HG3 GLN 30 24.187 -11.988 5.728 93 HE21 GLN 30 HE21 GLN 30 24.930 -13.385 3.620 94 HE22 GLN 30 HE22 GLN 30 25.514 -14.978 4.057 95 H ASN 31 H ASN 31 27.741 -8.568 4.781 96 HA ASN 31 HA ASN 31 28.375 -7.152 3.168 97 HB2 ASN 31 HB2 ASN 31 30.790 -9.027 3.300 98 HB3 ASN 31 HB3 ASN 31 30.815 -7.430 2.454 99 HD21 ASN 31 HD21 ASN 31 30.837 -8.963 5.654 100 HD22 ASN 31 HD22 ASN 31 31.083 -7.449 6.501 101 H GLU 32 H GLU 32 26.518 -8.684 1.906 102 HA GLU 32 HA GLU 32 27.591 -9.565 -0.642 103 HB2 GLU 32 HB2 GLU 32 25.910 -10.895 0.656 104 HB3 GLU 32 HB3 GLU 32 24.782 -9.517 0.576 105 HG2 GLU 32 HG2 GLU 32 24.058 -11.176 -1.015 106 HG3 GLU 32 HG3 GLU 32 24.665 -9.773 -1.965 107 H CYS 33 H CYS 33 27.903 -8.063 -2.279 108 HA CYS 33 HA CYS 33 25.673 -6.286 -2.869 109 HB2 CYS 33 HB2 CYS 33 28.646 -5.514 -3.036 110 HB3 CYS 33 HB3 CYS 33 27.333 -4.569 -3.800 111 HA PRO 34 HA PRO 34 26.650 -8.061 -6.913 112 HB2 PRO 34 HB2 PRO 34 25.666 -6.131 -8.679 113 HB3 PRO 34 HB3 PRO 34 24.552 -7.117 -7.639 114 HG2 PRO 34 HG2 PRO 34 25.657 -4.343 -6.987 115 HG3 PRO 34 HG3 PRO 34 23.916 -4.853 -7.044 116 HD2 PRO 34 HD2 PRO 34 25.296 -4.850 -4.682 117 HD3 PRO 34 HD3 PRO 34 24.192 -6.249 -5.082 118 H GLU 35 H GLU 35 28.158 -7.592 -8.827 119 HA GLU 35 HA GLU 35 30.532 -6.645 -7.710 120 HB2 GLU 35 HB2 GLU 35 29.808 -7.298 -10.614 121 HB3 GLU 35 HB3 GLU 35 31.479 -6.966 -10.079 122 HG2 GLU 35 HG2 GLU 35 29.749 -9.325 -9.032 123 HG3 GLU 35 HG3 GLU 35 31.018 -9.424 -10.308 124 H GLY 36 H GLY 36 31.761 -4.828 -7.867 125 HA2 GLY 36 HA2 GLY 36 32.406 -2.776 -8.695 126 HA3 GLY 36 HA3 GLY 36 30.833 -2.599 -9.542 127 H CYS 37 H CYS 37 29.742 -3.629 -6.705 128 HA CYS 37 HA CYS 37 29.709 -0.940 -5.497 129 HB2 CYS 37 HB2 CYS 37 27.572 -3.139 -5.463 130 HB3 CYS 37 HB3 CYS 37 27.473 -1.564 -4.589 131 H PHE 38 H PHE 38 29.653 -0.806 -3.143 132 HA PHE 38 HA PHE 38 30.449 -3.252 -1.725 133 HB2 PHE 38 HB2 PHE 38 32.317 -2.099 -0.561 134 HB3 PHE 38 HB3 PHE 38 32.609 -2.027 -2.345 135 HD1 PHE 38 HD1 PHE 38 32.078 -0.093 0.720 136 HD2 PHE 38 HD2 PHE 38 31.977 0.095 -3.576 137 HE1 PHE 38 HE1 PHE 38 31.965 2.372 0.830 138 HE2 PHE 38 HE2 PHE 38 31.755 2.529 -3.470 139 HZ PHE 38 HZ PHE 38 31.759 3.695 -1.254 140 H CYS 39 H CYS 39 30.061 -3.179 0.605 141 HA CYS 39 HA CYS 39 28.174 -1.099 1.463 142 HB2 CYS 39 HB2 CYS 39 28.909 -3.806 2.603 143 HB3 CYS 39 HB3 CYS 39 28.046 -2.587 3.594 144 H GLY 40 H GLY 40 28.685 0.436 2.895 145 HA2 GLY 40 HA2 GLY 40 31.351 0.439 4.160 146 HA3 GLY 40 HA3 GLY 40 30.125 1.766 4.132 147 H LEU 41 H LEU 41 31.101 -1.278 5.626 148 HA LEU 41 HA LEU 41 28.723 -1.237 7.361 149 HB2 LEU 41 HB2 LEU 41 29.310 -3.208 5.798 150 HB3 LEU 41 HB3 LEU 41 30.748 -3.489 6.808 151 HG LEU 41 HG LEU 41 28.928 -5.035 7.293 152 HD11 LEU 41 HD11 LEU 41 30.432 -4.379 9.186 153 HD12 LEU 41 HD12 LEU 41 28.796 -4.946 9.707 154 HD13 LEU 41 HD13 LEU 41 29.177 -3.189 9.729 155 HD21 LEU 41 HD21 LEU 41 27.196 -2.605 8.063 156 HD22 LEU 41 HD22 LEU 41 26.765 -4.338 8.316 157 HD23 LEU 41 HD23 LEU 41 26.984 -3.694 6.647 158 H LEU 42 H LEU 42 28.954 -0.702 9.495 159 HA LEU 42 HA LEU 42 31.457 0.556 9.986 160 HB2 LEU 42 HB2 LEU 42 28.961 0.547 11.806 161 HB3 LEU 42 HB3 LEU 42 30.317 1.699 11.781 162 HG LEU 42 HG LEU 42 28.588 2.860 10.814 163 HD11 LEU 42 HD11 LEU 42 30.130 1.720 8.385 164 HD12 LEU 42 HD12 LEU 42 30.502 3.213 9.337 165 HD13 LEU 42 HD13 LEU 42 29.001 3.084 8.320 166 HD21 LEU 42 HD21 LEU 42 27.134 0.715 10.560 167 HD22 LEU 42 HD22 LEU 42 27.721 0.690 8.847 168 HD23 LEU 42 HD23 LEU 42 26.808 2.103 9.485 169 H GLY 43 H GLY 43 32.752 -1.474 10.360 170 HA2 GLY 43 HA2 GLY 43 34.013 -2.625 11.858 171 HA3 GLY 43 HA3 GLY 43 33.227 -1.655 13.149 172 H GLN 44 H GLN 44 31.855 -4.024 10.918 173 HA GLN 44 HA GLN 44 30.375 -5.630 11.158 174 HB2 GLN 44 HB2 GLN 44 31.037 -7.648 12.339 175 HB3 GLN 44 HB3 GLN 44 32.334 -6.953 11.337 176 HG2 GLN 44 HG2 GLN 44 33.496 -6.061 13.368 177 HG3 GLN 44 HG3 GLN 44 32.170 -6.668 14.421 178 HE21 GLN 44 HE21 GLN 44 31.734 -9.116 14.213 179 HE22 GLN 44 HE22 GLN 44 33.148 -10.139 14.060 180 H ASN 45 H ASN 45 29.346 -3.486 12.556 181 HA ASN 45 HA ASN 45 28.035 -4.683 14.881 182 HB2 ASN 45 HB2 ASN 45 28.043 -1.867 13.659 183 HB3 ASN 45 HB3 ASN 45 26.928 -2.344 15.006 184 HD21 ASN 45 HD21 ASN 45 30.247 -1.378 14.288 185 HD22 ASN 45 HD22 ASN 45 30.804 -1.545 15.929 186 H LYS 46 H LYS 46 26.547 -2.851 12.062 187 HA LYS 46 HA LYS 46 24.119 -4.387 12.761 188 HB2 LYS 46 HB2 LYS 46 24.375 -1.510 11.692 189 HB3 LYS 46 HB3 LYS 46 22.846 -2.388 12.054 190 HG2 LYS 46 HG2 LYS 46 23.634 -2.606 14.467 191 HG3 LYS 46 HG3 LYS 46 25.016 -1.527 14.024 192 HD2 LYS 46 HD2 LYS 46 23.489 0.309 13.438 193 HD3 LYS 46 HD3 LYS 46 22.072 -0.772 13.626 194 HE2 LYS 46 HE2 LYS 46 22.189 0.637 15.611 195 HE3 LYS 46 HE3 LYS 46 22.631 -1.063 16.081 196 HZ1 LYS 46 HZ1 LYS 46 24.934 -0.437 15.954 197 HZ2 LYS 46 HZ2 LYS 46 24.096 0.569 17.034 198 HZ3 LYS 46 HZ3 LYS 46 24.528 1.151 15.497 199 H LYS 47 H LYS 47 24.286 -2.199 9.994 200 HA LYS 47 HA LYS 47 24.217 -4.263 8.033 201 HB2 LYS 47 HB2 LYS 47 21.919 -3.740 7.281 202 HB3 LYS 47 HB3 LYS 47 21.873 -4.321 8.977 203 HG2 LYS 47 HG2 LYS 47 21.835 -1.837 9.704 204 HG3 LYS 47 HG3 LYS 47 21.587 -1.425 7.978 205 HD2 LYS 47 HD2 LYS 47 19.716 -3.074 9.797 206 HD3 LYS 47 HD3 LYS 47 19.493 -1.404 9.211 207 HE2 LYS 47 HE2 LYS 47 18.031 -2.624 7.855 208 HE3 LYS 47 HE3 LYS 47 19.474 -2.435 6.774 209 HZ1 LYS 47 HZ1 LYS 47 18.439 -4.688 6.935 210 HZ2 LYS 47 HZ2 LYS 47 19.011 -4.780 8.537 211 HZ3 LYS 47 HZ3 LYS 47 20.108 -4.633 7.255 212 H GLY 48 H GLY 48 24.093 -3.078 5.829 213 HA2 GLY 48 HA2 GLY 48 24.626 -0.229 5.978 214 HA3 GLY 48 HA3 GLY 48 26.007 -1.298 5.493 215 H HIS 49 H HIS 49 24.746 0.739 3.777 216 HA HIS 49 HA HIS 49 23.117 -0.888 1.952 217 HB2 HIS 49 HB2 HIS 49 22.235 1.308 2.871 218 HB3 HIS 49 HB3 HIS 49 23.584 2.140 2.042 219 HD2 HIS 49 HD2 HIS 49 22.512 3.297 -0.232 220 HE1 HIS 49 HE1 HIS 49 19.527 0.375 -0.939 221 HE2 HIS 49 HE2 HIS 49 20.462 2.634 -1.651 222 H CYS 50 H CYS 50 23.792 -1.155 -0.327 223 HA CYS 50 HA CYS 50 26.635 -1.022 -0.602 224 HB2 CYS 50 HB2 CYS 50 24.468 -1.819 -2.602 225 HB3 CYS 50 HB3 CYS 50 26.232 -1.959 -2.915 226 H TYR 51 H TYR 51 27.871 0.469 -1.703 227 HA TYR 51 HA TYR 51 26.461 2.663 -3.121 228 HB2 TYR 51 HB2 TYR 51 29.227 2.985 -1.788 229 HB3 TYR 51 HB3 TYR 51 28.093 4.244 -2.384 230 HD1 TYR 51 HD1 TYR 51 25.751 4.440 -1.122 231 HD2 TYR 51 HD2 TYR 51 29.226 2.437 0.410 232 HE1 TYR 51 HE1 TYR 51 24.830 4.579 1.191 233 HE2 TYR 51 HE2 TYR 51 28.344 2.603 2.693 234 HH TYR 51 HH TYR 51 26.590 3.182 3.989 235 H LYS 52 H LYS 52 27.727 3.644 -4.868 236 HA LYS 52 HA LYS 52 30.032 2.056 -5.824 237 HB2 LYS 52 HB2 LYS 52 28.033 1.896 -7.340 238 HB3 LYS 52 HB3 LYS 52 28.017 3.681 -7.471 239 HG2 LYS 52 HG2 LYS 52 30.374 3.560 -8.485 240 HG3 LYS 52 HG3 LYS 52 30.222 1.773 -8.459 241 HD2 LYS 52 HD2 LYS 52 28.445 3.760 -10.002 242 HD3 LYS 52 HD3 LYS 52 29.719 2.699 -10.689 243 HE2 LYS 52 HE2 LYS 52 28.352 0.666 -10.015 244 HE3 LYS 52 HE3 LYS 52 27.046 1.782 -9.423 245 HZ1 LYS 52 HZ1 LYS 52 26.954 2.730 -11.636 246 HZ2 LYS 52 HZ2 LYS 52 26.621 1.065 -11.633 247 HZ3 LYS 52 HZ3 LYS 52 28.127 1.627 -12.183 248 H ILE 53 H ILE 53 31.937 3.226 -6.094 249 HA ILE 53 HA ILE 53 31.888 6.133 -5.656 250 HB ILE 53 HB ILE 53 34.090 4.080 -5.338 251 HG12 ILE 53 HG12 ILE 53 33.029 6.094 -3.289 252 HG13 ILE 53 HG13 ILE 53 32.319 4.478 -3.473 253 HG21 ILE 53 HG21 ILE 53 35.172 6.010 -6.404 254 HG22 ILE 53 HG22 ILE 53 35.577 6.047 -4.662 255 HG23 ILE 53 HG23 ILE 53 34.316 7.162 -5.310 256 HD11 ILE 53 HD11 ILE 53 34.548 3.426 -2.925 257 HD12 ILE 53 HD12 ILE 53 34.007 4.539 -1.622 258 HD13 ILE 53 HD13 ILE 53 35.291 5.066 -2.766 259 H ILE 54 H ILE 54 32.216 7.446 -7.342 260 HA ILE 54 HA ILE 54 33.664 6.459 -9.662 261 HB ILE 54 HB ILE 54 32.128 7.690 -11.153 262 HG12 ILE 54 HG12 ILE 54 31.067 9.058 -9.226 263 HG13 ILE 54 HG13 ILE 54 30.050 8.516 -10.600 264 HG21 ILE 54 HG21 ILE 54 32.132 5.227 -10.997 265 HG22 ILE 54 HG22 ILE 54 30.464 5.849 -11.296 266 HG23 ILE 54 HG23 ILE 54 30.942 5.282 -9.651 267 HD11 ILE 54 HD11 ILE 54 30.093 7.113 -7.823 268 HD12 ILE 54 HD12 ILE 54 29.066 6.696 -9.238 269 HD13 ILE 54 HD13 ILE 54 28.864 8.278 -8.413 270 H GLY 55 H GLY 55 34.386 8.244 -11.120 271 HA2 GLY 55 HA2 GLY 55 35.187 10.368 -11.450 272 HA3 GLY 55 HA3 GLY 55 34.918 10.770 -9.719 273 H ASN 56 H ASN 56 36.268 9.071 -8.266 274 HA ASN 56 HA ASN 56 38.996 9.678 -8.755 275 HB2 ASN 56 HB2 ASN 56 37.660 7.713 -6.792 276 HB3 ASN 56 HB3 ASN 56 39.436 8.048 -6.802 277 HD21 ASN 56 HD21 ASN 56 37.769 8.550 -4.540 278 HD22 ASN 56 HD22 ASN 56 37.825 10.272 -4.260 Start of MODEL 7 1 H1 PHE 17 HT1 PHE 17 35.814 12.852 -6.714 2 H2 PHE 17 HT2 PHE 17 35.499 11.915 -8.084 3 H3 PHE 17 HT3 PHE 17 36.806 11.519 -7.078 4 HA PHE 17 HA PHE 17 34.845 10.084 -6.802 5 HB2 PHE 17 HB2 PHE 17 36.636 10.271 -5.110 6 HB3 PHE 17 HB3 PHE 17 35.838 11.727 -4.414 7 HD1 PHE 17 HD1 PHE 17 33.881 8.603 -5.383 8 HD2 PHE 17 HD2 PHE 17 35.756 10.860 -2.225 9 HE1 PHE 17 HE1 PHE 17 32.686 7.273 -3.722 10 HE2 PHE 17 HE2 PHE 17 34.575 9.473 -0.552 11 HZ PHE 17 HZ PHE 17 33.031 7.678 -1.295 12 H ASP 18 H ASP 18 32.730 10.117 -7.241 13 HA ASP 18 HA ASP 18 31.032 11.696 -5.440 14 HB2 ASP 18 HB2 ASP 18 30.361 10.784 -8.322 15 HB3 ASP 18 HB3 ASP 18 29.165 11.490 -7.158 16 H VAL 19 H VAL 19 29.193 10.401 -4.582 17 HA VAL 19 HA VAL 19 29.582 7.508 -4.946 18 HB VAL 19 HB VAL 19 30.610 8.202 -2.834 19 HG11 VAL 19 HG11 VAL 19 29.264 10.245 -2.327 20 HG12 VAL 19 HG12 VAL 19 29.248 9.079 -0.958 21 HG13 VAL 19 HG13 VAL 19 27.808 9.219 -2.025 22 HG21 VAL 19 HG21 VAL 19 27.993 6.612 -2.452 23 HG22 VAL 19 HG22 VAL 19 29.455 6.551 -1.406 24 HG23 VAL 19 HG23 VAL 19 29.542 5.950 -3.105 25 H VAL 20 H VAL 20 27.730 6.386 -5.362 26 HA VAL 20 HA VAL 20 25.163 7.720 -4.921 27 HB VAL 20 HB VAL 20 24.262 6.840 -7.056 28 HG11 VAL 20 HG11 VAL 20 25.317 8.527 -8.551 29 HG12 VAL 20 HG12 VAL 20 26.700 8.713 -7.411 30 HG13 VAL 20 HG13 VAL 20 25.045 9.217 -6.903 31 HG21 VAL 20 HG21 VAL 20 25.925 4.976 -7.401 32 HG22 VAL 20 HG22 VAL 20 27.226 6.185 -7.683 33 HG23 VAL 20 HG23 VAL 20 25.844 6.066 -8.834 34 H SER 21 H SER 21 23.328 6.079 -4.809 35 HA SER 21 HA SER 21 24.285 3.808 -3.334 36 HB2 SER 21 HB2 SER 21 21.880 3.482 -2.782 37 HB3 SER 21 HB3 SER 21 22.474 5.144 -2.433 38 HG SER 21 HG SER 21 20.735 5.593 -3.543 39 H CYS 22 H CYS 22 23.694 1.576 -3.687 40 HA CYS 22 HA CYS 22 23.379 0.938 -6.555 41 HB2 CYS 22 HB2 CYS 22 25.656 0.763 -5.466 42 HB3 CYS 22 HB3 CYS 22 24.998 -0.485 -4.372 43 H ASN 23 H ASN 23 21.261 1.133 -4.470 44 HA ASN 23 HA ASN 23 19.495 0.073 -3.619 45 HB2 ASN 23 HB2 ASN 23 18.058 -0.945 -5.396 46 HB3 ASN 23 HB3 ASN 23 18.856 0.584 -5.883 47 HD21 ASN 23 HD21 ASN 23 19.401 -2.991 -6.121 48 HD22 ASN 23 HD22 ASN 23 20.001 -2.924 -7.769 49 H LYS 24 H LYS 24 21.579 -1.440 -2.517 50 HA LYS 24 HA LYS 24 20.307 -4.029 -2.169 51 HB2 LYS 24 HB2 LYS 24 21.993 -4.259 -4.081 52 HB3 LYS 24 HB3 LYS 24 23.244 -3.588 -3.012 53 HG2 LYS 24 HG2 LYS 24 23.603 -5.929 -3.088 54 HG3 LYS 24 HG3 LYS 24 22.913 -5.653 -1.471 55 HD2 LYS 24 HD2 LYS 24 20.752 -6.586 -2.174 56 HD3 LYS 24 HD3 LYS 24 21.212 -6.457 -3.908 57 HE2 LYS 24 HE2 LYS 24 23.031 -8.164 -3.565 58 HE3 LYS 24 HE3 LYS 24 22.472 -8.395 -1.854 59 HZ1 LYS 24 HZ1 LYS 24 21.564 -9.981 -3.470 60 HZ2 LYS 24 HZ2 LYS 24 20.758 -8.717 -4.262 61 HZ3 LYS 24 HZ3 LYS 24 20.364 -9.093 -2.653 62 H ASN 25 H ASN 25 20.708 -4.714 0.126 63 HA ASN 25 HA ASN 25 22.556 -2.892 1.545 64 HB2 ASN 25 HB2 ASN 25 21.449 -3.358 3.623 65 HB3 ASN 25 HB3 ASN 25 20.212 -2.823 2.438 66 HD21 ASN 25 HD21 ASN 25 21.086 -5.277 4.681 67 HD22 ASN 25 HD22 ASN 25 19.853 -6.433 4.286 68 H CYS 26 H CYS 26 23.945 -3.821 3.184 69 HA CYS 26 HA CYS 26 24.416 -6.715 2.845 70 HB2 CYS 26 HB2 CYS 26 26.258 -4.710 4.271 71 HB3 CYS 26 HB3 CYS 26 26.520 -6.488 4.006 72 H THR 27 H THR 27 24.644 -7.934 4.774 73 HA THR 27 HA THR 27 23.729 -6.688 7.282 74 HB THR 27 HB THR 27 23.502 -9.628 6.476 75 HG1 THR 27 HG1 THR 27 21.313 -9.231 6.386 76 HG21 THR 27 HG21 THR 27 22.088 -9.785 8.553 77 HG22 THR 27 HG22 THR 27 22.319 -8.026 8.846 78 HG23 THR 27 HG23 THR 27 23.719 -9.171 8.990 79 H SER 28 H SER 28 25.315 -7.064 9.020 80 HA SER 28 HA SER 28 27.929 -7.588 8.254 81 HB2 SER 28 HB2 SER 28 27.366 -6.367 10.333 82 HB3 SER 28 HB3 SER 28 26.678 -7.868 11.040 83 HG SER 28 HG SER 28 28.932 -7.350 11.609 84 H GLY 29 H GLY 29 29.156 -9.471 7.972 85 HA2 GLY 29 HA2 GLY 29 29.765 -11.625 8.247 86 HA3 GLY 29 HA3 GLY 29 28.243 -11.978 9.127 87 H GLN 30 H GLN 30 27.262 -10.317 6.483 88 HA GLN 30 HA GLN 30 27.382 -12.596 4.583 89 HB2 GLN 30 HB2 GLN 30 25.271 -10.402 4.945 90 HB3 GLN 30 HB3 GLN 30 25.338 -11.431 3.488 91 HG2 GLN 30 HG2 GLN 30 25.011 -12.560 6.355 92 HG3 GLN 30 HG3 GLN 30 23.627 -12.100 5.295 93 HE21 GLN 30 HE21 GLN 30 26.486 -14.385 5.432 94 HE22 GLN 30 HE22 GLN 30 25.710 -15.561 4.403 95 H ASN 31 H ASN 31 27.433 -9.007 4.884 96 HA ASN 31 HA ASN 31 28.448 -7.443 3.643 97 HB2 ASN 31 HB2 ASN 31 30.537 -9.688 3.640 98 HB3 ASN 31 HB3 ASN 31 30.911 -8.003 3.121 99 HD21 ASN 31 HD21 ASN 31 30.781 -6.304 4.631 100 HD22 ASN 31 HD22 ASN 31 30.896 -6.588 6.353 101 H GLU 32 H GLU 32 26.544 -8.474 2.035 102 HA GLU 32 HA GLU 32 27.724 -9.352 -0.465 103 HB2 GLU 32 HB2 GLU 32 25.929 -10.587 0.835 104 HB3 GLU 32 HB3 GLU 32 24.853 -9.204 0.596 105 HG2 GLU 32 HG2 GLU 32 24.191 -10.909 -1.015 106 HG3 GLU 32 HG3 GLU 32 24.876 -9.510 -1.915 107 H CYS 33 H CYS 33 28.127 -7.813 -2.082 108 HA CYS 33 HA CYS 33 25.885 -6.095 -2.752 109 HB2 CYS 33 HB2 CYS 33 28.823 -5.178 -2.893 110 HB3 CYS 33 HB3 CYS 33 27.439 -4.293 -3.596 111 HA PRO 34 HA PRO 34 27.220 -7.942 -6.671 112 HB2 PRO 34 HB2 PRO 34 26.249 -6.142 -8.574 113 HB3 PRO 34 HB3 PRO 34 25.146 -7.193 -7.594 114 HG2 PRO 34 HG2 PRO 34 25.974 -4.305 -6.962 115 HG3 PRO 34 HG3 PRO 34 24.288 -4.958 -7.114 116 HD2 PRO 34 HD2 PRO 34 25.514 -4.755 -4.668 117 HD3 PRO 34 HD3 PRO 34 24.530 -6.239 -5.068 118 H GLU 35 H GLU 35 28.791 -7.503 -8.483 119 HA GLU 35 HA GLU 35 31.051 -6.310 -7.401 120 HB2 GLU 35 HB2 GLU 35 31.068 -8.244 -8.967 121 HB3 GLU 35 HB3 GLU 35 30.442 -7.195 -10.268 122 HG2 GLU 35 HG2 GLU 35 32.840 -7.630 -10.611 123 HG3 GLU 35 HG3 GLU 35 32.609 -5.879 -10.283 124 H GLY 36 H GLY 36 32.162 -4.425 -7.695 125 HA2 GLY 36 HA2 GLY 36 32.619 -2.353 -8.608 126 HA3 GLY 36 HA3 GLY 36 31.022 -2.340 -9.428 127 H CYS 37 H CYS 37 30.059 -3.338 -6.542 128 HA CYS 37 HA CYS 37 29.881 -0.625 -5.400 129 HB2 CYS 37 HB2 CYS 37 27.847 -2.920 -5.331 130 HB3 CYS 37 HB3 CYS 37 27.675 -1.354 -4.455 131 H PHE 38 H PHE 38 29.769 -0.467 -3.034 132 HA PHE 38 HA PHE 38 30.761 -2.831 -1.597 133 HB2 PHE 38 HB2 PHE 38 32.500 -1.670 -0.409 134 HB3 PHE 38 HB3 PHE 38 32.759 -1.172 -2.112 135 HD1 PHE 38 HD1 PHE 38 32.359 -0.095 1.238 136 HD2 PHE 38 HD2 PHE 38 31.474 1.167 -2.774 137 HE1 PHE 38 HE1 PHE 38 32.050 2.218 2.044 138 HE2 PHE 38 HE2 PHE 38 31.109 3.476 -1.947 139 HZ PHE 38 HZ PHE 38 31.438 4.016 0.435 140 H CYS 39 H CYS 39 30.183 -2.539 0.861 141 HA CYS 39 HA CYS 39 28.068 -0.489 1.140 142 HB2 CYS 39 HB2 CYS 39 26.987 -1.947 2.833 143 HB3 CYS 39 HB3 CYS 39 26.983 -2.599 1.182 144 H GLY 40 H GLY 40 27.916 0.717 2.926 145 HA2 GLY 40 HA2 GLY 40 30.498 1.145 4.191 146 HA3 GLY 40 HA3 GLY 40 29.059 2.223 4.190 147 H LEU 41 H LEU 41 29.970 -1.053 5.356 148 HA LEU 41 HA LEU 41 28.588 -0.595 7.862 149 HB2 LEU 41 HB2 LEU 41 30.325 -2.856 6.820 150 HB3 LEU 41 HB3 LEU 41 29.821 -2.799 8.547 151 HG LEU 41 HG LEU 41 27.846 -2.778 6.190 152 HD11 LEU 41 HD11 LEU 41 29.184 -4.935 6.307 153 HD12 LEU 41 HD12 LEU 41 27.430 -5.153 6.670 154 HD13 LEU 41 HD13 LEU 41 28.615 -5.133 8.021 155 HD21 LEU 41 HD21 LEU 41 26.284 -3.540 8.096 156 HD22 LEU 41 HD22 LEU 41 26.848 -1.832 8.247 157 HD23 LEU 41 HD23 LEU 41 27.590 -3.137 9.256 158 H LEU 42 H LEU 42 29.320 0.158 9.681 159 HA LEU 42 HA LEU 42 31.406 1.904 9.591 160 HB2 LEU 42 HB2 LEU 42 29.911 0.762 12.059 161 HB3 LEU 42 HB3 LEU 42 30.809 2.304 11.974 162 HG LEU 42 HG LEU 42 28.623 2.961 11.881 163 HD11 LEU 42 HD11 LEU 42 30.010 3.910 9.886 164 HD12 LEU 42 HD12 LEU 42 28.211 4.048 9.772 165 HD13 LEU 42 HD13 LEU 42 29.067 2.769 8.851 166 HD21 LEU 42 HD21 LEU 42 27.700 1.056 9.673 167 HD22 LEU 42 HD22 LEU 42 26.741 1.970 10.875 168 HD23 LEU 42 HD23 LEU 42 27.707 0.537 11.401 169 H GLY 43 H GLY 43 31.111 -1.110 11.276 170 HA2 GLY 43 HA2 GLY 43 33.830 -1.875 10.992 171 HA3 GLY 43 HA3 GLY 43 33.404 -1.449 12.705 172 H GLN 44 H GLN 44 31.664 -2.952 10.003 173 HA GLN 44 HA GLN 44 30.074 -4.532 9.941 174 HB2 GLN 44 HB2 GLN 44 30.899 -6.816 10.271 175 HB3 GLN 44 HB3 GLN 44 31.953 -5.814 9.277 176 HG2 GLN 44 HG2 GLN 44 32.529 -6.267 12.292 177 HG3 GLN 44 HG3 GLN 44 32.914 -7.521 11.077 178 HE21 GLN 44 HE21 GLN 44 33.649 -5.114 9.105 179 HE22 GLN 44 HE22 GLN 44 35.297 -4.805 9.611 180 H ASN 45 H ASN 45 28.970 -3.128 11.876 181 HA ASN 45 HA ASN 45 28.683 -4.803 14.267 182 HB2 ASN 45 HB2 ASN 45 27.593 -1.994 13.568 183 HB3 ASN 45 HB3 ASN 45 27.292 -2.845 15.116 184 HD21 ASN 45 HD21 ASN 45 30.608 -3.468 14.253 185 HD22 ASN 45 HD22 ASN 45 31.222 -2.279 15.352 186 H LYS 46 H LYS 46 26.528 -3.299 11.769 187 HA LYS 46 HA LYS 46 24.419 -5.218 12.531 188 HB2 LYS 46 HB2 LYS 46 24.152 -2.189 12.075 189 HB3 LYS 46 HB3 LYS 46 22.758 -3.329 12.185 190 HG2 LYS 46 HG2 LYS 46 23.385 -3.923 14.487 191 HG3 LYS 46 HG3 LYS 46 24.786 -2.805 14.438 192 HD2 LYS 46 HD2 LYS 46 23.337 -0.862 14.137 193 HD3 LYS 46 HD3 LYS 46 21.882 -1.885 13.937 194 HE2 LYS 46 HE2 LYS 46 23.552 -1.768 16.542 195 HE3 LYS 46 HE3 LYS 46 22.067 -0.778 16.219 196 HZ1 LYS 46 HZ1 LYS 46 22.209 -3.739 16.161 197 HZ2 LYS 46 HZ2 LYS 46 20.827 -2.785 15.915 198 HZ3 LYS 46 HZ3 LYS 46 21.593 -2.791 17.432 199 H LYS 47 H LYS 47 23.784 -2.672 10.245 200 HA LYS 47 HA LYS 47 24.145 -4.350 7.932 201 HB2 LYS 47 HB2 LYS 47 21.797 -4.034 7.202 202 HB3 LYS 47 HB3 LYS 47 21.872 -4.973 8.722 203 HG2 LYS 47 HG2 LYS 47 21.287 -2.922 10.034 204 HG3 LYS 47 HG3 LYS 47 21.191 -1.959 8.523 205 HD2 LYS 47 HD2 LYS 47 19.304 -3.325 7.718 206 HD3 LYS 47 HD3 LYS 47 19.478 -4.455 9.104 207 HE2 LYS 47 HE2 LYS 47 18.826 -2.676 10.708 208 HE3 LYS 47 HE3 LYS 47 18.740 -1.461 9.365 209 HZ1 LYS 47 HZ1 LYS 47 17.121 -3.946 9.569 210 HZ2 LYS 47 HZ2 LYS 47 17.023 -2.770 8.347 211 HZ3 LYS 47 HZ3 LYS 47 16.596 -2.374 9.942 212 H GLY 48 H GLY 48 24.145 -3.016 5.968 213 HA2 GLY 48 HA2 GLY 48 23.913 -0.158 6.245 214 HA3 GLY 48 HA3 GLY 48 25.582 -0.811 5.974 215 H HIS 49 H HIS 49 24.213 0.898 4.067 216 HA HIS 49 HA HIS 49 22.984 -0.928 2.155 217 HB2 HIS 49 HB2 HIS 49 21.886 1.231 2.929 218 HB3 HIS 49 HB3 HIS 49 23.192 2.123 2.092 219 HD2 HIS 49 HD2 HIS 49 22.545 2.660 -0.591 220 HE1 HIS 49 HE1 HIS 49 19.412 -0.181 -0.882 221 HE2 HIS 49 HE2 HIS 49 20.629 1.721 -2.056 222 H CYS 50 H CYS 50 23.716 -1.161 -0.087 223 HA CYS 50 HA CYS 50 26.541 -0.807 -0.395 224 HB2 CYS 50 HB2 CYS 50 24.441 -1.818 -2.378 225 HB3 CYS 50 HB3 CYS 50 26.211 -1.833 -2.668 226 H TYR 51 H TYR 51 27.648 0.600 -1.690 227 HA TYR 51 HA TYR 51 26.115 2.638 -3.185 228 HB2 TYR 51 HB2 TYR 51 28.819 3.130 -1.795 229 HB3 TYR 51 HB3 TYR 51 27.740 4.335 -2.612 230 HD1 TYR 51 HD1 TYR 51 25.061 3.488 -1.139 231 HD2 TYR 51 HD2 TYR 51 29.090 4.288 0.095 232 HE1 TYR 51 HE1 TYR 51 24.267 3.957 1.160 233 HE2 TYR 51 HE2 TYR 51 28.316 4.699 2.408 234 HH TYR 51 HH TYR 51 26.539 4.447 3.851 235 H LYS 52 H LYS 52 27.288 3.485 -5.022 236 HA LYS 52 HA LYS 52 29.434 1.739 -6.056 237 HB2 LYS 52 HB2 LYS 52 27.348 1.873 -7.450 238 HB3 LYS 52 HB3 LYS 52 27.547 3.648 -7.537 239 HG2 LYS 52 HG2 LYS 52 29.780 3.303 -8.717 240 HG3 LYS 52 HG3 LYS 52 29.472 1.537 -8.691 241 HD2 LYS 52 HD2 LYS 52 27.745 3.683 -10.074 242 HD3 LYS 52 HD3 LYS 52 28.913 2.581 -10.878 243 HE2 LYS 52 HE2 LYS 52 27.500 0.598 -10.225 244 HE3 LYS 52 HE3 LYS 52 26.303 1.721 -9.447 245 HZ1 LYS 52 HZ1 LYS 52 25.646 1.179 -11.646 246 HZ2 LYS 52 HZ2 LYS 52 27.124 1.707 -12.299 247 HZ3 LYS 52 HZ3 LYS 52 26.062 2.822 -11.577 248 H ILE 53 H ILE 53 31.452 2.689 -6.453 249 HA ILE 53 HA ILE 53 31.734 5.546 -5.797 250 HB ILE 53 HB ILE 53 33.772 3.304 -5.847 251 HG12 ILE 53 HG12 ILE 53 32.680 5.030 -3.548 252 HG13 ILE 53 HG13 ILE 53 32.228 3.333 -3.899 253 HG21 ILE 53 HG21 ILE 53 34.192 6.325 -5.363 254 HG22 ILE 53 HG22 ILE 53 34.878 5.340 -6.713 255 HG23 ILE 53 HG23 ILE 53 35.422 5.047 -5.034 256 HD11 ILE 53 HD11 ILE 53 33.852 3.396 -2.050 257 HD12 ILE 53 HD12 ILE 53 35.035 4.307 -3.046 258 HD13 ILE 53 HD13 ILE 53 34.610 2.606 -3.484 259 H ILE 54 H ILE 54 31.988 6.955 -7.425 260 HA ILE 54 HA ILE 54 33.291 6.037 -9.870 261 HB ILE 54 HB ILE 54 31.922 7.585 -11.183 262 HG12 ILE 54 HG12 ILE 54 31.058 8.987 -9.245 263 HG13 ILE 54 HG13 ILE 54 29.918 8.561 -10.552 264 HG21 ILE 54 HG21 ILE 54 31.564 5.127 -11.219 265 HG22 ILE 54 HG22 ILE 54 30.003 6.006 -11.436 266 HG23 ILE 54 HG23 ILE 54 30.405 5.250 -9.849 267 HD11 ILE 54 HD11 ILE 54 28.823 6.838 -9.142 268 HD12 ILE 54 HD12 ILE 54 28.808 8.441 -8.338 269 HD13 ILE 54 HD13 ILE 54 29.937 7.172 -7.770 270 H GLY 55 H GLY 55 34.632 7.551 -10.905 271 HA2 GLY 55 HA2 GLY 55 35.643 9.558 -11.214 272 HA3 GLY 55 HA3 GLY 55 34.916 10.190 -9.704 273 H ASN 56 H ASN 56 36.140 7.452 -8.576 274 HA ASN 56 HA ASN 56 38.519 8.784 -7.608 275 HB2 ASN 56 HB2 ASN 56 36.953 7.481 -6.111 276 HB3 ASN 56 HB3 ASN 56 37.417 5.972 -6.984 277 HD21 ASN 56 HD21 ASN 56 38.121 5.203 -4.792 278 HD22 ASN 56 HD22 ASN 56 39.688 5.703 -4.201 Start of MODEL 8 1 H1 PHE 17 HT1 PHE 17 34.753 12.759 -8.247 2 H2 PHE 17 HT2 PHE 17 36.082 12.588 -7.195 3 H3 PHE 17 HT3 PHE 17 34.937 13.801 -6.924 4 HA PHE 17 HA PHE 17 34.392 10.914 -6.792 5 HB2 PHE 17 HB2 PHE 17 35.963 11.529 -5.078 6 HB3 PHE 17 HB3 PHE 17 34.996 12.993 -4.625 7 HD1 PHE 17 HD1 PHE 17 34.802 12.527 -2.349 8 HD2 PHE 17 HD2 PHE 17 33.604 9.492 -5.153 9 HE1 PHE 17 HE1 PHE 17 33.691 11.274 -0.525 10 HE2 PHE 17 HE2 PHE 17 32.455 8.288 -3.361 11 HZ PHE 17 HZ PHE 17 32.502 9.151 -1.027 12 H ASP 18 H ASP 18 32.383 10.459 -7.364 13 HA ASP 18 HA ASP 18 30.229 11.820 -5.910 14 HB2 ASP 18 HB2 ASP 18 30.149 10.413 -8.659 15 HB3 ASP 18 HB3 ASP 18 28.662 10.868 -7.740 16 H VAL 19 H VAL 19 28.770 10.379 -4.785 17 HA VAL 19 HA VAL 19 29.464 7.532 -4.946 18 HB VAL 19 HB VAL 19 30.324 8.400 -2.817 19 HG11 VAL 19 HG11 VAL 19 27.408 9.203 -2.187 20 HG12 VAL 19 HG12 VAL 19 28.782 10.339 -2.478 21 HG13 VAL 19 HG13 VAL 19 28.803 9.240 -1.054 22 HG21 VAL 19 HG21 VAL 19 29.225 6.712 -1.366 23 HG22 VAL 19 HG22 VAL 19 29.471 6.052 -3.023 24 HG23 VAL 19 HG23 VAL 19 27.833 6.599 -2.495 25 H VAL 20 H VAL 20 27.741 6.240 -5.361 26 HA VAL 20 HA VAL 20 25.049 7.345 -5.113 27 HB VAL 20 HB VAL 20 24.397 6.234 -7.309 28 HG11 VAL 20 HG11 VAL 20 24.777 8.735 -7.140 29 HG12 VAL 20 HG12 VAL 20 25.290 8.081 -8.741 30 HG13 VAL 20 HG13 VAL 20 26.530 8.487 -7.499 31 HG21 VAL 20 HG21 VAL 20 26.234 4.670 -7.494 32 HG22 VAL 20 HG22 VAL 20 27.436 6.010 -7.630 33 HG23 VAL 20 HG23 VAL 20 26.201 5.774 -8.923 34 H SER 21 H SER 21 23.395 5.678 -4.948 35 HA SER 21 HA SER 21 24.420 3.404 -3.495 36 HB2 SER 21 HB2 SER 21 22.122 2.877 -2.918 37 HB3 SER 21 HB3 SER 21 22.448 4.610 -2.602 38 HG SER 21 HG SER 21 21.220 5.150 -4.345 39 H CYS 22 H CYS 22 23.899 1.199 -3.887 40 HA CYS 22 HA CYS 22 23.572 0.561 -6.750 41 HB2 CYS 22 HB2 CYS 22 25.758 0.192 -5.497 42 HB3 CYS 22 HB3 CYS 22 24.923 -1.030 -4.504 43 H ASN 23 H ASN 23 21.609 0.878 -4.352 44 HA ASN 23 HA ASN 23 19.653 0.121 -3.647 45 HB2 ASN 23 HB2 ASN 23 19.629 -1.235 -6.416 46 HB3 ASN 23 HB3 ASN 23 18.166 -0.936 -5.401 47 HD21 ASN 23 HD21 ASN 23 18.181 1.596 -4.556 48 HD22 ASN 23 HD22 ASN 23 18.503 2.736 -5.842 49 H LYS 24 H LYS 24 21.831 -1.613 -2.828 50 HA LYS 24 HA LYS 24 20.305 -3.975 -2.042 51 HB2 LYS 24 HB2 LYS 24 23.180 -3.858 -3.117 52 HB3 LYS 24 HB3 LYS 24 22.592 -5.248 -2.152 53 HG2 LYS 24 HG2 LYS 24 21.254 -4.339 -4.767 54 HG3 LYS 24 HG3 LYS 24 22.633 -5.476 -4.752 55 HD2 LYS 24 HD2 LYS 24 20.065 -6.019 -3.139 56 HD3 LYS 24 HD3 LYS 24 20.278 -6.509 -4.857 57 HE2 LYS 24 HE2 LYS 24 22.307 -7.860 -4.236 58 HE3 LYS 24 HE3 LYS 24 22.066 -7.410 -2.496 59 HZ1 LYS 24 HZ1 LYS 24 21.126 -9.520 -2.996 60 HZ2 LYS 24 HZ2 LYS 24 20.145 -8.875 -4.225 61 HZ3 LYS 24 HZ3 LYS 24 19.887 -8.424 -2.608 62 H ASN 25 H ASN 25 21.216 -4.840 0.126 63 HA ASN 25 HA ASN 25 23.033 -2.942 1.393 64 HB2 ASN 25 HB2 ASN 25 21.721 -2.782 3.468 65 HB3 ASN 25 HB3 ASN 25 20.700 -2.234 2.098 66 HD21 ASN 25 HD21 ASN 25 21.204 -4.742 4.509 67 HD22 ASN 25 HD22 ASN 25 19.658 -5.542 4.304 68 H CYS 26 H CYS 26 23.970 -3.873 3.450 69 HA CYS 26 HA CYS 26 23.961 -6.833 3.359 70 HB2 CYS 26 HB2 CYS 26 26.281 -5.180 4.517 71 HB3 CYS 26 HB3 CYS 26 26.168 -6.955 4.150 72 H THR 27 H THR 27 23.710 -7.829 5.426 73 HA THR 27 HA THR 27 23.780 -6.081 7.776 74 HB THR 27 HB THR 27 23.179 -8.160 9.052 75 HG1 THR 27 HG1 THR 27 21.866 -9.260 7.036 76 HG21 THR 27 HG21 THR 27 20.739 -7.949 8.493 77 HG22 THR 27 HG22 THR 27 21.168 -6.981 7.025 78 HG23 THR 27 HG23 THR 27 21.584 -6.372 8.681 79 H SER 28 H SER 28 25.102 -6.880 9.619 80 HA SER 28 HA SER 28 27.735 -7.130 8.864 81 HB2 SER 28 HB2 SER 28 26.991 -6.177 11.006 82 HB3 SER 28 HB3 SER 28 26.340 -7.760 11.513 83 HG SER 28 HG SER 28 28.427 -7.297 12.390 84 H GLY 29 H GLY 29 29.148 -8.723 8.476 85 HA2 GLY 29 HA2 GLY 29 30.074 -10.773 8.450 86 HA3 GLY 29 HA3 GLY 29 28.575 -11.490 9.132 87 H GLN 30 H GLN 30 27.086 -9.960 6.845 88 HA GLN 30 HA GLN 30 27.202 -12.164 4.989 89 HB2 GLN 30 HB2 GLN 30 25.603 -9.569 5.133 90 HB3 GLN 30 HB3 GLN 30 25.443 -10.659 3.741 91 HG2 GLN 30 HG2 GLN 30 24.925 -11.525 6.687 92 HG3 GLN 30 HG3 GLN 30 23.649 -10.918 5.572 93 HE21 GLN 30 HE21 GLN 30 24.280 -12.022 3.190 94 HE22 GLN 30 HE22 GLN 30 24.110 -13.774 3.265 95 H ASN 31 H ASN 31 27.978 -8.697 4.759 96 HA ASN 31 HA ASN 31 28.885 -7.434 3.161 97 HB2 ASN 31 HB2 ASN 31 30.781 -9.855 3.045 98 HB3 ASN 31 HB3 ASN 31 31.185 -8.223 2.393 99 HD21 ASN 31 HD21 ASN 31 30.334 -6.431 4.317 100 HD22 ASN 31 HD22 ASN 31 31.226 -6.745 5.787 101 H GLU 32 H GLU 32 26.652 -8.577 1.974 102 HA GLU 32 HA GLU 32 27.488 -9.661 -0.605 103 HB2 GLU 32 HB2 GLU 32 25.738 -10.775 0.861 104 HB3 GLU 32 HB3 GLU 32 24.730 -9.320 0.679 105 HG2 GLU 32 HG2 GLU 32 23.846 -10.998 -0.829 106 HG3 GLU 32 HG3 GLU 32 24.555 -9.681 -1.824 107 H CYS 33 H CYS 33 27.947 -8.106 -2.175 108 HA CYS 33 HA CYS 33 25.719 -6.392 -2.871 109 HB2 CYS 33 HB2 CYS 33 28.647 -5.436 -2.904 110 HB3 CYS 33 HB3 CYS 33 27.273 -4.545 -3.623 111 HA PRO 34 HA PRO 34 27.118 -8.305 -6.718 112 HB2 PRO 34 HB2 PRO 34 26.276 -6.507 -8.693 113 HB3 PRO 34 HB3 PRO 34 25.112 -7.510 -7.739 114 HG2 PRO 34 HG2 PRO 34 26.017 -4.640 -7.132 115 HG3 PRO 34 HG3 PRO 34 24.313 -5.237 -7.312 116 HD2 PRO 34 HD2 PRO 34 25.475 -5.018 -4.841 117 HD3 PRO 34 HD3 PRO 34 24.472 -6.493 -5.227 118 H GLU 35 H GLU 35 28.743 -7.994 -8.515 119 HA GLU 35 HA GLU 35 31.039 -6.908 -7.389 120 HB2 GLU 35 HB2 GLU 35 30.939 -8.873 -8.877 121 HB3 GLU 35 HB3 GLU 35 30.468 -7.851 -10.258 122 HG2 GLU 35 HG2 GLU 35 33.182 -7.525 -8.769 123 HG3 GLU 35 HG3 GLU 35 32.932 -8.696 -10.110 124 H GLY 36 H GLY 36 32.135 -5.005 -7.553 125 HA2 GLY 36 HA2 GLY 36 32.747 -3.003 -8.551 126 HA3 GLY 36 HA3 GLY 36 31.207 -2.972 -9.473 127 H CYS 37 H CYS 37 30.000 -3.881 -6.662 128 HA CYS 37 HA CYS 37 29.884 -1.168 -5.519 129 HB2 CYS 37 HB2 CYS 37 27.792 -3.408 -5.489 130 HB3 CYS 37 HB3 CYS 37 27.645 -1.840 -4.615 131 H PHE 38 H PHE 38 29.749 -1.009 -3.178 132 HA PHE 38 HA PHE 38 30.561 -3.396 -1.685 133 HB2 PHE 38 HB2 PHE 38 32.297 -2.162 -0.422 134 HB3 PHE 38 HB3 PHE 38 32.706 -2.056 -2.176 135 HD1 PHE 38 HD1 PHE 38 32.118 0.111 -3.410 136 HD2 PHE 38 HD2 PHE 38 31.864 -0.231 0.865 137 HE1 PHE 38 HE1 PHE 38 31.936 2.558 -3.230 138 HE2 PHE 38 HE2 PHE 38 31.739 2.227 1.064 139 HZ PHE 38 HZ PHE 38 31.749 3.636 -0.986 140 H CYS 39 H CYS 39 29.923 -3.159 0.692 141 HA CYS 39 HA CYS 39 27.956 -0.978 1.020 142 HB2 CYS 39 HB2 CYS 39 26.980 -2.325 2.892 143 HB3 CYS 39 HB3 CYS 39 26.737 -3.008 1.279 144 H GLY 40 H GLY 40 27.989 0.361 2.689 145 HA2 GLY 40 HA2 GLY 40 30.550 0.692 4.019 146 HA3 GLY 40 HA3 GLY 40 29.085 1.745 4.109 147 H LEU 41 H LEU 41 30.359 -1.432 5.142 148 HA LEU 41 HA LEU 41 28.310 -1.572 7.197 149 HB2 LEU 41 HB2 LEU 41 29.103 -3.495 5.621 150 HB3 LEU 41 HB3 LEU 41 30.579 -3.567 6.628 151 HG LEU 41 HG LEU 41 28.988 -5.312 7.209 152 HD11 LEU 41 HD11 LEU 41 30.371 -4.320 9.079 153 HD12 LEU 41 HD12 LEU 41 28.842 -5.124 9.607 154 HD13 LEU 41 HD13 LEU 41 28.925 -3.334 9.557 155 HD21 LEU 41 HD21 LEU 41 26.972 -3.085 7.863 156 HD22 LEU 41 HD22 LEU 41 26.745 -4.834 8.211 157 HD23 LEU 41 HD23 LEU 41 26.872 -4.261 6.502 158 H LEU 42 H LEU 42 28.666 -0.804 9.282 159 HA LEU 42 HA LEU 42 31.237 0.425 9.652 160 HB2 LEU 42 HB2 LEU 42 28.793 0.463 11.527 161 HB3 LEU 42 HB3 LEU 42 30.209 1.551 11.559 162 HG LEU 42 HG LEU 42 28.497 2.829 10.695 163 HD11 LEU 42 HD11 LEU 42 29.025 3.431 8.377 164 HD12 LEU 42 HD12 LEU 42 29.817 1.847 8.089 165 HD13 LEU 42 HD13 LEU 42 30.569 3.028 9.221 166 HD21 LEU 42 HD21 LEU 42 27.009 0.733 10.269 167 HD22 LEU 42 HD22 LEU 42 27.618 0.789 8.583 168 HD23 LEU 42 HD23 LEU 42 26.730 2.203 9.245 169 H GLY 43 H GLY 43 32.784 -1.135 10.289 170 HA2 GLY 43 HA2 GLY 43 34.020 -2.216 11.827 171 HA3 GLY 43 HA3 GLY 43 33.010 -1.352 13.037 172 H GLN 44 H GLN 44 31.881 -3.813 10.810 173 HA GLN 44 HA GLN 44 30.460 -5.460 11.101 174 HB2 GLN 44 HB2 GLN 44 31.216 -7.482 12.244 175 HB3 GLN 44 HB3 GLN 44 32.432 -6.764 11.157 176 HG2 GLN 44 HG2 GLN 44 33.699 -5.848 13.061 177 HG3 GLN 44 HG3 GLN 44 32.464 -6.448 14.233 178 HE21 GLN 44 HE21 GLN 44 33.124 -8.323 15.217 179 HE22 GLN 44 HE22 GLN 44 34.131 -9.558 14.487 180 H ASN 45 H ASN 45 29.534 -3.283 12.598 181 HA ASN 45 HA ASN 45 28.286 -4.482 14.937 182 HB2 ASN 45 HB2 ASN 45 28.073 -1.684 13.648 183 HB3 ASN 45 HB3 ASN 45 27.126 -2.206 15.103 184 HD21 ASN 45 HD21 ASN 45 30.310 -1.203 13.968 185 HD22 ASN 45 HD22 ASN 45 31.040 -1.167 15.557 186 H LYS 46 H LYS 46 26.310 -2.415 12.836 187 HA LYS 46 HA LYS 46 24.317 -4.544 12.950 188 HB2 LYS 46 HB2 LYS 46 24.096 -1.540 12.364 189 HB3 LYS 46 HB3 LYS 46 22.703 -2.676 12.405 190 HG2 LYS 46 HG2 LYS 46 24.550 -2.055 14.796 191 HG3 LYS 46 HG3 LYS 46 22.959 -1.303 14.459 192 HD2 LYS 46 HD2 LYS 46 21.879 -3.600 14.579 193 HD3 LYS 46 HD3 LYS 46 23.476 -4.288 15.015 194 HE2 LYS 46 HE2 LYS 46 22.190 -3.997 17.065 195 HE3 LYS 46 HE3 LYS 46 23.525 -2.769 17.070 196 HZ1 LYS 46 HZ1 LYS 46 20.689 -2.323 16.291 197 HZ2 LYS 46 HZ2 LYS 46 21.926 -1.160 16.233 198 HZ3 LYS 46 HZ3 LYS 46 21.446 -1.818 17.726 199 H LYS 47 H LYS 47 24.389 -1.971 10.429 200 HA LYS 47 HA LYS 47 24.456 -3.943 8.329 201 HB2 LYS 47 HB2 LYS 47 22.185 -3.417 7.515 202 HB3 LYS 47 HB3 LYS 47 22.110 -4.089 9.172 203 HG2 LYS 47 HG2 LYS 47 21.885 -1.749 10.101 204 HG3 LYS 47 HG3 LYS 47 21.878 -1.101 8.428 205 HD2 LYS 47 HD2 LYS 47 19.824 -2.449 7.919 206 HD3 LYS 47 HD3 LYS 47 19.859 -3.104 9.594 207 HE2 LYS 47 HE2 LYS 47 19.575 -0.750 10.499 208 HE3 LYS 47 HE3 LYS 47 19.470 -0.135 8.794 209 HZ1 LYS 47 HZ1 LYS 47 17.579 -1.601 8.468 210 HZ2 LYS 47 HZ2 LYS 47 17.318 -0.496 9.731 211 HZ3 LYS 47 HZ3 LYS 47 17.673 -2.118 10.085 212 H GLY 48 H GLY 48 24.286 -2.838 6.154 213 HA2 GLY 48 HA2 GLY 48 24.648 0.025 6.142 214 HA3 GLY 48 HA3 GLY 48 26.112 -0.957 5.735 215 H HIS 49 H HIS 49 24.672 0.904 3.932 216 HA HIS 49 HA HIS 49 23.145 -0.880 2.188 217 HB2 HIS 49 HB2 HIS 49 22.263 1.384 2.997 218 HB3 HIS 49 HB3 HIS 49 23.539 2.152 2.011 219 HD2 HIS 49 HD2 HIS 49 22.623 2.716 -0.594 220 HE1 HIS 49 HE1 HIS 49 19.253 0.155 -0.442 221 HE2 HIS 49 HE2 HIS 49 20.442 1.981 -1.758 222 H CYS 50 H CYS 50 23.720 -1.140 -0.136 223 HA CYS 50 HA CYS 50 26.567 -1.048 -0.521 224 HB2 CYS 50 HB2 CYS 50 24.351 -1.938 -2.427 225 HB3 CYS 50 HB3 CYS 50 26.107 -2.084 -2.759 226 H TYR 51 H TYR 51 27.745 0.305 -1.798 227 HA TYR 51 HA TYR 51 26.351 2.379 -3.366 228 HB2 TYR 51 HB2 TYR 51 29.032 2.913 -1.938 229 HB3 TYR 51 HB3 TYR 51 27.915 4.086 -2.709 230 HD1 TYR 51 HD1 TYR 51 29.179 3.233 0.226 231 HD2 TYR 51 HD2 TYR 51 25.316 3.838 -1.517 232 HE1 TYR 51 HE1 TYR 51 28.225 3.553 2.495 233 HE2 TYR 51 HE2 TYR 51 24.353 4.222 0.743 234 HH TYR 51 HH TYR 51 26.354 3.989 3.699 235 H LYS 52 H LYS 52 27.856 3.337 -5.002 236 HA LYS 52 HA LYS 52 30.397 1.896 -5.270 237 HB2 LYS 52 HB2 LYS 52 30.396 2.207 -7.722 238 HB3 LYS 52 HB3 LYS 52 29.088 1.119 -7.173 239 HG2 LYS 52 HG2 LYS 52 27.418 2.873 -7.395 240 HG3 LYS 52 HG3 LYS 52 28.656 4.116 -7.793 241 HD2 LYS 52 HD2 LYS 52 29.039 3.272 -9.901 242 HD3 LYS 52 HD3 LYS 52 28.419 1.604 -9.510 243 HE2 LYS 52 HE2 LYS 52 26.052 2.732 -9.376 244 HE3 LYS 52 HE3 LYS 52 26.841 4.184 -10.122 245 HZ1 LYS 52 HZ1 LYS 52 25.874 2.763 -11.761 246 HZ2 LYS 52 HZ2 LYS 52 26.816 1.443 -11.254 247 HZ3 LYS 52 HZ3 LYS 52 27.564 2.808 -11.939 248 H ILE 53 H ILE 53 32.197 3.165 -5.802 249 HA ILE 53 HA ILE 53 31.883 6.069 -5.497 250 HB ILE 53 HB ILE 53 34.239 4.252 -4.915 251 HG12 ILE 53 HG12 ILE 53 32.900 6.289 -3.077 252 HG13 ILE 53 HG13 ILE 53 32.342 4.592 -3.158 253 HG21 ILE 53 HG21 ILE 53 34.157 7.339 -5.037 254 HG22 ILE 53 HG22 ILE 53 35.174 6.242 -6.050 255 HG23 ILE 53 HG23 ILE 53 35.496 6.387 -4.298 256 HD11 ILE 53 HD11 ILE 53 34.685 3.837 -2.485 257 HD12 ILE 53 HD12 ILE 53 33.913 4.897 -1.251 258 HD13 ILE 53 HD13 ILE 53 35.178 5.566 -2.339 259 H ILE 54 H ILE 54 32.173 7.255 -7.246 260 HA ILE 54 HA ILE 54 33.858 6.270 -9.404 261 HB ILE 54 HB ILE 54 32.282 7.291 -11.023 262 HG12 ILE 54 HG12 ILE 54 30.977 8.601 -9.207 263 HG13 ILE 54 HG13 ILE 54 30.090 7.899 -10.593 264 HG21 ILE 54 HG21 ILE 54 31.315 4.805 -9.476 265 HG22 ILE 54 HG22 ILE 54 32.529 4.853 -10.802 266 HG23 ILE 54 HG23 ILE 54 30.805 5.278 -11.140 267 HD11 ILE 54 HD11 ILE 54 28.759 7.551 -8.588 268 HD12 ILE 54 HD12 ILE 54 30.108 6.776 -7.697 269 HD13 ILE 54 HD13 ILE 54 29.366 5.949 -9.106 270 H GLY 55 H GLY 55 35.119 7.872 -10.447 271 HA2 GLY 55 HA2 GLY 55 35.068 10.444 -10.610 272 HA3 GLY 55 HA3 GLY 55 35.361 10.280 -8.831 273 H ASN 56 H ASN 56 37.459 11.144 -8.848 274 HA ASN 56 HA ASN 56 39.441 10.163 -10.620 275 HB2 ASN 56 HB2 ASN 56 40.948 11.683 -9.302 276 HB3 ASN 56 HB3 ASN 56 39.453 12.488 -9.891 277 HD21 ASN 56 HD21 ASN 56 41.419 12.225 -7.151 278 HD22 ASN 56 HD22 ASN 56 40.219 12.655 -5.959 Start of MODEL 9 1 H1 PHE 17 HT1 PHE 17 35.110 12.407 -9.168 2 H2 PHE 17 HT2 PHE 17 36.556 12.090 -8.318 3 H3 PHE 17 HT3 PHE 17 35.565 13.391 -7.867 4 HA PHE 17 HA PHE 17 34.799 10.560 -7.721 5 HB2 PHE 17 HB2 PHE 17 36.630 10.932 -6.232 6 HB3 PHE 17 HB3 PHE 17 35.920 12.476 -5.621 7 HD1 PHE 17 HD1 PHE 17 34.583 8.890 -5.948 8 HD2 PHE 17 HD2 PHE 17 35.355 12.281 -3.415 9 HE1 PHE 17 HE1 PHE 17 33.527 7.722 -4.043 10 HE2 PHE 17 HE2 PHE 17 34.316 11.094 -1.512 11 HZ PHE 17 HZ PHE 17 33.394 8.811 -1.827 12 H ASP 18 H ASP 18 32.746 9.985 -7.281 13 HA ASP 18 HA ASP 18 31.108 11.761 -5.735 14 HB2 ASP 18 HB2 ASP 18 30.627 12.220 -8.298 15 HB3 ASP 18 HB3 ASP 18 30.000 10.543 -8.369 16 H VAL 19 H VAL 19 29.281 10.415 -4.754 17 HA VAL 19 HA VAL 19 29.694 7.535 -5.036 18 HB VAL 19 HB VAL 19 30.955 8.209 -3.053 19 HG11 VAL 19 HG11 VAL 19 28.278 9.304 -1.958 20 HG12 VAL 19 HG12 VAL 19 29.717 10.289 -2.424 21 HG13 VAL 19 HG13 VAL 19 29.818 9.138 -1.044 22 HG21 VAL 19 HG21 VAL 19 29.807 5.982 -3.162 23 HG22 VAL 19 HG22 VAL 19 28.354 6.696 -2.361 24 HG23 VAL 19 HG23 VAL 19 29.915 6.604 -1.474 25 H VAL 20 H VAL 20 27.795 6.433 -5.240 26 HA VAL 20 HA VAL 20 25.288 7.817 -4.627 27 HB VAL 20 HB VAL 20 24.230 6.965 -6.701 28 HG11 VAL 20 HG11 VAL 20 26.670 8.810 -7.178 29 HG12 VAL 20 HG12 VAL 20 25.047 9.323 -6.602 30 HG13 VAL 20 HG13 VAL 20 25.239 8.640 -8.260 31 HG21 VAL 20 HG21 VAL 20 25.637 6.108 -8.558 32 HG22 VAL 20 HG22 VAL 20 25.874 5.064 -7.109 33 HG23 VAL 20 HG23 VAL 20 27.126 6.278 -7.562 34 H SER 21 H SER 21 23.395 6.181 -4.510 35 HA SER 21 HA SER 21 24.337 3.875 -3.095 36 HB2 SER 21 HB2 SER 21 21.945 3.420 -2.673 37 HB3 SER 21 HB3 SER 21 22.400 5.110 -2.257 38 HG SER 21 HG SER 21 20.447 5.003 -3.441 39 H CYS 22 H CYS 22 23.970 1.661 -3.583 40 HA CYS 22 HA CYS 22 23.792 1.125 -6.474 41 HB2 CYS 22 HB2 CYS 22 25.957 0.868 -5.242 42 HB3 CYS 22 HB3 CYS 22 25.204 -0.377 -4.209 43 H ASN 23 H ASN 23 21.857 0.938 -3.844 44 HA ASN 23 HA ASN 23 20.030 -0.120 -3.238 45 HB2 ASN 23 HB2 ASN 23 19.506 0.674 -5.608 46 HB3 ASN 23 HB3 ASN 23 19.816 -1.007 -6.172 47 HD21 ASN 23 HD21 ASN 23 17.798 -1.925 -6.585 48 HD22 ASN 23 HD22 ASN 23 16.393 -1.753 -5.556 49 H LYS 24 H LYS 24 22.148 -1.689 -2.443 50 HA LYS 24 HA LYS 24 20.812 -4.257 -2.325 51 HB2 LYS 24 HB2 LYS 24 22.602 -4.517 -4.115 52 HB3 LYS 24 HB3 LYS 24 23.815 -3.944 -2.942 53 HG2 LYS 24 HG2 LYS 24 24.025 -6.347 -3.026 54 HG3 LYS 24 HG3 LYS 24 23.245 -5.973 -1.471 55 HD2 LYS 24 HD2 LYS 24 22.045 -7.834 -2.300 56 HD3 LYS 24 HD3 LYS 24 20.968 -6.464 -2.729 57 HE2 LYS 24 HE2 LYS 24 21.969 -6.520 -5.099 58 HE3 LYS 24 HE3 LYS 24 22.951 -7.954 -4.592 59 HZ1 LYS 24 HZ1 LYS 24 20.937 -8.594 -5.686 60 HZ2 LYS 24 HZ2 LYS 24 19.987 -7.750 -4.561 61 HZ3 LYS 24 HZ3 LYS 24 20.900 -9.096 -4.064 62 H ASN 25 H ASN 25 21.176 -5.203 -0.173 63 HA ASN 25 HA ASN 25 22.369 -3.286 1.730 64 HB2 ASN 25 HB2 ASN 25 19.893 -3.407 1.834 65 HB3 ASN 25 HB3 ASN 25 19.970 -5.190 2.086 66 HD21 ASN 25 HD21 ASN 25 20.347 -5.937 4.210 67 HD22 ASN 25 HD22 ASN 25 20.631 -4.892 5.571 68 H CYS 26 H CYS 26 23.896 -4.037 3.187 69 HA CYS 26 HA CYS 26 24.478 -6.923 3.208 70 HB2 CYS 26 HB2 CYS 26 26.168 -4.623 4.357 71 HB3 CYS 26 HB3 CYS 26 26.587 -6.383 4.323 72 H THR 27 H THR 27 24.759 -7.918 5.341 73 HA THR 27 HA THR 27 23.653 -6.434 7.621 74 HB THR 27 HB THR 27 23.079 -9.398 7.114 75 HG1 THR 27 HG1 THR 27 20.966 -8.737 6.731 76 HG21 THR 27 HG21 THR 27 22.001 -7.369 9.190 77 HG22 THR 27 HG22 THR 27 23.038 -8.810 9.537 78 HG23 THR 27 HG23 THR 27 21.361 -9.035 8.958 79 H SER 28 H SER 28 24.713 -7.385 9.600 80 HA SER 28 HA SER 28 27.327 -7.404 9.462 81 HB2 SER 28 HB2 SER 28 25.984 -7.121 11.514 82 HB3 SER 28 HB3 SER 28 25.543 -8.860 11.498 83 HG SER 28 HG SER 28 27.202 -8.346 12.932 84 H GLY 29 H GLY 29 25.502 -10.519 9.311 85 HA2 GLY 29 HA2 GLY 29 27.939 -12.059 9.338 86 HA3 GLY 29 HA3 GLY 29 26.269 -12.629 9.036 87 H GLN 30 H GLN 30 26.763 -10.183 6.728 88 HA GLN 30 HA GLN 30 28.236 -11.925 4.927 89 HB2 GLN 30 HB2 GLN 30 26.472 -11.961 3.191 90 HB3 GLN 30 HB3 GLN 30 25.952 -12.788 4.690 91 HG2 GLN 30 HG2 GLN 30 24.643 -10.715 5.369 92 HG3 GLN 30 HG3 GLN 30 25.114 -9.935 3.817 93 HE21 GLN 30 HE21 GLN 30 22.731 -11.900 5.319 94 HE22 GLN 30 HE22 GLN 30 21.939 -12.433 3.853 95 H ASN 31 H ASN 31 29.471 -10.826 3.427 96 HA ASN 31 HA ASN 31 28.960 -7.925 3.172 97 HB2 ASN 31 HB2 ASN 31 31.370 -9.634 2.280 98 HB3 ASN 31 HB3 ASN 31 31.215 -7.846 2.079 99 HD21 ASN 31 HD21 ASN 31 30.508 -6.759 4.410 100 HD22 ASN 31 HD22 ASN 31 31.512 -7.310 5.731 101 H GLU 32 H GLU 32 27.323 -7.672 1.672 102 HA GLU 32 HA GLU 32 27.420 -9.401 -0.725 103 HB2 GLU 32 HB2 GLU 32 25.825 -10.108 1.146 104 HB3 GLU 32 HB3 GLU 32 25.041 -8.533 1.007 105 HG2 GLU 32 HG2 GLU 32 23.685 -10.226 -0.156 106 HG3 GLU 32 HG3 GLU 32 24.284 -9.001 -1.336 107 H CYS 33 H CYS 33 28.225 -7.782 -2.190 108 HA CYS 33 HA CYS 33 26.152 -5.874 -2.897 109 HB2 CYS 33 HB2 CYS 33 29.149 -5.170 -2.865 110 HB3 CYS 33 HB3 CYS 33 27.864 -4.165 -3.594 111 HA PRO 34 HA PRO 34 27.609 -7.598 -6.856 112 HB2 PRO 34 HB2 PRO 34 26.784 -5.646 -8.678 113 HB3 PRO 34 HB3 PRO 34 25.605 -6.745 -7.857 114 HG2 PRO 34 HG2 PRO 34 26.441 -3.929 -6.977 115 HG3 PRO 34 HG3 PRO 34 24.753 -4.534 -7.254 116 HD2 PRO 34 HD2 PRO 34 25.876 -4.498 -4.745 117 HD3 PRO 34 HD3 PRO 34 24.859 -5.921 -5.263 118 H GLU 35 H GLU 35 29.288 -7.031 -8.548 119 HA GLU 35 HA GLU 35 31.478 -5.873 -7.220 120 HB2 GLU 35 HB2 GLU 35 31.090 -6.706 -10.139 121 HB3 GLU 35 HB3 GLU 35 32.667 -6.174 -9.490 122 HG2 GLU 35 HG2 GLU 35 31.105 -8.623 -8.397 123 HG3 GLU 35 HG3 GLU 35 32.409 -8.703 -9.634 124 H GLY 36 H GLY 36 32.618 -3.991 -7.409 125 HA2 GLY 36 HA2 GLY 36 33.113 -1.891 -8.228 126 HA3 GLY 36 HA3 GLY 36 31.575 -1.865 -9.154 127 H CYS 37 H CYS 37 30.496 -2.989 -6.342 128 HA CYS 37 HA CYS 37 30.164 -0.326 -5.130 129 HB2 CYS 37 HB2 CYS 37 28.244 -2.720 -5.178 130 HB3 CYS 37 HB3 CYS 37 27.969 -1.187 -4.271 131 H PHE 38 H PHE 38 30.021 -0.236 -2.765 132 HA PHE 38 HA PHE 38 30.971 -2.656 -1.382 133 HB2 PHE 38 HB2 PHE 38 32.611 -1.518 -0.037 134 HB3 PHE 38 HB3 PHE 38 32.967 -0.958 -1.703 135 HD1 PHE 38 HD1 PHE 38 31.925 1.410 -2.382 136 HD2 PHE 38 HD2 PHE 38 32.226 -0.004 1.670 137 HE1 PHE 38 HE1 PHE 38 31.620 3.722 -1.530 138 HE2 PHE 38 HE2 PHE 38 31.990 2.299 2.503 139 HZ PHE 38 HZ PHE 38 31.694 4.174 0.901 140 H CYS 39 H CYS 39 30.202 -2.593 0.980 141 HA CYS 39 HA CYS 39 28.094 -0.551 1.358 142 HB2 CYS 39 HB2 CYS 39 27.040 -2.091 2.987 143 HB3 CYS 39 HB3 CYS 39 27.002 -2.662 1.310 144 H GLY 40 H GLY 40 28.031 0.628 3.189 145 HA2 GLY 40 HA2 GLY 40 30.548 0.871 4.617 146 HA3 GLY 40 HA3 GLY 40 29.071 1.900 4.743 147 H LEU 41 H LEU 41 30.270 -1.393 5.510 148 HA LEU 41 HA LEU 41 28.175 -1.637 7.514 149 HB2 LEU 41 HB2 LEU 41 28.899 -3.426 5.756 150 HB3 LEU 41 HB3 LEU 41 30.341 -3.684 6.781 151 HG LEU 41 HG LEU 41 28.644 -5.386 7.150 152 HD11 LEU 41 HD11 LEU 41 30.005 -4.693 9.148 153 HD12 LEU 41 HD12 LEU 41 28.400 -5.425 9.545 154 HD13 LEU 41 HD13 LEU 41 28.620 -3.649 9.681 155 HD21 LEU 41 HD21 LEU 41 26.398 -4.886 8.122 156 HD22 LEU 41 HD22 LEU 41 26.621 -4.180 6.479 157 HD23 LEU 41 HD23 LEU 41 26.716 -3.117 7.925 158 H LEU 42 H LEU 42 28.520 -1.104 9.648 159 HA LEU 42 HA LEU 42 31.084 0.009 10.207 160 HB2 LEU 42 HB2 LEU 42 28.621 -0.140 12.053 161 HB3 LEU 42 HB3 LEU 42 30.046 0.921 12.216 162 HG LEU 42 HG LEU 42 28.383 2.317 11.479 163 HD11 LEU 42 HD11 LEU 42 30.475 2.587 10.022 164 HD12 LEU 42 HD12 LEU 42 28.943 3.158 9.254 165 HD13 LEU 42 HD13 LEU 42 29.657 1.584 8.773 166 HD21 LEU 42 HD21 LEU 42 26.844 0.316 10.852 167 HD22 LEU 42 HD22 LEU 42 27.458 0.534 9.170 168 HD23 LEU 42 HD23 LEU 42 26.603 1.888 9.978 169 H GLY 43 H GLY 43 32.361 -2.038 10.358 170 HA2 GLY 43 HA2 GLY 43 33.638 -3.338 11.706 171 HA3 GLY 43 HA3 GLY 43 32.946 -2.405 13.076 172 H GLN 44 H GLN 44 31.288 -4.570 10.873 173 HA GLN 44 HA GLN 44 29.734 -6.092 11.165 174 HB2 GLN 44 HB2 GLN 44 30.380 -8.233 12.071 175 HB3 GLN 44 HB3 GLN 44 31.644 -7.510 11.036 176 HG2 GLN 44 HG2 GLN 44 32.963 -6.844 13.100 177 HG3 GLN 44 HG3 GLN 44 31.735 -7.669 14.123 178 HE21 GLN 44 HE21 GLN 44 31.274 -10.030 12.551 179 HE22 GLN 44 HE22 GLN 44 32.762 -10.952 12.553 180 H ASN 45 H ASN 45 29.083 -3.956 12.821 181 HA ASN 45 HA ASN 45 27.853 -5.207 15.155 182 HB2 ASN 45 HB2 ASN 45 27.832 -2.348 14.024 183 HB3 ASN 45 HB3 ASN 45 26.836 -2.855 15.447 184 HD21 ASN 45 HD21 ASN 45 30.111 -2.015 14.409 185 HD22 ASN 45 HD22 ASN 45 30.817 -2.176 15.997 186 H LYS 46 H LYS 46 26.445 -3.410 12.296 187 HA LYS 46 HA LYS 46 23.956 -4.937 12.817 188 HB2 LYS 46 HB2 LYS 46 24.243 -1.934 12.251 189 HB3 LYS 46 HB3 LYS 46 22.686 -2.842 12.249 190 HG2 LYS 46 HG2 LYS 46 22.988 -3.438 14.628 191 HG3 LYS 46 HG3 LYS 46 24.562 -2.583 14.666 192 HD2 LYS 46 HD2 LYS 46 22.887 -1.140 15.666 193 HD3 LYS 46 HD3 LYS 46 23.424 -0.427 14.116 194 HE2 LYS 46 HE2 LYS 46 20.995 -0.134 14.392 195 HE3 LYS 46 HE3 LYS 46 21.286 -1.270 13.015 196 HZ1 LYS 46 HZ1 LYS 46 20.874 -3.094 14.511 197 HZ2 LYS 46 HZ2 LYS 46 19.556 -2.022 14.488 198 HZ3 LYS 46 HZ3 LYS 46 20.621 -2.032 15.814 199 H LYS 47 H LYS 47 23.974 -2.450 10.347 200 HA LYS 47 HA LYS 47 24.148 -4.352 8.197 201 HB2 LYS 47 HB2 LYS 47 21.799 -4.013 7.489 202 HB3 LYS 47 HB3 LYS 47 21.883 -4.755 9.112 203 HG2 LYS 47 HG2 LYS 47 21.565 -2.338 10.079 204 HG3 LYS 47 HG3 LYS 47 21.195 -1.841 8.396 205 HD2 LYS 47 HD2 LYS 47 19.098 -2.240 9.497 206 HD3 LYS 47 HD3 LYS 47 19.344 -3.634 8.388 207 HE2 LYS 47 HE2 LYS 47 20.118 -5.038 10.347 208 HE3 LYS 47 HE3 LYS 47 19.932 -3.606 11.439 209 HZ1 LYS 47 HZ1 LYS 47 18.072 -5.168 11.439 210 HZ2 LYS 47 HZ2 LYS 47 17.736 -4.776 9.820 211 HZ3 LYS 47 HZ3 LYS 47 17.631 -3.579 11.026 212 H GLY 48 H GLY 48 23.877 -3.162 6.059 213 HA2 GLY 48 HA2 GLY 48 24.003 -0.306 6.158 214 HA3 GLY 48 HA3 GLY 48 25.611 -1.096 5.913 215 H HIS 49 H HIS 49 24.143 0.687 4.070 216 HA HIS 49 HA HIS 49 23.060 -1.123 2.055 217 HB2 HIS 49 HB2 HIS 49 21.778 0.882 2.896 218 HB3 HIS 49 HB3 HIS 49 23.068 1.937 2.246 219 HD2 HIS 49 HD2 HIS 49 22.165 3.017 -0.117 220 HE1 HIS 49 HE1 HIS 49 19.595 -0.172 -1.196 221 HE2 HIS 49 HE2 HIS 49 20.359 2.189 -1.765 222 H CYS 50 H CYS 50 23.935 -1.313 -0.086 223 HA CYS 50 HA CYS 50 26.715 -0.745 -0.278 224 HB2 CYS 50 HB2 CYS 50 24.772 -1.797 -2.396 225 HB3 CYS 50 HB3 CYS 50 26.555 -1.728 -2.589 226 H TYR 51 H TYR 51 27.834 0.734 -1.496 227 HA TYR 51 HA TYR 51 26.293 2.786 -2.969 228 HB2 TYR 51 HB2 TYR 51 29.016 3.240 -1.608 229 HB3 TYR 51 HB3 TYR 51 27.939 4.469 -2.363 230 HD1 TYR 51 HD1 TYR 51 29.302 4.306 0.341 231 HD2 TYR 51 HD2 TYR 51 25.264 3.539 -0.886 232 HE1 TYR 51 HE1 TYR 51 28.555 4.586 2.679 233 HE2 TYR 51 HE2 TYR 51 24.498 3.853 1.445 234 HH TYR 51 HH TYR 51 26.784 4.187 4.137 235 H LYS 52 H LYS 52 27.387 3.604 -4.850 236 HA LYS 52 HA LYS 52 29.502 1.852 -5.939 237 HB2 LYS 52 HB2 LYS 52 27.402 2.135 -7.310 238 HB3 LYS 52 HB3 LYS 52 27.705 3.898 -7.352 239 HG2 LYS 52 HG2 LYS 52 29.955 3.403 -8.523 240 HG3 LYS 52 HG3 LYS 52 29.451 1.686 -8.578 241 HD2 LYS 52 HD2 LYS 52 28.150 4.097 -9.969 242 HD3 LYS 52 HD3 LYS 52 29.003 2.711 -10.723 243 HE2 LYS 52 HE2 LYS 52 27.103 1.190 -9.876 244 HE3 LYS 52 HE3 LYS 52 26.247 2.701 -9.326 245 HZ1 LYS 52 HZ1 LYS 52 26.345 3.506 -11.580 246 HZ2 LYS 52 HZ2 LYS 52 25.548 2.007 -11.494 247 HZ3 LYS 52 HZ3 LYS 52 27.135 2.090 -12.093 248 H ILE 53 H ILE 53 31.570 2.725 -6.255 249 HA ILE 53 HA ILE 53 31.902 5.619 -5.807 250 HB ILE 53 HB ILE 53 33.900 3.362 -5.624 251 HG12 ILE 53 HG12 ILE 53 32.977 5.420 -3.542 252 HG13 ILE 53 HG13 ILE 53 32.309 3.768 -3.682 253 HG21 ILE 53 HG21 ILE 53 34.389 6.416 -5.557 254 HG22 ILE 53 HG22 ILE 53 35.068 5.231 -6.733 255 HG23 ILE 53 HG23 ILE 53 35.589 5.179 -5.025 256 HD11 ILE 53 HD11 ILE 53 34.599 2.800 -3.228 257 HD12 ILE 53 HD12 ILE 53 34.033 3.864 -1.887 258 HD13 ILE 53 HD13 ILE 53 35.264 4.467 -3.045 259 H ILE 54 H ILE 54 32.211 6.882 -7.469 260 HA ILE 54 HA ILE 54 33.444 5.854 -9.897 261 HB ILE 54 HB ILE 54 32.056 7.483 -11.169 262 HG12 ILE 54 HG12 ILE 54 31.264 8.707 -8.990 263 HG13 ILE 54 HG13 ILE 54 30.177 8.545 -10.409 264 HG21 ILE 54 HG21 ILE 54 30.098 5.944 -11.376 265 HG22 ILE 54 HG22 ILE 54 30.642 5.064 -9.895 266 HG23 ILE 54 HG23 ILE 54 31.682 5.070 -11.364 267 HD11 ILE 54 HD11 ILE 54 30.009 6.845 -7.818 268 HD12 ILE 54 HD12 ILE 54 28.979 6.620 -9.281 269 HD13 ILE 54 HD13 ILE 54 28.893 8.142 -8.348 270 H GLY 55 H GLY 55 34.828 7.403 -11.005 271 HA2 GLY 55 HA2 GLY 55 35.095 10.027 -10.344 272 HA3 GLY 55 HA3 GLY 55 36.174 9.101 -9.220 273 H ASN 56 H ASN 56 37.853 10.383 -10.387 274 HA ASN 56 HA ASN 56 38.487 9.417 -13.049 275 HB2 ASN 56 HB2 ASN 56 40.185 11.258 -13.026 276 HB3 ASN 56 HB3 ASN 56 38.503 11.833 -12.722 