NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
644440 | 6qk5 | 34355 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA2 GLY 1 HA1 GLY 1 -29.487 20.527 -30.027 2 HA3 GLY 1 HA2 GLY 1 -28.394 21.899 -30.111 3 H SER 2 HN SER 2 -26.137 21.536 -30.008 4 HA SER 2 HA SER 2 -25.206 19.285 -31.380 5 HB2 SER 2 HB2 SER 2 -23.598 21.141 -29.614 6 HB3 SER 2 HB1 SER 2 -22.985 20.152 -30.939 7 HG SER 2 HG SER 2 -23.507 22.505 -31.298 8 H GLY 3 HN GLY 3 -24.999 17.263 -30.683 9 HA2 GLY 3 HA2 GLY 3 -25.274 16.511 -27.964 10 HA3 GLY 3 HA1 GLY 3 -24.811 15.452 -29.286 11 H LYS 4 HN LYS 4 -23.689 17.544 -26.764 12 HA LYS 4 HA LYS 4 -21.132 16.180 -26.725 13 HB2 LYS 4 HB2 LYS 4 -19.861 18.312 -26.644 14 HB3 LYS 4 HB1 LYS 4 -20.643 18.058 -28.198 15 HG2 LYS 4 HG2 LYS 4 -22.418 19.606 -27.576 16 HG3 LYS 4 HG1 LYS 4 -21.674 19.836 -25.995 17 HD2 LYS 4 HD2 LYS 4 -19.681 20.770 -27.067 18 HD3 LYS 4 HD1 LYS 4 -20.422 20.532 -28.652 19 HE2 LYS 4 HE2 LYS 4 -22.218 22.061 -28.064 20 HE3 LYS 4 HE1 LYS 4 -21.544 22.258 -26.449 21 HZ1 LYS 4 HZ1 LYS 4 -20.208 23.057 -28.982 22 HZ2 LYS 4 HZ2 LYS 4 -19.586 23.264 -27.420 23 HZ3 LYS 4 HZ3 LYS 4 -20.970 24.100 -27.893 24 H GLY 5 HN GLY 5 -20.003 16.550 -24.692 25 HA2 GLY 5 HA2 GLY 5 -21.287 18.072 -22.633 26 HA3 GLY 5 HA1 GLY 5 -21.571 16.347 -22.467 27 H LYS 6 HN LYS 6 -19.537 18.864 -21.711 28 HA LYS 6 HA LYS 6 -17.365 16.999 -21.042 29 HB2 LYS 6 HB2 LYS 6 -17.257 19.972 -21.567 30 HB3 LYS 6 HB1 LYS 6 -15.904 19.029 -20.966 31 HG2 LYS 6 HG2 LYS 6 -15.938 17.686 -23.013 32 HG3 LYS 6 HG1 LYS 6 -17.285 18.653 -23.615 33 HD2 LYS 6 HD2 LYS 6 -15.866 20.660 -23.513 34 HD3 LYS 6 HD1 LYS 6 -14.521 19.668 -22.949 35 HE2 LYS 6 HE2 LYS 6 -14.539 18.411 -25.010 36 HE3 LYS 6 HE1 LYS 6 -15.958 19.292 -25.572 37 HZ1 LYS 6 HZ1 LYS 6 -13.958 20.142 -26.569 38 HZ2 LYS 6 HZ2 LYS 6 -13.278 20.461 -25.054 39 HZ3 LYS 6 HZ3 LYS 6 -14.642 21.318 -25.572 40 H GLY 7 HN GLY 7 -16.030 18.130 -19.114 41 HA2 GLY 7 HA2 GLY 7 -17.897 18.139 -16.913 42 HA3 GLY 7 HA1 GLY 7 -16.146 18.209 -16.795 43 H GLU 8 HN GLU 8 -18.897 20.152 -17.850 44 HA GLU 8 HA GLU 8 -17.441 22.588 -17.406 45 HB2 GLU 8 HB2 GLU 8 -20.366 22.182 -18.032 46 HB3 GLU 8 HB1 GLU 8 -19.513 23.718 -18.054 47 HG2 GLU 8 HG2 GLU 8 -19.101 21.373 -19.891 48 HG3 GLU 8 HG1 GLU 8 -19.756 22.958 -20.300 49 H LYS 9 HN LYS 9 -16.930 22.742 -15.316 50 HA LYS 9 HA LYS 9 -18.860 22.381 -13.203 51 HB2 LYS 9 HB2 LYS 9 -16.080 23.577 -13.144 52 HB3 LYS 9 HB1 LYS 9 -17.025 23.100 -11.742 53 HG2 LYS 9 HG2 LYS 9 -16.868 20.789 -12.347 54 HG3 LYS 9 HG1 LYS 9 -16.113 21.198 -13.888 55 HD2 LYS 9 HD2 LYS 9 -14.193 22.147 -12.676 56 HD3 LYS 9 HD1 LYS 9 -14.949 21.692 -11.147 57 HE2 LYS 9 HE2 LYS 9 -14.840 19.347 -11.761 58 HE3 LYS 9 HE1 LYS 9 -14.182 19.766 -13.340 59 HZ1 LYS 9 HZ1 LYS 9 -12.461 19.045 -11.803 60 HZ2 LYS 9 HZ2 LYS 9 -12.857 20.283 -10.731 61 HZ3 LYS 9 HZ3 LYS 9 -12.218 20.655 -12.251 62 H CYS 10 HN CYS 10 -17.878 24.831 -15.311 63 HA CYS 10 HA CYS 10 -18.576 27.016 -13.585 64 HB2 CYS 10 HB2 CYS 10 -17.758 26.949 -16.481 65 HB3 CYS 10 HB1 CYS 10 -18.004 28.414 -15.532 66 H THR 11 HN THR 11 -20.195 28.513 -13.963 67 HA THR 11 HA THR 11 -22.642 27.344 -14.909 68 HB THR 11 HB THR 11 -22.756 28.615 -12.859 69 HG1 THR 11 HG1 THR 11 -24.404 30.074 -13.404 70 HG21 THR 11 HG21 THR 11 -22.270 31.032 -12.781 71 HG22 THR 11 HG22 THR 11 -21.698 30.955 -14.447 72 HG23 THR 11 HG23 THR 11 -20.837 30.084 -13.178 73 H SER 12 HN SER 12 -24.118 28.705 -16.243 74 HA SER 12 HA SER 12 -23.165 29.115 -18.803 75 HB2 SER 12 HB2 SER 12 -25.536 30.487 -17.553 76 HB3 SER 12 HB1 SER 12 -25.328 30.061 -19.257 77 HG SER 12 HG SER 12 -25.918 28.071 -18.825 78 H ALA 13 HN ALA 13 -23.604 31.391 -16.149 79 HA ALA 13 HA ALA 13 -23.159 33.794 -17.485 80 HB1 ALA 13 HB1 ALA 13 -24.036 33.715 -15.229 81 HB2 ALA 13 HB2 ALA 13 -22.565 34.690 -15.258 82 HB3 ALA 13 HB3 ALA 13 -22.519 33.043 -14.636 83 H CYS 14 HN CYS 14 -20.846 31.616 -15.912 84 HA CYS 14 HA CYS 14 -18.578 33.246 -16.400 85 HB2 CYS 14 HB2 CYS 14 -18.682 31.518 -14.633 86 HB3 CYS 14 HB1 CYS 14 -18.716 30.276 -15.873 87 H ARG 15 HN ARG 15 -20.208 30.713 -18.144 88 HA ARG 15 HA ARG 15 -18.118 30.456 -20.127 89 HB2 ARG 15 HB2 ARG 15 -20.876 29.242 -19.993 90 HB3 ARG 15 HB1 ARG 15 -19.663 28.849 -21.201 91 HG2 ARG 15 HG2 ARG 15 -18.179 28.039 -19.405 92 HG3 ARG 15 HG1 ARG 15 -19.460 28.366 -18.236 93 HD2 ARG 15 HD2 ARG 15 -19.469 26.020 -18.849 94 HD3 ARG 15 HD1 ARG 15 -20.931 26.809 -19.440 95 HE ARG 15 HE ARG 15 -18.745 26.665 -21.330 96 HH11 ARG 15 HH11 ARG 15 -21.696 25.165 -20.148 97 HH12 ARG 15 HH12 ARG 15 -21.949 24.237 -21.579 98 HH21 ARG 15 HH21 ARG 15 -19.083 25.411 -23.234 99 HH22 ARG 15 HH22 ARG 15 -20.448 24.355 -23.331 100 H SER 16 HN SER 16 -19.931 32.962 -19.697 101 HA SER 16 HA SER 16 -20.878 33.236 -22.455 102 HB2 SER 16 HB2 SER 16 -21.367 34.948 -20.010 103 HB3 SER 16 HB1 SER 16 -22.011 35.288 -21.615 104 HG SER 16 HG SER 16 -22.477 32.870 -20.198 105 H GLU 17 HN GLU 17 -20.466 35.367 -23.516 106 HA GLU 17 HA GLU 17 -17.856 36.480 -22.744 107 HB2 GLU 17 HB2 GLU 17 -18.948 35.915 -25.499 108 HB3 GLU 17 HB1 GLU 17 -17.637 37.049 -25.237 109 HG2 GLU 17 HG2 GLU 17 -16.610 35.054 -25.872 110 HG3 GLU 17 HG1 GLU 17 -16.400 35.137 -24.128 111 HA PRO 18 HA PRO 18 -17.024 38.036 -21.978 112 HB2 PRO 18 HB2 PRO 18 -17.214 39.875 -20.046 113 HB3 PRO 18 HB1 PRO 18 -16.767 40.329 -21.696 114 HG2 PRO 18 HG2 PRO 18 -19.432 40.523 -20.340 115 HG3 PRO 18 HG1 PRO 18 -18.606 41.724 -21.349 116 HD2 PRO 18 HD2 PRO 18 -20.565 40.078 -22.283 117 HD3 PRO 18 HD1 PRO 18 -19.259 40.712 -23.304 118 H CYS 19 HN CYS 19 -16.591 37.493 -19.639 119 HA CYS 19 HA CYS 19 -18.456 35.608 -18.735 120 HB2 CYS 19 HB2 CYS 19 -16.096 35.395 -18.213 121 HB3 CYS 19 HB1 CYS 19 -16.150 36.879 -17.267 122 H GLN 20 HN GLN 20 -20.034 35.672 -17.307 123 HA GLN 20 HA GLN 20 -20.732 38.290 -16.143 124 HB2 GLN 20 HB2 GLN 20 -22.570 35.992 -16.806 125 HB3 GLN 20 HB1 GLN 20 -23.034 37.619 -16.330 126 HG2 GLN 20 HG2 GLN 20 -21.501 37.012 -18.832 127 HG3 GLN 20 HG1 GLN 20 -23.256 37.057 -18.753 128 HE21 GLN 20 HE21 GLN 20 -20.334 38.911 -18.587 129 HE22 GLN 20 HE22 GLN 20 -21.072 40.469 -18.744 130 H CYS 21 HN CYS 21 -19.025 36.066 -15.066 131 HA CYS 21 HA CYS 21 -20.563 34.768 -13.034 132 HB2 CYS 21 HB2 CYS 21 -18.198 34.222 -14.207 133 HB3 CYS 21 HB1 CYS 21 -17.629 35.052 -12.771 134 H GLY 22 HN GLY 22 -18.820 37.733 -13.405 135 HA2 GLY 22 HA2 GLY 22 -18.644 39.599 -12.122 136 HA3 GLY 22 HA1 GLY 22 -20.045 39.000 -11.252 137 H SER 23 HN SER 23 -19.381 39.633 -9.276 138 HA SER 23 HA SER 23 -16.847 38.615 -8.269 139 HB2 SER 23 HB2 SER 23 -18.877 40.401 -6.919 140 HB3 SER 23 HB1 SER 23 -17.237 40.064 -6.360 141 HG SER 23 HG SER 23 -17.790 41.209 -8.895 142 H LYS 24 HN LYS 24 -20.059 37.690 -8.472 143 HA LYS 24 HA LYS 24 -20.321 36.361 -5.952 144 HB2 LYS 24 HB2 LYS 24 -21.818 36.000 -8.558 145 HB3 LYS 24 HB1 LYS 24 -22.250 35.202 -7.054 146 HG2 LYS 24 HG2 LYS 24 -22.053 38.177 -7.108 147 HG3 LYS 24 HG1 LYS 24 -23.462 37.396 -7.819 148 HD2 LYS 24 HD2 LYS 24 -23.905 38.014 -5.499 149 HD3 LYS 24 HD1 LYS 24 -23.907 36.264 -5.676 150 HE2 LYS 24 HE2 LYS 24 -21.761 36.084 -4.670 151 HE3 LYS 24 HE1 LYS 24 -21.512 37.830 -4.728 152 HZ1 LYS 24 HZ1 LYS 24 -23.605 36.468 -3.124 153 HZ2 LYS 24 HZ2 LYS 24 -23.240 38.117 -3.104 154 HZ3 LYS 24 HZ3 LYS 24 -22.121 36.995 -2.514 155 H CYS 25 HN CYS 25 -19.455 35.439 -9.227 156 HA CYS 25 HA CYS 25 -18.308 33.710 -10.096 157 HB2 CYS 25 HB2 CYS 25 -16.735 34.796 -8.308 158 HB3 CYS 25 HB1 CYS 25 -16.982 33.279 -7.451 159 H GLN 26 HN GLN 26 -20.247 32.433 -10.247 160 HA GLN 26 HA GLN 26 -20.575 30.361 -8.192 161 HB2 GLN 26 HB2 GLN 26 -22.385 31.140 -10.476 162 HB3 GLN 26 HB1 GLN 26 -22.725 29.870 -9.312 163 HG2 GLN 26 HG2 GLN 26 -22.652 31.588 -7.518 164 HG3 GLN 26 HG1 GLN 26 -22.492 32.818 -8.772 165 HE21 GLN 26 HE21 GLN 26 -24.593 30.519 -7.270 166 HE22 GLN 26 HE22 GLN 26 -26.060 31.071 -8.000 167 H CYS 27 HN CYS 27 -18.552 30.504 -10.526 168 HA CYS 27 HA CYS 27 -19.297 28.141 -12.031 169 HB2 CYS 27 HB2 CYS 27 -17.303 28.555 -13.323 170 HB3 CYS 27 HB1 CYS 27 -18.168 30.072 -13.110 171 H GLY 28 HN GLY 28 -16.740 26.982 -12.362 172 HA2 GLY 28 HA2 GLY 28 -16.388 25.818 -9.681 173 HA3 GLY 28 HA1 GLY 28 -16.190 24.929 -11.183 174 H GLU 29 HN GLU 29 -14.328 25.215 -9.010 175 HA GLU 29 HA GLU 29 -12.253 27.008 -9.764 176 HB2 GLU 29 HB2 GLU 29 -12.301 24.596 -7.952 177 HB3 GLU 29 HB1 GLU 29 -10.882 25.610 -8.172 178 HG2 GLU 29 HG2 GLU 29 -13.503 26.757 -7.291 179 HG3 GLU 29 HG1 GLU 29 -12.378 26.032 -6.145 180 H GLY 30 HN GLY 30 -10.921 26.793 -11.407 181 HA2 GLY 30 HA2 GLY 30 -9.178 25.111 -12.228 182 HA3 GLY 30 HA1 GLY 30 -10.583 24.123 -12.593 183 H CYS 31 HN CYS 31 -11.638 27.153 -13.136 184 HA CYS 31 HA CYS 31 -11.205 26.863 -15.994 185 HB2 CYS 31 HB2 CYS 31 -12.974 28.373 -16.304 186 HB3 CYS 31 HB1 CYS 31 -13.448 27.460 -14.878 187 H THR 32 HN THR 32 -10.245 28.913 -13.348 188 HA THR 32 HA THR 32 -9.008 30.786 -13.151 189 HB THR 32 HB THR 32 -6.886 30.866 -14.504 190 HG1 THR 32 HG1 THR 32 -8.265 29.215 -16.111 191 HG21 THR 32 HG21 THR 32 -6.984 29.637 -12.401 192 HG22 THR 32 HG22 THR 32 -5.940 28.806 -13.555 193 HG23 THR 32 HG23 THR 32 -7.572 28.208 -13.249 194 H CYS 33 HN CYS 33 -11.328 31.186 -14.588 195 HA CYS 33 HA CYS 33 -11.087 32.546 -17.016 196 HB2 CYS 33 HB2 CYS 33 -13.184 31.687 -15.777 197 HB3 CYS 33 HB1 CYS 33 -13.132 33.211 -14.904 198 H ALA 34 HN ALA 34 -10.690 34.667 -17.517 199 HA ALA 34 HA ALA 34 -9.118 36.114 -15.571 200 HB1 ALA 34 HB1 ALA 34 -8.508 37.551 -17.441 201 HB2 ALA 34 HB2 ALA 34 -9.698 36.742 -18.459 202 HB3 ALA 34 HB3 ALA 34 -8.305 35.848 -17.851 203 H ALA 35 HN ALA 35 -12.094 35.971 -15.360 204 HA ALA 35 HA ALA 35 -12.547 38.864 -15.228 205 HB1 ALA 35 HB1 ALA 35 -14.904 38.507 -15.748 206 HB2 ALA 35 HB2 ALA 35 -14.605 36.777 -15.917 207 HB3 ALA 35 HB3 ALA 35 -13.874 37.912 -17.052 208 H CYS 36 HN CYS 36 -13.636 35.727 -14.037 209 HA CYS 36 HA CYS 36 -14.425 36.984 -11.549 210 HB2 CYS 36 HB2 CYS 36 -15.189 34.605 -11.031 211 HB3 CYS 36 HB1 CYS 36 -16.031 35.527 -12.270 212 H LYS 37 HN LYS 37 -12.230 34.513 -12.797 213 HA LYS 37 HA LYS 37 -11.003 34.041 -10.223 214 HB2 LYS 37 HB2 LYS 37 -10.846 32.828 -12.910 215 HB3 LYS 37 HB1 LYS 37 -9.353 32.800 -11.989 216 HG2 LYS 37 HG2 LYS 37 -10.639 30.750 -11.730 217 HG3 LYS 37 HG1 LYS 37 -10.447 31.601 -10.199 218 HD2 LYS 37 HD2 LYS 37 -12.708 32.469 -10.380 219 HD3 LYS 37 HD1 LYS 37 -12.897 31.692 -11.956 220 HE2 LYS 37 HE2 LYS 37 -12.800 29.534 -11.012 221 HE3 LYS 37 HE1 LYS 37 -12.217 30.153 -9.468 222 HZ1 LYS 37 HZ1 LYS 37 -14.386 31.292 -9.248 223 HZ2 LYS 37 HZ2 LYS 37 -14.493 29.607 -9.243 224 HZ3 LYS 37 HZ3 LYS 37 -14.913 30.479 -10.632 225 H THR 38 HN THR 38 -10.605 36.469 -10.269 226 HA THR 38 HA THR 38 -8.015 36.995 -11.536 227 HB THR 38 HB THR 38 -9.936 38.468 -12.249 228 HG1 THR 38 HG1 THR 38 -8.002 39.427 -12.562 229 HG21 THR 38 HG21 THR 38 -9.763 39.468 -9.398 230 HG22 THR 38 HG22 THR 38 -11.119 38.593 -10.108 231 HG23 THR 38 HG23 THR 38 -10.712 40.207 -10.689 232 H CYS 39 HN CYS 39 -6.873 38.822 -10.165 233 HA CYS 39 HA CYS 39 -7.083 38.198 -7.324 234 HB2 CYS 39 HB2 CYS 39 -5.288 36.776 -8.175 235 HB3 CYS 39 HB1 CYS 39 -4.519 38.166 -8.931 236 H ASN 40 HN ASN 40 -6.760 39.913 -6.042 237 HA ASN 40 HA ASN 40 -6.532 42.458 -7.475 238 HB2 ASN 40 HB2 ASN 40 -7.713 41.815 -4.773 239 HB3 ASN 40 HB1 ASN 40 -7.670 43.421 -5.503 240 HD21 ASN 40 HD21 ASN 40 -9.845 41.404 -4.795 241 HD22 ASN 40 HD22 ASN 40 -10.812 41.322 -6.222 242 H CYS 41 HN CYS 41 -4.477 40.510 -6.054 243 HA CYS 41 HA CYS 41 -3.159 42.360 -4.291 244 HB2 CYS 41 HB2 CYS 41 -2.229 39.705 -5.367 245 HB3 CYS 41 HB1 CYS 41 -1.489 40.612 -4.053 246 H THR 42 HN THR 42 -1.469 43.625 -4.745 247 HA THR 42 HA THR 42 -0.653 43.756 -7.548 248 HB THR 42 HB THR 42 0.196 46.022 -6.938 249 HG1 THR 42 HG1 THR 42 -0.993 46.598 -4.740 250 HG21 THR 42 HG21 THR 42 -2.062 45.753 -7.858 251 HG22 THR 42 HG22 THR 42 -2.009 47.071 -6.687 252 HG23 THR 42 HG23 THR 42 -2.696 45.511 -6.230 253 H SER 43 HN SER 43 1.672 44.432 -7.869 254 HA SER 43 HA SER 43 3.398 42.585 -6.585 255 HB2 SER 43 HB2 SER 43 4.100 44.973 -8.303 256 HB3 SER 43 HB1 SER 43 5.151 43.605 -7.937 257 HG SER 43 HG SER 43 3.241 42.364 -8.900 258 H ASP 44 HN ASP 44 2.373 45.760 -5.881 259 HA ASP 44 HA ASP 44 4.635 46.599 -4.342 260 HB2 ASP 44 HB2 ASP 44 1.792 47.627 -4.381 261 HB3 ASP 44 HB1 ASP 44 3.128 48.403 -3.543 262 H GLY 45 HN GLY 45 1.551 45.054 -3.666 263 HA2 GLY 45 HA2 GLY 45 2.547 44.056 -1.191 264 HA3 GLY 45 HA1 GLY 45 1.341 45.315 -0.974 265 H CYS 46 HN CYS 46 1.546 42.279 -0.639 266 HA CYS 46 HA CYS 46 -0.498 41.224 -2.319 267 HB2 CYS 46 HB2 CYS 46 1.387 39.969 -1.083 268 HB3 CYS 46 HB1 CYS 46 0.352 40.084 0.335 269 H LYS 47 HN LYS 47 -2.667 41.268 -2.006 270 HA LYS 47 HA LYS 47 -3.615 42.894 0.195 271 HB2 LYS 47 HB2 LYS 47 -5.097 41.759 -2.175 272 HB3 LYS 47 HB1 LYS 47 -5.785 42.849 -0.979 273 HG2 LYS 47 HG2 LYS 47 -3.488 43.485 -2.819 274 HG3 LYS 47 HG1 LYS 47 -5.154 44.034 -3.015 275 HD2 LYS 47 HD2 LYS 47 -4.990 45.252 -0.899 276 HD3 LYS 47 HD1 LYS 47 -3.331 44.681 -0.697 277 HE2 LYS 47 HE2 LYS 47 -2.713 45.817 -2.793 278 HE3 LYS 47 HE1 LYS 47 -4.360 46.431 -2.926 279 HZ1 LYS 47 HZ1 LYS 47 -2.868 48.070 -1.981 280 HZ2 LYS 47 HZ2 LYS 47 -2.472 47.024 -0.713 281 HZ3 LYS 47 HZ3 LYS 47 -4.047 47.622 -0.853 282 H CYS 48 HN CYS 48 -3.613 39.546 -0.706 283 HA CYS 48 HA CYS 48 -5.576 38.990 1.387 284 HB2 CYS 48 HB2 CYS 48 -5.691 36.766 0.509 285 HB3 CYS 48 HB1 CYS 48 -5.740 37.882 -0.859 286 H GLY 49 HN GLY 49 -2.199 38.456 0.547 287 HA2 GLY 49 HA2 GLY 49 -0.567 38.505 2.319 288 HA3 GLY 49 HA1 GLY 49 -1.735 37.698 3.354 289 H LYS 50 HN LYS 50 -1.880 36.304 0.320 290 HA LYS 50 HA LYS 50 -0.431 33.971 1.246 291 HB2 LYS 50 HB2 LYS 50 -1.883 34.439 -1.367 292 HB3 LYS 50 HB1 LYS 50 -1.260 32.896 -0.805 293 HG2 LYS 50 HG2 LYS 50 -3.440 34.505 0.512 294 HG3 LYS 50 HG1 LYS 50 -3.666 33.060 -0.473 295 HD2 LYS 50 HD2 LYS 50 -2.403 31.748 1.148 296 HD3 LYS 50 HD1 LYS 50 -2.129 33.197 2.118 297 HE2 LYS 50 HE2 LYS 50 -4.531 33.422 2.471 298 HE3 LYS 50 HE1 LYS 50 -4.817 31.994 1.478 299 HZ1 LYS 50 HZ1 LYS 50 -4.861 31.550 3.882 300 HZ2 LYS 50 HZ2 LYS 50 -3.230 31.986 3.987 301 HZ3 LYS 50 HZ3 LYS 50 -3.687 30.648 3.072 302 H GLU 51 HN GLU 51 0.439 36.753 -0.200 303 HA GLU 51 HA GLU 51 2.333 37.524 -1.134 304 HB2 GLU 51 HB2 GLU 51 3.397 34.742 -0.618 305 HB3 GLU 51 HB1 GLU 51 4.374 36.124 -1.093 306 HG2 GLU 51 HG2 GLU 51 3.700 37.292 0.959 307 HG3 GLU 51 HG1 GLU 51 2.764 35.881 1.441 308 H CYS 52 HN CYS 52 0.210 36.141 -2.688 309 HA CYS 52 HA CYS 52 1.475 35.010 -4.983 310 HB2 CYS 52 HB2 CYS 52 -0.874 35.512 -5.972 311 HB3 CYS 52 HB1 CYS 52 -0.726 34.295 -4.705 312 H THR 53 HN THR 53 0.021 38.127 -4.203 313 HA THR 53 HA THR 53 0.184 40.207 -5.062 314 HB THR 53 HB THR 53 2.458 40.960 -5.789 315 HG1 THR 53 HG1 THR 53 2.820 38.376 -6.233 316 HG21 THR 53 HG21 THR 53 3.512 40.591 -3.604 317 HG22 THR 53 HG22 THR 53 2.330 39.326 -3.258 318 HG23 THR 53 HG23 THR 53 1.802 40.999 -3.446 319 H GLY 54 HN GLY 54 -0.932 38.294 -6.893 320 HA2 GLY 54 HA2 GLY 54 -1.418 39.758 -9.089 321 HA3 GLY 54 HA1 GLY 54 0.119 39.000 -9.487 322 HA PRO 55 HA PRO 55 -3.802 36.144 -9.898 323 HB2 PRO 55 HB2 PRO 55 -4.420 36.594 -12.536 324 HB3 PRO 55 HB1 PRO 55 -5.242 37.357 -11.172 325 HG2 PRO 55 HG2 PRO 55 -3.081 38.438 -12.931 326 HG3 PRO 55 HG1 PRO 55 -4.509 39.261 -12.279 327 HD2 PRO 55 HD2 PRO 55 -2.051 39.591 -11.225 328 HD3 PRO 55 HD1 PRO 55 -3.516 39.616 -10.223 329 H ASP 56 HN ASP 56 -1.329 37.032 -12.243 330 HA ASP 56 HA ASP 56 -1.150 34.497 -13.499 331 HB2 ASP 56 HB2 ASP 56 0.866 36.746 -13.344 332 HB3 ASP 56 HB1 ASP 56 0.983 35.359 -14.421 333 H SER 57 HN SER 57 -0.115 35.613 -10.484 334 HA SER 57 HA SER 57 1.687 33.305 -10.187 335 HB2 SER 57 HB2 SER 57 1.955 35.943 -8.729 336 HB3 SER 57 HB1 SER 57 3.107 34.608 -8.754 337 HG SER 57 HG SER 57 3.224 36.641 -10.271 338 H CYS 58 HN CYS 58 -1.251 33.765 -9.647 339 HA CYS 58 HA CYS 58 -1.474 33.866 -6.794 340 HB2 CYS 58 HB2 CYS 58 -3.096 34.817 -8.573 341 HB3 CYS 58 HB1 CYS 58 -3.686 33.163 -8.688 342 H LYS 59 HN LYS 59 -1.912 32.193 -5.466 343 HA LYS 59 HA LYS 59 -1.832 29.506 -6.675 344 HB2 LYS 59 HB2 LYS 59 -0.526 30.395 -4.107 345 HB3 LYS 59 HB1 LYS 59 -0.469 28.778 -4.794 346 HG2 LYS 59 HG2 LYS 59 0.889 29.477 -6.587 347 HG3 LYS 59 HG1 LYS 59 0.582 31.182 -6.251 348 HD2 LYS 59 HD2 LYS 59 1.761 30.982 -4.139 349 HD3 LYS 59 HD1 LYS 59 2.074 29.274 -4.462 350 HE2 LYS 59 HE2 LYS 59 3.376 29.888 -6.433 351 HE3 LYS 59 HE1 LYS 59 3.031 31.591 -6.138 352 HZ1 LYS 59 HZ1 LYS 59 5.209 31.012 -5.325 353 HZ2 LYS 59 HZ2 LYS 59 4.573 29.787 -4.350 354 HZ3 LYS 59 HZ3 LYS 59 4.208 31.405 -4.019 355 H CYS 60 HN CYS 60 -3.652 31.612 -4.901 356 HA CYS 60 HA CYS 60 -4.800 29.470 -3.257 357 HB2 CYS 60 HB2 CYS 60 -5.981 31.505 -2.125 358 HB3 CYS 60 HB1 CYS 60 -4.300 31.144 -1.758 359 H GLY 61 HN GLY 61 -7.111 29.363 -2.990 360 HA2 GLY 61 HA2 GLY 61 -8.366 29.232 -5.543 361 HA3 GLY 61 HA1 GLY 61 -9.095 28.820 -4.005 362 H SER 62 HN SER 62 -10.873 29.799 -5.423 363 HA SER 62 HA SER 62 -10.912 32.645 -5.709 364 HB2 SER 62 HB2 SER 62 -13.103 30.615 -6.098 365 HB3 SER 62 HB1 SER 62 -13.150 32.301 -6.617 366 HG SER 62 HG SER 62 -11.675 30.146 -7.639 367 H SER 63 HN SER 63 -11.583 30.623 -3.083 368 HA SER 63 HA SER 63 -13.593 32.412 -1.973 369 HB2 SER 63 HB2 SER 63 -12.271 29.989 -0.727 370 HB3 SER 63 HB1 SER 63 -13.668 30.855 -0.089 371 HG SER 63 HG SER 63 -13.948 30.056 -2.699 372 H CYS 64 HN CYS 64 -10.682 33.141 -2.532 373 HA CYS 64 HA CYS 64 -9.793 33.728 0.177 374 HB2 CYS 64 HB2 CYS 64 -8.231 32.705 -1.479 375 HB3 CYS 64 HB1 CYS 64 -8.341 34.182 -2.427 376 H SER 65 HN SER 65 -8.781 35.933 0.468 377 HA SER 65 HA SER 65 -10.796 37.874 0.098 378 HB2 SER 65 HB2 SER 65 -7.944 38.218 1.026 379 HB3 SER 65 HB1 SER 65 -9.223 39.424 1.182 380 HG SER 65 HG SER 65 -9.511 36.811 2.231 381 H CYS 66 HN CYS 66 -7.901 37.137 -1.754 382 HA CYS 66 HA CYS 66 -7.917 39.680 -3.120 383 HB2 CYS 66 HB2 CYS 66 -6.137 38.670 -4.520 384 HB3 CYS 66 HB1 CYS 66 -5.795 38.570 -2.798 385 H LYS 67 HN LYS 67 -10.041 37.310 -3.257 386 HA LYS 67 HA LYS 67 -10.318 37.294 -6.187 387 HB2 LYS 67 HB2 LYS 67 -11.633 35.459 -4.188 388 HB3 LYS 67 HB1 LYS 67 -11.575 35.271 -5.935 389 HG2 LYS 67 HG2 LYS 67 -9.084 35.318 -4.275 390 HG3 LYS 67 HG1 LYS 67 -9.997 33.834 -4.529 391 HD2 LYS 67 HD2 LYS 67 -9.284 33.633 -6.658 392 HD3 LYS 67 HD1 LYS 67 -9.440 35.362 -6.972 393 HE2 LYS 67 HE2 LYS 67 -7.115 34.679 -7.124 394 HE3 LYS 67 HE1 LYS 67 -7.373 35.765 -5.760 395 HZ1 LYS 67 HZ1 LYS 67 -5.935 33.991 -5.124 396 HZ2 LYS 67 HZ2 LYS 67 -7.050 32.815 -5.611 397 HZ3 LYS 67 HZ3 LYS 67 -7.397 33.825 -4.297 Start of MODEL 2 1 HA2 GLY 1 HA1 GLY 1 -7.349 18.694 -4.447 2 HA3 GLY 1 HA2 GLY 1 -8.793 19.555 -3.936 3 H SER 2 HN SER 2 -5.377 20.516 -4.059 4 HA SER 2 HA SER 2 -6.097 23.065 -5.168 5 HB2 SER 2 HB2 SER 2 -4.257 22.820 -3.522 6 HB3 SER 2 HB1 SER 2 -3.355 21.864 -4.697 7 HG SER 2 HG SER 2 -3.012 24.293 -4.464 8 H GLY 3 HN GLY 3 -6.755 23.065 -7.235 9 HA2 GLY 3 HA2 GLY 3 -6.566 22.997 -9.522 10 HA3 GLY 3 HA1 GLY 3 -4.877 22.561 -9.309 11 H LYS 4 HN LYS 4 -7.767 20.872 -8.212 12 HA LYS 4 HA LYS 4 -6.781 18.487 -9.573 13 HB2 LYS 4 HB2 LYS 4 -8.643 18.926 -7.273 14 HB3 LYS 4 HB1 LYS 4 -8.715 17.421 -8.178 15 HG2 LYS 4 HG2 LYS 4 -6.207 18.491 -6.907 16 HG3 LYS 4 HG1 LYS 4 -7.298 17.339 -6.134 17 HD2 LYS 4 HD2 LYS 4 -6.928 15.744 -7.936 18 HD3 LYS 4 HD1 LYS 4 -5.896 16.901 -8.774 19 HE2 LYS 4 HE2 LYS 4 -5.341 15.794 -6.029 20 HE3 LYS 4 HE1 LYS 4 -4.649 15.155 -7.518 21 HZ1 LYS 4 HZ1 LYS 4 -3.155 16.685 -6.393 22 HZ2 LYS 4 HZ2 LYS 4 -4.289 17.925 -6.510 23 HZ3 LYS 4 HZ3 LYS 4 -3.593 17.274 -7.912 24 H GLY 5 HN GLY 5 -8.805 16.967 -10.099 25 HA2 GLY 5 HA2 GLY 5 -10.007 18.272 -12.352 26 HA3 GLY 5 HA1 GLY 5 -10.155 16.580 -11.914 27 H LYS 6 HN LYS 6 -11.341 19.796 -11.286 28 HA LYS 6 HA LYS 6 -13.687 18.710 -9.938 29 HB2 LYS 6 HB2 LYS 6 -12.836 21.569 -10.463 30 HB3 LYS 6 HB1 LYS 6 -14.287 21.103 -9.587 31 HG2 LYS 6 HG2 LYS 6 -12.882 19.974 -7.906 32 HG3 LYS 6 HG1 LYS 6 -11.446 20.517 -8.771 33 HD2 LYS 6 HD2 LYS 6 -11.885 21.987 -6.892 34 HD3 LYS 6 HD1 LYS 6 -12.143 22.858 -8.404 35 HE2 LYS 6 HE2 LYS 6 -14.532 22.625 -8.190 36 HE3 LYS 6 HE1 LYS 6 -14.344 21.581 -6.782 37 HZ1 LYS 6 HZ1 LYS 6 -13.539 24.449 -6.919 38 HZ2 LYS 6 HZ2 LYS 6 -13.404 23.437 -5.570 39 HZ3 LYS 6 HZ3 LYS 6 -14.930 23.846 -6.160 40 H GLY 7 HN GLY 7 -12.599 19.438 -12.989 41 HA2 GLY 7 HA2 GLY 7 -13.768 18.979 -14.961 42 HA3 GLY 7 HA1 GLY 7 -15.281 19.133 -14.075 43 H GLU 8 HN GLU 8 -16.282 21.038 -13.979 44 HA GLU 8 HA GLU 8 -14.941 23.415 -15.006 45 HB2 GLU 8 HB2 GLU 8 -16.082 22.293 -16.922 46 HB3 GLU 8 HB1 GLU 8 -17.599 22.425 -16.045 47 HG2 GLU 8 HG2 GLU 8 -17.212 24.912 -16.015 48 HG3 GLU 8 HG1 GLU 8 -15.919 24.624 -17.179 49 H LYS 9 HN LYS 9 -18.224 22.334 -14.213 50 HA LYS 9 HA LYS 9 -19.820 23.094 -12.813 51 HB2 LYS 9 HB2 LYS 9 -17.453 23.941 -11.132 52 HB3 LYS 9 HB1 LYS 9 -19.113 23.857 -10.567 53 HG2 LYS 9 HG2 LYS 9 -17.377 21.555 -11.450 54 HG3 LYS 9 HG1 LYS 9 -17.925 21.910 -9.813 55 HD2 LYS 9 HD2 LYS 9 -19.689 21.148 -12.150 56 HD3 LYS 9 HD1 LYS 9 -19.228 20.092 -10.817 57 HE2 LYS 9 HE2 LYS 9 -20.406 21.509 -9.244 58 HE3 LYS 9 HE1 LYS 9 -20.787 22.660 -10.524 59 HZ1 LYS 9 HZ1 LYS 9 -21.778 19.870 -10.307 60 HZ2 LYS 9 HZ2 LYS 9 -22.055 20.878 -11.627 61 HZ3 LYS 9 HZ3 LYS 9 -22.686 21.284 -10.117 62 H CYS 10 HN CYS 10 -18.979 24.805 -14.917 63 HA CYS 10 HA CYS 10 -19.095 27.457 -13.773 64 HB2 CYS 10 HB2 CYS 10 -18.680 26.536 -16.603 65 HB3 CYS 10 HB1 CYS 10 -18.773 28.228 -16.119 66 H THR 11 HN THR 11 -20.684 28.866 -14.003 67 HA THR 11 HA THR 11 -23.244 27.754 -14.768 68 HB THR 11 HB THR 11 -24.178 29.714 -13.619 69 HG1 THR 11 HG1 THR 11 -22.897 31.320 -12.890 70 HG21 THR 11 HG21 THR 11 -23.623 27.711 -12.305 71 HG22 THR 11 HG22 THR 11 -23.397 29.178 -11.355 72 HG23 THR 11 HG23 THR 11 -21.998 28.342 -12.032 73 H SER 12 HN SER 12 -24.741 29.680 -15.651 74 HA SER 12 HA SER 12 -23.915 30.115 -18.300 75 HB2 SER 12 HB2 SER 12 -26.148 31.500 -16.810 76 HB3 SER 12 HB1 SER 12 -26.006 31.292 -18.556 77 HG SER 12 HG SER 12 -26.720 29.323 -18.383 78 H ALA 13 HN ALA 13 -23.595 32.006 -15.408 79 HA ALA 13 HA ALA 13 -23.172 34.527 -16.594 80 HB1 ALA 13 HB1 ALA 13 -22.198 35.158 -14.446 81 HB2 ALA 13 HB2 ALA 13 -22.132 33.461 -13.970 82 HB3 ALA 13 HB3 ALA 13 -23.692 34.247 -14.221 83 H CYS 14 HN CYS 14 -20.952 31.931 -15.655 84 HA CYS 14 HA CYS 14 -18.616 33.382 -16.437 85 HB2 CYS 14 HB2 CYS 14 -18.570 31.620 -14.713 86 HB3 CYS 14 HB1 CYS 14 -18.955 30.424 -15.941 87 H ARG 15 HN ARG 15 -20.764 31.101 -17.958 88 HA ARG 15 HA ARG 15 -19.014 30.668 -20.201 89 HB2 ARG 15 HB2 ARG 15 -20.816 29.065 -19.230 90 HB3 ARG 15 HB1 ARG 15 -21.932 29.992 -20.223 91 HG2 ARG 15 HG2 ARG 15 -20.634 29.440 -22.212 92 HG3 ARG 15 HG1 ARG 15 -19.499 28.521 -21.222 93 HD2 ARG 15 HD2 ARG 15 -22.379 27.917 -21.822 94 HD3 ARG 15 HD1 ARG 15 -20.958 26.926 -22.146 95 HE ARG 15 HE ARG 15 -22.413 27.149 -19.666 96 HH11 ARG 15 HH11 ARG 15 -19.397 26.149 -21.159 97 HH12 ARG 15 HH12 ARG 15 -18.956 25.101 -19.851 98 HH21 ARG 15 HH21 ARG 15 -21.835 25.739 -17.960 99 HH22 ARG 15 HH22 ARG 15 -20.347 24.844 -18.054 100 H SER 16 HN SER 16 -20.734 33.277 -19.322 101 HA SER 16 HA SER 16 -21.756 33.950 -21.948 102 HB2 SER 16 HB2 SER 16 -23.013 34.552 -19.860 103 HB3 SER 16 HB1 SER 16 -21.691 35.640 -19.438 104 HG SER 16 HG SER 16 -23.766 36.074 -21.073 105 H GLU 17 HN GLU 17 -21.132 36.056 -22.886 106 HA GLU 17 HA GLU 17 -18.383 36.842 -22.255 107 HB2 GLU 17 HB2 GLU 17 -19.418 36.317 -25.050 108 HB3 GLU 17 HB1 GLU 17 -17.833 36.957 -24.650 109 HG2 GLU 17 HG2 GLU 17 -17.381 34.836 -23.409 110 HG3 GLU 17 HG1 GLU 17 -18.897 34.210 -24.054 111 HA PRO 18 HA PRO 18 -17.198 38.509 -21.933 112 HB2 PRO 18 HB2 PRO 18 -17.346 40.415 -20.000 113 HB3 PRO 18 HB1 PRO 18 -16.814 40.762 -21.650 114 HG2 PRO 18 HG2 PRO 18 -19.508 41.169 -20.407 115 HG3 PRO 18 HG1 PRO 18 -18.584 42.264 -21.451 116 HD2 PRO 18 HD2 PRO 18 -20.601 40.754 -22.399 117 HD3 PRO 18 HD1 PRO 18 -19.164 41.123 -23.374 118 H CYS 19 HN CYS 19 -16.595 37.916 -19.708 119 HA CYS 19 HA CYS 19 -18.365 36.035 -18.633 120 HB2 CYS 19 HB2 CYS 19 -15.773 36.206 -18.543 121 HB3 CYS 19 HB1 CYS 19 -16.053 37.175 -17.101 122 H GLN 20 HN GLN 20 -19.799 36.110 -16.985 123 HA GLN 20 HA GLN 20 -20.305 38.772 -15.812 124 HB2 GLN 20 HB2 GLN 20 -22.249 36.535 -16.331 125 HB3 GLN 20 HB1 GLN 20 -22.637 38.142 -15.729 126 HG2 GLN 20 HG2 GLN 20 -21.384 37.587 -18.394 127 HG3 GLN 20 HG1 GLN 20 -23.108 37.796 -18.116 128 HE21 GLN 20 HE21 GLN 20 -21.111 39.347 -19.659 129 HE22 GLN 20 HE22 GLN 20 -21.275 40.977 -19.092 130 H CYS 21 HN CYS 21 -18.715 36.334 -14.777 131 HA CYS 21 HA CYS 21 -20.187 35.357 -12.561 132 HB2 CYS 21 HB2 CYS 21 -17.407 35.188 -13.472 133 HB3 CYS 21 HB1 CYS 21 -17.606 35.064 -11.728 134 H GLY 22 HN GLY 22 -18.228 38.199 -13.012 135 HA2 GLY 22 HA2 GLY 22 -17.994 40.100 -11.768 136 HA3 GLY 22 HA1 GLY 22 -19.493 39.638 -10.988 137 H SER 23 HN SER 23 -19.125 40.043 -8.919 138 HA SER 23 HA SER 23 -16.581 39.331 -7.689 139 HB2 SER 23 HB2 SER 23 -18.949 40.780 -6.487 140 HB3 SER 23 HB1 SER 23 -17.325 40.667 -5.807 141 HG SER 23 HG SER 23 -16.908 42.396 -6.916 142 H LYS 24 HN LYS 24 -19.569 37.913 -8.183 143 HA LYS 24 HA LYS 24 -19.624 36.504 -5.649 144 HB2 LYS 24 HB2 LYS 24 -21.380 36.334 -8.094 145 HB3 LYS 24 HB1 LYS 24 -21.590 35.327 -6.670 146 HG2 LYS 24 HG2 LYS 24 -21.956 37.343 -5.320 147 HG3 LYS 24 HG1 LYS 24 -21.791 38.327 -6.774 148 HD2 LYS 24 HD2 LYS 24 -23.712 37.258 -7.765 149 HD3 LYS 24 HD1 LYS 24 -23.839 36.152 -6.397 150 HE2 LYS 24 HE2 LYS 24 -24.290 38.037 -4.912 151 HE3 LYS 24 HE1 LYS 24 -24.147 39.149 -6.273 152 HZ1 LYS 24 HZ1 LYS 24 -26.173 36.996 -6.001 153 HZ2 LYS 24 HZ2 LYS 24 -26.031 38.062 -7.310 154 HZ3 LYS 24 HZ3 LYS 24 -26.449 38.651 -5.787 155 H CYS 25 HN CYS 25 -19.238 35.791 -9.072 156 HA CYS 25 HA CYS 25 -18.319 34.085 -10.204 157 HB2 CYS 25 HB2 CYS 25 -16.363 34.856 -8.704 158 HB3 CYS 25 HB1 CYS 25 -16.685 33.390 -7.782 159 H GLN 26 HN GLN 26 -20.004 32.807 -10.474 160 HA GLN 26 HA GLN 26 -20.991 31.126 -8.342 161 HB2 GLN 26 HB2 GLN 26 -21.926 31.312 -11.195 162 HB3 GLN 26 HB1 GLN 26 -22.793 30.594 -9.846 163 HG2 GLN 26 HG2 GLN 26 -23.116 32.714 -8.823 164 HG3 GLN 26 HG1 GLN 26 -22.028 33.494 -9.970 165 HE21 GLN 26 HE21 GLN 26 -24.807 34.070 -9.356 166 HE22 GLN 26 HE22 GLN 26 -25.659 33.950 -10.857 167 H CYS 27 HN CYS 27 -18.599 30.735 -10.651 168 HA CYS 27 HA CYS 27 -19.178 27.884 -11.005 169 HB2 CYS 27 HB2 CYS 27 -17.567 27.915 -12.781 170 HB3 CYS 27 HB1 CYS 27 -18.683 29.264 -13.006 171 H GLY 28 HN GLY 28 -16.920 26.692 -11.323 172 HA2 GLY 28 HA2 GLY 28 -15.520 26.997 -8.755 173 HA3 GLY 28 HA1 GLY 28 -15.522 25.549 -9.754 174 H GLU 29 HN GLU 29 -13.275 25.373 -9.795 175 HA GLU 29 HA GLU 29 -11.839 27.534 -11.174 176 HB2 GLU 29 HB2 GLU 29 -10.481 25.261 -9.745 177 HB3 GLU 29 HB1 GLU 29 -9.833 26.839 -10.147 178 HG2 GLU 29 HG2 GLU 29 -10.117 27.026 -7.892 179 HG3 GLU 29 HG1 GLU 29 -11.639 27.693 -8.479 180 H GLY 30 HN GLY 30 -13.483 25.258 -12.228 181 HA2 GLY 30 HA2 GLY 30 -11.546 23.574 -13.579 182 HA3 GLY 30 HA1 GLY 30 -13.292 23.486 -13.747 183 H CYS 31 HN CYS 31 -12.834 26.606 -14.152 184 HA CYS 31 HA CYS 31 -12.773 26.348 -17.049 185 HB2 CYS 31 HB2 CYS 31 -13.632 28.629 -17.068 186 HB3 CYS 31 HB1 CYS 31 -14.605 27.610 -16.012 187 H THR 32 HN THR 32 -10.895 27.636 -14.416 188 HA THR 32 HA THR 32 -9.106 29.011 -14.268 189 HB THR 32 HB THR 32 -7.204 28.495 -15.846 190 HG1 THR 32 HG1 THR 32 -9.207 27.470 -17.330 191 HG21 THR 32 HG21 THR 32 -7.527 27.213 -13.794 192 HG22 THR 32 HG22 THR 32 -6.901 26.185 -15.083 193 HG23 THR 32 HG23 THR 32 -8.610 26.113 -14.646 194 H CYS 33 HN CYS 33 -11.248 30.237 -15.305 195 HA CYS 33 HA CYS 33 -11.035 31.539 -17.746 196 HB2 CYS 33 HB2 CYS 33 -12.872 31.398 -15.730 197 HB3 CYS 33 HB1 CYS 33 -12.301 33.053 -15.560 198 H ALA 34 HN ALA 34 -10.627 33.830 -18.133 199 HA ALA 34 HA ALA 34 -8.299 34.750 -16.595 200 HB1 ALA 34 HB1 ALA 34 -7.700 36.024 -18.587 201 HB2 ALA 34 HB2 ALA 34 -9.172 35.480 -19.390 202 HB3 ALA 34 HB3 ALA 34 -7.912 34.318 -18.976 203 H ALA 35 HN ALA 35 -11.362 35.159 -16.291 204 HA ALA 35 HA ALA 35 -11.228 38.084 -16.012 205 HB1 ALA 35 HB1 ALA 35 -12.767 37.444 -17.805 206 HB2 ALA 35 HB2 ALA 35 -13.623 38.194 -16.457 207 HB3 ALA 35 HB3 ALA 35 -13.674 36.444 -16.670 208 H CYS 36 HN CYS 36 -13.281 35.384 -14.845 209 HA CYS 36 HA CYS 36 -13.593 36.739 -12.330 210 HB2 CYS 36 HB2 CYS 36 -14.963 34.736 -11.728 211 HB3 CYS 36 HB1 CYS 36 -15.502 35.608 -13.158 212 H LYS 37 HN LYS 37 -11.564 34.256 -13.625 213 HA LYS 37 HA LYS 37 -10.736 33.359 -10.985 214 HB2 LYS 37 HB2 LYS 37 -9.925 32.407 -13.732 215 HB3 LYS 37 HB1 LYS 37 -9.304 31.739 -12.234 216 HG2 LYS 37 HG2 LYS 37 -12.198 31.705 -13.067 217 HG3 LYS 37 HG1 LYS 37 -11.066 30.368 -13.275 218 HD2 LYS 37 HD2 LYS 37 -11.784 29.685 -11.267 219 HD3 LYS 37 HD1 LYS 37 -10.786 30.987 -10.615 220 HE2 LYS 37 HE2 LYS 37 -13.019 31.095 -9.686 221 HE3 LYS 37 HE1 LYS 37 -12.723 32.492 -10.719 222 HZ1 LYS 37 HZ1 LYS 37 -13.974 31.411 -12.486 223 HZ2 LYS 37 HZ2 LYS 37 -14.913 31.542 -11.096 224 HZ3 LYS 37 HZ3 LYS 37 -14.230 30.055 -11.509 225 H THR 38 HN THR 38 -10.008 35.828 -10.942 226 HA THR 38 HA THR 38 -7.145 35.775 -11.596 227 HB THR 38 HB THR 38 -8.396 37.291 -13.158 228 HG1 THR 38 HG1 THR 38 -6.901 38.969 -12.934 229 HG21 THR 38 HG21 THR 38 -8.912 38.886 -10.639 230 HG22 THR 38 