277 HD21 ASN 56 HD21 ASN 56 40.084 13.704 -11.945 278 HD22 ASN 56 HD22 ASN 56 40.362 13.677 -10.216 Start of MODEL 10 1 H1 PHE 17 HT1 PHE 17 35.411 13.853 -7.081 2 H2 PHE 17 HT2 PHE 17 34.932 13.029 -8.483 3 H3 PHE 17 HT3 PHE 17 36.359 12.579 -7.686 4 HA PHE 17 HA PHE 17 34.662 11.008 -7.203 5 HB2 PHE 17 HB2 PHE 17 36.413 11.497 -5.547 6 HB3 PHE 17 HB3 PHE 17 35.444 12.870 -4.895 7 HD1 PHE 17 HD1 PHE 17 35.614 12.087 -2.680 8 HD2 PHE 17 HD2 PHE 17 33.800 9.521 -5.634 9 HE1 PHE 17 HE1 PHE 17 34.612 10.707 -0.888 10 HE2 PHE 17 HE2 PHE 17 32.750 8.231 -3.869 11 HZ PHE 17 HZ PHE 17 33.167 8.774 -1.474 12 H ASP 18 H ASP 18 32.558 10.620 -7.516 13 HA ASP 18 HA ASP 18 30.667 12.088 -5.815 14 HB2 ASP 18 HB2 ASP 18 30.114 10.842 -8.590 15 HB3 ASP 18 HB3 ASP 18 28.830 11.448 -7.462 16 H VAL 19 H VAL 19 29.197 10.703 -4.637 17 HA VAL 19 HA VAL 19 29.744 7.825 -4.911 18 HB VAL 19 HB VAL 19 30.768 8.653 -2.839 19 HG11 VAL 19 HG11 VAL 19 29.382 9.505 -0.969 20 HG12 VAL 19 HG12 VAL 19 27.922 9.528 -2.015 21 HG13 VAL 19 HG13 VAL 19 29.310 10.627 -2.374 22 HG21 VAL 19 HG21 VAL 19 29.834 6.329 -3.015 23 HG22 VAL 19 HG22 VAL 19 28.258 6.915 -2.357 24 HG23 VAL 19 HG23 VAL 19 29.737 6.983 -1.338 25 H VAL 20 H VAL 20 27.953 6.571 -5.185 26 HA VAL 20 HA VAL 20 25.327 7.782 -4.723 27 HB VAL 20 HB VAL 20 24.403 6.720 -6.755 28 HG11 VAL 20 HG11 VAL 20 26.746 8.612 -7.431 29 HG12 VAL 20 HG12 VAL 20 25.164 9.157 -6.749 30 HG13 VAL 20 HG13 VAL 20 25.232 8.373 -8.375 31 HG21 VAL 20 HG21 VAL 20 25.946 5.883 -8.537 32 HG22 VAL 20 HG22 VAL 20 26.172 4.920 -7.031 33 HG23 VAL 20 HG23 VAL 20 27.371 6.182 -7.474 34 H SER 21 H SER 21 23.599 6.058 -4.457 35 HA SER 21 HA SER 21 24.691 3.777 -3.075 36 HB2 SER 21 HB2 SER 21 22.363 3.180 -2.568 37 HB3 SER 21 HB3 SER 21 22.684 4.903 -2.170 38 HG SER 21 HG SER 21 20.694 4.510 -3.336 39 H CYS 22 H CYS 22 24.322 1.559 -3.648 40 HA CYS 22 HA CYS 22 24.162 1.095 -6.526 41 HB2 CYS 22 HB2 CYS 22 25.952 0.165 -4.902 42 HB3 CYS 22 HB3 CYS 22 24.665 -0.906 -4.270 43 H ASN 23 H ASN 23 22.093 1.327 -3.987 44 HA ASN 23 HA ASN 23 20.133 0.647 -3.296 45 HB2 ASN 23 HB2 ASN 23 19.589 1.520 -5.652 46 HB3 ASN 23 HB3 ASN 23 19.550 -0.201 -6.191 47 HD21 ASN 23 HD21 ASN 23 17.309 -0.321 -6.633 48 HD22 ASN 23 HD22 ASN 23 16.074 -0.114 -5.408 49 H LYS 24 H LYS 24 22.040 -1.185 -2.658 50 HA LYS 24 HA LYS 24 20.500 -3.678 -2.679 51 HB2 LYS 24 HB2 LYS 24 22.433 -3.874 -4.319 52 HB3 LYS 24 HB3 LYS 24 23.551 -3.439 -2.999 53 HG2 LYS 24 HG2 LYS 24 23.663 -5.823 -3.267 54 HG3 LYS 24 HG3 LYS 24 22.782 -5.564 -1.741 55 HD2 LYS 24 HD2 LYS 24 20.618 -6.027 -2.872 56 HD3 LYS 24 HD3 LYS 24 21.435 -5.987 -4.473 57 HE2 LYS 24 HE2 LYS 24 22.745 -8.048 -3.876 58 HE3 LYS 24 HE3 LYS 24 21.906 -8.109 -2.267 59 HZ1 LYS 24 HZ1 LYS 24 20.898 -9.522 -3.945 60 HZ2 LYS 24 HZ2 LYS 24 20.564 -8.171 -4.919 61 HZ3 LYS 24 HZ3 LYS 24 19.825 -8.323 -3.398 62 H ASN 25 H ASN 25 20.371 -4.598 -0.643 63 HA ASN 25 HA ASN 25 21.379 -3.024 1.588 64 HB2 ASN 25 HB2 ASN 25 18.918 -3.721 1.342 65 HB3 ASN 25 HB3 ASN 25 19.454 -5.433 1.498 66 HD21 ASN 25 HD21 ASN 25 20.807 -5.811 3.651 67 HD22 ASN 25 HD22 ASN 25 20.090 -5.107 5.076 68 H CYS 26 H CYS 26 22.988 -3.847 3.079 69 HA CYS 26 HA CYS 26 23.779 -6.641 2.672 70 HB2 CYS 26 HB2 CYS 26 26.162 -6.027 2.889 71 HB3 CYS 26 HB3 CYS 26 25.406 -5.321 1.435 72 H THR 27 H THR 27 24.658 -7.697 4.524 73 HA THR 27 HA THR 27 24.001 -6.395 7.093 74 HB THR 27 HB THR 27 23.508 -9.320 6.362 75 HG1 THR 27 HG1 THR 27 21.342 -8.735 6.596 76 HG21 THR 27 HG21 THR 27 22.264 -9.320 8.594 77 HG22 THR 27 HG22 THR 27 22.856 -7.648 8.897 78 HG23 THR 27 HG23 THR 27 24.020 -9.026 8.805 79 H SER 28 H SER 28 25.470 -7.127 8.850 80 HA SER 28 HA SER 28 27.952 -6.689 7.953 81 HB2 SER 28 HB2 SER 28 28.672 -7.050 10.336 82 HB3 SER 28 HB3 SER 28 27.140 -6.118 10.207 83 HG SER 28 HG SER 28 26.874 -7.682 11.746 84 H GLY 29 H GLY 29 26.856 -9.988 8.952 85 HA2 GLY 29 HA2 GLY 29 29.509 -11.060 8.479 86 HA3 GLY 29 HA3 GLY 29 27.988 -11.964 8.801 87 H GLN 30 H GLN 30 26.368 -11.359 6.788 88 HA GLN 30 HA GLN 30 27.271 -12.983 4.744 89 HB2 GLN 30 HB2 GLN 30 24.890 -11.017 4.658 90 HB3 GLN 30 HB3 GLN 30 25.172 -12.440 3.613 91 HG2 GLN 30 HG2 GLN 30 23.650 -13.384 5.019 92 HG3 GLN 30 HG3 GLN 30 25.162 -13.842 5.878 93 HE21 GLN 30 HE21 GLN 30 22.108 -12.216 6.148 94 HE22 GLN 30 HE22 GLN 30 22.361 -11.610 7.767 95 H ASN 31 H ASN 31 26.927 -9.446 4.794 96 HA ASN 31 HA ASN 31 27.559 -7.794 3.585 97 HB2 ASN 31 HB2 ASN 31 29.594 -9.048 4.740 98 HB3 ASN 31 HB3 ASN 31 30.142 -9.338 3.061 99 HD21 ASN 31 HD21 ASN 31 30.159 -7.183 5.704 100 HD22 ASN 31 HD22 ASN 31 30.723 -5.740 4.903 101 H GLU 32 H GLU 32 25.835 -9.168 1.808 102 HA GLU 32 HA GLU 32 27.111 -9.555 -0.701 103 HB2 GLU 32 HB2 GLU 32 24.139 -9.059 -0.083 104 HB3 GLU 32 HB3 GLU 32 24.775 -9.516 -1.668 105 HG2 GLU 32 HG2 GLU 32 24.015 -11.568 -0.928 106 HG3 GLU 32 HG3 GLU 32 25.747 -11.686 -0.453 107 H CYS 33 H CYS 33 27.821 -8.030 -2.166 108 HA CYS 33 HA CYS 33 25.871 -6.011 -2.836 109 HB2 CYS 33 HB2 CYS 33 28.897 -5.438 -2.780 110 HB3 CYS 33 HB3 CYS 33 27.662 -4.371 -3.512 111 HA PRO 34 HA PRO 34 27.201 -7.998 -6.704 112 HB2 PRO 34 HB2 PRO 34 26.428 -6.154 -8.653 113 HB3 PRO 34 HB3 PRO 34 25.218 -7.111 -7.709 114 HG2 PRO 34 HG2 PRO 34 26.243 -4.289 -7.084 115 HG3 PRO 34 HG3 PRO 34 24.516 -4.813 -7.269 116 HD2 PRO 34 HD2 PRO 34 25.706 -4.656 -4.792 117 HD3 PRO 34 HD3 PRO 34 24.604 -6.058 -5.192 118 H GLU 35 H GLU 35 28.850 -7.676 -8.494 119 HA GLU 35 HA GLU 35 31.162 -6.582 -7.385 120 HB2 GLU 35 HB2 GLU 35 31.111 -8.515 -8.938 121 HB3 GLU 35 HB3 GLU 35 30.551 -7.444 -10.259 122 HG2 GLU 35 HG2 GLU 35 32.757 -6.200 -10.207 123 HG3 GLU 35 HG3 GLU 35 33.312 -7.248 -8.841 124 H GLY 36 H GLY 36 32.198 -4.645 -7.522 125 HA2 GLY 36 HA2 GLY 36 32.763 -2.616 -8.522 126 HA3 GLY 36 HA3 GLY 36 31.205 -2.610 -9.416 127 H CYS 37 H CYS 37 30.060 -3.575 -6.599 128 HA CYS 37 HA CYS 37 29.925 -0.878 -5.420 129 HB2 CYS 37 HB2 CYS 37 27.878 -3.158 -5.358 130 HB3 CYS 37 HB3 CYS 37 27.733 -1.605 -4.457 131 H PHE 38 H PHE 38 29.874 -0.746 -3.073 132 HA PHE 38 HA PHE 38 30.914 -3.126 -1.690 133 HB2 PHE 38 HB2 PHE 38 32.673 -1.804 -0.552 134 HB3 PHE 38 HB3 PHE 38 32.912 -1.714 -2.339 135 HD1 PHE 38 HD1 PHE 38 32.071 0.334 -3.565 136 HD2 PHE 38 HD2 PHE 38 32.336 0.170 0.722 137 HE1 PHE 38 HE1 PHE 38 31.778 2.757 -3.465 138 HE2 PHE 38 HE2 PHE 38 32.182 2.640 0.825 139 HZ PHE 38 HZ PHE 38 31.872 3.947 -1.260 140 H CYS 39 H CYS 39 30.722 -3.055 0.651 141 HA CYS 39 HA CYS 39 28.080 -2.050 1.261 142 HB2 CYS 39 HB2 CYS 39 28.582 -4.420 1.559 143 HB3 CYS 39 HB3 CYS 39 29.965 -4.039 2.625 144 H GLY 40 H GLY 40 27.664 -0.270 2.496 145 HA2 GLY 40 HA2 GLY 40 29.791 0.961 4.014 146 HA3 GLY 40 HA3 GLY 40 28.070 1.465 3.829 147 H LEU 41 H LEU 41 29.767 -1.346 5.272 148 HA LEU 41 HA LEU 41 28.245 -0.821 7.755 149 HB2 LEU 41 HB2 LEU 41 27.473 -2.881 6.613 150 HB3 LEU 41 HB3 LEU 41 29.143 -3.507 6.566 151 HG LEU 41 HG LEU 41 27.578 -4.507 8.259 152 HD11 LEU 41 HD11 LEU 41 30.060 -4.736 8.507 153 HD12 LEU 41 HD12 LEU 41 29.179 -4.748 10.085 154 HD13 LEU 41 HD13 LEU 41 30.081 -3.283 9.578 155 HD21 LEU 41 HD21 LEU 41 26.418 -2.398 8.977 156 HD22 LEU 41 HD22 LEU 41 27.906 -1.913 9.882 157 HD23 LEU 41 HD23 LEU 41 27.019 -3.415 10.338 158 H LEU 42 H LEU 42 29.553 -0.174 9.400 159 HA LEU 42 HA LEU 42 32.442 -0.726 9.127 160 HB2 LEU 42 HB2 LEU 42 31.099 1.696 10.476 161 HB3 LEU 42 HB3 LEU 42 32.851 1.386 10.310 162 HG LEU 42 HG LEU 42 32.370 3.054 8.777 163 HD11 LEU 42 HD11 LEU 42 32.232 0.602 6.919 164 HD12 LEU 42 HD12 LEU 42 33.733 1.068 7.784 165 HD13 LEU 42 HD13 LEU 42 32.977 2.203 6.593 166 HD21 LEU 42 HD21 LEU 42 30.452 3.361 7.463 167 HD22 LEU 42 HD22 LEU 42 29.783 2.403 8.862 168 HD23 LEU 42 HD23 LEU 42 30.141 1.594 7.306 169 H GLY 43 H GLY 43 33.541 -1.363 11.022 170 HA2 GLY 43 HA2 GLY 43 33.908 -1.788 13.184 171 HA3 GLY 43 HA3 GLY 43 32.402 -0.892 13.567 172 H GLN 44 H GLN 44 31.921 -3.479 11.478 173 HA GLN 44 HA GLN 44 30.690 -5.290 11.583 174 HB2 GLN 44 HB2 GLN 44 32.271 -5.817 14.156 175 HB3 GLN 44 HB3 GLN 44 31.259 -7.045 13.329 176 HG2 GLN 44 HG2 GLN 44 32.706 -6.896 11.270 177 HG3 GLN 44 HG3 GLN 44 33.721 -5.645 12.078 178 HE21 GLN 44 HE21 GLN 44 32.415 -8.971 12.861 179 HE22 GLN 44 HE22 GLN 44 33.934 -9.541 13.516 180 H ASN 45 H ASN 45 29.188 -3.153 12.409 181 HA ASN 45 HA ASN 45 27.753 -3.908 14.815 182 HB2 ASN 45 HB2 ASN 45 27.456 -1.565 12.847 183 HB3 ASN 45 HB3 ASN 45 26.377 -1.824 14.281 184 HD21 ASN 45 HD21 ASN 45 29.581 -0.650 13.297 185 HD22 ASN 45 HD22 ASN 45 30.025 -0.185 14.915 186 H LYS 46 H LYS 46 25.651 -2.595 12.391 187 HA LYS 46 HA LYS 46 24.068 -5.057 12.542 188 HB2 LYS 46 HB2 LYS 46 22.151 -3.454 12.171 189 HB3 LYS 46 HB3 LYS 46 23.062 -3.236 13.682 190 HG2 LYS 46 HG2 LYS 46 24.037 -1.216 13.049 191 HG3 LYS 46 HG3 LYS 46 23.842 -1.466 11.295 192 HD2 LYS 46 HD2 LYS 46 22.349 0.287 12.186 193 HD3 LYS 46 HD3 LYS 46 21.444 -1.050 11.416 194 HE2 LYS 46 HE2 LYS 46 20.801 -1.957 13.656 195 HE3 LYS 46 HE3 LYS 46 21.835 -0.707 14.474 196 HZ1 LYS 46 HZ1 LYS 46 20.462 0.989 13.492 197 HZ2 LYS 46 HZ2 LYS 46 19.528 -0.095 14.406 198 HZ3 LYS 46 HZ3 LYS 46 19.502 -0.176 12.710 199 H LYS 47 H LYS 47 22.966 -2.746 10.306 200 HA LYS 47 HA LYS 47 23.672 -4.419 8.000 201 HB2 LYS 47 HB2 LYS 47 21.175 -2.708 8.535 202 HB3 LYS 47 HB3 LYS 47 21.554 -3.484 6.961 203 HG2 LYS 47 HG2 LYS 47 21.415 -5.717 7.952 204 HG3 LYS 47 HG3 LYS 47 21.140 -5.033 9.591 205 HD2 LYS 47 HD2 LYS 47 19.039 -3.971 8.821 206 HD3 LYS 47 HD3 LYS 47 19.267 -4.625 7.166 207 HE2 LYS 47 HE2 LYS 47 18.990 -6.941 7.959 208 HE3 LYS 47 HE3 LYS 47 19.074 -6.407 9.693 209 HZ1 LYS 47 HZ1 LYS 47 17.094 -5.186 9.412 210 HZ2 LYS 47 HZ2 LYS 47 16.825 -6.793 8.926 211 HZ3 LYS 47 HZ3 LYS 47 16.987 -5.567 7.757 212 H GLY 48 H GLY 48 24.011 -3.270 6.031 213 HA2 GLY 48 HA2 GLY 48 24.443 -0.379 6.258 214 HA3 GLY 48 HA3 GLY 48 25.724 -1.473 5.588 215 H HIS 49 H HIS 49 24.907 0.366 3.839 216 HA HIS 49 HA HIS 49 23.162 -1.233 2.052 217 HB2 HIS 49 HB2 HIS 49 22.092 0.921 3.145 218 HB3 HIS 49 HB3 HIS 49 23.232 1.832 2.107 219 HD2 HIS 49 HD2 HIS 49 21.813 2.497 -0.298 220 HE1 HIS 49 HE1 HIS 49 19.096 -0.765 -0.026 221 HE2 HIS 49 HE2 HIS 49 19.695 1.397 -1.297 222 H CYS 50 H CYS 50 23.912 -1.234 -0.168 223 HA CYS 50 HA CYS 50 26.756 -0.893 -0.252 224 HB2 CYS 50 HB2 CYS 50 24.794 -1.813 -2.399 225 HB3 CYS 50 HB3 CYS 50 26.586 -1.892 -2.555 226 H TYR 51 H TYR 51 28.018 0.506 -1.501 227 HA TYR 51 HA TYR 51 26.577 2.688 -2.911 228 HB2 TYR 51 HB2 TYR 51 29.383 3.006 -1.682 229 HB3 TYR 51 HB3 TYR 51 28.304 4.275 -2.354 230 HD1 TYR 51 HD1 TYR 51 29.493 2.813 0.532 231 HD2 TYR 51 HD2 TYR 51 25.880 4.460 -1.106 232 HE1 TYR 51 HE1 TYR 51 28.664 3.171 2.792 233 HE2 TYR 51 HE2 TYR 51 24.990 4.766 1.204 234 HH TYR 51 HH TYR 51 26.813 3.587 4.043 235 H LYS 52 H LYS 52 27.800 3.696 -4.658 236 HA LYS 52 HA LYS 52 30.018 2.084 -5.751 237 HB2 LYS 52 HB2 LYS 52 27.933 1.943 -7.156 238 HB3 LYS 52 HB3 LYS 52 27.924 3.727 -7.276 239 HG2 LYS 52 HG2 LYS 52 30.231 3.578 -8.416 240 HG3 LYS 52 HG3 LYS 52 30.030 1.797 -8.423 241 HD2 LYS 52 HD2 LYS 52 28.211 3.873 -9.786 242 HD3 LYS 52 HD3 LYS 52 29.400 2.802 -10.598 243 HE2 LYS 52 HE2 LYS 52 28.030 0.786 -9.961 244 HE3 LYS 52 HE3 LYS 52 26.830 1.870 -9.138 245 HZ1 LYS 52 HZ1 LYS 52 26.079 1.416 -11.284 246 HZ2 LYS 52 HZ2 LYS 52 27.557 1.843 -12.011 247 HZ3 LYS 52 HZ3 LYS 52 26.591 3.032 -11.271 248 H ILE 53 H ILE 53 31.915 3.260 -6.094 249 HA ILE 53 HA ILE 53 31.865 6.179 -5.728 250 HB ILE 53 HB ILE 53 34.107 4.162 -5.453 251 HG12 ILE 53 HG12 ILE 53 33.144 6.248 -3.426 252 HG13 ILE 53 HG13 ILE 53 32.437 4.627 -3.507 253 HG21 ILE 53 HG21 ILE 53 35.604 6.171 -4.939 254 HG22 ILE 53 HG22 ILE 53 34.292 7.244 -5.549 255 HG23 ILE 53 HG23 ILE 53 35.098 6.067 -6.654 256 HD11 ILE 53 HD11 ILE 53 34.207 4.704 -1.763 257 HD12 ILE 53 HD12 ILE 53 35.420 5.310 -2.948 258 HD13 ILE 53 HD13 ILE 53 34.760 3.635 -3.098 259 H ILE 54 H ILE 54 32.114 7.432 -7.467 260 HA ILE 54 HA ILE 54 33.484 6.385 -9.803 261 HB ILE 54 HB ILE 54 31.889 7.561 -11.286 262 HG12 ILE 54 HG12 ILE 54 30.888 8.995 -9.371 263 HG13 ILE 54 HG13 ILE 54 29.823 8.401 -10.686 264 HG21 ILE 54 HG21 ILE 54 31.891 5.106 -11.057 265 HG22 ILE 54 HG22 ILE 54 30.217 5.730 -11.324 266 HG23 ILE 54 HG23 ILE 54 30.742 5.209 -9.678 267 HD11 ILE 54 HD11 ILE 54 28.723 8.253 -8.449 268 HD12 ILE 54 HD12 ILE 54 29.978 7.119 -7.855 269 HD13 ILE 54 HD13 ILE 54 28.894 6.634 -9.206 270 H GLY 55 H GLY 55 34.327 8.105 -11.224 271 HA2 GLY 55 HA2 GLY 55 35.196 10.187 -11.585 272 HA3 GLY 55 HA3 GLY 55 34.618 10.736 -9.977 273 H ASN 56 H ASN 56 36.239 7.754 -9.754 274 HA ASN 56 HA ASN 56 38.490 8.991 -8.480 275 HB2 ASN 56 HB2 ASN 56 39.012 6.659 -7.746 276 HB3 ASN 56 HB3 ASN 56 37.309 7.121 -7.400 277 HD21 ASN 56 HD21 ASN 56 39.124 4.543 -8.516 278 HD22 ASN 56 HD22 ASN 56 37.908 3.783 -9.513 Start of MODEL 11 1 H1 PHE 17 HT1 PHE 17 36.651 12.447 -6.798 2 H2 PHE 17 HT2 PHE 17 35.769 13.610 -5.938 3 H3 PHE 17 HT3 PHE 17 35.177 13.042 -7.419 4 HA PHE 17 HA PHE 17 34.881 10.859 -6.491 5 HB2 PHE 17 HB2 PHE 17 36.829 10.917 -5.028 6 HB3 PHE 17 HB3 PHE 17 36.061 12.182 -3.995 7 HD1 PHE 17 HD1 PHE 17 36.359 10.993 -1.990 8 HD2 PHE 17 HD2 PHE 17 34.147 9.104 -5.171 9 HE1 PHE 17 HE1 PHE 17 35.464 9.327 -0.397 10 HE2 PHE 17 HE2 PHE 17 33.209 7.521 -3.576 11 HZ PHE 17 HZ PHE 17 33.875 7.589 -1.182 12 H ASP 18 H ASP 18 32.768 10.634 -6.650 13 HA ASP 18 HA ASP 18 31.069 11.846 -4.591 14 HB2 ASP 18 HB2 ASP 18 30.317 11.075 -7.492 15 HB3 ASP 18 HB3 ASP 18 29.118 11.539 -6.215 16 H VAL 19 H VAL 19 29.499 10.297 -3.661 17 HA VAL 19 HA VAL 19 30.040 7.502 -4.407 18 HB VAL 19 HB VAL 19 31.164 7.984 -2.287 19 HG11 VAL 19 HG11 VAL 19 29.746 9.855 -1.434 20 HG12 VAL 19 HG12 VAL 19 29.870 8.519 -0.236 21 HG13 VAL 19 HG13 VAL 19 28.364 8.715 -1.198 22 HG21 VAL 19 HG21 VAL 19 30.190 6.095 -1.023 23 HG22 VAL 19 HG22 VAL 19 30.201 5.720 -2.787 24 HG23 VAL 19 HG23 VAL 19 28.664 6.197 -1.967 25 H VAL 20 H VAL 20 28.236 6.308 -4.832 26 HA VAL 20 HA VAL 20 25.631 7.443 -4.123 27 HB VAL 20 HB VAL 20 24.651 6.714 -6.277 28 HG11 VAL 20 HG11 VAL 20 26.959 8.757 -6.547 29 HG12 VAL 20 HG12 VAL 20 25.301 9.087 -5.921 30 HG13 VAL 20 HG13 VAL 20 25.535 8.603 -7.645 31 HG21 VAL 20 HG21 VAL 20 26.341 4.961 -6.894 32 HG22 VAL 20 HG22 VAL 20 27.596 6.227 -7.095 33 HG23 VAL 20 HG23 VAL 20 26.172 6.188 -8.202 34 H SER 21 H SER 21 23.891 5.764 -4.090 35 HA SER 21 HA SER 21 24.958 3.290 -3.049 36 HB2 SER 21 HB2 SER 21 22.635 2.875 -2.329 37 HB3 SER 21 HB3 SER 21 23.277 4.457 -1.764 38 HG SER 21 HG SER 21 21.378 4.986 -2.579 39 H CYS 22 H CYS 22 24.460 1.210 -3.766 40 HA CYS 22 HA CYS 22 23.624 0.964 -6.572 41 HB2 CYS 22 HB2 CYS 22 24.794 -1.089 -4.612 42 HB3 CYS 22 HB3 CYS 22 24.336 -1.432 -6.319 43 H ASN 23 H ASN 23 22.232 1.156 -3.687 44 HA ASN 23 HA ASN 23 20.399 0.660 -2.662 45 HB2 ASN 23 HB2 ASN 23 19.637 1.819 -4.800 46 HB3 ASN 23 HB3 ASN 23 19.194 0.192 -5.441 47 HD21 ASN 23 HD21 ASN 23 16.965 0.541 -5.471 48 HD22 ASN 23 HD22 ASN 23 15.984 0.806 -4.035 49 H LYS 24 H LYS 24 22.006 -1.451 -2.479 50 HA LYS 24 HA LYS 24 20.139 -3.655 -2.085 51 HB2 LYS 24 HB2 LYS 24 23.035 -3.807 -3.114 52 HB3 LYS 24 HB3 LYS 24 22.216 -5.219 -2.372 53 HG2 LYS 24 HG2 LYS 24 21.038 -3.756 -4.793 54 HG3 LYS 24 HG3 LYS 24 22.242 -5.063 -4.999 55 HD2 LYS 24 HD2 LYS 24 19.848 -5.611 -3.204 56 HD3 LYS 24 HD3 LYS 24 19.597 -5.569 -4.994 57 HE2 LYS 24 HE2 LYS 24 21.366 -7.336 -5.271 58 HE3 LYS 24 HE3 LYS 24 21.607 -7.369 -3.473 59 HZ1 LYS 24 HZ1 LYS 24 20.136 -9.090 -4.210 60 HZ2 LYS 24 HZ2 LYS 24 19.081 -7.964 -4.922 61 HZ3 LYS 24 HZ3 LYS 24 19.297 -7.979 -3.237 62 H ASN 25 H ASN 25 20.522 -4.705 0.032 63 HA ASN 25 HA ASN 25 22.109 -3.039 1.807 64 HB2 ASN 25 HB2 ASN 25 21.134 -4.321 3.645 65 HB3 ASN 25 HB3 ASN 25 19.845 -3.820 2.495 66 HD21 ASN 25 HD21 ASN 25 21.259 -6.537 4.110 67 HD22 ASN 25 HD22 ASN 25 20.270 -7.745 3.348 68 H CYS 26 H CYS 26 23.497 -4.409 3.525 69 HA CYS 26 HA CYS 26 24.402 -6.901 2.318 70 HB2 CYS 26 HB2 CYS 26 26.672 -6.661 2.885 71 HB3 CYS 26 HB3 CYS 26 26.224 -5.217 1.963 72 H THR 27 H THR 27 25.614 -8.083 4.445 73 HA THR 27 HA THR 27 24.329 -7.191 6.890 74 HB THR 27 HB THR 27 24.607 -10.191 6.281 75 HG1 THR 27 HG1 THR 27 22.571 -10.331 5.862 76 HG21 THR 27 HG21 THR 27 22.989 -8.661 8.434 77 HG22 THR 27 HG22 THR 27 24.657 -9.255 8.758 78 HG23 THR 27 HG23 THR 27 23.329 -10.425 8.399 79 H SER 28 H SER 28 26.012 -7.426 8.553 80 HA SER 28 HA SER 28 28.438 -6.861 7.472 81 HB2 SER 28 HB2 SER 28 27.671 -6.165 9.731 82 HB3 SER 28 HB3 SER 28 27.832 -7.838 10.330 83 HG SER 28 HG SER 28 30.106 -7.656 9.819 84 H GLY 29 H GLY 29 27.624 -10.090 8.916 85 HA2 GLY 29 HA2 GLY 29 30.243 -11.137 8.499 86 HA3 GLY 29 HA3 GLY 29 28.734 -12.057 8.812 87 H GLN 30 H GLN 30 27.257 -11.400 6.556 88 HA GLN 30 HA GLN 30 28.345 -13.188 4.626 89 HB2 GLN 30 HB2 GLN 30 25.907 -11.312 4.578 90 HB3 GLN 30 HB3 GLN 30 26.262 -12.549 3.323 91 HG2 GLN 30 HG2 GLN 30 26.029 -14.390 4.971 92 HG3 GLN 30 HG3 GLN 30 25.752 -13.204 6.299 93 HE21 GLN 30 HE21 GLN 30 24.137 -15.178 4.039 94 HE22 GLN 30 HE22 GLN 30 22.587 -14.374 4.104 95 H ASN 31 H ASN 31 27.902 -9.700 4.775 96 HA ASN 31 HA ASN 31 28.337 -7.978 3.637 97 HB2 ASN 31 HB2 ASN 31 30.653 -8.910 4.438 98 HB3 ASN 31 HB3 ASN 31 30.949 -9.294 2.707 99 HD21 ASN 31 HD21 ASN 31 29.922 -6.650 4.924 100 HD22 ASN 31 HD22 ASN 31 30.668 -5.337 4.063 101 H GLU 32 H GLU 32 26.519 -9.412 2.253 102 HA GLU 32 HA GLU 32 27.021 -9.894 -0.453 103 HB2 GLU 32 HB2 GLU 32 24.524 -9.060 1.104 104 HB3 GLU 32 HB3 GLU 32 24.397 -9.409 -0.613 105 HG2 GLU 32 HG2 GLU 32 25.358 -11.426 1.568 106 HG3 GLU 32 HG3 GLU 32 23.698 -11.341 0.863 107 H CYS 33 H CYS 33 27.501 -8.538 -2.157 108 HA CYS 33 HA CYS 33 25.697 -6.364 -2.507 109 HB2 CYS 33 HB2 CYS 33 28.731 -5.977 -2.891 110 HB3 CYS 33 HB3 CYS 33 27.501 -4.888 -3.593 111 HA PRO 34 HA PRO 34 26.262 -8.253 -6.606 112 HB2 PRO 34 HB2 PRO 34 25.545 -6.168 -8.331 113 HB3 PRO 34 HB3 PRO 34 24.323 -7.054 -7.337 114 HG2 PRO 34 HG2 PRO 34 25.740 -4.426 -6.620 115 HG3 PRO 34 HG3 PRO 34 23.953 -4.741 -6.657 116 HD2 PRO 34 HD2 PRO 34 25.378 -4.926 -4.318 117 HD3 PRO 34 HD3 PRO 34 24.105 -6.175 -4.689 118 H GLU 35 H GLU 35 27.810 -8.100 -8.456 119 HA GLU 35 HA GLU 35 30.303 -7.329 -7.480 120 HB2 GLU 35 HB2 GLU 35 29.914 -9.231 -9.012 121 HB3 GLU 35 HB3 GLU 35 29.427 -8.098 -10.310 122 HG2 GLU 35 HG2 GLU 35 31.768 -7.155 -10.400 123 HG3 GLU 35 HG3 GLU 35 32.261 -8.240 -9.039 124 H GLY 36 H GLY 36 31.600 -5.559 -7.692 125 HA2 GLY 36 HA2 GLY 36 32.400 -3.643 -8.732 126 HA3 GLY 36 HA3 GLY 36 30.830 -3.426 -9.576 127 H CYS 37 H CYS 37 29.713 -4.174 -6.667 128 HA CYS 37 HA CYS 37 29.923 -1.431 -5.601 129 HB2 CYS 37 HB2 CYS 37 27.697 -3.512 -5.257 130 HB3 CYS 37 HB3 CYS 37 27.739 -1.884 -4.487 131 H PHE 38 H PHE 38 29.967 -1.250 -3.217 132 HA PHE 38 HA PHE 38 30.873 -3.666 -1.824 133 HB2 PHE 38 HB2 PHE 38 32.848 -2.529 -0.867 134 HB3 PHE 38 HB3 PHE 38 32.957 -2.395 -2.660 135 HD1 PHE 38 HD1 PHE 38 32.157 -0.232 -3.764 136 HD2 PHE 38 HD2 PHE 38 32.751 -0.569 0.481 137 HE1 PHE 38 HE1 PHE 38 31.954 2.191 -3.548 138 HE2 PHE 38 HE2 PHE 38 32.678 1.898 0.687 139 HZ PHE 38 HZ PHE 38 32.255 3.293 -1.325 140 H CYS 39 H CYS 39 30.722 -3.321 0.635 141 HA CYS 39 HA CYS 39 28.654 -1.270 1.225 142 HB2 CYS 39 HB2 CYS 39 27.763 -3.539 1.245 143 HB3 CYS 39 HB3 CYS 39 29.052 -4.088 2.371 144 H GLY 40 H GLY 40 29.412 0.312 2.494 145 HA2 GLY 40 HA2 GLY 40 31.883 -0.098 4.020 146 HA3 GLY 40 HA3 GLY 40 30.950 1.428 3.772 147 H LEU 41 H LEU 41 31.292 -1.505 5.681 148 HA LEU 41 HA LEU 41 28.812 -0.923 7.110 149 HB2 LEU 41 HB2 LEU 41 29.402 -3.168 6.009 150 HB3 LEU 41 HB3 LEU 41 30.646 -3.380 7.269 151 HG LEU 41 HG LEU 41 28.596 -4.652 7.681 152 HD11 LEU 41 HD11 LEU 41 29.867 -3.889 9.700 153 HD12 LEU 41 HD12 LEU 41 28.100 -4.123 10.011 154 HD13 LEU 41 HD13 LEU 41 28.748 -2.467 9.842 155 HD21 LEU 41 HD21 LEU 41 26.441 -3.880 7.857 156 HD22 LEU 41 HD22 LEU 41 27.090 -2.877 6.527 157 HD23 LEU 41 HD23 LEU 41 26.887 -2.174 8.186 158 H LEU 42 H LEU 42 28.895 0.178 8.999 159 HA LEU 42 HA LEU 42 31.394 0.544 10.348 160 HB2 LEU 42 HB2 LEU 42 29.761 2.067 11.799 161 HB3 LEU 42 HB3 LEU 42 30.427 2.578 10.236 162 HG LEU 42 HG LEU 42 28.019 3.128 10.739 163 HD11 LEU 42 HD11 LEU 42 27.273 2.980 8.412 164 HD12 LEU 42 HD12 LEU 42 28.532 1.760 8.020 165 HD13 LEU 42 HD13 LEU 42 29.014 3.426 8.499 166 HD21 LEU 42 HD21 LEU 42 26.210 1.630 10.251 167 HD22 LEU 42 HD22 LEU 42 27.223 0.853 11.525 168 HD23 LEU 42 HD23 LEU 42 27.313 0.274 9.819 169 H GLY 43 H GLY 43 32.102 -0.846 11.810 170 HA2 GLY 43 HA2 GLY 43 32.320 -1.636 13.866 171 HA3 GLY 43 HA3 GLY 43 30.840 -0.718 14.283 172 H GLN 44 H GLN 44 30.421 -3.174 11.951 173 HA GLN 44 HA GLN 44 29.242 -5.052 11.881 174 HB2 GLN 44 HB2 GLN 44 30.413 -5.585 14.661 175 HB3 GLN 44 HB3 GLN 44 29.579 -6.798 13.636 176 HG2 GLN 44 HG2 GLN 44 31.340 -6.451 11.824 177 HG3 GLN 44 HG3 GLN 44 32.197 -5.310 12.916 178 HE21 GLN 44 HE21 GLN 44 30.825 -8.688 13.086 179 HE22 GLN 44 HE22 GLN 44 32.207 -9.334 13.947 180 H ASN 45 H ASN 45 27.886 -2.668 12.917 181 HA ASN 45 HA ASN 45 26.176 -3.506 15.097 182 HB2 ASN 45 HB2 ASN 45 26.286 -0.985 13.327 183 HB3 ASN 45 HB3 ASN 45 25.032 -1.219 14.581 184 HD21 ASN 45 HD21 ASN 45 28.322 -0.228 13.968 185 HD22 ASN 45 HD22 ASN 45 28.736 0.077 15.641 186 H LYS 46 H LYS 46 25.743 -2.911 11.612 187 HA LYS 46 HA LYS 46 22.952 -3.771 11.806 188 HB2 LYS 46 HB2 LYS 46 23.897 -1.131 10.541 189 HB3 LYS 46 HB3 LYS 46 22.223 -1.774 10.442 190 HG2 LYS 46 HG2 LYS 46 22.028 -1.635 12.944 191 HG3 LYS 46 HG3 LYS 46 23.614 -0.797 12.984 192 HD2 LYS 46 HD2 LYS 46 21.103 0.178 11.490 193 HD3 LYS 46 HD3 LYS 46 21.698 0.780 13.071 194 HE2 LYS 46 HE2 LYS 46 23.809 1.613 11.966 195 HE3 LYS 46 HE3 LYS 46 23.168 1.060 10.360 196 HZ1 LYS 46 HZ1 LYS 46 21.886 3.018 12.187 197 HZ2 LYS 46 HZ2 LYS 46 21.263 2.486 10.700 198 HZ3 LYS 46 HZ3 LYS 46 22.717 3.364 10.748 199 H LYS 47 H LYS 47 22.087 -3.435 9.467 200 HA LYS 47 HA LYS 47 23.411 -5.185 7.691 201 HB2 LYS 47 HB2 LYS 47 21.538 -4.647 6.161 202 HB3 LYS 47 HB3 LYS 47 21.003 -5.120 7.797 203 HG2 LYS 47 HG2 LYS 47 20.534 -2.745 8.376 204 HG3 LYS 47 HG3 LYS 47 21.203 -2.195 6.812 205 HD2 LYS 47 HD2 LYS 47 18.736 -2.190 6.788 206 HD3 LYS 47 HD3 LYS 47 19.398 -3.335 5.584 207 HE2 LYS 47 HE2 LYS 47 17.382 -4.250 6.705 208 HE3 LYS 47 HE3 LYS 47 18.823 -5.277 7.074 209 HZ1 LYS 47 HZ1 LYS 47 17.408 -4.781 8.982 210 HZ2 LYS 47 HZ2 LYS 47 17.769 -3.126 8.835 211 HZ3 LYS 47 HZ3 LYS 47 19.008 -4.245 9.179 212 H GLY 48 H GLY 48 23.407 -1.573 7.792 213 HA2 GLY 48 HA2 GLY 48 24.560 -0.109 6.487 214 HA3 GLY 48 HA3 GLY 48 25.521 -1.497 5.854 215 H HIS 49 H HIS 49 25.444 -0.208 3.685 216 HA HIS 49 HA HIS 49 23.345 -1.452 2.215 217 HB2 HIS 49 HB2 HIS 49 22.440 0.893 3.178 218 HB3 HIS 49 HB3 HIS 49 23.496 1.606 1.930 219 HD2 HIS 49 HD2 HIS 49 21.870 2.075 -0.369 220 HE1 HIS 49 HE1 HIS 49 18.917 -0.785 0.656 221 HE2 HIS 49 HE2 HIS 49 19.516 1.143 -0.888 222 H CYS 50 H CYS 50 24.001 -1.457 -0.149 223 HA CYS 50 HA CYS 50 26.869 -1.259 -0.356 224 HB2 CYS 50 HB2 CYS 50 24.781 -2.164 -2.397 225 HB3 CYS 50 HB3 CYS 50 26.559 -2.267 -2.641 226 H TYR 51 H TYR 51 28.139 0.049 -1.669 227 HA TYR 51 HA TYR 51 26.764 2.319 -2.982 228 HB2 TYR 51 HB2 TYR 51 29.561 2.513 -1.727 229 HB3 TYR 51 HB3 TYR 51 28.470 3.843 -2.300 230 HD1 TYR 51 HD1 TYR 51 30.041 3.377 0.228 231 HD2 TYR 51 HD2 TYR 51 25.884 