HG22 THR 38 -10.132 38.071 -11.618 231 HG23 THR 38 HG23 THR 38 -9.234 39.435 -12.284 232 H CYS 39 HN CYS 39 -5.838 37.213 -10.240 233 HA CYS 39 HA CYS 39 -6.791 37.153 -7.483 234 HB2 CYS 39 HB2 CYS 39 -4.604 36.141 -7.921 235 HB3 CYS 39 HB1 CYS 39 -4.029 37.650 -8.618 236 H ASN 40 HN ASN 40 -6.989 38.964 -6.229 237 HA ASN 40 HA ASN 40 -7.111 41.453 -7.752 238 HB2 ASN 40 HB2 ASN 40 -8.360 40.582 -5.156 239 HB3 ASN 40 HB1 ASN 40 -8.372 42.265 -5.678 240 HD21 ASN 40 HD21 ASN 40 -9.486 39.027 -6.421 241 HD22 ASN 40 HD22 ASN 40 -10.757 39.512 -7.491 242 H CYS 41 HN CYS 41 -4.891 39.935 -5.928 243 HA CYS 41 HA CYS 41 -3.952 42.183 -4.400 244 HB2 CYS 41 HB2 CYS 41 -2.599 39.563 -5.050 245 HB3 CYS 41 HB1 CYS 41 -2.076 40.726 -3.837 246 H THR 42 HN THR 42 -2.385 43.600 -4.975 247 HA THR 42 HA THR 42 -1.488 43.439 -7.751 248 HB THR 42 HB THR 42 -0.972 45.856 -7.506 249 HG1 THR 42 HG1 THR 42 -2.348 46.490 -5.367 250 HG21 THR 42 HG21 THR 42 -3.153 45.173 -8.368 251 HG22 THR 42 HG22 THR 42 -3.312 46.629 -7.383 252 HG23 THR 42 HG23 THR 42 -3.777 45.060 -6.722 253 H SER 43 HN SER 43 0.713 44.352 -8.159 254 HA SER 43 HA SER 43 2.642 42.945 -6.621 255 HB2 SER 43 HB2 SER 43 3.040 45.023 -8.784 256 HB3 SER 43 HB1 SER 43 4.262 43.898 -8.187 257 HG SER 43 HG SER 43 1.828 43.199 -9.498 258 H ASP 44 HN ASP 44 1.206 45.987 -6.341 259 HA ASP 44 HA ASP 44 3.400 47.304 -5.019 260 HB2 ASP 44 HB2 ASP 44 1.807 48.653 -6.267 261 HB3 ASP 44 HB1 ASP 44 0.479 48.048 -5.283 262 H GLY 45 HN GLY 45 0.515 45.529 -4.115 263 HA2 GLY 45 HA2 GLY 45 1.547 45.036 -1.506 264 HA3 GLY 45 HA1 GLY 45 0.209 46.177 -1.479 265 H CYS 46 HN CYS 46 0.816 43.148 -0.849 266 HA CYS 46 HA CYS 46 -1.112 41.698 -2.328 267 HB2 CYS 46 HB2 CYS 46 0.823 40.741 -1.005 268 HB3 CYS 46 HB1 CYS 46 -0.109 41.070 0.450 269 H LYS 47 HN LYS 47 -3.266 41.396 -1.989 270 HA LYS 47 HA LYS 47 -4.503 43.185 -0.053 271 HB2 LYS 47 HB2 LYS 47 -5.665 41.654 -2.376 272 HB3 LYS 47 HB1 LYS 47 -6.613 42.662 -1.295 273 HG2 LYS 47 HG2 LYS 47 -4.322 43.643 -2.993 274 HG3 LYS 47 HG1 LYS 47 -6.027 43.776 -3.423 275 HD2 LYS 47 HD2 LYS 47 -4.763 44.985 -0.957 276 HD3 LYS 47 HD1 LYS 47 -5.092 45.857 -2.453 277 HE2 LYS 47 HE2 LYS 47 -7.482 45.394 -2.202 278 HE3 LYS 47 HE1 LYS 47 -7.159 44.512 -0.711 279 HZ1 LYS 47 HZ1 LYS 47 -6.313 46.559 0.264 280 HZ2 LYS 47 HZ2 LYS 47 -7.906 46.755 -0.266 281 HZ3 LYS 47 HZ3 LYS 47 -6.638 47.395 -1.172 282 H CYS 48 HN CYS 48 -4.201 39.747 -0.677 283 HA CYS 48 HA CYS 48 -6.179 39.190 1.388 284 HB2 CYS 48 HB2 CYS 48 -6.043 36.905 0.743 285 HB3 CYS 48 HB1 CYS 48 -6.014 37.842 -0.753 286 H GLY 49 HN GLY 49 -2.711 38.881 0.821 287 HA2 GLY 49 HA2 GLY 49 -1.265 39.328 2.742 288 HA3 GLY 49 HA1 GLY 49 -2.388 38.391 3.714 289 H LYS 50 HN LYS 50 -2.066 36.879 0.756 290 HA LYS 50 HA LYS 50 -0.350 34.860 1.934 291 HB2 LYS 50 HB2 LYS 50 -1.808 34.937 -0.706 292 HB3 LYS 50 HB1 LYS 50 -0.865 33.569 -0.130 293 HG2 LYS 50 HG2 LYS 50 -3.302 34.712 1.221 294 HG3 LYS 50 HG1 LYS 50 -3.255 33.249 0.236 295 HD2 LYS 50 HD2 LYS 50 -1.642 32.270 1.830 296 HD3 LYS 50 HD1 LYS 50 -1.785 33.722 2.824 297 HE2 LYS 50 HE2 LYS 50 -4.130 33.291 3.189 298 HE3 LYS 50 HE1 LYS 50 -4.081 31.913 2.094 299 HZ1 LYS 50 HZ1 LYS 50 -3.999 31.201 4.380 300 HZ2 LYS 50 HZ2 LYS 50 -2.617 32.134 4.662 301 HZ3 LYS 50 HZ3 LYS 50 -2.550 30.821 3.601 302 H GLU 51 HN GLU 51 0.195 37.618 0.271 303 HA GLU 51 HA GLU 51 2.051 38.554 -0.631 304 HB2 GLU 51 HB2 GLU 51 3.180 37.156 1.178 305 HB3 GLU 51 HB1 GLU 51 3.532 35.986 -0.081 306 HG2 GLU 51 HG2 GLU 51 4.802 37.676 -1.297 307 HG3 GLU 51 HG1 GLU 51 4.447 38.849 -0.030 308 H CYS 52 HN CYS 52 0.217 36.605 -2.076 309 HA CYS 52 HA CYS 52 1.636 35.427 -4.209 310 HB2 CYS 52 HB2 CYS 52 -0.745 35.767 -5.283 311 HB3 CYS 52 HB1 CYS 52 -0.505 34.602 -3.977 312 H THR 53 HN THR 53 -0.162 38.437 -3.918 313 HA THR 53 HA THR 53 -0.171 40.393 -5.029 314 HB THR 53 HB THR 53 2.057 41.338 -5.677 315 HG1 THR 53 HG1 THR 53 2.760 38.732 -5.607 316 HG21 THR 53 HG21 THR 53 2.939 41.387 -3.389 317 HG22 THR 53 HG22 THR 53 1.897 40.025 -2.969 318 HG23 THR 53 HG23 THR 53 1.184 41.577 -3.413 319 H GLY 54 HN GLY 54 -1.168 38.448 -6.637 320 HA2 GLY 54 HA2 GLY 54 -1.690 39.362 -8.969 321 HA3 GLY 54 HA1 GLY 54 0.011 39.040 -9.256 322 HA PRO 55 HA PRO 55 -2.840 35.205 -9.784 323 HB2 PRO 55 HB2 PRO 55 -3.403 35.301 -12.431 324 HB3 PRO 55 HB1 PRO 55 -4.429 36.056 -11.205 325 HG2 PRO 55 HG2 PRO 55 -2.366 37.304 -12.979 326 HG3 PRO 55 HG1 PRO 55 -3.981 37.901 -12.552 327 HD2 PRO 55 HD2 PRO 55 -1.714 38.815 -11.372 328 HD3 PRO 55 HD1 PRO 55 -3.272 38.730 -10.526 329 H ASP 56 HN ASP 56 -0.168 36.611 -11.448 330 HA ASP 56 HA ASP 56 0.612 34.185 -12.811 331 HB2 ASP 56 HB2 ASP 56 2.172 36.754 -12.430 332 HB3 ASP 56 HB1 ASP 56 2.576 35.452 -13.538 333 H SER 57 HN SER 57 0.776 35.220 -9.684 334 HA SER 57 HA SER 57 2.790 33.216 -9.045 335 HB2 SER 57 HB2 SER 57 2.964 36.083 -8.073 336 HB3 SER 57 HB1 SER 57 3.999 34.757 -7.541 337 HG SER 57 HG SER 57 4.072 34.736 -10.164 338 H CYS 58 HN CYS 58 -0.117 33.560 -8.785 339 HA CYS 58 HA CYS 58 -0.571 34.046 -5.983 340 HB2 CYS 58 HB2 CYS 58 -2.154 34.739 -7.835 341 HB3 CYS 58 HB1 CYS 58 -2.565 33.036 -8.006 342 H LYS 59 HN LYS 59 -0.993 32.585 -4.445 343 HA LYS 59 HA LYS 59 -0.689 29.743 -5.170 344 HB2 LYS 59 HB2 LYS 59 -0.165 31.085 -2.505 345 HB3 LYS 59 HB1 LYS 59 0.117 29.393 -2.884 346 HG2 LYS 59 HG2 LYS 59 1.548 31.735 -4.128 347 HG3 LYS 59 HG1 LYS 59 2.189 30.678 -2.868 348 HD2 LYS 59 HD2 LYS 59 2.039 28.770 -4.388 349 HD3 LYS 59 HD1 LYS 59 1.369 29.815 -5.641 350 HE2 LYS 59 HE2 LYS 59 3.432 31.134 -5.637 351 HE3 LYS 59 HE1 LYS 59 4.100 30.083 -4.391 352 HZ1 LYS 59 HZ1 LYS 59 3.979 28.232 -5.928 353 HZ2 LYS 59 HZ2 LYS 59 4.892 29.487 -6.598 354 HZ3 LYS 59 HZ3 LYS 59 3.307 29.225 -7.119 355 H CYS 60 HN CYS 60 -3.024 31.743 -4.850 356 HA CYS 60 HA CYS 60 -4.622 30.185 -2.957 357 HB2 CYS 60 HB2 CYS 60 -5.226 32.908 -4.086 358 HB3 CYS 60 HB1 CYS 60 -5.986 32.122 -2.704 359 H GLY 61 HN GLY 61 -6.751 29.582 -3.560 360 HA2 GLY 61 HA2 GLY 61 -6.926 28.918 -6.391 361 HA3 GLY 61 HA1 GLY 61 -7.922 28.263 -5.100 362 H SER 62 HN SER 62 -9.904 29.056 -4.834 363 HA SER 62 HA SER 62 -10.590 31.579 -6.186 364 HB2 SER 62 HB2 SER 62 -12.764 30.530 -6.808 365 HB3 SER 62 HB1 SER 62 -11.378 29.752 -7.575 366 HG SER 62 HG SER 62 -12.626 28.115 -6.759 367 H SER 63 HN SER 63 -10.534 29.852 -3.331 368 HA SER 63 HA SER 63 -12.944 31.142 -2.268 369 HB2 SER 63 HB2 SER 63 -11.323 28.911 -1.038 370 HB3 SER 63 HB1 SER 63 -12.928 29.465 -0.553 371 HG SER 63 HG SER 63 -12.864 28.828 -3.186 372 H CYS 64 HN CYS 64 -10.146 32.330 -2.633 373 HA CYS 64 HA CYS 64 -9.605 32.949 0.175 374 HB2 CYS 64 HB2 CYS 64 -7.703 32.166 -1.244 375 HB3 CYS 64 HB1 CYS 64 -7.894 33.616 -2.224 376 H SER 65 HN SER 65 -8.807 35.267 0.490 377 HA SER 65 HA SER 65 -10.989 36.973 -0.023 378 HB2 SER 65 HB2 SER 65 -9.546 37.105 1.999 379 HB3 SER 65 HB1 SER 65 -8.231 37.706 0.991 380 HG SER 65 HG SER 65 -9.180 39.498 1.778 381 H CYS 66 HN CYS 66 -7.940 36.446 -1.689 382 HA CYS 66 HA CYS 66 -8.125 38.911 -3.159 383 HB2 CYS 66 HB2 CYS 66 -6.186 37.994 -4.449 384 HB3 CYS 66 HB1 CYS 66 -5.911 38.120 -2.721 385 H LYS 67 HN LYS 67 -9.947 36.254 -3.316 386 HA LYS 67 HA LYS 67 -10.216 36.412 -6.244 387 HB2 LYS 67 HB2 LYS 67 -10.942 34.034 -4.527 388 HB3 LYS 67 HB1 LYS 67 -10.917 34.111 -6.282 389 HG2 LYS 67 HG2 LYS 67 -8.541 34.244 -4.440 390 HG3 LYS 67 HG1 LYS 67 -8.984 32.904 -5.494 391 HD2 LYS 67 HD2 LYS 67 -8.600 34.283 -7.456 392 HD3 LYS 67 HD1 LYS 67 -8.269 35.683 -6.433 393 HE2 LYS 67 HE2 LYS 67 -6.135 34.977 -6.900 394 HE3 LYS 67 HE1 LYS 67 -6.463 34.117 -5.396 395 HZ1 LYS 67 HZ1 LYS 67 -6.607 33.015 -8.139 396 HZ2 LYS 67 HZ2 LYS 67 -7.120 32.185 -6.763 397 HZ3 LYS 67 HZ3 LYS 67 -5.492 32.612 -6.932 Start of MODEL 3 1 HA2 GLY 1 HA1 GLY 1 -14.966 17.869 -36.293 2 HA3 GLY 1 HA2 GLY 1 -16.678 18.040 -36.649 3 H SER 2 HN SER 2 -14.310 16.489 -34.587 4 HA SER 2 HA SER 2 -16.384 15.319 -32.935 5 HB2 SER 2 HB2 SER 2 -13.377 15.340 -32.564 6 HB3 SER 2 HB1 SER 2 -14.527 14.390 -31.621 7 HG SER 2 HG SER 2 -14.375 14.182 -34.441 8 H GLY 3 HN GLY 3 -17.477 17.079 -32.114 9 HA2 GLY 3 HA2 GLY 3 -16.245 19.350 -30.972 10 HA3 GLY 3 HA1 GLY 3 -17.917 18.860 -30.750 11 H LYS 4 HN LYS 4 -16.024 19.985 -28.845 12 HA LYS 4 HA LYS 4 -15.612 17.759 -27.000 13 HB2 LYS 4 HB2 LYS 4 -14.743 20.638 -26.708 14 HB3 LYS 4 HB1 LYS 4 -14.259 19.291 -25.691 15 HG2 LYS 4 HG2 LYS 4 -13.549 19.724 -28.580 16 HG3 LYS 4 HG1 LYS 4 -12.471 19.829 -27.190 17 HD2 LYS 4 HD2 LYS 4 -12.769 17.451 -26.761 18 HD3 LYS 4 HD1 LYS 4 -13.904 17.337 -28.106 19 HE2 LYS 4 HE2 LYS 4 -10.989 18.083 -28.296 20 HE3 LYS 4 HE1 LYS 4 -11.696 16.536 -28.755 21 HZ1 LYS 4 HZ1 LYS 4 -12.255 19.166 -30.021 22 HZ2 LYS 4 HZ2 LYS 4 -13.028 17.726 -30.434 23 HZ3 LYS 4 HZ3 LYS 4 -11.370 17.897 -30.697 24 H GLY 5 HN GLY 5 -16.249 18.009 -24.778 25 HA2 GLY 5 HA2 GLY 5 -17.966 19.976 -23.814 26 HA3 GLY 5 HA1 GLY 5 -18.961 18.706 -24.520 27 H LYS 6 HN LYS 6 -16.272 19.191 -22.290 28 HA LYS 6 HA LYS 6 -16.858 16.685 -20.960 29 HB2 LYS 6 HB2 LYS 6 -14.783 18.797 -20.340 30 HB3 LYS 6 HB1 LYS 6 -14.886 17.210 -19.589 31 HG2 LYS 6 HG2 LYS 6 -14.452 16.151 -21.741 32 HG3 LYS 6 HG1 LYS 6 -14.380 17.736 -22.511 33 HD2 LYS 6 HD2 LYS 6 -12.463 18.324 -21.103 34 HD3 LYS 6 HD1 LYS 6 -12.534 16.732 -20.346 35 HE2 LYS 6 HE2 LYS 6 -12.027 17.292 -23.267 36 HE3 LYS 6 HE1 LYS 6 -10.818 16.803 -22.082 37 HZ1 LYS 6 HZ1 LYS 6 -12.008 14.719 -21.794 38 HZ2 LYS 6 HZ2 LYS 6 -11.557 14.928 -23.406 39 HZ3 LYS 6 HZ3 LYS 6 -13.158 15.186 -22.939 40 H GLY 7 HN GLY 7 -16.621 16.949 -18.393 41 HA2 GLY 7 HA2 GLY 7 -18.977 18.314 -17.587 42 HA3 GLY 7 HA1 GLY 7 -17.847 17.480 -16.530 43 H GLU 8 HN GLU 8 -18.948 20.457 -17.671 44 HA GLU 8 HA GLU 8 -16.639 21.980 -16.860 45 HB2 GLU 8 HB2 GLU 8 -19.404 22.845 -17.694 46 HB3 GLU 8 HB1 GLU 8 -18.059 23.932 -17.384 47 HG2 GLU 8 HG2 GLU 8 -16.853 23.100 -19.246 48 HG3 GLU 8 HG1 GLU 8 -17.997 21.774 -19.467 49 H LYS 9 HN LYS 9 -16.427 23.162 -15.051 50 HA LYS 9 HA LYS 9 -18.369 22.667 -12.915 51 HB2 LYS 9 HB2 LYS 9 -15.526 23.714 -12.828 52 HB3 LYS 9 HB1 LYS 9 -16.563 23.573 -11.421 53 HG2 LYS 9 HG2 LYS 9 -15.136 21.700 -11.382 54 HG3 LYS 9 HG1 LYS 9 -16.702 21.102 -11.919 55 HD2 LYS 9 HD2 LYS 9 -15.921 21.174 -14.246 56 HD3 LYS 9 HD1 LYS 9 -14.348 21.748 -13.692 57 HE2 LYS 9 HE2 LYS 9 -13.964 19.701 -12.499 58 HE3 LYS 9 HE1 LYS 9 -15.597 19.140 -12.853 59 HZ1 LYS 9 HZ1 LYS 9 -15.025 19.127 -15.210 60 HZ2 LYS 9 HZ2 LYS 9 -14.009 18.106 -14.322 61 HZ3 LYS 9 HZ3 LYS 9 -13.447 19.616 -14.844 62 H CYS 10 HN CYS 10 -18.308 24.681 -15.243 63 HA CYS 10 HA CYS 10 -18.455 27.154 -13.713 64 HB2 CYS 10 HB2 CYS 10 -18.335 26.711 -16.682 65 HB3 CYS 10 HB1 CYS 10 -18.400 28.283 -15.892 66 H THR 11 HN THR 11 -20.152 28.509 -13.768 67 HA THR 11 HA THR 11 -22.709 27.226 -14.271 68 HB THR 11 HB THR 11 -23.610 29.156 -12.959 69 HG1 THR 11 HG1 THR 11 -21.243 29.933 -11.906 70 HG21 THR 11 HG21 THR 11 -22.967 27.036 -11.850 71 HG22 THR 11 HG22 THR 11 -22.710 28.434 -10.805 72 HG23 THR 11 HG23 THR 11 -21.337 27.676 -11.614 73 H SER 12 HN SER 12 -24.447 29.007 -14.880 74 HA SER 12 HA SER 12 -24.023 29.732 -17.542 75 HB2 SER 12 HB2 SER 12 -26.145 31.101 -17.176 76 HB3 SER 12 HB1 SER 12 -26.246 29.377 -16.816 77 HG SER 12 HG SER 12 -26.437 29.789 -14.741 78 H ALA 13 HN ALA 13 -23.452 31.456 -14.581 79 HA ALA 13 HA ALA 13 -23.320 34.074 -15.595 80 HB1 ALA 13 HB1 ALA 13 -21.879 32.895 -13.222 81 HB2 ALA 13 HB2 ALA 13 -23.512 33.561 -13.208 82 HB3 ALA 13 HB3 ALA 13 -22.134 34.612 -13.536 83 H CYS 14 HN CYS 14 -20.811 31.611 -15.129 84 HA CYS 14 HA CYS 14 -18.678 33.274 -15.996 85 HB2 CYS 14 HB2 CYS 14 -18.480 31.202 -14.557 86 HB3 CYS 14 HB1 CYS 14 -18.748 30.253 -16.011 87 H ARG 15 HN ARG 15 -20.843 31.030 -17.623 88 HA ARG 15 HA ARG 15 -19.430 31.083 -20.122 89 HB2 ARG 15 HB2 ARG 15 -21.953 29.903 -19.140 90 HB3 ARG 15 HB1 ARG 15 -21.879 30.253 -20.858 91 HG2 ARG 15 HG2 ARG 15 -19.743 28.919 -20.926 92 HG3 ARG 15 HG1 ARG 15 -20.106 28.419 -19.269 93 HD2 ARG 15 HD2 ARG 15 -22.162 27.416 -19.947 94 HD3 ARG 15 HD1 ARG 15 -22.022 28.092 -21.565 95 HE ARG 15 HE ARG 15 -20.218 26.003 -20.505 96 HH11 ARG 15 HH11 ARG 15 -21.950 27.495 -23.163 97 HH12 ARG 15 HH12 ARG 15 -21.675 26.187 -24.255 98 HH21 ARG 15 HH21 ARG 15 -19.859 24.258 -21.938 99 HH22 ARG 15 HH22 ARG 15 -20.468 24.338 -23.562 100 H SER 16 HN SER 16 -21.035 33.509 -18.667 101 HA SER 16 HA SER 16 -22.597 34.432 -20.907 102 HB2 SER 16 HB2 SER 16 -21.867 35.798 -18.314 103 HB3 SER 16 HB1 SER 16 -23.024 36.409 -19.497 104 HG SER 16 HG SER 16 -23.219 33.927 -18.113 105 H GLU 17 HN GLU 17 -22.239 36.525 -21.907 106 HA GLU 17 HA GLU 17 -19.412 37.321 -22.003 107 HB2 GLU 17 HB2 GLU 17 -21.374 37.132 -24.298 108 HB3 GLU 17 HB1 GLU 17 -19.772 37.839 -24.412 109 HG2 GLU 17 HG2 GLU 17 -20.356 34.969 -23.714 110 HG3 GLU 17 HG1 GLU 17 -19.882 35.555 -25.307 111 HA PRO 18 HA PRO 18 -18.291 38.748 -21.339 112 HB2 PRO 18 HB2 PRO 18 -17.871 40.447 -19.290 113 HB3 PRO 18 HB1 PRO 18 -17.670 40.943 -20.975 114 HG2 PRO 18 HG2 PRO 18 -19.987 41.392 -19.134 115 HG3 PRO 18 HG1 PRO 18 -19.211 42.528 -20.253 116 HD2 PRO 18 HD2 PRO 18 -21.514 41.227 -20.846 117 HD3 PRO 18 HD1 PRO 18 -20.327 41.687 -22.079 118 H CYS 19 HN CYS 19 -17.380 38.078 -19.188 119 HA CYS 19 HA CYS 19 -18.943 36.092 -18.058 120 HB2 CYS 19 HB2 CYS 19 -16.412 36.343 -18.143 121 HB3 CYS 19 HB1 CYS 19 -16.576 37.376 -16.729 122 H GLN 20 HN GLN 20 -20.099 35.925 -16.171 123 HA GLN 20 HA GLN 20 -20.702 38.481 -14.833 124 HB2 GLN 20 HB2 GLN 20 -22.546 36.180 -15.423 125 HB3 GLN 20 HB1 GLN 20 -22.978 37.626 -14.519 126 HG2 GLN 20 HG2 GLN 20 -22.005 37.639 -17.352 127 HG3 GLN 20 HG1 GLN 20 -23.696 37.613 -16.874 128 HE21 GLN 20 HE21 GLN 20 -22.102 39.596 -18.346 129 HE22 GLN 20 HE22 GLN 20 -22.298 41.082 -17.486 130 H CYS 21 HN CYS 21 -18.899 36.036 -14.169 131 HA CYS 21 HA CYS 21 -20.047 34.838 -11.860 132 HB2 CYS 21 HB2 CYS 21 -17.386 34.926 -13.079 133 HB3 CYS 21 HB1 CYS 21 -17.355 34.769 -11.327 134 H GLY 22 HN GLY 22 -18.378 37.840 -12.388 135 HA2 GLY 22 HA2 GLY 22 -18.141 39.704 -11.082 136 HA3 GLY 22 HA1 GLY 22 -19.481 39.080 -10.136 137 H SER 23 HN SER 23 -18.801 39.495 -8.124 138 HA SER 23 HA SER 23 -16.127 38.624 -7.344 139 HB2 SER 23 HB2 SER 23 -18.136 40.282 -5.802 140 HB3 SER 23 HB1 SER 23 -16.447 40.002 -5.370 141 HG SER 23 HG SER 23 -16.203 40.911 -7.713 142 H LYS 24 HN LYS 24 -18.870 37.113 -7.696 143 HA LYS 24 HA LYS 24 -18.896 35.782 -5.090 144 HB2 LYS 24 HB2 LYS 24 -20.770 35.645 -7.457 145 HB3 LYS 24 HB1 LYS 24 -20.907 34.587 -6.062 146 HG2 LYS 24 HG2 LYS 24 -21.070 37.593 -5.963 147 HG3 LYS 24 HG1 LYS 24 -22.458 36.506 -6.001 148 HD2 LYS 24 HD2 LYS 24 -20.328 36.548 -3.853 149 HD3 LYS 24 HD1 LYS 24 -21.931 37.268 -3.717 150 HE2 LYS 24 HE2 LYS 24 -22.924 35.027 -4.075 151 HE3 LYS 24 HE1 LYS 24 -21.303 34.341 -4.097 152 HZ1 LYS 24 HZ1 LYS 24 -22.366 34.119 -1.938 153 HZ2 LYS 24 HZ2 LYS 24 -22.514 35.794 -1.811 154 HZ3 LYS 24 HZ3 LYS 24 -20.981 35.081 -1.829 155 H CYS 25 HN CYS 25 -18.721 35.107 -8.540 156 HA CYS 25 HA CYS 25 -17.830 33.461 -9.766 157 HB2 CYS 25 HB2 CYS 25 -15.814 34.389 -8.431 158 HB3 CYS 25 HB1 CYS 25 -15.908 32.869 -7.545 159 H GLN 26 HN GLN 26 -19.400 31.998 -9.905 160 HA GLN 26 HA GLN 26 -19.785 30.097 -7.716 161 HB2 GLN 26 HB2 GLN 26 -21.477 30.644 -10.150 162 HB3 GLN 26 HB1 GLN 26 -21.876 29.499 -8.879 163 HG2 GLN 26 HG2 GLN 26 -22.003 31.307 -7.264 164 HG3 GLN 26 HG1 GLN 26 -21.545 32.468 -8.510 165 HE21 GLN 26 HE21 GLN 26 -23.038 33.044 -10.083 166 HE22 GLN 26 HE22 GLN 26 -24.716 32.672 -9.944 167 H CYS 27 HN CYS 27 -17.733 30.084 -10.157 168 HA CYS 27 HA CYS 27 -18.344 27.326 -10.963 169 HB2 CYS 27 HB2 CYS 27 -16.890 27.673 -12.868 170 HB3 CYS 27 HB1 CYS 27 -18.132 28.926 -12.811 171 H GLY 28 HN GLY 28 -16.304 26.064 -11.536 172 HA2 GLY 28 HA2 GLY 28 -14.491 26.201 -9.228 173 HA3 GLY 28 HA1 GLY 28 -14.785 24.775 -10.215 174 H GLU 29 HN GLU 29 -12.258 25.114 -9.871 175 HA GLU 29 HA GLU 29 -11.100 26.972 -11.738 176 HB2 GLU 29 HB2 GLU 29 -9.824 24.859 -10.006 177 HB3 GLU 29 HB1 GLU 29 -8.941 25.997 -11.008 178 HG2 GLU 29 HG2 GLU 29 -9.912 27.849 -9.705 179 HG3 GLU 29 HG1 GLU 29 -10.705 26.664 -8.668 180 H GLY 30 HN GLY 30 -12.184 26.092 -13.587 181 HA2 GLY 30 HA2 GLY 30 -10.428 24.254 -14.972 182 HA3 GLY 30 HA1 GLY 30 -12.067 23.658 -14.735 183 H CYS 31 HN CYS 31 -11.544 27.038 -15.082 184 HA CYS 31 HA CYS 31 -12.727 26.885 -17.778 185 HB2 CYS 31 HB2 CYS 31 -13.759 29.079 -17.289 186 HB3 CYS 31 HB1 CYS 31 -14.305 27.805 -16.208 187 H THR 32 HN THR 32 -10.104 28.023 -15.915 188 HA THR 32 HA THR 32 -8.407 29.495 -16.221 189 HB THR 32 HB THR 32 -7.340 29.510 -18.469 190 HG1 THR 32 HG1 THR 32 -9.818 28.531 -19.211 191 HG21 THR 32 HG21 THR 32 -6.832 27.706 -16.914 192 HG22 THR 32 HG22 THR 32 -6.842 27.100 -18.571 193 HG23 THR 32 HG23 THR 32 -8.214 26.784 -17.508 194 H CYS 33 HN CYS 33 -11.023 30.588 -16.219 195 HA CYS 33 HA CYS 33 -11.269 32.584 -18.249 196 HB2 CYS 33 HB2 CYS 33 -13.068 31.362 -16.737 197 HB3 CYS 33 HB1 CYS 33 -12.736 32.700 -15.651 198 H ALA 34 HN ALA 34 -10.141 34.406 -18.261 199 HA ALA 34 HA ALA 34 -8.675 35.223 -15.885 200 HB1 ALA 34 HB1 ALA 34 -7.488 36.738 -17.386 201 HB2 ALA 34 HB2 ALA 34 -8.584 36.310 -18.699 202 HB3 ALA 34 HB3 ALA 34 -7.494 35.096 -18.029 203 H ALA 35 HN ALA 35 -11.631 35.569 -16.440 204 HA ALA 35 HA ALA 35 -11.819 38.481 -16.189 205 HB1 ALA 35 HB1 ALA 35 -14.201 38.188 -16.697 206 HB2 ALA 35 HB2 ALA 35 -13.966 36.443 -16.789 207 HB3 ALA 35 HB3 ALA 35 -13.186 37.501 -17.964 208 H CYS 36 HN CYS 36 -13.229 35.500 -14.870 209 HA CYS 36 HA CYS 36 -13.743 36.905 -12.359 210 HB2 CYS 36 HB2 CYS 36 -15.059 34.938 -11.773 211 HB3 CYS 36 HB1 CYS 36 -15.554 35.598 -13.328 212 H LYS 37 HN LYS 37 -11.712 34.431 -13.744 213 HA LYS 37 HA LYS 37 -10.784 33.756 -11.074 214 HB2 LYS 37 HB2 LYS 37 -11.705 32.058 -12.875 215 HB3 LYS 37 HB1 LYS 37 -10.046 32.125 -13.436 216 HG2 LYS 37 HG2 LYS 37 -9.212 31.159 -11.515 217 HG3 LYS 37 HG1 LYS 37 -10.633 31.593 -10.561 218 HD2 LYS 37 HD2 LYS 37 -10.821 29.690 -12.876 219 HD3 LYS 37 HD1 LYS 37 -10.348 29.133 -11.271 220 HE2 LYS 37 HE2 LYS 37 -12.728 28.794 -11.544 221 HE3 LYS 37 HE1 LYS 37 -12.469 30.074 -10.367 222 HZ1 LYS 37 HZ1 LYS 37 -13.068 31.712 -12.006 223 HZ2 LYS 37 HZ2 LYS 37 -14.266 30.528 -11.990 224 HZ3 LYS 37 HZ3 LYS 37 -13.130 30.543 -13.230 225 H THR 38 HN THR 38 -9.506 35.656 -10.987 226 HA THR 38 HA THR 38 -6.833 35.165 -11.891 227 HB THR 38 HB THR 38 -7.808 36.402 -13.827 228 HG1 THR 38 HG1 THR 38 -6.099 37.794 -13.988 229 HG21 THR 38 HG21 THR 38 -9.489 37.716 -12.625 230 HG22 THR 38 HG22 THR 38 -8.422 38.768 -13.554 231 HG23 THR 38 HG23 THR 38 -8.212 38.619 -11.811 232 H CYS 39 HN CYS 39 -5.341 36.761 -10.874 233 HA CYS 39 HA CYS 39 -6.339 37.378 -8.214 234 HB2 CYS 39 HB2 CYS 39 -4.211 36.155 -8.448 235 HB3 CYS 39 HB1 CYS 39 -3.524 37.537 -9.296 236 H ASN 40 HN ASN 40 -6.224 39.400 -7.264 237 HA ASN 40 HA ASN 40 -5.947 41.626 -9.172 238 HB2 ASN 40 HB2 ASN 40 -7.837 41.240 -6.862 239 HB3 ASN 40 HB1 ASN 40 -7.504 42.839 -7.521 240 HD21 ASN 40 HD21 ASN 40 -8.906 39.701 -8.163 241 HD22 ASN 40 HD22 ASN 40 -9.830 40.186 -9.540 242 H CYS 41 HN CYS 41 -4.318 40.178 -6.804 243 HA CYS 41 HA CYS 41 -3.572 42.452 -5.218 244 HB2 CYS 41 HB2 CYS 41 -2.269 39.735 -5.433 245 HB3 CYS 41 HB1 CYS 41 -2.016 40.922 -4.158 246 H THR 42 HN THR 42 -1.539 43.500 -5.256 247 HA THR 42 HA THR 42 -0.126 43.202 -7.812 248 HB THR 42 HB THR 42 0.534 45.596 -7.520 249 HG1 THR 42 HG1 THR 42 -1.512 46.134 -5.763 250 HG21 THR 42 HG21 THR 42 -1.363 44.985 -8.941 251 HG22 THR 42 HG22 THR 42 -1.662 46.521 -8.125 252 HG23 THR 42 HG23 THR 42 -2.433 45.044 -7.541 253 H SER 43 HN SER 43 2.187 43.793 -7.743 254 HA SER 43 HA SER 43 3.560 42.361 -5.751 255 HB2 SER 43 HB2 SER 43 5.593 43.519 -6.821 256 HB3 SER 43 HB1 SER 43 4.602 42.485 -7.853 257 HG SER 43 HG SER 43 4.483 44.190 -9.072 258 H ASP 44 HN ASP 44 2.594 45.665 -5.971 259 HA ASP 44 HA ASP 44 4.417 46.699 -4.040 260 HB2 ASP 44 HB2 ASP 44 3.477 48.230 -5.619 261 HB3 ASP 44 HB1 ASP 44 1.837 47.768 -5.182 262 H GLY 45 HN GLY 45 1.190 45.312 -3.895 263 HA2 GLY 45 HA2 GLY 45 1.445 44.902 -1.076 264 HA3 GLY 45 HA1 GLY 45 0.261 46.139 -1.475 265 H CYS 46 HN CYS 46 0.348 43.149 -0.528 266 HA CYS 46 HA CYS 46 -1.278 41.839 -2.481 267 HB2 CYS 46 HB2 CYS 46 0.282 40.679 -0.897 268 HB3 CYS 46 HB1 CYS 46 -0.844 41.067 0.398 269 H LYS 47 HN LYS 47 -3.440 41.712 -2.581 270 HA LYS 47 HA LYS 47 -4.930 43.515 -0.885 271 HB2 LYS 47 HB2 LYS 47 -5.693 41.955 -3.343 272 HB3 LYS 47 HB1 LYS 47 -6.834 42.937 -2.436 273 HG2 LYS 47 HG2 LYS 47 -4.323 43.946 -3.763 274 HG3 LYS 47 HG1 LYS 47 -5.964 44.116 -4.393 275 HD2 LYS 47 HD2 LYS 47 -6.568 45.383 -2.352 276 HD3 LYS 47 HD1 LYS 47 -4.890 45.277 -1.822 277 HE2 LYS 47 HE2 LYS 47 -4.187 46.482 -3.826 278 HE3 LYS 47 HE1 LYS 47 -5.867 46.594 -4.348 279 HZ1 LYS 47 HZ1 LYS 47 -6.353 47.879 -2.354 280 HZ2 LYS 47 HZ2 LYS 47 -5.147 48.626 -3.271 281 HZ3 LYS 47 HZ3 LYS 47 -4.735 47.776 -1.874 282 H CYS 48 HN CYS 48 -4.854 40.032 -1.540 283 HA CYS 48 HA CYS 48 -7.122 39.637 0.213 284 HB2 CYS 48 HB2 CYS 48 -6.978 37.308 -0.342 285 HB3 CYS 48 HB1 CYS 48 -6.737 38.231 -1.824 286 H GLY 49 HN GLY 49 -3.652 39.116 0.302 287 HA2 GLY 49 HA2 GLY 49 -2.554 39.489 2.432 288 HA3 GLY 49 HA1 GLY 49 -3.922 38.707 3.209 289 H LYS 50 HN LYS 50 -3.184 37.037 0.407 290 HA LYS 50 HA LYS 50 -1.919 34.918 1.932 291 HB2 LYS 50 HB2 LYS 50 -2.682 35.051 -0.992 292 HB3 LYS 50 HB1 LYS 50 -2.087 33.618 -0.169 293 HG2 LYS 50 HG2 LYS 50 -4.650 35.075 0.445 294 HG3 LYS 50 HG1 LYS 50 -4.501 33.551 -0.433 295 HD2 LYS 50 HD2 LYS 50 -3.544 32.501 1.559 296 HD3 LYS 50 HD1 LYS 50 -3.680 34.031 2.429 297 HE2 LYS 50 HE2 LYS 50 -6.088 33.984 2.182 298 HE3 LYS 50 HE1 LYS 50 -5.985 32.493 1.247 299 HZ1 LYS 50 HZ1 LYS 50 -5.063 31.394 3.190 300 HZ2 LYS 50 HZ2 LYS 50 -6.576 32.056 3.539 301 HZ3 LYS 50 HZ3 LYS 50 -5.171 32.824 4.080 302 H GLU 51 HN GLU 51 -0.844 37.624 0.545 303 HA GLU 51 HA GLU 51 1.164 38.457 -0.036 304 HB2 GLU 51 HB2 GLU 51 2.185 35.844 1.089 305 HB3 GLU 51 HB1 GLU 51 3.207 37.205 0.647 306 HG2 GLU 51 HG2 GLU 51 2.062 38.595 2.306 307 HG3 GLU 51 HG1 GLU 51 1.062 37.217 2.759 308 H CYS 52 HN CYS 52 -0.425 36.648 -1.817 309 HA CYS 52 HA CYS 52 1.375 35.332 -3.570 310 HB2 CYS 52 HB2 CYS 52 -0.641 35.531 -5.135 311 HB3 CYS 52 HB1 CYS 52 -0.858 34.602 -3.649 312 H THR 53 HN THR 53 -0.339 38.398 -3.652 313 HA THR 53 HA THR 53 -0.049 40.348 -4.725 314 HB THR 53 HB THR 53 2.251 41.193 -5.007 315 HG1 THR 53 HG1 THR 53 2.841 38.540 -4.976 316 HG21 THR 53 HG21 THR 53 2.890 41.075 -2.641 317 HG22 THR 53 HG22 THR 53 1.767 39.731 -2.414 318 HG23 THR 53 HG23 THR 53 1.154 41.329 -2.835 319 H GLY 54 HN GLY 54 -0.464 37.932 -6.403 320 HA2 GLY 54 HA2 GLY 54 -0.765 38.938 -8.842 321 HA3 GLY 54 HA1 GLY 54 0.961 38.610 -8.833 322 HA PRO 55 HA PRO 55 -1.900 34.811 -9.839 323 HB2 PRO 55 HB2 PRO 55 -1.381 34.752 -12.548 324 HB3 PRO 55 HB1 PRO 55 -2.820 35.474 -11.820 325 HG2 PRO 55 HG2 PRO 55 -0.293 36.794 -12.728 326 HG3 PRO 55 HG1 PRO 55 -1.971 37.326 -12.935 327 HD2 PRO 55 HD2 PRO 55 -0.403 38.404 -11.066 328 HD3 PRO 55 HD1 PRO 55 -2.124 38.104 -10.756 329 H ASP 56 HN ASP 56 1.286 35.912 -10.812 330 HA ASP 56 HA ASP 56 2.293 33.355 -11.587 331 HB2 ASP 56 HB2 ASP 56 3.735 35.890 -10.796 332 HB3 ASP 56 HB1 ASP 56 4.547 34.444 -11.384 333 H SER 57 HN SER 57 1.723 34.783 -8.555 334 HA SER 57 HA SER 57 3.142 32.559 -7.273 335 HB2 SER 57 HB2 SER 57 3.135 35.397 -6.224 336 HB3 SER 57 HB1 SER 57 3.999 34.017 -5.546 337 HG SER 57 HG SER 57 4.715 34.180 -8.069 338 H CYS 58 HN CYS 58 0.346 33.124 -8.002 339 HA CYS 58 HA CYS 58 -0.991 33.784 -5.542 340 HB2 CYS 58 HB2 CYS 58 -1.751 34.387 -7.913 341 HB3 CYS 58 HB1 CYS 58 -2.313 32.723 -8.019 342 H LYS 59 HN LYS 59 -1.669 32.459 -4.063 343 HA LYS 59 HA LYS 59 -1.441 29.561 -4.549 344 HB2 LYS 59 HB2 LYS 59 -1.612 30.926 -1.865 345 HB3 LYS 59 HB1 LYS 59 -1.038 29.305 -2.220 346 HG2 LYS 59 HG2 LYS 59 0.353 31.861 -2.999 347 HG3 LYS 59 HG1 LYS 59 0.785 30.823 -1.641 348 HD2 LYS 59 HD2 LYS 59 1.280 28.999 -3.179 349 HD3 LYS 59 HD1 LYS 59 0.802 30.010 -4.544 350 HE2 LYS 59 HE2 LYS 59 3.234 29.943 -4.285 351 HE3 LYS 59 HE1 LYS 59 2.601 31.569 -4.048 352 HZ1 LYS 59 HZ1 LYS 59 3.320 29.687 -1.868 353 HZ2 LYS 59 HZ2 LYS 59 2.807 31.288 -1.676 354 HZ3 LYS 59 HZ3 LYS 59 4.290 30.957 -2.410 355 H CYS 60 HN CYS 60 -3.678 31.561 -5.042 356 HA CYS 60 HA CYS 60 -5.745 30.416 -3.311 357 HB2 CYS 60 HB2 CYS 60 -6.048 32.880 -4.981 358 HB3 CYS 60 HB1 CYS 60 -6.898 32.429 -3.503 359 H GLY 61 HN GLY 61 -7.845 30.029 -4.292 360 HA2 GLY 61 HA2 GLY 61 -7.551 29.119 -7.077 361 HA3 GLY 61 HA1 GLY 61 -8.606 28.376 -5.887 362 H SER 62 HN SER 62 -10.430 29.696 -5.110 363 HA SER 62 HA SER 62 -11.261 31.837 -6.896 364 HB2 SER 62 HB2 SER 62 -12.939 29.347 -6.467 365 HB3 SER 62 HB1 SER 62 -13.416 30.775 -7.387 366 HG SER 62 HG SER 62 -11.020 29.752 -8.187 367 H SER 63 HN SER 63 -13.137 32.992 -6.079 368 HA SER 63 HA SER 63 -14.385 34.010 -4.521 369 HB2 SER 63 HB2 SER 63 -14.193 31.380 -3.037 370 HB3 SER 63 HB1 SER 63 -15.342 32.675 -2.691 371 HG SER 63 HG SER 63 -16.160 32.398 -4.826 372 H CYS 64 HN CYS 64 -11.250 33.497 -4.110 373 HA CYS 64 HA CYS 64 -10.918 34.240 -1.365 374 HB2 CYS 64 HB2 CYS 64 -9.151 33.012 -2.640 375 HB3 CYS 64 HB1 CYS 64 -8.923 34.431 -3.647 376 H SER 65 HN SER 65 -9.688 36.346 -0.871 377 HA SER 65 HA SER 65 -11.388 38.467 -1.595 378 HB2 SER 65 HB2 SER 65 -8.668 38.636 -0.307 379 HB3 SER 65 HB1 SER 65 -9.950 39.847 -0.227 380 HG SER 65 HG SER 65 -11.143 37.767 0.603 381 H CYS 66 HN CYS 66 -8.629 37.183 -3.173 382 HA CYS 66 HA CYS 66 -8.251 39.644 -4.704 383 HB2 CYS 66 HB2 CYS 66 -6.245 38.514 -5.613 384 HB3 CYS 66 HB1 CYS 66 -6.210 38.664 -3.862 385 H LYS 67 HN LYS 67 -10.271 37.119 -4.854 386 HA LYS 67 HA LYS 67 -10.058 36.814 -7.783 387 HB2 LYS 67 HB2 LYS 67 -11.379 34.918 -5.828 388 HB3 LYS 67 HB1 LYS 67 -11.144 34.643 -7.548 389 HG2 LYS 67 HG2 LYS 67 -8.940 34.929 -5.520 390 HG3 LYS 67 HG1 LYS 67 -9.544 33.400 -6.162 391 HD2 LYS 67 HD2 LYS 67 -8.777 33.952 -8.357 392 HD3 LYS 67 HD1 LYS 67 -8.399 35.605 -7.868 393 HE2 LYS 67 HE2 LYS 67 -6.686 34.756 -6.342 394 HE3 LYS 67 HE1 LYS 67 -7.060 33.108 -6.841 395 HZ1 LYS 67 HZ1 LYS 67 -6.102 35.228 -8.673 396 HZ2 LYS 67 HZ2 LYS 67 -6.296 33.588 -9.038 397 HZ3 LYS 67 HZ3 LYS 67 -5.106 34.081 -7.939 Start of MODEL 4 1 HA2 GLY 1 HA1 GLY 1 -16.951 8.635 -29.521 2 HA3 GLY 1 HA2 GLY 1 -17.079 10.197 -30.314 3 H SER 2 HN SER 2 -17.853 11.977 -28.700 4 HA SER 2 HA SER 2 -15.925 11.969 -26.541 5 HB2 SER 2 HB2 SER 2 -17.769 14.162 -27.512 6 HB3 SER 2 HB1 SER 2 -16.461 14.356 -26.344 7 HG SER 2 HG SER 2 -14.982 13.879 -27.931 8 H GLY 3 HN GLY 3 -19.308 11.531 -26.973 9 HA2 GLY 3 HA2 GLY 3 -20.828 10.768 -25.402 10 HA3 GLY 3 HA1 GLY 3 -19.614 11.009 -24.154 11 H LYS 4 HN LYS 4 -20.438 12.306 -22.673 12 HA LYS 4 HA LYS 4 -21.802 14.754 -23.575 13 HB2 LYS 4 HB2 LYS 4 -22.438 12.971 -21.224 14 HB3 LYS 4 HB1 LYS 4 -22.973 14.640 -21.284 15 HG2 LYS 4 HG2 LYS 4 -24.799 13.333 -22.003 16 HG3 LYS 4 HG1 LYS 4 -24.129 14.066 -23.458 17 HD2 LYS 4 HD2 LYS 4 -22.942 11.973 -23.952 18 HD3 LYS 4 HD1 LYS 4 -23.632 11.247 -22.498 19 HE2 LYS 4 HE2 LYS 4 -25.881 11.559 -23.408 20 HE3 LYS 4 HE1 LYS 4 -25.195 12.298 -24.855 21 HZ1 LYS 4 HZ1 LYS 4 -25.769 9.951 -25.167 22 HZ2 LYS 4 HZ2 LYS 4 -24.666 9.517 -23.962 23 HZ3 LYS 4 HZ3 LYS 4 -24.117 10.231 -25.387 24 H GLY 5 HN GLY 5 -21.751 16.475 -21.793 25 HA2 GLY 5 HA2 GLY 5 -20.422 17.049 -19.732 26 HA3 GLY 5 HA1 GLY 5 -19.035 16.485 -20.651 27 H LYS 6 HN LYS 6 -20.919 19.130 -19.834 28 HA LYS 6 HA LYS 6 -19.739 20.718 -22.011 29 HB2 LYS 6 HB2 LYS 6 -22.276 21.182 -20.437 30 HB3 LYS 6 HB1 LYS 6 -21.563 22.379 -21.506 31 HG2 LYS 6 HG2 LYS 6 -22.481 19.645 -22.366 32 HG3 LYS 6 HG1 LYS 6 -23.421 21.126 -22.540 33 HD2 LYS 6 HD2 LYS 6 -21.589 22.068 -23.922 34 HD3 LYS 6 HD1 LYS 6 -20.747 20.523 -23.802 35 HE2 LYS 6 HE2 LYS 6 -21.919 20.626 -25.905 36 HE3 LYS 6 HE1 LYS 6 -22.685 19.426 -24.868 37 HZ1 LYS 6 HZ1 LYS 6 -24.312 20.809 -25.998 38 HZ2 LYS 6 HZ2 LYS 6 -23.654 22.199 -25.299 39 HZ3 LYS 6 HZ3 LYS 6 -24.398 21.043 -24.325 40 H GLY 7 HN GLY 7 -17.882 21.448 -21.194 41 HA2 GLY 7 HA2 GLY 7 -16.590 22.952 -20.002 42 HA3 GLY 7 HA1 GLY 7 -18.008 23.375 -19.052 43 H GLU 8 HN GLU 8 -17.227 23.189 -17.010 44 HA GLU 8 HA GLU 8 -16.483 20.490 -16.180 45 HB2 GLU 8 HB2 GLU 8 -14.884 22.975 -15.606 46 HB3 GLU 8 HB1 GLU 8 -14.727 21.509 -14.650 47 HG2 GLU 8 HG2 GLU 8 -14.159 20.284 -16.756 48 HG3 GLU 8 HG1 GLU 8 -14.134 21.837 -17.584 49 H LYS 9 HN LYS 9 -16.361 23.515 -14.380 50 HA LYS 9 HA LYS 9 -18.631 22.600 -12.740 51 HB2 LYS 9 HB2 LYS 9 -16.050 23.766 -11.679 52 HB3 LYS 9 HB1 LYS 9 -17.430 23.259 -10.722 53 HG2 LYS 9 HG2 LYS 9 -17.051 20.951 -11.334 54 HG3 LYS 9 HG1 LYS 9 -15.732 21.429 -12.406 55 HD2 LYS 9 HD2 LYS 9 -14.519 22.345 -10.471 56 HD3 LYS 9 HD1 LYS 9 -15.825 21.806 -9.417 57 HE2 LYS 9 HE2 LYS 9 -15.406 19.496 -10.048 58 HE3 LYS 9 HE1 LYS 9 -14.136 20.012 -11.154 59 HZ1 LYS 9 HZ1 LYS 9 -14.103 20.451 -8.219 60 HZ2 LYS 9 HZ2 LYS 9 -12.858 20.824 -9.298 61 HZ3 LYS 9 HZ3 LYS 9 -13.280 19.210 -9.016 62 H CYS 10 HN CYS 10 -18.274 24.645 -14.873 63 HA CYS 10 HA CYS 10 -18.433 27.081 -13.332 64 HB2 CYS 10 HB2 CYS 10 -18.122 26.633 -16.284 65 HB3 CYS 10 HB1 CYS 10 -18.273 28.223 -15.537 66 H THR 11 HN THR 11 -20.112 28.574 -13.530 67 HA THR 11 HA THR 11 -22.665 27.310 -14.155 68 HB THR 11 HB THR 11 -23.642 29.101 -12.771 69 HG1 THR 11 HG1 THR 11 -22.397 30.650 -11.914 70 HG21 THR 11 HG21 THR 11 -21.363 27.643 -11.425 71 HG22 THR 11 HG22 THR 11 -22.973 26.983 -11.716 72 HG23 THR 11 HG23 THR 11 -22.762 28.342 -10.614 73 H SER 12 HN SER 12 -24.357 29.172 -14.682 74 HA SER 12 HA SER 12 -23.808 29.982 -17.294 75 HB2 SER 12 HB2 SER 12 -25.976 30.972 -15.444 76 HB3 SER 12 HB1 SER 12 -25.977 31.085 -17.206 77 HG SER 12 HG SER 12 -27.060 29.253 -16.908 78 H ALA 13 HN ALA 13 -23.094 31.576 -14.292 79 HA ALA 13 HA ALA 13 -22.973 34.228 -15.282 80 HB1 ALA 13 HB1 ALA 13 -23.096 33.740 -12.884 81 HB2 ALA 13 HB2 ALA 13 -21.668 34.703 -13.263 82 HB3 ALA 13 HB3 ALA 13 -21.509 32.974 -12.956 83 H CYS 14 HN CYS 14 -20.490 31.748 -14.737 84 HA CYS 14 HA CYS 14 -18.417 33.266 -15.959 85 HB2 CYS 14 HB2 CYS 14 -17.928 31.543 -14.303 86 HB3 CYS 14 HB1 CYS 14 -18.581 30.314 -15.372 87 H ARG 15 HN ARG 15 -20.656 30.788 -17.047 88 HA ARG 15 HA ARG 15 -19.394 30.332 -19.552 89 HB2 ARG 15 HB2 ARG 15 -22.211 29.755 -18.637 90 HB3 ARG 15 HB1 ARG 15 -21.581 29.269 -20.202 91 HG2 ARG 15 HG2 ARG 15 -19.805 27.985 -19.014 92 HG3 ARG 15 HG1 ARG 15 -20.617 28.371 -17.497 93 HD2 ARG 15 HD2 ARG 15 -21.825 26.863 -19.814 94 HD3 ARG 15 HD1 ARG 15 -21.225 26.144 -18.323 95 HE ARG 15 HE ARG 15 -23.379 28.129 -18.184 96 HH11 ARG 15 HH11 ARG 15 -22.325 24.797 -17.846 97 HH12 ARG 15 HH12 ARG 15 -23.737 24.292 -16.991 98 HH21 ARG 15 HH21 ARG 15 -25.276 27.463 -17.032 99 HH22 ARG 15 HH22 ARG 15 -25.423 25.812 -16.540 100 H SER 16 HN SER 16 -20.898 33.039 -18.467 101 HA SER 16 HA SER 16 -22.113 33.822 -20.955 102 HB2 SER 16 HB2 SER 16 -23.016 34.613 -18.786 103 HB3 SER 16 HB1 SER 16 -21.483 35.416 -18.457 104 HG SER 16 HG SER 16 -21.959 36.959 -19.835 105 H GLU 17 HN GLU 17 -21.334 35.837 -22.006 106 HA GLU 17 HA GLU 17 -18.459 36.221 -21.704 107 HB2 GLU 17 HB2 GLU 17 -18.269 36.388 -24.216 108 HB3 GLU 17 HB1 GLU 17 -18.562 34.778 -23.583 109 HG2 GLU 17 HG2 GLU 17 -20.945 35.021 -24.148 110 HG3 GLU 17 HG1 GLU 17 -20.591 36.602 -24.845 111 HA PRO 18 HA PRO 18 -17.149 37.519 -21.231 112 HB2 PRO 18 HB2 PRO 18 -16.684 39.424 -19.393 113 HB3 PRO 18 HB1 PRO 18 -16.273 39.656 -21.097 114 HG2 PRO 18 HG2 PRO 18 -18.665 40.627 -19.583 115 HG3 PRO 18 HG1 PRO 18 -17.641 41.505 -20.734 116 HD2 PRO 18 HD2 PRO 18 -20.039 40.428 -21.416 117 HD3 PRO 18 HD1 PRO 18 -18.693 40.583 -22.562 118 H CYS 19 HN CYS 19 -16.574 37.004 -18.900 119 HA CYS 19 HA CYS 19 -18.632 35.555 -17.692 120 HB2 CYS 19 HB2 CYS 19 -16.035 36.491 -16.476 121 HB3 CYS 19 HB1 CYS 19 -17.069 35.219 -15.834 122 H GLN 20 HN GLN 20 -19.911 35.888 -15.969 123 HA GLN 20 HA GLN 20 -20.139 38.675 -15.039 124 HB2 GLN 20 HB2 GLN 20 -22.280 36.569 -15.263 125 HB3 GLN 20 HB1 GLN 20 -22.510 38.234 -14.750 126 HG2 GLN 20 HG2 GLN 20 -21.529 37.396 -17.462 127 HG3 GLN 20 HG1 GLN 20 -23.195 37.792 -17.060 128 HE21 GLN 20 HE21 GLN 20 -20.003 39.052 -17.576 129 HE22 GLN 20 HE22 GLN 20 -20.448 40.721 -17.633 130 H CYS 21 HN CYS 21 -18.636 36.288 -13.952 131 HA CYS 21 HA CYS 21 -19.920 35.412 -11.601 132 HB2 CYS 21 HB2 CYS 21 -17.116 35.401 -12.579 133 HB3 CYS 21 HB1 CYS 21 -17.425 35.012 -10.894 134 H GLY 22 HN GLY 22 -17.915 38.192 -12.323 135 HA2 GLY 22 HA2 GLY 22 -17.693 40.156 -11.128 136 HA3 GLY 22 HA1 GLY 22 -18.683 39.457 -9.852 137 H SER 23 HN SER 23 -17.673 39.051 -8.021 138 HA SER 23 HA SER 23 -14.816 38.383 -8.111 139 HB2 SER 23 HB2 SER 23 -15.193 40.762 -7.409 140 HB3 SER 23 HB1 SER 23 -16.122 40.166 -6.037 141 HG SER 23 HG SER 23 -13.442 39.364 -6.537 142 H LYS 24 HN LYS 24 -17.855 37.376 -7.316 143 HA LYS 24 HA LYS 24 -17.136 35.967 -4.875 144 HB2 LYS 24 HB2 LYS 24 -19.675 36.049 -6.499 145 HB3 LYS 24 HB1 LYS 24 -19.473 35.045 -5.072 146 HG2 LYS 24 HG2 LYS 24 -19.097 37.045 -3.719 147 HG3 LYS 24 HG1 LYS 24 -19.314 38.051 -5.153 148 HD2 LYS 24 HD2 LYS 24 -21.394 36.150 -4.072 149 HD3 LYS 24 HD1 LYS 24 -21.350 37.875 -3.720 150 HE2 LYS 24 HE2 LYS 24 -21.600 38.380 -6.088 151 HE3 LYS 24 HE1 LYS 24 -21.588 36.661 -6.472 152 HZ1 LYS 24 HZ1 LYS 24 -23.829 37.626 -6.396 153 HZ2 LYS 24 HZ2 LYS 24 -23.612 37.986 -4.757 154 HZ3 LYS 24 HZ3 LYS 24 -23.625 36.380 -5.274 155 H CYS 25 HN CYS 25 -17.874 35.332 -8.229 156 HA CYS 25 HA CYS 25 -17.469 33.627 -9.613 157 HB2 CYS 25 HB2 CYS 25 -15.327 33.428 -7.699 158 HB3 CYS 25 HB1 CYS 25 -15.769 31.847 -8.340 159 H GLN 26 HN GLN 26 -19.210 32.591 -9.903 160 HA GLN 26 HA GLN 26 -20.180 30.713 -7.928 161 HB2 GLN 26 HB2 GLN 26 -21.276 31.449 -10.640 162 HB3 GLN 26 HB1 GLN 26 -22.088 30.445 -9.447 163 HG2 GLN 26 HG2 GLN 26 -22.192 32.321 -7.910 164 HG3 GLN 26 HG1 GLN 26 -21.326 33.332 -9.066 165 HE21 GLN 26 HE21 GLN 26 -22.984 34.803 -9.205 166 HE22 GLN 26 HE22 GLN 26 -24.474 34.459 -10.008 167 H CYS 27 HN CYS 27 -18.131 30.723 -10.634 168 HA CYS 27 HA CYS 27 -18.590 27.960 -11.318 169 HB2 CYS 27 HB2 CYS 27 -16.837 28.240 -12.972 170 HB3 CYS 27 HB1 CYS 27 -17.943 29.599 -13.068 171 H GLY 28 HN GLY 28 -16.548 26.543 -11.444 172 HA2 GLY 28 HA2 GLY 28 -15.453 26.483 -8.754 173 HA3 GLY 28 HA1 GLY 28 -15.331 25.208 -9.956 174 H GLU 29 HN GLU 29 -13.286 24.838 -10.388 175 HA GLU 29 HA GLU 29 -11.596 27.099 -11.072 176 HB2 GLU 29 HB2 GLU 29 -9.682 26.127 -9.828 177 HB3 GLU 29 HB1 GLU 29 -10.992 26.616 -8.773 178 HG2 GLU 29 HG2 GLU 29 -10.373 23.777 -9.613 179 HG3 GLU 29 HG1 GLU 29 -9.960 24.504 -8.065 180 H GLY 30 HN GLY 30 -12.153 26.394 -13.198 181 HA2 GLY 30 HA2 GLY 30 -10.157 24.729 -14.334 182 HA3 GLY 30 HA1 GLY 30 -11.702 23.891 -14.289 183 H CYS 31 HN CYS 31 -11.016 27.301 -14.824 184 HA CYS 31 HA CYS 31 -12.096 27.013 -17.548 185 HB2 CYS 31 HB2 CYS 31 -13.240 29.212 -17.180 186 HB3 CYS 31 HB1 CYS 31 -13.885 27.878 -16.224 187 H THR 32 HN THR 32 -9.972 28.632 -15.331 188 HA THR 32 HA THR 32 -8.286 30.102 -15.533 189 HB THR 32 HB THR 32 -6.754 29.717 -17.525 190 HG1 THR 32 HG1 THR 32 -8.873 28.630 -18.584 191 HG21 THR 32 HG21 THR 32 -6.497 28.574 -15.372 192 HG22 THR 32 HG22 THR 32 -6.050 27.528 -16.720 193 HG23 THR 32 HG23 THR 32 -7.607 27.314 -15.915 194 H CYS 33 HN CYS 33 -10.597 31.355 -16.127 195 HA CYS 33 HA CYS 33 -10.442 32.836 -18.553 196 HB2 CYS 33 HB2 CYS 33 -11.976 33.467 -16.026 197 HB3 CYS 33 HB1 CYS 33 -12.262 34.164 -17.616 198 H ALA 34 HN ALA 34 -10.391 35.318 -18.425 199 HA ALA 34 HA ALA 34 -8.158 36.122 -16.684 200 HB1 ALA 34 HB1 ALA 34 -7.690 37.867 -18.340 201 HB2 ALA 34 HB2 ALA 34 -9.063 37.322 -19.305 202 HB3 ALA 34 HB3 ALA 34 -7.670 36.265 -19.078 203 H ALA 35 HN ALA 35 -11.345 36.202 -16.705 204 HA ALA 35 HA ALA 35 -11.611 38.994 -15.843 205 HB1 ALA 35 HB1 ALA 35 -13.767 37.009 -16.582 206 HB2 ALA 35 HB2 ALA 35 -13.154 38.295 -17.619 207 HB3 ALA 35 HB3 ALA 35 -14.023 38.696 -16.138 208 H CYS 36 HN CYS 36 -13.206 35.932 -14.978 209 HA CYS 36 HA CYS 36 -13.333 36.800 -12.227 210 HB2 CYS 36 HB2 CYS 36 -14.693 34.758 -11.921 211 HB3 CYS 36 HB1 CYS 36 -15.303 35.816 -13.190 212 H LYS 37 HN LYS 37 -10.992 35.377 -14.012 213 HA LYS 37 HA LYS 37 -10.078 33.796 -11.734 214 HB2 LYS 37 HB2 LYS 37 -9.652 33.199 -14.655 215 HB3 LYS 37 HB1 LYS 37 -8.810 32.364 -13.357 216 HG2 LYS 37 HG2 LYS 37 -11.791 32.433 -13.711 217 HG3 LYS 37 HG1 LYS 37 -10.735 31.115 -14.222 218 HD2 LYS 37 HD2 LYS 37 -10.187 30.543 -12.029 219 HD3 LYS 37 HD1 LYS 37 -10.748 32.083 -11.382 220 HE2 LYS 37 HE2 LYS 37 -12.451 29.893 -12.540 221 HE3 LYS 37 HE1 LYS 37 -12.315 30.330 -10.835 222 HZ1 LYS 37 HZ1 LYS 37 -13.259 32.494 -11.349 223 HZ2 LYS 37 HZ2 LYS 37 -14.297 31.257 -11.844 224 HZ3 LYS 37 HZ3 LYS 37 -13.380 32.079 -12.986 225 H THR 38 HN THR 38 -9.623 36.445 -12.023 226 HA THR 38 HA THR 38 -6.728 36.479 -12.482 227 HB THR 38 HB THR 38 -8.044 38.066 -13.932 228 HG1 THR 38 HG1 THR 38 -6.759 40.003 -12.956 229 HG21 THR 38 HG21 THR 38 -9.001 40.080 -12.893 230 HG22 THR 38 HG22 THR 38 -8.648 39.424 -11.295 231 HG23 THR 38 HG23 THR 38 -9.825 38.622 -12.337 232 H CYS 39 HN CYS 39 -5.605 38.030 -10.942 233 HA CYS 39 HA CYS 39 -6.772 37.608 -8.290 234 HB2 CYS 39 HB2 CYS 39 -4.507 36.637 -8.775 235 HB3 CYS 39 HB1 CYS 39 -3.904 38.281 -8.950 236 H ASN 40 HN ASN 40 -7.186 39.275 -6.954 237 HA ASN 40 HA ASN 40 -7.160 41.908 -8.176 238 HB2 ASN 40 HB2 ASN 40 -8.462 40.780 -5.714 239 HB3 ASN 40 HB1 ASN 40 -8.411 42.515 -6.008 240 HD21 ASN 40 HD21 ASN 40 -9.655 39.452 -7.128 241 HD22 ASN 40 HD22 ASN 40 -10.901 40.107 -8.121 242 H CYS 41 HN CYS 41 -5.091 40.144 -6.349 243 HA CYS 41 HA CYS 41 -4.130 42.249 -4.668 244 HB2 CYS 41 HB2 CYS 41 -2.913 39.588 -5.385 245 HB3 CYS 41 HB1 CYS 41 -2.356 40.666 -4.109 246 H THR 42 HN THR 42 -2.473 43.567 -5.037 247 HA THR 42 HA THR 42 -1.547 43.711 -7.779 248 HB THR 42 HB THR 42 -0.683 45.942 -7.099 249 HG1 THR 42 HG1 THR 42 -1.133 44.920 -4.622 250 HG21 THR 42 HG21 THR 42 -2.882 46.994 -6.796 251 HG22 THR 42 HG22 THR 42 -3.568 45.424 -6.372 252 HG23 THR 42 HG23 THR 42 -2.956 45.708 -8.004 253 H SER 43 HN SER 43 0.671 43.911 -8.285 254 HA SER 43 HA SER 43 2.388 42.205 -6.851 255 HB2 SER 43 HB2 SER 43 3.033 44.234 -8.996 256 HB3 SER 43 HB1 SER 43 4.080 42.914 -8.472 257 HG SER 43 HG SER 43 1.940 41.675 -8.999 258 H ASP 44 HN ASP 44 1.525 45.418 -6.365 259 HA ASP 44 HA ASP 44 3.984 46.267 -5.095 260 HB2 ASP 44 HB2 ASP 44 1.310 47.649 -4.959 261 HB3 ASP 44 HB1 ASP 44 2.913 48.358 -4.790 262 H GLY 45 HN GLY 45 1.103 44.644 -4.255 263 HA2 GLY 45 HA2 GLY 45 1.890 44.073 -1.651 264 HA3 GLY 45 HA1 GLY 45 0.800 45.451 -1.580 265 H CYS 46 HN CYS 46 0.730 42.436 -0.905 266 HA CYS 46 HA CYS 46 -1.353 41.328 -2.473 267 HB2 CYS 46 HB2 CYS 46 0.281 40.037 -1.070 268 HB3 CYS 46 HB1 CYS 46 -0.580 40.602 0.356 269 H LYS 47 HN LYS 47 -3.566 41.214 -2.071 270 HA LYS 47 HA LYS 47 -4.486 43.175 -0.093 271 HB2 LYS 47 HB2 LYS 47 -5.810 42.399 -2.691 272 HB3 LYS 47 HB1 LYS 47 -6.444 43.555 -1.525 273 HG2 LYS 47 HG2 LYS 47 -4.400 44.931 -1.856 274 HG3 LYS 47 HG1 LYS 47 -3.902 43.814 -3.124 275 HD2 LYS 47 HD2 LYS 47 -4.944 45.689 -4.172 276 HD3 LYS 47 HD1 LYS 47 -6.054 44.324 -4.299 277 HE2 LYS 47 HE2 LYS 47 -7.353 45.172 -2.434 278 HE3 LYS 47 HE1 LYS 47 -6.206 46.490 -2.206 279 HZ1 LYS 47 HZ1 LYS 47 -6.787 47.290 -4.428 280 HZ2 LYS 47 HZ2 LYS 47 -8.131 47.257 -3.398 281 HZ3 LYS 47 HZ3 LYS 47 -7.936 46.060 -4.572 282 H CYS 48 HN CYS 48 -4.532 39.866 -0.801 283 HA CYS 48 HA CYS 48 -6.965 39.544 0.808 284 HB2 CYS 48 HB2 CYS 48 -7.156 37.314 -0.003 285 HB3 CYS 48 HB1 CYS 48 -6.748 38.302 -1.404 286 H GLY 49 HN GLY 49 -3.551 38.657 0.651 287 HA2 GLY 49 HA2 GLY 49 -2.427 38.889 2.855 288 HA3 GLY 49 HA1 GLY 49 -3.728 37.904 3.502 289 H LYS 50 HN LYS 50 -3.101 36.638 0.530 290 HA LYS 50 HA LYS 50 -1.630 34.434 1.708 291 HB2 LYS 50 HB2 LYS 50 -2.579 34.801 -1.126 292 HB3 LYS 50 HB1 LYS 50 -2.002 33.306 -0.406 293 HG2 LYS 50 HG2 LYS 50 -4.447 34.810 0.478 294 HG3 LYS 50 HG1 LYS 50 -4.444 33.420 -0.606 295 HD2 LYS 50 HD2 LYS 50 -3.381 32.089 1.191 296 HD3 LYS 50 HD1 LYS 50 -3.541 33.483 2.266 297 HE2 LYS 50 HE2 LYS 50 -5.371 31.850 2.537 298 HE3 LYS 50 HE1 LYS 50 -5.938 33.442 2.035 299 HZ1 LYS 50 HZ1 LYS 50 -5.540 31.103 0.252 300 HZ2 LYS 50 HZ2 LYS 50 -6.064 32.627 -0.244 301 HZ3 LYS 50 HZ3 LYS 50 -7.028 31.696 0.787 302 H GLU 51 HN GLU 51 -0.752 37.295 0.349 303 HA GLU 51 HA GLU 51 1.230 38.187 -0.324 304 HB2 GLU 51 HB2 GLU 51 2.076 36.423 1.428 305 HB3 GLU 51 HB1 GLU 51 2.625 35.551 0.006 306 HG2 GLU 51 HG2 GLU 51 4.481 36.773 0.694 307 HG3 GLU 51 HG1 GLU 51 3.811 37.705 -0.646 308 H CYS 52 HN CYS 52 -0.610 36.495 -2.054 309 HA CYS 52 HA CYS 52 0.984 35.303 -4.061 310 HB2 CYS 52 HB2 CYS 52 -1.278 35.607 -5.363 311 HB3 CYS 52 HB1 CYS 52 -1.141 34.453 -4.036 312 H THR 53 HN THR 53 -0.630 38.427 -3.808 313 HA THR 53 HA THR 53 -0.382 40.414 -4.868 314 HB THR 53 HB THR 53 1.916 41.147 -5.413 315 HG1 THR 53 HG1 THR 53 2.364 38.473 -5.554 316 HG21 THR 53 HG21 THR 53 2.831 40.916 -3.155 317 HG22 THR 53 HG22 THR 53 1.671 39.628 -2.821 318 HG23 THR 53 HG23 THR 53 1.103 41.271 -3.121 319 H GLY 54 HN GLY 54 -1.166 38.147 -6.606 320 HA2 GLY 54 HA2 GLY 54 -1.719 39.196 -8.935 321 HA3 GLY 54 HA1 GLY 54 0.011 38.966 -9.152 322 HA PRO 55 HA PRO 55 -2.758 35.098 -10.084 323 HB2 PRO 55 HB2 PRO 55 -2.351 35.134 -12.818 324 HB3 PRO 55 HB1 PRO 55 -3.782 35.778 -12.004 325 HG2 PRO 55 HG2 PRO 55 -1.348 37.218 -12.979 326 HG3 PRO 55 HG1 PRO 55 -3.050 37.698 -13.088 327 HD2 PRO 55 HD2 PRO 55 -1.434 38.773 -11.260 328 HD3 PRO 55 HD1 PRO 55 -3.125 38.395 -10.877 329 H ASP 56 HN ASP 56 0.350 36.307 -11.177 330 HA ASP 56 HA ASP 56 1.481 33.916 -12.112 331 HB2 ASP 56 HB2 ASP 56 2.628 35.959 -12.560 332 HB3 ASP 56 HB1 ASP 56 2.746 36.342 -10.845 333 H SER 57 HN SER 57 1.593 35.350 -8.870 334 HA SER 57 HA SER 57 2.702 32.817 -7.888 335 HB2 SER 57 HB2 SER 57 2.695 35.505 -6.505 336 HB3 SER 57 HB1 SER 57 3.595 34.066 -6.029 337 HG SER 57 HG SER 57 4.173 34.673 -8.584 338 H CYS 58 HN CYS 58 -0.208 33.628 -8.401 339 HA CYS 58 HA CYS 58 -1.297 33.678 -5.732 340 HB2 CYS 58 HB2 CYS 58 -2.344 34.998 -7.548 341 HB3 CYS 58 HB1 CYS 58 -2.784 33.490 -8.346 342 H LYS 59 HN LYS 59 -2.209 32.097 -4.650 343 HA LYS 59 HA LYS 59 -2.368 29.472 -5.958 344 HB2 LYS 59 HB2 LYS 59 -1.551 30.065 -3.106 345 HB3 LYS 59 HB1 LYS 59 -1.758 28.458 -3.788 346 HG2 LYS 59 HG2 LYS 59 0.275 30.501 -4.674 347 HG3 LYS 59 HG1 LYS 59 0.598 29.083 -3.675 348 HD2 LYS 59 HD2 LYS 59 -0.068 27.619 -5.505 349 HD3 LYS 59 HD1 LYS 59 -0.484 29.018 -6.496 350 HE2 LYS 59 HE2 LYS 59 1.686 28.142 -7.141 351 HE3 LYS 59 HE1 LYS 59 1.849 29.747 -6.434 352 HZ1 LYS 59 HZ1 LYS 59 2.587 28.761 -4.383 353 HZ2 LYS 59 HZ2 LYS 59 3.535 28.164 -5.643 354 HZ3 LYS 59 HZ3 LYS 59 2.315 27.205 -4.979 355 H CYS 60 HN CYS 60 -4.262 31.816 -5.151 356 HA CYS 60 HA CYS 60 -6.176 30.239 -3.599 357 HB2 CYS 60 HB2 CYS 60 -6.600 33.048 -4.491 358 HB3 CYS 60 HB1 CYS 60 -7.272 32.230 -3.095 359 H GLY 61 HN GLY 61 -7.619 29.174 -4.663 360 HA2 GLY 61 HA2 GLY 61 -8.137 29.847 -7.483 361 HA3 GLY 61 HA1 GLY 61 -8.257 28.230 -6.805 362 H SER 62 HN SER 62 -9.753 31.321 -7.125 363 HA SER 62 HA SER 62 -11.875 32.060 -6.952 364 HB2 SER 62 HB2 SER 62 -12.607 29.121 -6.812 365 HB3 SER 62 HB1 SER 62 -13.723 30.448 -7.133 366 HG SER 62 HG SER 62 -12.842 29.275 -9.019 367 H SER 63 HN SER 63 -13.750 32.232 -5.463 368 HA SER 63 HA SER 63 -14.748 32.409 -3.454 369 HB2 SER 63 HB2 SER 63 -12.977 30.119 -2.590 370 HB3 SER 63 HB1 SER 63 -14.408 30.705 -1.739 371 HG SER 63 HG SER 63 -14.860 30.138 -4.379 372 H CYS 64 HN CYS 64 -11.344 32.916 -3.703 373 HA CYS 64 HA CYS 64 -11.128 33.818 -0.954 374 HB2 CYS 64 HB2 CYS 64 -9.239 32.670 -2.134 375 HB3 CYS 64 HB1 CYS 64 -9.083 34.092 -3.158 376 H SER 65 HN SER 65 -10.170 36.014 -0.532 377 HA SER 65 HA SER 65 -11.961 37.984 -1.437 378 HB2 SER 65 HB2 SER 65 -9.318 38.386 -0.029 379 HB3 SER 65 HB1 SER 65 -10.661 39.527 -0.090 380 HG SER 65 HG SER 65 -11.651 37.255 0.779 381 H CYS 66 HN CYS 66 -8.902 36.924 -2.690 382 HA CYS 66 HA CYS 66 -8.586 39.331 -4.277 383 HB2 CYS 66 HB2 CYS 66 -6.539 38.259 -5.120 384 HB3 CYS 66 HB1 CYS 66 -6.569 38.321 -3.365 385 H LYS 67 HN LYS 67 -10.599 36.855 -4.494 386 HA LYS 67 HA LYS 67 -10.315 36.489 -7.403 387 HB2 LYS 67 HB2 LYS 67 -11.881 34.877 -5.379 388 HB3 LYS 67 HB1 LYS 67 -11.840 34.557 -7.104 389 HG2 LYS 67 HG2 LYS 67 -9.413 34.489 -5.321 390 HG3 LYS 67 HG1 LYS 67 -10.381 33.071 -5.730 391 HD2 LYS 67 HD2 LYS 67 -8.900 32.858 -7.421 392 HD3 LYS 67 HD1 LYS 67 -9.889 34.097 -8.196 393 HE2 LYS 67 HE2 LYS 67 -7.653 34.835 -8.387 394 HE3 LYS 67 HE1 LYS 67 -8.391 35.784 -7.089 395 HZ1 LYS 67 HZ1 LYS 67 -7.274 34.517 -5.470 396 HZ2 LYS 67 HZ2 LYS 67 -6.112 34.914 -6.619 397 HZ3 LYS 67 HZ3 LYS 67 -6.770 33.357 -6.594 Start of MODEL 5 1 HA2 GLY 1 HA1 GLY 1 -6.707 13.399 -11.052 2 HA3 GLY 1 HA2 GLY 1 -7.748 14.336 -12.115 3 H SER 2 HN SER 2 -9.135 15.853 -10.294 4 HA SER 2 HA SER 2 -6.991 17.541 -9.213 5 HB2 SER 2 HB2 SER 2 -8.394 18.580 -10.953 6 HB3 SER 2 HB1 SER 2 -9.826 18.275 -9.973 7 HG SER 2 HG SER 2 -9.324 20.286 -9.411 8 H GLY 3 HN GLY 3 -7.217 18.440 -7.150 9 HA2 GLY 3 HA2 GLY 3 -8.438 16.691 -5.253 10 HA3 GLY 3 HA1 GLY 3 -7.592 18.188 -4.894 11 H LYS 4 HN LYS 4 -9.198 19.941 -6.420 12 HA LYS 4 HA LYS 4 -11.566 19.953 -4.690 13 HB2 LYS 4 HB2 LYS 4 -10.190 22.177 -6.168 14 HB3 LYS 4 HB1 LYS 4 -11.684 22.372 -5.270 15 HG2 LYS 4 HG2 LYS 4 -10.534 21.745 -3.211 16 HG3 LYS 4 HG1 LYS 4 -9.034 21.538 -4.117 17 HD2 LYS 4 HD2 LYS 4 -10.596 24.115 -3.905 18 HD3 LYS 4 HD1 LYS 4 -9.150 23.726 -2.972 19 HE2 LYS 4 HE2 LYS 4 -7.820 23.626 -4.973 20 HE3 LYS 4 HE1 LYS 4 -9.248 23.806 -5.986 21 HZ1 LYS 4 HZ1 LYS 4 -9.559 26.018 -5.118 22 HZ2 LYS 4 HZ2 LYS 4 -8.013 25.862 -5.778 23 HZ3 LYS 4 HZ3 LYS 4 -8.224 25.841 -4.100 24 H GLY 5 HN GLY 5 -13.414 19.373 -5.567 25 HA2 GLY 5 HA2 GLY 5 -15.258 19.670 -6.938 26 HA3 GLY 5 HA1 GLY 5 -14.271 20.635 -8.017 27 H LYS 6 HN LYS 6 -12.230 18.723 -8.474 28 HA LYS 6 HA LYS 6 -11.686 17.043 -9.904 29 HB2 LYS 6 HB2 LYS 6 -14.351 15.975 -8.973 30 HB3 LYS 6 HB1 LYS 6 -13.409 15.142 -10.197 31 HG2 LYS 6 HG2 LYS 6 -12.915 14.077 -8.165 32 HG3 LYS 6 HG1 LYS 6 -11.521 15.096 -8.520 33 HD2 LYS 6 HD2 LYS 6 -12.329 16.773 -6.955 34 HD3 LYS 6 HD1 LYS 6 -13.763 15.796 -6.629 35 HE2 LYS 6 HE2 LYS 6 -12.341 13.998 -5.781 36 HE3 LYS 6 HE1 LYS 6 -10.913 14.978 -6.108 37 HZ1 LYS 6 HZ1 LYS 6 -11.626 15.041 -3.770 38 HZ2 LYS 6 HZ2 LYS 6 -13.082 15.756 -4.241 39 HZ3 LYS 6 HZ3 LYS 6 -11.623 16.571 -4.488 40 H GLY 7 HN GLY 7 -13.324 19.442 -10.591 41 HA2 GLY 7 HA2 GLY 7 -13.494 19.003 -13.370 42 HA3 GLY 7 HA1 GLY 7 -15.104 18.975 -12.656 43 H GLU 8 HN GLU 8 -14.808 20.867 -14.391 44 HA GLU 8 HA GLU 8 -13.621 23.279 -13.546 45 HB2 GLU 8 HB2 GLU 8 -15.901 22.780 -15.455 46 HB3 GLU 8 HB1 GLU 8 -15.049 24.308 -15.284 47 HG2 GLU 8 HG2 GLU 8 -13.066 23.425 -16.173 48 HG3 GLU 8 HG1 GLU 8 -13.631 21.765 -15.995 49 H LYS 9 HN LYS 9 -17.006 22.214 -13.510 50 HA LYS 9 HA LYS 9 -18.815 22.857 -12.335 51 HB2 LYS 9 HB2 LYS 9 -16.716 23.531 -10.292 52 HB3 LYS 9 HB1 LYS 9 -18.441 23.538 -9.958 53 HG2 LYS 9 HG2 LYS 9 -18.483 21.120 -10.655 54 HG3 LYS 9 HG1 LYS 9 -16.721 21.180 -10.698 55 HD2 LYS 9 HD2 LYS 9 -17.514 20.271 -8.574 56 HD3 LYS 9 HD1 LYS 9 -16.688 21.811 -8.329 57 HE2 LYS 9 HE2 LYS 9 -18.793 22.965 -8.126 58 HE3 LYS 9 HE1 LYS 9 -19.683 21.500 -8.542 59 HZ1 LYS 9 HZ1 LYS 9 -18.874 20.483 -6.503 60 HZ2 LYS 9 HZ2 LYS 9 -19.701 21.916 -6.163 61 HZ3 LYS 9 HZ3 LYS 9 -18.016 21.886 -6.115 62 H CYS 10 HN CYS 10 -18.267 24.605 -14.171 63 HA CYS 10 HA CYS 10 -18.315 27.246 -12.977 64 HB2 CYS 10 HB2 CYS 10 -18.265 26.422 -15.872 65 HB3 CYS 10 HB1 CYS 10 -18.247 28.086 -15.305 66 H THR 11 HN THR 11 -19.967 28.632 -12.987 67 HA THR 11 HA THR 11 -22.573 27.406 -13.247 68 HB THR 11 HB THR 11 -23.361 29.496 -12.164 69 HG1 THR 11 HG1 THR 11 -22.001 31.129 -11.806 70 HG21 THR 11 HG21 THR 11 -22.661 27.580 -10.785 71 HG22 THR 11 HG22 THR 11 -22.292 29.112 -9.991 72 HG23 THR 11 HG23 THR 11 -21.007 28.198 -10.777 73 H SER 12 HN SER 12 -24.299 29.219 -13.962 74 HA SER 12 HA SER 12 -24.008 29.495 -16.731 75 HB2 SER 12 HB2 SER 12 -26.080 30.954 -16.497 76 HB3 SER 12 HB1 SER 12 -26.206 29.320 -15.846 77 HG SER 12 HG SER 12 -26.100 31.776 -14.522 78 H ALA 13 HN ALA 13 -23.275 31.641 -14.080 79 HA ALA 13 HA ALA 13 -23.095 34.062 -15.480 80 HB1 ALA 13 HB1 ALA 13 -23.107 33.972 -13.051 81 HB2 ALA 13 HB2 ALA 13 -21.665 34.809 -13.624 82 HB3 ALA 13 HB3 ALA 13 -21.550 33.144 -13.056 83 H CYS 14 HN CYS 14 -20.591 31.661 -14.720 84 HA CYS 14 HA CYS 14 -18.525 32.986 -16.122 85 HB2 CYS 14 HB2 CYS 14 -18.144 31.284 -14.361 86 HB3 CYS 14 HB1 CYS 14 -18.776 30.052 -15.437 87 H ARG 15 HN ARG 15 -21.007 30.755 -17.039 88 HA ARG 15 HA ARG 15 -19.856 30.239 -19.637 89 HB2 ARG 15 HB2 ARG 15 -22.434 29.383 -18.347 90 HB3 ARG 15 HB1 ARG 15 -22.053 29.021 -20.025 91 HG2 ARG 15 HG2 ARG 15 -20.533 28.120 -17.585 92 HG3 ARG 15 HG1 ARG 15 -21.490 27.121 -18.685 93 HD2 ARG 15 HD2 ARG 15 -19.937 27.823 -20.521 94 HD3 ARG 15 HD1 ARG 15 -18.929 28.584 -19.298 95 HE ARG 15 HE ARG 15 -19.043 26.119 -18.347 96 HH11 ARG 15 HH11 ARG 15 -18.575 27.240 -21.639 97 HH12 ARG 15 HH12 ARG 15 -17.595 25.895 -22.100 98 HH21 ARG 15 HH21 ARG 15 -17.731 24.335 -18.952 99 HH22 ARG 15 HH22 ARG 15 -17.113 24.230 -20.565 100 H SER 16 HN SER 16 -20.901 32.962 -18.650 101 HA SER 16 HA SER 16 -22.522 33.546 -21.023 102 HB2 SER 16 HB2 SER 16 -22.099 35.194 -18.518 103 HB3 SER 16 HB1 SER 16 -23.152 35.624 -19.867 104 HG SER 16 HG SER 16 -23.417 33.300 -18.236 105 H GLU 17 HN GLU 17 -21.960 35.604 -22.145 106 HA GLU 17 HA GLU 17 -19.088 36.168 -21.896 107 HB2 GLU 17 HB2 GLU 17 -20.696 36.059 -24.450 108 HB3 GLU 17 HB1 GLU 17 -19.003 36.517 -24.329 109 HG2 GLU 17 HG2 GLU 17 -18.526 34.257 -23.413 110 HG3 GLU 17 HG1 GLU 17 -20.204 33.827 -23.738 111 HA PRO 18 HA PRO 18 -17.849 37.450 -21.324 112 HB2 PRO 18 HB2 PRO 18 -17.252 39.285 -19.473 113 HB3 PRO 18 HB1 PRO 18 -17.018 39.612 -21.196 114 HG2 PRO 18 HG2 PRO 18 -19.261 40.456 -19.399 115 HG3 PRO 18 HG1 PRO 18 -18.380 41.409 -20.607 116 HD2 PRO 18 HD2 PRO 18 -20.820 40.267 -21.075 117 HD3 PRO 18 HD1 PRO 18 -19.627 40.580 -22.348 118 H CYS 19 HN CYS 19 -17.135 36.787 -19.091 119 HA CYS 19 HA CYS 19 -19.085 35.321 -17.781 120 HB2 CYS 19 HB2 CYS 19 -16.412 36.281 -16.770 121 HB3 CYS 19 HB1 CYS 19 -17.422 35.114 -15.923 122 H GLN 20 HN GLN 20 -20.513 35.708 -16.301 123 HA GLN 20 HA GLN 20 -20.775 38.444 -15.304 124 HB2 GLN 20 HB2 GLN 20 -22.703 36.124 -15.223 125 HB3 GLN 20 HB1 GLN 20 -23.053 37.761 -14.691 126 HG2 GLN 20 HG2 GLN 20 -22.317 36.993 -17.503 127 HG3 GLN 20 HG1 GLN 20 -23.959 37.222 -16.915 128 HE21 GLN 20 HE21 GLN 20 -21.012 38.750 -17.853 129 HE22 GLN 20 HE22 GLN 20 -21.598 40.378 -17.843 130 H CYS 21 HN CYS 21 -19.137 35.933 -14.365 131 HA CYS 21 HA CYS 21 -19.940 35.358 -11.750 132 HB2 CYS 21 HB2 CYS 21 -17.426 35.130 -13.302 133 HB3 CYS 21 HB1 CYS 21 -17.323 34.914 -11.561 134 H GLY 22 HN GLY 22 -17.924 37.882 -13.126 135 HA2 GLY 22 HA2 GLY 22 -17.266 39.901 -12.316 136 HA3 GLY 22 HA1 GLY 22 -18.483 39.710 -11.069 137 H SER 23 HN SER 23 -17.324 40.472 -9.393 138 HA SER 23 HA SER 23 -14.660 39.459 -8.887 139 HB2 SER 23 HB2 SER 23 -16.312 41.457 -7.346 140 HB3 SER 23 HB1 SER 23 -14.596 41.117 -7.112 141 HG SER 23 HG SER 23 -14.948 41.616 -9.679 142 H LYS 24 HN LYS 24 -17.788 38.477 -8.124 143 HA LYS 24 HA LYS 24 -17.074 37.447 -5.502 144 HB2 LYS 24 HB2 LYS 24 -19.573 37.071 -7.162 145 HB3 LYS 24 HB1 LYS 24 -19.347 36.471 -5.527 146 HG2 LYS 24 HG2 LYS 24 -19.486 39.336 -6.413 147 HG3 LYS 24 HG1 LYS 24 -20.658 38.454 -5.432 148 HD2 LYS 24 HD2 LYS 24 -18.918 38.181 -3.695 149 HD3 LYS 24 HD1 LYS 24 -17.834 39.174 -4.672 150 HE2 LYS 24 HE2 LYS 24 -19.574 40.965 -4.597 151 HE3 LYS 24 HE1 LYS 24 -20.440 39.971 -3.426 152 HZ1 LYS 24 HZ1 LYS 24 -17.690 41.043 -3.099 153 HZ2 LYS 24 HZ2 LYS 24 -18.489 40.070 -1.975 154 HZ3 LYS 24 HZ3 LYS 24 -19.074 41.618 -2.320 155 H CYS 25 HN CYS 25 -18.154 36.239 -8.600 156 HA CYS 25 HA CYS 25 -17.657 34.451 -9.815 157 HB2 CYS 25 HB2 CYS 25 -15.342 35.342 -9.349 158 HB3 CYS 25 HB1 CYS 25 -15.210 34.080 -8.126 159 H GLN 26 HN GLN 26 -19.155 33.043 -9.465 160 HA GLN 26 HA GLN 26 -19.049 31.368 -7.084 161 HB2 GLN 26 HB2 GLN 26 -21.208 32.028 -9.035 162 HB3 GLN 26 HB1 GLN 26 -21.350 30.604 -8.015 163 HG2 GLN 26 HG2 GLN 26 -21.291 31.906 -6.034 164 HG3 GLN 26 HG1 GLN 26 -20.814 33.351 -6.922 165 HE21 GLN 26 HE21 GLN 26 -22.344 34.550 -7.950 166 HE22 GLN 26 HE22 GLN 26 -24.043 34.276 -7.775 167 H CYS 27 HN CYS 27 -17.485 30.981 -9.860 168 HA CYS 27 HA CYS 27 -18.225 28.147 -10.073 169 HB2 CYS 27 HB2 CYS 27 -17.039 28.022 -12.159 170 HB3 CYS 27 HB1 CYS 27 -18.194 29.352 -12.249 171 H GLY 28 HN GLY 28 -16.390 26.614 -10.497 172 HA2 GLY 28 HA2 GLY 28 -14.534 26.884 -8.310 173 HA3 GLY 28 HA1 GLY 28 -14.692 25.505 -9.389 174 H GLU 29 HN GLU 29 -13.112 25.176 -10.778 175 HA GLU 29 HA GLU 29 -11.479 27.429 -11.712 176 HB2 GLU 29 HB2 GLU 29 -10.370 24.904 -10.467 177 HB3 GLU 29 HB1 GLU 29 -9.411 26.087 -11.337 178 HG2 GLU 29 HG2 GLU 29 -9.917 27.765 -9.669 179 HG3 GLU 29 HG1 GLU 29 -10.958 26.627 -8.815 180 H GLY 30 HN GLY 30 -9.666 26.192 -13.245 181 HA2 GLY 30 HA2 GLY 30 -9.350 24.542 -14.916 182 HA3 GLY 30 HA1 GLY 30 -11.056 24.144 -14.813 183 H CYS 31 HN CYS 31 -11.943 26.913 -15.002 184 HA CYS 31 HA CYS 31 -12.102 27.087 -17.820 185 HB2 CYS 31 HB2 CYS 31 -13.296 29.226 -17.338 186 HB3 CYS 31 HB1 CYS 31 -13.937 27.837 -16.464 187 H THR 32 HN THR 32 -10.224 28.729 -15.366 188 HA THR 32 HA THR 32 -8.602 30.306 -15.398 189 HB THR 32 HB THR 32 -6.819 29.999 -17.117 190 HG1 THR 32 HG1 THR 32 -8.809 28.741 -18.434 191 HG21 THR 32 HG21 THR 32 -6.180 27.739 -16.391 192 HG22 THR 32 HG22 THR 32 -7.821 27.475 -15.800 193 HG23 THR 32 HG23 THR 32 -6.800 28.703 -15.049 194 H CYS 33 HN CYS 33 -10.926 31.328 -16.270 195 HA CYS 33 HA CYS 33 -10.877 32.674 -18.727 196 HB2 CYS 33 HB2 CYS 33 -12.306 33.285 -16.150 197 HB3 CYS 33 HB1 CYS 33 -12.667 34.054 -17.693 198 H ALA 34 HN ALA 34 -11.012 35.134 -18.815 199 HA ALA 34 HA ALA 34 -8.734 36.275 -17.340 200 HB1 ALA 34 HB1 ALA 34 -8.474 36.243 -19.781 201 HB2 ALA 34 HB2 ALA 34 -8.568 37.896 -19.173 202 HB3 ALA 34 HB3 ALA 34 -9.969 37.163 -19.954 203 H ALA 35 HN ALA 35 -11.897 36.058 -17.090 204 HA ALA 35 HA ALA 35 -12.366 38.882 -16.442 205 HB1 ALA 35 HB1 ALA 35 -13.922 37.977 -18.076 206 HB2 ALA 35 HB2 ALA 35 -14.763 38.334 -16.566 207 HB3 ALA 35 HB3 ALA 35 -14.346 36.670 -16.974 208 H CYS 36 HN CYS 36 -13.743 35.807 -15.270 209 HA CYS 36 HA CYS 36 -13.847 36.884 -12.620 210 HB2 CYS 36 HB2 CYS 36 -14.789 34.619 -12.050 211 HB3 CYS 36 HB1 CYS 36 -15.681 35.573 -13.222 212 H LYS 37 HN LYS 37 -11.688 34.920 -14.429 213 HA LYS 37 HA LYS 37 -10.361 34.049 -12.009 214 HB2 LYS 37 HB2 LYS 37 -10.403 33.055 -14.766 215 HB3 LYS 37 HB1 LYS 37 -8.823 33.001 -13.996 216 HG2 LYS 37 HG2 LYS 37 -10.102 30.913 -13.725 217 HG3 LYS 37 HG1 LYS 37 -9.691 31.672 -12.187 218 HD2 LYS 37 HD2 LYS 37 -11.997 32.736 -12.269 219 HD3 LYS 37 HD1 LYS 37 -12.340 31.627 -13.599 220 HE2 LYS 37 HE2 LYS 37 -11.962 29.727 -12.195 221 HE3 LYS 37 HE1 LYS 37 -11.392 30.753 -10.879 222 HZ1 LYS 37 HZ1 LYS 37 -13.620 31.712 -10.734 223 HZ2 LYS 37 HZ2 LYS 37 -13.656 30.034 -10.513 224 HZ3 LYS 37 HZ3 LYS 37 -14.149 30.701 -11.981 225 H THR 38 HN THR 38 -9.165 35.479 -11.141 226 HA THR 38 HA THR 38 -6.750 36.335 -12.307 227 HB THR 38 HB THR 38 -8.311 37.947 -13.439 228 HG1 THR 38 HG1 THR 38 -6.947 39.611 -13.127 229 HG21 THR 38 HG21 THR 38 -9.366 39.716 -12.067 230 HG22 THR 38 HG22 THR 38 -8.866 38.863 -10.607 231 HG23 THR 38 HG23 THR 38 -10.024 38.119 -11.709 232 H CYS 39 HN CYS 39 -6.051 38.316 -10.700 233 HA CYS 39 HA CYS 39 -6.909 37.656 -7.992 234 HB2 CYS 39 HB2 CYS 39 -4.823 36.381 -8.481 235 HB3 CYS 39 HB1 CYS 39 -4.010 37.900 -8.841 236 H ASN 40 HN ASN 40 -7.348 39.451 -6.889 237 HA ASN 40 HA ASN 40 -6.966 42.016 -8.099 238 HB2 ASN 40 HB2 ASN 40 -8.063 41.144 -5.433 239 HB3 ASN 40 HB1 ASN 40 -7.848 42.845 -5.828 240 HD21 ASN 40 HD21 ASN 40 -9.660 39.958 -6.471 241 HD22 ASN 40 HD22 ASN 40 -10.912 40.707 -7.382 242 H CYS 41 HN CYS 41 -5.137 40.074 -6.000 243 HA CYS 41 HA CYS 41 -3.686 42.079 -4.654 244 HB2 CYS 41 HB2 CYS 41 -2.883 39.243 -5.280 245 HB3 CYS 41 HB1 CYS 41 -2.213 40.270 -4.015 246 H THR 42 HN THR 42 -1.804 43.093 -5.171 247 HA THR 42 HA THR 42 -0.791 42.641 -7.897 248 HB THR 42 HB THR 42 -0.204 45.051 -7.922 249 HG1 THR 42 HG1 THR 42 -1.849 45.735 -5.839 250 HG21 THR 42 HG21 THR 42 -2.504 45.922 -8.115 251 HG22 THR 42 HG22 THR 42 -3.105 44.475 -7.301 252 HG23 THR 42 HG23 THR 42 -2.339 44.342 -8.884 253 H SER 43 HN SER 43 1.511 43.618 -8.101 254 HA SER 43 HA SER 43 3.263 42.241 -6.399 255 HB2 SER 43 HB2 SER 43 3.924 44.619 -8.147 256 HB3 SER 43 HB1 SER 43 5.035 43.364 -7.599 257 HG SER 43 HG SER 43 3.906 43.306 -9.823 258 H ASP 44 HN ASP 44 1.731 45.284 -6.071 259 HA ASP 44 HA ASP 44 3.597 46.591 -4.385 260 HB2 ASP 44 HB2 ASP 44 1.781 47.759 -5.602 261 HB3 ASP 44 HB1 ASP 44 0.602 46.970 -4.562 262 H GLY 45 HN GLY 45 0.851 44.464 -3.818 263 HA2 GLY 45 HA2 GLY 45 1.818 43.431 -1.451 264 HA3 GLY 45 HA1 GLY 45 0.756 44.767 -1.028 265 H CYS 46 HN CYS 46 0.537 41.841 -0.649 266 HA CYS 46 HA CYS 46 -1.499 40.823 -2.297 267 HB2 CYS 46 HB2 CYS 46 -0.090 39.449 -0.759 268 HB3 CYS 46 HB1 CYS 46 -0.972 40.134 0.602 269 H LYS 47 HN LYS 47 -3.636 41.136 -2.315 270 HA LYS 47 HA LYS 47 -4.629 43.174 -0.485 271 HB2 LYS 47 HB2 LYS 47 -5.776 42.194 -3.096 272 HB3 LYS 47 HB1 LYS 47 -6.491 43.444 -2.092 273 HG2 LYS 47 HG2 LYS 47 -3.835 43.563 -3.514 274 HG3 LYS 47 HG1 LYS 47 -5.291 44.479 -3.898 275 HD2 LYS 47 HD2 LYS 47 -3.647 44.709 -1.372 276 HD3 LYS 47 HD1 LYS 47 -3.655 45.855 -2.708 277 HE2 LYS 47 HE2 LYS 47 -6.028 46.308 -2.298 278 HE3 LYS 47 HE1 LYS 47 -6.011 45.162 -0.960 279 HZ1 LYS 47 HZ1 LYS 47 -4.436 46.550 0.195 280 HZ2 LYS 47 HZ2 LYS 47 -5.790 47.469 -0.225 281 HZ3 LYS 47 HZ3 LYS 47 -4.363 47.622 -1.107 282 H CYS 48 HN CYS 48 -4.823 39.815 -0.932 283 HA CYS 48 HA CYS 48 -7.375 39.782 0.532 284 HB2 CYS 48 HB2 CYS 48 -7.569 37.446 0.031 285 HB3 CYS 48 HB1 CYS 48 -7.130 38.273 -1.458 286 H GLY 49 HN GLY 49 -4.043 38.694 0.757 287 HA2 GLY 49 HA2 GLY 49 -2.960 39.053 2.882 288 HA3 GLY 49 HA1 GLY 49 -4.445 38.534 3.670 289 H LYS 50 HN LYS 50 -3.616 36.723 0.894 290 HA LYS 50 HA LYS 50 -2.768 34.497 2.593 291 HB2 LYS 50 HB2 LYS 50 -3.394 34.534 -0.366 292 HB3 LYS 50 HB1 LYS 50 -3.091 33.105 0.608 293 HG2 LYS 50 HG2 LYS 50 -5.414 34.993 0.947 294 HG3 LYS 50 HG1 LYS 50 -5.469 33.428 0.138 295 HD2 LYS 50 HD2 LYS 50 -4.787 32.358 2.266 296 HD3 LYS 50 HD1 LYS 50 -4.858 33.941 3.046 297 HE2 LYS 50 HE2 LYS 50 -7.231 34.120 2.426 298 HE3 LYS 50 HE1 LYS 50 -7.150 32.519 1.697 299 HZ1 LYS 50 HZ1 LYS 50 -6.772 33.183 4.562 300 HZ2 LYS 50 HZ2 LYS 50 -6.546 31.642 3.897 301 HZ3 LYS 50 