2.957 -0.707 232 HE1 TYR 51 HE1 TYR 51 29.506 3.231 2.678 233 HE2 TYR 51 HE2 TYR 51 25.340 2.898 1.707 234 HH TYR 51 HH TYR 51 27.770 2.195 4.046 235 H LYS 52 H LYS 52 28.061 3.396 -4.636 236 HA LYS 52 HA LYS 52 30.286 1.832 -5.769 237 HB2 LYS 52 HB2 LYS 52 28.282 1.730 -7.248 238 HB3 LYS 52 HB3 LYS 52 28.199 3.516 -7.248 239 HG2 LYS 52 HG2 LYS 52 30.419 3.610 -8.439 240 HG3 LYS 52 HG3 LYS 52 30.535 1.821 -8.348 241 HD2 LYS 52 HD2 LYS 52 29.823 2.470 -10.576 242 HD3 LYS 52 HD3 LYS 52 28.472 1.616 -9.757 243 HE2 LYS 52 HE2 LYS 52 27.319 3.802 -9.332 244 HE3 LYS 52 HE3 LYS 52 28.723 4.689 -10.065 245 HZ1 LYS 52 HZ1 LYS 52 26.936 4.385 -11.615 246 HZ2 LYS 52 HZ2 LYS 52 26.981 2.699 -11.418 247 HZ3 LYS 52 HZ3 LYS 52 28.302 3.509 -12.121 248 H ILE 53 H ILE 53 32.195 2.973 -6.124 249 HA ILE 53 HA ILE 53 32.291 5.816 -5.423 250 HB ILE 53 HB ILE 53 34.455 3.722 -5.759 251 HG12 ILE 53 HG12 ILE 53 33.823 5.459 -3.318 252 HG13 ILE 53 HG13 ILE 53 33.073 3.866 -3.583 253 HG21 ILE 53 HG21 ILE 53 35.390 5.780 -6.746 254 HG22 ILE 53 HG22 ILE 53 36.102 5.561 -5.123 255 HG23 ILE 53 HG23 ILE 53 34.787 6.770 -5.363 256 HD11 ILE 53 HD11 ILE 53 35.029 3.634 -2.078 257 HD12 ILE 53 HD12 ILE 53 36.109 4.437 -3.271 258 HD13 ILE 53 HD13 ILE 53 35.401 2.820 -3.639 259 H ILE 54 H ILE 54 32.305 7.323 -6.978 260 HA ILE 54 HA ILE 54 33.580 6.705 -9.513 261 HB ILE 54 HB ILE 54 31.948 8.123 -10.699 262 HG12 ILE 54 HG12 ILE 54 30.970 9.267 -8.636 263 HG13 ILE 54 HG13 ILE 54 29.845 8.733 -9.916 264 HG21 ILE 54 HG21 ILE 54 30.276 6.306 -10.992 265 HG22 ILE 54 HG22 ILE 54 30.893 5.496 -9.504 266 HG23 ILE 54 HG23 ILE 54 31.972 5.692 -10.933 267 HD11 ILE 54 HD11 ILE 54 29.156 6.753 -8.563 268 HD12 ILE 54 HD12 ILE 54 28.858 8.303 -7.712 269 HD13 ILE 54 HD13 ILE 54 30.209 7.253 -7.196 270 H GLY 55 H GLY 55 34.923 8.346 -10.339 271 HA2 GLY 55 HA2 GLY 55 34.726 10.996 -9.879 272 HA3 GLY 55 HA3 GLY 55 35.684 10.331 -8.485 273 H ASN 56 H ASN 56 37.100 12.031 -9.911 274 HA ASN 56 HA ASN 56 38.684 10.372 -11.777 275 HB2 ASN 56 HB2 ASN 56 38.451 13.445 -11.559 276 HB3 ASN 56 HB3 ASN 56 39.564 12.566 -12.679 277 HD21 ASN 56 HD21 ASN 56 36.408 13.917 -12.439 278 HD22 ASN 56 HD22 ASN 56 35.693 13.047 -13.777 Start of MODEL 12 1 H1 PHE 17 HT1 PHE 17 34.421 13.316 -7.619 2 H2 PHE 17 HT2 PHE 17 35.926 12.886 -6.957 3 H3 PHE 17 HT3 PHE 17 34.972 14.080 -6.212 4 HA PHE 17 HA PHE 17 34.378 11.211 -6.429 5 HB2 PHE 17 HB2 PHE 17 36.142 11.713 -4.832 6 HB3 PHE 17 HB3 PHE 17 35.149 13.026 -4.081 7 HD1 PHE 17 HD1 PHE 17 35.204 12.240 -1.868 8 HD2 PHE 17 HD2 PHE 17 33.846 9.560 -4.948 9 HE1 PHE 17 HE1 PHE 17 34.247 10.738 -0.152 10 HE2 PHE 17 HE2 PHE 17 32.786 8.151 -3.261 11 HZ PHE 17 HZ PHE 17 33.018 8.690 -0.842 12 H ASP 18 H ASP 18 32.330 10.617 -6.603 13 HA ASP 18 HA ASP 18 30.431 11.832 -4.734 14 HB2 ASP 18 HB2 ASP 18 29.797 10.788 -7.575 15 HB3 ASP 18 HB3 ASP 18 28.539 11.169 -6.327 16 H VAL 19 H VAL 19 29.159 10.270 -3.574 17 HA VAL 19 HA VAL 19 29.707 7.462 -4.236 18 HB VAL 19 HB VAL 19 30.849 7.937 -2.140 19 HG11 VAL 19 HG11 VAL 19 29.593 8.601 -0.096 20 HG12 VAL 19 HG12 VAL 19 28.086 8.818 -1.052 21 HG13 VAL 19 HG13 VAL 19 29.505 9.898 -1.339 22 HG21 VAL 19 HG21 VAL 19 28.263 6.320 -1.638 23 HG22 VAL 19 HG22 VAL 19 29.856 6.118 -0.834 24 HG23 VAL 19 HG23 VAL 19 29.662 5.694 -2.578 25 H VAL 20 H VAL 20 27.936 6.272 -4.617 26 HA VAL 20 HA VAL 20 25.307 7.362 -3.995 27 HB VAL 20 HB VAL 20 24.509 6.620 -6.308 28 HG11 VAL 20 HG11 VAL 20 26.626 8.899 -6.260 29 HG12 VAL 20 HG12 VAL 20 24.907 9.082 -5.743 30 HG13 VAL 20 HG13 VAL 20 25.299 8.682 -7.461 31 HG21 VAL 20 HG21 VAL 20 27.534 6.677 -6.885 32 HG22 VAL 20 HG22 VAL 20 26.204 6.395 -8.070 33 HG23 VAL 20 HG23 VAL 20 26.542 5.191 -6.755 34 H SER 21 H SER 21 23.600 5.686 -4.017 35 HA SER 21 HA SER 21 24.663 3.215 -3.018 36 HB2 SER 21 HB2 SER 21 22.326 2.678 -2.452 37 HB3 SER 21 HB3 SER 21 22.813 4.298 -1.838 38 HG SER 21 HG SER 21 20.785 4.385 -2.822 39 H CYS 22 H CYS 22 24.051 1.103 -3.732 40 HA CYS 22 HA CYS 22 23.518 0.911 -6.621 41 HB2 CYS 22 HB2 CYS 22 24.714 -1.064 -4.616 42 HB3 CYS 22 HB3 CYS 22 24.379 -1.452 -6.347 43 H ASN 23 H ASN 23 21.585 1.172 -4.174 44 HA ASN 23 HA ASN 23 19.630 0.447 -3.447 45 HB2 ASN 23 HB2 ASN 23 19.160 1.050 -5.902 46 HB3 ASN 23 HB3 ASN 23 19.214 -0.717 -6.259 47 HD21 ASN 23 HD21 ASN 23 17.073 -1.385 -6.520 48 HD22 ASN 23 HD22 ASN 23 15.745 -0.898 -5.492 49 H LYS 24 H LYS 24 21.583 -1.358 -2.535 50 HA LYS 24 HA LYS 24 20.035 -3.850 -2.566 51 HB2 LYS 24 HB2 LYS 24 21.918 -3.976 -4.309 52 HB3 LYS 24 HB3 LYS 24 23.078 -3.716 -2.978 53 HG2 LYS 24 HG2 LYS 24 23.046 -6.095 -3.363 54 HG3 LYS 24 HG3 LYS 24 22.089 -5.881 -1.873 55 HD2 LYS 24 HD2 LYS 24 19.974 -5.891 -3.277 56 HD3 LYS 24 HD3 LYS 24 20.986 -6.079 -4.748 57 HE2 LYS 24 HE2 LYS 24 21.735 -8.334 -3.975 58 HE3 LYS 24 HE3 LYS 24 20.778 -8.125 -2.440 59 HZ1 LYS 24 HZ1 LYS 24 19.417 -9.279 -3.906 60 HZ2 LYS 24 HZ2 LYS 24 19.788 -8.274 -5.227 61 HZ3 LYS 24 HZ3 LYS 24 18.859 -7.667 -3.945 62 H ASN 25 H ASN 25 19.909 -4.826 -0.625 63 HA ASN 25 HA ASN 25 21.039 -3.502 1.683 64 HB2 ASN 25 HB2 ASN 25 18.602 -4.084 1.532 65 HB3 ASN 25 HB3 ASN 25 19.024 -5.812 1.341 66 HD21 ASN 25 HD21 ASN 25 21.139 -4.649 3.842 67 HD22 ASN 25 HD22 ASN 25 20.107 -5.135 5.138 68 H CYS 26 H CYS 26 22.935 -4.175 2.607 69 HA CYS 26 HA CYS 26 23.671 -7.007 2.364 70 HB2 CYS 26 HB2 CYS 26 26.035 -6.359 2.522 71 HB3 CYS 26 HB3 CYS 26 25.263 -5.625 1.097 72 H THR 27 H THR 27 25.080 -7.689 4.301 73 HA THR 27 HA THR 27 24.543 -6.118 6.709 74 HB THR 27 HB THR 27 24.371 -9.173 6.660 75 HG1 THR 27 HG1 THR 27 22.515 -8.089 5.840 76 HG21 THR 27 HG21 THR 27 23.672 -8.890 9.041 77 HG22 THR 27 HG22 THR 27 23.799 -7.106 8.906 78 HG23 THR 27 HG23 THR 27 25.288 -8.116 8.857 79 H SER 28 H SER 28 26.409 -6.165 8.078 80 HA SER 28 HA SER 28 28.798 -6.045 6.784 81 HB2 SER 28 HB2 SER 28 28.262 -4.890 8.902 82 HB3 SER 28 HB3 SER 28 28.326 -6.448 9.793 83 HG SER 28 HG SER 28 30.559 -6.566 9.135 84 H GLY 29 H GLY 29 27.606 -8.868 8.667 85 HA2 GLY 29 HA2 GLY 29 30.116 -10.304 8.192 86 HA3 GLY 29 HA3 GLY 29 28.694 -10.833 9.145 87 H GLN 30 H GLN 30 27.707 -9.655 6.131 88 HA GLN 30 HA GLN 30 27.791 -12.360 4.905 89 HB2 GLN 30 HB2 GLN 30 25.603 -10.209 4.728 90 HB3 GLN 30 HB3 GLN 30 25.622 -11.721 3.764 91 HG2 GLN 30 HG2 GLN 30 25.443 -11.616 6.855 92 HG3 GLN 30 HG3 GLN 30 24.057 -11.793 5.727 93 HE21 GLN 30 HE21 GLN 30 27.090 -13.455 6.870 94 HE22 GLN 30 HE22 GLN 30 26.477 -15.045 6.513 95 H ASN 31 H ASN 31 27.777 -8.841 4.290 96 HA ASN 31 HA ASN 31 28.500 -7.556 2.674 97 HB2 ASN 31 HB2 ASN 31 30.627 -9.758 2.329 98 HB3 ASN 31 HB3 ASN 31 30.773 -8.095 1.659 99 HD21 ASN 31 HD21 ASN 31 29.729 -6.614 3.989 100 HD22 ASN 31 HD22 ASN 31 30.935 -6.807 5.226 101 H GLU 32 H GLU 32 26.337 -9.165 1.688 102 HA GLU 32 HA GLU 32 27.108 -9.971 -0.985 103 HB2 GLU 32 HB2 GLU 32 24.413 -9.801 0.452 104 HB3 GLU 32 HB3 GLU 32 24.604 -10.445 -1.201 105 HG2 GLU 32 HG2 GLU 32 26.053 -11.681 1.255 106 HG3 GLU 32 HG3 GLU 32 24.424 -12.200 0.685 107 H CYS 33 H CYS 33 27.543 -8.401 -2.462 108 HA CYS 33 HA CYS 33 25.482 -6.409 -2.957 109 HB2 CYS 33 HB2 CYS 33 28.516 -5.879 -2.936 110 HB3 CYS 33 HB3 CYS 33 27.315 -4.744 -3.616 111 HA PRO 34 HA PRO 34 26.385 -7.915 -7.105 112 HB2 PRO 34 HB2 PRO 34 25.681 -5.752 -8.736 113 HB3 PRO 34 HB3 PRO 34 24.446 -6.719 -7.835 114 HG2 PRO 34 HG2 PRO 34 25.776 -4.104 -6.926 115 HG3 PRO 34 HG3 PRO 34 23.998 -4.461 -7.038 116 HD2 PRO 34 HD2 PRO 34 25.341 -4.749 -4.665 117 HD3 PRO 34 HD3 PRO 34 24.108 -5.995 -5.179 118 H GLU 35 H GLU 35 27.916 -7.504 -8.997 119 HA GLU 35 HA GLU 35 30.405 -6.816 -7.908 120 HB2 GLU 35 HB2 GLU 35 29.570 -7.270 -10.819 121 HB3 GLU 35 HB3 GLU 35 31.269 -7.107 -10.276 122 HG2 GLU 35 HG2 GLU 35 31.041 -9.147 -8.816 123 HG3 GLU 35 HG3 GLU 35 29.334 -9.352 -9.361 124 H GLY 36 H GLY 36 31.727 -5.053 -8.015 125 HA2 GLY 36 HA2 GLY 36 32.446 -2.988 -8.742 126 HA3 GLY 36 HA3 GLY 36 30.875 -2.705 -9.564 127 H CYS 37 H CYS 37 29.811 -3.853 -6.733 128 HA CYS 37 HA CYS 37 29.867 -1.215 -5.416 129 HB2 CYS 37 HB2 CYS 37 27.695 -3.388 -5.346 130 HB3 CYS 37 HB3 CYS 37 27.658 -1.828 -4.453 131 H PHE 38 H PHE 38 29.877 -1.226 -3.047 132 HA PHE 38 HA PHE 38 30.833 -3.750 -1.860 133 HB2 PHE 38 HB2 PHE 38 32.611 -2.613 -0.597 134 HB3 PHE 38 HB3 PHE 38 32.850 -2.264 -2.344 135 HD1 PHE 38 HD1 PHE 38 32.145 -0.019 -3.256 136 HD2 PHE 38 HD2 PHE 38 32.153 -0.851 0.958 137 HE1 PHE 38 HE1 PHE 38 31.896 2.371 -2.790 138 HE2 PHE 38 HE2 PHE 38 31.959 1.565 1.441 139 HZ PHE 38 HZ PHE 38 31.792 3.193 -0.419 140 H CYS 39 H CYS 39 30.613 -3.745 0.573 141 HA CYS 39 HA CYS 39 27.998 -2.624 1.188 142 HB2 CYS 39 HB2 CYS 39 28.508 -5.046 1.578 143 HB3 CYS 39 HB3 CYS 39 29.807 -4.575 2.712 144 H GLY 40 H GLY 40 27.790 -0.686 2.266 145 HA2 GLY 40 HA2 GLY 40 30.164 0.481 3.460 146 HA3 GLY 40 HA3 GLY 40 28.559 1.226 3.158 147 H LEU 41 H LEU 41 29.926 -1.409 5.289 148 HA LEU 41 HA LEU 41 28.620 0.018 7.518 149 HB2 LEU 41 HB2 LEU 41 27.290 -2.053 6.680 150 HB3 LEU 41 HB3 LEU 41 28.641 -3.046 7.260 151 HG LEU 41 HG LEU 41 26.697 -2.943 8.772 152 HD11 LEU 41 HD11 LEU 41 28.803 -1.524 10.431 153 HD12 LEU 41 HD12 LEU 41 29.151 -3.146 9.721 154 HD13 LEU 41 HD13 LEU 41 27.733 -2.919 10.821 155 HD21 LEU 41 HD21 LEU 41 27.339 0.004 9.397 156 HD22 LEU 41 HD22 LEU 41 25.930 -0.993 9.934 157 HD23 LEU 41 HD23 LEU 41 26.099 -0.517 8.199 158 H LEU 42 H LEU 42 29.945 0.264 9.308 159 HA LEU 42 HA LEU 42 32.571 -1.076 9.128 160 HB2 LEU 42 HB2 LEU 42 31.873 1.610 10.459 161 HB3 LEU 42 HB3 LEU 42 33.491 0.861 10.305 162 HG LEU 42 HG LEU 42 33.505 2.540 8.734 163 HD11 LEU 42 HD11 LEU 42 34.094 0.164 7.750 164 HD12 LEU 42 HD12 LEU 42 33.846 1.537 6.591 165 HD13 LEU 42 HD13 LEU 42 32.553 0.317 6.849 166 HD21 LEU 42 HD21 LEU 42 30.762 1.800 7.545 167 HD22 LEU 42 HD22 LEU 42 31.744 3.286 7.273 168 HD23 LEU 42 HD23 LEU 42 30.983 2.962 8.889 169 H GLY 43 H GLY 43 33.198 -2.321 10.867 170 HA2 GLY 43 HA2 GLY 43 33.504 -2.918 12.997 171 HA3 GLY 43 HA3 GLY 43 32.531 -1.499 13.498 172 H GLN 44 H GLN 44 30.784 -3.500 11.472 173 HA GLN 44 HA GLN 44 28.899 -4.565 11.697 174 HB2 GLN 44 HB2 GLN 44 30.583 -6.313 12.396 175 HB3 GLN 44 HB3 GLN 44 30.157 -5.975 14.102 176 HG2 GLN 44 HG2 GLN 44 27.790 -6.771 13.663 177 HG3 GLN 44 HG3 GLN 44 28.167 -6.953 11.914 178 HE21 GLN 44 HE21 GLN 44 29.487 -8.054 15.134 179 HE22 GLN 44 HE22 GLN 44 29.795 -9.690 14.591 180 H ASN 45 H ASN 45 28.835 -2.024 12.860 181 HA ASN 45 HA ASN 45 27.325 -2.012 15.271 182 HB2 ASN 45 HB2 ASN 45 27.649 0.018 12.977 183 HB3 ASN 45 HB3 ASN 45 26.604 0.349 14.401 184 HD21 ASN 45 HD21 ASN 45 29.980 0.229 13.281 185 HD22 ASN 45 HD22 ASN 45 30.628 0.777 14.799 186 H LYS 46 H LYS 46 26.246 -1.999 11.836 187 HA LYS 46 HA LYS 46 23.591 -2.842 12.743 188 HB2 LYS 46 HB2 LYS 46 24.080 -0.449 10.854 189 HB3 LYS 46 HB3 LYS 46 22.466 -1.189 11.199 190 HG2 LYS 46 HG2 LYS 46 22.579 -0.538 13.536 191 HG3 LYS 46 HG3 LYS 46 24.208 0.182 13.314 192 HD2 LYS 46 HD2 LYS 46 23.314 1.808 11.690 193 HD3 LYS 46 HD3 LYS 46 21.666 1.085 11.828 194 HE2 LYS 46 HE2 LYS 46 21.632 1.728 14.287 195 HE3 LYS 46 HE3 LYS 46 23.249 2.523 14.068 196 HZ1 LYS 46 HZ1 LYS 46 21.499 4.098 13.856 197 HZ2 LYS 46 HZ2 LYS 46 20.720 3.184 12.656 198 HZ3 LYS 46 HZ3 LYS 46 22.233 3.887 12.337 199 H LYS 47 H LYS 47 23.041 -2.056 9.700 200 HA LYS 47 HA LYS 47 23.844 -4.673 8.641 201 HB2 LYS 47 HB2 LYS 47 21.968 -4.149 6.956 202 HB3 LYS 47 HB3 LYS 47 21.492 -4.595 8.619 203 HG2 LYS 47 HG2 LYS 47 20.777 -2.440 9.175 204 HG3 LYS 47 HG3 LYS 47 21.728 -1.607 7.911 205 HD2 LYS 47 HD2 LYS 47 20.322 -2.356 6.152 206 HD3 LYS 47 HD3 LYS 47 19.400 -3.483 7.202 207 HE2 LYS 47 HE2 LYS 47 19.484 -0.435 7.716 208 HE3 LYS 47 HE3 LYS 47 18.250 -1.211 6.627 209 HZ1 LYS 47 HZ1 LYS 47 17.491 -2.524 8.403 210 HZ2 LYS 47 HZ2 LYS 47 17.544 -0.914 8.943 211 HZ3 LYS 47 HZ3 LYS 47 18.747 -2.018 9.430 212 H GLY 48 H GLY 48 23.410 -1.269 7.406 213 HA2 GLY 48 HA2 GLY 48 24.898 -0.179 6.019 214 HA3 GLY 48 HA3 GLY 48 25.650 -1.748 5.558 215 H HIS 49 H HIS 49 25.201 -0.251 3.479 216 HA HIS 49 HA HIS 49 23.099 -1.676 2.131 217 HB2 HIS 49 HB2 HIS 49 22.102 0.568 3.089 218 HB3 HIS 49 HB3 HIS 49 23.230 1.405 1.983 219 HD2 HIS 49 HD2 HIS 49 22.090 1.794 -0.556 220 HE1 HIS 49 HE1 HIS 49 18.906 -0.961 -0.048 221 HE2 HIS 49 HE2 HIS 49 19.901 0.808 -1.566 222 H CYS 50 H CYS 50 23.717 -1.672 -0.238 223 HA CYS 50 HA CYS 50 26.577 -1.510 -0.418 224 HB2 CYS 50 HB2 CYS 50 24.510 -2.198 -2.555 225 HB3 CYS 50 HB3 CYS 50 26.284 -2.406 -2.737 226 H TYR 51 H TYR 51 27.896 -0.049 -1.503 227 HA TYR 51 HA TYR 51 26.542 2.170 -2.943 228 HB2 TYR 51 HB2 TYR 51 29.258 2.510 -1.527 229 HB3 TYR 51 HB3 TYR 51 28.215 3.754 -2.268 230 HD1 TYR 51 HD1 TYR 51 25.507 2.827 -0.799 231 HD2 TYR 51 HD2 TYR 51 29.539 3.727 0.377 232 HE1 TYR 51 HE1 TYR 51 24.718 3.435 1.469 233 HE2 TYR 51 HE2 TYR 51 28.761 4.325 2.636 234 HH TYR 51 HH TYR 51 26.972 4.432 4.046 235 H LYS 52 H LYS 52 27.864 3.181 -4.606 236 HA LYS 52 HA LYS 52 30.353 1.770 -5.264 237 HB2 LYS 52 HB2 LYS 52 30.091 2.311 -7.654 238 HB3 LYS 52 HB3 LYS 52 28.799 1.217 -7.085 239 HG2 LYS 52 HG2 LYS 52 27.195 3.064 -6.959 240 HG3 LYS 52 HG3 LYS 52 28.454 4.274 -7.389 241 HD2 LYS 52 HD2 LYS 52 28.681 3.483 -9.576 242 HD3 LYS 52 HD3 LYS 52 27.773 1.944 -9.273 243 HE2 LYS 52 HE2 LYS 52 26.609 4.816 -9.386 244 HE3 LYS 52 HE3 LYS 52 26.478 3.553 -10.669 245 HZ1 LYS 52 HZ1 LYS 52 24.516 3.716 -9.292 246 HZ2 LYS 52 HZ2 LYS 52 25.394 3.301 -7.911 247 HZ3 LYS 52 HZ3 LYS 52 25.242 2.181 -9.174 248 H ILE 53 H ILE 53 32.077 3.122 -5.968 249 HA ILE 53 HA ILE 53 31.732 5.980 -5.395 250 HB ILE 53 HB ILE 53 34.102 4.209 -4.823 251 HG12 ILE 53 HG12 ILE 53 32.397 6.067 -3.063 252 HG13 ILE 53 HG13 ILE 53 32.264 4.298 -3.130 253 HG21 ILE 53 HG21 ILE 53 34.000 7.287 -4.952 254 HG22 ILE 53 HG22 ILE 53 35.066 6.185 -5.896 255 HG23 ILE 53 HG23 ILE 53 35.316 6.354 -4.139 256 HD11 ILE 53 HD11 ILE 53 34.685 5.939 -2.166 257 HD12 ILE 53 HD12 ILE 53 34.713 4.138 -2.348 258 HD13 ILE 53 HD13 ILE 53 33.605 4.915 -1.153 259 H ILE 54 H ILE 54 32.191 7.366 -6.875 260 HA ILE 54 HA ILE 54 33.679 6.590 -9.247 261 HB ILE 54 HB ILE 54 32.172 8.179 -10.476 262 HG12 ILE 54 HG12 ILE 54 31.122 9.040 -8.232 263 HG13 ILE 54 HG13 ILE 54 30.136 8.905 -9.728 264 HG21 ILE 54 HG21 ILE 54 31.043 5.469 -9.519 265 HG22 ILE 54 HG22 ILE 54 32.183 5.746 -10.883 266 HG23 ILE 54 HG23 ILE 54 30.497 6.378 -10.980 267 HD11 ILE 54 HD11 ILE 54 30.041 6.941 -7.313 268 HD12 ILE 54 HD12 ILE 54 29.164 6.721 -8.872 269 HD13 ILE 54 HD13 ILE 54 28.811 8.130 -7.833 270 H GLY 55 H GLY 55 35.104 8.135 -10.044 271 HA2 GLY 55 HA2 GLY 55 35.596 10.623 -9.793 272 HA3 GLY 55 HA3 GLY 55 35.799 10.146 -8.055 273 H ASN 56 H ASN 56 38.019 10.306 -7.841 274 HA ASN 56 HA ASN 56 39.872 9.509 -9.783 275 HB2 ASN 56 HB2 ASN 56 40.134 9.780 -6.726 276 HB3 ASN 56 HB3 ASN 56 41.543 9.574 -7.841 277 HD21 ASN 56 HD21 ASN 56 40.294 11.944 -6.070 278 HD22 ASN 56 HD22 ASN 56 40.451 13.288 -7.175 Start of MODEL 13 1 H1 PHE 17 HT1 PHE 17 36.173 12.591 -6.557 2 H2 PHE 17 HT2 PHE 17 35.410 12.141 -7.999 3 H3 PHE 17 HT3 PHE 17 36.817 11.332 -7.486 4 HA PHE 17 HA PHE 17 34.837 10.020 -7.071 5 HB2 PHE 17 HB2 PHE 17 36.847 9.700 -5.757 6 HB3 PHE 17 HB3 PHE 17 36.418 11.080 -4.668 7 HD1 PHE 17 HD1 PHE 17 36.404 10.021 -2.605 8 HD2 PHE 17 HD2 PHE 17 34.141 8.230 -5.797 9 HE1 PHE 17 HE1 PHE 17 35.327 8.489 -0.989 10 HE2 PHE 17 HE2 PHE 17 33.030 6.759 -4.180 11 HZ PHE 17 HZ PHE 17 33.634 6.850 -1.772 12 H ASP 18 H ASP 18 32.699 10.108 -7.035 13 HA ASP 18 HA ASP 18 31.406 11.547 -4.829 14 HB2 ASP 18 HB2 ASP 18 30.272 10.965 -7.649 15 HB3 ASP 18 HB3 ASP 18 29.289 11.584 -6.258 16 H VAL 19 H VAL 19 29.641 10.249 -3.805 17 HA VAL 19 HA VAL 19 29.771 7.402 -4.531 18 HB VAL 19 HB VAL 19 31.188 7.779 -2.578 19 HG11 VAL 19 HG11 VAL 19 28.646 8.839 -1.178 20 HG12 VAL 19 HG12 VAL 19 30.108 9.808 -1.608 21 HG13 VAL 19 HG13 VAL 19 30.226 8.483 -0.398 22 HG21 VAL 19 HG21 VAL 19 28.571 6.289 -1.902 23 HG22 VAL 19 HG22 VAL 19 30.187 6.026 -1.160 24 HG23 VAL 19 HG23 VAL 19 29.925 5.634 -2.902 25 H VAL 20 H VAL 20 27.821 6.404 -4.707 26 HA VAL 20 HA VAL 20 25.426 7.818 -3.790 27 HB VAL 20 HB VAL 20 24.202 7.210 -5.847 28 HG11 VAL 20 HG11 VAL 20 26.728 8.908 -6.393 29 HG12 VAL 20 HG12 VAL 20 25.209 9.495 -5.623 30 HG13 VAL 20 HG13 VAL 20 25.194 8.935 -7.339 31 HG21 VAL 20 HG21 VAL 20 26.985 6.349 -6.906 32 HG22 VAL 20 HG22 VAL 20 25.465 6.443 -7.870 33 HG23 VAL 20 HG23 VAL 20 25.618 5.241 -6.538 34 H SER 21 H SER 21 23.479 6.240 -3.695 35 HA SER 21 HA SER 21 24.347 3.781 -2.537 36 HB2 SER 21 HB2 SER 21 21.900 3.367 -2.199 37 HB3 SER 21 HB3 SER 21 22.420 4.982 -1.614 38 HG SER 21 HG SER 21 21.297 4.519 -4.190 39 H CYS 22 H CYS 22 24.087 1.627 -3.270 40 HA CYS 22 HA CYS 22 23.801 1.311 -6.157 41 HB2 CYS 22 HB2 CYS 22 25.762 0.434 -4.830 42 HB3 CYS 22 HB3 CYS 22 24.645 -0.659 -3.971 43 H ASN 23 H ASN 23 21.824 1.180 -3.477 44 HA ASN 23 HA ASN 23 19.882 0.333 -2.879 45 HB2 ASN 23 HB2 ASN 23 19.278 1.372 -5.142 46 HB3 ASN 23 HB3 ASN 23 19.365 -0.282 -5.846 47 HD21 ASN 23 HD21 ASN 23 17.238 -0.947 -6.144 48 HD22 ASN 23 HD22 ASN 23 15.945 -0.737 -4.982 49 H LYS 24 H LYS 24 21.989 -1.429 -2.513 50 HA LYS 24 HA LYS 24 20.556 -3.961 -2.604 51 HB2 LYS 24 HB2 LYS 24 23.491 -3.495 -3.346 52 HB3 LYS 24 HB3 LYS 24 22.928 -5.104 -2.794 53 HG2 LYS 24 HG2 LYS 24 21.634 -3.627 -5.151 54 HG3 LYS 24 HG3 LYS 24 23.047 -4.699 -5.374 55 HD2 LYS 24 HD2 LYS 24 20.565 -5.682 -3.869 56 HD3 LYS 24 HD3 LYS 24 20.622 -5.697 -5.675 57 HE2 LYS 24 HE2 LYS 24 22.661 -7.168 -5.596 58 HE3 LYS 24 HE3 LYS 24 22.598 -7.148 -3.783 59 HZ1 LYS 24 HZ1 LYS 24 21.563 -9.084 -4.623 60 HZ2 LYS 24 HZ2 LYS 24 20.519 -8.194 -5.628 61 HZ3 LYS 24 HZ3 LYS 24 20.369 -8.091 -3.940 62 H ASN 25 H ASN 25 20.804 -5.346 -0.888 63 HA ASN 25 HA ASN 25 21.456 -3.904 1.543 64 HB2 ASN 25 HB2 ASN 25 19.180 -4.934 1.258 65 HB3 ASN 25 HB3 ASN 25 19.943 -6.564 1.154 66 HD21 ASN 25 HD21 ASN 25 20.717 -7.517 3.116 67 HD22 ASN 25 HD22 ASN 25 20.394 -6.835 4.686 68 H CYS 26 H CYS 26 23.181 -4.280 2.689 69 HA CYS 26 HA CYS 26 24.866 -6.640 2.344 70 HB2 CYS 26 HB2 CYS 26 25.999 -4.672 1.652 71 HB3 CYS 26 HB3 CYS 26 25.337 -3.690 2.984 72 H THR 27 H THR 27 25.700 -7.603 4.417 73 HA THR 27 HA THR 27 24.404 -6.593 6.835 74 HB THR 27 HB THR 27 24.659 -9.581 6.167 75 HG1 THR 27 HG1 THR 27 23.003 -8.463 5.029 76 HG21 THR 27 HG21 THR 27 23.230 -9.880 8.208 77 HG22 THR 27 HG22 THR 27 23.154 -8.101 8.438 78 HG23 THR 27 HG23 THR 27 24.706 -8.981 8.706 79 H SER 28 H SER 28 25.822 -7.161 8.749 80 HA SER 28 HA SER 28 28.568 -6.931 8.204 81 HB2 SER 28 HB2 SER 28 27.510 -6.200 10.324 82 HB3 SER 28 HB3 SER 28 27.153 -7.904 10.767 83 HG SER 28 HG SER 28 29.428 -8.260 10.800 84 H GLY 29 H GLY 29 26.635 -9.860 9.022 85 HA2 GLY 29 HA2 GLY 29 28.787 -11.665 9.093 86 HA3 GLY 29 HA3 GLY 29 27.055 -12.044 8.795 87 H GLN 30 H GLN 30 26.749 -10.648 6.327 88 HA GLN 30 HA GLN 30 28.759 -11.844 4.571 89 HB2 GLN 30 HB2 GLN 30 27.044 -12.654 2.991 90 HB3 GLN 30 HB3 GLN 30 26.980 -13.504 4.558 91 HG2 GLN 30 HG2 GLN 30 24.997 -12.193 5.270 92 HG3 GLN 30 HG3 GLN 30 25.012 -11.236 3.746 93 HE21 GLN 30 HE21 GLN 30 22.849 -12.928 4.763 94 HE22 GLN 30 HE22 GLN 30 22.587 -14.159 3.547 95 H ASN 31 H ASN 31 29.663 -10.226 3.452 96 HA ASN 31 HA ASN 31 28.200 -7.728 3.191 97 HB2 ASN 31 HB2 ASN 31 31.081 -8.466 2.352 98 HB3 ASN 31 HB3 ASN 31 30.372 -6.809 2.384 99 HD21 ASN 31 HD21 ASN 31 29.031 -6.941 5.019 100 HD22 ASN 31 HD22 ASN 31 30.341 -6.992 6.156 101 H GLU 32 H GLU 32 26.552 -8.491 1.609 102 HA GLU 32 HA GLU 32 27.649 -9.463 -0.935 103 HB2 GLU 32 HB2 GLU 32 24.800 -9.347 0.163 104 HB3 GLU 32 HB3 GLU 32 25.231 -9.999 -1.448 105 HG2 GLU 32 HG2 GLU 32 26.203 -11.155 1.265 106 HG3 GLU 32 HG3 GLU 32 24.856 -11.819 0.266 107 H CYS 33 H CYS 33 28.204 -7.894 -2.387 108 HA CYS 33 HA CYS 33 26.079 -6.041 -3.114 109 HB2 CYS 33 HB2 CYS 33 29.067 -5.298 -2.985 110 HB3 CYS 33 HB3 CYS 33 27.774 -4.267 -3.668 111 HA PRO 34 HA PRO 34 27.523 -7.755 -7.052 112 HB2 PRO 34 HB2 PRO 34 26.562 -5.889 -8.896 113 HB3 PRO 34 HB3 PRO 34 25.453 -6.980 -7.975 114 HG2 PRO 34 HG2 PRO 34 26.263 -4.111 -7.245 115 HG3 PRO 34 HG3 PRO 34 24.583 -4.773 -7.408 116 HD2 PRO 34 HD2 PRO 34 25.846 -4.615 -4.965 117 HD3 PRO 34 HD3 PRO 34 24.829 -6.074 -5.370 118 H GLU 35 H GLU 35 29.090 -7.195 -8.886 119 HA GLU 35 HA GLU 35 31.310 -5.856 -7.784 120 HB2 GLU 35 HB2 GLU 35 30.742 -6.813 -10.637 121 HB3 GLU 35 HB3 GLU 35 32.331 -6.189 -10.092 122 HG2 GLU 35 HG2 GLU 35 32.536 -8.041 -8.410 123 HG3 GLU 35 HG3 GLU 35 30.936 -8.701 -8.914 124 H GLY 36 H GLY 36 32.193 -3.843 -8.074 125 HA2 GLY 36 HA2 GLY 36 32.378 -1.722 -9.001 126 HA3 GLY 36 HA3 GLY 36 30.766 -1.902 -9.773 127 H CYS 37 H CYS 37 29.989 -3.108 -6.937 128 HA CYS 37 HA CYS 37 29.636 -0.520 -5.587 129 HB2 CYS 37 HB2 CYS 37 27.849 -3.012 -5.535 130 HB3 CYS 37 HB3 CYS 37 27.617 -1.553 -4.507 131 H PHE 38 H PHE 38 29.686 -0.570 -3.220 132 HA PHE 38 HA PHE 38 31.131 -2.863 -2.094 133 HB2 PHE 38 HB2 PHE 38 32.937 -1.568 -1.159 134 HB3 PHE 38 HB3 PHE 38 32.855 -1.091 -2.884 135 HD1 PHE 38 HD1 PHE 38 31.336 1.099 -3.356 136 HD2 PHE 38 HD2 PHE 38 33.135 0.109 0.419 137 HE1 PHE 38 HE1 PHE 38 31.240 3.474 -2.671 138 HE2 PHE 38 HE2 PHE 38 33.132 2.503 1.048 139 HZ PHE 38 HZ PHE 38 32.207 4.203 -0.551 140 H CYS 39 H CYS 39 31.161 -2.799 0.324 141 HA CYS 39 HA CYS 39 29.032 -1.118 1.471 142 HB2 CYS 39 HB2 CYS 39 28.211 -3.392 1.277 143 HB3 CYS 39 HB3 CYS 39 29.720 -4.064 1.991 144 H GLY 40 H GLY 40 29.844 0.259 2.961 145 HA2 GLY 40 HA2 GLY 40 32.387 -0.424 4.310 146 HA3 GLY 40 HA3 GLY 40 31.594 1.197 4.185 147 H LEU 41 H LEU 41 31.903 -1.683 6.104 148 HA LEU 41 HA LEU 41 29.258 -1.266 7.308 149 HB2 LEU 41 HB2 LEU 41 30.015 -3.492 6.386 150 HB3 LEU 41 HB3 LEU 41 31.290 -3.545 7.626 151 HG LEU 41 HG LEU 41 29.382 -4.960 8.127 152 HD11 LEU 41 HD11 LEU 41 30.596 -4.025 10.099 153 HD12 LEU 41 HD12 LEU 41 28.862 -4.438 10.421 154 HD13 LEU 41 HD13 LEU 41 29.334 -2.724 10.225 155 HD21 LEU 41 HD21 LEU 41 27.650 -3.496 6.942 156 HD22 LEU 41 HD22 LEU 41 27.473 -2.581 8.494 157 HD23 LEU 41 HD23 LEU 41 27.136 -4.329 8.443 158 H LEU 42 H LEU 42 29.101 -0.065 9.118 159 HA LEU 42 HA LEU 42 31.474 0.710 10.508 160 HB2 LEU 42 HB2 LEU 42 29.647 2.144 11.781 161 HB3 LEU 42 HB3 LEU 42 30.272 2.581 10.180 162 HG LEU 42 HG LEU 42 27.840 2.933 10.578 163 HD11 LEU 42 HD11 LEU 42 28.401 1.230 8.070 164 HD12 LEU 42 HD12 LEU 42 28.848 2.958 8.294 165 HD13 LEU 42 HD13 LEU 42 27.119 2.460 8.318 166 HD21 LEU 42 HD21 LEU 42 26.177 1.197 10.320 167 HD22 LEU 42 HD22 LEU 42 27.255 0.756 11.699 168 HD23 LEU 42 HD23 LEU 42 27.425 -0.080 10.111 169 H GLY 43 H GLY 43 32.142 -1.163 11.586 170 HA2 GLY 43 HA2 GLY 43 32.614 -2.081 13.562 171 HA3 GLY 43 HA3 GLY 43 31.629 -0.755 14.260 172 H GLN 44 H GLN 44 30.403 -3.410 12.312 173 HA GLN 44 HA GLN 44 28.635 -4.691 12.541 174 HB2 GLN 44 HB2 GLN 44 28.732 -6.505 14.160 175 HB3 GLN 44 HB3 GLN 44 30.272 -6.255 13.320 176 HG2 GLN 44 HG2 GLN 44 29.815 -5.068 16.129 177 HG3 GLN 44 HG3 GLN 44 30.194 -6.813 15.912 178 HE21 GLN 44 HE21 GLN 44 31.781 -4.578 17.184 179 HE22 GLN 44 HE22 GLN 44 33.355 -4.742 16.435 180 H ASN 45 H ASN 45 27.989 -2.146 13.430 181 HA ASN 45 HA ASN 45 26.220 -2.353 15.724 182 HB2 ASN 45 HB2 ASN 45 26.701 -0.203 13.575 183 HB3 ASN 45 HB3 ASN 45 25.375 -0.053 14.772 184 HD21 ASN 45 HD21 ASN 45 28.838 0.290 14.233 185 HD22 ASN 45 HD22 ASN 45 29.227 0.811 