HZ3 LYS 50 -8.077 32.352 3.874 302 H GLU 51 HN GLU 51 -1.329 36.999 1.318 303 HA GLU 51 HA GLU 51 0.787 37.587 0.853 304 HB2 GLU 51 HB2 GLU 51 1.282 35.882 2.687 305 HB3 GLU 51 HB1 GLU 51 1.642 34.744 1.399 306 HG2 GLU 51 HG2 GLU 51 3.451 36.129 0.619 307 HG3 GLU 51 HG1 GLU 51 3.033 37.381 1.785 308 H CYS 52 HN CYS 52 -0.949 36.815 -1.202 309 HA CYS 52 HA CYS 52 0.954 35.781 -3.183 310 HB2 CYS 52 HB2 CYS 52 -1.002 35.261 -4.560 311 HB3 CYS 52 HB1 CYS 52 -1.040 34.380 -3.038 312 H THR 53 HN THR 53 1.315 36.984 -5.007 313 HA THR 53 HA THR 53 -0.075 39.534 -5.166 314 HB THR 53 HB THR 53 2.115 40.663 -5.652 315 HG1 THR 53 HG1 THR 53 3.259 38.653 -6.048 316 HG21 THR 53 HG21 THR 53 0.985 40.830 -3.447 317 HG22 THR 53 HG22 THR 53 2.743 40.901 -3.298 318 HG23 THR 53 HG23 THR 53 1.880 39.414 -2.901 319 H GLY 54 HN GLY 54 -1.077 39.334 -7.012 320 HA2 GLY 54 HA2 GLY 54 -1.134 39.571 -9.345 321 HA3 GLY 54 HA1 GLY 54 0.515 38.960 -9.421 322 HA PRO 55 HA PRO 55 -2.978 35.621 -9.997 323 HB2 PRO 55 HB2 PRO 55 -2.897 35.510 -12.761 324 HB3 PRO 55 HB1 PRO 55 -4.133 36.349 -11.819 325 HG2 PRO 55 HG2 PRO 55 -1.705 37.447 -13.169 326 HG3 PRO 55 HG1 PRO 55 -3.331 38.145 -13.048 327 HD2 PRO 55 HD2 PRO 55 -1.301 39.013 -11.517 328 HD3 PRO 55 HD1 PRO 55 -2.965 38.935 -10.900 329 H ASP 56 HN ASP 56 0.023 36.412 -11.592 330 HA ASP 56 HA ASP 56 0.758 33.841 -12.476 331 HB2 ASP 56 HB2 ASP 56 2.608 36.072 -11.616 332 HB3 ASP 56 HB1 ASP 56 2.993 34.739 -12.698 333 H SER 57 HN SER 57 1.489 35.619 -9.510 334 HA SER 57 HA SER 57 2.720 33.215 -8.388 335 HB2 SER 57 HB2 SER 57 2.758 36.059 -7.358 336 HB3 SER 57 HB1 SER 57 3.696 34.704 -6.728 337 HG SER 57 HG SER 57 4.100 36.252 -8.980 338 H CYS 58 HN CYS 58 -0.261 33.905 -8.664 339 HA CYS 58 HA CYS 58 -1.151 34.226 -5.977 340 HB2 CYS 58 HB2 CYS 58 -2.515 34.970 -7.897 341 HB3 CYS 58 HB1 CYS 58 -2.715 33.289 -8.382 342 H LYS 59 HN LYS 59 -1.420 32.749 -4.471 343 HA LYS 59 HA LYS 59 -1.021 29.951 -5.232 344 HB2 LYS 59 HB2 LYS 59 -0.880 31.268 -2.516 345 HB3 LYS 59 HB1 LYS 59 -0.587 29.566 -2.830 346 HG2 LYS 59 HG2 LYS 59 1.058 31.896 -3.804 347 HG3 LYS 59 HG1 LYS 59 1.514 30.707 -2.584 348 HD2 LYS 59 HD2 LYS 59 1.034 30.169 -5.522 349 HD3 LYS 59 HD1 LYS 59 2.596 30.214 -4.709 350 HE2 LYS 59 HE2 LYS 59 1.952 28.290 -3.343 351 HE3 LYS 59 HE1 LYS 59 0.372 28.263 -4.120 352 HZ1 LYS 59 HZ1 LYS 59 1.872 26.624 -5.071 353 HZ2 LYS 59 HZ2 LYS 59 2.965 27.840 -5.502 354 HZ3 LYS 59 HZ3 LYS 59 1.439 27.782 -6.223 355 H CYS 60 HN CYS 60 -3.462 32.061 -4.649 356 HA CYS 60 HA CYS 60 -5.174 30.209 -3.245 357 HB2 CYS 60 HB2 CYS 60 -5.906 32.876 -4.426 358 HB3 CYS 60 HB1 CYS 60 -6.734 32.004 -3.146 359 H GLY 61 HN GLY 61 -6.958 29.222 -4.141 360 HA2 GLY 61 HA2 GLY 61 -6.960 29.151 -7.097 361 HA3 GLY 61 HA1 GLY 61 -7.245 27.743 -6.091 362 H SER 62 HN SER 62 -8.537 30.942 -6.824 363 HA SER 62 HA SER 62 -10.634 31.743 -7.078 364 HB2 SER 62 HB2 SER 62 -10.866 29.718 -8.569 365 HB3 SER 62 HB1 SER 62 -11.589 28.873 -7.201 366 HG SER 62 HG SER 62 -13.333 29.702 -8.146 367 H SER 63 HN SER 63 -12.828 31.835 -6.042 368 HA SER 63 HA SER 63 -14.230 31.943 -4.276 369 HB2 SER 63 HB2 SER 63 -13.987 29.470 -4.205 370 HB3 SER 63 HB1 SER 63 -12.638 29.657 -3.088 371 HG SER 63 HG SER 63 -14.326 30.952 -1.843 372 H CYS 64 HN CYS 64 -10.868 32.338 -3.839 373 HA CYS 64 HA CYS 64 -10.976 33.264 -1.130 374 HB2 CYS 64 HB2 CYS 64 -8.921 32.284 -2.226 375 HB3 CYS 64 HB1 CYS 64 -8.782 33.774 -3.152 376 H SER 65 HN SER 65 -10.209 35.510 -0.586 377 HA SER 65 HA SER 65 -12.094 37.349 -1.564 378 HB2 SER 65 HB2 SER 65 -9.604 38.010 -0.000 379 HB3 SER 65 HB1 SER 65 -11.132 38.892 -0.025 380 HG SER 65 HG SER 65 -10.433 36.986 1.625 381 H CYS 66 HN CYS 66 -8.845 36.619 -2.579 382 HA CYS 66 HA CYS 66 -8.386 39.099 -3.933 383 HB2 CYS 66 HB2 CYS 66 -6.472 37.875 -4.963 384 HB3 CYS 66 HB1 CYS 66 -6.477 37.817 -3.206 385 H LYS 67 HN LYS 67 -10.486 36.650 -4.544 386 HA LYS 67 HA LYS 67 -10.234 36.837 -7.468 387 HB2 LYS 67 HB2 LYS 67 -11.907 34.908 -5.852 388 HB3 LYS 67 HB1 LYS 67 -11.534 34.812 -7.569 389 HG2 LYS 67 HG2 LYS 67 -9.426 34.693 -5.435 390 HG3 LYS 67 HG1 LYS 67 -10.242 33.260 -6.053 391 HD2 LYS 67 HD2 LYS 67 -9.055 33.282 -7.968 392 HD3 LYS 67 HD1 LYS 67 -9.195 35.032 -8.138 393 HE2 LYS 67 HE2 LYS 67 -7.390 35.398 -6.626 394 HE3 LYS 67 HE1 LYS 67 -7.322 33.684 -6.191 395 HZ1 LYS 67 HZ1 LYS 67 -6.682 34.904 -8.809 396 HZ2 LYS 67 HZ2 LYS 67 -6.666 33.238 -8.493 397 HZ3 LYS 67 HZ3 LYS 67 -5.578 34.261 -7.692 Start of MODEL 6 1 HA2 GLY 1 HA1 GLY 1 -6.676 7.693 -21.790 2 HA3 GLY 1 HA2 GLY 1 -5.301 7.710 -20.695 3 H SER 2 HN SER 2 -5.634 7.916 -18.525 4 HA SER 2 HA SER 2 -8.172 7.267 -17.493 5 HB2 SER 2 HB2 SER 2 -7.008 7.849 -15.270 6 HB3 SER 2 HB1 SER 2 -6.322 6.543 -16.239 7 HG SER 2 HG SER 2 -4.562 7.646 -16.337 8 H GLY 3 HN GLY 3 -6.437 10.304 -17.798 9 HA2 GLY 3 HA2 GLY 3 -8.716 11.724 -16.601 10 HA3 GLY 3 HA1 GLY 3 -7.094 12.380 -16.796 11 H LYS 4 HN LYS 4 -8.914 10.607 -19.196 12 HA LYS 4 HA LYS 4 -8.497 12.694 -21.120 13 HB2 LYS 4 HB2 LYS 4 -8.338 10.321 -21.747 14 HB3 LYS 4 HB1 LYS 4 -10.032 10.099 -21.335 15 HG2 LYS 4 HG2 LYS 4 -10.682 11.611 -23.118 16 HG3 LYS 4 HG1 LYS 4 -8.985 11.893 -23.511 17 HD2 LYS 4 HD2 LYS 4 -8.706 9.544 -24.073 18 HD3 LYS 4 HD1 LYS 4 -10.381 9.221 -23.627 19 HE2 LYS 4 HE2 LYS 4 -9.437 11.020 -25.853 20 HE3 LYS 4 HE1 LYS 4 -10.141 9.417 -26.039 21 HZ1 LYS 4 HZ1 LYS 4 -11.759 11.168 -26.440 22 HZ2 LYS 4 HZ2 LYS 4 -11.533 11.770 -24.878 23 HZ3 LYS 4 HZ3 LYS 4 -12.196 10.236 -25.106 24 H GLY 5 HN GLY 5 -9.707 14.433 -21.007 25 HA2 GLY 5 HA2 GLY 5 -12.379 14.558 -21.593 26 HA3 GLY 5 HA1 GLY 5 -12.303 14.487 -19.836 27 H LYS 6 HN LYS 6 -12.734 16.586 -22.168 28 HA LYS 6 HA LYS 6 -11.171 18.684 -20.832 29 HB2 LYS 6 HB2 LYS 6 -11.980 18.537 -23.744 30 HB3 LYS 6 HB1 LYS 6 -11.178 19.905 -22.990 31 HG2 LYS 6 HG2 LYS 6 -10.047 17.129 -23.300 32 HG3 LYS 6 HG1 LYS 6 -9.592 18.557 -24.232 33 HD2 LYS 6 HD2 LYS 6 -8.795 19.638 -22.185 34 HD3 LYS 6 HD1 LYS 6 -9.257 18.216 -21.250 35 HE2 LYS 6 HE2 LYS 6 -7.674 16.869 -22.558 36 HE3 LYS 6 HE1 LYS 6 -7.199 18.314 -23.446 37 HZ1 LYS 6 HZ1 LYS 6 -6.504 19.287 -21.309 38 HZ2 LYS 6 HZ2 LYS 6 -5.627 17.904 -21.713 39 HZ3 LYS 6 HZ3 LYS 6 -6.843 17.818 -20.544 40 H GLY 7 HN GLY 7 -12.185 20.641 -20.443 41 HA2 GLY 7 HA2 GLY 7 -14.439 21.770 -21.259 42 HA3 GLY 7 HA1 GLY 7 -15.084 20.452 -20.291 43 H GLU 8 HN GLU 8 -16.015 22.269 -19.162 44 HA GLU 8 HA GLU 8 -14.238 23.024 -17.000 45 HB2 GLU 8 HB2 GLU 8 -15.585 25.282 -17.047 46 HB3 GLU 8 HB1 GLU 8 -14.160 25.067 -18.046 47 HG2 GLU 8 HG2 GLU 8 -16.002 26.175 -19.240 48 HG3 GLU 8 HG1 GLU 8 -15.523 24.659 -19.995 49 H LYS 9 HN LYS 9 -15.685 24.216 -15.355 50 HA LYS 9 HA LYS 9 -18.204 22.732 -14.967 51 HB2 LYS 9 HB2 LYS 9 -16.113 23.421 -12.875 52 HB3 LYS 9 HB1 LYS 9 -17.682 22.710 -12.524 53 HG2 LYS 9 HG2 LYS 9 -17.111 20.687 -13.641 54 HG3 LYS 9 HG1 LYS 9 -15.643 21.402 -14.308 55 HD2 LYS 9 HD2 LYS 9 -15.064 19.955 -12.465 56 HD3 LYS 9 HD1 LYS 9 -14.756 21.628 -12.007 57 HE2 LYS 9 HE2 LYS 9 -16.846 21.680 -10.755 58 HE3 LYS 9 HE1 LYS 9 -17.203 20.027 -11.256 59 HZ1 LYS 9 HZ1 LYS 9 -14.892 20.870 -9.593 60 HZ2 LYS 9 HZ2 LYS 9 -15.219 19.290 -10.079 61 HZ3 LYS 9 HZ3 LYS 9 -16.278 20.087 -9.030 62 H CYS 10 HN CYS 10 -17.898 25.184 -16.204 63 HA CYS 10 HA CYS 10 -18.446 27.263 -14.278 64 HB2 CYS 10 HB2 CYS 10 -18.165 27.408 -17.272 65 HB3 CYS 10 HB1 CYS 10 -18.235 28.769 -16.162 66 H THR 11 HN THR 11 -20.212 28.712 -14.487 67 HA THR 11 HA THR 11 -22.669 27.357 -15.245 68 HB THR 11 HB THR 11 -23.749 29.265 -14.022 69 HG1 THR 11 HG1 THR 11 -22.451 30.717 -12.948 70 HG21 THR 11 HG21 THR 11 -21.642 27.736 -12.485 71 HG22 THR 11 HG22 THR 11 -23.260 27.154 -12.876 72 HG23 THR 11 HG23 THR 11 -23.055 28.524 -11.785 73 H SER 12 HN SER 12 -24.416 29.083 -16.019 74 HA SER 12 HA SER 12 -23.762 29.800 -18.623 75 HB2 SER 12 HB2 SER 12 -25.975 30.900 -16.888 76 HB3 SER 12 HB1 SER 12 -25.904 30.991 -18.648 77 HG SER 12 HG SER 12 -27.115 29.178 -17.504 78 H ALA 13 HN ALA 13 -23.690 31.730 -15.671 79 HA ALA 13 HA ALA 13 -23.356 34.257 -16.848 80 HB1 ALA 13 HB1 ALA 13 -22.329 33.313 -14.173 81 HB2 ALA 13 HB2 ALA 13 -23.951 33.933 -14.492 82 HB3 ALA 13 HB3 ALA 13 -22.549 34.989 -14.681 83 H CYS 14 HN CYS 14 -20.969 31.837 -15.856 84 HA CYS 14 HA CYS 14 -18.724 33.480 -16.529 85 HB2 CYS 14 HB2 CYS 14 -18.777 31.527 -14.883 86 HB3 CYS 14 HB1 CYS 14 -18.757 30.481 -16.290 87 H ARG 15 HN ARG 15 -20.820 31.313 -18.202 88 HA ARG 15 HA ARG 15 -19.115 31.130 -20.555 89 HB2 ARG 15 HB2 ARG 15 -21.774 29.956 -19.803 90 HB3 ARG 15 HB1 ARG 15 -21.212 29.915 -21.464 91 HG2 ARG 15 HG2 ARG 15 -19.210 28.675 -20.727 92 HG3 ARG 15 HG1 ARG 15 -19.852 28.667 -19.081 93 HD2 ARG 15 HD2 ARG 15 -21.706 27.343 -19.708 94 HD3 ARG 15 HD1 ARG 15 -21.404 27.599 -21.422 95 HE ARG 15 HE ARG 15 -19.484 26.085 -19.768 96 HH11 ARG 15 HH11 ARG 15 -21.700 26.272 -22.506 97 HH12 ARG 15 HH12 ARG 15 -21.216 24.749 -23.163 98 HH21 ARG 15 HH21 ARG 15 -18.854 24.044 -20.661 99 HH22 ARG 15 HH22 ARG 15 -19.608 23.491 -22.121 100 H SER 16 HN SER 16 -20.658 33.630 -19.463 101 HA SER 16 HA SER 16 -22.255 34.317 -21.790 102 HB2 SER 16 HB2 SER 16 -21.597 35.918 -19.308 103 HB3 SER 16 HB1 SER 16 -22.778 36.368 -20.536 104 HG SER 16 HG SER 16 -23.062 33.842 -19.412 105 H GLU 17 HN GLU 17 -21.851 36.766 -22.490 106 HA GLU 17 HA GLU 17 -18.976 37.201 -22.756 107 HB2 GLU 17 HB2 GLU 17 -19.729 36.143 -24.807 108 HB3 GLU 17 HB1 GLU 17 -20.994 37.344 -25.003 109 HG2 GLU 17 HG2 GLU 17 -18.123 38.184 -24.916 110 HG3 GLU 17 HG1 GLU 17 -18.799 37.501 -26.391 111 HA PRO 18 HA PRO 18 -17.657 38.343 -22.234 112 HB2 PRO 18 HB2 PRO 18 -16.700 39.885 -20.245 113 HB3 PRO 18 HB1 PRO 18 -16.676 40.427 -21.927 114 HG2 PRO 18 HG2 PRO 18 -18.597 41.125 -19.744 115 HG3 PRO 18 HG1 PRO 18 -17.847 42.183 -20.954 116 HD2 PRO 18 HD2 PRO 18 -20.390 41.205 -21.170 117 HD3 PRO 18 HD1 PRO 18 -19.380 41.627 -22.566 118 H CYS 19 HN CYS 19 -16.572 37.854 -19.808 119 HA CYS 19 HA CYS 19 -18.272 35.940 -18.690 120 HB2 CYS 19 HB2 CYS 19 -15.822 35.858 -18.515 121 HB3 CYS 19 HB1 CYS 19 -15.857 37.250 -17.438 122 H GLN 20 HN GLN 20 -19.910 36.111 -17.342 123 HA GLN 20 HA GLN 20 -20.264 38.637 -15.873 124 HB2 GLN 20 HB2 GLN 20 -22.324 36.620 -16.745 125 HB3 GLN 20 HB1 GLN 20 -22.651 38.118 -15.883 126 HG2 GLN 20 HG2 GLN 20 -21.428 37.904 -18.606 127 HG3 GLN 20 HG1 GLN 20 -23.112 38.270 -18.258 128 HE21 GLN 20 HE21 GLN 20 -21.039 39.821 -19.619 129 HE22 GLN 20 HE22 GLN 20 -20.947 41.332 -18.779 130 H CYS 21 HN CYS 21 -18.894 35.958 -15.197 131 HA CYS 21 HA CYS 21 -20.438 34.800 -13.123 132 HB2 CYS 21 HB2 CYS 21 -18.303 33.922 -14.396 133 HB3 CYS 21 HB1 CYS 21 -17.447 34.746 -13.108 134 H GLY 22 HN GLY 22 -18.292 37.494 -13.384 135 HA2 GLY 22 HA2 GLY 22 -17.798 39.259 -12.036 136 HA3 GLY 22 HA1 GLY 22 -19.408 39.012 -11.404 137 H SER 23 HN SER 23 -19.140 39.435 -9.340 138 HA SER 23 HA SER 23 -16.851 38.510 -7.866 139 HB2 SER 23 HB2 SER 23 -19.305 39.944 -6.847 140 HB3 SER 23 HB1 SER 23 -17.730 39.830 -6.058 141 HG SER 23 HG SER 23 -16.897 40.932 -7.982 142 H LYS 24 HN LYS 24 -19.938 37.317 -8.610 143 HA LYS 24 HA LYS 24 -20.375 35.837 -6.208 144 HB2 LYS 24 HB2 LYS 24 -21.581 35.745 -8.959 145 HB3 LYS 24 HB1 LYS 24 -22.006 34.563 -7.736 146 HG2 LYS 24 HG2 LYS 24 -22.261 37.525 -7.315 147 HG3 LYS 24 HG1 LYS 24 -23.566 36.526 -7.963 148 HD2 LYS 24 HD2 LYS 24 -22.207 36.057 -5.301 149 HD3 LYS 24 HD1 LYS 24 -23.729 36.922 -5.505 150 HE2 LYS 24 HE2 LYS 24 -24.792 34.944 -6.392 151 HE3 LYS 24 HE1 LYS 24 -23.267 34.068 -6.384 152 HZ1 LYS 24 HZ1 LYS 24 -24.642 33.460 -4.512 153 HZ2 LYS 24 HZ2 LYS 24 -24.698 35.062 -3.977 154 HZ3 LYS 24 HZ3 LYS 24 -23.231 34.218 -3.980 155 H CYS 25 HN CYS 25 -19.223 35.070 -9.444 156 HA CYS 25 HA CYS 25 -18.144 33.317 -10.322 157 HB2 CYS 25 HB2 CYS 25 -16.452 34.303 -8.689 158 HB3 CYS 25 HB1 CYS 25 -16.852 32.950 -7.632 159 H GLN 26 HN GLN 26 -19.987 32.090 -10.577 160 HA GLN 26 HA GLN 26 -20.820 30.255 -8.488 161 HB2 GLN 26 HB2 GLN 26 -21.908 30.460 -11.286 162 HB3 GLN 26 HB1 GLN 26 -22.684 29.739 -9.886 163 HG2 GLN 26 HG2 GLN 26 -22.850 31.947 -8.849 164 HG3 GLN 26 HG1 GLN 26 -22.082 32.663 -10.265 165 HE21 GLN 26 HE21 GLN 26 -24.964 31.275 -8.972 166 HE22 GLN 26 HE22 GLN 26 -26.004 31.672 -10.292 167 H CYS 27 HN CYS 27 -18.596 30.170 -11.023 168 HA CYS 27 HA CYS 27 -19.009 27.392 -11.697 169 HB2 CYS 27 HB2 CYS 27 -17.070 27.651 -13.138 170 HB3 CYS 27 HB1 CYS 27 -18.221 28.967 -13.399 171 H GLY 28 HN GLY 28 -16.869 26.045 -11.753 172 HA2 GLY 28 HA2 GLY 28 -15.649 26.291 -9.079 173 HA3 GLY 28 HA1 GLY 28 -16.142 24.746 -9.757 174 H GLU 29 HN GLU 29 -14.328 23.688 -10.002 175 HA GLU 29 HA GLU 29 -11.851 24.871 -10.768 176 HB2 GLU 29 HB2 GLU 29 -12.069 22.913 -9.272 177 HB3 GLU 29 HB1 GLU 29 -12.680 21.971 -10.620 178 HG2 GLU 29 HG2 GLU 29 -10.533 22.272 -11.772 179 HG3 GLU 29 HG1 GLU 29 -9.930 23.162 -10.372 180 H GLY 30 HN GLY 30 -10.663 24.470 -12.693 181 HA2 GLY 30 HA2 GLY 30 -10.367 23.635 -14.878 182 HA3 GLY 30 HA1 GLY 30 -12.076 23.235 -14.932 183 H CYS 31 HN CYS 31 -11.368 26.364 -13.744 184 HA CYS 31 HA CYS 31 -12.128 27.463 -16.359 185 HB2 CYS 31 HB2 CYS 31 -13.924 27.842 -14.849 186 HB3 CYS 31 HB1 CYS 31 -12.831 28.387 -13.583 187 H THR 32 HN THR 32 -10.561 28.555 -13.355 188 HA THR 32 HA THR 32 -8.962 30.096 -12.948 189 HB THR 32 HB THR 32 -6.847 29.886 -14.255 190 HG1 THR 32 HG1 THR 32 -8.547 28.734 -16.079 191 HG21 THR 32 HG21 THR 32 -6.413 27.551 -13.681 192 HG22 THR 32 HG22 THR 32 -8.150 27.263 -13.549 193 HG23 THR 32 HG23 THR 32 -7.347 28.349 -12.413 194 H CYS 33 HN CYS 33 -11.158 31.086 -14.409 195 HA CYS 33 HA CYS 33 -10.583 32.707 -16.590 196 HB2 CYS 33 HB2 CYS 33 -12.750 32.267 -14.838 197 HB3 CYS 33 HB1 CYS 33 -12.455 33.999 -14.841 198 H ALA 34 HN ALA 34 -9.879 34.774 -16.822 199 HA ALA 34 HA ALA 34 -8.467 35.940 -14.552 200 HB1 ALA 34 HB1 ALA 34 -8.465 36.704 -17.477 201 HB2 ALA 34 HB2 ALA 34 -7.252 35.711 -16.666 202 HB3 ALA 34 HB3 ALA 34 -7.439 37.410 -16.229 203 H ALA 35 HN ALA 35 -11.446 35.914 -15.074 204 HA ALA 35 HA ALA 35 -11.900 38.815 -14.966 205 HB1 ALA 35 HB1 ALA 35 -13.765 36.724 -16.105 206 HB2 ALA 35 HB2 ALA 35 -12.807 37.865 -17.045 207 HB3 ALA 35 HB3 ALA 35 -14.098 38.451 -15.999 208 H CYS 36 HN CYS 36 -13.356 35.700 -14.071 209 HA CYS 36 HA CYS 36 -14.572 36.959 -11.752 210 HB2 CYS 36 HB2 CYS 36 -15.849 34.901 -11.584 211 HB3 CYS 36 HB1 CYS 36 -15.912 35.585 -13.209 212 H LYS 37 HN LYS 37 -12.234 34.466 -12.602 213 HA LYS 37 HA LYS 37 -11.823 33.906 -9.763 214 HB2 LYS 37 HB2 LYS 37 -12.441 32.136 -11.647 215 HB3 LYS 37 HB1 LYS 37 -10.701 32.145 -11.885 216 HG2 LYS 37 HG2 LYS 37 -10.360 31.490 -9.570 217 HG3 LYS 37 HG1 LYS 37 -12.101 31.536 -9.287 218 HD2 LYS 37 HD2 LYS 37 -10.591 29.678 -11.123 219 HD3 LYS 37 HD1 LYS 37 -11.421 29.253 -9.628 220 HE2 LYS 37 HE2 LYS 37 -12.693 30.225 -12.192 221 HE3 LYS 37 HE1 LYS 37 -12.765 28.596 -11.529 222 HZ1 LYS 37 HZ1 LYS 37 -14.790 29.818 -11.094 223 HZ2 LYS 37 HZ2 LYS 37 -13.943 31.023 -10.278 224 HZ3 LYS 37 HZ3 LYS 37 -14.007 29.456 -9.641 225 H THR 38 HN THR 38 -10.734 36.157 -10.900 226 HA THR 38 HA THR 38 -7.917 35.544 -11.371 227 HB THR 38 HB THR 38 -9.073 37.065 -12.960 228 HG1 THR 38 HG1 THR 38 -7.441 38.920 -12.410 229 HG21 THR 38 HG21 THR 38 -10.603 38.148 -11.382 230 HG22 THR 38 HG22 THR 38 -9.645 39.340 -12.256 231 HG23 THR 38 HG23 THR 38 -9.237 38.932 -10.590 232 H CYS 39 HN CYS 39 -6.390 37.228 -10.393 233 HA CYS 39 HA CYS 39 -6.996 37.441 -7.540 234 HB2 CYS 39 HB2 CYS 39 -4.952 36.221 -8.129 235 HB3 CYS 39 HB1 CYS 39 -4.359 37.622 -9.011 236 H ASN 40 HN ASN 40 -6.647 39.393 -6.440 237 HA ASN 40 HA ASN 40 -6.756 41.760 -8.189 238 HB2 ASN 40 HB2 ASN 40 -8.038 41.186 -5.530 239 HB3 ASN 40 HB1 ASN 40 -7.855 42.832 -6.126 240 HD21 ASN 40 HD21 ASN 40 -9.393 39.745 -6.653 241 HD22 ASN 40 HD22 ASN 40 -10.614 40.327 -7.730 242 H CYS 41 HN CYS 41 -4.583 40.195 -6.401 243 HA CYS 41 HA CYS 41 -3.535 42.381 -4.882 244 HB2 CYS 41 HB2 CYS 41 -2.327 39.703 -5.557 245 HB3 CYS 41 HB1 CYS 41 -1.715 40.841 -4.359 246 H THR 42 HN THR 42 -1.422 43.294 -5.225 247 HA THR 42 HA THR 42 -0.663 43.318 -8.056 248 HB THR 42 HB THR 42 -0.046 45.719 -7.732 249 HG1 THR 42 HG1 THR 42 -0.864 46.758 -5.851 250 HG21 THR 42 HG21 THR 42 -2.212 45.128 -8.718 251 HG22 THR 42 HG22 THR 42 -2.350 46.585 -7.731 252 HG23 THR 42 HG23 THR 42 -2.921 45.037 -7.106 253 H SER 43 HN SER 43 1.599 43.876 -8.439 254 HA SER 43 HA SER 43 3.374 42.443 -6.789 255 HB2 SER 43 HB2 SER 43 4.032 44.516 -8.891 256 HB3 SER 43 HB1 SER 43 5.107 43.256 -8.284 257 HG SER 43 HG SER 43 3.340 41.785 -9.043 258 H ASP 44 HN ASP 44 2.364 45.743 -6.901 259 HA ASP 44 HA ASP 44 4.440 46.924 -5.392 260 HB2 ASP 44 HB2 ASP 44 3.007 48.339 -6.680 261 HB3 ASP 44 HB1 ASP 44 1.568 47.718 -5.878 262 H GLY 45 HN GLY 45 1.534 45.199 -4.526 263 HA2 GLY 45 HA2 GLY 45 2.446 44.694 -1.906 264 HA3 GLY 45 HA1 GLY 45 1.238 45.970 -1.882 265 H CYS 46 HN CYS 46 1.529 42.852 -1.298 266 HA CYS 46 HA CYS 46 -0.531 41.634 -2.791 267 HB2 CYS 46 HB2 CYS 46 1.248 40.537 -1.284 268 HB3 CYS 46 HB1 CYS 46 0.156 40.900 0.048 269 H LYS 47 HN LYS 47 -2.710 41.306 -2.319 270 HA LYS 47 HA LYS 47 -3.783 43.377 -0.553 271 HB2 LYS 47 HB2 LYS 47 -4.964 42.053 -2.983 272 HB3 LYS 47 HB1 LYS 47 -5.866 43.141 -1.941 273 HG2 LYS 47 HG2 LYS 47 -3.325 43.898 -3.374 274 HG3 LYS 47 HG1 LYS 47 -4.947 44.213 -3.994 275 HD2 LYS 47 HD2 LYS 47 -5.443 45.605 -2.068 276 HD3 LYS 47 HD1 LYS 47 -3.877 45.221 -1.354 277 HE2 LYS 47 HE2 LYS 47 -4.208 46.589 -4.016 278 HE3 LYS 47 HE1 LYS 47 -4.027 47.458 -2.494 279 HZ1 LYS 47 HZ1 LYS 47 -1.874 46.414 -2.192 280 HZ2 LYS 47 HZ2 LYS 47 -1.920 47.240 -3.654 281 HZ3 LYS 47 HZ3 LYS 47 -2.040 45.556 -3.637 282 H CYS 48 HN CYS 48 -3.697 39.945 -0.967 283 HA CYS 48 HA CYS 48 -5.940 39.656 0.898 284 HB2 CYS 48 HB2 CYS 48 -5.897 37.296 0.388 285 HB3 CYS 48 HB1 CYS 48 -5.879 38.207 -1.116 286 H GLY 49 HN GLY 49 -2.511 38.930 0.586 287 HA2 GLY 49 HA2 GLY 49 -1.166 39.229 2.613 288 HA3 GLY 49 HA1 GLY 49 -2.452 38.421 3.496 289 H LYS 50 HN LYS 50 -2.310 36.836 0.666 290 HA LYS 50 HA LYS 50 -0.851 34.635 1.808 291 HB2 LYS 50 HB2 LYS 50 -2.065 34.954 -0.941 292 HB3 LYS 50 HB1 LYS 50 -1.463 33.451 -0.256 293 HG2 LYS 50 HG2 LYS 50 -3.724 35.056 0.921 294 HG3 LYS 50 HG1 LYS 50 -3.937 33.701 -0.187 295 HD2 LYS 50 HD2 LYS 50 -2.529 33.558 2.472 296 HD3 LYS 50 HD1 LYS 50 -4.208 33.084 2.198 297 HE2 LYS 50 HE2 LYS 50 -3.340 31.489 0.431 298 HE3 LYS 50 HE1 LYS 50 -1.722 31.836 1.036 299 HZ1 LYS 50 HZ1 LYS 50 -2.479 31.058 3.234 300 HZ2 LYS 50 HZ2 LYS 50 -2.537 29.855 2.054 301 HZ3 LYS 50 HZ3 LYS 50 -3.959 30.616 2.547 302 H GLU 51 HN GLU 51 0.052 37.378 0.266 303 HA GLU 51 HA GLU 51 2.040 38.167 -0.454 304 HB2 GLU 51 HB2 GLU 51 2.923 36.583 1.315 305 HB3 GLU 51 HB1 GLU 51 3.197 35.423 0.028 306 HG2 GLU 51 HG2 GLU 51 4.721 36.989 -1.057 307 HG3 GLU 51 HG1 GLU 51 4.445 38.150 0.243 308 H CYS 52 HN CYS 52 0.107 36.486 -2.149 309 HA CYS 52 HA CYS 52 1.669 35.351 -4.228 310 HB2 CYS 52 HB2 CYS 52 -0.528 35.588 -5.512 311 HB3 CYS 52 HB1 CYS 52 -0.516 34.536 -4.093 312 H THR 53 HN THR 53 0.218 38.484 -3.674 313 HA THR 53 HA THR 53 0.381 40.503 -4.680 314 HB THR 53 HB THR 53 2.647 41.162 -5.522 315 HG1 THR 53 HG1 THR 53 2.955 38.468 -5.596 316 HG21 THR 53 HG21 THR 53 2.567 39.730 -2.868 317 HG22 THR 53 HG22 THR 53 2.061 41.391 -3.171 318 HG23 THR 53 HG23 THR 53 3.759 40.942 -3.342 319 H GLY 54 HN GLY 54 -0.862 38.557 -6.323 320 HA2 GLY 54 HA2 GLY 54 -1.617 39.631 -8.517 321 HA3 GLY 54 HA1 GLY 54 0.060 39.382 -8.984 322 HA PRO 55 HA PRO 55 -2.860 35.614 -9.709 323 HB2 PRO 55 HB2 PRO 55 -2.957 35.800 -12.452 324 HB3 PRO 55 HB1 PRO 55 -4.193 36.447 -11.369 325 HG2 PRO 55 HG2 PRO 55 -1.920 37.856 -12.709 326 HG3 PRO 55 HG1 PRO 55 -3.593 38.396 -12.481 327 HD2 PRO 55 HD2 PRO 55 -1.592 39.299 -10.935 328 HD3 PRO 55 HD1 PRO 55 -3.221 39.027 -10.285 329 H ASP 56 HN ASP 56 0.026 36.892 -11.183 330 HA ASP 56 HA ASP 56 0.926 34.595 -12.525 331 HB2 ASP 56 HB2 ASP 56 2.480 36.886 -11.327 332 HB3 ASP 56 HB1 ASP 56 3.191 35.646 -12.353 333 H SER 57 HN SER 57 1.389 35.663 -9.207 334 HA SER 57 HA SER 57 2.682 33.083 -8.660 335 HB2 SER 57 HB2 SER 57 2.980 35.697 -7.162 336 HB3 SER 57 HB1 SER 57 3.807 34.187 -6.779 337 HG SER 57 HG SER 57 5.069 35.675 -8.062 338 H CYS 58 HN CYS 58 -0.218 34.016 -8.679 339 HA CYS 58 HA CYS 58 -1.015 33.883 -5.924 340 HB2 CYS 58 HB2 CYS 58 -2.268 35.230 -7.581 341 HB3 CYS 58 HB1 CYS 58 -2.723 33.745 -8.407 342 H LYS 59 HN LYS 59 -1.243 32.157 -4.789 343 HA LYS 59 HA LYS 59 -1.650 29.608 -6.182 344 HB2 LYS 59 HB2 LYS 59 -0.557 30.075 -3.399 345 HB3 LYS 59 HB1 LYS 59 -0.676 28.527 -4.221 346 HG2 LYS 59 HG2 LYS 59 1.067 30.845 -5.045 347 HG3 LYS 59 HG1 LYS 59 1.605 29.357 -4.265 348 HD2 LYS 59 HD2 LYS 59 0.924 28.057 -6.197 349 HD3 LYS 59 HD1 LYS 59 0.246 29.496 -6.961 350 HE2 LYS 59 HE2 LYS 59 2.490 30.504 -7.003 351 HE3 LYS 59 HE1 LYS 59 3.152 29.034 -6.292 352 HZ1 LYS 59 HZ1 LYS 59 2.457 27.810 -8.242 353 HZ2 LYS 59 HZ2 LYS 59 3.440 29.105 -8.697 354 HZ3 LYS 59 HZ3 LYS 59 1.768 29.198 -8.914 355 H CYS 60 HN CYS 60 -3.426 31.891 -4.872 356 HA CYS 60 HA CYS 60 -5.038 30.346 -3.071 357 HB2 CYS 60 HB2 CYS 60 -5.723 32.980 -4.363 358 HB3 CYS 60 HB1 CYS 60 -6.408 32.304 -2.897 359 H GLY 61 HN GLY 61 -7.053 29.509 -3.497 360 HA2 GLY 61 HA2 GLY 61 -7.843 29.428 -6.345 361 HA3 GLY 61 HA1 GLY 61 -7.815 27.975 -5.355 362 H SER 62 HN SER 62 -9.356 31.083 -5.834 363 HA SER 62 HA SER 62 -11.405 31.901 -5.329 364 HB2 SER 62 HB2 SER 62 -12.128 28.973 -4.989 365 HB3 SER 62 HB1 SER 62 -13.286 30.296 -5.101 366 HG SER 62 HG SER 62 -13.172 29.706 -7.138 367 H SER 63 HN SER 63 -13.137 31.958 -3.540 368 HA SER 63 HA SER 63 -13.747 32.227 -1.389 369 HB2 SER 63 HB2 SER 63 -11.860 29.931 -0.850 370 HB3 SER 63 HB1 SER 63 -13.115 30.515 0.240 371 HG SER 63 HG SER 63 -14.206 29.009 -0.777 372 H CYS 64 HN CYS 64 -10.777 33.128 -2.399 373 HA CYS 64 HA CYS 64 -9.905 33.995 0.259 374 HB2 CYS 64 HB2 CYS 64 -8.245 32.843 -1.230 375 HB3 CYS 64 HB1 CYS 64 -8.370 34.206 -2.338 376 H SER 65 HN SER 65 -8.916 36.234 0.295 377 HA SER 65 HA SER 65 -10.977 38.057 -0.341 378 HB2 SER 65 HB2 SER 65 -9.503 38.231 1.657 379 HB3 SER 65 HB1 SER 65 -8.172 38.681 0.592 380 HG SER 65 HG SER 65 -10.570 40.116 0.420 381 H CYS 66 HN CYS 66 -8.014 37.156 -1.982 382 HA CYS 66 HA CYS 66 -8.088 39.487 -3.676 383 HB2 CYS 66 HB2 CYS 66 -6.198 38.412 -4.872 384 HB3 CYS 66 HB1 CYS 66 -5.912 38.576 -3.147 385 H LYS 67 HN LYS 67 -9.989 36.859 -3.536 386 HA LYS 67 HA LYS 67 -10.300 36.646 -6.460 387 HB2 LYS 67 HB2 LYS 67 -11.213 34.708 -4.324 388 HB3 LYS 67 HB1 LYS 67 -11.343 34.475 -6.062 389 HG2 LYS 67 HG2 LYS 67 -8.749 34.754 -4.566 390 HG3 LYS 67 HG1 LYS 67 -9.485 33.220 -5.031 391 HD2 LYS 67 HD2 LYS 67 -9.222 33.690 -7.335 392 HD3 LYS 67 HD1 LYS 67 -8.833 35.381 -7.018 393 HE2 LYS 67 HE2 LYS 67 -6.756 34.762 -5.995 394 HE3 LYS 67 HE1 LYS 67 -7.156 33.049 -6.126 395 HZ1 LYS 67 HZ1 LYS 67 -6.773 34.892 -8.417 396 HZ2 LYS 67 HZ2 LYS 67 -7.060 33.226 -8.508 397 HZ3 LYS 67 HZ3 LYS 67 -5.617 33.799 -7.842 Start of MODEL 7 1 HA2 GLY 1 HA1 GLY 1 -17.582 21.937 -35.834 2 HA3 GLY 1 HA2 GLY 1 -15.950 21.503 -36.319 3 H SER 2 HN SER 2 -15.819 24.116 -34.285 4 HA SER 2 HA SER 2 -15.655 22.451 -31.881 5 HB2 SER 2 HB2 SER 2 -13.578 24.439 -32.817 6 HB3 SER 2 HB1 SER 2 -13.599 23.708 -31.215 7 HG SER 2 HG SER 2 -12.922 22.601 -33.675 8 H GLY 3 HN GLY 3 -16.022 23.546 -29.926 9 HA2 GLY 3 HA2 GLY 3 -16.380 26.222 -29.476 10 HA3 GLY 3 HA1 GLY 3 -17.912 25.677 -30.146 11 H LYS 4 HN LYS 4 -15.914 25.797 -27.395 12 HA LYS 4 HA LYS 4 -17.354 23.756 -25.949 13 HB2 LYS 4 HB2 LYS 4 -15.267 25.733 -25.026 14 HB3 LYS 4 HB1 LYS 4 -15.942 24.454 -24.030 15 HG2 LYS 4 HG2 LYS 4 -14.381 24.038 -26.574 16 HG3 LYS 4 HG1 LYS 4 -13.734 23.888 -24.940 17 HD2 LYS 4 HD2 LYS 4 -16.008 22.235 -26.051 18 HD3 LYS 4 HD1 LYS 4 -14.329 21.710 -25.981 19 HE2 LYS 4 HE2 LYS 4 -14.376 21.969 -23.526 20 HE3 LYS 4 HE1 LYS 4 -16.075 22.431 -23.623 21 HZ1 LYS 4 HZ1 LYS 4 -16.599 20.265 -24.512 22 HZ2 LYS 4 HZ2 LYS 4 -15.769 20.085 -23.050 23 HZ3 LYS 4 HZ3 LYS 4 -14.968 19.822 -24.508 24 H GLY 5 HN GLY 5 -19.283 24.099 -25.150 25 HA2 GLY 5 HA2 GLY 5 -20.095 26.817 -24.425 26 HA3 GLY 5 HA1 GLY 5 -21.165 25.426 -24.615 27 H LYS 6 HN LYS 6 -19.116 23.832 -23.144 28 HA LYS 6 HA LYS 6 -19.338 24.905 -20.455 29 HB2 LYS 6 HB2 LYS 6 -21.304 23.455 -20.741 30 HB3 LYS 6 HB1 LYS 6 -20.265 22.140 -21.266 31 HG2 LYS 6 HG2 LYS 6 -20.910 21.791 -18.981 32 HG3 LYS 6 HG1 LYS 6 -19.180 22.139 -19.067 33 HD2 LYS 6 HD2 LYS 6 -20.067 23.361 -17.221 34 HD3 LYS 6 HD1 LYS 6 -19.708 24.514 -18.501 35 HE2 LYS 6 HE2 LYS 6 -21.818 25.123 -17.589 36 HE3 LYS 6 HE1 LYS 6 -22.141 24.383 -19.154 37 HZ1 LYS 6 HZ1 LYS 6 -22.402 23.062 -16.510 38 HZ2 LYS 6 HZ2 LYS 6 -22.668 22.310 -17.999 39 HZ3 LYS 6 HZ3 LYS 6 -23.676 23.571 -17.500 40 H GLY 7 HN GLY 7 -17.401 24.760 -19.528 41 HA2 GLY 7 HA2 GLY 7 -15.429 22.979 -20.747 42 HA3 GLY 7 HA1 GLY 7 -15.075 24.358 -19.717 43 H GLU 8 HN GLU 8 -14.248 23.804 -17.875 44 HA GLU 8 HA GLU 8 -14.351 21.141 -16.876 45 HB2 GLU 8 HB2 GLU 8 -13.073 23.693 -16.076 46 HB3 GLU 8 HB1 GLU 8 -13.253 22.462 -14.843 47 HG2 GLU 8 HG2 GLU 8 -11.920 22.031 -17.499 48 HG3 GLU 8 HG1 GLU 8 -11.077 22.389 -15.990 49 H LYS 9 HN LYS 9 -14.859 23.909 -14.830 50 HA LYS 9 HA LYS 9 -17.357 22.713 -13.865 51 HB2 LYS 9 HB2 LYS 9 -15.063 23.800 -12.211 52 HB3 LYS 9 HB1 LYS 9 -16.669 23.538 -11.556 53 HG2 LYS 9 HG2 LYS 9 -15.546 21.624 -10.903 54 HG3 LYS 9 HG1 LYS 9 -16.348 21.095 -12.378 55 HD2 LYS 9 HD2 LYS 9 -14.277 21.418 -13.630 56 HD3 LYS 9 HD1 LYS 9 -13.465 21.997 -12.173 57 HE2 LYS 9 HE2 LYS 9 -13.993 19.771 -11.123 58 HE3 LYS 9 HE1 LYS 9 -14.563 19.236 -12.700 59 HZ1 LYS 9 HZ1 LYS 9 -12.353 18.500 -12.490 60 HZ2 LYS 9 HZ2 LYS 9 -11.801 19.978 -11.912 61 HZ3 LYS 9 HZ3 LYS 9 -12.256 19.823 -13.544 62 H CYS 10 HN CYS 10 -16.707 24.914 -15.732 63 HA CYS 10 HA CYS 10 -17.527 27.273 -14.283 64 HB2 CYS 10 HB2 CYS 10 -16.764 26.816 -17.155 65 HB3 CYS 10 HB1 CYS 10 -17.387 28.356 -16.574 66 H THR 11 HN THR 11 -19.495 28.267 -14.450 67 HA THR 11 HA THR 11 -21.626 26.615 -15.505 68 HB THR 11 HB THR 11 -23.115 28.237 -14.373 69 HG1 THR 11 HG1 THR 11 -22.267 29.963 -13.291 70 HG21 THR 11 HG21 THR 11 -22.452 27.677 -12.074 71 HG22 THR 11 HG22 THR 11 -20.851 27.210 -12.650 72 HG23 THR 11 HG23 THR 11 -22.270 26.287 -13.144 73 H SER 12 HN SER 12 -23.542 28.188 -16.339 74 HA SER 12 HA SER 12 -22.730 29.062 -18.880 75 HB2 SER 12 HB2 SER 12 -25.276 29.814 -17.445 76 HB3 SER 12 HB1 SER 12 -25.010 29.737 -19.187 77 HG SER 12 HG SER 12 -24.837 27.514 -19.052 78 H ALA 13 HN ALA 13 -22.831 30.677 -15.815 79 HA ALA 13 HA ALA 13 -23.016 33.334 -16.759 80 HB1 ALA 13 HB1 ALA 13 -22.269 33.971 -14.528 81 HB2 ALA 13 HB2 ALA 13 -21.813 32.299 -14.195 82 HB3 ALA 13 HB3 ALA 13 -23.508 32.719 -14.443 83 H CYS 14 HN CYS 14 -20.250 31.325 -15.776 84 HA CYS 14 HA CYS 14 -18.338 33.305 -16.506 85 HB2 CYS 14 HB2 CYS 14 -17.937 31.522 -14.804 86 HB3 CYS 14 HB1 CYS 14 -17.886 30.347 -16.109 87 H ARG 15 HN ARG 15 -19.864 30.618 -18.115 88 HA ARG 15 HA ARG 15 -18.091 30.578 -20.361 89 HB2 ARG 15 HB2 ARG 15 -20.733 29.320 -19.763 90 HB3 ARG 15 HB1 ARG 15 -20.116 29.304 -21.407 91 HG2 ARG 15 HG2 ARG 15 -18.531 28.277 -19.067 92 HG3 ARG 15 HG1 ARG 15 -19.635 27.264 -20.001 93 HD2 ARG 15 HD2 ARG 15 -17.437 26.945 -20.889 94 HD3 ARG 15 HD1 ARG 15 -18.352 27.895 -22.055 95 HE ARG 15 HE ARG 15 -16.647 29.328 -20.162 96 HH11 ARG 15 HH11 ARG 15 -17.139 28.160 -23.440 97 HH12 ARG 15 HH12 ARG 15 -15.920 29.175 -24.118 98 HH21 ARG 15 HH21 ARG 15 -15.033 30.684 -21.069 99 HH22 ARG 15 HH22 ARG 15 -14.720 30.625 -22.769 100 H SER 16 HN SER 16 -20.506 32.705 -19.442 101 HA SER 16 HA SER 16 -21.340 33.436 -22.097 102 HB2 SER 16 HB2 SER 16 -22.825 33.633 -20.079 103 HB3 SER 16 HB1 SER 16 -21.771 34.918 -19.493 104 HG SER 16 HG SER 16 -23.677 34.953 -21.474 105 H GLU 17 HN GLU 17 -21.084 35.771 -22.770 106 HA GLU 17 HA GLU 17 -18.448 36.776 -21.996 107 HB2 GLU 17 HB2 GLU 17 -18.175 37.494 -24.417 108 HB3 GLU 17 HB1 GLU 17 -18.043 35.772 -24.092 109 HG2 GLU 17 HG2 GLU 17 -20.317 35.434 -24.873 110 HG3 GLU 17 HG1 GLU 17 -20.488 37.164 -25.158 111 HA PRO 18 HA PRO 18 -17.525 38.199 -21.265 112 HB2 PRO 18 HB2 PRO 18 -17.854 40.124 -19.181 113 HB3 PRO 18 HB1 PRO 18 -16.779 40.217 -20.575 114 HG2 PRO 18 HG2 PRO 18 -18.973 41.844 -20.133 115 HG3 PRO 18 HG1 PRO 18 -18.187 41.598 -21.701 116 HD2 PRO 18 HD2 PRO 18 -20.687 40.387 -20.612 117 HD3 PRO 18 HD1 PRO 18 -20.292 40.862 -22.277 118 H CYS 19 HN CYS 19 -16.978 37.987 -18.728 119 HA CYS 19 HA CYS 19 -18.492 35.844 -17.815 120 HB2 CYS 19 HB2 CYS 19 -16.450 37.575 -16.521 121 HB3 CYS 19 HB1 CYS 19 -17.343 36.402 -15.555 122 H GLN 20 HN GLN 20 -20.246 35.617 -16.796 123 HA GLN 20 HA GLN 20 -21.570 37.971 -15.694 124 HB2 GLN 20 HB2 GLN 20 -22.643 35.290 -16.518 125 HB3 GLN 20 HB1 GLN 20 -23.610 36.563 -15.791 126 HG2 GLN 20 HG2 GLN 20 -22.181 36.664 -18.428 127 HG3 GLN 20 HG1 GLN 20 -23.915 36.555 -18.148 128 HE21 GLN 20 HE21 GLN 20 -21.163 38.607 -18.238 129 HE22 GLN 20 HE22 GLN 20 -21.997 40.107 -18.008 130 H CYS 21 HN CYS 21 -19.513 35.923 -14.523 131 HA CYS 21 HA CYS 21 -20.782 34.647 -12.369 132 HB2 CYS 21 HB2 CYS 21 -17.972 35.568 -12.834 133 HB3 CYS 21 HB1 CYS 21 -18.434 34.982 -11.246 134 H GLY 22 HN GLY 22 -19.809 37.950 -12.880 135 HA2 GLY 22 HA2 GLY 22 -20.128 39.875 -11.691 136 HA3 GLY 22 HA1 GLY 22 -21.417 39.015 -10.863 137 H SER 23 HN SER 23 -21.185 38.768 -8.776 138 HA SER 23 HA SER 23 -18.463 38.718 -7.662 139 HB2 SER 23 HB2 SER 23 -20.968 39.909 -6.453 140 HB3 SER 23 HB1 SER 23 -19.419 39.768 -5.623 141 HG SER 23 HG SER 23 -18.502 41.117 -7.177 142 H LYS 24 HN LYS 24 -20.512 36.634 -8.534 143 HA LYS 24 HA LYS 24 -20.861 35.227 -5.981 144 HB2 LYS 24 HB2 LYS 24 -22.072 34.680 -8.695 145 HB3 LYS 24 HB1 LYS 24 -22.389 33.744 -7.245 146 HG2 LYS 24 HG2 LYS 24 -23.050 36.658 -7.631 147 HG3 LYS 24 HG1 LYS 24 -24.192 35.318 -7.742 148 HD2 LYS 24 HD2 LYS 24 -22.608 36.071 -5.280 149 HD3 LYS 24 HD1 LYS 24 -24.301 36.468 -5.566 150 HE2 LYS 24 HE2 LYS 24 -24.853 34.091 -5.653 151 HE3 LYS 24 HE1 LYS 24 -23.157 33.680 -5.395 152 HZ1 LYS 24 HZ1 LYS 24 -24.961 35.068 -3.494 153 HZ2 LYS 24 HZ2 LYS 24 -23.302 34.879 -3.255 154 HZ3 LYS 24 HZ3 LYS 24 -24.301 33.516 -3.330 155 H CYS 25 HN CYS 25 -19.622 34.819 -9.256 156 HA CYS 25 HA CYS 25 -18.290 33.299 -10.255 157 HB2 CYS 25 HB2 CYS 25 -16.936 34.230 -8.035 158 HB3 CYS 25 HB1 CYS 25 -16.788 32.481 -7.891 159 H GLN 26 HN GLN 26 -19.685 31.755 -10.800 160 HA GLN 26 HA GLN 26 -20.475 29.736 -8.851 161 HB2 GLN 26 HB2 GLN 26 -21.353 29.971 -11.715 162 HB3 GLN 26 HB1 GLN 26 -22.159 29.125 -10.404 163 HG2 GLN 26 HG2 GLN 26 -22.795 31.166 -9.369 164 HG3 GLN 26 HG1 GLN 26 -21.775 32.103 -10.458 165 HE21 GLN 26 HE21 GLN 26 -24.613 32.358 -9.971 166 HE22 GLN 26 HE22 GLN 26 -25.387 32.121 -11.500 167 H CYS 27 HN CYS 27 -18.018 30.149 -11.041 168 HA CYS 27 HA CYS 27 -17.975 27.421 -12.017 169 HB2 CYS 27 HB2 CYS 27 -15.961 28.156 -13.227 170 HB3 CYS 27 HB1 CYS 27 -17.354 29.191 -13.537 171 H GLY 28 HN GLY 28 -15.693 26.390 -11.989 172 HA2 GLY 28 HA2 GLY 28 -14.713 26.515 -9.210 173 HA3 GLY 28 HA1 GLY 28 -14.846 25.021 -10.123 174 H GLU 29 HN GLU 29 -12.854 24.313 -10.353 175 HA GLU 29 HA GLU 29 -10.543 25.972 -10.530 176 HB2 GLU 29 HB2 GLU 29 -9.325 23.892 -10.718 177 HB3 GLU 29 HB1 GLU 29 -10.553 23.751 -9.464 178 HG2 GLU 29 HG2 GLU 29 -11.975 22.487 -10.894 179 HG3 GLU 29 HG1 GLU 29 -10.930 22.778 -12.281 180 H GLY 30 HN GLY 30 -8.849 25.304 -12.252 181 HA2 GLY 30 HA2 GLY 30 -8.131 25.350 -14.421 182 HA3 GLY 30 HA1 GLY 30 -9.612 24.495 -14.833 183 H CYS 31 HN CYS 31 -9.530 27.641 -13.309 184 HA CYS 31 HA CYS 31 -10.526 28.735 -15.813 185 HB2 CYS 31 HB2 CYS 31 -12.356 28.311 -14.227 186 HB3 CYS 31 HB1 CYS 31 -11.565 29.366 -13.059 187 H THR 32 HN THR 32 -9.851 30.182 -12.635 188 HA THR 32 HA THR 32 -8.789 32.108 -12.070 189 HB THR 32 HB THR 32 -6.398 32.247 -12.720 190 HG1 THR 32 HG1 THR 32 -7.204 30.931 -14.876 191 HG21 THR 32 HG21 THR 32 -7.059 30.753 -10.914 192 HG22 THR 32 HG22 THR 32 -5.719 30.054 -11.827 193 HG23 THR 32 HG23 THR 32 -7.367 29.467 -12.083 194 H CYS 33 HN CYS 33 -10.656 32.510 -13.987 195 HA CYS 33 HA CYS 33 -9.998 33.790 -16.325 196 HB2 CYS 33 HB2 CYS 33 -12.281 33.435 -14.651 197 HB3 CYS 33 HB1 CYS 33 -12.273 35.077 -15.301 198 H ALA 34 HN ALA 34 -10.081 36.031 -16.906 199 HA ALA 34 HA ALA 34 -8.757 37.717 -14.920 200 HB1 ALA 34 HB1 ALA 34 -9.109 38.106 -17.894 201 HB2 ALA 34 HB2 ALA 34 -7.669 37.470 -17.096 202 HB3 ALA 34 HB3 ALA 34 -8.163 39.141 -16.824 203 H ALA 35 HN ALA 35 -11.679 37.081 -15.079 204 HA ALA 35 HA ALA 35 -12.628 39.854 -15.021 205 HB1 ALA 35 HB1 ALA 35 -13.416 38.824 -17.109 206 HB2 ALA 35 HB2 ALA 35 -14.758 39.163 -16.017 207 HB3 ALA 35 HB3 ALA 35 -14.157 37.518 -16.184 208 H CYS 36 HN CYS 36 -13.831 36.586 -14.342 209 HA CYS 36 HA CYS 36 -15.194 37.489 -11.991 210 HB2 CYS 36 HB2 CYS 36 -15.885 35.145 -11.838 211 HB3 CYS 36 HB1 CYS 36 -16.146 35.806 -13.451 212 H LYS 37 HN LYS 37 -12.371 35.468 -12.697 213 HA LYS 37 HA LYS 37 -11.922 35.221 -9.807 214 HB2 LYS 37 HB2 LYS 37 -12.670 33.188 -11.183 215 HB3 LYS 37 HB1 LYS 37 -11.043 33.202 -11.841 216 HG2 LYS 37 HG2 LYS 37 -10.087 32.732 -9.734 217 HG3 LYS 37 HG1 LYS 37 -11.606 33.059 -8.895 218 HD2 LYS 37 HD2 LYS 37 -11.003 30.761 -10.756 219 HD3 LYS 37 HD1 LYS 37 -11.316 30.678 -9.019 220 HE2 LYS 37 HE2 LYS 37 -13.586 31.762 -9.598 221 HE3 LYS 37 HE1 LYS 37 -13.231 31.279 -11.254 222 HZ1 LYS 37 HZ1 LYS 37 -13.454 29.494 -8.905 223 HZ2 LYS 37 HZ2 LYS 37 -13.018 28.979 -10.462 224 HZ3 LYS 37 HZ3 LYS 37 -14.557 29.630 -10.181 225 H THR 38 HN THR 38 -10.822 37.355 -10.897 226 HA THR 38 HA THR 38 -8.072 36.644 -11.559 227 HB THR 38 HB THR 38 -9.294 38.340 -12.977 228 HG1 THR 38 HG1 THR 38 -7.063 38.360 -13.026 229 HG21 THR 38 HG21 THR 38 -9.506 40.630 -12.103 230 HG22 THR 38 HG22 THR 38 -8.992 40.069 -10.512 231 HG23 THR 38 HG23 THR 38 -10.514 39.501 -11.198 232 H CYS 39 HN CYS 39 -6.347 37.936 -10.470 233 HA CYS 39 HA CYS 39 -6.941 38.056 -7.617 234 HB2 CYS 39 HB2 CYS 39 -5.026 36.686 -8.272 235 HB3 CYS 39 HB1 CYS 39 -4.288 38.070 -9.069 236 H ASN 40 HN ASN 40 -6.671 39.861 -6.403 237 HA ASN 40 HA ASN 40 -6.455 42.338 -7.943 238 HB2 ASN 40 HB2 ASN 40 -7.688 41.732 -5.260 239 HB3 ASN 40 HB1 ASN 40 -7.416 43.380 -5.819 240 HD21 ASN 40 HD21 ASN 40 -9.240 40.450 -6.304 241 HD22 ASN 40 HD22 ASN 40 -10.442 41.134 -7.336 242 H CYS 41 HN CYS 41 -4.480 40.391 -6.286 243 HA CYS 41 HA CYS 41 -3.015 42.382 -4.807 244 HB2 CYS 41 HB2 CYS 41 -2.285 39.533 -5.511 245 HB3 CYS 41 HB1 CYS 41 -1.462 40.551 -4.336 246 H THR 42 HN THR 42 -1.082 43.302 -5.421 247 HA THR 42 HA THR 42 -0.506 43.106 -8.279 248 HB THR 42 HB THR 42 0.626 45.258 -8.045 249 HG1 THR 42 HG1 THR 42 0.343 46.268 -5.832 250 HG21 THR 42 HG21 THR 42 -2.042 45.259 -6.623 251 HG22 THR 42 HG22 THR 42 -1.805 45.309 -8.371 252 HG23 THR 42 HG23 THR 42 -1.277 46.664 -7.370 253 H SER 43 HN SER 43 1.825 43.274 -8.862 254 HA SER 43 HA SER 43 3.344 41.290 -7.548 255 HB2 SER 43 HB2 SER 43 4.350 43.319 -9.549 256 HB3 SER 43 HB1 SER 43 5.000 41.711 -9.232 257 HG SER 43 HG SER 43 2.897 42.477 -10.814 258 H ASP 44 HN ASP 44 2.815 44.495 -6.837 259 HA ASP 44 HA ASP 44 5.395 44.882 -5.530 260 HB2 ASP 44 HB2 ASP 44 4.748 46.762 -6.841 261 HB3 ASP 44 HB1 ASP 44 3.123 46.760 -6.164 262 H GLY 45 HN GLY 45 1.985 44.414 -4.859 263 HA2 GLY 45 HA2 GLY 45 2.632 44.082 -2.050 264 HA3 GLY 45 HA1 GLY 45 1.494 45.362 -2.439 265 H CYS 46 HN CYS 46 1.578 42.467 -1.241 266 HA CYS 46 HA CYS 46 -0.503 41.159 -2.734 267 HB2 CYS 46 HB2 CYS 46 1.388 40.051 -1.370 268 HB3 CYS 46 HB1 CYS 46 0.405 40.425 0.041 269 H LYS 47 HN LYS 47 -2.662 41.187 -2.289 270 HA LYS 47 HA LYS 47 -3.503 43.160 -0.297 271 HB2 LYS 47 HB2 LYS 47 -4.941 42.025 -2.690 272 HB3 LYS 47 HB1 LYS 47 -5.674 43.133 -1.541 273 HG2 LYS 47 HG2 LYS 47 -3.240 43.732 -3.213 274 HG3 LYS 47 HG1 LYS 47 -4.885 44.264 -3.574 275 HD2 LYS 47 HD2 LYS 47 -4.936 45.494 -1.446 276 HD3 LYS 47 HD1 LYS 47 -3.288 44.971 -1.113 277 HE2 LYS 47 HE2 LYS 47 -2.487 46.159 -3.066 278 HE3 LYS 47 HE1 LYS 47 -4.135 46.628 -3.482 279 HZ1 LYS 47 HZ1 LYS 47 -2.707 47.419 -1.000 280 HZ2 LYS 47 HZ2 LYS 47 -4.262 47.903 -1.451 281 HZ3 LYS 47 HZ3 LYS 47 -2.931 48.407 -2.354 282 H CYS 48 HN CYS 48 -3.751 39.753 -0.962 283 HA CYS 48 HA CYS 48 -5.903 39.489 1.001 284 HB2 CYS 48 HB2 CYS 48 -6.011 37.169 0.353 285 HB3 CYS 48 HB1 CYS 48 -5.947 38.158 -1.106 286 H GLY 49 HN GLY 49 -2.504 38.768 0.583 287 HA2 GLY 49 HA2 GLY 49 -1.087 38.947 2.533 288 HA3 GLY 49 HA1 GLY 49 -2.369 38.188 3.466 289 H LYS 50 HN LYS 50 -2.360 36.540 0.637 290 HA LYS 50 HA LYS 50 -0.957 34.308 1.801 291 HB2 LYS 50 HB2 LYS 50 -2.191 34.626 -0.944 292 HB3 LYS 50 HB1 LYS 50 -1.582 33.117 -0.279 293 HG2 LYS 50 HG2 LYS 50 -3.899 34.727 0.773 294 HG3 LYS 50 HG1 LYS 50 -3.991 33.206 -0.115 295 HD2 LYS 50 HD2 LYS 50 -2.769 32.090 1.698 296 HD3 LYS 50 HD1 LYS 50 -2.713 33.617 2.584 297 HE2 LYS 50 HE2 LYS 50 -5.162 33.659 2.643 298 HE3 LYS 50 HE1 LYS 50 -5.204 32.123 1.780 299 HZ1 LYS 50 HZ1 LYS 50 -4.020 32.575 4.461 300 HZ2 LYS 50 HZ2 LYS 50 -4.028 31.106 3.639 301 HZ3 LYS 50 HZ3 LYS 50 -5.486 31.799 4.144 302 H GLU 51 HN GLU 51 -0.019 36.973 0.118 303 HA GLU 51 HA GLU 51 1.887 37.682 -0.826 304 HB2 GLU 51 HB2 GLU 51 2.850 36.413 1.165 305 HB3 GLU 51 HB1 GLU 51 3.180 35.097 0.052 306 HG2 GLU 51 HG2 GLU 51 4.687 36.445 -1.206 307 HG3 GLU 51 HG1 GLU 51 4.228 37.888 -0.305 308 H CYS 52 HN CYS 52 -0.039 36.244 -2.321 309 HA CYS 52 HA CYS 52 1.255 34.539 -4.217 310 HB2 CYS 52 HB2 CYS 52 -0.920 35.001 -5.492 311 HB3 CYS 52 HB1 CYS 52 -1.051 34.160 -3.947 312 H THR 53 HN THR 53 0.036 37.840 -4.235 313 HA THR 53 HA THR 53 0.349 39.621 -5.561 314 HB THR 53 HB THR 53 2.714 40.180 -6.135 315 HG1 THR 53 HG1 THR 53 3.113 37.651 -6.116 316 HG21 THR 53 HG21 THR 53 1.757 40.743 -3.953 317 HG22 THR 53 HG22 THR 53 3.470 40.346 -3.811 318 HG23 THR 53 HG23 THR 53 2.248 39.168 -3.329 319 H GLY 54 HN GLY 54 -1.036 38.683 -7.148 320 HA2 GLY 54 HA2 GLY 54 -1.110 39.100 -9.551 321 HA3 GLY 54 HA1 GLY 54 0.418 38.238 -9.668 322 HA PRO 55 HA PRO 55 -3.608 35.470 -9.672 323 HB2 PRO 55 HB2 PRO 55 -4.177 35.454 -12.365 324 HB3 PRO 55 HB1 PRO 55 -5.001 36.461 -11.171 325 HG2 PRO 55 HG2 PRO 55 -2.783 37.168 -13.043 326 HG3 PRO 55 HG1 PRO 55 -4.204 38.121 -12.578 327 HD2 PRO 55 HD2 PRO 55 -1.762 38.587 -11.550 328 HD3 PRO 55 HD1 PRO 55 -3.241 38.808 -10.593 329 H ASP 56 HN ASP 56 -0.904 35.855 -11.849 330 HA ASP 56 HA ASP 56 -0.799 33.254 -12.909 331 HB2 ASP 56 HB2 ASP 56 0.473 34.982 -13.961 332 HB3 ASP 56 HB1 ASP 56 1.341 35.336 -12.471 333 H SER 57 HN SER 57 0.552 34.654 -9.981 334 HA SER 57 HA SER 57 1.596 32.023 -9.200 335 HB2 SER 57 HB2 SER 57 2.241 34.753 -8.055 336 HB3 SER 57 HB1 SER 57 3.033 33.232 -7.643 337 HG SER 57 HG SER 57 3.375 34.870 -9.835 338 H CYS 58 HN CYS 58 -1.218 33.009 -9.053 339 HA CYS 58 HA CYS 58 -1.771 33.532 -6.298 340 HB2 CYS 58 HB2 CYS 58 -3.112 33.991 -8.603 341 HB3 CYS 58 HB1 CYS 58 -3.949 32.559 -8.022 342 H LYS 59 HN LYS 59 -2.221 32.150 -4.727 343 HA LYS 59 HA LYS 59 -2.268 29.278 -5.386 344 HB2 LYS 59 HB2 LYS 59 -1.768 30.534 -2.683 345 HB3 LYS 59 HB1 LYS 59 -1.457 28.875 -3.165 346 HG2 LYS 59 HG2 LYS 59 0.007 31.291 -4.217 347 HG3 LYS 59 HG1 LYS 59 0.593 30.213 -2.951 348 HD2 LYS 59 HD2 LYS 59 0.498 28.340 -4.571 349 HD3 LYS 59 HD1 LYS 59 0.027 29.488 -5.826 350 HE2 LYS 59 HE2 LYS 59 2.113 30.690 -5.561 351 HE3 LYS 59 HE1 LYS 59 2.574 29.647 -4.217 352 HZ1 LYS 59 HZ1 LYS 59 2.178 28.767 -7.025 353 HZ2 LYS 59 HZ2 LYS 59 2.638 27.774 -5.741 354 HZ3 LYS 59 HZ3 LYS 59 3.670 29.003 -6.271 355 H CYS 60 HN CYS 60 -4.341 31.652 -4.943 356 HA CYS 60 HA CYS 60 -6.045 30.414 -2.936 357 HB2 CYS 60 HB2 CYS 60 -6.555 32.989 -4.383 358 HB3 CYS 60 HB1 CYS 60 -7.133 32.482 -2.795 359 H GLY 61 HN GLY 61 -8.420 30.441 -3.380 360 HA2 GLY 61 HA2 GLY 61 -8.900 29.308 -6.039 361 HA3 GLY 61 HA1 GLY 61 -9.914 29.086 -4.619 362 H SER 62 HN SER 62 -11.675 30.340 -4.389 363 HA SER 62 HA SER 62 -11.886 32.745 -6.087 364 HB2 SER 62 HB2 SER 62 -14.183 30.850 -5.622 365 HB3 SER 62 HB1 SER 62 -14.063 32.150 -6.810 366 HG SER 62 HG SER 62 -12.237 30.018 -6.827 367 H SER 63 HN SER 63 -12.202 31.375 -3.015 368 HA SER 63 HA SER 63 -14.180 33.353 -2.146 369 HB2 SER 63 HB2 SER 63 -13.132 30.938 -0.671 370 HB3 SER 63 HB1 SER 63 -14.489 31.957 -0.193 371 HG SER 63 HG SER 63 -15.596 31.268 -2.038 372 H CYS 64 HN CYS 64 -11.186 33.757 -2.621 373 HA CYS 64 HA CYS 64 -10.365 34.456 0.093 374 HB2 CYS 64 HB2 CYS 64 -8.781 33.210 -1.368 375 HB3 CYS 64 HB1 CYS 64 -8.742 34.596 -2.452 376 H SER 65 HN SER 65 -9.195 36.563 0.342 377 HA SER 65 HA SER 65 -10.965 38.673 -0.207 378 HB2 SER 65 HB2 SER 65 -8.093 38.842 0.712 379 HB3 SER 65 HB1 SER 65 -9.328 40.088 0.894 380 HG SER 65 HG SER 65 -10.424 38.788 2.319 381 H CYS 66 HN CYS 66 -8.210 37.475 -2.017 382 HA CYS 66 HA CYS 66 -8.052 39.947 -3.538 383 HB2 CYS 66 HB2 CYS 66 -6.193 38.852 -4.739 384 HB3 CYS 66 HB1 CYS 66 -5.940 38.871 -3.001 385 H LYS 67 HN LYS 67 -10.308 37.835 -3.509 386 HA LYS 67 HA LYS 67 -10.531 37.590 -6.437 387 HB2 LYS 67 HB2 LYS 67 -11.637 35.732 -4.321 388 HB3 LYS 67 HB1 LYS 67 -11.895 35.571 -6.053 389 HG2 LYS 67 HG2 LYS 67 -9.184 35.495 -4.756 390 HG3 LYS 67 HG1 LYS 67 -10.156 34.062 -5.101 391 HD2 LYS 67 HD2 LYS 67 -10.053 34.449 -7.439 392 HD3 LYS 67 HD1 LYS 67 -9.399 36.072 -7.210 393 HE2 LYS 67 HE2 LYS 67 -7.984 33.575 -6.329 394 HE3 LYS 67 HE1 LYS 67 -7.733 34.322 -7.910 395 HZ1 LYS 67 HZ1 LYS 67 -7.076 36.362 -6.729 396 HZ2 LYS 67 HZ2 LYS 67 -6.054 35.061 -6.388 397 HZ3 LYS 67 HZ3 LYS 67 -7.201 35.546 -5.256 Start of MODEL 8 1 HA2 GLY 1 HA1 GLY 1 -9.681 22.373 -21.637 2 HA3 GLY 1 HA2 GLY 1 -10.011 21.218 -22.920 3 H SER 2 HN SER 2 -12.171 21.285 -23.151 4 HA SER 2 HA SER 2 -13.934 21.636 -20.925 5 HB2 SER 2 HB2 SER 2 -14.599 20.904 -23.782 6 HB3 SER 2 HB1 SER 2 -15.715 21.541 -22.572 7 HG SER 2 HG SER 2 -14.297 23.416 -22.490 8 H GLY 3 HN GLY 3 -13.887 19.960 -19.516 9 HA2 GLY 3 HA2 GLY 3 -14.547 17.921 -18.672 10 HA3 GLY 3 HA1 GLY 3 -15.307 17.585 -20.221 11 H LYS 4 HN LYS 4 -12.011 18.458 -20.280 12 HA LYS 4 HA LYS 4 -11.299 15.722 -21.026 13 HB2 LYS 4 HB2 LYS 4 -10.774 17.645 -22.553 14 HB3 LYS 4 HB1 LYS 4 -9.676 18.256 -21.328 15 HG2 LYS 4 HG2 LYS 4 -8.414 17.108 -23.006 16 HG3 LYS 4 HG1 LYS 4 -8.370 16.158 -21.520 17 HD2 LYS 4 HD2 LYS 4 -9.995 14.624 -22.380 18 HD3 LYS 4 HD1 LYS 4 -10.288 15.647 -23.788 19 HE2 LYS 4 HE2 LYS 4 -8.879 13.759 -24.380 20 HE3 LYS 4 HE1 LYS 4 -7.987 15.269 -24.535 21 HZ1 LYS 4 HZ1 LYS 4 -7.797 13.353 -22.275 22 HZ2 LYS 4 HZ2 LYS 4 -6.967 14.821 -22.371 23 HZ3 LYS 4 HZ3 LYS 4 -6.636 13.593 -23.477 24 H GLY 5 HN GLY 5 -9.628 18.387 -19.324 25 HA2 GLY 5 HA2 GLY 5 -8.098 16.588 -17.718 26 HA3 GLY 5 HA1 GLY 5 -8.227 18.330 -17.493 27 H LYS 6 HN LYS 6 -10.826 18.740 -17.073 28 HA LYS 6 HA LYS 6 -12.027 16.882 -15.295 29 HB2 LYS 6 HB2 LYS 6 -12.060 18.458 -13.330 30 HB3 LYS 6 HB1 LYS 6 -10.507 17.709 -13.659 31 HG2 LYS 6 HG2 LYS 6 -9.883 19.814 -14.882 32 HG3 LYS 6 HG1 LYS 6 -11.352 20.533 -14.215 33 HD2 LYS 6 HD2 LYS 6 -10.571 20.097 -11.958 34 HD3 LYS 6 HD1 LYS 6 -9.130 19.298 -12.591 35 HE2 LYS 6 HE2 LYS 6 -8.563 21.539 -11.924 36 HE3 LYS 6 HE1 LYS 6 -8.487 21.421 -13.681 37 HZ1 LYS 6 HZ1 LYS 6 -10.690 22.434 -13.797 38 HZ2 LYS 6 HZ2 LYS 6 -9.581 23.438 -13.000 39 HZ3 LYS 6 HZ3 LYS 6 -10.720 22.560 -12.107 40 H GLY 7 HN GLY 7 -13.945 18.249 -14.116 41 HA2 GLY 7 HA2 GLY 7 -15.253 19.511 -16.422 42 HA3 GLY 7 HA1 GLY 7 -16.077 18.684 -15.112 43 H GLU 8 HN GLU 8 -15.015 21.654 -16.332 44 HA GLU 8 HA GLU 8 -15.178 23.141 -13.889 45 HB2 GLU 8 HB2 GLU 8 -15.043 23.904 -16.795 46 HB3 GLU 8 HB1 GLU 8 -15.430 25.106 -15.580 47 HG2 GLU 8 HG2 GLU 8 -13.092 25.206 -16.117 48 HG3 GLU 8 HG1 GLU 8 -13.298 24.647 -14.462 49 H LYS 9 HN LYS 9 -16.961 23.680 -12.893 50 HA LYS 9 HA LYS 9 -19.519 23.214 -14.184 51 HB2 LYS 9 HB2 LYS 9 -18.861 23.888 -11.332 52 HB3 LYS 9 HB1 LYS 9 -20.447 23.416 -11.929 53 HG2 LYS 9 HG2 LYS 9 -19.403 21.249 -12.653 54 HG3 LYS 9 HG1 LYS 9 -17.959 21.742 -11.767 55 HD2 LYS 9 HD2 LYS 9 -20.720 21.384 -10.613 56 HD3 LYS 9 HD1 LYS 9 -19.357 20.281 -10.419 57 HE2 LYS 9 HE2 LYS 9 -18.110 21.996 -9.240 58 HE3 LYS 9 HE1 LYS 9 -19.421 23.147 -9.485 59 HZ1 LYS 9 HZ1 LYS 9 -19.512 22.218 -7.283 60 HZ2 LYS 9 HZ2 LYS 9 -19.565 20.645 -7.901 61 HZ3 LYS 9 HZ3 LYS 9 -20.858 21.698 -8.166 62 H CYS 10 HN CYS 10 -18.413 25.266 -15.320 63 HA CYS 10 HA CYS 10 -19.184 27.748 -14.102 64 HB2 CYS 10 HB2 CYS 10 -18.275 27.150 -16.916 65 HB3 CYS 10 HB1 CYS 10 -18.456 28.757 -16.219 66 H THR 11 HN THR 11 -20.976 28.899 -14.418 67 HA THR 11 HA THR 11 -23.212 27.560 -15.603 68 HB THR 11 HB THR 11 -24.487 29.540 -14.815 69 HG1 THR 11 HG1 THR 11 -23.380 31.164 -13.696 70 HG21 THR 11 HG21 THR 11 -24.086 27.597 -13.336 71 HG22 THR 11 HG22 THR 11 -24.196 29.109 -12.436 72 HG23 THR 11 HG23 THR 11 -22.620 28.377 -12.740 73 H SER 12 HN SER 12 -24.773 29.120 -16.831 74 HA SER 12 HA SER 12 -23.712 29.632 -19.336 75 HB2 SER 12 HB2 SER 12 -25.899 30.986 -19.579 76 HB3 SER 12 HB1 SER 12 -26.014 29.260 -19.235 77 HG SER 12 HG SER 12 -27.076 31.208 -17.862 78 H ALA 13 HN ALA 13 -24.175 31.780 -16.572 79 HA ALA 13 HA ALA 13 -23.639 34.215 -17.881 80 HB1 ALA 13 HB1 ALA 13 -23.176 33.452 -15.000 81 HB2 ALA 13 HB2 ALA 13 -24.641 34.173 -15.671 82 HB3 ALA 13 HB3 ALA 13 -23.136 35.096 -15.635 83 H CYS 14 HN CYS 14 -21.501 31.997 -16.123 84 HA CYS 14 HA CYS 14 -19.153 33.529 -16.525 85 HB2 CYS 14 HB2 CYS 14 -19.419 31.822 -14.741 86 HB3 CYS 14 HB1 CYS 14 -19.419 30.567 -15.970 87 H ARG 15 HN ARG 15 -20.683 30.896 -18.280 88 HA ARG 15 HA ARG 15 -18.551 30.514 -20.130 89 HB2 ARG 15 HB2 ARG 15 -20.130 28.724 -19.588 90 HB3 ARG 15 HB1 ARG 15 -21.449 29.660 -20.270 91 HG2 ARG 15 HG2 ARG 15 -20.508 29.464 -22.478 92 HG3 ARG 15 HG1 ARG 15 -19.077 28.659 -21.832 93 HD2 ARG 15 HD2 ARG 15 -20.366 26.759 -21.166 94 HD3 ARG 15 HD1 ARG 15 -21.877 27.584 -21.545 95 HE ARG 15 HE ARG 15 -20.934 27.598 -23.919 96 HH11 ARG 15 HH11 ARG 15 -20.263 25.037 -21.613 97 HH12 ARG 15 HH12 ARG 15 -20.157 23.809 -22.820 98 HH21 ARG 15 HH21 ARG 15 -20.770 25.960 -25.524 99 HH22 ARG 15 HH22 ARG 15 -20.442 24.332 -25.047 100 H SER 16 HN SER 16 -20.801 33.004 -19.862 101 HA SER 16 HA SER 16 -21.284 33.473 -22.632 102 HB2 SER 16 HB2 SER 16 -21.514 35.315 -20.245 103 HB3 SER 16 HB1 SER 16 -22.077 35.704 -21.870 104 HG SER 16 HG SER 16 -22.957 33.478 -20.326 105 H GLU 17 HN GLU 17 -20.534 35.478 -23.743 106 HA GLU 17 HA GLU 17 -17.812 36.160 -22.930 107 HB2 GLU 17 HB2 GLU 17 -17.128 36.251 -25.275 108 HB3 GLU 17 HB1 GLU 17 -17.710 34.653 -24.856 109 HG2 GLU 17 HG2 GLU 17 -19.403 36.702 -26.269 110 HG3 GLU 17 HG1 GLU 17 -18.392 35.534 -27.112 111 HA PRO 18 HA PRO 18 -16.655 37.567 -22.360 112 HB2 PRO 18 HB2 PRO 18 -16.518 39.542 -20.538 113 HB3 PRO 18 HB1 PRO 18 -15.921 39.751 -22.190 114 HG2 PRO 18 HG2 PRO 18 -18.511 40.640 -20.985 115 HG3 PRO 18 HG1 PRO 18 -17.422 41.524 -22.070 116 HD2 PRO 18 HD2 PRO 18 -19.688 40.266 -22.915 117 HD3 PRO 18 HD1 PRO 18 -18.260 40.491 -23.943 118 H CYS 19 HN CYS 19 -16.314 37.195 -19.945 119 HA CYS 19 HA CYS 19 -18.330 35.566 -18.939 120 HB2 CYS 19 HB2 CYS 19 -15.966 35.335 -18.325 121 HB3 CYS 19 HB1 CYS 19 -16.042 36.855 -17.442 122 H GLN 20 HN GLN 20 -20.019 35.857 -17.659 123 HA GLN 20 HA GLN 20 -20.527 38.554 -16.567 124 HB2 GLN 20 HB2 GLN 20 -22.542 36.502 -17.495 125 HB3 GLN 20 HB1 GLN 20 -22.896 38.125 -16.917 126 HG2 GLN 20 HG2 GLN 20 -21.315 37.458 -19.382 127 HG3 GLN 20 HG1 GLN 20 -23.008 37.935 -19.343 128 HE21 GLN 20 HE21 GLN 20 -20.658 39.207 -20.585 129 HE22 GLN 20 HE22 GLN 20 -20.623 40.823 -19.964 130 H CYS 21 HN CYS 21 -19.310 35.982 -15.537 131 HA CYS 21 HA CYS 21 -20.934 34.741 -13.618 132 HB2 CYS 21 HB2 CYS 21 -18.516 34.227 -14.536 133 HB3 CYS 21 HB1 CYS 21 -18.036 35.216 -13.170 134 H GLY 22 HN GLY 22 -19.138 37.728 -13.619 135 HA2 GLY 22 HA2 GLY 22 -19.445 39.564 -12.269 136 HA3 GLY 22 HA1 GLY 22 -20.534 38.615 -11.267 137 H SER 23 HN SER 23 -19.562 39.435 -9.422 138 HA SER 23 HA SER 23 -16.831 38.490 -8.914 139 HB2 SER 23 HB2 SER 23 -18.433 40.534 -7.359 140 HB3 SER 23 HB1 SER 23 -16.717 40.169 -7.174 141 HG SER 23 HG SER 23 -16.421 40.905 -9.338 142 H LYS 24 HN LYS 24 -19.682 37.260 -8.734 143 HA LYS 24 HA LYS 24 -19.574 36.364 -5.946 144 HB2 LYS 24 HB2 LYS 24 -21.768 36.030 -7.993 145 HB3 LYS 24 HB1 LYS 24 -21.850 35.547 -6.304 146 HG2 LYS 24 HG2 LYS 24 -21.654 37.872 -5.614 147 HG3 LYS 24 HG1 LYS 24 -21.525 38.370 -7.300 148 HD2 LYS 24 HD2 LYS 24 -23.779 38.734 -6.571 149 HD3 LYS 24 HD1 LYS 24 -23.774 37.378 -7.696 150 HE2 LYS 24 HE2 LYS 24 -23.824 35.812 -5.819 151 HE3 LYS 24 HE1 LYS 24 -23.799 37.163 -4.687 152 HZ1 LYS 24 HZ1 LYS 24 -25.917 37.896 -5.609 153 HZ2 LYS 24 HZ2 LYS 24 -26.029 36.338 -4.967 154 HZ3 LYS 24 HZ3 LYS 24 -25.949 36.559 -6.642 155 H CYS 25 HN CYS 25 -19.323 35.283 -9.258 156 HA CYS 25 HA CYS 25 -18.624 33.390 -10.211 157 HB2 CYS 25 HB2 CYS 25 -17.369 33.271 -7.581 158 HB3 CYS 25 HB1 CYS 25 -17.589 31.695 -8.336 159 H GLN 26 HN GLN 26 -20.298 32.387 -10.948 160 HA GLN 26 HA GLN 26 -21.905 30.721 -9.163 161 HB2 GLN 26 HB2 GLN 26 -22.265 31.249 -12.114 162 HB3 GLN 26 HB1 GLN 26 -23.427 30.507 -11.025 163 HG2 GLN 26 HG2 GLN 26 -23.695 32.596 -9.839 164 HG3 GLN 26 HG1 GLN 26 -22.465 33.352 -10.852 165 HE21 GLN 26 HE21 GLN 26 -25.253 34.076 -10.482 166 HE22 GLN 26 HE22 GLN 26 -25.968 34.026 -12.054 167 H CYS 27 HN CYS 27 -19.155 30.544 -10.960 168 HA CYS 27 HA CYS 27 -19.546 27.845 -11.947 169 HB2 CYS 27 HB2 CYS 27 -17.430 28.128 -13.069 170 HB3 CYS 27 HB1 CYS 27 -18.410 29.559 -13.354 171 H GLY 28 HN GLY 28 -18.001 26.190 -11.468 172 HA2 GLY 28 HA2 GLY 28 -17.205 26.123 -8.698 173 HA3 GLY 28 HA1 GLY 28 -16.962 24.843 -9.887 174 H GLU 29 HN GLU 29 -14.929 25.558 -8.100 175 HA GLU 29 HA GLU 29 -13.226 27.485 -9.282 176 HB2 GLU 29 HB2 GLU 29 -11.483 26.637 -7.718 177 HB3 GLU 29 HB1 GLU 29 -12.975 27.119 -6.938 178 HG2 GLU 29 HG2 GLU 29 -12.299 25.169 -5.845 179 HG3 GLU 29 HG1 GLU 29 -13.592 24.659 -6.926 180 H GLY 30 HN GLY 30 -10.960 26.965 -10.002 181 HA2 GLY 30 HA2 GLY 30 -9.532 25.579 -11.288 182 HA3 GLY 30 HA1 GLY 30 -10.901 24.517 -11.607 183 H CYS 31 HN CYS 31 -12.043 27.514 -11.843 184 HA CYS 31 HA CYS 31 -12.191 27.491 -14.679 185 HB2 CYS 31 HB2 CYS 31 -14.069 28.300 -13.353 186 HB3 CYS 31 HB1 CYS 31 -13.048 29.535 -12.624 187 H THR 32 HN THR 32 -11.181 28.900 -16.081 188 HA THR 32 HA THR 32 -8.788 30.080 -14.918 189 HB THR 32 HB THR 32 -7.798 29.881 -17.170 190 HG1 THR 32 HG1 THR 32 -10.102 28.339 -17.830 191 HG21 THR 32 HG21 THR 32 -7.424 28.113 -15.586 192 HG22 THR 32 HG22 THR 32 -7.750 27.356 -17.149 193 HG23 THR 32 HG23 THR 32 -9.009 27.419 -15.907 194 H CYS 33 HN CYS 33 -11.646 31.221 -15.451 195 HA CYS 33 HA CYS 33 -11.251 33.428 -17.170 196 HB2 CYS 33 HB2 CYS 33 -13.200 32.842 -14.962 197 HB3 CYS 33 HB1 CYS 33 -13.144 34.437 -15.695 198 H ALA 34 HN ALA 34 -10.304 35.330 -16.835 199 HA ALA 34 HA ALA 34 -9.138 35.843 -14.196 200 HB1 ALA 34 HB1 ALA 34 -8.562 37.118 -16.878 201 HB2 ALA 34 HB2 ALA 34 -7.589 35.874 -16.096 202 HB3 ALA 34 HB3 ALA 34 -7.720 37.475 -15.371 203 H ALA 35 HN ALA 35 -11.935 36.260 -15.357 204 HA ALA 35 HA ALA 35 -12.236 39.138 -14.898 205 HB1 ALA 35 HB1 ALA 35 -14.419 38.910 -15.990 206 HB2 ALA 35 HB2 ALA 35 -14.167 37.173 -16.146 207 HB3 ALA 35 HB3 ALA 35 -13.132 38.296 -17.029 208 H CYS 36 HN CYS 36 -13.942 36.090 -14.249 209 HA CYS 36 HA CYS 36 -15.176 37.219 -11.927 210 HB2 CYS 36 HB2 CYS 36 -16.240 35.024 -11.702 211 HB3 CYS 36 HB1 CYS 36 -16.370 35.672 -13.335 212 H LYS 37 HN LYS 37 -12.701 34.801 -12.661 213 HA LYS 37 HA LYS 37 -11.990 34.721 -9.839 214 HB2 LYS 37 HB2 LYS 37 -12.339 32.560 -11.051 215 HB3 LYS 37 HB1 LYS 37 -10.960 32.962 -12.065 216 HG2 LYS 37 HG2 LYS 37 -9.690 33.177 -9.810 217 HG3 LYS 37 HG1 LYS 37 -11.027 32.220 -9.172 218 HD2 LYS 37 HD2 LYS 37 -9.576 30.539 -9.762 219 HD3 LYS 37 HD1 LYS 37 -10.488 30.706 -11.265 220 HE2 LYS 37 HE2 LYS 37 -7.873 32.116 -10.725 221 HE3 LYS 37 HE1 LYS 37 -7.996 30.563 -11.546 222 HZ1 LYS 37 HZ1 LYS 37 -7.838 32.317 -13.147 223 HZ2 LYS 37 HZ2 LYS 37 -9.140 33.151 -12.471 224 HZ3 LYS 37 HZ3 LYS 37 -9.389 31.654 -13.226 225 H THR 38 HN THR 38 -11.026 36.815 -9.882 226 HA THR 38 HA THR 38 -8.397 36.800 -11.185 227 HB THR 38 HB THR 38 -9.952 38.446 -12.229 228 HG1 THR 38 HG1 THR 38 -8.133 39.445 -12.532 229 HG21 THR 38 HG21 THR 38 -9.924 39.756 -9.503 230 HG22 THR 38 HG22 THR 38 -11.314 38.985 -10.266 231 HG23 THR 38 HG23 THR 38 -10.622 40.447 -10.968 232 H CYS 39 HN CYS 39 -6.718 37.912 -10.023 233 HA CYS 39 HA CYS 39 -7.087 37.729 -7.143 234 HB2 CYS 39 HB2 CYS 39 -5.122 36.606 -8.111 235 HB3 CYS 39 HB1 CYS 39 -4.569 38.138 -8.777 236 H ASN 40 HN ASN 40 -7.046 39.440 -5.826 237 HA ASN 40 HA ASN 40 -7.150 42.056 -7.112 238 HB2 ASN 40 HB2 ASN 40 -7.982 41.083 -4.385 239 HB3 ASN 40 HB1 ASN 40 -7.963 42.790 -4.815 240 HD21 ASN 40 HD21 ASN 40 -9.470 39.692 -5.418 241 HD22 ASN 40 HD22 ASN 40 -10.864 40.318 -6.219 242 H CYS 41 HN CYS 41 -4.815 40.212 -5.897 243 HA CYS 41 HA CYS 41 -3.426 42.253 -4.394 244 HB2 CYS 41 HB2 CYS 41 -2.501 39.508 -5.228 245 HB3 CYS 41 HB1 CYS 41 -1.741 40.556 -4.035 246 H THR 42 HN THR 42 -1.847 43.480 -5.160 247 HA THR 42 HA THR 42 -1.109 43.092 -7.962 248 HB THR 42 HB THR 42 -2.130 45.199 -7.805 249 HG1 THR 42 HG1 THR 42 -0.488 46.579 -8.364 250 HG21 THR 42 HG21 THR 42 -1.535 46.907 -6.120 251 HG22 THR 42 HG22 THR 42 -0.453 45.746 -5.352 252 HG23 THR 42 HG23 THR 42 -2.191 45.448 -5.379 253 H SER 43 HN SER 43 1.049 43.864 -8.489 254 HA SER 43 HA SER 43 2.978 42.518 -6.891 255 HB2 SER 43 HB2 SER 43 3.357 44.330 -9.272 256 HB3 SER 43 HB1 SER 43 4.574 43.239 -8.600 257 HG SER 43 HG SER 43 2.773 41.601 -8.933 258 H ASP 44 HN ASP 44 1.628 45.567 -6.723 259 HA ASP 44 HA ASP 44 3.940 46.868 -5.545 260 HB2 ASP 44 HB2 ASP 44 2.334 48.125 -6.976 261 HB3 ASP 44 HB1 ASP 44 1.087 47.853 -5.763 262 H GLY 45 HN GLY 45 1.274 44.962 -4.557 263 HA2 GLY 45 HA2 GLY 45 2.104 44.777 -1.889 264 HA3 GLY 45 HA1 GLY 45 0.791 45.944 -1.976 265 H CYS 46 HN CYS 46 1.271 42.969 -1.074 266 HA CYS 46 HA CYS 46 -0.730 41.533 -2.545 267 HB2 CYS 46 HB2 CYS 46 1.306 40.563 -1.289 268 HB3 CYS 46 HB1 CYS 46 0.338 40.768 0.164 269 H LYS 47 HN LYS 47 -2.802 40.913 -1.775 270 HA LYS 47 HA LYS 47 -3.834 42.775 0.252 271 HB2 LYS 47 HB2 LYS 47 -5.260 41.459 -2.055 272 HB3 LYS 47 HB1 LYS 47 -6.041 42.462 -0.842 273 HG2 LYS 47 HG2 LYS 47 -3.857 43.387 -2.698 274 HG3 LYS 47 HG1 LYS 47 -5.582 43.657 -2.946 275 HD2 LYS 47 HD2 LYS 47 -5.635 44.871 -0.769 276 HD3 LYS 47 HD1 LYS 47 -3.882 44.690 -0.677 277 HE2 LYS 47 HE2 LYS 47 -3.602 45.957 -2.715 278 HE3 LYS 47 HE1 LYS 47 -5.348 46.058 -2.928 279 HZ1 LYS 47 HZ1 LYS 47 -4.399 48.089 -2.000 280 HZ2 LYS 47 HZ2 LYS 47 -3.836 47.231 -0.660 281 HZ3 LYS 47 HZ3 LYS 47 -5.498 47.374 -0.929 282 H CYS 48 HN CYS 48 -3.698 39.387 -0.661 283 HA CYS 48 HA CYS 48 -5.657 38.702 1.381 284 HB2 CYS 48 HB2 CYS 48 -5.419 36.421 0.620 285 HB3 CYS 48 HB1 CYS 48 -5.617 37.488 -0.768 286 H GLY 49 HN GLY 49 -2.197 38.558 0.894 287 HA2 GLY 49 HA2 GLY 49 -0.777 38.732 2.852 288 HA3 GLY 49 HA1 GLY 49 -1.935 37.729 3.711 289 H LYS 50 HN LYS 50 -1.752 36.374 0.737 290 HA LYS 50 HA LYS 50 -0.019 34.257 1.667 291 HB2 LYS 50 HB2 LYS 50 -1.278 34.598 -1.061 292 HB3 LYS 50 HB1 LYS 50 -0.590 33.124 -0.403 293 HG2 LYS 50 HG2 LYS 50 -3.029 34.533 0.659 294 HG3 LYS 50 HG1 LYS 50 -3.039 33.117 -0.389 295 HD2 LYS 50 HD2 LYS 50 -1.781 31.889 1.366 296 HD3 LYS 50 HD1 LYS 50 -1.950 33.302 2.412 297 HE2 LYS 50 HE2 LYS 50 -4.386 33.126 2.256 298 HE3 LYS 50 HE1 LYS 50 -4.219 31.714 1.216 299 HZ1 LYS 50 HZ1 LYS 50 -4.667 31.057 3.472 300 HZ2 LYS 50 HZ2 LYS 50 -3.343 31.930 4.038 301 HZ3 LYS 50 HZ3 LYS 50 -3.100 30.578 3.055 302 H GLU 51 HN GLU 51 0.404 37.171 0.164 303 HA GLU 51 HA GLU 51 2.163 38.269 -0.698 304 HB2 GLU 51 HB2 GLU 51 3.389 36.900 1.085 305 HB3 GLU 51 HB1 GLU 51 3.884 35.839 -0.224 306 HG2 GLU 51 HG2 GLU 51 5.013 37.681 -1.322 307 HG3 GLU 51 HG1 GLU 51 4.468 38.786 -0.061 308 H CYS 52 HN CYS 52 0.419 36.640 -2.346 309 HA CYS 52 HA CYS 52 1.977 35.495 -4.445 310 HB2 CYS 52 HB2 CYS 52 -0.291 35.785 -5.694 311 HB3 CYS 52 HB1 CYS 52 -0.168 34.624 -4.376 312 H THR 53 HN THR 53 0.303 38.549 -3.959 313 HA THR 53 HA THR 53 0.397 40.572 -4.964 314 HB THR 53 HB THR 53 2.656 41.438 -5.487 315 HG1 THR 53 HG1 THR 53 3.214 38.813 -5.751 316 HG21 THR 53 HG21 THR 53 1.834 41.448 -3.199 317 HG22 THR 53 HG22 THR 53 3.577 41.168 -3.230 318 HG23 THR 53 HG23 THR 53 2.467 39.822 -2.953 319 H GLY 54 HN GLY 54 -0.583 38.651 -6.705 320 HA2 GLY 54 HA2 GLY 54 -0.926 39.798 -9.043 321 HA3 GLY 54 HA1 GLY 54 0.705 39.175 -9.262 322 HA PRO 55 HA PRO 55 -2.978 35.931 -9.590 323 HB2 PRO 55 HB2 PRO 55 -3.475 36.188 -12.310 324 HB3 PRO 55 HB1 PRO 55 -4.487 36.833 -11.016 325 HG2 PRO 55 HG2 PRO 55 -2.423 38.204 -12.673 326 HG3 PRO 55 HG1 PRO 55 -3.978 38.817 -12.086 327 HD2 PRO 55 HD2 PRO 55 -1.661 39.527 -10.947 328 HD3 PRO 55 HD1 PRO 55 -3.132 39.290 -9.983 329 H ASP 56 HN ASP 56 -0.220 36.805 -11.576 330 HA ASP 56 HA ASP 56 0.062 34.220 -12.773 331 HB2 ASP 56 HB2 ASP 56 1.001 36.141 -13.908 332 HB3 ASP 56 HB1 ASP 56 2.031 36.499 -12.526 333 H SER 57 HN SER 57 1.346 35.771 -9.905 334 HA SER 57 HA SER 57 2.899 33.364 -9.266 335 HB2 SER 57 HB2 SER 57 4.092 35.532 -9.133 336 HB3 SER 57 HB1 SER 57 2.912 36.102 -7.956 337 HG SER 57 HG SER 57 3.609 34.097 -6.759 338 H CYS 58 HN CYS 58 -0.097 34.128 -9.037 339 HA CYS 58 HA CYS 58 -0.684 33.926 -6.257 340 HB2 CYS 58 HB2 CYS 58 -1.985 35.200 -8.008 341 HB3 CYS 58 HB1 CYS 58 -2.533 33.643 -8.617 342 H LYS 59 HN LYS 59 -0.414 32.034 -5.263 343 HA LYS 59 HA LYS 59 -0.907 29.582 -6.802 344 HB2 LYS 59 HB2 LYS 59 0.736 29.933 -4.295 345 HB3 LYS 59 HB1 LYS 59 0.548 28.444 -5.207 346 HG2 LYS 59 HG2 LYS 59 1.839 30.967 -6.225 347 HG3 LYS 59 HG1 LYS 59 2.690 29.538 -5.639 348 HD2 LYS 59 HD2 LYS 59 1.677 28.207 -7.433 349 HD3 LYS 59 HD1 LYS 59 0.831 29.641 -8.017 350 HE2 LYS 59 HE2 LYS 59 2.969 30.736 -8.444 351 HE3 LYS 59 HE1 LYS 59 3.823 29.318 -7.842 352 HZ1 LYS 59 HZ1 LYS 59 2.921 28.028 -9.649 353 HZ2 LYS 59 HZ2 LYS 59 3.712 29.388 -10.265 354 HZ3 LYS 59 HZ3 LYS 59 2.026 29.351 -10.203 355 H CYS 60 HN CYS 60 -2.338 31.499 -4.484 356 HA CYS 60 HA CYS 60 -3.385 29.264 -2.960 357 HB2 CYS 60 HB2 CYS 60 -4.761 31.145 -1.809 358 HB3 CYS 60 HB1 CYS 60 -3.037 31.019 -1.500 359 H GLY 61 HN GLY 61 -5.711 29.003 -2.581 360 HA2 GLY 61 HA2 GLY 61 -6.905 28.361 -5.051 361 HA3 GLY 61 HA1 GLY 61 -7.652 28.219 -3.474 362 H SER 62 HN SER 62 -9.316 28.746 -5.348 363 HA SER 62 HA SER 62 -9.665 31.496 -6.008 364 HB2 SER 62 HB2 SER 62 -11.611 29.206 -6.294 365 HB3 SER 62 HB1 SER 62 -11.633 30.739 -7.168 366 HG SER 62 HG SER 62 -9.865 28.559 -7.429 367 H SER 63 HN SER 63 -10.340 29.619 -3.286 368 HA SER 63 HA SER 63 -12.656 31.197 -2.477 369 HB2 SER 63 HB2 SER 63 -11.231 28.990 -0.980 370 HB3 SER 63 HB1 SER 63 -12.815 29.668 -0.605 371 HG SER 63 HG SER 63 -13.546 28.867 -2.621 372 H CYS 64 HN CYS 64 -9.591 31.935 -2.623 373 HA CYS 64 HA CYS 64 -9.064 32.682 0.104 374 HB2 CYS 64 HB2 CYS 64 -7.256 31.977 -1.441 375 HB3 CYS 64 HB1 CYS 64 -7.540 33.427 -2.396 376 H SER 65 HN SER 65 -8.280 34.994 0.484 377 HA SER 65 HA SER 65 -10.536 36.679 0.163 378 HB2 SER 65 HB2 SER 65 -9.093 36.662 2.183 379 HB3 SER 65 HB1 SER 65 -7.795 37.382 1.233 380 HG SER 65 HG SER 65 -8.946 38.977 2.354 381 H CYS 66 HN CYS 66 -7.572 36.319 -1.667 382 HA CYS 66 HA CYS 66 -7.786 38.952 -2.833 383 HB2 CYS 66 HB2 CYS 66 -5.933 38.182 -4.294 384 HB3 CYS 66 HB1 CYS 66 -5.570 38.050 -2.581 385 H LYS 67 HN LYS 67 -9.480 36.203 -3.197 386 HA LYS 67 HA LYS 67 -9.791 36.475 -6.100 387 HB2 LYS 67 HB2 LYS 67 -10.805 34.272 -4.303 388 HB3 LYS 67 HB1 LYS 67 -10.727 34.234 -6.056 389 HG2 LYS 67 HG2 LYS 67 -8.380 34.314 -4.182 390 HG3 LYS 67 HG1 LYS 67 -8.947 32.905 -5.073 391 HD2 LYS 67 HD2 LYS 67 -8.555 34.295 -7.172 392 HD3 LYS 67 HD1 LYS 67 -7.693 35.425 -6.126 393 HE2 LYS 67 HE2 LYS 67 -7.023 32.546 -6.691 394 HE3 LYS 67 HE1 LYS 67 -6.080 33.983 -7.082 395 HZ1 LYS 67 HZ1 LYS 67 -6.608 32.926 -4.358 396 HZ2 LYS 67 HZ2 LYS 67 -5.754 34.351 -4.700 397 HZ3 LYS 67 HZ3 LYS 67 -5.143 32.861 -5.197 Start of MODEL 9 1 HA2 GLY 1 HA1 GLY 1 -27.788 16.807 -31.207 2 HA3 GLY 1 HA2 GLY 1 -26.377 16.053 -30.481 3 H SER 2 HN SER 2 -25.208 18.538 -29.570 4 HA SER 2 HA SER 2 -27.166 19.486 -27.620 5 HB2 SER 2 HB2 SER 2 -24.431 18.401 -26.911 6 HB3 SER 2 HB1 SER 2 -25.540 19.181 -25.783 7 HG SER 2 HG SER 2 -27.056 17.432 -26.646 8 H GLY 3 HN GLY 3 -26.673 21.531 -26.720 9 HA2 GLY 3 HA2 GLY 3 -24.542 22.992 -28.164 10 HA3 GLY 3 HA1 GLY 3 -26.121 23.691 -27.836 11 H LYS 4 HN LYS 4 -24.477 21.688 -25.528 12 HA LYS 4 HA LYS 4 -23.824 24.057 -23.925 13 HB2 LYS 4 HB2 LYS 4 -25.472 21.693 -23.167 14 HB3 LYS 4 HB1 LYS 4 -24.467 22.452 -21.945 15 HG2 LYS 4 HG2 LYS 4 -25.610 24.562 -22.297 16 HG3 LYS 4 HG1 LYS 4 -26.587 23.826 -23.569 17 HD2 LYS 4 HD2 LYS 4 -27.709 22.429 -22.053 18 HD3 LYS 4 HD1 LYS 4 -26.519 22.716 -20.786 19 HE2 LYS 4 HE2 LYS 4 -28.364 24.822 -21.899 20 HE3 LYS 4 HE1 LYS 4 -28.682 23.892 -20.434 21 HZ1 LYS 4 HZ1 LYS 4 -26.308 25.624 -20.844 22 HZ2 LYS 4 HZ2 LYS 4 -26.728 24.819 -19.421 23 HZ3 LYS 4 HZ3 LYS 4 -27.690 26.075 -19.993 24 H GLY 5 HN GLY 5 -22.212 23.750 -22.361 25 HA2 GLY 5 HA2 GLY 5 -20.749 21.269 -22.246 26 HA3 GLY 5 HA1 GLY 5 -19.888 22.591 -23.033 27 H LYS 6 HN LYS 6 -19.597 21.129 -20.366 28 HA LYS 6 HA LYS 6 -19.511 23.570 -18.730 29 HB2 LYS 6 HB2 LYS 6 -21.231 22.052 -17.885 30 HB3 LYS 6 HB1 LYS 6 -20.068 20.738 -17.820 31 HG2 LYS 6 HG2 LYS 6 -18.803 21.959 -16.101 32 HG3 LYS 6 HG1 LYS 6 -20.002 23.251 -16.154 33 HD2 LYS 6 HD2 LYS 6 -20.643 20.378 -15.485 34 HD3 LYS 6 HD1 LYS 6 -20.306 21.617 -14.277 35 HE2 LYS 6 HE2 LYS 6 -22.524 21.759 -16.323 36 HE3 LYS 6 HE1 LYS 6 -22.729 21.239 -14.653 37 HZ1 LYS 6 HZ1 LYS 6 -23.326 23.571 -14.980 38 HZ2 LYS 6 HZ2 LYS 6 -21.752 23.920 -15.488 39 HZ3 LYS 6 HZ3 LYS 6 -22.032 23.407 -13.905 40 H GLY 7 HN GLY 7 -17.642 23.993 -17.665 41 HA2 GLY 7 HA2 GLY 7 -15.313 22.476 -18.465 42 HA3 GLY 7 HA1 GLY 7 -15.322 23.937 -17.484 43 H GLU 8 HN GLU 8 -15.229 23.777 -15.324 44 HA GLU 8 HA GLU 8 -15.015 21.077 -14.234 45 HB2 GLU 8 HB2 GLU 8 -14.133 22.536 -12.201 46 HB3 GLU 8 HB1 GLU 8 -13.068 22.054 -13.520 47 HG2 GLU 8 HG2 GLU 8 -12.576 24.202 -13.782 48 HG3 GLU 8 HG1 GLU 8 -14.253 24.512 -14.229 49 H LYS 9 HN LYS 9 -15.691 23.838 -12.220 50 HA LYS 9 HA LYS 9 -18.322 22.684 -11.581 51 HB2 LYS 9 HB2 LYS 9 -16.510 24.514 -9.968 52 HB3 LYS 9 HB1 LYS 9 -18.133 24.057 -9.483 53 HG2 LYS 9 HG2 LYS 9 -16.693 22.697 -8.234 54 HG3 LYS 9 HG1 LYS 9 -17.312 21.656 -9.516 55 HD2 LYS 9 HD2 LYS 9 -15.260 21.947 -10.771 56 HD3 LYS 9 HD1 LYS 9 -14.641 23.066 -9.554 57 HE2 LYS 9 HE2 LYS 9 -14.713 21.261 -7.890 58 HE3 LYS 9 HE1 LYS 9 -15.308 20.153 -9.125 59 HZ1 LYS 9 HZ1 LYS 9 -12.928 19.919 -8.779 60 HZ2 LYS 9 HZ2 LYS 9 -12.682 21.540 -9.185 61 HZ3 LYS 9 HZ3 LYS 9 -13.252 20.456 -10.346 62 H CYS 10 HN CYS 10 -17.107 24.639 -13.631 63 HA CYS 10 HA CYS 10 -18.092 27.138 -13.063 64 HB2 CYS 10 HB2 CYS 10 -17.361 25.927 -15.710 65 HB3 CYS 10 HB1 CYS 10 -17.768 27.624 -15.485 66 H THR 11 HN THR 11 -19.799 28.318 -13.964 67 HA THR 11 HA THR 11 -22.129 26.670 -14.602 68 HB THR 11 HB THR 11 -23.470 28.512 -13.689 69 HG1 THR 11 HG1 THR 11 -22.503 30.348 -12.898 70 HG21 THR 11 HG21 THR 11 -22.781 28.320 -11.333 71 HG22 THR 11 HG22 THR 11 -21.219 27.678 -11.846 72 HG23 THR 11 HG23 THR 11 -22.695 26.761 -12.152 73 H SER 12 HN SER 12 -23.826 28.436 -15.692 74 HA SER 12 HA SER 12 -22.820 28.780 -18.306 75 HB2 SER 12 HB2 SER 12 -25.213 28.332 -17.793 76 HB3 SER 12 HB1 SER 12 -25.346 29.946 -17.098 77 HG SER 12 HG SER 12 -24.756 29.270 -19.800 78 H ALA 13 HN ALA 13 -23.063 30.907 -15.532 79 HA ALA 13 HA ALA 13 -22.840 33.378 -16.808 80 HB1 ALA 13 HB1 ALA 13 -23.451 33.131 -14.453 81 HB2 ALA 13 HB2 ALA 13 -22.072 34.216 -14.641 82 HB3 ALA 13 HB3 ALA 13 -21.822 32.560 -14.087 83 H CYS 14 HN CYS 14 -20.339 31.254 -15.466 84 HA CYS 14 HA CYS 14 -18.156 32.849 -16.225 85 HB2 CYS 14 HB2 CYS 14 -18.017 31.036 -14.553 86 HB3 CYS 14 HB1 CYS 14 -18.227 29.852 -15.834 87 H ARG 15 HN ARG 15 -19.859 30.253 -17.932 88 HA ARG 15 HA ARG 15 -17.996 30.377 -20.124 89 HB2 ARG 15 HB2 ARG 15 -20.570 28.860 -19.804 90 HB3 ARG 15 HB1 ARG 15 -19.615 28.831 -21.281 91 HG2 ARG 15 HG2 ARG 15 -17.695 28.214 -19.551 92 HG3 ARG 15 HG1 ARG 15 -19.084 27.598 -18.654 93 HD2 ARG 15 HD2 ARG 15 -18.229 25.816 -20.002 94 HD3 ARG 15 HD1 ARG 15 -19.756 26.347 -20.708 95 HE ARG 15 HE ARG 15 -17.308 27.502 -21.799 96 HH11 ARG 15 HH11 ARG 15 -19.917 25.191 -22.181 97 HH12 ARG 15 HH12 ARG 15 -19.621 24.947 -23.874 98 HH21 ARG 15 HH21 ARG 15 -16.915 27.169 -24.027 99 HH22 ARG 15 HH22 ARG 15 -17.903 26.064 -24.920 100 H SER 16 HN SER 16 -19.778 32.721 -19.335 101 HA SER 16 HA SER 16 -20.785 33.292 -22.031 102 HB2 SER 16 HB2 SER 16 -21.264 34.786 -19.434 103 HB3 SER 16 HB1 SER 16 -22.021 35.139 -20.990 104 HG SER 16 HG SER 16 -22.266 32.682 -19.574 105 H GLU 17 HN GLU 17 -20.220 35.500 -22.873 106 HA GLU 17 HA GLU 17 -17.608 36.334 -21.826 107 HB2 GLU 17 HB2 GLU 17 -18.526 36.026 -24.661 108 HB3 GLU 17 HB1 GLU 17 -17.195 37.099 -24.253 109 HG2 GLU 17 HG2 GLU 17 -17.300 34.160 -23.616 110 HG3 GLU 17 HG1 GLU 17 -16.449 34.877 -24.983 111 HA PRO 18 HA PRO 18 -16.585 37.654 -21.001 112 HB2 PRO 18 HB2 PRO 18 -16.544 39.366 -18.934 113 HB3 PRO 18 HB1 PRO 18 -15.965 39.839 -20.535 114 HG2 PRO 18 HG2 PRO 18 -18.593 40.421 -19.226 115 HG3 PRO 18 HG1 PRO 18 -17.553 41.499 -20.172 116 HD2 PRO 18 HD2 PRO 18 -19.758 40.254 -21.195 117 HD3 PRO 18 HD1 PRO 18 -18.351 40.713 -22.175 118 H CYS 19 HN CYS 19 -16.288 36.790 -18.747 119 HA CYS 19 HA CYS 19 -18.365 35.117 -18.004 120 HB2 CYS 19 HB2 CYS 19 -16.077 36.106 -16.300 121 HB3 CYS 19 HB1 CYS 19 -17.110 34.736 -15.905 122 H GLN 20 HN GLN 20 -20.177 35.383 -16.977 123 HA GLN 20 HA GLN 20 -20.845 38.028 -15.955 124 HB2 GLN 20 HB2 GLN 20 -22.544 35.591 -16.460 125 HB3 GLN 20 HB1 GLN 20 -23.152 37.156 -15.939 126 HG2 GLN 20 HG2 GLN 20 -21.678 36.638 -18.503 127 HG3 GLN 20 HG1 GLN 20 -23.425 36.760 -18.332 128 HE21 GLN 20 HE21 GLN 20 -20.429 38.466 -18.412 129 HE22 GLN 20 HE22 GLN 20 -21.094 40.064 -18.441 130 H CYS 21 HN CYS 21 -19.249 35.827 -14.597 131 HA CYS 21 HA CYS 21 -20.671 34.967 -12.360 132 HB2 CYS 21 HB2 CYS 21 -17.831 35.206 -13.105 133 HB3 CYS 21 HB1 CYS 21 -18.178 35.012 -11.393 134 H GLY 22 HN GLY 22 -19.031 37.948 -13.137 135 HA2 GLY 22 HA2 GLY 22 -18.904 39.974 -12.088 136 HA3 GLY 22 HA1 GLY 22 -20.252 39.438 -11.094 137 H SER 23 HN SER 23 -19.598 40.095 -9.142 138 HA SER 23 HA SER 23 -16.959 39.285 -8.193 139 HB2 SER 23 HB2 SER 23 -19.026 41.113 -6.940 140 HB3 SER 23 HB1 SER 23 -17.412 40.801 -6.301 141 HG SER 23 HG SER 23 -16.856 42.425 -7.504 142 H LYS 24 HN LYS 24 -19.643 37.704 -8.533 143 HA LYS 24 HA LYS 24 -19.915 36.721 -5.789 144 HB2 LYS 24 HB2 LYS 24 -21.535 36.086 -8.265 145 HB3 LYS 24 HB1 LYS 24 -21.884 35.518 -6.638 146 HG2 LYS 24 HG2 LYS 24 -22.253 37.821 -5.911 147 HG3 LYS 24 HG1 LYS 24 -21.906 38.388 -7.545 148 HD2 LYS 24 HD2 LYS 24 -23.812 37.169 -8.408 149 HD3 LYS 24 HD1 LYS 24 -24.131 36.490 -6.811 150 HE2 LYS 24 HE2 LYS 24 -24.239 39.412 -7.551 151 HE3 LYS 24 HE1 LYS 24 -25.629 38.358 -7.297 152 HZ1 LYS 24 HZ1 LYS 24 -23.628 39.196 -5.268 153 HZ2 LYS 24 HZ2 LYS 24 -24.811 38.022 -4.992 154 HZ3 LYS 24 HZ3 LYS 24 -25.267 39.613 -5.321 155 H CYS 25 HN CYS 25 -19.531 35.534 -9.079 156 HA CYS 25 HA CYS 25 -18.434 33.816 -10.000 157 HB2 CYS 25 HB2 CYS 25 -16.693 34.804 -8.144 158 HB3 CYS 25 HB1 CYS 25 -16.761 33.093 -7.724 159 H GLN 26 HN GLN 26 -19.874 32.336 -10.300 160 HA GLN 26 HA GLN 26 -20.750 30.602 -8.133 161 HB2 GLN 26 HB2 GLN 26 -21.562 30.638 -11.034 162 HB3 GLN 26 HB1 GLN 26 -22.341 29.730 -9.748 163 HG2 GLN 26 HG2 GLN 26 -23.079 31.744 -8.693 164 HG3 GLN 26 HG1 GLN 26 -22.159 32.726 -9.832 165 HE21 GLN 26 HE21 GLN 26 -25.017 32.681 -9.245 166 HE22 GLN 26 HE22 GLN 26 -25.800 32.377 -10.753 167 H CYS 27 HN CYS 27 -18.348 30.574 -10.534 168 HA CYS 27 HA CYS 27 -18.419 27.701 -10.921 169 HB2 CYS 27 HB2 CYS 27 -16.574 28.055 -12.470 170 HB3 CYS 27 HB1 CYS 27 -17.900 29.161 -12.822 171 H GLY 28 HN GLY 28 -15.933 26.854 -11.045 172 HA2 GLY 28 HA2 GLY 28 -15.120 26.807 -8.271 173 HA3 GLY 28 HA1 GLY 28 -14.473 25.824 -9.577 174 H GLU 29 HN GLU 29 -12.517 26.332 -10.371 175 HA GLU 29 HA GLU 29 -11.473 29.015 -10.238 176 HB2 GLU 29 HB2 GLU 29 -9.623 28.516 -8.694 177 HB3 GLU 29 HB1 GLU 29 -11.190 28.340 -7.909 178 HG2 GLU 29 HG2 GLU 29 -11.025 25.872 -8.458 179 HG3 GLU 29 HG1 GLU 29 -9.340 26.180 -8.860 180 H GLY 30 HN GLY 30 -11.595 26.161 -11.666 181 HA2 GLY 30 HA2 GLY 30 -8.794 25.886 -12.445 182 HA3 GLY 30 HA1 GLY 30 -10.110 24.823 -12.901 183 H CYS 31 HN CYS 31 -11.348 27.682 -13.570 184 HA CYS 31 HA CYS 31 -10.922 27.429 -16.383 185 HB2 CYS 31 HB2 CYS 31 -12.314 29.570 -16.342 186 HB3 CYS 31 HB1 CYS 31 -13.057 28.108 -15.686 187 H THR 32 HN THR 32 -9.659 29.393 -13.804 188 HA THR 32 HA THR 32 -8.177 31.104 -13.657 189 HB THR 32 HB THR 32 -6.120 30.882 -15.046 190 HG1 THR 32 HG1 THR 32 -7.772 29.494 -16.651 191 HG21 THR 32 HG21 THR 32 -6.347 29.613 -12.974 192 HG22 THR 32 HG22 THR 32 -5.461 28.674 -14.177 193 HG23 THR 32 HG23 THR 32 -7.155 28.311 -13.846 194 H CYS 33 HN CYS 33 -10.434 31.909 -14.995 195 HA CYS 33 HA CYS 33 -9.996 33.219 -17.453 196 HB2 CYS 33 HB2 CYS 33 -11.998 33.852 -15.291 197 HB3 CYS 33 HB1 CYS 33 -12.104 34.338 -16.982 198 H ALA 34 HN ALA 34 -10.482 35.703 -17.545 199 HA ALA 34 HA ALA 34 -8.622 37.038 -15.696 200 HB1 ALA 34 HB1 ALA 34 -9.399 37.822 -18.507 201 HB2 ALA 34 HB2 ALA 34 -7.885 37.054 -18.030 202 HB3 ALA 34 HB3 ALA 34 -8.260 38.684 -17.471 203 H ALA 35 HN ALA 35 -11.780 36.569 -16.172 204 HA ALA 35 HA ALA 35 -12.581 39.333 -15.611 205 HB1 ALA 35 HB1 ALA 35 -14.247 36.966 -16.459 206 HB2 ALA 35 HB2 ALA 35 -13.727 38.299 -17.489 207 HB3 ALA 35 HB3 ALA 35 -14.861 38.594 -16.170 208 H CYS 36 HN CYS 36 -13.753 36.102 -14.622 209 HA CYS 36 HA CYS 36 -14.458 37.195 -12.051 210 HB2 CYS 36 HB2 CYS 36 -15.293 34.851 -11.624 211 HB3 CYS 36 HB1 CYS 36 -16.049 35.718 -12.954 212 H LYS 37 HN LYS 37 -11.760 35.746 -13.436 213 HA LYS 37 HA LYS 37 -10.771 34.888 -10.829 214 HB2 LYS 37 HB2 LYS 37 -10.217 33.958 -13.581 215 HB3 LYS 37 HB1 LYS 37 -8.847 33.978 -12.479 216 HG2 LYS 37 HG2 LYS 37 -9.995 31.804 -12.568 217 HG3 LYS 37 HG1 LYS 37 -9.988 32.516 -10.954 218 HD2 LYS 37 HD2 LYS 37 -12.280 33.407 -11.459 219 HD3 LYS 37 HD1 LYS 37 -12.254 32.421 -12.924 220 HE2 LYS 37 HE2 LYS 37 -12.132 30.426 -11.692 221 HE3 LYS 37 HE1 LYS 37 -11.764 31.284 -10.196 222 HZ1 LYS 37 HZ1 LYS 37 -14.025 30.596 -10.166 223 HZ2 LYS 37 HZ2 LYS 37 -14.330 31.288 -11.672 224 HZ3 LYS 37 HZ3 LYS 37 -14.008 32.279 -10.341 225 H THR 38 HN THR 38 -10.918 37.503 -11.154 226 HA THR 38 HA THR 38 -8.285 38.438 -11.906 227 HB THR 38 HB THR 38 -10.199 39.805 -12.622 228 HG1 THR 38 HG1 THR 38 -8.209 40.844 -12.074 229 HG21 THR 38 HG21 THR 38 -10.746 40.169 -9.672 230 HG22 THR 38 HG22 THR 38 -11.767 39.299 -10.818 231 HG23 THR 38 HG23 THR 38 -11.552 41.044 -10.976 232 H CYS 39 HN CYS 39 -6.714 38.789 -10.474 233 HA CYS 39 HA CYS 39 -7.313 38.359 -7.659 234 HB2 CYS 39 HB2 CYS 39 -5.394 37.149 -8.720 235 HB3 CYS 39 HB1 CYS 39 -4.615 38.700 -8.999 236 H ASN 40 HN ASN 40 -7.176 39.911 -6.155 237 HA ASN 40 HA ASN 40 -6.971 42.634 -7.157 238 HB2 ASN 40 HB2 ASN 40 -7.964 41.448 -4.579 239 HB3 ASN 40 HB1 ASN 40 -7.694 43.180 -4.752 240 HD21 ASN 40 HD21 ASN 40 -9.552 40.445 -5.904 241 HD22 ASN 40 HD22 ASN 40 -10.839 41.377 -6.586 242 H CYS 41 HN CYS 41 -4.948 40.388 -5.896 243 HA CYS 41 HA CYS 41 -3.323 42.142 -4.310 244 HB2 CYS 41 HB2 CYS 41 -2.691 39.400 -5.399 245 HB3 CYS 41 HB1 CYS 41 -1.880 40.228 -4.073 246 H THR 42 HN THR 42 -1.585 43.243 -4.985 247 HA THR 42 HA THR 42 -0.983 43.115 -7.849 248 HB THR 42 HB THR 42 -0.171 45.440 -7.590 249 HG1 THR 42 HG1 THR 42 -1.238 46.187 -5.324 250 HG21 THR 42 HG21 THR 42 -2.364 46.500 -7.272 251 HG22 THR 42 HG22 THR 42 -2.977 45.010 -6.550 252 HG23 THR 42 HG23 THR 42 -2.507 45.036 -8.250 253 H SER 43 HN SER 43 1.321 43.853 -8.315 254 HA SER 43 HA SER 43 3.125 42.159 -6.922 255 HB2 SER 43 HB2 SER 43 3.723 44.341 -8.929 256 HB3 SER 43 HB1 SER 43 4.795 43.014 -8.475 257 HG SER 43 HG SER 43 3.486 41.586 -9.490 258 H ASP 44 HN ASP 44 1.930 45.211 -6.280 259 HA ASP 44 HA ASP 44 4.247 46.320 -4.982 260 HB2 ASP 44 HB2 ASP 44 1.336 47.146 -4.859 261 HB3 ASP 44 HB1 ASP 44 2.684 48.073 -4.214 262 H GLY 45 HN GLY 45 1.275 44.667 -4.061 263 HA2 GLY 45 HA2 GLY 45 2.420 43.668 -1.671 264 HA3 GLY 45 HA1 GLY 45 1.291 44.976 -1.339 265 H CYS 46 HN CYS 46 1.318 41.967 -0.941 266 HA CYS 46 HA CYS 46 -0.904 41.029 -2.489 267 HB2 CYS 46 HB2 CYS 46 0.974 39.594 -1.611 268 HB3 CYS 46 HB1 CYS 46 0.279 39.796 -0.009 269 H LYS 47 HN LYS 47 -3.008 41.139 -1.974 270 HA LYS 47 HA LYS 47 -3.697 42.578 0.438 271 HB2 LYS 47 HB2 LYS 47 -5.298 41.786 -1.974 272 HB3 LYS 47 HB1 LYS 47 -6.026 42.518 -0.550 273 HG2 LYS 47 HG2 LYS 47 -4.515 44.449 -0.823 274 HG3 LYS 47 HG1 LYS 47 -3.919 43.728 -2.320 275 HD2 LYS 47 HD2 LYS 47 -6.112 43.854 -3.303 276 HD3 LYS 47 HD1 LYS 47 -6.803 44.415 -1.779 277 HE2 LYS 47 HE2 LYS 47 -4.732 45.877 -3.410 278 HE3 LYS 47 HE1 LYS 47 -6.454 46.249 -3.374 279 HZ1 LYS 47 HZ1 LYS 47 -4.598 46.391 -1.056 280 HZ2 LYS 47 HZ2 LYS 47 -6.257 46.731 -1.010 281 HZ3 LYS 47 HZ3 LYS 47 -5.221 47.705 -1.917 282 H CYS 48 HN CYS 48 -4.271 39.363 -0.936 283 HA CYS 48 HA CYS 48 -6.069 38.690 1.216 284 HB2 CYS 48 HB2 CYS 48 -6.231 36.522 0.236 285 HB3 CYS 48 HB1 CYS 48 -6.191 37.680 -1.092 286 H GLY 49 HN GLY 49 -2.691 38.264 0.469 287 HA2 GLY 49 HA2 GLY 49 -1.113 38.239 2.272 288 HA3 GLY 49 HA1 GLY 49 -2.301 37.387 3.245 289 H LYS 50 HN LYS 50 -2.439 36.004 0.250 290 HA LYS 50 HA LYS 50 -0.926 33.731 1.206 291 HB2 LYS 50 HB2 LYS 50 -2.414 34.043 -1.407 292 HB3 LYS 50 HB1 LYS 50 -1.788 32.541 -0.743 293 HG2 LYS 50 HG2 LYS 50 -4.085 34.206 0.249 294 HG3 LYS 50 HG1 LYS 50 -4.091 32.522 -0.279 295 HD2 LYS 50 HD2 LYS 50 -2.746 31.907 1.675 296 HD3 LYS 50 HD1 LYS 50 -2.723 33.592 2.193 297 HE2 LYS 50 HE2 LYS 50 -4.400 32.492 3.470 298 HE3 LYS 50 HE1 LYS 50 -5.226 33.501 2.285 299 HZ1 LYS 50 HZ1 LYS 50 -5.525 31.523 0.904 300 HZ2 LYS 50 HZ2 LYS 50 -6.245 31.334 2.420 301 HZ3 LYS 50 HZ3 LYS 50 -4.778 30.577 2.089 302 H GLU 51 HN GLU 51 -0.110 36.476 -0.320 303 HA GLU 51 HA GLU 51 1.833 37.232 -1.194 304 HB2 GLU 51 HB2 GLU 51 2.781 35.498 0.435 305 HB3 GLU 51 HB1 GLU 51 2.976 34.458 -0.965 306 HG2 GLU 51 HG2 GLU 51 4.387 36.221 -1.999 307 HG3 GLU 51 HG1 GLU 51 4.279 37.122 -0.486 308 H CYS 52 HN CYS 52 -0.299 35.844 -2.787 309 HA CYS 52 HA CYS 52 0.969 34.673 -5.042 310 HB2 CYS 52 HB2 CYS 52 -1.317 35.256 -6.097 311 HB3 CYS 52 HB1 CYS 52 -1.274 34.080 -4.781 312 H THR 53 HN THR 53 -0.391 37.854 -4.351 313 HA THR 53 HA THR 53 -0.156 39.904 -5.273 314 HB THR 53 HB THR 53 2.171 40.594 -5.887 315 HG1 THR 53 HG1 THR 53 2.509 38.002 -6.269 316 HG21 THR 53 HG21 THR 53 1.361 40.664 -3.577 317 HG22 THR 53 HG22 THR 53 3.085 40.289 -3.645 318 HG23 THR 53 HG23 THR 53 1.911 39.007 -3.339 319 H GLY 54 HN GLY 54 -1.163 37.901 -7.079 320 HA2 GLY 54 HA2 GLY 54 -1.513 39.273 -9.362 321 HA3 GLY 54 HA1 GLY 54 0.021 38.456 -9.637 322 HA PRO 55 HA PRO 55 -3.954 35.694 -10.091 323 HB2 PRO 55 HB2 PRO 55 -4.478 35.974 -12.754 324 HB3 PRO 55 HB1 PRO 55 -5.260 36.925 -11.487 325 HG2 PRO 55 HG2 PRO 55 -2.955 37.657 -13.253 326 HG3 PRO 55 HG1 PRO 55 -4.350 38.640 -12.774 327 HD2 PRO 55 HD2 PRO 55 -1.936 38.915 -11.609 328 HD3 PRO 55 HD1 PRO 55 -3.448 39.134 -10.706 329 H ASP 56 HN ASP 56 -1.195 36.242 -12.215 330 HA ASP 56 HA ASP 56 -1.266 33.592 -13.319 331 HB2 ASP 56 HB2 ASP 56 -0.296 35.501 -14.561 332 HB3 ASP 56 HB1 ASP 56 0.984 35.613 -13.358 333 H SER 57 HN SER 57 -0.123 34.988 -10.462 334 HA SER 57 HA SER 57 1.489 32.598 -9.870 335 HB2 SER 57 HB2 SER 57 1.721 35.345 -8.625 336 HB3 SER 57 HB1 SER 57 2.785 33.965 -8.345 337 HG SER 57 HG SER 57 3.344 34.061 -10.566 338 H CYS 58 HN CYS 58 -1.464 33.316 -9.573 339 HA CYS 58 HA CYS 58 -1.950 33.543 -6.782 340 HB2 CYS 58 HB2 CYS 58 -3.434 33.968 -9.014 341 HB3 CYS 58 HB1 CYS 58 -4.073 32.417 -8.479 342 H LYS 59 HN LYS 59 -2.141 32.009 -5.286 343 HA LYS 59 HA LYS 59 -1.941 29.204 -6.181 344 HB2 LYS 59 HB2 LYS 59 -1.048 30.315 -3.515 345 HB3 LYS 59 HB1 LYS 59 -0.724 28.717 -4.162 346 HG2 LYS 59 HG2 LYS 59 0.354 31.306 -5.273 347 HG3 LYS 59 HG1 LYS 59 1.243 30.180 -4.252 348 HD2 LYS 59 HD2 LYS 59 0.031 29.249 -6.833 349 HD3 LYS 59 HD1 LYS 59 1.562 30.117 -6.838 350 HE2 LYS 59 HE2 LYS 59 1.997 27.743 -6.824 351 HE3 LYS 59 HE1 LYS 59 2.485 28.429 -5.282 352 HZ1 LYS 59 HZ1 LYS 59 0.526 27.551 -4.258 353 HZ2 LYS 59 HZ2 LYS 59 1.286 26.302 -5.100 354 HZ3 LYS 59 HZ3 LYS 59 -0.091 27.030 -5.745 355 H CYS 60 HN CYS 60 -4.179 31.246 -5.216 356 HA CYS 60 HA CYS 60 -5.523 29.300 -3.478 357 HB2 CYS 60 HB2 CYS 60 -6.719 31.506 -2.660 358 HB3 CYS 60 HB1 CYS 60 -5.178 30.992 -1.979 359 H GLY 61 HN GLY 61 -7.886 29.364 -3.541 360 HA2 GLY 61 HA2 GLY 61 -8.791 29.350 -6.261 361 HA3 GLY 61 HA1 GLY 61 -9.719 28.893 -4.846 362 H SER 62 HN SER 62 -11.450 29.975 -6.006 363 HA SER 62 HA SER 62 -11.321 32.836 -6.364 364 HB2 SER 62 HB2 SER 62 -13.725 31.066 -6.717 365 HB3 SER 62 HB1 SER 62 -13.383 32.617 -7.487 366 HG SER 62 HG SER 62 -12.701 30.145 -8.273 367 H SER 63 HN SER 63 -12.104 30.751 -3.848 368 HA SER 63 HA SER 63 -14.132 32.477 -2.695 369 HB2 SER 63 HB2 SER 63 -12.839 29.989 -1.556 370 HB3 SER 63 HB1 SER 63 -14.287 30.791 -0.946 371 HG SER 63 HG SER 63 -14.061 29.755 -3.575 372 H CYS 64 HN CYS 64 -11.086 33.038 -3.096 373 HA CYS 64 HA CYS 64 -10.316 33.507 -0.348 374 HB2 CYS 64 HB2 CYS 64 -8.765 32.570 -2.116 375 HB3 CYS 64 HB1 CYS 64 -8.762 34.171 -2.846 376 H SER 65 HN SER 65 -9.204 35.724 0.016 377 HA SER 65 HA SER 65 -11.257 37.672 -0.343 378 HB2 SER 65 HB2 SER 65 -9.474 39.093 0.921 379 HB3 SER 65 HB1 SER 65 -10.307 37.778 1.752 380 HG SER 65 HG SER 65 -8.278 37.282 2.172 381 H CYS 66 HN CYS 66 -8.434 36.880 -2.108 382 HA CYS 66 HA CYS 66 -8.143 39.542 -3.222 383 HB2 CYS 66 HB2 CYS 66 -6.411 38.477 -4.655 384 HB3 CYS 66 HB1 CYS 66 -6.116 38.273 -2.936 385 H LYS 67 HN LYS 67 -10.395 37.307 -3.596 386 HA LYS 67 HA LYS 67 -10.558 37.506 -6.525 387 HB2 LYS 67 HB2 LYS 67 -11.984 35.579 -4.693 388 HB3 LYS 67 HB1 LYS 67 -11.900 35.501 -6.448 389 HG2 LYS 67 HG2 LYS 67 -9.441 35.377 -4.741 390 HG3 LYS 67 HG1 LYS 67 -10.380 33.937 -5.126 391 HD2 LYS 67 HD2 LYS 67 -9.665 33.902 -7.274 392 HD3 LYS 67 HD1 LYS 67 -9.698 35.659 -7.418 393 HE2 LYS 67 HE2 LYS 67 -7.418 34.813 -7.588 394 HE3 LYS 67 HE1 LYS 67 -7.641 35.811 -6.152 395 HZ1 LYS 67 HZ1 LYS 67 -7.606 32.838 -6.157 396 HZ2 LYS 67 HZ2 LYS 67 -7.745 33.844 -4.805 397 HZ3 LYS 67 HZ3 LYS 67 -6.321 33.844 -5.704 Start of MODEL 10 1 HA2 GLY 1 HA1 GLY 1 -15.403 4.978 -13.430 2 HA3 GLY 1 HA2 GLY 1 -14.124 5.893 -12.646 3 H SER 2 HN SER 2 -13.606 5.242 -15.942 4 HA SER 2 HA SER 2 -13.877 8.032 -16.590 5 HB2 SER 2 HB2 SER 2 -13.097 5.686 -18.335 6 HB3 SER 2 HB1 SER 2 -12.936 7.391 -18.759 7 HG SER 2 HG SER 2 -10.971 6.782 -17.991 8 H GLY 3 HN GLY 3 -15.226 8.879 -18.234 9 HA2 GLY 3 HA2 GLY 3 -16.962 8.690 -19.845 10 HA3 GLY 3 HA1 GLY 3 -17.382 7.122 -19.169 11 H LYS 4 HN LYS 4 -16.820 9.224 -16.678 12 HA LYS 4 HA LYS 4 -19.606 9.372 -16.039 13 HB2 LYS 4 HB2 LYS 4 -18.788 10.662 -14.029 14 HB3 LYS 4 HB1 LYS 4 -18.145 9.036 -14.198 15 HG2 LYS 4 HG2 LYS 4 -16.069 9.925 -15.078 16 HG3 LYS 4 HG1 LYS 4 -16.710 11.567 -14.978 17 HD2 LYS 4 HD2 LYS 4 -16.862 11.394 -12.574 18 HD3 LYS 4 HD1 LYS 4 -16.355 9.705 -12.631 19 HE2 LYS 4 HE2 LYS 4 -14.698 12.064 -13.519 20 HE3 LYS 4 HE1 LYS 4 -14.521 11.212 -11.986 21 HZ1 LYS 4 HZ1 LYS 4 -14.010 9.191 -13.247 22 HZ2 LYS 4 HZ2 LYS 4 -12.904 10.423 -13.565 23 HZ3 LYS 4 HZ3 LYS 4 -14.100 10.058 -14.693 24 H GLY 5 HN GLY 5 -20.971 11.018 -16.280 25 HA2 GLY 5 HA2 GLY 5 -20.181 13.190 -17.986 26 HA3 GLY 5 HA1 GLY 5 -21.795 12.872 -17.368 27 H LYS 6 HN LYS 6 -18.675 14.265 -16.621 28 HA LYS 6 HA LYS 6 -19.784 15.581 -14.272 29 HB2 LYS 6 HB2 LYS 6 -17.519 16.374 -13.847 30 HB3 LYS 6 HB1 LYS 6 -17.534 14.633 -14.079 31 HG2 LYS 6 HG2 LYS 6 -16.660 14.879 -16.315 32 HG3 LYS 6 HG1 LYS 6 -16.759 16.637 -16.192 33 HD2 LYS 6 HD2 LYS 6 -15.036 14.857 -14.462 34 HD3 LYS 6 HD1 LYS 6 -14.465 15.805 -15.836 35 HE2 LYS 6 HE2 LYS 6 -15.187 17.864 -14.694 36 HE3 LYS 6 HE1 LYS 6 -15.717 16.903 -13.318 37 HZ1 LYS 6 HZ1 LYS 6 -13.436 16.160 -13.015 38 HZ2 LYS 6 HZ2 LYS 6 -13.550 17.845 -12.921 39 HZ3 LYS 6 HZ3 LYS 6 -12.936 17.116 -14.318 40 H GLY 7 HN GLY 7 -18.928 16.214 -17.563 41 HA2 GLY 7 HA2 GLY 7 -19.221 18.053 -18.905 42 HA3 GLY 7 HA1 GLY 7 -20.397 18.594 -17.714 43 H GLU 8 HN GLU 8 -20.011 20.460 -16.904 44 HA GLU 8 HA GLU 8 -17.335 21.180 -16.098 45 HB2 GLU 8 HB2 GLU 8 -17.571 23.437 -17.149 46 HB3 GLU 8 HB1 GLU 8 -17.383 22.126 -18.303 47 HG2 GLU 8 HG2 GLU 8 -19.822 22.139 -18.659 48 HG3 GLU 8 HG1 GLU 8 -19.943 23.525 -17.575 49 H LYS 9 HN LYS 9 -17.335 22.381 -14.306 50 HA LYS 9 HA LYS 9 -19.818 22.594 -12.876 51 HB2 LYS 9 HB2 LYS 9 -17.037 23.468 -12.103 52 HB3 LYS 9 HB1 LYS 9 -18.427 23.461 -11.028 53 HG2 LYS 9 HG2 LYS 9 -17.149 21.066 -12.323 54 HG3 LYS 9 HG1 LYS 9 -17.058 21.526 -10.623 55 HD2 LYS 9 HD2 LYS 9 -19.512 21.269 -10.460 56 HD3 LYS 9 HD1 LYS 9 -19.539 20.717 -12.136 57 HE2 LYS 9 HE2 LYS 9 -18.044 18.875 -11.530 58 HE3 LYS 9 HE1 LYS 9 -18.080 19.418 -9.853 59 HZ1 LYS 9 HZ1 LYS 9 -19.626 17.609 -10.199 60 HZ2 LYS 9 HZ2 LYS 9 -20.416 18.461 -11.426 61 HZ3 LYS 9 HZ3 LYS 9 -20.476 19.023 -9.835 62 H CYS 10 HN CYS 10 -18.539 24.532 -15.151 63 HA CYS 10 HA CYS 10 -19.070 27.042 -13.884 64 HB2 CYS 10 HB2 CYS 10 -18.361 26.359 -16.728 65 HB3 CYS 10 HB1 CYS 10 -18.595 28.002 -16.140 66 H THR 11 HN THR 11 -20.700 28.437 -14.289 67 HA THR 11 HA THR 11 -23.132 27.186 -15.252 68 HB THR 11 HB THR 11 -24.262 29.125 -14.223 69 HG1 THR 11 HG1 THR 11 -22.269 30.154 -12.796 70 HG21 THR 11 HG21 THR 11 -22.212 27.957 -12.336 71 HG22 THR 11 HG22 THR 11 -23.653 27.084 -12.876 72 HG23 THR 11 HG23 THR 11 -23.816 28.563 -11.925 73 H SER 12 HN SER 12 -24.647 29.031 -16.233 74 HA SER 12 HA SER 12 -23.603 29.582 -18.783 75 HB2 SER 12 HB2 SER 12 -26.058 30.815 -17.531 76 HB3 SER 12 HB1 SER 12 -25.744 30.536 -19.246 77 HG SER 12 HG SER 12 -25.572 28.204 -18.511 78 H ALA 13 HN ALA 13 -23.527 31.340 -15.812 79 HA ALA 13 HA ALA 13 -23.287 33.964 -16.872 80 HB1 ALA 13 HB1 ALA 13 -23.945 33.548 -14.551 81 HB2 ALA 13 HB2 ALA 13 -22.521 34.587 -14.641 82 HB3 ALA 13 HB3 ALA 13 -22.345 32.884 -14.217 83 H CYS 14 HN CYS 14 -20.917 31.552 -15.809 84 HA CYS 14 HA CYS 14 -18.635 33.157 -16.307 85 HB2 CYS 14 HB2 CYS 14 -18.747 31.124 -14.825 86 HB3 CYS 14 HB1 CYS 14 -18.785 30.136 -16.273 87 H ARG 15 HN ARG 15 -20.582 31.033 -18.259 88 HA ARG 15 HA ARG 15 -18.685 31.071 -20.466 89 HB2 ARG 15 HB2 ARG 15 -21.399 29.772 -20.244 90 HB3 ARG 15 HB1 ARG 15 -20.292 29.587 -21.594 91 HG2 ARG 15 HG2 ARG 15 -19.841 28.679 -18.761 92 HG3 ARG 15 HG1 ARG 15 -20.171 27.660 -20.162 93 HD2 ARG 15 HD2 ARG 15 -18.068 28.523 -21.192 94 HD3 ARG 15 HD1 ARG 15 -17.731 29.361 -19.678 95 HE ARG 15 HE ARG 15 -18.210 26.500 -19.492 96 HH11 ARG 15 HH11 ARG 15 -15.846 29.100 -19.610 97 HH12 ARG 15 HH12 ARG 15 -14.551 28.113 -19.043 98 HH21 ARG 15 HH21 ARG 15 -16.496 25.210 -18.741 99 HH22 ARG 15 HH22 ARG 15 -14.918 25.886 -18.546 100 H SER 16 HN SER 16 -20.612 33.363 -19.422 101 HA SER 16 HA SER 16 -22.045 33.975 -21.859 102 HB2 SER 16 HB2 SER 16 -22.912 34.501 -19.532 103 HB3 SER 16 HB1 SER 16 -21.672 35.746 -19.432 104 HG SER 16 HG SER 16 -23.516 35.669 -21.582 105 H GLU 17 HN GLU 17 -21.761 36.300 -22.736 106 HA GLU 17 HA GLU 17 -18.888 36.884 -22.909 107 HB2 GLU 17 HB2 GLU 17 -21.002 37.045 -25.054 108 HB3 GLU 17 HB1 GLU 17 -19.388 37.717 -25.228 109 HG2 GLU 17 HG2 GLU 17 -19.998 34.814 -24.718 110 HG3 GLU 17 HG1 GLU 17 -19.655 35.513 -26.300 111 HA PRO 18 HA PRO 18 -17.679 37.950 -22.074 112 HB2 PRO 18 HB2 PRO 18 -17.112 39.772 -19.957 113 HB3 PRO 18 HB1 PRO 18 -16.369 39.718 -21.555 114 HG2 PRO 18 HG2 PRO 18 -17.992 41.758 -20.617 115 HG3 PRO 18 HG1 PRO 18 -17.652 41.433 -22.325 116 HD2 PRO 18 HD2 PRO 18 -20.041 40.704 -20.686 117 HD3 PRO 18 HD1 PRO 18 -19.950 41.211 -22.387 118 H CYS 19 HN CYS 19 -16.690 37.517 -19.698 119 HA CYS 19 HA CYS 19 -18.376 35.660 -18.502 120 HB2 CYS 19 HB2 CYS 19 -15.855 35.796 -18.384 121 HB3 CYS 19 HB1 CYS 19 -16.057 37.041 -17.159 122 H GLN 20 HN GLN 20 -20.030 35.859 -17.136 123 HA GLN 20 HA GLN 20 -20.483 38.480 -15.854 124 HB2 GLN 20 HB2 GLN 20 -22.436 36.320 -16.608 125 HB3 GLN 20 HB1 GLN 20 -22.852 37.826 -15.806 126 HG2 GLN 20 HG2 GLN 20 -21.636 37.576 -18.536 127 HG3 GLN 20 HG1 GLN 20 -23.333 37.864 -18.174 128 HE21 GLN 20 HE21 GLN 20 -20.180 39.211 -18.330 129 HE22 GLN 20 HE22 GLN 20 -20.627 40.861 -18.052 130 H CYS 21 HN CYS 21 -18.986 36.034 -14.874 131 HA CYS 21 HA CYS 21 -20.451 34.834 -12.805 132 HB2 CYS 21 HB2 CYS 21 -17.745 34.828 -13.707 133 HB3 CYS 21 HB1 CYS 21 -17.765 35.003 -11.953 134 H GLY 22 HN GLY 22 -18.622 37.825 -12.896 135 HA2 GLY 22 HA2 GLY 22 -18.879 39.691 -11.584 136 HA3 GLY 22 HA1 GLY 22 -20.081 38.823 -10.647 137 H SER 23 HN SER 23 -18.903 40.071 -8.951 138 HA SER 23 HA SER 23 -16.283 39.184 -8.211 139 HB2 SER 23 HB2 SER 23 -18.285 40.819 -6.644 140 HB3 SER 23 HB1 SER 23 -16.564 40.651 -6.286 141 HG SER 23 HG SER 23 -17.342 41.532 -8.835 142 H LYS 24 HN LYS 24 -19.382 37.907 -7.805 143 HA LYS 24 HA LYS 24 -18.811 36.625 -5.256 144 HB2 LYS 24 HB2 LYS 24 -21.132 36.300 -7.161 145 HB3 LYS 24 HB1 LYS 24 -20.997 35.503 -5.604 146 HG2 LYS 24 HG2 LYS 24 -21.013 37.688 -4.498 147 HG3 LYS 24 HG1 LYS 24 -21.193 38.469 -6.072 148 HD2 LYS 24 HD2 LYS 24 -23.279 37.179 -6.422 149 HD3 LYS 24 HD1 LYS 24 -23.111 36.522 -4.794 150 HE2 LYS 24 HE2 LYS 24 -24.656 38.352 -4.734 151 HE3 LYS 24 HE1 LYS 24 -23.173 38.834 -3.912 152 HZ1 LYS 24 HZ1 LYS 24 -23.892 39.539 -6.706 153 HZ2 LYS 24 HZ2 LYS 24 -22.502 40.043 -5.884 154 HZ3 LYS 24 HZ3 LYS 24 -24.022 40.571 -5.374 155 H CYS 25 HN CYS 25 -18.766 35.958 -8.650 156 HA CYS 25 HA CYS 25 -18.070 34.236 -9.914 157 HB2 CYS 25 HB2 CYS 25 -16.124 34.352 -8.225 158 HB3 CYS 25 HB1 CYS 25 -16.864 32.927 -7.498 159 H GLN 26 HN GLN 26 -19.640 33.138 -10.640 160 HA GLN 26 HA GLN 26 -21.210 31.478 -8.797 161 HB2 GLN 26 HB2 GLN 26 -22.013 32.856 -11.355 162 HB3 GLN 26 HB1 GLN 26 -23.066 31.822 -10.395 163 HG2 GLN 26 HG2 GLN 26 -23.090 33.350 -8.594 164 HG3 GLN 26 HG1 GLN 26 -21.744 34.271 -9.261 165 HE21 GLN 26 HE21 GLN 26 -22.118 35.740 -10.883 166 HE22 GLN 26 HE22 GLN 26 -23.706 36.249 -11.338 167 H CYS 27 HN CYS 27 -18.781 30.674 -10.293 168 HA CYS 27 HA CYS 27 -19.999 28.463 -11.810 169 HB2 CYS 27 HB2 CYS 27 -18.266 28.548 -13.411 170 HB3 CYS 27 HB1 CYS 27 -18.671 30.230 -13.120 171 H GLY 28 HN GLY 28 -17.678 26.960 -12.172 172 HA2 GLY 28 HA2 GLY 28 -16.989 26.225 -9.402 173 HA3 GLY 28 HA1 GLY 28 -17.155 25.067 -10.716 174 H GLU 29 HN GLU 29 -14.827 25.423 -9.063 175 HA GLU 29 HA GLU 29 -12.962 26.980 -10.592 176 HB2 GLU 29 HB2 GLU 29 -12.765 26.819 -8.141 177 HB3 GLU 29 HB1 GLU 29 -12.401 25.104 -8.298 178 HG2 GLU 29 HG2 GLU 29 -10.404 25.676 -9.615 179 HG3 GLU 29 HG1 GLU 29 -10.759 27.385 -9.374 180 H GLY 30 HN GLY 30 -13.156 25.974 -12.567 181 HA2 GLY 30 HA2 GLY 30 -11.103 24.031 -13.003 182 HA3 GLY 30 HA1 GLY 30 -12.714 23.364 -13.263 183 H CYS 31 HN CYS 31 -12.148 26.709 -13.812 184 HA CYS 31 HA CYS 31 -12.444 26.208 -16.695 185 HB2 CYS 31 HB2 CYS 31 -13.502 28.408 -16.803 186 HB3 CYS 31 HB1 CYS 31 -14.341 27.355 -15.665 187 H THR 32 HN THR 32 -10.431 27.581 -14.264 188 HA THR 32 HA THR 32 -8.720 29.072 -14.242 189 HB THR 32 HB THR 32 -7.020 28.796 -16.100 190 HG1 THR 32 HG1 THR 32 -9.114 27.763 -17.386 191 HG21 THR 32 HG21 THR 32 -6.446 26.480 -15.534 192 HG22 THR 32 HG22 THR 32 -8.060 26.246 -14.864 193 HG23 THR 32 HG23 THR 32 -6.947 27.385 -14.106 194 H CYS 33 HN CYS 33 -11.104 30.210 -15.004 195 HA CYS 33 HA CYS 33 -11.020 31.651 -17.410 196 HB2 CYS 33 HB2 CYS 33 -12.975 31.067 -15.731 197 HB3 CYS 33 HB1 CYS 33 -12.556 32.633 -15.048 198 H ALA 34 HN ALA 34 -10.677 33.876 -17.728 199 HA ALA 34 HA ALA 34 -8.677 34.987 -15.879 200 HB1 ALA 34 HB1 ALA 34 -7.877 36.295 -17.773 201 HB2 ALA 34 HB2 ALA 34 -9.174 35.651 -18.781 202 HB3 ALA 34 HB3 ALA 34 -7.915 34.577 -18.173 203 H ALA 35 HN ALA 35 -11.670 35.186 -15.701 204 HA ALA 35 HA ALA 35 -11.791 38.115 -15.636 205 HB1 ALA 35 HB1 ALA 35 -14.141 38.040 -16.251 206 HB2 ALA 35 HB2 ALA 35 -14.064 36.282 -16.370 207 