15.856 186 H LYS 46 H LYS 46 25.907 -2.311 12.173 187 HA LYS 46 HA LYS 46 23.364 -3.528 12.303 188 HB2 LYS 46 HB2 LYS 46 22.102 -1.832 11.037 189 HB3 LYS 46 HB3 LYS 46 22.617 -1.159 12.599 190 HG2 LYS 46 HG2 LYS 46 24.257 0.253 11.617 191 HG3 LYS 46 HG3 LYS 46 24.260 -0.609 10.045 192 HD2 LYS 46 HD2 LYS 46 22.077 0.165 9.459 193 HD3 LYS 46 HD3 LYS 46 21.718 0.771 11.096 194 HE2 LYS 46 HE2 LYS 46 24.061 1.948 9.459 195 HE3 LYS 46 HE3 LYS 46 22.349 2.498 9.200 196 HZ1 LYS 46 HZ1 LYS 46 23.477 3.846 10.812 197 HZ2 LYS 46 HZ2 LYS 46 23.773 2.493 11.802 198 HZ3 LYS 46 HZ3 LYS 46 22.177 2.988 11.493 199 H LYS 47 H LYS 47 22.597 -3.466 9.990 200 HA LYS 47 HA LYS 47 24.257 -5.171 8.569 201 HB2 LYS 47 HB2 LYS 47 22.330 -5.302 7.026 202 HB3 LYS 47 HB3 LYS 47 21.807 -5.345 8.732 203 HG2 LYS 47 HG2 LYS 47 21.199 -2.863 8.575 204 HG3 LYS 47 HG3 LYS 47 21.704 -2.921 6.851 205 HD2 LYS 47 HD2 LYS 47 19.958 -4.723 6.457 206 HD3 LYS 47 HD3 LYS 47 19.399 -4.481 8.148 207 HE2 LYS 47 HE2 LYS 47 17.958 -3.219 6.573 208 HE3 LYS 47 HE3 LYS 47 18.900 -2.038 7.585 209 HZ1 LYS 47 HZ1 LYS 47 18.884 -1.510 5.206 210 HZ2 LYS 47 HZ2 LYS 47 19.640 -2.991 4.875 211 HZ3 LYS 47 HZ3 LYS 47 20.458 -1.828 5.784 212 H GLY 48 H GLY 48 23.628 -1.680 7.962 213 HA2 GLY 48 HA2 GLY 48 24.862 -0.271 6.654 214 HA3 GLY 48 HA3 GLY 48 25.805 -1.667 6.019 215 H HIS 49 H HIS 49 25.495 -0.376 3.878 216 HA HIS 49 HA HIS 49 23.345 -1.643 2.494 217 HB2 HIS 49 HB2 HIS 49 22.294 0.536 3.462 218 HB3 HIS 49 HB3 HIS 49 23.474 1.442 2.469 219 HD2 HIS 49 HD2 HIS 49 22.333 2.111 -0.011 220 HE1 HIS 49 HE1 HIS 49 19.338 -0.881 0.031 221 HE2 HIS 49 HE2 HIS 49 20.224 1.165 -1.170 222 H CYS 50 H CYS 50 23.910 -1.615 0.107 223 HA CYS 50 HA CYS 50 26.739 -1.211 -0.245 224 HB2 CYS 50 HB2 CYS 50 24.577 -2.041 -2.228 225 HB3 CYS 50 HB3 CYS 50 26.334 -2.019 -2.601 226 H TYR 51 H TYR 51 27.836 0.296 -1.495 227 HA TYR 51 HA TYR 51 26.240 2.550 -2.591 228 HB2 TYR 51 HB2 TYR 51 29.176 2.700 -1.706 229 HB3 TYR 51 HB3 TYR 51 28.074 4.053 -2.133 230 HD1 TYR 51 HD1 TYR 51 25.731 2.817 -0.100 231 HD2 TYR 51 HD2 TYR 51 29.888 3.881 0.099 232 HE1 TYR 51 HE1 TYR 51 25.577 2.983 2.349 233 HE2 TYR 51 HE2 TYR 51 29.733 4.112 2.536 234 HH TYR 51 HH TYR 51 26.650 3.477 4.279 235 H LYS 52 H LYS 52 27.266 3.546 -4.532 236 HA LYS 52 HA LYS 52 29.116 1.741 -5.976 237 HB2 LYS 52 HB2 LYS 52 26.888 1.945 -7.063 238 HB3 LYS 52 HB3 LYS 52 27.076 3.723 -7.101 239 HG2 LYS 52 HG2 LYS 52 29.047 3.486 -8.652 240 HG3 LYS 52 HG3 LYS 52 28.917 1.702 -8.527 241 HD2 LYS 52 HD2 LYS 52 27.946 2.391 -10.620 242 HD3 LYS 52 HD3 LYS 52 26.619 1.818 -9.556 243 HE2 LYS 52 HE2 LYS 52 25.962 4.205 -9.087 244 HE3 LYS 52 HE3 LYS 52 27.344 4.783 -10.109 245 HZ1 LYS 52 HZ1 LYS 52 25.087 3.074 -11.011 246 HZ2 LYS 52 HZ2 LYS 52 26.376 3.624 -11.971 247 HZ3 LYS 52 HZ3 LYS 52 25.277 4.735 -11.305 248 H ILE 53 H ILE 53 31.060 2.580 -6.726 249 HA ILE 53 HA ILE 53 31.717 5.337 -5.961 250 HB ILE 53 HB ILE 53 33.474 2.970 -6.658 251 HG12 ILE 53 HG12 ILE 53 33.191 4.602 -4.082 252 HG13 ILE 53 HG13 ILE 53 32.407 3.020 -4.421 253 HG21 ILE 53 HG21 ILE 53 34.575 4.979 -7.630 254 HG22 ILE 53 HG22 ILE 53 35.440 4.494 -6.144 255 HG23 ILE 53 HG23 ILE 53 34.312 5.898 -6.097 256 HD11 ILE 53 HD11 ILE 53 34.666 1.930 -4.595 257 HD12 ILE 53 HD12 ILE 53 34.375 2.707 -2.992 258 HD13 ILE 53 HD13 ILE 53 35.450 3.508 -4.191 259 H ILE 54 H ILE 54 31.736 6.894 -7.443 260 HA ILE 54 HA ILE 54 32.533 6.222 -10.159 261 HB ILE 54 HB ILE 54 31.027 7.937 -11.046 262 HG12 ILE 54 HG12 ILE 54 30.583 9.165 -8.857 263 HG13 ILE 54 HG13 ILE 54 29.199 8.883 -9.948 264 HG21 ILE 54 HG21 ILE 54 30.546 5.524 -11.270 265 HG22 ILE 54 HG22 ILE 54 29.016 6.466 -11.101 266 HG23 ILE 54 HG23 ILE 54 29.660 5.522 -9.707 267 HD11 ILE 54 HD11 ILE 54 29.709 7.262 -7.340 268 HD12 ILE 54 HD12 ILE 54 28.362 7.027 -8.510 269 HD13 ILE 54 HD13 ILE 54 28.514 8.569 -7.602 270 H GLY 55 H GLY 55 34.037 7.635 -11.074 271 HA2 GLY 55 HA2 GLY 55 34.660 10.137 -10.687 272 HA3 GLY 55 HA3 GLY 55 35.283 9.395 -9.155 273 H ASN 56 H ASN 56 37.462 10.052 -9.898 274 HA ASN 56 HA ASN 56 38.498 8.640 -12.172 275 HB2 ASN 56 HB2 ASN 56 40.595 9.892 -11.673 276 HB3 ASN 56 HB3 ASN 56 39.163 10.976 -11.761 277 HD21 ASN 56 HD21 ASN 56 41.943 10.497 -9.974 278 HD22 ASN 56 HD22 ASN 56 41.391 11.146 -8.449 Start of MODEL 14 1 H1 PHE 17 HT1 PHE 17 35.969 12.891 -6.002 2 H2 PHE 17 HT2 PHE 17 35.350 12.357 -7.486 3 H3 PHE 17 HT3 PHE 17 36.744 11.633 -6.837 4 HA PHE 17 HA PHE 17 34.838 10.226 -6.534 5 HB2 PHE 17 HB2 PHE 17 36.733 10.125 -4.994 6 HB3 PHE 17 HB3 PHE 17 36.069 11.497 -4.024 7 HD1 PHE 17 HD1 PHE 17 35.956 10.491 -1.936 8 HD2 PHE 17 HD2 PHE 17 34.150 8.442 -5.260 9 HE1 PHE 17 HE1 PHE 17 34.869 8.909 -0.376 10 HE2 PHE 17 HE2 PHE 17 33.030 6.911 -3.705 11 HZ PHE 17 HZ PHE 17 33.400 7.112 -1.256 12 H ASP 18 H ASP 18 32.689 10.186 -6.704 13 HA ASP 18 HA ASP 18 31.151 11.556 -4.613 14 HB2 ASP 18 HB2 ASP 18 30.258 10.921 -7.503 15 HB3 ASP 18 HB3 ASP 18 29.122 11.417 -6.186 16 H VAL 19 H VAL 19 29.419 10.179 -3.700 17 HA VAL 19 HA VAL 19 29.705 7.345 -4.384 18 HB VAL 19 HB VAL 19 31.025 7.767 -2.368 19 HG11 VAL 19 HG11 VAL 19 29.952 8.462 -0.238 20 HG12 VAL 19 HG12 VAL 19 28.396 8.766 -1.086 21 HG13 VAL 19 HG13 VAL 19 29.846 9.775 -1.463 22 HG21 VAL 19 HG21 VAL 19 30.003 5.997 -0.981 23 HG22 VAL 19 HG22 VAL 19 29.827 5.590 -2.729 24 HG23 VAL 19 HG23 VAL 19 28.416 6.222 -1.794 25 H VAL 20 H VAL 20 27.775 6.321 -4.670 26 HA VAL 20 HA VAL 20 25.325 7.660 -3.796 27 HB VAL 20 HB VAL 20 24.171 7.155 -5.917 28 HG11 VAL 20 HG11 VAL 20 25.133 8.972 -7.259 29 HG12 VAL 20 HG12 VAL 20 26.692 8.874 -6.358 30 HG13 VAL 20 HG13 VAL 20 25.196 9.427 -5.513 31 HG21 VAL 20 HG21 VAL 20 26.979 6.178 -6.767 32 HG22 VAL 20 HG22 VAL 20 25.722 6.679 -7.950 33 HG23 VAL 20 HG23 VAL 20 25.414 5.286 -6.842 34 H SER 21 H SER 21 23.414 6.070 -3.820 35 HA SER 21 HA SER 21 24.277 3.604 -2.692 36 HB2 SER 21 HB2 SER 21 21.817 3.168 -2.432 37 HB3 SER 21 HB3 SER 21 22.310 4.778 -1.803 38 HG SER 21 HG SER 21 21.332 4.372 -4.438 39 H CYS 22 H CYS 22 24.076 1.473 -3.446 40 HA CYS 22 HA CYS 22 23.832 1.188 -6.341 41 HB2 CYS 22 HB2 CYS 22 25.851 0.438 -5.022 42 HB3 CYS 22 HB3 CYS 22 24.816 -0.762 -4.197 43 H ASN 23 H ASN 23 21.810 0.940 -3.731 44 HA ASN 23 HA ASN 23 19.869 0.011 -3.229 45 HB2 ASN 23 HB2 ASN 23 19.450 1.034 -5.563 46 HB3 ASN 23 HB3 ASN 23 19.518 -0.639 -6.208 47 HD21 ASN 23 HD21 ASN 23 17.921 -2.183 -4.853 48 HD22 ASN 23 HD22 ASN 23 16.301 -1.521 -4.675 49 H LYS 24 H LYS 24 21.925 -1.714 -2.579 50 HA LYS 24 HA LYS 24 20.547 -4.272 -2.850 51 HB2 LYS 24 HB2 LYS 24 22.455 -4.299 -4.511 52 HB3 LYS 24 HB3 LYS 24 23.583 -3.910 -3.182 53 HG2 LYS 24 HG2 LYS 24 23.748 -6.283 -3.634 54 HG3 LYS 24 HG3 LYS 24 22.944 -6.119 -2.054 55 HD2 LYS 24 HD2 LYS 24 20.723 -6.556 -3.125 56 HD3 LYS 24 HD3 LYS 24 21.492 -6.512 -4.748 57 HE2 LYS 24 HE2 LYS 24 22.835 -8.557 -4.185 58 HE3 LYS 24 HE3 LYS 24 22.048 -8.619 -2.549 59 HZ1 LYS 24 HZ1 LYS 24 20.994 -10.046 -4.181 60 HZ2 LYS 24 HZ2 LYS 24 20.630 -8.705 -5.160 61 HZ3 LYS 24 HZ3 LYS 24 19.931 -8.847 -3.617 62 H ASN 25 H ASN 25 20.595 -5.487 -0.929 63 HA ASN 25 HA ASN 25 21.198 -3.900 1.409 64 HB2 ASN 25 HB2 ASN 25 18.970 -5.050 1.112 65 HB3 ASN 25 HB3 ASN 25 19.804 -6.644 1.144 66 HD21 ASN 25 HD21 ASN 25 20.647 -7.397 3.219 67 HD22 ASN 25 HD22 ASN 25 20.178 -6.638 4.712 68 H CYS 26 H CYS 26 22.900 -4.168 2.694 69 HA CYS 26 HA CYS 26 24.607 -6.540 2.511 70 HB2 CYS 26 HB2 CYS 26 25.820 -4.636 1.839 71 HB3 CYS 26 HB3 CYS 26 25.119 -3.597 3.144 72 H THR 27 H THR 27 25.213 -7.616 4.431 73 HA THR 27 HA THR 27 24.241 -6.548 6.962 74 HB THR 27 HB THR 27 24.156 -9.557 6.397 75 HG1 THR 27 HG1 THR 27 22.323 -9.326 5.547 76 HG21 THR 27 HG21 THR 27 24.299 -8.664 8.853 77 HG22 THR 27 HG22 THR 27 22.773 -9.560 8.487 78 HG23 THR 27 HG23 THR 27 22.780 -7.761 8.492 79 H SER 28 H SER 28 25.877 -7.300 8.656 80 HA SER 28 HA SER 28 28.452 -7.112 7.714 81 HB2 SER 28 HB2 SER 28 27.725 -6.569 10.058 82 HB3 SER 28 HB3 SER 28 27.481 -8.318 10.375 83 HG SER 28 HG SER 28 29.426 -8.017 11.119 84 H GLY 29 H GLY 29 26.832 -10.191 8.714 85 HA2 GLY 29 HA2 GLY 29 29.234 -11.696 8.228 86 HA3 GLY 29 HA3 GLY 29 27.593 -12.311 8.619 87 H GLN 30 H GLN 30 27.077 -10.384 6.049 88 HA GLN 30 HA GLN 30 27.359 -12.660 4.149 89 HB2 GLN 30 HB2 GLN 30 25.253 -10.419 4.270 90 HB3 GLN 30 HB3 GLN 30 25.347 -11.688 3.003 91 HG2 GLN 30 HG2 GLN 30 24.909 -13.469 4.737 92 HG3 GLN 30 HG3 GLN 30 24.825 -12.200 6.007 93 HE21 GLN 30 HE21 GLN 30 22.830 -14.129 4.275 94 HE22 GLN 30 HE22 GLN 30 21.446 -13.071 4.115 95 H ASN 31 H ASN 31 27.316 -9.098 4.449 96 HA ASN 31 HA ASN 31 27.974 -7.421 3.306 97 HB2 ASN 31 HB2 ASN 31 30.024 -8.575 4.519 98 HB3 ASN 31 HB3 ASN 31 30.580 -8.919 2.841 99 HD21 ASN 31 HD21 ASN 31 30.305 -6.553 5.359 100 HD22 ASN 31 HD22 ASN 31 31.015 -5.205 4.513 101 H GLU 32 H GLU 32 26.286 -8.450 1.579 102 HA GLU 32 HA GLU 32 27.656 -9.326 -0.853 103 HB2 GLU 32 HB2 GLU 32 24.787 -9.487 0.150 104 HB3 GLU 32 HB3 GLU 32 25.221 -9.947 -1.529 105 HG2 GLU 32 HG2 GLU 32 26.473 -11.249 0.989 106 HG3 GLU 32 HG3 GLU 32 25.011 -11.898 0.147 107 H CYS 33 H CYS 33 28.108 -7.865 -2.395 108 HA CYS 33 HA CYS 33 26.013 -5.987 -3.139 109 HB2 CYS 33 HB2 CYS 33 29.018 -5.313 -2.992 110 HB3 CYS 33 HB3 CYS 33 27.754 -4.250 -3.681 111 HA PRO 34 HA PRO 34 27.433 -7.781 -7.050 112 HB2 PRO 34 HB2 PRO 34 26.612 -5.894 -8.938 113 HB3 PRO 34 HB3 PRO 34 25.427 -6.914 -8.029 114 HG2 PRO 34 HG2 PRO 34 26.371 -4.086 -7.307 115 HG3 PRO 34 HG3 PRO 34 24.661 -4.652 -7.513 116 HD2 PRO 34 HD2 PRO 34 25.841 -4.549 -5.029 117 HD3 PRO 34 HD3 PRO 34 24.779 -5.965 -5.482 118 H GLU 35 H GLU 35 29.082 -7.360 -8.816 119 HA GLU 35 HA GLU 35 31.349 -6.182 -7.681 120 HB2 GLU 35 HB2 GLU 35 31.344 -8.112 -9.221 121 HB3 GLU 35 HB3 GLU 35 30.777 -7.086 -10.563 122 HG2 GLU 35 HG2 GLU 35 33.494 -6.618 -9.118 123 HG3 GLU 35 HG3 GLU 35 33.296 -7.768 -10.486 124 H GLY 36 H GLY 36 32.294 -4.188 -7.815 125 HA2 GLY 36 HA2 GLY 36 32.699 -2.104 -8.761 126 HA3 GLY 36 HA3 GLY 36 31.129 -2.175 -9.629 127 H CYS 37 H CYS 37 30.105 -3.297 -6.824 128 HA CYS 37 HA CYS 37 29.837 -0.663 -5.541 129 HB2 CYS 37 HB2 CYS 37 27.922 -3.049 -5.541 130 HB3 CYS 37 HB3 CYS 37 27.720 -1.566 -4.538 131 H PHE 38 H PHE 38 29.795 -0.643 -3.168 132 HA PHE 38 HA PHE 38 31.103 -2.974 -1.936 133 HB2 PHE 38 HB2 PHE 38 32.885 -1.700 -0.933 134 HB3 PHE 38 HB3 PHE 38 32.894 -1.234 -2.664 135 HD1 PHE 38 HD1 PHE 38 31.440 0.994 -3.221 136 HD2 PHE 38 HD2 PHE 38 33.020 -0.031 0.642 137 HE1 PHE 38 HE1 PHE 38 31.275 3.358 -2.506 138 HE2 PHE 38 HE2 PHE 38 32.986 2.355 1.291 139 HZ PHE 38 HZ PHE 38 32.118 4.065 -0.321 140 H CYS 39 H CYS 39 30.946 -2.917 0.494 141 HA CYS 39 HA CYS 39 28.661 -1.272 1.393 142 HB2 CYS 39 HB2 CYS 39 28.108 -3.599 1.422 143 HB3 CYS 39 HB3 CYS 39 29.632 -4.036 2.274 144 H GLY 40 H GLY 40 29.238 0.390 2.599 145 HA2 GLY 40 HA2 GLY 40 31.703 0.305 4.193 146 HA3 GLY 40 HA3 GLY 40 30.624 1.709 3.888 147 H LEU 41 H LEU 41 30.557 -1.538 5.442 148 HA LEU 41 HA LEU 41 28.985 -0.355 7.645 149 HB2 LEU 41 HB2 LEU 41 27.872 -2.296 6.599 150 HB3 LEU 41 HB3 LEU 41 29.356 -3.272 6.793 151 HG LEU 41 HG LEU 41 29.122 -3.173 9.281 152 HD11 LEU 41 HD11 LEU 41 26.508 -1.627 8.705 153 HD12 LEU 41 HD12 LEU 41 27.935 -1.003 9.619 154 HD13 LEU 41 HD13 LEU 41 26.962 -2.366 10.288 155 HD21 LEU 41 HD21 LEU 41 27.005 -4.568 9.408 156 HD22 LEU 41 HD22 LEU 41 28.222 -5.054 8.149 157 HD23 LEU 41 HD23 LEU 41 26.729 -4.182 7.666 158 H LEU 42 H LEU 42 30.072 0.078 9.500 159 HA LEU 42 HA LEU 42 32.761 -1.104 9.785 160 HB2 LEU 42 HB2 LEU 42 31.647 1.486 11.029 161 HB3 LEU 42 HB3 LEU 42 33.319 0.859 11.133 162 HG LEU 42 HG LEU 42 33.461 2.612 9.647 163 HD11 LEU 42 HD11 LEU 42 33.070 0.306 7.648 164 HD12 LEU 42 HD12 LEU 42 34.521 0.475 8.697 165 HD13 LEU 42 HD13 LEU 42 34.127 1.749 7.477 166 HD21 LEU 42 HD21 LEU 42 31.005 1.715 8.021 167 HD22 LEU 42 HD22 LEU 42 31.926 3.255 7.891 168 HD23 LEU 42 HD23 LEU 42 30.953 2.888 9.376 169 H GLY 43 H GLY 43 33.053 -2.438 11.558 170 HA2 GLY 43 HA2 GLY 43 33.020 -3.066 13.694 171 HA3 GLY 43 HA3 GLY 43 32.104 -1.567 14.053 172 H GLN 44 H GLN 44 30.434 -3.471 11.883 173 HA GLN 44 HA GLN 44 28.435 -4.354 11.945 174 HB2 GLN 44 HB2 GLN 44 29.819 -6.235 12.857 175 HB3 GLN 44 HB3 GLN 44 29.342 -5.763 14.514 176 HG2 GLN 44 HG2 GLN 44 26.968 -6.356 14.053 177 HG3 GLN 44 HG3 GLN 44 27.318 -6.574 12.304 178 HE21 GLN 44 HE21 GLN 44 27.014 -8.252 15.278 179 HE22 GLN 44 HE22 GLN 44 27.809 -9.728 14.770 180 H ASN 45 H ASN 45 28.373 -1.794 12.812 181 HA ASN 45 HA ASN 45 26.819 -1.409 15.162 182 HB2 ASN 45 HB2 ASN 45 27.280 0.225 12.613 183 HB3 ASN 45 HB3 ASN 45 26.070 0.779 13.800 184 HD21 ASN 45 HD21 ASN 45 29.598 0.385 13.178 185 HD22 ASN 45 HD22 ASN 45 30.064 1.288 14.589 186 H LYS 46 H LYS 46 25.782 -1.719 11.762 187 HA LYS 46 HA LYS 46 23.252 -2.816 12.639 188 HB2 LYS 46 HB2 LYS 46 23.413 -0.349 10.779 189 HB3 LYS 46 HB3 LYS 46 21.916 -1.341 11.031 190 HG2 LYS 46 HG2 LYS 46 23.322 0.276 13.214 191 HG3 LYS 46 HG3 LYS 46 21.927 0.842 12.245 192 HD2 LYS 46 HD2 LYS 46 20.496 -0.970 13.088 193 HD3 LYS 46 HD3 LYS 46 21.864 -1.703 13.983 194 HE2 LYS 46 HE2 LYS 46 20.679 1.089 14.585 195 HE3 LYS 46 HE3 LYS 46 20.360 -0.445 15.502 196 HZ1 LYS 46 HZ1 LYS 46 22.832 1.130 15.298 197 HZ2 LYS 46 HZ2 LYS 46 22.916 -0.531 15.592 198 HZ3 LYS 46 HZ3 LYS 46 22.061 0.478 16.668 199 H LYS 47 H LYS 47 22.979 -1.821 9.542 200 HA LYS 47 HA LYS 47 24.012 -4.310 8.397 201 HB2 LYS 47 HB2 LYS 47 22.085 -4.043 6.812 202 HB3 LYS 47 HB3 LYS 47 21.599 -4.323 8.506 203 HG2 LYS 47 HG2 LYS 47 20.776 -2.143 8.789 204 HG3 LYS 47 HG3 LYS 47 21.810 -1.427 7.531 205 HD2 LYS 47 HD2 LYS 47 19.483 -1.475 6.750 206 HD3 LYS 47 HD3 LYS 47 20.447 -2.632 5.776 207 HE2 LYS 47 HE2 LYS 47 19.522 -4.542 7.207 208 HE3 LYS 47 HE3 LYS 47 18.482 -3.326 8.066 209 HZ1 LYS 47 HZ1 LYS 47 18.512 -3.940 5.159 210 HZ2 LYS 47 HZ2 LYS 47 17.572 -2.733 5.885 211 HZ3 LYS 47 HZ3 LYS 47 17.314 -4.371 6.274 212 H GLY 48 H GLY 48 23.812 -0.744 7.835 213 HA2 GLY 48 HA2 GLY 48 24.994 0.512 6.359 214 HA3 GLY 48 HA3 GLY 48 25.870 -0.962 5.800 215 H HIS 49 H HIS 49 25.491 0.051 3.537 216 HA HIS 49 HA HIS 49 23.349 -1.452 2.464 217 HB2 HIS 49 HB2 HIS 49 22.228 0.840 3.041 218 HB3 HIS 49 HB3 HIS 49 23.357 1.582 1.870 219 HD2 HIS 49 HD2 HIS 49 22.076 1.818 -0.607 220 HE1 HIS 49 HE1 HIS 49 19.257 -1.279 0.015 221 HE2 HIS 49 HE2 HIS 49 19.969 0.641 -1.497 222 H CYS 50 H CYS 50 23.857 -1.596 -0.036 223 HA CYS 50 HA CYS 50 26.699 -1.261 -0.382 224 HB2 CYS 50 HB2 CYS 50 24.530 -2.119 -2.343 225 HB3 CYS 50 HB3 CYS 50 26.289 -2.120 -2.715 226 H TYR 51 H TYR 51 27.836 0.222 -1.591 227 HA TYR 51 HA TYR 51 26.296 2.477 -2.752 228 HB2 TYR 51 HB2 TYR 51 29.155 2.643 -1.650 229 HB3 TYR 51 HB3 TYR 51 28.047 3.998 -2.107 230 HD1 TYR 51 HD1 TYR 51 25.530 3.105 -0.440 231 HD2 TYR 51 HD2 TYR 51 29.743 3.243 0.355 232 HE1 TYR 51 HE1 TYR 51 25.086 2.953 1.997 233 HE2 TYR 51 HE2 TYR 51 29.315 3.073 2.774 234 HH TYR 51 HH TYR 51 27.696 2.268 4.271 235 H LYS 52 H LYS 52 27.368 3.503 -4.597 236 HA LYS 52 HA LYS 52 29.336 1.800 -6.005 237 HB2 LYS 52 HB2 LYS 52 27.143 2.118 -7.176 238 HB3 LYS 52 HB3 LYS 52 27.386 3.889 -7.122 239 HG2 LYS 52 HG2 LYS 52 29.511 3.583 -8.524 240 HG3 LYS 52 HG3 LYS 52 29.129 1.836 -8.623 241 HD2 LYS 52 HD2 LYS 52 27.424 4.162 -9.708 242 HD3 LYS 52 HD3 LYS 52 28.454 3.043 -10.661 243 HE2 LYS 52 HE2 LYS 52 26.951 1.110 -9.928 244 HE3 LYS 52 HE3 LYS 52 25.874 2.332 -9.118 245 HZ1 LYS 52 HZ1 LYS 52 26.611 2.275 -11.994 246 HZ2 LYS 52 HZ2 LYS 52 25.608 3.419 -11.233 247 HZ3 LYS 52 HZ3 LYS 52 25.131 1.790 -11.314 248 H ILE 53 H ILE 53 31.348 2.720 -6.558 249 HA ILE 53 HA ILE 53 31.848 5.490 -5.708 250 HB ILE 53 HB ILE 53 33.757 3.227 -6.365 251 HG12 ILE 53 HG12 ILE 53 33.275 4.774 -3.758 252 HG13 ILE 53 HG13 ILE 53 32.529 3.194 -4.171 253 HG21 ILE 53 HG21 ILE 53 34.394 6.169 -5.652 254 HG22 ILE 53 HG22 ILE 53 34.787 5.329 -7.203 255 HG23 ILE 53 HG23 ILE 53 35.599 4.830 -5.688 256 HD11 ILE 53 HD11 ILE 53 35.572 3.641 -3.864 257 HD12 ILE 53 HD12 ILE 53 34.713 2.073 -4.169 258 HD13 ILE 53 HD13 ILE 53 34.459 2.951 -2.625 259 H ILE 54 H ILE 54 31.875 7.066 -7.180 260 HA ILE 54 HA ILE 54 32.695 6.446 -9.904 261 HB ILE 54 HB ILE 54 31.054 8.021 -10.803 262 HG12 ILE 54 HG12 ILE 54 30.555 9.220 -8.612 263 HG13 ILE 54 HG13 ILE 54 29.186 8.860 -9.702 264 HG21 ILE 54 HG21 ILE 54 29.167 6.409 -10.837 265 HG22 ILE 54 HG22 ILE 54 29.868 5.541 -9.421 266 HG23 ILE 54 HG23 ILE 54 30.759 5.569 -10.983 267 HD11 ILE 54 HD11 ILE 54 28.445 6.973 -8.266 268 HD12 ILE 54 HD12 ILE 54 28.542 8.509 -7.340 269 HD13 ILE 54 HD13 ILE 54 29.791 7.249 -7.106 270 H GLY 55 H GLY 55 33.448 8.372 -11.098 271 HA2 GLY 55 HA2 GLY 55 34.330 10.482 -11.201 272 HA3 GLY 55 HA3 GLY 55 34.309 10.613 -9.414 273 H ASN 56 H ASN 56 35.618 7.718 -9.664 274 HA ASN 56 HA ASN 56 38.311 8.639 -9.415 275 HB2 ASN 56 HB2 ASN 56 37.299 6.704 -8.127 276 HB3 ASN 56 HB3 ASN 56 37.230 5.763 -9.659 277 HD21 ASN 56 HD21 ASN 56 39.096 6.277 -6.868 278 HD22 ASN 56 HD22 ASN 56 40.623 5.703 -7.491 Start of MODEL 15 1 H1 PHE 17 HT1 PHE 17 36.446 12.515 -7.293 2 H2 PHE 17 HT2 PHE 17 35.375 13.769 -6.918 3 H3 PHE 17 HT3 PHE 17 35.135 12.868 -8.328 4 HA PHE 17 HA PHE 17 34.611 10.934 -7.055 5 HB2 PHE 17 HB2 PHE 17 36.270 11.290 -5.299 6 HB3 PHE 17 HB3 PHE 17 35.367 12.729 -4.692 7 HD1 PHE 17 HD1 PHE 17 33.677 9.420 -5.563 8 HD2 PHE 17 HD2 PHE 17 35.237 11.994 -2.475 9 HE1 PHE 17 HE1 PHE 17 32.495 8.123 -3.882 10 HE2 PHE 17 HE2 PHE 17 34.082 10.625 -0.769 11 HZ PHE 17 HZ PHE 17 32.701 8.683 -1.467 12 H ASP 18 H ASP 18 32.529 10.644 -7.507 13 HA ASP 18 HA ASP 18 30.608 12.102 -5.843 14 HB2 ASP 18 HB2 ASP 18 30.149 11.040 -8.713 15 HB3 ASP 18 HB3 ASP 18 28.830 11.619 -7.612 16 H VAL 19 H VAL 19 28.946 10.670 -4.922 17 HA VAL 19 HA VAL 19 29.598 7.814 -5.175 18 HB VAL 19 HB VAL 19 30.466 8.668 -3.042 19 HG11 VAL 19 HG11 VAL 19 27.546 9.428 -2.380 20 HG12 VAL 19 HG12 VAL 19 28.904 10.584 -2.667 21 HG13 VAL 19 HG13 VAL 19 28.950 9.467 -1.258 22 HG21 VAL 19 HG21 VAL 19 27.998 6.839 -2.701 23 HG22 VAL 19 HG22 VAL 19 29.429 6.945 -1.618 24 HG23 VAL 19 HG23 VAL 19 29.618 6.311 -3.296 25 H VAL 20 H VAL 20 27.865 6.486 -5.532 26 HA VAL 20 HA VAL 20 25.183 7.607 -5.175 27 HB VAL 20 HB VAL 20 24.374 6.447 -7.215 28 HG11 VAL 20 HG11 VAL 20 26.594 8.547 -7.720 29 HG12 VAL 20 HG12 VAL 20 24.889 8.899 -7.266 30 HG13 VAL 20 HG13 VAL 20 25.257 8.119 -8.850 31 HG21 VAL 20 HG21 VAL 20 26.029 5.684 -8.927 32 HG22 VAL 20 HG22 VAL 20 26.258 4.752 -7.402 33 HG23 VAL 20 HG23 VAL 20 27.392 6.079 -7.820 34 H SER 21 H SER 21 23.514 5.904 -4.832 35 HA SER 21 HA SER 21 24.621 3.693 -3.366 36 HB2 SER 21 HB2 SER 21 22.277 3.195 -2.750 37 HB3 SER 21 HB3 SER 21 22.700 4.913 -2.439 38 HG SER 21 HG SER 21 20.791 3.893 -4.044 39 H CYS 22 H CYS 22 24.291 1.470 -3.793 40 HA CYS 22 HA CYS 22 23.874 0.817 -6.613 41 HB2 CYS 22 HB2 CYS 22 25.922 0.153 -5.228 42 HB3 CYS 22 HB3 CYS 22 24.848 -0.927 -4.296 43 H ASN 23 H ASN 23 22.160 1.009 -3.768 44 HA ASN 23 HA ASN 23 20.259 0.321 -2.909 45 HB2 ASN 23 HB2 ASN 23 19.582 -0.208 -5.859 46 HB3 ASN 23 HB3 ASN 23 18.358 -0.132 -4.529 47 HD21 ASN 23 HD21 ASN 23 18.464 1.652 -6.834 48 HD22 ASN 23 HD22 ASN 23 18.721 3.260 -6.198 49 H LYS 24 H LYS 24 22.170 -1.610 -2.580 50 HA LYS 24 HA LYS 24 20.454 -3.998 -2.429 51 HB2 LYS 24 HB2 LYS 24 22.400 -4.364 -4.000 52 HB3 LYS 24 HB3 LYS 24 23.514 -3.887 -2.690 53 HG2 LYS 24 HG2 LYS 24 23.550 -6.291 -2.814 54 HG3 LYS 24 HG3 LYS 24 22.653 -5.905 -1.325 55 HD2 LYS 24 HD2 LYS 24 20.483 -6.330 -2.508 56 HD3 LYS 24 HD3 LYS 24 21.372 -6.522 -4.058 57 HE2 LYS 24 HE2 LYS 24 22.544 -8.554 -3.137 58 HE3 LYS 24 HE3 LYS 24 21.596 -8.387 -1.597 59 HZ1 LYS 24 HZ1 LYS 24 20.445 -8.710 -4.321 60 HZ2 LYS 24 HZ2 LYS 24 19.587 -8.630 -2.857 61 HZ3 LYS 24 HZ3 LYS 24 20.626 -9.938 -3.162 62 H ASN 25 H ASN 25 20.213 -4.814 -0.368 63 HA ASN 25 HA ASN 25 21.178 -3.178 1.819 64 HB2 ASN 25 HB2 ASN 25 18.749 -3.827 1.630 65 HB3 ASN 25 HB3 ASN 25 19.210 -5.561 1.750 66 HD21 ASN 25 HD21 ASN 25 20.006 -6.338 3.836 67 HD22 ASN 25 HD22 ASN 25 19.615 -5.458 5.296 68 H CYS 26 H CYS 26 22.852 -3.769 3.176 69 HA CYS 26 HA CYS 26 23.903 -6.498 2.987 70 HB2 CYS 26 HB2 CYS 26 25.339 -5.176 1.788 71 HB3 CYS 26 HB3 CYS 26 25.173 -3.753 2.878 72 H THR 27 H THR 27 24.316 -7.586 4.799 73 HA THR 27 HA THR 27 23.809 -6.305 7.413 74 HB THR 27 HB THR 27 23.257 -9.217 6.652 75 HG1 THR 27 HG1 THR 27 21.732 -7.753 5.786 76 HG21 THR 27 HG21 THR 27 22.062 -9.269 8.869 77 HG22 THR 27 HG22 THR 27 22.634 -7.602 9.215 78 HG23 THR 27 HG23 THR 27 23.819 -8.964 9.081 79 H SER 28 H SER 28 25.353 -7.051 9.066 80 HA SER 28 HA SER 28 27.874 -6.943 8.052 81 HB2 SER 28 HB2 SER 28 28.638 -7.238 10.408 82 HB3 SER 28 HB3 SER 28 27.199 -6.160 10.267 83 HG SER 28 HG SER 28 26.874 -7.578 11.932 84 H GLY 29 H GLY 29 26.364 -9.909 9.367 85 HA2 GLY 29 HA2 GLY 29 28.564 -11.611 8.969 86 HA3 GLY 29 HA3 GLY 29 26.830 -12.091 9.030 87 H GLN 30 H GLN 30 26.128 -10.498 6.675 88 HA GLN 30 HA GLN 30 26.698 -12.575 4.726 89 HB2 GLN 30 HB2 GLN 30 25.015 -10.001 4.694 90 HB3 GLN 30 HB3 GLN 30 25.136 -11.081 3.279 91 HG2 GLN 30 HG2 GLN 30 24.060 -12.010 6.034 92 HG3 GLN 30 HG3 GLN 30 23.017 -11.340 4.732 93 HE21 GLN 30 HE21 GLN 30 23.539 -12.424 2.461 94 HE22 GLN 30 HE22 GLN 30 23.579 -14.177 2.509 95 H ASN 31 H ASN 31 27.224 -9.090 5.101 96 HA ASN 31 HA ASN 31 28.384 -7.550 4.111 97 HB2 ASN 31 HB2 ASN 31 30.066 -9.071 5.403 98 HB3 ASN 31 HB3 ASN 31 30.598 -9.656 3.791 99 HD21 ASN 31 HD21 ASN 31 29.974 -6.617 5.618 100 HD22 ASN 31 HD22 ASN 31 31.357 -5.734 5.008 101 H GLU 32 H GLU 32 26.599 -8.586 2.233 102 HA GLU 32 HA GLU 32 28.083 -9.222 -0.201 103 HB2 GLU 32 HB2 GLU 32 25.128 -9.380 0.514 104 HB3 GLU 32 HB3 GLU 32 25.758 -9.825 -1.099 105 HG2 GLU 32 HG2 GLU 32 26.587 -11.287 1.500 106 HG3 GLU 32 HG3 GLU 32 25.287 -11.831 0.377 107 H CYS 33 H CYS 33 28.150 -8.008 -2.032 108 HA CYS 33 HA CYS 33 25.947 -6.238 -2.563 109 HB2 CYS 33 HB2 CYS 33 28.880 -5.420 -3.032 110 HB3 CYS 33 HB3 CYS 33 27.459 -4.537 -3.668 111 HA PRO 34 HA PRO 34 26.912 -8.326 -6.503 112 HB2 PRO 34 HB2 PRO 34 25.878 -6.564 -8.411 113 HB3 PRO 34 HB3 PRO 34 24.804 -7.543 -7.334 114 HG2 PRO 34 HG2 PRO 34 25.765 -4.668 -6.860 115 HG3 PRO 34 HG3 PRO 34 24.051 -5.263 -6.881 116 HD2 PRO 34 HD2 PRO 34 25.430 -5.014 -4.522 117 HD3 PRO 34 HD3 PRO 34 24.382 -6.481 -4.809 118 H GLU 35 H GLU 35 28.358 -7.950 -8.464 119 HA GLU 35 HA GLU 35 30.725 -6.842 -7.472 120 HB2 GLU 35 HB2 GLU 35 30.005 -7.785 -10.292 121 HB3 GLU 35 HB3 GLU 35 31.667 -7.360 -9.773 122 HG2 GLU 35 HG2 GLU 35 31.639 -9.173 -8.031 123 HG3 GLU 35 HG3 GLU 35 29.970 -9.639 -8.529 124 H GLY 36 H GLY 36 31.915 -5.022 -7.856 125 HA2 GLY 36 HA2 GLY 36 32.467 -3.031 -8.881 126 HA3 GLY 36 HA3 GLY 36 30.856 -2.968 -9.673 127 H CYS 37 H CYS 37 29.925 -3.811 -6.734 128 HA CYS 37 HA CYS 37 29.876 -1.064 -5.668 129 HB2 CYS 37 HB2 CYS 37 27.816 -3.321 -5.411 130 HB3 CYS 37 HB3 CYS 37 27.713 -1.717 -4.595 131 H PHE 38 H PHE 38 29.922 -0.860 -3.300 132 HA PHE 38 HA PHE 38 31.027 -3.220 -1.925 133 HB2 PHE 38 HB2 PHE 38 32.778 -1.856 -0.828 134 HB3 PHE 38 HB3 PHE 38 32.985 -1.785 -2.622 135 HD1 PHE 38 HD1 PHE 38 32.425 0.102 0.442 136 HD2 PHE 38 HD2 PHE 38 32.056 0.256 -3.835 137 HE1 PHE 38 HE1 PHE 38 32.170 2.562 0.555 138 HE2 PHE 38 HE2 PHE 38 31.666 2.670 -3.723 139 HZ PHE 38 HZ PHE 38 31.768 3.858 -1.521 140 H CYS 39 H CYS 39 30.845 -3.184 