HB3 ALA 35 HB3 ALA 35 -13.145 37.284 -17.494 208 H CYS 36 HN CYS 36 -13.536 35.236 -14.424 209 HA CYS 36 HA CYS 36 -14.209 36.679 -12.013 210 HB2 CYS 36 HB2 CYS 36 -15.247 34.474 -11.369 211 HB3 CYS 36 HB1 CYS 36 -15.884 35.219 -12.832 212 H LYS 37 HN LYS 37 -12.211 33.949 -12.969 213 HA LYS 37 HA LYS 37 -11.088 33.715 -10.326 214 HB2 LYS 37 HB2 LYS 37 -11.548 31.699 -11.689 215 HB3 LYS 37 HB1 LYS 37 -10.366 32.245 -12.869 216 HG2 LYS 37 HG2 LYS 37 -8.609 32.078 -11.167 217 HG3 LYS 37 HG1 LYS 37 -9.805 31.497 -10.007 218 HD2 LYS 37 HD2 LYS 37 -10.247 29.566 -11.425 219 HD3 LYS 37 HD1 LYS 37 -9.077 30.159 -12.604 220 HE2 LYS 37 HE2 LYS 37 -8.450 29.433 -9.747 221 HE3 LYS 37 HE1 LYS 37 -8.153 28.400 -11.145 222 HZ1 LYS 37 HZ1 LYS 37 -6.921 31.055 -10.643 223 HZ2 LYS 37 HZ2 LYS 37 -6.655 30.105 -12.014 224 HZ3 LYS 37 HZ3 LYS 37 -6.154 29.558 -10.502 225 H THR 38 HN THR 38 -10.161 35.784 -10.165 226 HA THR 38 HA THR 38 -7.535 35.935 -11.414 227 HB THR 38 HB THR 38 -9.100 37.314 -12.812 228 HG1 THR 38 HG1 THR 38 -7.747 39.321 -12.508 229 HG21 THR 38 HG21 THR 38 -9.324 38.987 -10.300 230 HG22 THR 38 HG22 THR 38 -10.624 38.051 -11.038 231 HG23 THR 38 HG23 THR 38 -9.939 39.435 -11.891 232 H CYS 39 HN CYS 39 -6.366 37.948 -10.366 233 HA CYS 39 HA CYS 39 -6.922 37.776 -7.487 234 HB2 CYS 39 HB2 CYS 39 -4.834 36.656 -8.121 235 HB3 CYS 39 HB1 CYS 39 -4.254 38.147 -8.854 236 H ASN 40 HN ASN 40 -6.781 39.604 -6.250 237 HA ASN 40 HA ASN 40 -6.890 42.126 -7.751 238 HB2 ASN 40 HB2 ASN 40 -8.061 41.236 -5.134 239 HB3 ASN 40 HB1 ASN 40 -7.869 42.950 -5.486 240 HD21 ASN 40 HD21 ASN 40 -9.436 39.982 -6.489 241 HD22 ASN 40 HD22 ASN 40 -10.697 40.739 -7.404 242 H CYS 41 HN CYS 41 -4.761 40.353 -5.993 243 HA CYS 41 HA CYS 41 -3.557 42.449 -4.463 244 HB2 CYS 41 HB2 CYS 41 -2.500 39.726 -5.209 245 HB3 CYS 41 HB1 CYS 41 -1.838 40.793 -3.973 246 H THR 42 HN THR 42 -1.499 43.344 -4.821 247 HA THR 42 HA THR 42 -0.693 43.341 -7.647 248 HB THR 42 HB THR 42 -0.022 45.713 -7.330 249 HG1 THR 42 HG1 THR 42 -1.080 45.193 -4.753 250 HG21 THR 42 HG21 THR 42 -2.204 45.157 -8.308 251 HG22 THR 42 HG22 THR 42 -2.281 46.644 -7.363 252 HG23 THR 42 HG23 THR 42 -2.916 45.140 -6.694 253 H SER 43 HN SER 43 1.595 44.217 -7.878 254 HA SER 43 HA SER 43 3.331 42.566 -6.369 255 HB2 SER 43 HB2 SER 43 4.082 44.862 -8.184 256 HB3 SER 43 HB1 SER 43 5.086 43.483 -7.735 257 HG SER 43 HG SER 43 2.732 43.466 -9.331 258 H ASP 44 HN ASP 44 2.281 45.841 -6.109 259 HA ASP 44 HA ASP 44 4.360 46.657 -4.297 260 HB2 ASP 44 HB2 ASP 44 3.322 48.291 -5.773 261 HB3 ASP 44 HB1 ASP 44 1.751 47.977 -5.046 262 H GLY 45 HN GLY 45 1.093 45.421 -4.051 263 HA2 GLY 45 HA2 GLY 45 1.456 45.076 -1.204 264 HA3 GLY 45 HA1 GLY 45 0.169 46.177 -1.675 265 H CYS 46 HN CYS 46 0.527 43.309 -0.529 266 HA CYS 46 HA CYS 46 -1.134 41.789 -2.341 267 HB2 CYS 46 HB2 CYS 46 0.816 40.936 -0.829 268 HB3 CYS 46 HB1 CYS 46 -0.397 40.945 0.445 269 H LYS 47 HN LYS 47 -3.293 41.383 -2.059 270 HA LYS 47 HA LYS 47 -4.652 43.092 -0.122 271 HB2 LYS 47 HB2 LYS 47 -5.656 41.603 -2.544 272 HB3 LYS 47 HB1 LYS 47 -6.697 42.509 -1.457 273 HG2 LYS 47 HG2 LYS 47 -4.395 43.694 -2.993 274 HG3 LYS 47 HG1 LYS 47 -6.080 43.739 -3.512 275 HD2 LYS 47 HD2 LYS 47 -6.664 44.961 -1.463 276 HD3 LYS 47 HD1 LYS 47 -4.970 44.929 -0.971 277 HE2 LYS 47 HE2 LYS 47 -4.360 46.220 -2.945 278 HE3 LYS 47 HE1 LYS 47 -6.041 46.223 -3.475 279 HZ1 LYS 47 HZ1 LYS 47 -5.405 48.288 -2.358 280 HZ2 LYS 47 HZ2 LYS 47 -5.055 47.430 -0.948 281 HZ3 LYS 47 HZ3 LYS 47 -6.639 47.485 -1.529 282 H CYS 48 HN CYS 48 -4.135 39.711 -0.790 283 HA CYS 48 HA CYS 48 -6.237 38.960 1.088 284 HB2 CYS 48 HB2 CYS 48 -5.831 36.698 0.391 285 HB3 CYS 48 HB1 CYS 48 -5.899 37.718 -1.049 286 H GLY 49 HN GLY 49 -2.764 39.134 0.857 287 HA2 GLY 49 HA2 GLY 49 -1.406 39.419 2.777 288 HA3 GLY 49 HA1 GLY 49 -2.614 38.569 3.728 289 H LYS 50 HN LYS 50 -2.060 36.975 0.809 290 HA LYS 50 HA LYS 50 -0.487 34.928 2.172 291 HB2 LYS 50 HB2 LYS 50 -1.711 34.937 -0.596 292 HB3 LYS 50 HB1 LYS 50 -0.922 33.563 0.163 293 HG2 LYS 50 HG2 LYS 50 -3.431 34.908 1.143 294 HG3 LYS 50 HG1 LYS 50 -3.352 33.384 0.259 295 HD2 LYS 50 HD2 LYS 50 -2.045 32.401 2.081 296 HD3 LYS 50 HD1 LYS 50 -2.125 33.930 2.960 297 HE2 LYS 50 HE2 LYS 50 -4.487 32.241 2.157 298 HE3 LYS 50 HE1 LYS 50 -3.782 32.310 3.770 299 HZ1 LYS 50 HZ1 LYS 50 -5.122 34.526 2.316 300 HZ2 LYS 50 HZ2 LYS 50 -4.301 34.711 3.779 301 HZ3 LYS 50 HZ3 LYS 50 -5.669 33.735 3.707 302 H GLU 51 HN GLU 51 0.105 37.643 0.461 303 HA GLU 51 HA GLU 51 1.901 38.592 -0.483 304 HB2 GLU 51 HB2 GLU 51 3.062 37.419 1.466 305 HB3 GLU 51 HB1 GLU 51 3.533 36.178 0.315 306 HG2 GLU 51 HG2 GLU 51 4.734 37.844 -1.003 307 HG3 GLU 51 HG1 GLU 51 4.245 39.099 0.134 308 H CYS 52 HN CYS 52 0.172 36.684 -1.973 309 HA CYS 52 HA CYS 52 1.759 35.372 -3.920 310 HB2 CYS 52 HB2 CYS 52 -0.376 35.572 -5.294 311 HB3 CYS 52 HB1 CYS 52 -0.499 34.664 -3.786 312 H THR 53 HN THR 53 0.108 38.460 -3.809 313 HA THR 53 HA THR 53 0.322 40.393 -4.929 314 HB THR 53 HB THR 53 2.659 41.206 -5.280 315 HG1 THR 53 HG1 THR 53 3.202 38.585 -5.227 316 HG21 THR 53 HG21 THR 53 3.249 41.191 -2.893 317 HG22 THR 53 HG22 THR 53 2.088 39.888 -2.623 318 HG23 THR 53 HG23 THR 53 1.524 41.478 -3.132 319 H GLY 54 HN GLY 54 -0.867 39.362 -6.721 320 HA2 GLY 54 HA2 GLY 54 -0.893 40.025 -9.068 321 HA3 GLY 54 HA1 GLY 54 0.781 39.494 -9.161 322 HA PRO 55 HA PRO 55 -2.684 36.069 -9.842 323 HB2 PRO 55 HB2 PRO 55 -2.822 36.223 -12.608 324 HB3 PRO 55 HB1 PRO 55 -4.008 36.912 -11.495 325 HG2 PRO 55 HG2 PRO 55 -1.724 38.240 -12.894 326 HG3 PRO 55 HG1 PRO 55 -3.363 38.847 -12.598 327 HD2 PRO 55 HD2 PRO 55 -1.289 39.675 -11.126 328 HD3 PRO 55 HD1 PRO 55 -2.888 39.411 -10.396 329 H ASP 56 HN ASP 56 0.192 37.047 -11.592 330 HA ASP 56 HA ASP 56 0.833 34.554 -12.741 331 HB2 ASP 56 HB2 ASP 56 1.871 36.598 -13.529 332 HB3 ASP 56 HB1 ASP 56 2.624 36.858 -11.959 333 H SER 57 HN SER 57 1.614 35.981 -9.621 334 HA SER 57 HA SER 57 2.996 33.508 -8.857 335 HB2 SER 57 HB2 SER 57 4.214 35.716 -8.647 336 HB3 SER 57 HB1 SER 57 3.036 36.173 -7.417 337 HG SER 57 HG SER 57 3.730 34.392 -6.180 338 H CYS 58 HN CYS 58 0.032 34.226 -8.974 339 HA CYS 58 HA CYS 58 -0.773 34.108 -6.202 340 HB2 CYS 58 HB2 CYS 58 -1.956 35.521 -7.925 341 HB3 CYS 58 HB1 CYS 58 -2.525 34.025 -8.657 342 H LYS 59 HN LYS 59 -0.723 32.291 -5.211 343 HA LYS 59 HA LYS 59 -1.166 29.808 -6.720 344 HB2 LYS 59 HB2 LYS 59 0.120 30.166 -4.013 345 HB3 LYS 59 HB1 LYS 59 0.096 28.702 -4.987 346 HG2 LYS 59 HG2 LYS 59 1.488 29.741 -6.661 347 HG3 LYS 59 HG1 LYS 59 1.435 31.273 -5.791 348 HD2 LYS 59 HD2 LYS 59 2.564 30.229 -3.896 349 HD3 LYS 59 HD1 LYS 59 2.634 28.702 -4.780 350 HE2 LYS 59 HE2 LYS 59 3.912 31.298 -5.630 351 HE3 LYS 59 HE1 LYS 59 4.755 29.933 -4.902 352 HZ1 LYS 59 HZ1 LYS 59 5.009 29.937 -7.289 353 HZ2 LYS 59 HZ2 LYS 59 3.335 29.911 -7.511 354 HZ3 LYS 59 HZ3 LYS 59 4.113 28.584 -6.815 355 H CYS 60 HN CYS 60 -2.775 31.904 -4.796 356 HA CYS 60 HA CYS 60 -4.083 30.170 -2.956 357 HB2 CYS 60 HB2 CYS 60 -5.246 32.730 -4.000 358 HB3 CYS 60 HB1 CYS 60 -5.388 32.029 -2.392 359 H GLY 61 HN GLY 61 -6.281 29.461 -3.031 360 HA2 GLY 61 HA2 GLY 61 -7.163 28.615 -5.620 361 HA3 GLY 61 HA1 GLY 61 -8.016 28.383 -4.098 362 H SER 62 HN SER 62 -9.708 28.929 -5.944 363 HA SER 62 HA SER 62 -10.011 31.719 -6.530 364 HB2 SER 62 HB2 SER 62 -12.026 29.518 -6.968 365 HB3 SER 62 HB1 SER 62 -11.908 31.062 -7.817 366 HG SER 62 HG SER 62 -10.281 28.779 -8.002 367 H SER 63 HN SER 63 -10.459 30.173 -3.721 368 HA SER 63 HA SER 63 -12.896 31.667 -3.043 369 HB2 SER 63 HB2 SER 63 -11.651 29.342 -1.556 370 HB3 SER 63 HB1 SER 63 -13.188 30.120 -1.187 371 HG SER 63 HG SER 63 -12.749 29.058 -3.753 372 H CYS 64 HN CYS 64 -9.851 32.349 -3.116 373 HA CYS 64 HA CYS 64 -9.385 33.017 -0.342 374 HB2 CYS 64 HB2 CYS 64 -7.591 32.156 -1.863 375 HB3 CYS 64 HB1 CYS 64 -7.685 33.664 -2.759 376 H SER 65 HN SER 65 -8.585 35.299 0.134 377 HA SER 65 HA SER 65 -10.679 37.114 -0.315 378 HB2 SER 65 HB2 SER 65 -7.886 37.788 0.610 379 HB3 SER 65 HB1 SER 65 -9.359 38.707 0.920 380 HG SER 65 HG SER 65 -10.039 37.181 2.317 381 H CYS 66 HN CYS 66 -7.736 36.561 -2.108 382 HA CYS 66 HA CYS 66 -7.824 39.113 -3.426 383 HB2 CYS 66 HB2 CYS 66 -5.988 38.068 -4.847 384 HB3 CYS 66 HB1 CYS 66 -5.652 38.260 -3.134 385 H LYS 67 HN LYS 67 -9.624 36.373 -3.751 386 HA LYS 67 HA LYS 67 -9.834 36.513 -6.670 387 HB2 LYS 67 HB2 LYS 67 -11.034 34.526 -4.735 388 HB3 LYS 67 HB1 LYS 67 -11.028 34.382 -6.488 389 HG2 LYS 67 HG2 LYS 67 -8.527 34.551 -4.850 390 HG3 LYS 67 HG1 LYS 67 -9.305 33.026 -5.273 391 HD2 LYS 67 HD2 LYS 67 -8.623 33.141 -7.426 392 HD3 LYS 67 HD1 LYS 67 -8.848 34.889 -7.509 393 HE2 LYS 67 HE2 LYS 67 -6.507 34.376 -7.724 394 HE3 LYS 67 HE1 LYS 67 -6.806 35.177 -6.181 395 HZ1 LYS 67 HZ1 LYS 67 -6.348 32.284 -6.612 396 HZ2 LYS 67 HZ2 LYS 67 -6.796 32.974 -5.135 397 HZ3 LYS 67 HZ3 LYS 67 -5.317 33.391 -5.849 Start of MODEL 11 1 HA2 GLY 1 HA1 GLY 1 -37.065 9.783 -21.441 2 HA3 GLY 1 HA2 GLY 1 -38.243 10.468 -22.550 3 H SER 2 HN SER 2 -36.785 13.137 -21.819 4 HA SER 2 HA SER 2 -35.083 13.073 -24.143 5 HB2 SER 2 HB2 SER 2 -36.550 15.020 -23.622 6 HB3 SER 2 HB1 SER 2 -35.580 15.333 -22.186 7 HG SER 2 HG SER 2 -34.861 16.632 -23.844 8 H GLY 3 HN GLY 3 -34.648 13.588 -20.654 9 HA2 GLY 3 HA2 GLY 3 -32.500 12.270 -20.017 10 HA3 GLY 3 HA1 GLY 3 -31.751 13.489 -21.036 11 H LYS 4 HN LYS 4 -30.636 13.745 -18.859 12 HA LYS 4 HA LYS 4 -32.215 15.300 -16.979 13 HB2 LYS 4 HB2 LYS 4 -29.398 14.238 -16.792 14 HB3 LYS 4 HB1 LYS 4 -30.191 15.174 -15.532 15 HG2 LYS 4 HG2 LYS 4 -31.923 13.435 -15.356 16 HG3 LYS 4 HG1 LYS 4 -31.069 12.489 -16.574 17 HD2 LYS 4 HD2 LYS 4 -29.869 13.358 -13.947 18 HD3 LYS 4 HD1 LYS 4 -30.626 11.791 -14.220 19 HE2 LYS 4 HE2 LYS 4 -28.983 11.344 -16.005 20 HE3 LYS 4 HE1 LYS 4 -28.207 12.886 -15.654 21 HZ1 LYS 4 HZ1 LYS 4 -27.776 12.085 -13.397 22 HZ2 LYS 4 HZ2 LYS 4 -27.044 11.103 -14.558 23 HZ3 LYS 4 HZ3 LYS 4 -28.457 10.588 -13.790 24 H GLY 5 HN GLY 5 -28.934 15.683 -18.321 25 HA2 GLY 5 HA2 GLY 5 -28.127 17.567 -19.473 26 HA3 GLY 5 HA1 GLY 5 -29.553 18.461 -18.963 27 H LYS 6 HN LYS 6 -26.291 17.979 -18.439 28 HA LYS 6 HA LYS 6 -26.409 19.568 -15.993 29 HB2 LYS 6 HB2 LYS 6 -26.236 17.253 -15.226 30 HB3 LYS 6 HB1 LYS 6 -24.839 17.002 -16.262 31 HG2 LYS 6 HG2 LYS 6 -23.693 18.836 -14.945 32 HG3 LYS 6 HG1 LYS 6 -25.039 18.733 -13.814 33 HD2 LYS 6 HD2 LYS 6 -23.244 17.377 -12.972 34 HD3 LYS 6 HD1 LYS 6 -24.531 16.306 -13.527 35 HE2 LYS 6 HE2 LYS 6 -22.344 15.472 -14.219 36 HE3 LYS 6 HE1 LYS 6 -23.307 15.924 -15.621 37 HZ1 LYS 6 HZ1 LYS 6 -21.038 16.691 -15.848 38 HZ2 LYS 6 HZ2 LYS 6 -21.134 17.542 -14.398 39 HZ3 LYS 6 HZ3 LYS 6 -22.068 18.024 -15.719 40 H GLY 7 HN GLY 7 -24.899 21.109 -15.952 41 HA2 GLY 7 HA2 GLY 7 -22.914 21.175 -18.081 42 HA3 GLY 7 HA1 GLY 7 -23.280 22.478 -16.949 43 H GLU 8 HN GLU 8 -20.692 22.055 -17.320 44 HA GLU 8 HA GLU 8 -19.442 20.121 -15.761 45 HB2 GLU 8 HB2 GLU 8 -18.562 22.900 -16.534 46 HB3 GLU 8 HB1 GLU 8 -17.521 21.767 -15.687 47 HG2 GLU 8 HG2 GLU 8 -16.868 21.403 -17.835 48 HG3 GLU 8 HG1 GLU 8 -18.123 20.181 -17.675 49 H LYS 9 HN LYS 9 -20.107 23.483 -14.908 50 HA LYS 9 HA LYS 9 -21.068 23.072 -12.344 51 HB2 LYS 9 HB2 LYS 9 -18.351 22.513 -12.313 52 HB3 LYS 9 HB1 LYS 9 -18.396 24.201 -11.851 53 HG2 LYS 9 HG2 LYS 9 -19.887 21.973 -10.477 54 HG3 LYS 9 HG1 LYS 9 -18.413 22.748 -9.895 55 HD2 LYS 9 HD2 LYS 9 -19.583 24.872 -9.712 56 HD3 LYS 9 HD1 LYS 9 -21.042 24.140 -10.375 57 HE2 LYS 9 HE2 LYS 9 -21.127 22.619 -8.445 58 HE3 LYS 9 HE1 LYS 9 -19.697 23.406 -7.783 59 HZ1 LYS 9 HZ1 LYS 9 -22.292 24.732 -8.318 60 HZ2 LYS 9 HZ2 LYS 9 -20.931 25.474 -7.646 61 HZ3 LYS 9 HZ3 LYS 9 -21.736 24.254 -6.802 62 H CYS 10 HN CYS 10 -18.992 25.068 -14.363 63 HA CYS 10 HA CYS 10 -19.553 27.547 -13.266 64 HB2 CYS 10 HB2 CYS 10 -18.885 26.775 -16.096 65 HB3 CYS 10 HB1 CYS 10 -18.964 28.441 -15.537 66 H THR 11 HN THR 11 -21.084 29.064 -13.574 67 HA THR 11 HA THR 11 -23.642 28.099 -14.426 68 HB THR 11 HB THR 11 -24.424 30.343 -13.656 69 HG1 THR 11 HG1 THR 11 -22.820 31.643 -12.571 70 HG21 THR 11 HG21 THR 11 -23.918 29.969 -11.273 71 HG22 THR 11 HG22 THR 11 -22.637 28.843 -11.729 72 HG23 THR 11 HG23 THR 11 -24.320 28.458 -12.092 73 H SER 12 HN SER 12 -25.020 29.793 -15.683 74 HA SER 12 HA SER 12 -24.027 29.920 -18.295 75 HB2 SER 12 HB2 SER 12 -26.079 31.436 -18.631 76 HB3 SER 12 HB1 SER 12 -26.367 29.795 -18.054 77 HG SER 12 HG SER 12 -26.789 32.206 -16.807 78 H ALA 13 HN ALA 13 -23.902 32.187 -15.657 79 HA ALA 13 HA ALA 13 -23.289 34.505 -17.158 80 HB1 ALA 13 HB1 ALA 13 -22.699 33.800 -14.283 81 HB2 ALA 13 HB2 ALA 13 -24.107 34.676 -14.884 82 HB3 ALA 13 HB3 ALA 13 -22.503 35.403 -14.986 83 H CYS 14 HN CYS 14 -21.330 32.039 -15.566 84 HA CYS 14 HA CYS 14 -18.826 33.278 -16.075 85 HB2 CYS 14 HB2 CYS 14 -19.328 31.550 -14.299 86 HB3 CYS 14 HB1 CYS 14 -19.348 30.349 -15.580 87 H ARG 15 HN ARG 15 -20.787 30.927 -17.802 88 HA ARG 15 HA ARG 15 -18.678 30.343 -19.656 89 HB2 ARG 15 HB2 ARG 15 -20.622 28.800 -18.904 90 HB3 ARG 15 HB1 ARG 15 -21.546 29.637 -20.146 91 HG2 ARG 15 HG2 ARG 15 -20.045 28.923 -21.848 92 HG3 ARG 15 HG1 ARG 15 -18.923 28.265 -20.658 93 HD2 ARG 15 HD2 ARG 15 -20.975 26.830 -19.946 94 HD3 ARG 15 HD1 ARG 15 -21.565 27.221 -21.562 95 HE ARG 15 HE ARG 15 -19.361 26.287 -22.350 96 HH11 ARG 15 HH11 ARG 15 -21.010 25.147 -19.483 97 HH12 ARG 15 HH12 ARG 15 -20.148 23.642 -19.416 98 HH21 ARG 15 HH21 ARG 15 -18.213 24.291 -22.274 99 HH22 ARG 15 HH22 ARG 15 -18.537 23.158 -21.000 100 H SER 16 HN SER 16 -20.812 32.895 -19.334 101 HA SER 16 HA SER 16 -21.181 33.402 -22.142 102 HB2 SER 16 HB2 SER 16 -22.797 34.149 -20.345 103 HB3 SER 16 HB1 SER 16 -21.573 35.304 -19.821 104 HG SER 16 HG SER 16 -23.362 35.604 -21.737 105 H GLU 17 HN GLU 17 -20.325 35.451 -23.101 106 HA GLU 17 HA GLU 17 -17.783 36.256 -21.924 107 HB2 GLU 17 HB2 GLU 17 -16.685 36.129 -24.157 108 HB3 GLU 17 HB1 GLU 17 -17.099 34.573 -23.459 109 HG2 GLU 17 HG2 GLU 17 -18.999 34.373 -24.916 110 HG3 GLU 17 HG1 GLU 17 -18.721 35.997 -25.550 111 HA PRO 18 HA PRO 18 -16.377 37.885 -21.773 112 HB2 PRO 18 HB2 PRO 18 -16.748 39.944 -20.023 113 HB3 PRO 18 HB1 PRO 18 -15.936 40.135 -21.582 114 HG2 PRO 18 HG2 PRO 18 -18.777 40.700 -20.845 115 HG3 PRO 18 HG1 PRO 18 -17.653 41.707 -21.782 116 HD2 PRO 18 HD2 PRO 18 -19.516 40.215 -22.995 117 HD3 PRO 18 HD1 PRO 18 -17.894 40.397 -23.696 118 H CYS 19 HN CYS 19 -16.131 37.207 -19.599 119 HA CYS 19 HA CYS 19 -18.246 35.618 -18.680 120 HB2 CYS 19 HB2 CYS 19 -15.887 35.103 -18.268 121 HB3 CYS 19 HB1 CYS 19 -15.777 36.496 -17.196 122 H GLN 20 HN GLN 20 -19.836 35.942 -17.318 123 HA GLN 20 HA GLN 20 -20.133 38.629 -16.187 124 HB2 GLN 20 HB2 GLN 20 -22.190 36.471 -16.629 125 HB3 GLN 20 HB1 GLN 20 -22.510 38.116 -16.103 126 HG2 GLN 20 HG2 GLN 20 -21.326 37.329 -18.748 127 HG3 GLN 20 HG1 GLN 20 -23.011 37.744 -18.456 128 HE21 GLN 20 HE21 GLN 20 -21.069 39.020 -20.203 129 HE22 GLN 20 HE22 GLN 20 -20.970 40.670 -19.698 130 H CYS 21 HN CYS 21 -18.741 36.050 -15.115 131 HA CYS 21 HA CYS 21 -20.233 35.307 -12.814 132 HB2 CYS 21 HB2 CYS 21 -17.784 34.497 -14.051 133 HB3 CYS 21 HB1 CYS 21 -17.496 34.819 -12.345 134 H GLY 22 HN GLY 22 -18.307 38.039 -13.545 135 HA2 GLY 22 HA2 GLY 22 -17.103 38.649 -11.105 136 HA3 GLY 22 HA1 GLY 22 -17.650 39.842 -12.272 137 H SER 23 HN SER 23 -20.438 38.946 -12.062 138 HA SER 23 HA SER 23 -21.293 40.728 -10.066 139 HB2 SER 23 HB2 SER 23 -23.573 39.837 -10.596 140 HB3 SER 23 HB1 SER 23 -22.659 40.361 -12.009 141 HG SER 23 HG SER 23 -22.486 38.326 -12.687 142 H LYS 24 HN LYS 24 -21.335 37.163 -10.145 143 HA LYS 24 HA LYS 24 -21.663 37.181 -7.210 144 HB2 LYS 24 HB2 LYS 24 -23.093 35.368 -9.156 145 HB3 LYS 24 HB1 LYS 24 -23.080 35.132 -7.417 146 HG2 LYS 24 HG2 LYS 24 -24.210 37.526 -8.856 147 HG3 LYS 24 HG1 LYS 24 -25.142 36.183 -8.194 148 HD2 LYS 24 HD2 LYS 24 -23.394 38.058 -6.591 149 HD3 LYS 24 HD1 LYS 24 -25.149 38.153 -6.716 150 HE2 LYS 24 HE2 LYS 24 -25.331 35.915 -5.723 151 HE3 LYS 24 HE1 LYS 24 -23.575 35.846 -5.577 152 HZ1 LYS 24 HZ1 LYS 24 -24.614 36.487 -3.501 153 HZ2 LYS 24 HZ2 LYS 24 -25.340 37.820 -4.234 154 HZ3 LYS 24 HZ3 LYS 24 -23.658 37.747 -4.094 155 H CYS 25 HN CYS 25 -20.750 35.261 -10.023 156 HA CYS 25 HA CYS 25 -19.177 33.714 -10.400 157 HB2 CYS 25 HB2 CYS 25 -17.744 35.539 -9.315 158 HB3 CYS 25 HB1 CYS 25 -17.809 34.564 -7.852 159 H GLN 26 HN GLN 26 -20.702 32.106 -10.072 160 HA GLN 26 HA GLN 26 -20.459 30.676 -7.516 161 HB2 GLN 26 HB2 GLN 26 -22.815 30.853 -9.395 162 HB3 GLN 26 HB1 GLN 26 -22.740 29.799 -7.989 163 HG2 GLN 26 HG2 GLN 26 -22.663 31.646 -6.503 164 HG3 GLN 26 HG1 GLN 26 -22.433 32.783 -7.829 165 HE21 GLN 26 HE21 GLN 26 -24.462 32.700 -5.748 166 HE22 GLN 26 HE22 GLN 26 -25.985 32.640 -6.575 167 H CYS 27 HN CYS 27 -18.984 30.551 -10.153 168 HA CYS 27 HA CYS 27 -19.639 28.009 -11.278 169 HB2 CYS 27 HB2 CYS 27 -17.647 28.311 -12.600 170 HB3 CYS 27 HB1 CYS 27 -18.506 29.846 -12.526 171 H GLY 28 HN GLY 28 -18.071 26.185 -11.283 172 HA2 GLY 28 HA2 GLY 28 -16.881 25.893 -8.607 173 HA3 GLY 28 HA1 GLY 28 -17.343 24.568 -9.669 174 H GLU 29 HN GLU 29 -15.682 27.331 -10.916 175 HA GLU 29 HA GLU 29 -13.682 27.647 -11.884 176 HB2 GLU 29 HB2 GLU 29 -13.065 26.394 -9.454 177 HB3 GLU 29 HB1 GLU 29 -12.127 25.525 -10.655 178 HG2 GLU 29 HG2 GLU 29 -12.098 28.523 -10.497 179 HG3 GLU 29 HG1 GLU 29 -11.036 27.526 -9.508 180 H GLY 30 HN GLY 30 -11.729 26.121 -12.865 181 HA2 GLY 30 HA2 GLY 30 -11.254 24.398 -14.377 182 HA3 GLY 30 HA1 GLY 30 -12.928 23.853 -14.252 183 H CYS 31 HN CYS 31 -12.729 27.142 -14.512 184 HA CYS 31 HA CYS 31 -13.568 27.081 -17.311 185 HB2 CYS 31 HB2 CYS 31 -14.335 29.424 -16.748 186 HB3 CYS 31 HB1 CYS 31 -15.152 28.133 -15.871 187 H THR 32 HN THR 32 -11.138 28.180 -15.124 188 HA THR 32 HA THR 32 -9.241 29.359 -15.294 189 HB THR 32 HB THR 32 -7.870 29.023 -17.372 190 HG1 THR 32 HG1 THR 32 -10.294 28.343 -18.390 191 HG21 THR 32 HG21 THR 32 -7.778 27.428 -15.535 192 HG22 THR 32 HG22 THR 32 -7.638 26.591 -17.081 193 HG23 THR 32 HG23 THR 32 -9.163 26.563 -16.196 194 H CYS 33 HN CYS 33 -11.568 30.882 -15.698 195 HA CYS 33 HA CYS 33 -11.380 32.656 -17.878 196 HB2 CYS 33 HB2 CYS 33 -12.711 32.841 -15.188 197 HB3 CYS 33 HB1 CYS 33 -12.787 34.153 -16.354 198 H ALA 34 HN ALA 34 -11.032 34.997 -17.633 199 HA ALA 34 HA ALA 34 -8.783 35.596 -15.831 200 HB1 ALA 34 HB1 ALA 34 -8.036 37.219 -17.524 201 HB2 ALA 34 HB2 ALA 34 -9.374 36.742 -18.568 202 HB3 ALA 34 HB3 ALA 34 -8.099 35.586 -18.187 203 H ALA 35 HN ALA 35 -11.863 35.841 -15.866 204 HA ALA 35 HA ALA 35 -12.043 38.712 -15.279 205 HB1 ALA 35 HB1 ALA 35 -13.498 37.943 -17.113 206 HB2 ALA 35 HB2 ALA 35 -14.418 38.555 -15.737 207 HB3 ALA 35 HB3 ALA 35 -14.270 36.817 -15.996 208 H CYS 36 HN CYS 36 -13.836 35.766 -14.318 209 HA CYS 36 HA CYS 36 -14.195 36.835 -11.702 210 HB2 CYS 36 HB2 CYS 36 -15.375 34.733 -11.234 211 HB3 CYS 36 HB1 CYS 36 -15.905 35.491 -12.729 212 H LYS 37 HN LYS 37 -12.357 34.240 -13.185 213 HA LYS 37 HA LYS 37 -10.954 33.601 -10.762 214 HB2 LYS 37 HB2 LYS 37 -11.495 31.826 -12.359 215 HB3 LYS 37 HB1 LYS 37 -10.557 32.641 -13.599 216 HG2 LYS 37 HG2 LYS 37 -8.545 32.352 -12.129 217 HG3 LYS 37 HG1 LYS 37 -9.545 31.333 -11.092 218 HD2 LYS 37 HD2 LYS 37 -9.919 29.782 -12.885 219 HD3 LYS 37 HD1 LYS 37 -9.098 30.851 -14.026 220 HE2 LYS 37 HE2 LYS 37 -7.616 29.049 -13.382 221 HE3 LYS 37 HE1 LYS 37 -7.014 30.578 -12.750 222 HZ1 LYS 37 HZ1 LYS 37 -6.830 28.920 -11.067 223 HZ2 LYS 37 HZ2 LYS 37 -8.447 28.459 -11.244 224 HZ3 LYS 37 HZ3 LYS 37 -8.065 29.979 -10.604 225 H THR 38 HN THR 38 -9.496 35.030 -10.078 226 HA THR 38 HA THR 38 -7.107 35.465 -11.430 227 HB THR 38 HB THR 38 -8.581 36.959 -12.852 228 HG1 THR 38 HG1 THR 38 -6.547 37.585 -13.017 229 HG21 THR 38 HG21 THR 38 -8.705 38.614 -10.319 230 HG22 THR 38 HG22 THR 38 -10.066 37.804 -11.094 231 HG23 THR 38 HG23 THR 38 -9.251 39.138 -11.912 232 H CYS 39 HN CYS 39 -5.734 37.048 -10.234 233 HA CYS 39 HA CYS 39 -6.445 36.981 -7.405 234 HB2 CYS 39 HB2 CYS 39 -4.272 36.022 -8.073 235 HB3 CYS 39 HB1 CYS 39 -3.795 37.580 -8.736 236 H ASN 40 HN ASN 40 -6.455 38.830 -6.127 237 HA ASN 40 HA ASN 40 -6.802 41.296 -7.691 238 HB2 ASN 40 HB2 ASN 40 -7.951 40.394 -5.057 239 HB3 ASN 40 HB1 ASN 40 -8.017 42.077 -5.569 240 HD21 ASN 40 HD21 ASN 40 -9.074 38.816 -6.302 241 HD22 ASN 40 HD22 ASN 40 -10.397 39.264 -7.320 242 H CYS 41 HN CYS 41 -4.405 39.904 -6.117 243 HA CYS 41 HA CYS 41 -3.573 42.120 -4.467 244 HB2 CYS 41 HB2 CYS 41 -2.103 39.590 -5.208 245 HB3 CYS 41 HB1 CYS 41 -1.639 40.739 -3.955 246 H THR 42 HN THR 42 -1.791 43.434 -4.840 247 HA THR 42 HA THR 42 -0.788 43.434 -7.601 248 HB THR 42 HB THR 42 -0.569 45.912 -7.358 249 HG1 THR 42 HG1 THR 42 -1.887 46.801 -5.553 250 HG21 THR 42 HG21 THR 42 -2.547 44.973 -8.465 251 HG22 THR 42 HG22 THR 42 -2.963 46.435 -7.567 252 HG23 THR 42 HG23 THR 42 -3.362 44.848 -6.906 253 H SER 43 HN SER 43 1.414 44.419 -7.787 254 HA SER 43 HA SER 43 3.211 43.268 -5.940 255 HB2 SER 43 HB2 SER 43 3.742 45.439 -7.982 256 HB3 SER 43 HB1 SER 43 4.956 44.420 -7.207 257 HG SER 43 HG SER 43 3.151 42.796 -8.224 258 H ASP 44 HN ASP 44 1.688 46.361 -6.129 259 HA ASP 44 HA ASP 44 3.364 47.776 -4.338 260 HB2 ASP 44 HB2 ASP 44 0.549 48.178 -5.304 261 HB3 ASP 44 HB1 ASP 44 1.218 49.204 -4.043 262 H GLY 45 HN GLY 45 0.565 45.691 -3.888 263 HA2 GLY 45 HA2 GLY 45 1.231 45.356 -1.129 264 HA3 GLY 45 HA1 GLY 45 -0.233 46.298 -1.366 265 H CYS 46 HN CYS 46 0.697 43.404 -0.535 266 HA CYS 46 HA CYS 46 -0.962 41.785 -2.225 267 HB2 CYS 46 HB2 CYS 46 1.153 41.062 -0.929 268 HB3 CYS 46 HB1 CYS 46 0.095 40.983 0.476 269 H LYS 47 HN LYS 47 -3.067 41.471 -1.990 270 HA LYS 47 HA LYS 47 -4.495 42.934 0.020 271 HB2 LYS 47 HB2 LYS 47 -5.543 41.025 -2.069 272 HB3 LYS 47 HB1 LYS 47 -6.505 42.146 -1.120 273 HG2 LYS 47 HG2 LYS 47 -4.314 43.029 -2.970 274 HG3 LYS 47 HG1 LYS 47 -5.991 42.843 -3.483 275 HD2 LYS 47 HD2 LYS 47 -6.676 44.497 -1.819 276 HD3 LYS 47 HD1 LYS 47 -5.001 44.657 -1.282 277 HE2 LYS 47 HE2 LYS 47 -5.658 46.470 -2.812 278 HE3 LYS 47 HE1 LYS 47 -4.346 45.492 -3.465 279 HZ1 LYS 47 HZ1 LYS 47 -6.009 45.978 -5.145 280 HZ2 LYS 47 HZ2 LYS 47 -7.217 45.267 -4.210 281 HZ3 LYS 47 HZ3 LYS 47 -5.968 44.315 -4.840 282 H CYS 48 HN CYS 48 -3.957 39.513 -0.677 283 HA CYS 48 HA CYS 48 -5.668 38.732 1.520 284 HB2 CYS 48 HB2 CYS 48 -5.232 36.484 0.816 285 HB3 CYS 48 HB1 CYS 48 -5.484 37.466 -0.635 286 H GLY 49 HN GLY 49 -2.219 38.857 0.786 287 HA2 GLY 49 HA2 GLY 49 -0.711 39.414 2.602 288 HA3 GLY 49 HA1 GLY 49 -1.692 38.405 3.652 289 H LYS 50 HN LYS 50 -1.423 36.842 0.722 290 HA LYS 50 HA LYS 50 0.474 34.951 1.814 291 HB2 LYS 50 HB2 LYS 50 -0.931 35.006 -0.859 292 HB3 LYS 50 HB1 LYS 50 0.047 33.676 -0.261 293 HG2 LYS 50 HG2 LYS 50 -2.503 34.687 0.980 294 HG3 LYS 50 HG1 LYS 50 -2.329 33.233 -0.005 295 HD2 LYS 50 HD2 LYS 50 -0.667 32.417 1.698 296 HD3 LYS 50 HD1 LYS 50 -1.150 33.789 2.704 297 HE2 LYS 50 HE2 LYS 50 -3.469 32.994 2.654 298 HE3 LYS 50 HE1 LYS 50 -2.973 31.619 1.671 299 HZ1 LYS 50 HZ1 LYS 50 -3.149 30.949 3.941 300 HZ2 LYS 50 HZ2 LYS 50 -2.140 32.200 4.455 301 HZ3 LYS 50 HZ3 LYS 50 -1.514 30.943 3.516 302 H GLU 51 HN GLU 51 0.787 37.784 0.218 303 HA GLU 51 HA GLU 51 2.469 38.888 -0.783 304 HB2 GLU 51 HB2 GLU 51 3.809 37.690 1.024 305 HB3 GLU 51 HB1 GLU 51 4.273 36.539 -0.220 306 HG2 GLU 51 HG2 GLU 51 5.265 38.362 -1.524 307 HG3 GLU 51 HG1 GLU 51 4.818 39.499 -0.255 308 H CYS 52 HN CYS 52 0.776 36.910 -2.210 309 HA CYS 52 HA CYS 52 2.341 35.863 -4.339 310 HB2 CYS 52 HB2 CYS 52 -0.040 35.843 -5.433 311 HB3 CYS 52 HB1 CYS 52 0.328 34.745 -4.104 312 H THR 53 HN THR 53 0.228 38.652 -3.945 313 HA THR 53 HA THR 53 0.036 40.646 -4.989 314 HB THR 53 HB THR 53 2.119 41.837 -5.508 315 HG1 THR 53 HG1 THR 53 3.111 39.293 -5.677 316 HG21 THR 53 HG21 THR 53 1.342 41.723 -3.205 317 HG22 THR 53 HG22 THR 53 3.105 41.704 -3.259 318 HG23 THR 53 HG23 THR 53 2.212 40.208 -2.974 319 H GLY 54 HN GLY 54 -0.335 38.324 -6.714 320 HA2 GLY 54 HA2 GLY 54 -0.889 39.505 -9.099 321 HA3 GLY 54 HA1 GLY 54 0.785 38.977 -9.259 322 HA PRO 55 HA PRO 55 -2.694 35.521 -9.548 323 HB2 PRO 55 HB2 PRO 55 -2.914 35.476 -12.317 324 HB3 PRO 55 HB1 PRO 55 -4.075 36.192 -11.198 325 HG2 PRO 55 HG2 PRO 55 -1.918 37.504 -12.789 326 HG3 PRO 55 HG1 PRO 55 -3.546 38.089 -12.405 327 HD2 PRO 55 HD2 PRO 55 -1.376 39.019 -11.131 328 HD3 PRO 55 HD1 PRO 55 -2.928 38.805 -10.295 329 H ASP 56 HN ASP 56 0.016 36.280 -11.704 330 HA ASP 56 HA ASP 56 0.539 33.582 -12.400 331 HB2 ASP 56 HB2 ASP 56 2.231 36.067 -12.548 332 HB3 ASP 56 HB1 ASP 56 2.834 34.492 -13.045 333 H SER 57 HN SER 57 1.784 35.695 -9.891 334 HA SER 57 HA SER 57 3.450 33.543 -8.849 335 HB2 SER 57 HB2 SER 57 3.145 36.412 -7.934 336 HB3 SER 57 HB1 SER 57 4.343 35.258 -7.344 337 HG SER 57 HG SER 57 4.977 36.789 -9.091 338 H CYS 58 HN CYS 58 0.383 33.860 -8.751 339 HA CYS 58 HA CYS 58 -0.119 33.988 -5.923 340 HB2 CYS 58 HB2 CYS 58 -1.672 34.952 -7.647 341 HB3 CYS 58 HB1 CYS 58 -2.040 33.307 -8.149 342 H LYS 59 HN LYS 59 -0.478 32.337 -4.624 343 HA LYS 59 HA LYS 59 -0.205 29.634 -5.758 344 HB2 LYS 59 HB2 LYS 59 0.598 30.730 -3.061 345 HB3 LYS 59 HB1 LYS 59 0.670 29.028 -3.495 346 HG2 LYS 59 HG2 LYS 59 2.399 29.373 -5.032 347 HG3 LYS 59 HG1 LYS 59 2.114 31.111 -5.095 348 HD2 LYS 59 HD2 LYS 59 2.982 31.422 -2.919 349 HD3 LYS 59 HD1 LYS 59 3.032 29.684 -2.607 350 HE2 LYS 59 HE2 LYS 59 4.753 29.424 -4.315 351 HE3 LYS 59 HE1 LYS 59 4.668 31.143 -4.682 352 HZ1 LYS 59 HZ1 LYS 59 5.533 29.960 -2.095 353 HZ2 LYS 59 HZ2 LYS 59 5.439 31.612 -2.425 354 HZ3 LYS 59 HZ3 LYS 59 6.544 30.648 -3.259 355 H CYS 60 HN CYS 60 -2.339 31.751 -4.422 356 HA CYS 60 HA CYS 60 -3.775 30.008 -2.668 357 HB2 CYS 60 HB2 CYS 60 -4.734 32.574 -3.915 358 HB3 CYS 60 HB1 CYS 60 -5.267 31.840 -2.403 359 H GLY 61 HN GLY 61 -6.008 29.355 -3.024 360 HA2 GLY 61 HA2 GLY 61 -6.345 28.316 -5.711 361 HA3 GLY 61 HA1 GLY 61 -7.311 27.906 -4.302 362 H SER 62 HN SER 62 -9.274 28.762 -4.156 363 HA SER 62 HA SER 62 -9.899 31.173 -5.709 364 HB2 SER 62 HB2 SER 62 -11.661 28.722 -5.617 365 HB3 SER 62 HB1 SER 62 -11.935 30.192 -6.551 366 HG SER 62 HG SER 62 -9.983 28.184 -6.926 367 H SER 63 HN SER 63 -9.896 29.730 -2.735 368 HA SER 63 HA SER 63 -12.370 31.062 -1.883 369 HB2 SER 63 HB2 SER 63 -10.752 28.981 -0.402 370 HB3 SER 63 HB1 SER 63 -12.333 29.612 0.063 371 HG SER 63 HG SER 63 -11.661 27.980 -2.146 372 H CYS 64 HN CYS 64 -9.274 31.862 -2.159 373 HA CYS 64 HA CYS 64 -8.811 32.899 0.491 374 HB2 CYS 64 HB2 CYS 64 -6.963 32.064 -0.987 375 HB3 CYS 64 HB1 CYS 64 -7.236 33.454 -2.030 376 H SER 65 HN SER 65 -8.172 35.263 0.683 377 HA SER 65 HA SER 65 -10.463 36.792 -0.004 378 HB2 SER 65 HB2 SER 65 -9.183 37.063 2.119 379 HB3 SER 65 HB1 SER 65 -7.863 37.775 1.192 380 HG SER 65 HG SER 65 -9.018 39.551 0.871 381 H CYS 66 HN CYS 66 -7.503 36.226 -1.662 382 HA CYS 66 HA CYS 66 -7.686 38.728 -3.112 383 HB2 CYS 66 HB2 CYS 66 -5.693 37.916 -4.349 384 HB3 CYS 66 HB1 CYS 66 -5.452 37.988 -2.612 385 H LYS 67 HN LYS 67 -9.425 36.020 -3.246 386 HA LYS 67 HA LYS 67 -9.623 36.063 -6.188 387 HB2 LYS 67 HB2 LYS 67 -10.449 33.798 -4.362 388 HB3 LYS 67 HB1 LYS 67 -10.412 33.778 -6.118 389 HG2 LYS 67 HG2 LYS 67 -8.051 33.924 -4.257 390 HG3 LYS 67 HG1 LYS 67 -8.515 32.567 -5.280 391 HD2 LYS 67 HD2 LYS 67 -8.040 33.839 -7.269 392 HD3 LYS 67 HD1 LYS 67 -7.756 35.296 -6.316 393 HE2 LYS 67 HE2 LYS 67 -5.610 34.544 -6.747 394 HE3 LYS 67 HE1 LYS 67 -5.948 33.893 -5.144 395 HZ1 LYS 67 HZ1 LYS 67 -6.094 32.421 -7.706 396 HZ2 LYS 67 HZ2 LYS 67 -6.542 31.779 -6.215 397 HZ3 LYS 67 HZ3 LYS 67 -4.935 32.225 -6.495 Start of MODEL 12 1 HA2 GLY 1 HA1 GLY 1 -12.450 7.703 -8.473 2 HA3 GLY 1 HA2 GLY 1 -11.182 6.912 -9.396 3 H SER 2 HN SER 2 -11.140 10.040 -10.348 4 HA SER 2 HA SER 2 -8.884 10.634 -8.582 5 HB2 SER 2 HB2 SER 2 -9.778 12.098 -11.073 6 HB3 SER 2 HB1 SER 2 -8.232 12.269 -10.240 7 HG SER 2 HG SER 2 -7.702 10.845 -11.732 8 H GLY 3 HN GLY 3 -12.105 11.222 -8.630 9 HA2 GLY 3 HA2 GLY 3 -12.979 12.602 -6.809 10 HA3 GLY 3 HA1 GLY 3 -11.793 13.820 -7.271 11 H LYS 4 HN LYS 4 -14.964 13.096 -7.428 12 HA LYS 4 HA LYS 4 -15.564 13.761 -10.124 13 HB2 LYS 4 HB2 LYS 4 -17.325 13.742 -7.670 14 HB3 LYS 4 HB1 LYS 4 -17.911 13.979 -9.309 15 HG2 LYS 4 HG2 LYS 4 -17.033 11.752 -9.914 16 HG3 LYS 4 HG1 LYS 4 -16.540 11.519 -8.240 17 HD2 LYS 4 HD2 LYS 4 -19.374 12.002 -9.170 18 HD3 LYS 4 HD1 LYS 4 -18.694 10.425 -8.771 19 HE2 LYS 4 HE2 LYS 4 -18.273 11.210 -6.475 20 HE3 LYS 4 HE1 LYS 4 -18.995 12.764 -6.885 21 HZ1 LYS 4 HZ1 LYS 4 -20.397 10.149 -6.965 22 HZ2 LYS 4 HZ2 LYS 4 -21.085 11.650 -7.317 23 HZ3 LYS 4 HZ3 LYS 4 -20.561 11.312 -5.752 24 H GLY 5 HN GLY 5 -14.386 15.635 -10.482 25 HA2 GLY 5 HA2 GLY 5 -15.908 18.033 -9.999 26 HA3 GLY 5 HA1 GLY 5 -14.338 18.016 -9.204 27 H LYS 6 HN LYS 6 -14.809 16.350 -12.197 28 HA LYS 6 HA LYS 6 -12.752 17.913 -13.469 29 HB2 LYS 6 HB2 LYS 6 -14.516 15.699 -14.523 30 HB3 LYS 6 HB1 LYS 6 -13.182 16.422 -15.409 31 HG2 LYS 6 HG2 LYS 6 -11.621 15.629 -13.711 32 HG3 LYS 6 HG1 LYS 6 -12.963 14.910 -12.818 33 HD2 LYS 6 HD2 LYS 6 -13.459 13.448 -14.685 34 HD3 LYS 6 HD1 LYS 6 -12.189 14.210 -15.642 35 HE2 LYS 6 HE2 LYS 6 -10.516 13.432 -14.050 36 HE3 LYS 6 HE1 LYS 6 -11.781 12.686 -13.076 37 HZ1 LYS 6 HZ1 LYS 6 -10.642 11.093 -14.527 38 HZ2 LYS 6 HZ2 LYS 6 -11.160 11.956 -15.887 39 HZ3 LYS 6 HZ3 LYS 6 -12.292 11.208 -14.877 40 H GLY 7 HN GLY 7 -16.141 17.907 -13.278 41 HA2 GLY 7 HA2 GLY 7 -16.764 19.176 -15.719 42 HA3 GLY 7 HA1 GLY 7 -17.770 19.160 -14.276 43 H GLU 8 HN GLU 8 -17.168 21.295 -16.191 44 HA GLU 8 HA GLU 8 -15.480 23.224 -14.999 45 HB2 GLU 8 HB2 GLU 8 -17.860 23.649 -16.809 46 HB3 GLU 8 HB1 GLU 8 -16.555 24.789 -16.519 47 HG2 