0.417 141 HA CYS 39 HA CYS 39 28.483 -1.672 1.293 142 HB2 CYS 39 HB2 CYS 39 28.211 -4.117 1.336 143 HB3 CYS 39 HB3 CYS 39 29.732 -4.308 2.263 144 H GLY 40 H GLY 40 28.865 0.038 2.566 145 HA2 GLY 40 HA2 GLY 40 31.384 0.242 4.053 146 HA3 GLY 40 HA3 GLY 40 30.108 1.491 3.839 147 H LEU 41 H LEU 41 30.616 -1.733 5.354 148 HA LEU 41 HA LEU 41 28.862 -0.859 7.571 149 HB2 LEU 41 HB2 LEU 41 28.107 -2.853 6.312 150 HB3 LEU 41 HB3 LEU 41 29.660 -3.678 6.641 151 HG LEU 41 HG LEU 41 27.631 -4.368 7.996 152 HD11 LEU 41 HD11 LEU 41 29.980 -3.409 9.757 153 HD12 LEU 41 HD12 LEU 41 29.896 -4.960 8.836 154 HD13 LEU 41 HD13 LEU 41 28.733 -4.616 10.181 155 HD21 LEU 41 HD21 LEU 41 28.006 -1.828 9.672 156 HD22 LEU 41 HD22 LEU 41 26.640 -3.007 9.660 157 HD23 LEU 41 HD23 LEU 41 26.868 -1.893 8.274 158 H LEU 42 H LEU 42 29.835 -0.387 9.487 159 HA LEU 42 HA LEU 42 32.733 -0.930 9.614 160 HB2 LEU 42 HB2 LEU 42 31.156 1.397 10.881 161 HB3 LEU 42 HB3 LEU 42 32.931 1.164 10.855 162 HG LEU 42 HG LEU 42 32.641 2.801 9.287 163 HD11 LEU 42 HD11 LEU 42 33.815 0.697 8.234 164 HD12 LEU 42 HD12 LEU 42 33.267 2.032 7.141 165 HD13 LEU 42 HD13 LEU 42 32.308 0.523 7.280 166 HD21 LEU 42 HD21 LEU 42 29.985 1.489 8.477 167 HD22 LEU 42 HD22 LEU 42 30.751 2.773 7.491 168 HD23 LEU 42 HD23 LEU 42 30.294 3.097 9.208 169 H GLY 43 H GLY 43 33.544 -1.867 11.515 170 HA2 GLY 43 HA2 GLY 43 33.710 -2.447 13.662 171 HA3 GLY 43 HA3 GLY 43 32.392 -1.276 13.992 172 H GLN 44 H GLN 44 31.631 -3.846 11.921 173 HA GLN 44 HA GLN 44 30.032 -5.335 11.917 174 HB2 GLN 44 HB2 GLN 44 31.773 -6.506 13.433 175 HB3 GLN 44 HB3 GLN 44 30.677 -6.106 14.789 176 HG2 GLN 44 HG2 GLN 44 28.792 -7.393 13.429 177 HG3 GLN 44 HG3 GLN 44 30.097 -7.857 12.291 178 HE21 GLN 44 HE21 GLN 44 28.887 -8.221 15.613 179 HE22 GLN 44 HE22 GLN 44 29.836 -9.647 15.993 180 H ASN 45 H ASN 45 29.146 -2.724 12.507 181 HA ASN 45 HA ASN 45 26.883 -2.944 14.255 182 HB2 ASN 45 HB2 ASN 45 27.605 -1.006 11.974 183 HB3 ASN 45 HB3 ASN 45 26.033 -0.909 12.852 184 HD21 ASN 45 HD21 ASN 45 29.514 -0.260 13.148 185 HD22 ASN 45 HD22 ASN 45 29.359 0.551 14.688 186 H LYS 46 H LYS 46 24.566 -2.597 13.174 187 HA LYS 46 HA LYS 46 24.151 -5.273 12.378 188 HB2 LYS 46 HB2 LYS 46 22.211 -2.906 12.577 189 HB3 LYS 46 HB3 LYS 46 21.703 -4.597 12.263 190 HG2 LYS 46 HG2 LYS 46 22.672 -5.344 14.425 191 HG3 LYS 46 HG3 LYS 46 23.226 -3.679 14.770 192 HD2 LYS 46 HD2 LYS 46 21.175 -4.092 16.015 193 HD3 LYS 46 HD3 LYS 46 20.878 -2.855 14.757 194 HE2 LYS 46 HE2 LYS 46 18.950 -4.383 14.926 195 HE3 LYS 46 HE3 LYS 46 19.741 -4.616 13.317 196 HZ1 LYS 46 HZ1 LYS 46 20.903 -6.511 14.253 197 HZ2 LYS 46 HZ2 LYS 46 19.216 -6.687 14.340 198 HZ3 LYS 46 HZ3 LYS 46 20.103 -6.303 15.739 199 H LYS 47 H LYS 47 23.612 -2.252 10.429 200 HA LYS 47 HA LYS 47 23.555 -3.933 8.036 201 HB2 LYS 47 HB2 LYS 47 21.484 -1.781 8.716 202 HB3 LYS 47 HB3 LYS 47 21.727 -2.462 7.072 203 HG2 LYS 47 HG2 LYS 47 21.140 -4.715 7.868 204 HG3 LYS 47 HG3 LYS 47 20.825 -4.097 9.522 205 HD2 LYS 47 HD2 LYS 47 18.937 -2.785 8.781 206 HD3 LYS 47 HD3 LYS 47 19.441 -2.887 7.061 207 HE2 LYS 47 HE2 LYS 47 18.882 -5.259 6.918 208 HE3 LYS 47 HE3 LYS 47 18.424 -5.315 8.676 209 HZ1 LYS 47 HZ1 LYS 47 16.522 -5.042 7.251 210 HZ2 LYS 47 HZ2 LYS 47 17.190 -3.645 6.551 211 HZ3 LYS 47 HZ3 LYS 47 16.742 -3.642 8.190 212 H GLY 48 H GLY 48 24.175 -2.969 6.141 213 HA2 GLY 48 HA2 GLY 48 25.028 -0.183 6.156 214 HA3 GLY 48 HA3 GLY 48 26.159 -1.494 5.606 215 H HIS 49 H HIS 49 25.391 0.454 3.701 216 HA HIS 49 HA HIS 49 23.425 -1.067 2.090 217 HB2 HIS 49 HB2 HIS 49 22.533 1.124 3.131 218 HB3 HIS 49 HB3 HIS 49 23.766 1.987 2.164 219 HD2 HIS 49 HD2 HIS 49 22.535 2.911 -0.187 220 HE1 HIS 49 HE1 HIS 49 19.502 -0.059 -0.294 221 HE2 HIS 49 HE2 HIS 49 20.391 2.098 -1.372 222 H CYS 50 H CYS 50 24.033 -1.293 -0.135 223 HA CYS 50 HA CYS 50 26.859 -1.013 -0.507 224 HB2 CYS 50 HB2 CYS 50 24.665 -1.974 -2.394 225 HB3 CYS 50 HB3 CYS 50 26.422 -2.049 -2.771 226 H TYR 51 H TYR 51 28.052 0.381 -1.797 227 HA TYR 51 HA TYR 51 26.541 2.545 -3.169 228 HB2 TYR 51 HB2 TYR 51 29.347 2.956 -1.960 229 HB3 TYR 51 HB3 TYR 51 28.172 4.181 -2.538 230 HD1 TYR 51 HD1 TYR 51 25.869 4.362 -1.188 231 HD2 TYR 51 HD2 TYR 51 29.432 2.423 0.221 232 HE1 TYR 51 HE1 TYR 51 25.026 4.479 1.157 233 HE2 TYR 51 HE2 TYR 51 28.632 2.561 2.525 234 HH TYR 51 HH TYR 51 26.881 3.048 3.864 235 H LYS 52 H LYS 52 27.780 3.583 -4.944 236 HA LYS 52 HA LYS 52 30.099 2.032 -5.898 237 HB2 LYS 52 HB2 LYS 52 28.134 1.629 -7.388 238 HB3 LYS 52 HB3 LYS 52 27.962 3.395 -7.612 239 HG2 LYS 52 HG2 LYS 52 30.255 3.454 -8.706 240 HG3 LYS 52 HG3 LYS 52 30.396 1.685 -8.433 241 HD2 LYS 52 HD2 LYS 52 29.776 2.061 -10.729 242 HD3 LYS 52 HD3 LYS 52 28.368 1.322 -9.894 243 HE2 LYS 52 HE2 LYS 52 27.230 3.547 -9.789 244 HE3 LYS 52 HE3 LYS 52 28.705 4.344 -10.482 245 HZ1 LYS 52 HZ1 LYS 52 27.031 3.920 -12.140 246 HZ2 LYS 52 HZ2 LYS 52 27.039 2.257 -11.794 247 HZ3 LYS 52 HZ3 LYS 52 28.420 2.994 -12.455 248 H ILE 53 H ILE 53 31.918 3.247 -6.353 249 HA ILE 53 HA ILE 53 31.804 6.150 -5.938 250 HB ILE 53 HB ILE 53 34.083 4.167 -5.739 251 HG12 ILE 53 HG12 ILE 53 33.066 6.154 -3.638 252 HG13 ILE 53 HG13 ILE 53 32.410 4.514 -3.780 253 HG21 ILE 53 HG21 ILE 53 35.015 6.165 -6.872 254 HG22 ILE 53 HG22 ILE 53 35.556 6.145 -5.170 255 HG23 ILE 53 HG23 ILE 53 34.223 7.253 -5.667 256 HD11 ILE 53 HD11 ILE 53 34.155 4.576 -2.026 257 HD12 ILE 53 HD12 ILE 53 35.359 5.275 -3.167 258 HD13 ILE 53 HD13 ILE 53 34.767 3.585 -3.398 259 H ILE 54 H ILE 54 32.059 7.479 -7.614 260 HA ILE 54 HA ILE 54 33.430 6.535 -9.998 261 HB ILE 54 HB ILE 54 31.839 7.819 -11.394 262 HG12 ILE 54 HG12 ILE 54 30.868 9.122 -9.362 263 HG13 ILE 54 HG13 ILE 54 29.797 8.647 -10.721 264 HG21 ILE 54 HG21 ILE 54 30.709 5.366 -9.921 265 HG22 ILE 54 HG22 ILE 54 31.839 5.353 -11.318 266 HG23 ILE 54 HG23 ILE 54 30.163 5.990 -11.522 267 HD11 ILE 54 HD11 ILE 54 29.930 7.129 -8.006 268 HD12 ILE 54 HD12 ILE 54 28.839 6.788 -9.395 269 HD13 ILE 54 HD13 ILE 54 28.702 8.338 -8.497 270 H GLY 55 H GLY 55 34.283 8.297 -11.346 271 HA2 GLY 55 HA2 GLY 55 35.183 10.423 -11.547 272 HA3 GLY 55 HA3 GLY 55 34.929 10.720 -9.787 273 H ASN 56 H ASN 56 36.657 10.376 -8.465 274 HA ASN 56 HA ASN 56 38.670 9.832 -7.757 275 HB2 ASN 56 HB2 ASN 56 37.376 7.635 -7.687 276 HB3 ASN 56 HB3 ASN 56 38.187 7.170 -9.228 277 HD21 ASN 56 HD21 ASN 56 39.293 5.364 -8.233 278 HD22 ASN 56 HD22 ASN 56 40.574 5.601 -7.068 Start of MODEL 16 1 H1 PHE 17 HT1 PHE 17 35.192 13.850 -7.476 2 H2 PHE 17 HT2 PHE 17 34.791 12.799 -8.745 3 H3 PHE 17 HT3 PHE 17 36.200 12.530 -7.827 4 HA PHE 17 HA PHE 17 34.448 11.015 -7.218 5 HB2 PHE 17 HB2 PHE 17 36.149 11.428 -5.674 6 HB3 PHE 17 HB3 PHE 17 35.502 13.061 -5.210 7 HD1 PHE 17 HD1 PHE 17 34.470 9.414 -5.209 8 HD2 PHE 17 HD2 PHE 17 34.511 13.161 -3.132 9 HE1 PHE 17 HE1 PHE 17 33.422 8.331 -3.228 10 HE2 PHE 17 HE2 PHE 17 33.477 12.085 -1.149 11 HZ PHE 17 HZ PHE 17 32.941 9.657 -1.199 12 H ASP 18 H ASP 18 32.406 10.601 -7.459 13 HA ASP 18 HA ASP 18 30.587 12.054 -5.681 14 HB2 ASP 18 HB2 ASP 18 29.870 10.678 -8.361 15 HB3 ASP 18 HB3 ASP 18 28.649 11.238 -7.143 16 H VAL 19 H VAL 19 29.187 10.559 -4.446 17 HA VAL 19 HA VAL 19 29.861 7.730 -4.769 18 HB VAL 19 HB VAL 19 31.043 8.527 -2.772 19 HG11 VAL 19 HG11 VAL 19 29.801 9.312 -0.768 20 HG12 VAL 19 HG12 VAL 19 28.258 9.326 -1.691 21 HG13 VAL 19 HG13 VAL 19 29.593 10.460 -2.137 22 HG21 VAL 19 HG21 VAL 19 28.619 6.725 -2.116 23 HG22 VAL 19 HG22 VAL 19 30.170 6.813 -1.210 24 HG23 VAL 19 HG23 VAL 19 30.155 6.190 -2.901 25 H VAL 20 H VAL 20 28.051 6.410 -4.826 26 HA VAL 20 HA VAL 20 25.455 7.634 -4.280 27 HB VAL 20 HB VAL 20 24.394 6.654 -6.285 28 HG11 VAL 20 HG11 VAL 20 26.674 8.651 -6.879 29 HG12 VAL 20 HG12 VAL 20 24.992 9.024 -6.324 30 HG13 VAL 20 HG13 VAL 20 25.266 8.307 -7.953 31 HG21 VAL 20 HG21 VAL 20 25.943 4.816 -6.801 32 HG22 VAL 20 HG22 VAL 20 27.290 5.972 -7.107 33 HG23 VAL 20 HG23 VAL 20 25.862 5.927 -8.209 34 H SER 21 H SER 21 23.715 5.927 -4.068 35 HA SER 21 HA SER 21 24.791 3.574 -2.810 36 HB2 SER 21 HB2 SER 21 22.440 3.035 -2.305 37 HB3 SER 21 HB3 SER 21 22.861 4.713 -1.807 38 HG SER 21 HG SER 21 20.881 4.680 -2.879 39 H CYS 22 H CYS 22 24.409 1.403 -3.472 40 HA CYS 22 HA CYS 22 24.024 1.065 -6.378 41 HB2 CYS 22 HB2 CYS 22 26.245 0.565 -5.268 42 HB3 CYS 22 HB3 CYS 22 25.447 -0.736 -4.344 43 H ASN 23 H ASN 23 22.047 1.191 -4.087 44 HA ASN 23 HA ASN 23 20.043 0.374 -3.529 45 HB2 ASN 23 HB2 ASN 23 20.208 -0.781 -6.381 46 HB3 ASN 23 HB3 ASN 23 18.680 -0.515 -5.462 47 HD21 ASN 23 HD21 ASN 23 18.748 2.006 -4.444 48 HD22 ASN 23 HD22 ASN 23 19.232 3.194 -5.635 49 H LYS 24 H LYS 24 22.076 -1.394 -2.484 50 HA LYS 24 HA LYS 24 20.564 -3.912 -2.471 51 HB2 LYS 24 HB2 LYS 24 22.461 -4.101 -4.114 52 HB3 LYS 24 HB3 LYS 24 23.597 -3.626 -2.822 53 HG2 LYS 24 HG2 LYS 24 23.739 -6.024 -3.086 54 HG3 LYS 24 HG3 LYS 24 22.946 -5.721 -1.523 55 HD2 LYS 24 HD2 LYS 24 20.714 -6.240 -2.538 56 HD3 LYS 24 HD3 LYS 24 21.475 -6.370 -4.162 57 HE2 LYS 24 HE2 LYS 24 22.841 -8.326 -3.379 58 HE3 LYS 24 HE3 LYS 24 22.064 -8.204 -1.744 59 HZ1 LYS 24 HZ1 LYS 24 20.662 -8.687 -4.322 60 HZ2 LYS 24 HZ2 LYS 24 19.940 -8.585 -2.785 61 HZ3 LYS 24 HZ3 LYS 24 21.033 -9.837 -3.128 62 H ASN 25 H ASN 25 20.413 -4.898 -0.531 63 HA ASN 25 HA ASN 25 21.241 -3.503 1.820 64 HB2 ASN 25 HB2 ASN 25 18.940 -4.458 1.563 65 HB3 ASN 25 HB3 ASN 25 19.644 -6.097 1.368 66 HD21 ASN 25 HD21 ASN 25 20.803 -3.745 3.926 67 HD22 ASN 25 HD22 ASN 25 20.406 -4.887 5.181 68 H CYS 26 H CYS 26 22.917 -3.931 3.133 69 HA CYS 26 HA CYS 26 24.508 -6.359 2.764 70 HB2 CYS 26 HB2 CYS 26 25.649 -4.506 1.856 71 HB3 CYS 26 HB3 CYS 26 25.164 -3.418 3.196 72 H THR 27 H THR 27 24.849 -7.621 4.582 73 HA THR 27 HA THR 27 24.028 -6.478 7.194 74 HB THR 27 HB THR 27 23.973 -9.455 6.492 75 HG1 THR 27 HG1 THR 27 22.361 -8.967 5.369 76 HG21 THR 27 HG21 THR 27 22.370 -9.496 8.439 77 HG22 THR 27 HG22 THR 27 22.564 -7.723 8.650 78 HG23 THR 27 HG23 THR 27 23.951 -8.836 8.978 79 H SER 28 H SER 28 25.426 -7.249 9.026 80 HA SER 28 HA SER 28 28.050 -6.800 8.419 81 HB2 SER 28 HB2 SER 28 28.502 -7.196 10.812 82 HB3 SER 28 HB3 SER 28 26.949 -6.322 10.598 83 HG SER 28 HG SER 28 27.380 -8.941 11.446 84 H GLY 29 H GLY 29 26.540 -9.993 9.000 85 HA2 GLY 29 HA2 GLY 29 29.139 -11.319 8.701 86 HA3 GLY 29 HA3 GLY 29 27.551 -12.058 9.092 87 H GLN 30 H GLN 30 27.007 -10.085 6.479 88 HA GLN 30 HA GLN 30 27.450 -12.338 4.584 89 HB2 GLN 30 HB2 GLN 30 25.355 -10.098 4.513 90 HB3 GLN 30 HB3 GLN 30 25.613 -11.309 3.214 91 HG2 GLN 30 HG2 GLN 30 24.935 -13.156 4.754 92 HG3 GLN 30 HG3 GLN 30 24.676 -11.962 6.084 93 HE21 GLN 30 HE21 GLN 30 22.910 -13.741 3.948 94 HE22 GLN 30 HE22 GLN 30 21.616 -12.615 3.613 95 H ASN 31 H ASN 31 27.479 -8.767 4.955 96 HA ASN 31 HA ASN 31 28.170 -7.127 3.732 97 HB2 ASN 31 HB2 ASN 31 30.488 -9.059 3.398 98 HB3 ASN 31 HB3 ASN 31 30.637 -7.319 2.892 99 HD21 ASN 31 HD21 ASN 31 29.457 -5.950 5.058 100 HD22 ASN 31 HD22 ASN 31 30.471 -6.242 6.447 101 H GLU 32 H GLU 32 26.255 -8.297 2.267 102 HA GLU 32 HA GLU 32 27.218 -9.355 -0.190 103 HB2 GLU 32 HB2 GLU 32 25.203 -10.148 1.176 104 HB3 GLU 32 HB3 GLU 32 24.381 -8.651 0.731 105 HG2 GLU 32 HG2 GLU 32 24.381 -9.199 -1.687 106 HG3 GLU 32 HG3 GLU 32 25.347 -10.693 -1.390 107 H CYS 33 H CYS 33 27.856 -8.093 -1.960 108 HA CYS 33 HA CYS 33 25.996 -5.996 -2.767 109 HB2 CYS 33 HB2 CYS 33 29.063 -5.750 -2.903 110 HB3 CYS 33 HB3 CYS 33 27.914 -4.606 -3.654 111 HA PRO 34 HA PRO 34 26.947 -8.045 -6.720 112 HB2 PRO 34 HB2 PRO 34 26.314 -6.046 -8.567 113 HB3 PRO 34 HB3 PRO 34 25.033 -6.922 -7.638 114 HG2 PRO 34 HG2 PRO 34 26.338 -4.241 -6.912 115 HG3 PRO 34 HG3 PRO 34 24.566 -4.591 -7.078 116 HD2 PRO 34 HD2 PRO 34 25.814 -4.661 -4.631 117 HD3 PRO 34 HD3 PRO 34 24.571 -5.928 -5.064 118 H GLU 35 H GLU 35 28.626 -7.814 -8.488 119 HA GLU 35 HA GLU 35 31.006 -6.817 -7.362 120 HB2 GLU 35 HB2 GLU 35 30.346 -7.794 -10.189 121 HB3 GLU 35 HB3 GLU 35 32.008 -7.408 -9.659 122 HG2 GLU 35 HG2 GLU 35 30.247 -9.590 -8.328 123 HG3 GLU 35 HG3 GLU 35 31.463 -9.895 -9.618 124 H GLY 36 H GLY 36 32.263 -5.040 -7.717 125 HA2 GLY 36 HA2 GLY 36 32.909 -3.078 -8.755 126 HA3 GLY 36 HA3 GLY 36 31.328 -2.981 -9.602 127 H CYS 37 H CYS 37 30.240 -3.735 -6.705 128 HA CYS 37 HA CYS 37 30.338 -0.995 -5.622 129 HB2 CYS 37 HB2 CYS 37 28.090 -3.071 -5.492 130 HB3 CYS 37 HB3 CYS 37 28.101 -1.511 -4.592 131 H PHE 38 H PHE 38 30.185 -0.832 -3.235 132 HA PHE 38 HA PHE 38 31.299 -3.184 -1.872 133 HB2 PHE 38 HB2 PHE 38 33.171 -1.905 -0.919 134 HB3 PHE 38 HB3 PHE 38 33.229 -1.684 -2.708 135 HD1 PHE 38 HD1 PHE 38 32.224 0.409 -3.718 136 HD2 PHE 38 HD2 PHE 38 32.971 0.001 0.495 137 HE1 PHE 38 HE1 PHE 38 31.910 2.815 -3.436 138 HE2 PHE 38 HE2 PHE 38 32.776 2.462 0.765 139 HZ PHE 38 HZ PHE 38 32.218 3.875 -1.191 140 H CYS 39 H CYS 39 31.222 -2.889 0.564 141 HA CYS 39 HA CYS 39 28.942 -1.167 1.313 142 HB2 CYS 39 HB2 CYS 39 28.242 -3.456 1.290 143 HB3 CYS 39 HB3 CYS 39 29.683 -3.987 2.229 144 H GLY 40 H GLY 40 29.339 0.341 2.769 145 HA2 GLY 40 HA2 GLY 40 31.650 0.059 4.582 146 HA3 GLY 40 HA3 GLY 40 30.664 1.529 4.259 147 H LEU 41 H LEU 41 30.471 -1.777 5.701 148 HA LEU 41 HA LEU 41 28.708 -0.601 7.763 149 HB2 LEU 41 HB2 LEU 41 27.582 -2.433 6.498 150 HB3 LEU 41 HB3 LEU 41 28.933 -3.538 6.870 151 HG LEU 41 HG LEU 41 26.829 -3.850 8.199 152 HD11 LEU 41 HD11 LEU 41 29.003 -3.142 10.221 153 HD12 LEU 41 HD12 LEU 41 29.188 -4.544 9.075 154 HD13 LEU 41 HD13 LEU 41 27.813 -4.464 10.247 155 HD21 LEU 41 HD21 LEU 41 26.153 -2.358 9.991 156 HD22 LEU 41 HD22 LEU 41 26.279 -1.375 8.484 157 HD23 LEU 41 HD23 LEU 41 27.572 -1.281 9.737 158 H LEU 42 H LEU 42 29.742 -0.350 9.717 159 HA LEU 42 HA LEU 42 32.448 -1.529 9.833 160 HB2 LEU 42 HB2 LEU 42 31.484 1.130 11.056 161 HB3 LEU 42 HB3 LEU 42 33.155 0.499 10.978 162 HG LEU 42 HG LEU 42 33.159 2.131 9.388 163 HD11 LEU 42 HD11 LEU 42 33.685 -0.351 8.386 164 HD12 LEU 42 HD12 LEU 42 33.690 1.125 7.323 165 HD13 LEU 42 HD13 LEU 42 32.268 0.028 7.374 166 HD21 LEU 42 HD21 LEU 42 31.379 2.941 8.065 167 HD22 LEU 42 HD22 LEU 42 30.505 2.280 9.521 168 HD23 LEU 42 HD23 LEU 42 30.558 1.343 8.003 169 H GLY 43 H GLY 43 33.248 -2.252 11.826 170 HA2 GLY 43 HA2 GLY 43 33.324 -2.726 14.005 171 HA3 GLY 43 HA3 GLY 43 32.034 -1.498 14.242 172 H GLN 44 H GLN 44 31.231 -4.022 12.171 173 HA GLN 44 HA GLN 44 29.564 -5.451 12.147 174 HB2 GLN 44 HB2 GLN 44 30.585 -6.283 14.916 175 HB3 GLN 44 HB3 GLN 44 29.386 -7.182 13.933 176 HG2 GLN 44 HG2 GLN 44 31.377 -8.336 13.501 177 HG3 GLN 44 HG3 GLN 44 31.146 -7.319 12.035 178 HE21 GLN 44 HE21 GLN 44 32.963 -6.142 11.400 179 HE22 GLN 44 HE22 GLN 44 34.366 -5.890 12.417 180 H ASN 45 H ASN 45 28.708 -2.939 12.660 181 HA ASN 45 HA ASN 45 26.514 -3.084 14.528 182 HB2 ASN 45 HB2 ASN 45 27.290 -1.084 12.313 183 HB3 ASN 45 HB3 ASN 45 25.762 -0.936 13.266 184 HD21 ASN 45 HD21 ASN 45 29.285 -0.496 13.434 185 HD22 ASN 45 HD22 ASN 45 29.243 0.225 15.024 186 H LYS 46 H LYS 46 24.273 -2.350 13.261 187 HA LYS 46 HA LYS 46 23.519 -5.030 12.967 188 HB2 LYS 46 HB2 LYS 46 21.927 -2.455 12.457 189 HB3 LYS 46 HB3 LYS 46 21.174 -4.079 12.495 190 HG2 LYS 46 HG2 LYS 46 22.638 -2.824 14.899 191 HG3 LYS 46 HG3 LYS 46 20.881 -2.756 14.574 192 HD2 LYS 46 HD2 LYS 46 20.910 -5.356 14.496 193 HD3 LYS 46 HD3 LYS 46 22.576 -5.248 15.146 194 HE2 LYS 46 HE2 LYS 46 21.089 -5.598 17.044 195 HE3 LYS 46 HE3 LYS 46 21.608 -3.861 17.111 196 HZ1 LYS 46 HZ1 LYS 46 19.321 -3.912 17.433 197 HZ2 LYS 46 HZ2 LYS 46 19.043 -5.005 16.162 198 HZ3 LYS 46 HZ3 LYS 46 19.513 -3.413 15.817 199 H LYS 47 H LYS 47 23.389 -2.452 10.406 200 HA LYS 47 HA LYS 47 23.884 -4.365 8.407 201 HB2 LYS 47 HB2 LYS 47 21.762 -4.186 7.147 202 HB3 LYS 47 HB3 LYS 47 21.473 -4.902 8.758 203 HG2 LYS 47 HG2 LYS 47 20.750 -2.571 9.578 204 HG3 LYS 47 HG3 LYS 47 20.840 -2.022 7.870 205 HD2 LYS 47 HD2 LYS 47 19.175 -3.883 7.267 206 HD3 LYS 47 HD3 LYS 47 19.112 -4.302 9.004 207 HE2 LYS 47 HE2 LYS 47 17.172 -2.958 8.659 208 HE3 LYS 47 HE3 LYS 47 18.354 -1.828 9.438 209 HZ1 LYS 47 HZ1 LYS 47 17.247 -0.887 7.504 210 HZ2 LYS 47 HZ2 LYS 47 17.883 -2.126 6.523 211 HZ3 LYS 47 HZ3 LYS 47 18.927 -1.011 7.259 212 H GLY 48 H GLY 48 24.073 -3.291 6.311 213 HA2 GLY 48 HA2 GLY 48 24.132 -0.357 6.378 214 HA3 GLY 48 HA3 GLY 48 25.581 -1.319 5.873 215 H HIS 49 H HIS 49 25.238 -0.029 3.764 216 HA HIS 49 HA HIS 49 23.381 -1.522 2.067 217 HB2 HIS 49 HB2 HIS 49 22.281 0.627 3.106 218 HB3 HIS 49 HB3 HIS 49 23.472 1.553 2.150 219 HD2 HIS 49 HD2 HIS 49 22.737 1.860 -0.575 220 HE1 HIS 49 HE1 HIS 49 19.290 -0.606 -0.307 221 HE2 HIS 49 HE2 HIS 49 20.580 1.024 -1.773 222 H CYS 50 H CYS 50 24.154 -1.503 -0.170 223 HA CYS 50 HA CYS 50 27.002 -1.085 -0.273 224 HB2 CYS 50 HB2 CYS 50 25.062 -1.997 -2.450 225 HB3 CYS 50 HB3 CYS 50 26.855 -2.005 -2.600 226 H TYR 51 H TYR 51 28.241 0.298 -1.571 227 HA TYR 51 HA TYR 51 26.774 2.581 -2.757 228 HB2 TYR 51 HB2 TYR 51 29.600 2.812 -1.554 229 HB3 TYR 51 HB3 TYR 51 28.473 4.118 -2.040 230 HD1 TYR 51 HD1 TYR 51 30.034 3.365 0.619 231 HD2 TYR 51 HD2 TYR 51 25.907 3.177 -0.580 232 HE1 TYR 51 HE1 TYR 51 29.348 3.427 2.986 233 HE2 TYR 51 HE2 TYR 51 25.236 3.119 1.796 234 HH TYR 51 HH TYR 51 27.617 3.175 4.446 235 H LYS 52 H LYS 52 27.908 3.646 -4.513 236 HA LYS 52 HA LYS 52 30.160 2.152 -5.711 237 HB2 LYS 52 HB2 LYS 52 28.109 2.070 -7.180 238 HB3 LYS 52 HB3 LYS 52 28.059 3.858 -7.168 239 HG2 LYS 52 HG2 LYS 52 30.411 3.847 -8.243 240 HG3 LYS 52 HG3 LYS 52 30.262 2.066 -8.364 241 HD2 LYS 52 HD2 LYS 52 28.507 4.196 -9.727 242 HD3 LYS 52 HD3 LYS 52 29.747 3.151 -10.496 243 HE2 LYS 52 HE2 LYS 52 28.297 1.117 -9.930 244 HE3 LYS 52 HE3 LYS 52 27.041 2.282 -9.302 245 HZ1 LYS 52 HZ1 LYS 52 26.676 1.616 -11.584 246 HZ2 LYS 52 HZ2 LYS 52 28.169 2.284 -12.046 247 HZ3 LYS 52 HZ3 LYS 52 26.939 3.289 -11.441 248 H ILE 53 H ILE 53 32.019 3.383 -6.019 249 HA ILE 53 HA ILE 53 31.928 6.282 -5.549 250 HB ILE 53 HB ILE 53 34.200 4.280 -5.548 251 HG12 ILE 53 HG12 ILE 53 33.403 6.299 -3.401 252 HG13 ILE 53 HG13 ILE 53 32.724 4.657 -3.453 253 HG21 ILE 53 HG21 ILE 53 35.736 6.283 -5.118 254 HG22 ILE 53 HG22 ILE 53 34.356 7.364 -5.545 255 HG23 ILE 53 HG23 ILE 53 35.067 6.250 -6.777 256 HD11 ILE 53 HD11 ILE 53 35.732 5.384 -3.155 257 HD12 ILE 53 HD12 ILE 53 35.084 3.705 -3.280 258 HD13 ILE 53 HD13 ILE 53 34.647 4.739 -1.874 259 H ILE 54 H ILE 54 32.035 7.643 -7.290 260 HA ILE 54 HA ILE 54 32.699 6.401 -9.902 261 HB ILE 54 HB ILE 54 31.024 8.927 -9.476 262 HG12 ILE 54 HG12 ILE 54 29.127 7.346 -10.381 263 HG13 ILE 54 HG13 ILE 54 30.078 6.006 -9.656 264 HG21 ILE 54 HG21 ILE 54 30.435 8.561 -11.842 265 HG22 ILE 54 HG22 ILE 54 31.275 6.973 -11.847 266 HG23 ILE 54 HG23 ILE 54 32.229 8.513 -11.728 267 HD11 ILE 54 HD11 ILE 54 29.735 8.391 -7.847 268 HD12 ILE 54 HD12 ILE 54 29.462 6.656 -7.500 269 HD13 ILE 54 HD13 ILE 54 28.170 7.613 -8.325 270 H GLY 55 H GLY 55 34.680 7.273 -10.761 271 HA2 GLY 55 HA2 GLY 55 35.273 9.977 -10.575 272 HA3 GLY 55 HA3 GLY 55 36.129 9.086 -9.250 273 H ASN 56 H ASN 56 37.950 10.095 -10.608 274 HA ASN 56 HA ASN 56 38.547 8.653 -13.050 275 HB2 ASN 56 HB2 ASN 56 40.514 10.214 -13.183 276 HB3 ASN 56 HB3 ASN 56 38.932 11.054 -13.039 277 HD21 ASN 56 HD21 ASN 56 38.959 12.750 -11.583 278 HD22 ASN 56 HD22 ASN 56 39.968 12.823 -10.160 Start of MODEL 17 1 H1 PHE 17 HT1 PHE 17 34.937 12.685 -8.265 2 H2 PHE 17 HT2 PHE 17 36.144 12.682 -7.064 3 H3 PHE 17 HT3 PHE 17 34.952 13.888 -7.075 4 HA PHE 17 HA PHE 17 34.425 11.026 -6.669 5 HB2 PHE 17 HB2 PHE 17 35.809 11.750 -4.887 6 HB3 PHE 17 HB3 PHE 17 34.886 13.305 -4.672 7 HD1 PHE 17 HD1 PHE 17 33.927 13.260 -2.549 8 HD2 PHE 17 HD2 PHE 17 33.921 9.647 -4.868 9 HE1 PHE 17 HE1 PHE 17 32.641 12.119 -0.763 10 HE2 PHE 17 HE2 PHE 17 32.623 8.519 -3.106 11 HZ PHE 17 HZ PHE 17 31.989 9.728 -1.041 12 H ASP 18 H ASP 18 32.472 10.472 -7.321 13 HA ASP 18 HA ASP 18 30.272 11.860 -5.992 14 HB2 ASP 18 HB2 ASP 18 30.199 10.584 -8.807 15 HB3 ASP 18 HB3 ASP 18 28.713 11.011 -7.869 16 H VAL 19 H VAL 19 28.775 10.400 -4.982 17 HA VAL 19 HA VAL 19 29.466 7.559 -5.171 18 HB VAL 19 HB VAL 19 30.319 8.387 -3.031 19 HG11 VAL 19 HG11 VAL 19 27.409 9.246 -2.421 20 HG12 VAL 19 HG12 VAL 19 28.810 10.355 -2.687 21 HG13 VAL 19 HG13 VAL 19 28.790 9.248 -1.270 22 HG21 VAL 19 HG21 VAL 19 29.379 6.058 -3.263 23 HG22 VAL 19 HG22 VAL 19 27.774 6.661 -2.702 24 HG23 VAL 19 HG23 VAL 19 29.184 6.707 -1.593 25 H VAL 20 H VAL 20 27.734 6.265 -5.618 26 HA VAL 20 HA VAL 20 25.050 7.386 -5.269 27 HB VAL 20 HB VAL 20 24.245 6.332 -7.353 28 HG11 VAL 20 HG11 VAL 20 26.507 8.399 -7.776 29 HG12 VAL 20 HG12 VAL 20 24.810 8.756 -7.270 30 HG13 VAL 20 HG13 VAL 20 25.140 8.060 -8.903 31 HG21 VAL 20 HG21 VAL 20 26.031 4.588 -7.639 32 HG22 VAL 20 HG22 VAL 20 27.256 5.878 -7.935 33 HG23 VAL 20 HG23 VAL 20 25.906 5.631 -9.100 34 H SER 21 H SER 21 23.385 5.723 -4.973 35 HA SER 21 HA SER 21 24.440 3.477 -3.538 36 HB2 SER 21 HB2 SER 21 22.057 3.089 -2.932 37 HB3 SER 21 HB3 SER 21 22.608 4.768 -2.590 38 HG SER 21 HG SER 21 20.785 5.103 -3.643 39 H CYS 22 H CYS 22 23.948 1.264 -3.875 40 HA CYS 22 HA CYS 22 23.454 0.582 -6.712 41 HB2 CYS 22 HB2 CYS 22 25.833 0.555 -5.806 42 HB3 CYS 22 HB3 CYS 22 25.329 -0.722 -4.664 43 H ASN 23 H ASN 23 21.481 0.782 -4.648 44 HA ASN 23 HA ASN 23 19.759 -0.243 -3.690 45 HB2 ASN 23 HB2 ASN 23 18.327 -1.400 -5.377 46 HB3 ASN 23 HB3 ASN 23 19.121 0.082 -5.996 47 HD21 ASN 23 HD21 ASN 23 19.476 -3.498 -5.990 48 HD22 ASN 23 HD22 ASN 23 20.138 -3.582 -7.614 49 H LYS 24 H LYS 24 21.902 -1.714 -2.492 50 HA LYS 24 HA LYS 24 20.510 -4.221 -2.019 51 HB2 LYS 24 HB2 LYS 24 22.108 -4.617 -3.964 52 HB3 LYS 24 HB3 LYS 24 23.443 -4.049 -2.937 53 HG2 LYS 24 HG2 LYS 24 23.545 -6.473 -2.944 54 HG3 LYS 24 HG3 LYS 24 22.970 -5.975 -1.335 55 HD2 LYS 24 HD2 LYS 24 21.523 -7.703 -1.759 56 HD3 LYS 24 HD3 LYS 24 20.526 -6.376 -2.443 57 HE2 LYS 24 HE2 LYS 24 22.420 -8.138 -4.152 58 HE3 LYS 24 HE3 LYS 24 20.695 -8.568 -3.807 59 HZ1 LYS 24 HZ1 LYS 24 20.938 -7.421 -5.884 60 HZ2 LYS 24 HZ2 LYS 24 21.621 -6.070 -5.106 61 HZ3 LYS 24 HZ3 LYS 24 20.014 -6.506 -4.788 62 H ASN 25 H ASN 25 20.979 -5.050 0.118 63 HA ASN 25 HA ASN 25 22.411 -3.121 1.830 64 HB2 ASN 25 HB2 ASN 25 19.940 -3.057 2.085 65 HB3 ASN 25 HB3 ASN 25 19.911 -4.824 2.429 66 HD21 ASN 25 HD21 ASN 25 20.278 -5.468 4.560 67 HD22 ASN 25 HD22 ASN 25 20.724 -4.391 5.857 68 H CYS 26 H CYS 26 23.979 -3.902 3.233 69 HA CYS 26 HA CYS 26 24.378 -6.812 3.374 70 HB2 CYS 26 HB2 CYS 26 26.258 -4.563 4.307 71 HB3 CYS 26 HB3 CYS 26 26.579 -6.343 4.342 72 H THR 27 H THR 27 24.748 -7.719 5.547 73 HA THR 27 HA THR 27 23.900 -6.062 7.812 74 HB THR 27 HB THR 27 23.061 -8.986 7.461 75 HG1 THR 27 HG1 THR 27 21.853 -7.572 6.129 76 HG21 THR 27 HG21 THR 27 23.309 -8.327 9.863 77 HG22 THR 27 HG22 THR 27 21.574 -8.466 9.431 78 HG23 THR 27 HG23 THR 27 22.325 -6.836 9.564 79 H SER 28 H SER 28 25.089 -6.925 9.745 80 HA SER 28 HA SER 28 27.657 -6.953 9.255 81 HB2 SER 28 HB2 SER 28 26.631 -6.430 11.424 82 HB3 SER 28 HB3 SER 28 26.236 -8.151 11.709 83 HG SER 28 HG SER 28 28.099 -7.484 12.785 84 H GLY 29 H GLY 29 25.909 -10.083 9.642 85 HA2 GLY 29 HA2 GLY 29 28.362 -11.587 9.541 86 HA3 GLY 29 HA3 GLY 29 26.683 -12.200 9.448 87 H GLN 30 H GLN 30 26.913 -9.951 6.910 88 HA GLN 30 HA GLN 30 28.242 -11.832 5.122 89 HB2 GLN 30 HB2 GLN 30 26.345 -11.941 3.538 90 HB3 GLN 30 HB3 GLN 30 25.905 -12.624 5.132 91 HG2 GLN 30 HG2 GLN 30 24.753 -10.411 5.724 92 HG3 GLN 30 HG3 GLN 30 25.117 -9.827 4.061 93 HE21 GLN 30 HE21 GLN 30 22.994 -11.838 6.013 94 HE22 GLN 30 HE22 GLN 30 21.944 -12.320 4.700 95 H ASN 31 H ASN 31 29.259 -10.871 3.338 96 HA ASN 31 HA ASN 31 28.757 -7.973 2.980 97 HB2 ASN 31 HB2 ASN 31 31.071 -9.733 1.954 98 HB3 ASN 31 HB3 ASN 31 30.872 -7.966 1.641 99 HD21 ASN 31 HD21 ASN 31 30.388 -6.726 3.981 100 HD22 ASN 31 HD22 ASN 31 31.605 -7.135 5.163 101 H GLU 32 H GLU 32 27.005 -7.780 1.626 102 HA GLU 32 HA GLU 32 26.837 -9.660 -0.650 103 HB2 GLU 32 HB2 GLU 32 25.308 -10.118 1.352 104 HB3 GLU 32 HB3 GLU 32 24.636 -8.499 1.148 105 HG2 GLU 32 HG2 GLU 32 23.086 -10.143 0.178 106 HG3 GLU 32 HG3 GLU 32 23.714 -9.059 -1.118 107 H CYS 33 H CYS 33 27.672 -8.192 -2.257 108 HA CYS 33 HA CYS 33 25.741 -6.147 -2.961 109 HB2 CYS 33 HB2 CYS 33 28.783 -5.689 -3.053 110 HB3 CYS 33 HB3 CYS 33 27.575 -4.619 -3.815 111 HA PRO 34 HA PRO 34 26.819 -8.142 -6.895 112 HB2 PRO 34 HB2 PRO 34 26.077 -6.206 -8.766 113 HB3 PRO 34 HB3 PRO 34 24.845 -7.116 -7.796 114 HG2 PRO 34 HG2 PRO 34 26.051 -4.381 -7.132 115 HG3 PRO 34 HG3 PRO 34 24.292 -4.795 -7.283 116 HD2 PRO 34 HD2 PRO 34 25.557 -4.778 -4.848 117 HD3 PRO 34 HD3 PRO 34 24.365 -6.103 -5.232 118 H GLU 35 H GLU 35 28.457 -7.850 -8.696 119 HA GLU 35 HA GLU 35 30.824 -6.912 -7.581 120 HB2 GLU 35 HB2 GLU 35 30.668 -8.809 -9.187 121 HB3 GLU 35 HB3 GLU 35 30.156 -7.678 -10.469 122 HG2 GLU 35 HG2 GLU 35 32.507 -8.327 -10.806 123 HG3 GLU 35 HG3 GLU 35 32.438 -6.572 -10.437 124 H GLY 36 H GLY 36 32.106 -5.137 -7.819 125 HA2 GLY 36 HA2 GLY 36 32.810 -3.132 -8.693 126 HA3 GLY 36 HA3 GLY 36 31.272 -2.962 -9.605 127 H CYS 37 H CYS 37 30.081 -3.808 -6.744 128 HA CYS 37 HA CYS 37 30.101 -1.063 -5.662 129 HB2 CYS 37 HB2 CYS 37 27.905 -3.199 -5.571 130 HB3 CYS 37 HB3 CYS 37 27.840 -1.609 -4.726 131 H PHE 38 H PHE 38 29.998 -0.836 -3.314 132 HA PHE 38 HA PHE 38 30.799 -3.224 -1.801 133 HB2 PHE 38 HB2 PHE 38 32.528 -1.995 -0.550 134 HB3 PHE 38 HB3 PHE 38 32.925 -1.817 -2.301 135 HD1 PHE 38 HD1 PHE 38 32.279 0.406 -3.455 136 HD2 PHE 38 HD2 PHE 38 32.038 -0.146 0.804 137 HE1 PHE 38 HE1 PHE 38 32.005 2.822 -3.157 138 HE2 PHE 38 HE2 PHE 38 31.768 2.287 1.114 139 HZ PHE 38 HZ PHE 38 31.708 3.786 -0.868 140 H CYS 39 H CYS 39 30.166 -2.921 0.595 141 HA CYS 39 HA CYS 39 28.133 -0.789 0.834 142 HB2 CYS 39 HB2 CYS 39 27.085 -2.167 2.636 143 HB3 CYS 39 HB3 CYS 39 26.962 -2.856 1.015 144 H GLY 40 H GLY 40 27.978 0.495 2.532 145 HA2 GLY 40 HA2 GLY 40 30.401 0.927 4.062 146 HA3 GLY 40 HA3 GLY 40 28.863 1.871 4.092 147 H LEU 41 H LEU 41 30.155 -1.340 4.988 148 HA LEU 41 HA LEU 41 28.127 -1.590 7.066 149 HB2 LEU 41 HB2 LEU 41 28.738 -3.441 5.432 150 HB3 LEU 41 HB3 LEU 41 30.365 -3.505 6.162 151 HG LEU 41 HG LEU 41 28.882 -5.332 6.850 152 HD11 LEU 41 HD11 LEU 41 29.376 -3.664 9.371 153 HD12 LEU 41 HD12 LEU 41 30.683 -4.521 8.445 154 HD13 LEU 41 HD13 LEU 41 29.324 -5.449 9.187 155 HD21 LEU 41 HD21 LEU 41 26.894 -5.060 8.231 156 HD22 LEU 41 HD22 LEU 41 26.712 -4.072 6.735 157 HD23 LEU 41 HD23 LEU 41 27.118 -3.274 8.302 158 H LEU 42 H LEU 42 28.549 -0.943 9.174 159 HA LEU 42 HA LEU 42 31.043 0.383 9.501 160 HB2 LEU 42 HB2 LEU 42 28.776 0.111 11.571 161 HB3 LEU 42 HB3 LEU 42 30.132 1.274 11.585 162 HG LEU 42 HG LEU 42 28.401 2.588 10.912 163 HD11 LEU 42 HD11 LEU 42 29.316 1.665 8.131 164 HD12 LEU 42 HD12 LEU 42 30.239 2.799 9.183 165 HD13 LEU 42 HD13 LEU 42 28.596 3.245 8.584 166 HD21 LEU 42 HD21 LEU 42 26.446 1.509 10.668 167 HD22 LEU 42 HD22 LEU 42 27.190 0.070 9.911 168 HD23 LEU 42 HD23 LEU 42 26.799 1.523 8.901 169 H GLY 43 H GLY 43 32.405 -1.647 9.524 170 HA2 GLY 43 HA2 GLY 43 33.955 -2.784 10.728 171 HA3 GLY 43 HA3 GLY 43 33.477 -1.736 12.106 172 H GLN 44 H GLN 44 31.772 -4.335 10.398 173 HA GLN 44 HA GLN 44 30.423 -5.923 11.057 174 HB2 GLN 44 HB2 GLN 44 31.335 -7.793 12.325 175 HB3 GLN 44 HB3 GLN 44 32.441 -7.184 11.065 176 HG2 GLN 44 HG2 GLN 44 33.842 -6.037 12.838 177 HG3 GLN 44 HG3 GLN 44 32.720 -6.655 14.102 178 HE21 GLN 44 HE21 GLN 44 34.715 -7.873 11.303 179 HE22 GLN 44 HE22 GLN 44 35.236 -9.325 12.133 180 H ASN 45 H ASN 45 29.664 -3.588 12.356 181 HA ASN 45 HA ASN 45 28.559 -4.620 14.884 182 HB2 ASN 45 HB2 ASN 45 28.468 -1.831 13.570 183 HB3 ASN 45 HB3 ASN 45 27.544 -2.276 15.059 184 HD21 ASN 45 HD21 ASN 45 30.743 -1.410 13.868 185 HD22 ASN 45 HD22 ASN 45 31.505 -1.454 15.440 186 H LYS 46 H LYS 46 26.965 -2.778 12.160 187 HA LYS 46 HA LYS 46 24.563 -4.372 12.847 188 HB2 LYS 46 HB2 LYS 46 24.820 -1.405 12.110 189 HB3 LYS 46 HB3 LYS 46 23.265 -2.288 12.371 190 HG2 LYS 46 HG2 LYS 46 24.028 -2.874 14.694 191 HG3 LYS 46 HG3 LYS 46 25.506 -1.889 14.420 192 HD2 LYS 46 HD2 LYS 46 24.070 0.141 14.022 193 HD3 LYS 46 HD3 LYS 46 22.613 -0.831 14.413 194 HE2 LYS 46 HE2 LYS 46 24.994 -0.282 16.319 195 HE3 LYS 46 HE3 LYS 46 23.363 0.511 16.390 196 HZ1 LYS 46 HZ1 LYS 46 23.609 -1.328 17.931 197 HZ2 LYS 46 HZ2 LYS 46 23.885 -2.401 16.640 198 HZ3 LYS 46 HZ3 LYS 46 22.383 -1.622 16.790 199 H LYS 47 H LYS 47 24.390 -1.990 10.280 200 HA LYS 47 HA LYS 47 24.456 -3.989 8.211 201 HB2 LYS 47 HB2 LYS 47 22.159 -3.524 7.428 202 HB3 LYS 47 HB3 LYS 47 22.159 -4.197 9.079 203 HG2 LYS 47 HG2 LYS 47 20.546 -2.588 9.263 204 HG3 LYS 47 HG3 LYS 47 21.953 -1.683 9.897 205 HD2 LYS 47 HD2 LYS 47 22.127 -0.451 7.733 206 HD3 LYS 47 HD3 LYS 47 20.946 -1.562 6.975 207 HE2 LYS 47 HE2 LYS 47 19.852 0.590 7.487 208 HE3 LYS 47 HE3 LYS 47 19.140 -0.720 8.520 209 HZ1 LYS 47 HZ1 LYS 47 21.214 1.253 9.316 210 HZ2 LYS 47 HZ2 LYS 47 20.630 -0.016 10.285 211 HZ3 LYS 47 HZ3 LYS 47 19.579 1.226 9.792 212 H GLY 48 H GLY 48 24.235 -2.888 6.028 213 HA2 GLY 48 HA2 GLY 48 24.584 -0.050 5.994 214 HA3 GLY 48 HA3 GLY 48 26.109 -0.978 5.701 215 H HIS 49 H HIS 49 24.650 0.812 3.806 216 HA HIS 49 HA HIS 49 23.337 -1.087 2.010 217 HB2 HIS 49 HB2 HIS 49 22.206 1.050 2.791 218 HB3 HIS 49 HB3 HIS 49 23.461 1.971 1.910 219 HD2 HIS 49 HD2 HIS 49 22.704 2.528 -0.715 220 HE1 HIS 49 HE1 HIS 49 19.621 -0.371 -0.948 221 HE2 HIS 49 HE2 HIS 49 20.737 1.601 -2.114 222 H CYS 50 H CYS 50 23.985 -1.368 -0.218 223 HA CYS 50 HA CYS 50 26.773 -1.013 -0.666 224 HB2 CYS 50 HB2 CYS 50 24.592 -1.981 -2.578 225 HB3 CYS 50 HB3 CYS 50 26.354 -2.048 -2.911 226 H TYR 51 H TYR 51 27.882 0.404 -1.964 227 HA TYR 51 HA TYR 51 26.335 2.427 -3.457 228 HB2 TYR 51 HB2 TYR 51 29.009 3.092 -2.076 229 HB3 TYR 51 HB3 TYR 51 27.781 4.201 -2.813 230 HD1 TYR 51 HD1 TYR 51 29.190 3.347 0.080 231 HD2 TYR 51 HD2 TYR 51 25.262 3.828 -1.555 232 HE1 TYR 51 HE1 TYR 51 28.286 3.608 2.375 233 HE2 TYR 51 HE2 TYR 51 24.346 4.140 0.736 234 HH TYR 51 HH TYR 51 26.432 3.939 3.632 235 H LYS 52 H LYS 52 27.614 3.421 -5.182 236 HA LYS 52 HA LYS 52 30.070 1.962 -5.950 237 HB2 LYS 52 HB2 LYS 52 28.201 1.730 -7.638 238 HB3 LYS 52 HB3 LYS 52 28.126 3.514 -7.758 239 HG2 LYS 52 HG2 LYS 52 30.595 3.476 -8.522 240 HG3 LYS 52 HG3 LYS 52 30.478 1.689 -8.536 241 HD2 LYS 52 HD2 LYS 52 28.926 3.686 -10.284 242 HD3 LYS 52 HD3 LYS 52 30.204 2.534 -10.793 243 HE2 LYS 52 HE2 LYS 52 28.618 0.612 -10.165 244 HE3 LYS 52 HE3 LYS 52 27.339 1.870 -9.850 245 HZ1 LYS 52 HZ1 LYS 52 27.236 0.942 -12.062 246 HZ2 LYS 52 HZ2 LYS 52 28.807 1.488 -12.404 247 HZ3 LYS 52 HZ3 LYS 52 27.565 2.609 -12.100 248 H ILE 53 H ILE 53 31.930 3.275 -5.927 249 HA ILE 53 HA ILE 53 31.532 6.190 -5.802 250 HB ILE 53 HB ILE 53 33.824 4.549 -4.738 251 HG12 ILE 53 HG12 ILE 53 32.030 6.645 -3.419 252 HG13 ILE 53 HG13 ILE 53 31.702 4.890 -3.313 253 HG21 ILE 53 HG21 ILE 53 34.835 6.485 -5.908 254 HG22 ILE 53 HG22 ILE 53 34.884 6.807 -4.156 255 HG23 ILE 53 HG23 ILE 53 33.617 7.596 -5.177 256 HD11 ILE 53 HD11 ILE 53 34.221 6.352 -2.225 257 HD12 ILE 53 HD12 ILE 53 33.964 4.569 -2.179 258 HD13 ILE 53 HD13 ILE 53 32.874 5.674 -1.258 259 H ILE 54 H ILE 54 32.123 7.382 -7.383 260 HA ILE 54 HA ILE 54 33.865 6.379 -9.478 261 HB ILE 54 HB ILE 54 32.369 7.561 -11.110 262 HG12 ILE 54 HG12 ILE 54 31.031 8.746 -9.227 263 HG13 ILE 54 HG13 ILE 54 30.203 8.171 -10.714 264 HG21 ILE 54 HG21 ILE 54 31.416 4.977 -9.749 265 HG22 ILE 54 HG22 ILE 54 32.613 5.131 -11.083 266 HG23 ILE 54 HG23 ILE 54 30.880 5.563 -11.370 267 HD11 ILE 54 HD11 ILE 54 30.048 6.851 -7.912 268 HD12 ILE 54 HD12 ILE 54 29.422 6.087 -9.410 269 HD13 ILE 54 HD13 ILE 54 28.738 7.638 -8.848 270 H GLY 55 H GLY 55 34.666 8.122 -10.923 271 HA2 GLY 55 HA2 GLY 55 35.606 10.205 -11.173 272 HA3 GLY 55 HA3 GLY 55 35.184 10.628 -9.475 273 H ASN 56 H ASN 56 36.329 9.249 -7.784 274 HA ASN 56 HA ASN 56 38.252 8.738 -6.778 275 HB2 ASN 56 HB2 ASN 56 38.588 7.026 -9.319 276 HB3 ASN 56 HB3 ASN 56 39.516 6.783 -7.788 277 HD21 ASN 56 HD21 ASN 56 36.849 5.577 -9.416 278 HD22 ASN 56 HD22 ASN 56 35.899 5.067 -8.043 Start of MODEL 18 1 H1 PHE 17 HT1 PHE 17 36.071 12.676 -6.454 2 H2 PHE 17 HT2 PHE 17 35.515 11.925 -7.861 3 H3 PHE 17 HT3 PHE 17 36.888 11.320 -7.049 4 HA PHE 17 HA PHE 17 34.908 9.982 -6.631 5 HB2 PHE 17 HB2 PHE 17 36.761 9.935 -5.097 6 HB3 PHE 17 HB3 PHE 17 36.248 11.492 -4.325 7 HD1 PHE 17 HD1 PHE 17 34.689 8.108 -5.080 8 HD2 PHE 17 HD2 PHE 17 35.429 11.198 -2.192 9 HE1 PHE 17 HE1 PHE 17 33.511 6.781 -3.354 10 HE2 PHE 17 HE2 PHE 17 34.272 9.863 -0.459 11 HZ PHE 17 HZ PHE 17 33.312 7.649 -1.037 12 H ASP 18 H ASP 18 32.781 9.947 -6.789 13 HA ASP 18 HA ASP 18 31.300 11.444 -4.761 14 HB2 ASP 18 HB2 ASP 18 30.318 10.728 -7.605 15 HB3 ASP 18 HB3 ASP 18 29.219 11.262 -6.274 16 H VAL 19 H VAL 19 29.576 10.089 -3.769 17 HA VAL 19 HA VAL 19 29.792 7.252 -4.447 18 HB VAL 19 HB VAL 19 31.185 7.616 -2.475 19 HG11 VAL 19 HG11 VAL 19 30.098 9.649 -1.513 20 HG12 VAL 19 HG12 VAL 19 30.197 8.322 -0.303 21 HG13 VAL 19 HG13 VAL 19 28.628 8.684 -1.102 22 HG21 VAL 19 HG21 VAL 19 28.552 6.140 -1.831 23 HG22 VAL 19 HG22 VAL 19 30.157 5.865 -1.068 24 HG23 VAL 19 HG23 VAL 19 29.917 5.479 -2.813 25 H VAL 20 H VAL 20 27.847 6.282 -4.668 26 HA VAL 20 HA VAL 20 25.433 7.698 -3.820 27 HB VAL 20 HB VAL 20 24.318 7.211 -5.979 28 HG11 VAL 20 HG11 VAL 20 25.408 8.992 -7.310 29 HG12 VAL 20 HG12 VAL 20 26.898 8.883 -6.303 30 HG13 VAL 20 HG13 VAL 20 25.358 9.459 -5.568 31 HG21 VAL 20 HG21 VAL 20 25.990 6.709 -7.947 32 HG22 VAL 20 HG22 VAL 20 25.495 5.325 -6.894 33 HG23 VAL 20 HG23 VAL 20 27.110 6.089 -6.686 34 H SER 21 H SER 21 23.481 6.103 -3.870 35 HA SER 21 HA SER 21 24.443 3.639 -2.721 36 HB2 SER 21 HB2 SER 21 22.141 3.088 -2.192 37 HB3 SER 21 HB3 SER 21 22.505 4.768 -1.689 38 HG SER 21 HG SER 21 21.220 5.520 -3.263 39 H CYS 22 H CYS 22 23.854 1.474 -3.379 40 HA CYS 22 HA CYS 22 23.403 1.192 -6.291 41 HB2 CYS 22 HB2 CYS 22 25.721 0.748 -5.379 42 HB3 CYS 22 HB3 CYS 22 25.038 -0.555 -4.365 43 H ASN 23 H ASN 23 21.420 1.356 -4.163 44 HA ASN 23 HA ASN 23 19.602 0.406 -3.313 45 HB2 ASN 23 HB2 ASN 23 18.044 -0.420 -5.082 46 HB3 ASN 23 HB3 ASN 23 18.963 1.042 -5.558 47 HD21 ASN 23 HD21 ASN 23 19.185 -2.551 -5.861 48 HD22 ASN 23 HD22 ASN 23 19.789 -2.534 -7.505 49 H LYS 24 H LYS 24 21.655 -1.388 -2.371 50 HA LYS 24 HA LYS 24 20.165 -3.928 -2.459 51 HB2 LYS 24 HB2 LYS 24 21.993 -3.865 -4.250 52 HB3 LYS 24 HB3 LYS 24 23.180 -3.621 -2.947 53 HG2 LYS 24 HG2 LYS 24 23.299 -5.942 -3.449 54 HG3 LYS 24 HG3 LYS 24 22.342 -5.899 -1.945 55 HD2 LYS 24 HD2 LYS 24 20.218 -5.993 -3.386 56 HD3 LYS 24 HD3 LYS 24 21.268 -6.068 -4.832 57 HE2 LYS 24 HE2 LYS 24 22.269 -8.233 -4.034 58 HE3 LYS 24 HE3 LYS 24 21.182 -8.191 -2.580 59 HZ1 LYS 24 HZ1 LYS 24 19.296 -8.243 -4.021 60 HZ2 LYS 24 HZ2 LYS 24 20.339 -9.528 -4.405 61 HZ3 LYS 24 HZ3 LYS 24 20.272 -8.163 -5.410 62 H ASN 25 H ASN 25 20.259 -5.135 -0.614 63 HA ASN 25 HA ASN 25 21.130 -3.742 1.782 64 HB2 ASN 25 HB2 ASN 25 18.753 -4.575 1.434 65 HB3 ASN 25 HB3 ASN 25 19.373 -6.254 1.327 66 HD21 ASN 25 HD21 ASN 25 20.728 -6.912 3.451 67 HD22 ASN 25 HD22 ASN 25 19.991 -6.408 4.945 68 H CYS 26 H CYS 26 23.070 -4.391 2.862 69 HA CYS 26 HA CYS 26 24.034 -7.116 2.246 70 HB2 CYS 26 HB2 CYS 26 26.305 -6.486 2.526 71 HB3 CYS 26 HB3 CYS 26 25.598 -5.318 1.386 72 H THR 27 H THR 27 25.471 -7.930 4.200 73 HA THR 27 HA THR 27 24.612 -6.759 6.749 74 HB THR 27 HB THR 27 25.046 -9.768 6.419 75 HG1 THR 27 HG1 THR 27 23.005 -10.062 6.282 76 HG21 THR 27 HG21 THR 27 24.148 -9.859 8.730 77 HG22 THR 27 HG22 THR 27 23.683 -8.126 8.674 78 HG23 THR 27 HG23 THR 27 25.413 -8.571 8.766 79 H SER 28 H SER 28 26.480 -6.747 8.186 80 HA SER 28 HA SER 28 28.870 -6.303 6.943 81 HB2 SER 28 HB2 SER 28 29.797 -6.028 9.215 82 HB3 SER 28 HB3 SER 28 28.147 -5.322 9.068 83 HG SER 28 HG SER 28 28.904 -7.738 10.331 84 H GLY 29 H GLY 29 27.829 -9.393 8.401 85 HA2 GLY 29 HA2 GLY 29 30.511 -10.525 7.991 86 HA3 GLY 29 HA3 GLY 29 29.086 -11.297 8.757 87 H GLN 30 H GLN 30 27.924 -9.985 5.958 88 HA GLN 30 HA GLN 30 28.360 -12.520 4.475 89 HB2 GLN 30 HB2 GLN 30 26.009 -10.554 4.370 90 HB3 GLN 30 HB3 GLN 30 26.221 -11.966 3.278 91 HG2 GLN 30 HG2 GLN 30 26.126 -13.532 5.251 92 HG3 GLN 30 HG3 GLN 30 25.910 -12.128 6.353 93 HE21 GLN 30 HE21 GLN 30 24.372 -13.933 3.627 94 HE22 GLN 30 HE22 GLN 30 22.751 -13.390 3.995 95 H ASN 31 H ASN 31 28.166 -8.969 4.159 96 HA ASN 31 HA ASN 31 28.904 -7.511 2.697 97 HB2 ASN 31 HB2 ASN 31 31.108 -9.617 2.229 98 HB3 ASN 31 HB3 ASN 31 31.235 -7.885 1.757 99 HD21 ASN 31 HD21 ASN 31 30.165 -6.585 4.077 100 HD22 ASN 31 HD22 ASN 31 31.238 -6.953 5.408 101 H GLU 32 H GLU 32 26.854 -9.172 1.467 102 HA GLU 32 HA GLU 32 27.791 -9.596 -1.247 103 HB2 GLU 32 HB2 GLU 32 25.044 -9.863 0.064 104 HB3 GLU 32 HB3 GLU 32 25.347 -10.233 -1.653 105 HG2 GLU 32 HG2 GLU 32 26.780 -11.675 0.701 106 HG3 GLU 32 HG3 GLU 32 25.287 -12.279 -0.108 107 H CYS 33 H CYS 33 28.019 -7.954 -2.643 108 HA CYS 33 HA CYS 33 25.761 -6.196 -3.048 109 HB2 CYS 33 HB2 CYS 33 28.703 -5.274 -3.056 110 HB3 CYS 33 HB3 CYS 33 27.338 -4.292 -3.663 111 HA PRO 34 HA PRO 34 26.902 -7.769 -7.113 112 HB2 PRO 34 HB2 PRO 34 25.957 -5.824 -8.886 113 HB3 PRO 34 HB3 PRO 34 24.839 -6.865 -7.913 114 HG2 PRO 34 HG2 PRO 34 25.863 -4.062 -7.189 115 HG3 PRO 34 HG3 PRO 34 24.136 -4.609 -7.283 116 HD2 PRO 34 HD2 PRO 34 25.480 -4.590 -4.892 117 HD3 PRO 34 HD3 PRO 34 24.403 -6.004 -5.313 118 H GLU 35 H GLU 35 28.381 -7.320 -9.035 119 HA GLU 35 HA GLU 35 30.772 -6.328 -8.025 120 HB2 GLU 35 HB2 GLU 35 30.597 -8.138 -9.725 121 HB3 GLU 35 HB3 GLU 35 29.952 -6.964 -10.905 122 HG2 GLU 35 HG2 GLU 35 32.305 -7.475 -11.422 123 HG3 GLU 35 HG3 GLU 35 32.177 -5.748 -10.949 124 H GLY 36 H GLY 36 31.935 -4.475 -8.214 125 HA2 GLY 36 HA2 GLY 36 32.429 -2.336 -8.902 126 HA3 GLY 36 HA3 GLY 36 30.842 -2.213 -9.735 127 H CYS 37 H CYS 37 29.856 -3.464 -6.934 128 HA CYS 37 HA CYS 37 29.733 -0.876 -5.542 129 HB2 CYS 37 HB2 CYS 37 27.640 -3.111 -5.687 130 HB3 CYS 37 HB3 CYS 37 27.519 -1.641 -4.654 131 H PHE 38 H PHE 38 29.548 -0.981 -3.182 132 HA PHE 38 HA PHE 38 30.614 -3.380 -1.929 133 HB2 PHE 38 HB2 PHE 38 32.549 -2.302 -0.926 134 HB3 PHE 38 HB3 PHE 38 32.653 -1.906 -2.673 135 HD1 PHE 38 HD1 PHE 38 32.866 -0.602 0.592 136 HD2 PHE 38 HD2 PHE 38 31.322 0.456 -3.280 137 HE1 PHE 38 HE1 PHE 38 32.840 1.781 1.252 138 HE2 PHE 38 HE2 PHE 38 31.140 2.802 -2.544 139 HZ PHE 38 HZ PHE 38 31.987 3.502 -0.358 140 H CYS 39 H CYS 39 30.437 -2.966 0.654 141 HA CYS 39 HA CYS 39 28.791 -0.581 1.120 142 HB2 CYS 39 HB2 CYS 39 27.350 -1.618 2.730 143 HB3 CYS 39 HB3 CYS 39 27.173 -2.460 1.171 144 H GLY 40 H GLY 40 29.060 0.333 3.203 145 HA2 GLY 40 HA2 GLY 40 31.670 -0.385 4.419 146 HA3 GLY 40 HA3 GLY 40 31.058 1.284 4.120 147 H LEU 41 H LEU 41 30.332 -1.767 5.874 148 HA LEU 41 HA LEU 41 28.890 -0.173 7.912 149 HB2 LEU 41 HB2 LEU 41 27.677 -2.067 6.806 150 HB3 LEU 41 HB3 LEU 41 28.906 -3.195 7.434 151 HG LEU 41 HG LEU 41 26.798 -3.135 8.715 152 HD11 LEU 41 HD11 LEU 41 28.811 -2.027 10.709 153 HD12 LEU 41 HD12 LEU 41 29.105 -3.608 9.896 154 HD13 LEU 41 HD13 LEU 41 27.608 -3.352 10.881 155 HD21 LEU 41 HD21 LEU 41 26.092 -1.270 10.086 156 HD22 LEU 41 HD22 LEU 41 26.266 -0.687 8.388 157 HD23 LEU 41 HD23 LEU 41 27.521 -0.275 9.625 158 H LEU 42 H LEU 42 30.118 0.195 9.824 159 HA LEU 42 HA LEU 42 32.528 -1.490 10.163 160 HB2 LEU 42 HB2 LEU 42 32.016 1.323 11.288 161 HB3 LEU 42 HB3 LEU 42 33.509 0.349 11.420 162 HG LEU 42 HG LEU 42 34.020 1.947 9.853 163 HD11 LEU 42 HD11 LEU 42 33.093 -0.188 7.857 164 HD12 LEU 42 HD12 LEU 42 34.434 -0.524 8.997 165 HD13 LEU 42 HD13 LEU 42 34.566 0.836 7.806 166 HD21 LEU 42 HD21 LEU 42 31.474 2.559 9.575 167 HD22 LEU 42 HD22 LEU 42 31.546 1.533 8.107 168 HD23 LEU 42 HD23 LEU 42 32.632 2.962 8.230 169 H GLY 43 H GLY 43 32.844 -2.528 12.137 170 HA2 GLY 43 HA2 GLY 43 32.716 -2.929 14.324 171 HA3 GLY 43 HA3 GLY 43 31.766 -1.421 14.497 172 H GLN 44 H GLN 44 30.302 -3.614 12.419 173 HA GLN 44 HA GLN 44 28.381 -4.696 12.439 174 HB2 GLN 44 HB2 GLN 44 29.267 -5.630 15.224 175 HB3 GLN 44 HB3 GLN 44 27.917 -6.349 14.286 176 HG2 GLN 44 HG2 GLN 44 29.518 -7.019 12.453 177 HG3 GLN 44 HG3 GLN 44 30.880 -6.307 13.395 178 HE21 GLN 44 HE21 GLN 44 28.108 -8.612 14.001 179 HE22 GLN 44 HE22 GLN 44 29.102 -9.769 14.860 180 H ASN 45 H ASN 45 28.160 -1.975 13.204 181 HA ASN 45 HA ASN 45 26.409 -1.653 15.429 182 HB2 ASN 45 HB2 ASN 45 27.183 0.174 13.081 183 HB3 ASN 45 HB3 ASN 45 25.991 0.669 14.338 184 HD21 ASN 45 HD21 ASN 45 29.471 0.239 13.711 185 HD22 ASN 45 HD22 ASN 45 29.940 0.852 15.272 186 H LYS 46 H LYS 46 25.865 -2.039 11.961 187 HA LYS 46 HA LYS 46 23.029 -2.383 12.292 188 HB2 LYS 46 HB2 LYS 46 24.216 -0.219 10.424 189 HB3 LYS 46 HB3 LYS 46 22.497 -0.742 10.399 190 HG2 LYS 46 HG2 LYS 46 23.873 0.625 12.774 191 HG3 LYS 46 HG3 LYS 46 22.867 1.454 11.549 192 HD2 LYS 46 HD2 LYS 46 20.871 0.220 12.198 193 HD3 LYS 46 HD3 LYS 46 21.799 -0.869 13.274 194 HE2 LYS 46 HE2 LYS 46 21.477 2.165 13.767 195 HE3 LYS 46 HE3 LYS 46 20.527 0.835 14.556 196 HZ1 LYS 46 HZ1 LYS 46 23.345 1.561 14.871 197 HZ2 LYS 46 HZ2 LYS 46 22.906 -0.063 15.031 198 HZ3 LYS 46 HZ3 LYS 46 22.186 1.110 16.031 199 H LYS 47 H LYS 47 22.313 -2.609 9.726 200 HA LYS 47 HA LYS 47 23.638 -4.975 8.831 201 HB2 LYS 47 HB2 LYS 47 21.950 -4.928 7.009 202 HB3 LYS 47 HB3 LYS 47 21.236 -4.806 8.643 203 HG2 LYS 47 HG2 LYS 47 20.859 -2.369 8.352 204 HG3 LYS 47 HG3 LYS 47 21.701 -2.394 6.764 205 HD2 LYS 47 HD2 LYS 47 19.291 -2.304 6.455 206 HD3 LYS 47 HD3 LYS 47 20.023 -3.780 5.759 207 HE2 LYS 47 HE2 LYS 47 19.139 -5.157 7.646 208 HE3 LYS 47 HE3 LYS 47 18.422 -3.670 8.410 209 HZ1 LYS 47 HZ1 LYS 47 16.946 -5.055 6.932 210 HZ2 LYS 47 HZ2 LYS 47 17.865 -4.483 5.620 211 HZ3 LYS 47 HZ3 LYS 47 17.015 -3.389 6.584 212 H GLY 48 H GLY 48 23.556 -1.606 7.547 213 HA2 GLY 48 HA2 GLY 48 25.153 -0.651 6.141 214 HA3 GLY 48 HA3 GLY 48 25.754 -2.291 5.706 215 H HIS 49 H HIS 49 25.096 -0.149 3.802 216 HA HIS 49 HA HIS 49 23.091 -1.624 2.270 217 HB2 HIS 49 HB2 HIS 49 21.953 0.395 3.374 218 HB3 HIS 49 HB3 HIS 49 23.158 1.444 2.568 219 HD2 HIS 49 HD2 HIS 49 22.375 2.262 0.019 220 HE1 HIS 49 HE1 HIS 49 19.251 -0.565 -0.453 221 HE2 HIS 49 HE2 HIS 49 20.401 1.482 -1.454 222 H CYS 50 H CYS 50 23.675 -1.627 -0.006 223 HA CYS 50 HA CYS 50 26.478 -1.201 -0.342 224 HB2 CYS 50 HB2 CYS 50 24.367 -2.004 -2.392 225 HB3 CYS 50 HB3 CYS 50 26.138 -2.064 -2.666 226 H TYR 51 H TYR 51 27.639 0.161 -1.632 227 HA TYR 51 HA TYR 51 26.228 2.489 -2.774 228 HB2 TYR 51 HB2 TYR 51 29.080 2.491 -1.630 229 HB3 TYR 51 HB3 TYR 51 28.128 3.910 -2.200 230 HD1 TYR 51 HD1 TYR 51 29.685 3.383 0.308 231 HD2 TYR 51 HD2 TYR 51 25.483 3.178 -0.525 232 HE1 TYR 51 HE1 TYR 51 29.221 3.628 2.715 233 HE2 TYR 51 HE2 TYR 51 24.995 3.474 1.886 234 HH TYR 51 HH TYR 51 27.574 3.554 4.341 235 H LYS 52 H LYS 52 27.360 3.451 -4.590 236 HA LYS 52 HA LYS 52 29.291 1.682 -5.960 237 HB2 LYS 52 HB2 LYS 52 27.103 1.884 -7.147 238 HB3 LYS 52 HB3 LYS 52 27.271 3.663 -7.132 239 HG2 LYS 52 HG2 LYS 52 29.307 3.482 -8.603 240 HG3 LYS 52 HG3 LYS 52 29.194 1.694 -8.531 241 HD2 LYS 52 HD2 LYS 52 28.298 2.482 -10.651 242 HD3 LYS 52 HD3 LYS 52 26.973 1.773 -9.669 243 HE2 LYS 52 HE2 LYS 52 26.148 4.070 -9.087 244 HE3 LYS 52 HE3 LYS 52 27.527 4.804 -10.010 245 HZ1 LYS 52 HZ1 LYS 52 26.706 3.704 -11.981 246 HZ2 LYS 52 HZ2 LYS 52 25.520 4.710 -11.295 247 HZ3 LYS 52 HZ3 LYS 52 25.415 3.026 -11.108 248 H ILE 53 H ILE 53 31.284 2.585 -6.506 249 HA ILE 53 HA ILE 53 31.765 5.378 -5.728 250 HB ILE 53 HB ILE 53 33.686 3.083 -6.201 251 HG12 ILE 53 HG12 ILE 53 33.087 4.734 -3.691 252 HG13 ILE 53 HG13 ILE 53 32.414 3.107 -4.069 253 HG21 ILE 53 HG21 ILE 53 34.758 5.150 -7.098 254 HG22 ILE 53 HG22 ILE 53 35.511 4.724 -5.537 255 HG23 ILE 53 HG23 ILE 53 34.296 6.057 -5.606 256 HD11 ILE 53 HD11 ILE 53 34.741 2.140 -4.060 257 HD12 ILE 53 HD12 ILE 53 34.279 2.883 -2.484 258 HD13 ILE 53 HD13 ILE 53 35.399 3.755 -3.589 259 H ILE 54 H ILE 54 31.964 6.895 -7.229 260 HA ILE 54 HA ILE 54 32.801 6.158 -9.914 261 HB ILE 54 HB ILE 54 31.238 7.806 -10.863 262 HG12 ILE 54 HG12 ILE 54 30.783 9.013 -8.651 263 HG13 ILE 54 HG13 ILE 54 29.420 8.758 -9.786 264 HG21 ILE 54 HG21 ILE 54 29.941 5.379 -9.485 265 HG22 ILE 54 HG22 ILE 54 30.844 5.372 -11.040 266 HG23 ILE 54 HG23 ILE 54 29.285 6.271 -10.907 267 HD11 ILE 54 HD11 ILE 54 29.860 7.099 -7.186 268 HD12 ILE 54 HD12 ILE 54 28.540 6.886 -8.388 269 HD13 ILE 54 HD13 ILE 54 28.678 8.414 -7.456 270 H GLY 55 H GLY 55 33.732 7.951 -11.133 271 HA2 GLY 55 HA2 GLY 55 34.803 10.016 -11.205 272 HA3 GLY 55 HA3 GLY 55 34.895 10.048 -9.405 273 H ASN 56 H ASN 56 36.808 9.393 -8.512 274 HA ASN 56 HA ASN 56 38.963 8.625 -10.162 275 HB2 ASN 56 HB2 ASN 56 38.620 8.500 -7.099 276 HB3 ASN 56 HB3 ASN 56 40.186 8.203 -7.951 277 HD21 ASN 56 HD21 ASN 56 39.290 10.441 -6.039 278 HD22 ASN 56 HD22 ASN 56 39.702 11.891 -6.921 Start of MODEL 19 1 H1 PHE 17 HT1 PHE 17 35.004 13.112 -7.911 2 H2 PHE 17 HT2 PHE 17 36.393 12.709 -6.998 3 H3 PHE 17 HT3 PHE 17 35.316 13.890 -6.439 4 HA PHE 17 HA PHE 17 34.672 11.043 -6.788 5 HB2 PHE 17 HB2 PHE 17 36.406 11.355 -5.087 6 HB3 PHE 17 HB3 PHE 17 35.458 12.681 -4.318 7 HD1 PHE 17 HD1 PHE 17 34.133 9.283 -5.429 8 HD2 PHE 17 HD2 PHE 17 35.232 11.854 -2.157 9 HE1 PHE 17 HE1 PHE 17 32.996 7.779 -3.863 10 HE2 PHE 17 HE2 PHE 17 34.171 10.279 -0.571 11 HZ PHE 17 HZ PHE 17 33.043 8.238 -1.419 12 H ASP 18 H ASP 18 32.573 10.607 -7.062 13 HA ASP 18 HA ASP 18 30.681 11.917 -5.254 14 HB2 ASP 18 HB2 ASP 18 30.127 10.992 -8.153 15 HB3 ASP 18 HB3 ASP 18 28.837 11.449 -6.964 16 H VAL 19 H VAL 19 29.094 10.392 -4.347 17 HA VAL 19 HA VAL 19 29.741 7.576 -4.851 18 HB VAL 19 HB VAL 19 30.827 8.246 -2.760 19 HG11 VAL 19 HG11 VAL 19 27.997 8.977 -1.756 20 HG12 VAL 19 HG12 VAL 19 29.350 10.132 -2.066 21 HG13 VAL 19 HG13 VAL 19 29.496 8.898 -0.767 22 HG21 VAL 19 HG21 VAL 19 29.893 6.434 -1.355 23 HG22 VAL 19 HG22 VAL 19 29.960 5.922 -3.082 24 HG23 VAL 19 HG23 VAL 19 28.386 6.399 -2.336 25 H VAL 20 H VAL 20 27.970 6.282 -5.142 26 HA VAL 20 HA VAL 20 25.329 7.406 -4.550 27 HB VAL 20 HB VAL 20 24.382 6.449 -6.628 28 HG11 VAL 20 HG11 VAL 20 24.972 8.874 -6.522 29 HG12 VAL 20 HG12 VAL 20 25.233 8.211 -8.180 30 HG13 VAL 20 HG13 VAL 20 26.640 8.513 -7.092 31 HG21 VAL 20 HG21 VAL 20 26.131 4.697 -7.082 32 HG22 VAL 20 HG22 VAL 20 27.348 5.984 -7.405 33 HG23 VAL 20 HG23 VAL 20 25.928 5.791 -8.494 34 H SER 21 H SER 21 23.652 5.689 -4.332 35 HA SER 21 HA SER 21 24.797 3.307 -3.138 36 HB2 SER 21 HB2 SER 21 22.554 2.732 -2.402 37 HB3 SER 21 HB3 SER 21 22.943 4.420 -1.946 38 HG SER 21 HG SER 21 21.540 5.150 -3.444 39 H CYS 22 H CYS 22 24.173 1.123 -3.723 40 HA CYS 22 HA CYS 22 23.449 0.820 -6.577 41 HB2 CYS 22 HB2 CYS 22 24.882 -1.150 -4.715 42 HB3 CYS 22 HB3 CYS 22 24.469 -1.442 -6.438 43 H ASN 23 H ASN 23 21.626 1.137 -4.179 44 HA ASN 23 HA ASN 23 19.809 0.279 -3.218 45 HB2 ASN 23 HB2 ASN 23 18.010 -0.335 -4.839 46 HB3 ASN 23 HB3 ASN 23 18.962 1.106 -5.317 47 HD21 ASN 23 HD21 ASN 23 19.066 -2.477 -5.892 48 HD22 ASN 23 HD22 ASN 23 19.358 -2.332 -7.614 49 H LYS 24 H LYS 24 21.792 -1.620 -2.567 50 HA LYS 24 HA LYS 24 20.152 -4.060 -2.520 51 HB2 LYS 24 HB2 LYS 24 21.964 -4.293 -4.259 52 HB3 LYS 24 HB3 LYS 24 23.179 -3.900 -3.011 53 HG2 LYS 24 HG2 LYS 24 23.174 -6.305 -3.388 54 HG3 LYS 24 HG3 LYS 24 22.548 -6.016 -1.748 55 HD2 LYS 24 HD2 LYS 24 20.229 -6.425 -2.519 56 HD3 LYS 24 HD3 LYS 24 20.767 -6.431 -4.234 57 HE2 LYS 24 HE2 LYS 24 22.098 -8.505 -3.847 58 HE3 LYS 24 HE3 LYS 24 21.586 -8.521 -2.105 59 HZ1 LYS 24 HZ1 LYS 24 19.330 -8.733 -2.792 60 HZ2 LYS 24 HZ2 LYS 24 20.255 -9.938 -3.548 61 HZ3 LYS 24 HZ3 LYS 24 19.740 -8.583 -4.435 62 H ASN 25 H ASN 25 20.067 -5.103 -0.582 63 HA ASN 25 HA ASN 25 21.002 -3.598 1.683 64 HB2 ASN 25 HB2 ASN 25 18.650 -4.479 1.545 65 HB3 ASN 25 HB3 ASN 25 19.287 -6.164 1.514 66 HD21 ASN 25 HD21 ASN 25 20.090 -7.051 3.520 67 HD22 ASN 25 HD22 ASN 25 19.818 -6.255 5.050 68 H CYS 26 H CYS 26 22.638 -4.058 2.954 69 HA CYS 26 HA CYS 26 24.213 -6.499 2.623 70 HB2 CYS 26 HB2 CYS 26 25.439 -4.575 1.939 71 HB3 CYS 26 HB3 CYS 26 24.837 -3.594 3.328 72 H THR 27 H THR 27 24.956 -7.564 4.582 73 HA THR 27 HA THR 27 24.014 -6.456 7.099 74 HB THR 27 HB THR 27 23.900 -9.476 6.632 75 HG1 THR 27 HG1 THR 27 22.225 -8.368 5.465 76 HG21 THR 27 HG21 THR 27 22.645 -7.621 8.748 77 HG22 THR 27 HG22 THR 27 24.165 -8.534 9.065 78 HG23 THR 27 HG23 THR 27 22.617 -9.419 8.780 79 H SER 28 H SER 28 25.622 -7.271 8.812 80 HA SER 28 HA SER 28 28.099 -6.644 7.914 81 HB2 SER 28 HB2 SER 28 28.801 -7.181 10.263 82 HB3 SER 28 HB3 SER 28 27.233 -6.290 10.190 83 HG SER 28 HG SER 28 27.214 -8.098 11.612 84 H GLY 29 H GLY 29 27.101 -9.971 8.860 85 HA2 GLY 29 HA2 GLY 29 29.743 -10.984 8.123 86 HA3 GLY 29 HA3 GLY 29 28.396 -11.860 8.919 87 H GLN 30 H GLN 30 27.172 -10.300 6.273 88 HA GLN 30 HA GLN 30 27.596 -12.664 4.506 89 HB2 GLN 30 HB2 GLN 30 25.112 -10.874 4.789 90 HB3 GLN 30 HB3 GLN 30 25.306 -12.180 3.575 91 HG2 GLN 30 HG2 GLN 30 25.246 -12.621 6.640 92 HG3 GLN 30 HG3 GLN 30 23.874 -12.854 5.504 93 HE21 GLN 30 HE21 GLN 30 27.240 -14.106 6.200 94 HE22 GLN 30 HE22 GLN 30 26.851 -15.714 5.649 95 H ASN 31 H ASN 31 27.076 -9.128 4.644 96 HA ASN 31 HA ASN 31 27.680 -7.464 3.477 97 HB2 ASN 31 HB2 ASN 31 29.835 -8.807 4.393 98 HB3 ASN 31 HB3 ASN 31 30.194 -8.932 2.633 99 HD21 ASN 31 HD21 ASN 31 30.099 -6.849 5.449 100 HD22 ASN 31 HD22 ASN 31 30.776 -5.432 4.693 101 H GLU 32 H GLU 32 25.817 -8.632 1.967 102 HA GLU 32 HA GLU 32 26.808 -9.516 -0.573 103 HB2 GLU 32 HB2 GLU 32 24.018 -9.159 0.614 104 HB3 GLU 32 HB3 GLU 32 24.305 -9.816 -1.039 105 HG2 GLU 32 HG2 GLU 32 25.626 -11.732 -0.048 106 HG3 GLU 32 HG3 GLU 32 25.348 -11.072 1.603 107 H CYS 33 H CYS 33 27.355 -8.175 -2.215 108 HA CYS 33 HA CYS 33 25.505 -6.038 -2.901 109 HB2 CYS 33 HB2 CYS 33 28.581 -5.816 -2.977 110 HB3 CYS 33 HB3 CYS 33 27.460 -4.618 -3.687 111 HA PRO 34 HA PRO 34 26.411 -7.973 -6.910 112 HB2 PRO 34 HB2 PRO 34 25.885 -5.905 -8.716 113 HB3 PRO 34 HB3 PRO 34 24.562 -6.737 -7.805 114 HG2 PRO 34 HG2 PRO 34 25.992 -4.136 -7.024 115 HG3 PRO 34 HG3 PRO 34 24.206 -4.400 -7.199 116 HD2 PRO 34 HD2 PRO 34 25.437 -4.586 -4.747 117 HD3 PRO 34 HD3 PRO 34 24.144 -5.785 -5.219 118 H GLU 35 H GLU 35 28.111 -7.808 -8.673 119 HA GLU 35 HA GLU 35 30.532 -6.968 -7.514 120 HB2 GLU 35 HB2 GLU 35 29.875 -7.823 -10.380 121 HB3 GLU 35 HB3 GLU 35 31.539 -7.561 -9.769 122 HG2 GLU 35 HG2 GLU 35 31.243 -9.385 -8.061 123 HG3 GLU 35 HG3 GLU 35 29.568 -9.687 -8.657 124 H GLY 36 H GLY 36 31.848 -5.204 -7.783 125 HA2 GLY 36 HA2 GLY 36 32.571 -3.237 -8.764 126 HA3 GLY 36 HA3 GLY 36 31.010 -3.073 -9.635 127 H CYS 37 H CYS 37 29.866 -3.889 -6.753 128 HA CYS 37 HA CYS 37 29.965 -1.158 -5.645 129 HB2 CYS 37 HB2 CYS 37 27.771 -3.287 -5.447 130 HB3 CYS 37 HB3 CYS 37 27.744 -1.701 -4.601 131 H PHE 38 H PHE 38 29.935 -0.996 -3.272 132 HA PHE 38 HA PHE 38 30.905 -3.407 -1.892 133 HB2 PHE 38 HB2 PHE 38 32.814 -2.214 -0.893 134 HB3 PHE 38 HB3 PHE 38 32.932 -2.047 -2.683 135 HD1 PHE 38 HD1 PHE 38 32.602 -0.272 0.482 136 HD2 PHE 38 HD2 PHE 38 32.085 0.093 -3.767 137 HE1 PHE 38 HE1 PHE 38 32.491 2.191 0.709 138 HE2 PHE 38 HE2 PHE 38 31.847 2.519 -3.533 139 HZ PHE 38 HZ PHE 38 32.108 3.601 -1.300 140 H CYS 39 H CYS 39 30.718 -3.238 0.502 141 HA CYS 39 HA CYS 39 28.459 -1.492 1.218 142 HB2 CYS 39 HB2 CYS 39 27.921 -3.823 1.386 143 HB3 CYS 39 HB3 CYS 39 29.428 -4.177 2.303 144 H GLY 40 H GLY 40 28.741 0.141 2.562 145 HA2 GLY 40 HA2 GLY 40 31.272 0.429 4.002 146 HA3 GLY 40 HA3 GLY 40 29.944 1.626 3.813 147 H LEU 41 H LEU 41 30.316 -1.670 5.213 148 HA LEU 41 HA LEU 41 28.917 -0.701 7.632 149 HB2 LEU 41 HB2 LEU 41 27.784 -2.560 6.460 150 HB3 LEU 41 HB3 LEU 41 29.268 -3.542 6.523 151 HG LEU 41 HG LEU 41 27.402 -4.124 8.110 152 HD11 LEU 41 HD11 LEU 41 28.761 -4.818 9.930 153 HD12 LEU 41 HD12 LEU 41 29.997 -3.533 9.648 154 HD13 LEU 41 HD13 LEU 41 29.799 -4.874 8.454 155 HD21 LEU 41 HD21 LEU 41 26.729 -1.812 8.811 156 HD22 LEU 41 HD22 LEU 41 28.266 -1.662 9.752 157 HD23 LEU 41 HD23 LEU 41 27.055 -2.919 10.200 158 H LEU 42 H LEU 42 30.221 -0.299 9.357 159 HA LEU 42 HA LEU 42 32.843 -1.659 9.417 160 HB2 LEU 42 HB2 LEU 42 32.131 1.099 10.588 161 HB3 LEU 42 HB3 LEU 42 33.728 0.291 10.598 162 HG LEU 42 HG LEU 42 33.956 1.909 8.996 163 HD11 LEU 42 HD11 LEU 42 33.046 -0.250 7.035 164 HD12 LEU 42 HD12 LEU 42 34.442 -0.559 8.105 165 HD13 LEU 42 HD13 LEU 42 34.471 0.839 6.944 166 HD21 LEU 42 HD21 LEU 42 32.346 2.690 7.369 167 HD22 LEU 42 HD22 LEU 42 31.470 2.477 8.946 168 HD23 LEU 42 HD23 LEU 42 31.266 1.272 7.640 169 H GLY 43 H GLY 43 33.408 -2.650 11.355 170 HA2 GLY 43 HA2 GLY 43 33.503 -3.049 13.541 171 HA3 GLY 43 HA3 GLY 43 32.483 -1.594 13.787 172 H GLN 44 H GLN 44 30.914 -3.820 11.886 173 HA GLN 44 HA GLN 44 29.014 -4.891 12.098 174 HB2 GLN 44 HB2 GLN 44 30.640 -6.508 13.331 175 HB3 GLN 44 HB3 GLN 44 29.977 -5.848 14.843 176 HG2 GLN 44 HG2 GLN 44 27.622 -6.614 13.443 177 HG3 GLN 44 HG3 GLN 44 28.822 -7.833 12.861 178 HE21 GLN 44 HE21 GLN 44 27.741 -6.215 15.906 179 HE22 GLN 44 HE22 GLN 44 27.793 -7.661 16.898 180 H ASN 45 H ASN 45 28.753 -2.242 12.745 181 HA ASN 45 HA ASN 45 27.370 -1.885 15.246 182 HB2 ASN 45 HB2 ASN 45 27.750 -0.126 12.762 183 HB3 ASN 45 HB3 ASN 45 26.673 0.391 14.096 184 HD21 ASN 45 HD21 ASN 45 30.086 -0.023 13.113 185 HD22 ASN 45 HD22 ASN 45 30.720 0.722 14.555 186 H LYS 46 H LYS 46 26.191 -2.016 11.867 187 HA LYS 46 HA LYS 46 23.619 -2.958 12.867 188 HB2 LYS 46 HB2 LYS 46 23.918 -0.565 10.940 189 HB3 LYS 46 HB3 LYS 46 22.354 -1.412 11.287 190 HG2 LYS 46 HG2 LYS 46 23.955 0.156 13.378 191 HG3 LYS 46 HG3 LYS 46 22.588 0.776 12.400 192 HD2 LYS 46 HD2 LYS 46 21.147 -1.128 13.322 193 HD3 LYS 46 HD3 LYS 46 22.492 -1.502 14.455 194 HE2 LYS 46 HE2 LYS 46 22.325 0.862 15.375 195 HE3 LYS 46 HE3 LYS 46 20.923 1.160 14.258 196 HZ1 LYS 46 HZ1 LYS 46 21.089 -0.951 16.339 197 HZ2 LYS 46 HZ2 LYS 46 19.766 -0.651 15.316 198 HZ3 LYS 46 HZ3 LYS 46 20.237 0.512 16.463 199 H LYS 47 H LYS 47 23.179 -2.081 9.788 200 HA LYS 47 HA LYS 47 23.896 -4.702 8.721 201 HB2 LYS 47 HB2 LYS 47 21.923 -4.268 7.210 202 HB3 LYS 47 HB3 LYS 47 21.529 -4.396 8.949 203 HG2 LYS 47 HG2 LYS 47 21.265 -2.006 9.174 204 HG3 LYS 47 HG3 LYS 47 21.865 -1.663 7.522 205 HD2 LYS 47 HD2 LYS 47 19.848 -2.498 6.533 206 HD3 LYS 47 HD3 LYS 47 19.442 -3.489 7.964 207 HE2 LYS 47 HE2 LYS 47 17.914 -1.519 7.775 208 HE3 LYS 47 HE3 LYS 47 18.886 -1.474 9.304 209 HZ1 LYS 47 HZ1 LYS 47 18.816 0.650 8.238 210 HZ2 LYS 47 HZ2 LYS 47 19.471 0.009 6.803 211 HZ3 LYS 47 HZ3 LYS 47 20.402 0.040 8.225 212 H GLY 48 H GLY 48 23.823 -1.204 7.704 213 HA2 GLY 48 HA2 GLY 48 25.303 -0.186 6.280 214 HA3 GLY 48 HA3 GLY 48 25.979 -1.788 5.809 215 H HIS 49 H HIS 49 25.692 -0.257 3.657 216 HA HIS 49 HA HIS 49 23.541 -1.557 2.282 217 HB2 HIS 49 HB2 HIS 49 22.486 0.592 3.254 218 HB3 HIS 49 HB3 HIS 49 23.686 1.525 2.312 219 HD2 HIS 49 HD2 HIS 49 22.752 2.155 -0.239 220 HE1 HIS 49 HE1 HIS 49 19.599 -0.675 -0.314 221 HE2 HIS 49 HE2 HIS 49 20.679 1.277 -1.526 222 H CYS 50 H CYS 50 23.985 -1.406 -0.119 223 HA CYS 50 HA CYS 50 26.839 -1.275 -0.499 224 HB2 CYS 50 HB2 CYS 50 24.588 -2.037 -2.418 225 HB3 CYS 50 HB3 CYS 50 26.342 -2.209 -2.774 226 H TYR 51 H TYR 51 28.062 0.148 -1.693 227 HA TYR 51 HA TYR 51 26.652 2.399 -3.004 228 HB2 TYR 51 HB2 TYR 51 29.456 2.645 -1.751 229 HB3 TYR 51 HB3 TYR 51 28.336 3.943 -2.307 230 HD1 TYR 51 HD1 TYR 51 25.768 2.966 -0.739 231 HD2 TYR 51 HD2 TYR 51 29.912 3.464 0.269 232 HE1 TYR 51 HE1 TYR 51 25.186 3.017 1.664 233 HE2 TYR 51 HE2 TYR 51 29.330 3.546 2.667 234 HH TYR 51 HH TYR 51 27.663 3.395 4.209 235 H LYS 52 H LYS 52 27.914 3.441 -4.724 236 HA LYS 52 HA LYS 52 30.260 1.933 -5.683 237 HB2 LYS 52 HB2 LYS 52 28.378 1.608 -7.273 238 HB3 LYS 52 HB3 LYS 52 28.171 3.384 -7.385 239 HG2 LYS 52 HG2 LYS 52 30.488 3.554 -8.394 240 HG3 LYS 52 HG3 LYS 52 30.686 1.781 -8.216 241 HD2 LYS 52 HD2 LYS 52 30.165 2.428 -10.511 242 HD3 LYS 52 HD3 LYS 52 28.858 1.388 -9.853 243 HE2 LYS 52 HE2 LYS 52 27.299 3.228 -9.705 244 HE3 LYS 52 HE3 LYS 52 28.618 4.465 -9.827 245 HZ1 LYS 52 HZ1 LYS 52 27.407 4.186 -11.881 246 HZ2 LYS 52 HZ2 LYS 52 27.872 2.551 -11.969 247 HZ3 LYS 52 HZ3 LYS 52 29.054 3.777 -12.025 248 H ILE 53 H ILE 53 32.102 3.117 -5.977 249 HA ILE 53 HA ILE 53 32.098 6.000 -5.543 250 HB ILE 53 HB ILE 53 34.301 3.931 -5.780 251 HG12 ILE 53 HG12 ILE 53 33.682 5.812 -3.441 252 HG13 ILE 53 HG13 ILE 53 32.975 4.186 -3.585 253 HG21 ILE 53 HG21 ILE 53 35.118 5.961 -6.946 254 HG22 ILE 53 HG22 ILE 53 35.943 5.814 -5.361 255 HG23 ILE 53 HG23 ILE 53 34.602 7.002 -5.563 256 HD11 ILE 53 HD11 ILE 53 35.998 4.855 -3.388 257 HD12 ILE 53 HD12 ILE 53 35.325 3.199 -3.631 258 HD13 ILE 53 HD13 ILE 53 34.963 4.106 -2.119 259 H ILE 54 H ILE 54 32.114 7.428 -7.221 260 HA ILE 54 HA ILE 54 33.384 6.591 -9.698 261 HB ILE 54 HB ILE 54 31.778 7.914 -11.015 262 HG12 ILE 54 HG12 ILE 54 30.831 9.179 -8.974 263 HG13 ILE 54 HG13 ILE 54 29.728 8.699 -10.301 264 HG21 ILE 54 HG21 ILE 54 31.760 5.450 -11.021 265 HG22 ILE 54 HG22 ILE 54 30.082 6.101 -11.173 266 HG23 ILE 54 HG23 ILE 54 30.656 5.425 -9.603 267 HD11 ILE 54 HD11 ILE 54 29.934 7.175 -7.592 268 HD12 ILE 54 HD12 ILE 54 28.814 6.831 -8.957 269 HD13 ILE 54 HD13 ILE 54 28.692 8.381 -8.056 270 H GLY 55 H GLY 55 34.270 8.347 -10.968 271 HA2 GLY 55 HA2 GLY 55 34.880 10.615 -11.164 272 HA3 GLY 55 HA3 GLY 55 34.821 10.776 -9.370 273 H ASN 56 H ASN 56 36.994 11.451 -9.169 274 HA ASN 56 HA ASN 56 39.186 11.287 -9.009 275 HB2 ASN 56 HB2 ASN 56 38.530 8.309 -8.578 276 HB3 ASN 56 HB3 ASN 56 40.097 9.089 -8.128 277 HD21 ASN 56 HD21 ASN 56 37.736 7.851 -6.489 278 HD22 ASN 56 HD22 ASN 56 37.463 9.075 -5.272 Start of MODEL 20 1 H1 PHE 17 HT1 PHE 17 36.161 12.863 -7.037 2 H2 PHE 17 HT2 PHE 17 35.009 14.050 -6.670 3 H3 PHE 17 HT3 PHE 17 34.800 13.089 -8.047 4 HA PHE 17 HA PHE 17 34.560 11.143 -6.662 5 HB2 PHE 17 HB2 PHE 17 36.069 11.888 -4.848 6 HB3 PHE 17 HB3 PHE 17 34.918 13.203 -4.412 7 HD1 PHE 17 HD1 PHE 17 34.022 9.584 -5.136 8 HD2 PHE 17 HD2 PHE 17 34.505 12.666 -2.173 9 HE1 PHE 17 HE1 PHE 17 32.826 8.202 -3.508 10 HE2 PHE 17 HE2 PHE 17 33.374 11.229 -0.504 11 HZ PHE 17 HZ PHE 17 32.521 8.994 -1.167 12 H ASP 18 H ASP 18 32.533 10.545 -7.202 13 HA ASP 18 HA ASP 18 30.366 11.841 -5.719 14 HB2 ASP 18 HB2 ASP 18 30.237 10.611 -8.551 15 HB3 ASP 18 HB3 ASP 18 28.780 11.074 -7.575 16 H VAL 19 H VAL 19 28.877 10.346 -4.734 17 HA VAL 19 HA VAL 19 29.591 7.511 -4.998 18 HB VAL 19 HB VAL 19 30.442 8.325 -2.852 19 HG11 VAL 19 HG11 VAL 19 28.903 9.121 -1.066 20 HG12 VAL 19 HG12 VAL 19 27.524 9.131 -2.219 21 HG13 VAL 19 HG13 VAL 19 28.915 10.260 -2.458 22 HG21 VAL 19 HG21 VAL 19 29.323 6.641 -1.411 23 HG22 VAL 19 HG22 VAL 19 29.594 5.983 -3.065 24 HG23 VAL 19 HG23 VAL 19 27.946 6.524 -2.560 25 H VAL 20 H VAL 20 27.856 6.200 -5.481 26 HA VAL 20 HA VAL 20 25.168 7.305 -5.141 27 HB VAL 20 HB VAL 20 24.395 6.401 -7.302 28 HG11 VAL 20 HG11 VAL 20 25.363 8.202 -8.740 29 HG12 VAL 20 HG12 VAL 20 26.663 8.492 -7.523 30 HG13 VAL 20 HG13 VAL 20 24.947 8.818 -7.095 31 HG21 VAL 20 HG21 VAL 20 27.411 5.943 -7.847 32 HG22 VAL 20 HG22 VAL 20 26.091 5.817 -9.065 33 HG23 VAL 20 HG23 VAL 20 26.148 4.663 -7.690 34 H SER 21 H SER 21 23.470 5.647 -5.022 35 HA SER 21 HA SER 21 24.462 3.361 -3.607 36 HB2 SER 21 HB2 SER 21 22.086 2.958 -3.034 37 HB3 SER 21 HB3 SER 21 22.590 4.647 -2.675 38 HG SER 21 HG SER 21 20.550 4.462 -3.760 39 H CYS 22 H CYS 22 24.028 1.162 -4.007 40 HA CYS 22 HA CYS 22 23.562 0.528 -6.836 41 HB2 CYS 22 HB2 CYS 22 24.717 -1.156 -4.565 42 HB3 CYS 22 HB3 CYS 22 24.510 -1.682 -6.273 43 H ASN 23 H ASN 23 21.781 0.809 -4.069 44 HA ASN 23 HA ASN 23 19.897 0.043 -3.207 45 HB2 ASN 23 HB2 ASN 23 19.259 -0.396 -6.171 46 HB3 ASN 23 HB3 ASN 23 18.024 -0.459 -4.847 47 HD21 ASN 23 HD21 ASN 23 19.876 1.713 -6.866 48 HD22 ASN 23 HD22 ASN 23 19.354 3.187 -6.089 49 H LYS 24 H LYS 24 21.802 -1.743 -2.816 50 HA LYS 24 HA LYS 24 20.128 -4.018 -2.182 51 HB2 LYS 24 HB2 LYS 24 23.040 -4.081 -3.168 52 HB3 LYS 24 HB3 LYS 24 22.363 -5.420 -2.191 53 HG2 LYS 24 HG2 LYS 24 21.058 -4.499 -4.813 54 HG3 LYS 24 HG3 LYS 24 22.382 -5.704 -4.811 55 HD2 LYS 24 HD2 LYS 24 19.896 -6.083 -3.052 56 HD3 LYS 24 HD3 LYS 24 19.923 -6.588 -4.781 57 HE2 LYS 24 HE2 LYS 24 21.802 -8.131 -4.383 58 HE3 LYS 24 HE3 LYS 24 21.969 -7.565 -2.670 59 HZ1 LYS 24 HZ1 LYS 24 19.520 -8.816 -3.788 60 HZ2 LYS 24 HZ2 LYS 24 19.853 -8.409 -2.167 61 HZ3 LYS 24 HZ3 LYS 24 20.740 -9.632 -2.927 62 H ASN 25 H ASN 25 20.569 -4.768 0.038 63 HA ASN 25 HA ASN 25 22.094 -2.819 1.597 64 HB2 ASN 25 HB2 ASN 25 21.001 -3.771 3.565 65 HB3 ASN 25 HB3 ASN 25 19.775 -3.450 2.284 66 HD21 ASN 25 HD21 ASN 25 20.967 -5.853 4.430 67 HD22 ASN 25 HD22 ASN 25 19.984 -7.154 3.820 68 H CYS 26 H CYS 26 23.473 -3.971 3.502 69 HA CYS 26 HA CYS 26 24.251 -6.653 2.623 70 HB2 CYS 26 HB2 CYS 26 26.474 -6.493 3.294 71 HB3 CYS 26 HB3 CYS 26 26.182 -5.077 2.269 72 H THR 27 H THR 27 25.065 -7.835 4.804 73 HA THR 27 HA THR 27 23.805 -6.702 7.153 74 HB THR 27 HB THR 27 23.425 -9.665 6.447 75 HG1 THR 27 HG1 THR 27 22.027 -8.270 5.284 76 HG21 THR 27 HG21 THR 27 22.267 -7.921 8.720 77 HG22 THR 27 HG22 THR 27 23.648 -9.067 8.944 78 HG23 THR 27 HG23 THR 27 22.013 -9.687 8.488 79 H SER 28 H SER 28 25.269 -7.267 8.953 80 HA SER 28 HA SER 28 27.842 -7.176 8.141 81 HB2 SER 28 HB2 SER 28 27.056 -6.434 10.388 82 HB3 SER 28 HB3 SER 28 26.823 -8.138 10.887 83 HG SER 28 HG SER 28 29.081 -8.418 10.662 84 H GLY 29 H GLY 29 26.264 -10.245 9.281 85 HA2 GLY 29 HA2 GLY 29 28.680 -11.768 8.999 86 HA3 GLY 29 HA3 GLY 29 27.002 -12.386 9.156 87 H GLN 30 H GLN 30 25.870 -11.280 6.887 88 HA GLN 30 HA GLN 30 26.582 -13.222 4.947 89 HB2 GLN 30 HB2 GLN 30 24.631 -10.854 4.969 90 HB3 GLN 30 HB3 GLN 30 24.723 -12.039 3.621 91 HG2 GLN 30 HG2 GLN 30 24.020 -13.900 5.041 92 HG3 GLN 30 HG3 GLN 30 24.180 -12.913 6.533 93 HE21 GLN 30 HE21 GLN 30 22.382 -12.525 3.319 94 HE22 GLN 30 HE22 GLN 30 20.897 -12.113 4.124 95 H ASN 31 H ASN 31 27.014 -9.717 5.131 96 HA ASN 31 HA ASN 31 28.028 -8.192 4.014 97 HB2 ASN 31 HB2 ASN 31 29.868 -9.714 5.056 98 HB3 ASN 31 HB3 ASN 31 30.166 -10.315 3.388 99 HD21 ASN 31 HD21 ASN 31 29.724 -7.173 5.143 100 HD22 ASN 31 HD22 ASN 31 31.031 -6.336 4.343 101 H GLU 32 H GLU 32 26.050 -9.370 2.387 102 HA GLU 32 HA GLU 32 26.893 -9.737 -0.275 103 HB2 GLU 32 HB2 GLU 32 24.258 -9.019 1.061 104 HB3 GLU 32 HB3 GLU 32 24.330 -9.157 -0.695 105 HG2 GLU 32 HG2 GLU 32 25.155 -11.559 -0.480 106 HG3 GLU 32 HG3 GLU 32 25.159 -11.409 1.312 107 H CYS 33 H CYS 33 27.592 -8.327 -1.825 108 HA CYS 33 HA CYS 33 25.810 -6.184 -2.304 109 HB2 CYS 33 HB2 CYS 33 28.854 -5.701 -2.386 110 HB3 CYS 33 HB3 CYS 33 27.685 -4.669 -3.254 111 HA PRO 34 HA PRO 34 26.813 -8.039 -6.332 112 HB2 PRO 34 HB2 PRO 34 26.132 -5.998 -8.118 113 HB3 PRO 34 HB3 PRO 34 24.877 -6.937 -7.216 114 HG2 PRO 34 HG2 PRO 34 26.106 -4.239 -6.425 115 HG3 PRO 34 HG3 PRO 34 24.344 -4.645 -6.578 116 HD2 PRO 34 HD2 PRO 34 25.640 -4.731 -4.151 117 HD3 PRO 34 HD3 PRO 34 24.426 -6.024 -4.570 118 H GLU 35 H GLU 35 28.472 -7.738 -8.108 119 HA GLU 35 HA GLU 35 30.848 -6.799 -6.937 120 HB2 GLU 35 HB2 GLU 35 30.234 -7.657 -9.812 121 HB3 GLU 35 HB3 GLU 35 31.884 -7.342 -9.189 122 HG2 GLU 35 HG2 GLU 35 31.648 -9.184 -7.492 123 HG3 GLU 35 HG3 GLU 35 29.984 -9.536 -8.093 124 H GLY 36 H GLY 36 32.124 -5.000 -7.226 125 HA2 GLY 36 HA2 GLY 36 32.793 -3.018 -8.181 126 HA3 GLY 36 HA3 GLY 36 31.261 -2.920 -9.112 127 H CYS 37 H CYS 37 30.131 -3.722 -6.193 128 HA CYS 37 HA CYS 37 30.006 -0.943 -5.206 129 HB2 CYS 37 HB2 CYS 37 27.968 -3.223 -4.929 130 HB3 CYS 37 HB3 CYS 37 27.800 -1.578 -4.220 131 H PHE 38 H PHE 38 29.948 -0.714 -2.799 132 HA PHE 38 HA PHE 38 30.826 -3.122 -1.376 133 HB2 PHE 38 HB2 PHE 38 32.680 -2.044 -0.268 134 HB3 PHE 38 HB3 PHE 38 32.907 -1.714 -2.016 135 HD1 PHE 38 HD1 PHE 38 32.000 0.643 -2.892 136 HD2 PHE 38 HD2 PHE 38 32.689 -0.310 1.250 137 HE1 PHE 38 HE1 PHE 38 31.954 3.024 -2.326 138 HE2 PHE 38 HE2 PHE 38 32.786 2.100 1.788 139 HZ PHE 38 HZ PHE 38 32.418 3.783 -0.005 140 H CYS 39 H CYS 39 30.584 -2.795 1.051 141 HA CYS 39 HA CYS 39 28.375 -0.909 1.626 142 HB2 CYS 39 HB2 CYS 39 27.650 -3.309 1.557 143 HB3 CYS 39 HB3 CYS 39 28.911 -3.719 2.761 144 H GLY 40 H GLY 40 29.053 0.653 3.090 145 HA2 GLY 40 HA2 GLY 40 31.577 0.307 4.461 146 HA3 GLY 40 HA3 GLY 40 30.456 1.715 4.485 147 H LEU 41 H LEU 41 30.898 -1.599 5.673 148 HA LEU 41 HA LEU 41 28.967 -1.124 7.826 149 HB2 LEU 41 HB2 LEU 41 28.968 -3.119 6.203 150 HB3 LEU 41 HB3 LEU 41 30.501 -3.647 6.946 151 HG LEU 41 HG LEU 41 28.565 -4.931 7.685 152 HD11 LEU 41 HD11 LEU 41 29.624 -3.279 10.040 153 HD12 LEU 41 HD12 LEU 41 30.433 -4.718 9.293 154 HD13 LEU 41 HD13 LEU 41 28.825 -4.897 10.105 155 HD21 LEU 41 HD21 LEU 41 26.822 -3.169 7.444 156 HD22 LEU 41 HD22 LEU 41 27.390 -2.400 8.976 157 HD23 LEU 41 HD23 LEU 41 26.713 -4.074 8.995 158 H LEU 42 H LEU 42 29.819 -0.263 9.715 159 HA LEU 42 HA LEU 42 32.406 0.621 9.379 160 HB2 LEU 42 HB2 LEU 42 30.655 0.896 11.920 161 HB3 LEU 42 HB3 LEU 42 32.042 1.910 11.456 162 HG LEU 42 HG LEU 42 30.150 3.189 11.092 163 HD11 LEU 42 HD11 LEU 42 30.137 3.759 8.706 164 HD12 LEU 42 HD12 LEU 42 30.784 2.141 8.269 165 HD13 LEU 42 HD13 LEU 42 31.819 3.310 9.186 166 HD21 LEU 42 HD21 LEU 42 28.613 1.011 10.983 167 HD22 LEU 42 HD22 LEU 42 28.730 1.276 9.203 168 HD23 LEU 42 HD23 LEU 42 28.060 2.572 10.251 169 H GLY 43 H GLY 43 31.131 -1.288 12.155 170 HA2 GLY 43 HA2 GLY 43 33.552 -2.867 12.281 171 HA3 GLY 43 HA3 GLY 43 33.208 -1.768 13.680 172 H GLN 44 H GLN 44 31.859 -4.326 11.657 173 HA GLN 44 HA GLN 44 30.183 -5.691 11.804 174 HB2 GLN 44 HB2 GLN 44 30.291 -7.387 13.613 175 HB3 GLN 44 HB3 GLN 44 31.837 -7.090 12.797 176 HG2 GLN 44 HG2 GLN 44 31.168 -5.711 15.482 177 HG3 GLN 44 HG3 GLN 44 31.733 -7.421 15.425 178 HE21 GLN 44 HE21 GLN 44 33.096 -5.150 16.671 179 HE22 GLN 44 HE22 GLN 44 34.668 -5.085 15.903 180 H ASN 45 H ASN 45 28.761 -3.737 11.894 181 HA ASN 45 HA ASN 45 27.181 -3.592 14.364 182 HB2 ASN 45 HB2 ASN 45 27.314 -1.722 11.891 183 HB3 ASN 45 HB3 ASN 45 26.438 -1.375 13.438 184 HD21 ASN 45 HD21 ASN 45 28.018 -1.741 15.505 185 HD22 ASN 45 HD22 ASN 45 29.575 -0.981 15.314 186 H LYS 46 H LYS 46 25.411 -2.278 11.846 187 HA LYS 46 HA LYS 46 23.538 -4.511 11.980 188 HB2 LYS 46 HB2 LYS 46 23.177 -1.563 11.151 189 HB3 LYS 46 HB3 LYS 46 21.886 -2.818 11.109 190 HG2 LYS 46 HG2 LYS 46 21.476 -1.533 12.996 191 HG3 LYS 46 HG3 LYS 46 22.137 -3.068 13.631 192 HD2 LYS 46 HD2 LYS 46 24.201 -2.032 14.253 193 HD3 LYS 46 HD3 LYS 46 23.948 -0.613 13.185 194 HE2 LYS 46 HE2 LYS 46 22.154 -1.182 15.633 195 HE3 LYS 46 HE3 LYS 46 23.679 -0.196 15.708 196 HZ1 LYS 46 HZ1 LYS 46 21.874 1.236 15.389 197 HZ2 LYS 46 HZ2 LYS 46 21.263 0.344 14.078 198 HZ3 LYS 46 HZ3 LYS 46 22.733 1.185 13.929 199 H LYS 47 H LYS 47 23.308 -2.183 9.391 200 HA LYS 47 HA LYS 47 23.655 -4.384 7.472 201 HB2 LYS 47 HB2 LYS 47 21.542 -3.688 6.405 202 HB3 LYS 47 HB3 LYS 47 21.299 -4.190 8.102 203 HG2 LYS 47 HG2 LYS 47 21.134 -1.841 8.843 204 HG3 LYS 47 HG3 LYS 47 21.524 -1.245 7.192 205 HD2 LYS 47 HD2 LYS 47 19.487 -2.156 6.285 206 HD3 LYS 47 HD3 LYS 47 19.060 -2.994 7.814 207 HE2 LYS 47 HE2 LYS 47 19.351 0.083 7.598 208 HE3 LYS 47 HE3 LYS 47 17.786 -0.798 7.333 209 HZ1 LYS 47 HZ1 LYS 47 17.977 -1.705 9.533 210 HZ2 LYS 47 HZ2 LYS 47 18.011 -0.007 9.565 211 HZ3 LYS 47 HZ3 LYS 47 19.446 -0.889 9.792 212 H GLY 48 H GLY 48 23.919 -0.788 7.807 213 HA2 GLY 48 HA2 GLY 48 24.775 0.711 6.375 214 HA3 GLY 48 HA3 GLY 48 25.613 -0.659 5.554 215 H HIS 49 H HIS 49 25.310 0.148 3.389 216 HA HIS 49 HA HIS 49 23.021 -1.004 2.324 217 HB2 HIS 49 HB2 HIS 49 22.239 1.525 2.763 218 HB3 HIS 49 HB3 HIS 49 23.381 1.933 1.435 219 HD2 HIS 49 HD2 HIS 49 22.166 1.942 -1.020 220 HE1 HIS 49 HE1 HIS 49 18.831 -0.414 0.114 221 HE2 HIS 49 HE2 HIS 49 19.833 1.055 -1.702 222 H CYS 50 H CYS 50 23.655 -1.266 -0.188 223 HA CYS 50 HA CYS 50 26.547 -1.056 -0.406 224 HB2 CYS 50 HB2 CYS 50 24.488 -2.228 -2.324 225 HB3 CYS 50 HB3 CYS 50 26.264 -2.240 -2.598 226 H TYR 51 H TYR 51 27.677 0.334 -1.609 227 HA TYR 51 HA TYR 51 26.470 1.915 -3.682 228 HB2 TYR 51 HB2 TYR 51 27.451 4.096 -2.570 229 HB3 TYR 51 HB3 TYR 51 25.859 3.468 -2.052 230 HD1 TYR 51 HD1 TYR 51 25.388 3.016 0.075 231 HD2 TYR 51 HD2 TYR 51 29.534 3.377 -0.994 232 HE1 TYR 51 HE1 TYR 51 25.995 2.887 2.457 233 HE2 TYR 51 HE2 TYR 51 30.144 3.216 1.431 234 HH TYR 51 HH TYR 51 27.646 2.675 3.921 235 H LYS 52 H LYS 52 28.086 3.385 -4.777 236 HA LYS 52 HA LYS 52 30.721 2.076 -4.818 237 HB2 LYS 52 HB2 LYS 52 30.678 1.917 -7.265 238 HB3 LYS 52 HB3 LYS 52 29.329 0.994 -6.553 239 HG2 LYS 52 HG2 LYS 52 27.738 2.848 -7.098 240 HG3 LYS 52 HG3 LYS 52 29.080 3.801 -7.816 241 HD2 LYS 52 HD2 LYS 52 29.477 1.971 -9.486 242 HD3 LYS 52 HD3 LYS 52 28.119 1.035 -8.771 243 HE2 LYS 52 HE2 LYS 52 26.518 2.880 -9.389 244 HE3 LYS 52 HE3 LYS 52 27.890 3.813 -10.125 245 HZ1 LYS 52 HZ1 LYS 52 26.660 2.552 -11.744 246 HZ2 LYS 52 HZ2 LYS 52 26.984 1.098 -10.926 247 HZ3 LYS 52 HZ3 LYS 52 28.257 1.980 -11.626 248 H ILE 53 H ILE 53 32.409 3.260 -5.929 249 HA ILE 53 HA ILE 53 32.095 6.163 -5.586 250 HB ILE 53 HB ILE 53 34.521 4.355 -5.313 251 HG12 ILE 53 HG12 ILE 53 33.160 6.138 -3.211 252 HG13 ILE 53 HG13 ILE 53 32.816 4.402 -3.431 253 HG21 ILE 53 HG21 ILE 53 35.290 6.454 -6.366 254 HG22 ILE 53 HG22 ILE 53 35.761 6.481 -4.640 255 HG23 ILE 53 HG23 ILE 53 34.331 7.433 -5.191 256 HD11 ILE 53 HD11 ILE 53 35.582 5.583 -2.684 257 HD12 ILE 53 HD12 ILE 53 35.210 3.834 -2.936 258 HD13 ILE 53 HD13 ILE 53 34.443 4.735 -1.580 259 H ILE 54 H ILE 54 32.227 7.402 -7.366 260 HA ILE 54 HA ILE 54 33.920 6.521 -9.558 261 HB ILE 54 HB ILE 54 32.374 7.443 -11.227 262 HG12 ILE 54 HG12 ILE 54 31.006 8.836 -9.532 263 HG13 ILE 54 HG13 ILE 54 30.160 8.046 -10.898 264 HG21 ILE 54 HG21 ILE 54 30.913 5.442 -11.363 265 HG22 ILE 54 HG22 ILE 54 31.287 5.032 -9.648 266 HG23 ILE 54 HG23 ILE 54 32.597 5.008 -10.878 267 HD11 ILE 54 HD11 ILE 54 29.268 6.277 -9.421 268 HD12 ILE 54 HD12 ILE 54 28.876 7.898 -8.753 269 HD13 ILE 54 HD13 ILE 54 30.182 6.910 -8.008 270 H GLY 55 H GLY 55 34.743 8.370 -10.875 271 HA2 GLY 55 HA2 GLY 55 34.532 10.884 -10.878 272 HA3 GLY 55 HA3 GLY 55 35.028 10.725 -9.146 273 H ASN 56 H ASN 56 37.019 11.755 -9.366 274 HA ASN 56 HA ASN 56 38.875 11.184 -11.379 275 HB2 ASN 56 HB2 ASN 56 38.775 13.266 -9.932 276 HB3 ASN 56 HB3 ASN 56 39.339 12.281 -8.532 277 HD21 ASN 56 HD21 ASN 56 41.281 13.572 -8.308 278 HD22 ASN 56 HD22 ASN 56 42.574 13.468 -9.478
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