GLU 8 HG2 GLU 8 -16.081 22.076 -17.706 48 HG3 GLU 8 HG1 GLU 8 -16.492 23.481 -18.682 49 H LYS 9 HN LYS 9 -18.950 22.586 -14.880 50 HA LYS 9 HA LYS 9 -20.633 23.245 -13.515 51 HB2 LYS 9 HB2 LYS 9 -18.350 23.630 -11.576 52 HB3 LYS 9 HB1 LYS 9 -20.047 23.705 -11.126 53 HG2 LYS 9 HG2 LYS 9 -20.280 21.359 -11.985 54 HG3 LYS 9 HG1 LYS 9 -18.526 21.325 -12.162 55 HD2 LYS 9 HD2 LYS 9 -20.013 21.849 -9.588 56 HD3 LYS 9 HD1 LYS 9 -19.279 20.313 -10.046 57 HE2 LYS 9 HE2 LYS 9 -17.080 21.377 -10.102 58 HE3 LYS 9 HE1 LYS 9 -17.811 22.924 -9.674 59 HZ1 LYS 9 HZ1 LYS 9 -18.500 21.996 -7.570 60 HZ2 LYS 9 HZ2 LYS 9 -16.831 21.803 -7.762 61 HZ3 LYS 9 HZ3 LYS 9 -17.861 20.484 -7.986 62 H CYS 10 HN CYS 10 -19.416 25.199 -15.239 63 HA CYS 10 HA CYS 10 -19.477 27.651 -13.747 64 HB2 CYS 10 HB2 CYS 10 -19.001 27.051 -16.647 65 HB3 CYS 10 HB1 CYS 10 -19.060 28.687 -15.995 66 H THR 11 HN THR 11 -20.805 29.387 -14.223 67 HA THR 11 HA THR 11 -23.542 28.545 -14.664 68 HB THR 11 HB THR 11 -24.089 30.739 -13.716 69 HG1 THR 11 HG1 THR 11 -21.977 31.790 -12.832 70 HG21 THR 11 HG21 THR 11 -23.646 28.846 -12.198 71 HG22 THR 11 HG22 THR 11 -23.157 30.381 -11.481 72 HG23 THR 11 HG23 THR 11 -21.938 29.292 -12.152 73 H SER 12 HN SER 12 -24.923 30.385 -15.728 74 HA SER 12 HA SER 12 -24.105 30.654 -18.418 75 HB2 SER 12 HB2 SER 12 -26.282 32.207 -16.999 76 HB3 SER 12 HB1 SER 12 -26.174 31.850 -18.724 77 HG SER 12 HG SER 12 -27.227 30.103 -18.302 78 H ALA 13 HN ALA 13 -23.612 32.536 -15.594 79 HA ALA 13 HA ALA 13 -23.094 35.033 -16.872 80 HB1 ALA 13 HB1 ALA 13 -22.256 34.045 -14.149 81 HB2 ALA 13 HB2 ALA 13 -23.764 34.877 -14.521 82 HB3 ALA 13 HB3 ALA 13 -22.226 35.719 -14.702 83 H CYS 14 HN CYS 14 -21.069 32.441 -15.547 84 HA CYS 14 HA CYS 14 -18.595 33.610 -16.265 85 HB2 CYS 14 HB2 CYS 14 -19.034 31.732 -14.581 86 HB3 CYS 14 HB1 CYS 14 -19.127 30.650 -15.962 87 H ARG 15 HN ARG 15 -20.880 31.553 -17.921 88 HA ARG 15 HA ARG 15 -19.106 31.211 -20.198 89 HB2 ARG 15 HB2 ARG 15 -21.871 30.165 -19.618 90 HB3 ARG 15 HB1 ARG 15 -21.015 29.873 -21.124 91 HG2 ARG 15 HG2 ARG 15 -20.225 28.952 -18.371 92 HG3 ARG 15 HG1 ARG 15 -20.764 27.957 -19.725 93 HD2 ARG 15 HD2 ARG 15 -18.750 28.875 -20.985 94 HD3 ARG 15 HD1 ARG 15 -18.186 29.467 -19.423 95 HE ARG 15 HE ARG 15 -18.855 26.638 -19.650 96 HH11 ARG 15 HH11 ARG 15 -16.361 29.106 -19.349 97 HH12 ARG 15 HH12 ARG 15 -15.110 27.966 -19.026 98 HH21 ARG 15 HH21 ARG 15 -17.188 25.152 -19.238 99 HH22 ARG 15 HH22 ARG 15 -15.570 25.699 -18.942 100 H SER 16 HN SER 16 -20.394 33.861 -19.396 101 HA SER 16 HA SER 16 -21.974 34.368 -21.791 102 HB2 SER 16 HB2 SER 16 -22.697 35.227 -19.518 103 HB3 SER 16 HB1 SER 16 -21.309 36.312 -19.567 104 HG SER 16 HG SER 16 -23.306 36.219 -21.583 105 H GLU 17 HN GLU 17 -21.411 36.825 -22.569 106 HA GLU 17 HA GLU 17 -18.522 36.908 -23.044 107 HB2 GLU 17 HB2 GLU 17 -19.084 37.602 -25.422 108 HB3 GLU 17 HB1 GLU 17 -19.339 35.910 -25.017 109 HG2 GLU 17 HG2 GLU 17 -21.712 36.271 -24.812 110 HG3 GLU 17 HG1 GLU 17 -21.500 38.003 -25.058 111 HA PRO 18 HA PRO 18 -17.167 37.883 -22.260 112 HB2 PRO 18 HB2 PRO 18 -16.103 39.452 -20.380 113 HB3 PRO 18 HB1 PRO 18 -15.949 39.858 -22.094 114 HG2 PRO 18 HG2 PRO 18 -17.812 40.972 -20.040 115 HG3 PRO 18 HG1 PRO 18 -16.917 41.815 -21.317 116 HD2 PRO 18 HD2 PRO 18 -19.570 41.092 -21.488 117 HD3 PRO 18 HD1 PRO 18 -18.517 41.375 -22.885 118 H CYS 19 HN CYS 19 -16.319 37.356 -19.859 119 HA CYS 19 HA CYS 19 -18.377 35.922 -18.636 120 HB2 CYS 19 HB2 CYS 19 -16.044 35.285 -18.379 121 HB3 CYS 19 HB1 CYS 19 -15.717 36.769 -17.490 122 H GLN 20 HN GLN 20 -19.861 36.429 -17.216 123 HA GLN 20 HA GLN 20 -19.768 39.087 -15.936 124 HB2 GLN 20 HB2 GLN 20 -22.182 37.369 -16.534 125 HB3 GLN 20 HB1 GLN 20 -22.190 39.021 -15.930 126 HG2 GLN 20 HG2 GLN 20 -21.056 38.231 -18.595 127 HG3 GLN 20 HG1 GLN 20 -22.720 38.743 -18.351 128 HE21 GLN 20 HE21 GLN 20 -19.391 39.737 -18.350 129 HE22 GLN 20 HE22 GLN 20 -19.680 41.441 -18.367 130 H CYS 21 HN CYS 21 -18.743 36.334 -15.182 131 HA CYS 21 HA CYS 21 -20.308 35.247 -13.095 132 HB2 CYS 21 HB2 CYS 21 -18.116 34.446 -14.446 133 HB3 CYS 21 HB1 CYS 21 -17.403 34.974 -12.929 134 H GLY 22 HN GLY 22 -18.186 37.988 -13.215 135 HA2 GLY 22 HA2 GLY 22 -17.235 38.081 -10.583 136 HA3 GLY 22 HA1 GLY 22 -17.475 39.479 -11.615 137 H SER 23 HN SER 23 -20.441 38.397 -11.616 138 HA SER 23 HA SER 23 -21.405 40.229 -9.690 139 HB2 SER 23 HB2 SER 23 -22.990 38.005 -10.966 140 HB3 SER 23 HB1 SER 23 -23.572 39.571 -10.406 141 HG SER 23 HG SER 23 -22.397 38.876 -12.786 142 H LYS 24 HN LYS 24 -20.904 36.742 -9.693 143 HA LYS 24 HA LYS 24 -21.190 36.647 -6.774 144 HB2 LYS 24 HB2 LYS 24 -22.743 34.840 -8.636 145 HB3 LYS 24 HB1 LYS 24 -22.525 34.532 -6.925 146 HG2 LYS 24 HG2 LYS 24 -23.692 36.659 -6.437 147 HG3 LYS 24 HG1 LYS 24 -23.989 36.847 -8.168 148 HD2 LYS 24 HD2 LYS 24 -25.167 34.664 -8.152 149 HD3 LYS 24 HD1 LYS 24 -24.946 34.596 -6.406 150 HE2 LYS 24 HE2 LYS 24 -26.409 36.788 -7.867 151 HE3 LYS 24 HE1 LYS 24 -27.182 35.409 -7.093 152 HZ1 LYS 24 HZ1 LYS 24 -27.240 37.306 -5.648 153 HZ2 LYS 24 HZ2 LYS 24 -25.568 37.505 -5.744 154 HZ3 LYS 24 HZ3 LYS 24 -26.216 36.142 -4.978 155 H CYS 25 HN CYS 25 -20.461 34.937 -9.748 156 HA CYS 25 HA CYS 25 -18.864 33.523 -10.384 157 HB2 CYS 25 HB2 CYS 25 -17.367 35.220 -9.196 158 HB3 CYS 25 HB1 CYS 25 -17.375 34.118 -7.824 159 H GLN 26 HN GLN 26 -20.539 32.042 -10.075 160 HA GLN 26 HA GLN 26 -20.342 30.388 -7.670 161 HB2 GLN 26 HB2 GLN 26 -22.505 31.554 -8.666 162 HB3 GLN 26 HB1 GLN 26 -22.530 30.104 -9.657 163 HG2 GLN 26 HG2 GLN 26 -22.476 28.754 -7.595 164 HG3 GLN 26 HG1 GLN 26 -22.562 30.271 -6.689 165 HE21 GLN 26 HE21 GLN 26 -24.493 29.533 -5.749 166 HE22 GLN 26 HE22 GLN 26 -25.989 29.618 -6.611 167 H CYS 27 HN CYS 27 -18.870 30.424 -10.472 168 HA CYS 27 HA CYS 27 -19.465 27.840 -11.550 169 HB2 CYS 27 HB2 CYS 27 -17.629 28.244 -13.042 170 HB3 CYS 27 HB1 CYS 27 -18.532 29.746 -12.867 171 H GLY 28 HN GLY 28 -17.351 26.441 -11.965 172 HA2 GLY 28 HA2 GLY 28 -16.384 25.671 -9.317 173 HA3 GLY 28 HA1 GLY 28 -16.242 24.721 -10.791 174 H GLU 29 HN GLU 29 -14.059 24.337 -10.763 175 HA GLU 29 HA GLU 29 -12.370 26.723 -11.029 176 HB2 GLU 29 HB2 GLU 29 -11.664 24.116 -9.665 177 HB3 GLU 29 HB1 GLU 29 -10.480 25.341 -10.078 178 HG2 GLU 29 HG2 GLU 29 -10.937 25.641 -7.799 179 HG3 GLU 29 HG1 GLU 29 -11.812 26.930 -8.622 180 H GLY 30 HN GLY 30 -13.745 24.730 -12.835 181 HA2 GLY 30 HA2 GLY 30 -11.527 23.466 -14.208 182 HA3 GLY 30 HA1 GLY 30 -13.221 23.357 -14.654 183 H CYS 31 HN CYS 31 -13.511 26.308 -14.635 184 HA CYS 31 HA CYS 31 -13.034 26.694 -17.396 185 HB2 CYS 31 HB2 CYS 31 -13.966 28.870 -17.075 186 HB3 CYS 31 HB1 CYS 31 -14.862 27.745 -16.056 187 H THR 32 HN THR 32 -11.303 27.614 -14.506 188 HA THR 32 HA THR 32 -9.529 28.921 -14.050 189 HB THR 32 HB THR 32 -7.541 28.707 -15.569 190 HG1 THR 32 HG1 THR 32 -9.451 27.953 -17.340 191 HG21 THR 32 HG21 THR 32 -7.987 27.028 -13.851 192 HG22 THR 32 HG22 THR 32 -7.254 26.294 -15.278 193 HG23 THR 32 HG23 THR 32 -8.986 26.124 -14.990 194 H CYS 33 HN CYS 33 -11.743 30.166 -15.164 195 HA CYS 33 HA CYS 33 -11.276 32.017 -17.209 196 HB2 CYS 33 HB2 CYS 33 -13.424 31.203 -15.765 197 HB3 CYS 33 HB1 CYS 33 -13.109 32.747 -14.990 198 H ALA 34 HN ALA 34 -9.900 33.677 -17.191 199 HA ALA 34 HA ALA 34 -8.752 34.625 -14.697 200 HB1 ALA 34 HB1 ALA 34 -8.118 35.404 -17.544 201 HB2 ALA 34 HB2 ALA 34 -7.288 34.160 -16.608 202 HB3 ALA 34 HB3 ALA 34 -7.190 35.850 -16.112 203 H ALA 35 HN ALA 35 -11.537 35.197 -15.626 204 HA ALA 35 HA ALA 35 -11.435 38.134 -15.625 205 HB1 ALA 35 HB1 ALA 35 -13.639 36.282 -16.538 206 HB2 ALA 35 HB2 ALA 35 -12.575 37.229 -17.578 207 HB3 ALA 35 HB3 ALA 35 -13.730 38.042 -16.523 208 H CYS 36 HN CYS 36 -13.229 35.346 -14.412 209 HA CYS 36 HA CYS 36 -14.185 36.928 -12.173 210 HB2 CYS 36 HB2 CYS 36 -15.529 34.925 -11.669 211 HB3 CYS 36 HB1 CYS 36 -15.748 35.507 -13.320 212 H LYS 37 HN LYS 37 -12.151 34.130 -12.867 213 HA LYS 37 HA LYS 37 -11.421 33.971 -10.060 214 HB2 LYS 37 HB2 LYS 37 -10.653 32.071 -12.272 215 HB3 LYS 37 HB1 LYS 37 -10.507 31.807 -10.541 216 HG2 LYS 37 HG2 LYS 37 -12.948 31.790 -10.339 217 HG3 LYS 37 HG1 LYS 37 -13.087 32.054 -12.078 218 HD2 LYS 37 HD2 LYS 37 -13.383 29.716 -11.649 219 HD3 LYS 37 HD1 LYS 37 -11.816 29.938 -12.431 220 HE2 LYS 37 HE2 LYS 37 -11.546 28.383 -10.629 221 HE3 LYS 37 HE1 LYS 37 -10.760 29.889 -10.179 222 HZ1 LYS 37 HZ1 LYS 37 -12.006 29.076 -8.332 223 HZ2 LYS 37 HZ2 LYS 37 -13.413 28.940 -9.266 224 HZ3 LYS 37 HZ3 LYS 37 -12.780 30.464 -8.917 225 H THR 38 HN THR 38 -10.062 35.741 -9.914 226 HA THR 38 HA THR 38 -7.414 35.286 -11.012 227 HB THR 38 HB THR 38 -8.513 36.831 -12.624 228 HG1 THR 38 HG1 THR 38 -6.897 38.609 -12.282 229 HG21 THR 38 HG21 THR 38 -8.759 38.670 -10.237 230 HG22 THR 38 HG22 THR 38 -10.092 37.922 -11.115 231 HG23 THR 38 HG23 THR 38 -9.075 39.122 -11.912 232 H CYS 39 HN CYS 39 -5.892 37.001 -10.006 233 HA CYS 39 HA CYS 39 -6.447 37.003 -7.145 234 HB2 CYS 39 HB2 CYS 39 -4.280 36.111 -8.050 235 HB3 CYS 39 HB1 CYS 39 -3.894 37.738 -8.594 236 H ASN 40 HN ASN 40 -6.785 38.833 -5.981 237 HA ASN 40 HA ASN 40 -7.320 41.259 -7.498 238 HB2 ASN 40 HB2 ASN 40 -7.547 40.875 -4.505 239 HB3 ASN 40 HB1 ASN 40 -8.302 42.128 -5.474 240 HD21 ASN 40 HD21 ASN 40 -9.095 40.235 -7.584 241 HD22 ASN 40 HD22 ASN 40 -10.406 39.322 -6.928 242 H CYS 41 HN CYS 41 -4.787 39.933 -5.724 243 HA CYS 41 HA CYS 41 -3.697 42.258 -4.546 244 HB2 CYS 41 HB2 CYS 41 -2.318 39.684 -5.262 245 HB3 CYS 41 HB1 CYS 41 -1.800 40.869 -4.067 246 H THR 42 HN THR 42 -2.257 43.695 -5.262 247 HA THR 42 HA THR 42 -1.460 43.518 -8.066 248 HB THR 42 HB THR 42 -0.932 45.914 -7.855 249 HG1 THR 42 HG1 THR 42 -1.451 46.984 -5.899 250 HG21 THR 42 HG21 THR 42 -3.221 46.750 -7.518 251 HG22 THR 42 HG22 THR 42 -3.668 45.203 -6.796 252 HG23 THR 42 HG23 THR 42 -3.204 45.282 -8.496 253 H SER 43 HN SER 43 0.803 44.393 -8.503 254 HA SER 43 HA SER 43 2.656 42.800 -7.115 255 HB2 SER 43 HB2 SER 43 3.173 45.123 -8.973 256 HB3 SER 43 HB1 SER 43 4.356 43.907 -8.490 257 HG SER 43 HG SER 43 3.560 42.593 -9.909 258 H ASP 44 HN ASP 44 1.596 46.048 -6.622 259 HA ASP 44 HA ASP 44 3.829 46.682 -4.883 260 HB2 ASP 44 HB2 ASP 44 2.985 48.456 -6.288 261 HB3 ASP 44 HB1 ASP 44 1.365 48.258 -5.630 262 H GLY 45 HN GLY 45 0.508 45.602 -4.586 263 HA2 GLY 45 HA2 GLY 45 0.887 45.546 -1.688 264 HA3 GLY 45 HA1 GLY 45 -0.498 46.423 -2.313 265 H CYS 46 HN CYS 46 0.472 43.606 -1.025 266 HA CYS 46 HA CYS 46 -1.196 41.794 -2.479 267 HB2 CYS 46 HB2 CYS 46 0.876 41.170 -1.159 268 HB3 CYS 46 HB1 CYS 46 -0.068 41.448 0.298 269 H LYS 47 HN LYS 47 -3.318 41.455 -2.173 270 HA LYS 47 HA LYS 47 -4.706 43.165 -0.310 271 HB2 LYS 47 HB2 LYS 47 -5.741 41.200 -2.352 272 HB3 LYS 47 HB1 LYS 47 -6.761 42.229 -1.363 273 HG2 LYS 47 HG2 LYS 47 -4.662 43.299 -3.225 274 HG3 LYS 47 HG1 LYS 47 -6.333 43.019 -3.711 275 HD2 LYS 47 HD2 LYS 47 -5.622 44.748 -1.350 276 HD3 LYS 47 HD1 LYS 47 -5.666 45.386 -2.989 277 HE2 LYS 47 HE2 LYS 47 -7.792 45.878 -2.137 278 HE3 LYS 47 HE1 LYS 47 -8.046 44.430 -3.100 279 HZ1 LYS 47 HZ1 LYS 47 -7.620 44.376 -0.165 280 HZ2 LYS 47 HZ2 LYS 47 -8.178 43.111 -1.145 281 HZ3 LYS 47 HZ3 LYS 47 -9.143 44.461 -0.875 282 H CYS 48 HN CYS 48 -4.080 39.728 -0.654 283 HA CYS 48 HA CYS 48 -5.853 39.182 1.590 284 HB2 CYS 48 HB2 CYS 48 -5.538 36.854 1.072 285 HB3 CYS 48 HB1 CYS 48 -5.841 37.730 -0.436 286 H GLY 49 HN GLY 49 -2.425 39.101 0.772 287 HA2 GLY 49 HA2 GLY 49 -0.880 39.769 2.532 288 HA3 GLY 49 HA1 GLY 49 -1.854 38.842 3.660 289 H LYS 50 HN LYS 50 -1.438 37.233 0.689 290 HA LYS 50 HA LYS 50 0.385 35.337 1.949 291 HB2 LYS 50 HB2 LYS 50 -0.901 35.269 -0.780 292 HB3 LYS 50 HB1 LYS 50 -0.040 33.946 -0.010 293 HG2 LYS 50 HG2 LYS 50 -2.548 35.192 1.072 294 HG3 LYS 50 HG1 LYS 50 -2.501 33.748 0.062 295 HD2 LYS 50 HD2 LYS 50 -1.077 32.658 1.762 296 HD3 LYS 50 HD1 LYS 50 -1.242 34.104 2.770 297 HE2 LYS 50 HE2 LYS 50 -2.820 32.237 3.341 298 HE3 LYS 50 HE1 LYS 50 -3.580 33.786 2.994 299 HZ1 LYS 50 HZ1 LYS 50 -4.071 33.000 0.755 300 HZ2 LYS 50 HZ2 LYS 50 -4.754 31.977 1.916 301 HZ3 LYS 50 HZ3 LYS 50 -3.354 31.509 1.101 302 H GLU 51 HN GLU 51 0.746 38.112 0.264 303 HA GLU 51 HA GLU 51 2.425 39.144 -0.835 304 HB2 GLU 51 HB2 GLU 51 3.984 36.770 0.164 305 HB3 GLU 51 HB1 GLU 51 4.720 38.038 -0.804 306 HG2 GLU 51 HG2 GLU 51 3.982 39.677 0.922 307 HG3 GLU 51 HG1 GLU 51 3.468 38.310 1.914 308 H CYS 52 HN CYS 52 0.719 36.928 -2.032 309 HA CYS 52 HA CYS 52 2.141 35.790 -4.174 310 HB2 CYS 52 HB2 CYS 52 -0.296 35.784 -5.156 311 HB3 CYS 52 HB1 CYS 52 0.112 34.759 -3.777 312 H THR 53 HN THR 53 0.110 38.658 -3.902 313 HA THR 53 HA THR 53 -0.068 40.573 -5.092 314 HB THR 53 HB THR 53 2.091 41.637 -5.750 315 HG1 THR 53 HG1 THR 53 2.939 39.049 -5.579 316 HG21 THR 53 HG21 THR 53 2.030 40.338 -3.027 317 HG22 THR 53 HG22 THR 53 1.221 41.836 -3.477 318 HG23 THR 53 HG23 THR 53 2.984 41.755 -3.465 319 H GLY 54 HN GLY 54 -0.883 38.476 -6.635 320 HA2 GLY 54 HA2 GLY 54 -1.465 39.196 -9.016 321 HA3 GLY 54 HA1 GLY 54 0.268 39.029 -9.275 322 HA PRO 55 HA PRO 55 -2.325 34.919 -9.504 323 HB2 PRO 55 HB2 PRO 55 -2.527 34.731 -12.241 324 HB3 PRO 55 HB1 PRO 55 -3.795 35.376 -11.192 325 HG2 PRO 55 HG2 PRO 55 -1.742 36.842 -12.804 326 HG3 PRO 55 HG1 PRO 55 -3.460 37.215 -12.577 327 HD2 PRO 55 HD2 PRO 55 -1.541 38.539 -11.246 328 HD3 PRO 55 HD1 PRO 55 -3.106 38.165 -10.494 329 H ASP 56 HN ASP 56 0.348 36.329 -11.189 330 HA ASP 56 HA ASP 56 1.546 34.031 -12.278 331 HB2 ASP 56 HB2 ASP 56 2.902 36.530 -11.241 332 HB3 ASP 56 HB1 ASP 56 3.592 35.365 -12.365 333 H SER 57 HN SER 57 2.153 35.726 -9.229 334 HA SER 57 HA SER 57 3.704 33.422 -8.295 335 HB2 SER 57 HB2 SER 57 3.572 36.214 -7.140 336 HB3 SER 57 HB1 SER 57 4.719 34.941 -6.714 337 HG SER 57 HG SER 57 5.671 36.385 -8.176 338 H CYS 58 HN CYS 58 0.690 33.795 -8.345 339 HA CYS 58 HA CYS 58 0.036 33.949 -5.545 340 HB2 CYS 58 HB2 CYS 58 -1.441 35.013 -7.215 341 HB3 CYS 58 HB1 CYS 58 -1.786 33.423 -7.887 342 H LYS 59 HN LYS 59 -0.572 32.363 -4.275 343 HA LYS 59 HA LYS 59 -0.395 29.638 -5.360 344 HB2 LYS 59 HB2 LYS 59 0.426 30.692 -2.658 345 HB3 LYS 59 HB1 LYS 59 0.434 28.994 -3.115 346 HG2 LYS 59 HG2 LYS 59 2.199 29.289 -4.621 347 HG3 LYS 59 HG1 LYS 59 1.988 31.042 -4.654 348 HD2 LYS 59 HD2 LYS 59 2.765 31.233 -2.404 349 HD3 LYS 59 HD1 LYS 59 2.833 29.477 -2.226 350 HE2 LYS 59 HE2 LYS 59 4.571 29.384 -3.950 351 HE3 LYS 59 HE1 LYS 59 4.488 31.138 -4.124 352 HZ1 LYS 59 HZ1 LYS 59 5.262 29.693 -1.649 353 HZ2 LYS 59 HZ2 LYS 59 5.217 31.371 -1.840 354 HZ3 LYS 59 HZ3 LYS 59 6.331 30.449 -2.718 355 H CYS 60 HN CYS 60 -2.564 31.832 -4.350 356 HA CYS 60 HA CYS 60 -4.057 30.063 -2.592 357 HB2 CYS 60 HB2 CYS 60 -4.973 32.713 -3.615 358 HB3 CYS 60 HB1 CYS 60 -5.452 31.901 -2.141 359 H GLY 61 HN GLY 61 -5.435 28.713 -3.394 360 HA2 GLY 61 HA2 GLY 61 -6.164 28.900 -6.236 361 HA3 GLY 61 HA1 GLY 61 -6.190 27.431 -5.272 362 H SER 62 HN SER 62 -7.799 30.458 -5.913 363 HA SER 62 HA SER 62 -9.933 31.173 -5.707 364 HB2 SER 62 HB2 SER 62 -10.567 28.220 -5.493 365 HB3 SER 62 HB1 SER 62 -11.744 29.498 -5.798 366 HG SER 62 HG SER 62 -9.498 29.333 -7.464 367 H SER 63 HN SER 63 -11.899 31.172 -4.200 368 HA SER 63 HA SER 63 -12.877 31.293 -2.169 369 HB2 SER 63 HB2 SER 63 -10.763 29.379 -1.184 370 HB3 SER 63 HB1 SER 63 -12.320 29.721 -0.430 371 HG SER 63 HG SER 63 -11.921 27.809 -2.018 372 H CYS 64 HN CYS 64 -9.453 31.996 -2.358 373 HA CYS 64 HA CYS 64 -9.245 33.064 0.280 374 HB2 CYS 64 HB2 CYS 64 -7.298 32.222 -1.022 375 HB3 CYS 64 HB1 CYS 64 -7.456 33.606 -2.096 376 H SER 65 HN SER 65 -8.538 35.380 0.631 377 HA SER 65 HA SER 65 -10.646 37.100 -0.065 378 HB2 SER 65 HB2 SER 65 -9.292 37.327 1.997 379 HB3 SER 65 HB1 SER 65 -7.907 37.813 1.022 380 HG SER 65 HG SER 65 -8.885 39.655 1.761 381 H CYS 66 HN CYS 66 -7.575 36.431 -1.576 382 HA CYS 66 HA CYS 66 -7.698 38.769 -3.276 383 HB2 CYS 66 HB2 CYS 66 -5.640 37.926 -4.254 384 HB3 CYS 66 HB1 CYS 66 -5.526 37.898 -2.500 385 H LYS 67 HN LYS 67 -9.562 36.207 -3.251 386 HA LYS 67 HA LYS 67 -9.445 35.734 -6.154 387 HB2 LYS 67 HB2 LYS 67 -10.641 34.030 -3.969 388 HB3 LYS 67 HB1 LYS 67 -10.730 33.670 -5.686 389 HG2 LYS 67 HG2 LYS 67 -8.138 33.939 -4.175 390 HG3 LYS 67 HG1 LYS 67 -8.974 32.407 -4.412 391 HD2 LYS 67 HD2 LYS 67 -7.785 32.234 -6.302 392 HD3 LYS 67 HD1 LYS 67 -8.868 33.463 -6.956 393 HE2 LYS 67 HE2 LYS 67 -6.678 34.239 -7.381 394 HE3 LYS 67 HE1 LYS 67 -7.275 35.165 -5.998 395 HZ1 LYS 67 HZ1 LYS 67 -5.583 32.753 -5.727 396 HZ2 LYS 67 HZ2 LYS 67 -5.945 33.921 -4.541 397 HZ3 LYS 67 HZ3 LYS 67 -4.952 34.313 -5.838 Start of MODEL 13 1 HA2 GLY 1 HA1 GLY 1 -9.649 6.330 -27.608 2 HA3 GLY 1 HA2 GLY 1 -10.137 4.819 -26.855 3 H SER 2 HN SER 2 -10.988 4.907 -24.678 4 HA SER 2 HA SER 2 -11.972 7.544 -23.868 5 HB2 SER 2 HB2 SER 2 -13.696 5.060 -24.046 6 HB3 SER 2 HB1 SER 2 -14.209 6.650 -23.482 7 HG SER 2 HG SER 2 -13.440 5.870 -26.088 8 H GLY 3 HN GLY 3 -11.229 7.865 -21.883 9 HA2 GLY 3 HA2 GLY 3 -10.987 5.563 -20.070 10 HA3 GLY 3 HA1 GLY 3 -10.121 7.087 -19.903 11 H LYS 4 HN LYS 4 -11.411 9.001 -19.416 12 HA LYS 4 HA LYS 4 -14.097 8.704 -18.510 13 HB2 LYS 4 HB2 LYS 4 -13.707 9.277 -16.152 14 HB3 LYS 4 HB1 LYS 4 -12.986 7.731 -16.565 15 HG2 LYS 4 HG2 LYS 4 -10.786 8.761 -16.664 16 HG3 LYS 4 HG1 LYS 4 -11.496 10.340 -16.320 17 HD2 LYS 4 HD2 LYS 4 -12.321 9.471 -14.162 18 HD3 LYS 4 HD1 LYS 4 -11.541 7.928 -14.504 19 HE2 LYS 4 HE2 LYS 4 -10.118 10.579 -14.281 20 HE3 LYS 4 HE1 LYS 4 -10.221 9.379 -12.995 21 HZ1 LYS 4 HZ1 LYS 4 -8.133 9.241 -14.203 22 HZ2 LYS 4 HZ2 LYS 4 -8.951 8.944 -15.650 23 HZ3 LYS 4 HZ3 LYS 4 -9.027 7.820 -14.392 24 H GLY 5 HN GLY 5 -15.032 10.743 -17.907 25 HA2 GLY 5 HA2 GLY 5 -13.355 13.088 -18.364 26 HA3 GLY 5 HA1 GLY 5 -14.717 12.835 -19.447 27 H LYS 6 HN LYS 6 -14.613 15.113 -18.015 28 HA LYS 6 HA LYS 6 -16.727 14.719 -16.007 29 HB2 LYS 6 HB2 LYS 6 -14.524 16.799 -15.926 30 HB3 LYS 6 HB1 LYS 6 -15.821 16.628 -14.754 31 HG2 LYS 6 HG2 LYS 6 -13.671 14.587 -15.289 32 HG3 LYS 6 HG1 LYS 6 -13.697 15.720 -13.938 33 HD2 LYS 6 HD2 LYS 6 -15.748 14.713 -13.107 34 HD3 LYS 6 HD1 LYS 6 -15.795 13.621 -14.492 35 HE2 LYS 6 HE2 LYS 6 -14.925 12.456 -12.562 36 HE3 LYS 6 HE1 LYS 6 -13.657 12.645 -13.769 37 HZ1 LYS 6 HZ1 LYS 6 -14.003 14.347 -11.356 38 HZ2 LYS 6 HZ2 LYS 6 -12.766 14.498 -12.498 39 HZ3 LYS 6 HZ3 LYS 6 -12.861 13.112 -11.533 40 H GLY 7 HN GLY 7 -17.736 17.058 -15.597 41 HA2 GLY 7 HA2 GLY 7 -18.439 18.047 -18.272 42 HA3 GLY 7 HA1 GLY 7 -19.448 18.183 -16.839 43 H GLU 8 HN GLU 8 -19.366 20.459 -17.908 44 HA GLU 8 HA GLU 8 -17.013 21.946 -17.172 45 HB2 GLU 8 HB2 GLU 8 -19.646 22.855 -18.331 46 HB3 GLU 8 HB1 GLU 8 -18.265 23.908 -18.046 47 HG2 GLU 8 HG2 GLU 8 -16.929 22.518 -19.578 48 HG3 GLU 8 HG1 GLU 8 -18.360 21.545 -19.906 49 H LYS 9 HN LYS 9 -16.650 22.685 -15.247 50 HA LYS 9 HA LYS 9 -18.595 22.522 -13.160 51 HB2 LYS 9 HB2 LYS 9 -15.865 23.812 -13.126 52 HB3 LYS 9 HB1 LYS 9 -16.824 23.373 -11.722 53 HG2 LYS 9 HG2 LYS 9 -15.695 21.443 -13.734 54 HG3 LYS 9 HG1 LYS 9 -15.010 21.794 -12.147 55 HD2 LYS 9 HD2 LYS 9 -17.122 21.016 -11.115 56 HD3 LYS 9 HD1 LYS 9 -17.707 20.571 -12.721 57 HE2 LYS 9 HE2 LYS 9 -15.809 19.047 -12.976 58 HE3 LYS 9 HE1 LYS 9 -15.250 19.495 -11.364 59 HZ1 LYS 9 HZ1 LYS 9 -16.478 17.407 -11.352 60 HZ2 LYS 9 HZ2 LYS 9 -17.844 18.181 -11.975 61 HZ3 LYS 9 HZ3 LYS 9 -17.273 18.585 -10.438 62 H CYS 10 HN CYS 10 -17.871 24.870 -15.444 63 HA CYS 10 HA CYS 10 -18.496 27.078 -13.713 64 HB2 CYS 10 HB2 CYS 10 -17.862 27.076 -16.650 65 HB3 CYS 10 HB1 CYS 10 -17.950 28.489 -15.599 66 H THR 11 HN THR 11 -20.176 28.462 -13.917 67 HA THR 11 HA THR 11 -22.624 27.234 -14.704 68 HB THR 11 HB THR 11 -23.610 29.390 -13.867 69 HG1 THR 11 HG1 THR 11 -22.027 30.735 -12.710 70 HG21 THR 11 HG21 THR 11 -23.294 27.482 -12.359 71 HG22 THR 11 HG22 THR 11 -23.008 29.002 -11.511 72 HG23 THR 11 HG23 THR 11 -21.645 28.011 -12.028 73 H SER 12 HN SER 12 -24.257 28.798 -15.827 74 HA SER 12 HA SER 12 -23.418 29.180 -18.477 75 HB2 SER 12 HB2 SER 12 -25.801 30.455 -17.112 76 HB3 SER 12 HB1 SER 12 -25.608 30.135 -18.836 77 HG SER 12 HG SER 12 -25.337 27.834 -18.057 78 H ALA 13 HN ALA 13 -23.555 31.298 -15.697 79 HA ALA 13 HA ALA 13 -23.259 33.780 -16.952 80 HB1 ALA 13 HB1 ALA 13 -23.908 33.545 -14.620 81 HB2 ALA 13 HB2 ALA 13 -22.470 34.556 -14.756 82 HB3 ALA 13 HB3 ALA 13 -22.323 32.880 -14.232 83 H CYS 14 HN CYS 14 -20.800 31.643 -15.538 84 HA CYS 14 HA CYS 14 -18.588 33.242 -16.281 85 HB2 CYS 14 HB2 CYS 14 -18.541 31.562 -14.491 86 HB3 CYS 14 HB1 CYS 14 -18.714 30.290 -15.684 87 H ARG 15 HN ARG 15 -20.430 30.827 -17.889 88 HA ARG 15 HA ARG 15 -18.508 30.272 -19.951 89 HB2 ARG 15 HB2 ARG 15 -20.423 28.791 -18.976 90 HB3 ARG 15 HB1 ARG 15 -21.424 29.629 -20.147 91 HG2 ARG 15 HG2 ARG 15 -20.018 28.825 -21.955 92 HG3 ARG 15 HG1 ARG 15 -18.963 28.019 -20.789 93 HD2 ARG 15 HD2 ARG 15 -21.861 27.409 -21.359 94 HD3 ARG 15 HD1 ARG 15 -20.468 26.387 -21.708 95 HE ARG 15 HE ARG 15 -20.626 26.974 -18.933 96 HH11 ARG 15 HH11 ARG 15 -22.062 24.966 -21.417 97 HH12 ARG 15 HH12 ARG 15 -22.579 23.743 -20.315 98 HH21 ARG 15 HH21 ARG 15 -21.338 25.340 -17.441 99 HH22 ARG 15 HH22 ARG 15 -22.176 23.957 -18.058 100 H SER 16 HN SER 16 -20.449 32.904 -19.389 101 HA SER 16 HA SER 16 -21.321 33.353 -22.115 102 HB2 SER 16 HB2 SER 16 -21.521 35.138 -19.684 103 HB3 SER 16 HB1 SER 16 -22.311 35.415 -21.235 104 HG SER 16 HG SER 16 -22.705 33.092 -19.648 105 H GLU 17 HN GLU 17 -20.903 35.505 -23.112 106 HA GLU 17 HA GLU 17 -18.196 36.515 -22.564 107 HB2 GLU 17 HB2 GLU 17 -19.481 36.018 -25.255 108 HB3 GLU 17 HB1 GLU 17 -18.000 36.929 -25.029 109 HG2 GLU 17 HG2 GLU 17 -18.394 34.037 -24.310 110 HG3 GLU 17 HG1 GLU 17 -17.586 34.635 -25.757 111 HA PRO 18 HA PRO 18 -17.348 38.070 -21.801 112 HB2 PRO 18 HB2 PRO 18 -17.515 39.898 -19.845 113 HB3 PRO 18 HB1 PRO 18 -17.038 40.342 -21.489 114 HG2 PRO 18 HG2 PRO 18 -19.707 40.610 -20.160 115 HG3 PRO 18 HG1 PRO 18 -18.837 41.781 -21.167 116 HD2 PRO 18 HD2 PRO 18 -20.839 40.202 -22.122 117 HD3 PRO 18 HD1 PRO 18 -19.494 40.773 -23.128 118 H CYS 19 HN CYS 19 -16.866 37.449 -19.550 119 HA CYS 19 HA CYS 19 -18.670 35.566 -18.568 120 HB2 CYS 19 HB2 CYS 19 -16.286 35.381 -18.193 121 HB3 CYS 19 HB1 CYS 19 -16.292 36.862 -17.242 122 H GLN 20 HN GLN 20 -20.082 35.550 -16.884 123 HA GLN 20 HA GLN 20 -20.785 38.182 -15.750 124 HB2 GLN 20 HB2 GLN 20 -22.609 35.848 -16.305 125 HB3 GLN 20 HB1 GLN 20 -23.085 37.441 -15.736 126 HG2 GLN 20 HG2 GLN 20 -21.753 36.920 -18.370 127 HG3 GLN 20 HG1 GLN 20 -23.492 37.022 -18.131 128 HE21 GLN 20 HE21 GLN 20 -21.614 38.668 -19.700 129 HE22 GLN 20 HE22 GLN 20 -21.870 40.296 -19.158 130 H CYS 21 HN CYS 21 -19.041 35.860 -14.749 131 HA CYS 21 HA CYS 21 -20.427 34.672 -12.569 132 HB2 CYS 21 HB2 CYS 21 -17.845 34.464 -13.708 133 HB3 CYS 21 HB1 CYS 21 -17.624 34.930 -12.025 134 H GLY 22 HN GLY 22 -18.667 37.653 -13.011 135 HA2 GLY 22 HA2 GLY 22 -18.665 39.574 -11.771 136 HA3 GLY 22 HA1 GLY 22 -19.838 38.821 -10.702 137 H SER 23 HN SER 23 -18.495 40.077 -9.132 138 HA SER 23 HA SER 23 -15.913 38.988 -8.509 139 HB2 SER 23 HB2 SER 23 -16.160 40.523 -6.477 140 HB3 SER 23 HB1 SER 23 -16.145 41.299 -8.061 141 HG SER 23 HG SER 23 -18.430 40.680 -6.483 142 H LYS 24 HN LYS 24 -19.099 38.081 -7.896 143 HA LYS 24 HA LYS 24 -18.663 36.914 -5.297 144 HB2 LYS 24 HB2 LYS 24 -20.865 36.468 -7.323 145 HB3 LYS 24 HB1 LYS 24 -20.853 35.796 -5.703 146 HG2 LYS 24 HG2 LYS 24 -20.855 38.101 -4.794 147 HG3 LYS 24 HG1 LYS 24 -20.997 38.710 -6.443 148 HD2 LYS 24 HD2 LYS 24 -22.965 36.912 -5.022 149 HD3 LYS 24 HD1 LYS 24 -23.187 38.626 -5.366 150 HE2 LYS 24 HE2 LYS 24 -23.111 38.154 -7.769 151 HE3 LYS 24 HE1 LYS 24 -22.873 36.442 -7.431 152 HZ1 LYS 24 HZ1 LYS 24 -25.038 36.400 -6.343 153 HZ2 LYS 24 HZ2 LYS 24 -25.174 36.920 -7.946 154 HZ3 LYS 24 HZ3 LYS 24 -25.258 38.042 -6.690 155 H CYS 25 HN CYS 25 -18.809 35.894 -8.634 156 HA CYS 25 HA CYS 25 -17.994 34.157 -9.769 157 HB2 CYS 25 HB2 CYS 25 -15.944 34.769 -8.404 158 HB3 CYS 25 HB1 CYS 25 -16.368 33.423 -7.350 159 H GLN 26 HN GLN 26 -19.650 32.888 -10.094 160 HA GLN 26 HA GLN 26 -20.607 31.106 -7.964 161 HB2 GLN 26 HB2 GLN 26 -21.859 31.896 -10.594 162 HB3 GLN 26 HB1 GLN 26 -22.601 30.846 -9.394 163 HG2 GLN 26 HG2 GLN 26 -22.845 32.598 -7.855 164 HG3 GLN 26 HG1 GLN 26 -21.747 33.646 -8.750 165 HE21 GLN 26 HE21 GLN 26 -24.506 34.066 -7.873 166 HE22 GLN 26 HE22 GLN 26 -25.400 34.447 -9.306 167 H CYS 27 HN CYS 27 -18.444 30.872 -10.435 168 HA CYS 27 HA CYS 27 -19.356 28.311 -11.495 169 HB2 CYS 27 HB2 CYS 27 -17.730 28.580 -13.156 170 HB3 CYS 27 HB1 CYS 27 -18.268 30.222 -12.838 171 H GLY 28 HN GLY 28 -17.852 26.484 -11.604 172 HA2 GLY 28 HA2 GLY 28 -16.305 26.140 -9.174 173 HA3 GLY 28 HA1 GLY 28 -16.597 24.919 -10.415 174 H GLU 29 HN GLU 29 -14.014 25.707 -9.216 175 HA GLU 29 HA GLU 29 -12.774 27.410 -11.149 176 HB2 GLU 29 HB2 GLU 29 -12.169 27.263 -8.669 177 HB3 GLU 29 HB1 GLU 29 -11.265 25.819 -9.113 178 HG2 GLU 29 HG2 GLU 29 -10.080 27.221 -10.826 179 HG3 GLU 29 HG1 GLU 29 -10.838 28.626 -10.082 180 H GLY 30 HN GLY 30 -13.005 26.366 -13.039 181 HA2 GLY 30 HA2 GLY 30 -10.809 24.571 -13.625 182 HA3 GLY 30 HA1 GLY 30 -12.417 23.907 -13.912 183 H CYS 31 HN CYS 31 -11.828 27.278 -14.207 184 HA CYS 31 HA CYS 31 -12.290 27.066 -17.123 185 HB2 CYS 31 HB2 CYS 31 -13.307 29.286 -16.899 186 HB3 CYS 31 HB1 CYS 31 -14.110 28.083 -15.888 187 H THR 32 HN THR 32 -10.314 28.434 -14.610 188 HA THR 32 HA THR 32 -8.675 29.974 -14.502 189 HB THR 32 HB THR 32 -6.949 29.962 -16.327 190 HG1 THR 32 HG1 THR 32 -8.962 28.933 -17.776 191 HG21 THR 32 HG21 THR 32 -6.267 27.627 -16.022 192 HG22 THR 32 HG22 THR 32 -7.878 27.247 -15.412 193 HG23 THR 32 HG23 THR 32 -6.832 28.345 -14.514 194 H CYS 33 HN CYS 33 -11.247 30.799 -15.407 195 HA CYS 33 HA CYS 33 -11.287 32.543 -17.570 196 HB2 CYS 33 HB2 CYS 33 -13.174 31.614 -15.965 197 HB3 CYS 33 HB1 CYS 33 -12.885 33.117 -15.102 198 H ALA 34 HN ALA 34 -10.880 34.698 -17.795 199 HA ALA 34 HA ALA 34 -9.012 35.806 -15.840 200 HB1 ALA 34 HB1 ALA 34 -8.384 37.359 -17.609 201 HB2 ALA 34 HB2 ALA 34 -9.673 36.730 -18.635 202 HB3 ALA 34 HB3 ALA 34 -8.317 35.695 -18.186 203 H ALA 35 HN ALA 35 -12.052 35.774 -15.690 204 HA ALA 35 HA ALA 35 -12.415 38.671 -15.407 205 HB1 ALA 35 HB1 ALA 35 -13.816 37.742 -17.191 206 HB2 ALA 35 HB2 ALA 35 -14.786 38.354 -15.851 207 HB3 ALA 35 HB3 ALA 35 -14.528 36.620 -16.031 208 H CYS 36 HN CYS 36 -13.699 35.593 -14.216 209 HA CYS 36 HA CYS 36 -14.291 36.884 -11.707 210 HB2 CYS 36 HB2 CYS 36 -15.198 34.600 -11.130 211 HB3 CYS 36 HB1 CYS 36 -15.970 35.479 -12.449 212 H LYS 37 HN LYS 37 -12.198 34.279 -12.961 213 HA LYS 37 HA LYS 37 -10.979 34.037 -10.362 214 HB2 LYS 37 HB2 LYS 37 -11.230 31.985 -11.803 215 HB3 LYS 37 HB1 LYS 37 -10.031 32.668 -12.899 216 HG2 LYS 37 HG2 LYS 37 -8.416 32.732 -11.018 217 HG3 LYS 37 HG1 LYS 37 -9.613 31.935 -10.007 218 HD2 LYS 37 HD2 LYS 37 -9.507 29.952 -11.366 219 HD3 LYS 37 HD1 LYS 37 -8.456 30.764 -12.535 220 HE2 LYS 37 HE2 LYS 37 -6.707 30.994 -10.879 221 HE3 LYS 37 HE1 LYS 37 -7.757 30.347 -9.626 222 HZ1 LYS 37 HZ1 LYS 37 -6.084 28.781 -10.518 223 HZ2 LYS 37 HZ2 LYS 37 -6.889 28.779 -12.000 224 HZ3 LYS 37 HZ3 LYS 37 -7.664 28.204 -10.598 225 H THR 38 HN THR 38 -10.419 36.242 -10.297 226 HA THR 38 HA THR 38 -7.874 36.774 -11.642 227 HB THR 38 HB THR 38 -9.616 38.184 -12.635 228 HG1 THR 38 HG1 THR 38 -7.394 39.021 -11.839 229 HG21 THR 38 HG21 THR 38 -10.101 39.182 -9.821 230 HG22 THR 38 HG22 THR 38 -11.214 38.215 -10.788 231 HG23 THR 38 HG23 THR 38 -10.813 39.860 -11.285 232 H CYS 39 HN CYS 39 -6.330 37.902 -10.409 233 HA CYS 39 HA CYS 39 -6.821 37.784 -7.531 234 HB2 CYS 39 HB2 CYS 39 -4.852 36.560 -8.341 235 HB3 CYS 39 HB1 CYS 39 -4.219 38.042 -9.048 236 H ASN 40 HN ASN 40 -6.988 39.560 -6.359 237 HA ASN 40 HA ASN 40 -6.809 42.112 -7.769 238 HB2 ASN 40 HB2 ASN 40 -8.062 41.280 -5.167 239 HB3 ASN 40 HB1 ASN 40 -7.825 42.980 -5.556 240 HD21 ASN 40 HD21 ASN 40 -9.484 40.041 -6.461 241 HD22 ASN 40 HD22 ASN 40 -10.700 40.802 -7.424 242 H CYS 41 HN CYS 41 -4.712 40.279 -6.081 243 HA CYS 41 HA CYS 41 -3.515 42.279 -4.432 244 HB2 CYS 41 HB2 CYS 41 -2.400 39.648 -5.394 245 HB3 CYS 41 HB1 CYS 41 -1.755 40.638 -4.088 246 H THR 42 HN THR 42 -1.827 43.589 -4.862 247 HA THR 42 HA THR 42 -1.022 43.732 -7.669 248 HB THR 42 HB THR 42 -0.360 46.045 -7.179 249 HG1 THR 42 HG1 THR 42 -1.108 46.790 -4.968 250 HG21 THR 42 HG21 THR 42 -3.127 45.400 -6.140 251 HG22 THR 42 HG22 THR 42 -2.691 45.643 -7.831 252 HG23 THR 42 HG23 THR 42 -2.585 46.983 -6.692 253 H SER 43 HN SER 43 1.252 44.420 -8.038 254 HA SER 43 HA SER 43 3.073 42.752 -6.636 255 HB2 SER 43 HB2 SER 43 3.695 45.012 -8.549 256 HB3 SER 43 HB1 SER 43 4.746 43.658 -8.132 257 HG SER 43 HG SER 43 3.319 42.265 -9.151 258 H ASP 44 HN ASP 44 1.777 45.755 -5.942 259 HA ASP 44 HA ASP 44 4.096 46.785 -4.534 260 HB2 ASP 44 HB2 ASP 44 1.298 47.880 -4.855 261 HB3 ASP 44 HB1 ASP 44 2.592 48.697 -3.988 262 H GLY 45 HN GLY 45 1.034 45.229 -3.895 263 HA2 GLY 45 HA2 GLY 45 1.875 44.565 -1.247 264 HA3 GLY 45 HA1 GLY 45 0.582 45.756 -1.273 265 H CYS 46 HN CYS 46 0.961 42.734 -0.650 266 HA CYS 46 HA CYS 46 -0.892 41.434 -2.376 267 HB2 CYS 46 HB2 CYS 46 0.983 40.425 -0.877 268 HB3 CYS 46 HB1 CYS 46 -0.224 40.502 0.399 269 H LYS 47 HN LYS 47 -3.076 41.125 -2.098 270 HA LYS 47 HA LYS 47 -4.302 42.903 -0.133 271 HB2 LYS 47 HB2 LYS 47 -5.451 41.596 -2.597 272 HB3 LYS 47 HB1 LYS 47 -6.369 42.612 -1.496 273 HG2 LYS 47 HG2 LYS 47 -3.938 43.512 -3.029 274 HG3 LYS 47 HG1 LYS 47 -5.606 43.794 -3.530 275 HD2 LYS 47 HD2 LYS 47 -5.993 45.069 -1.477 276 HD3 LYS 47 HD1 LYS 47 -4.326 44.774 -0.978 277 HE2 LYS 47 HE2 LYS 47 -3.536 45.951 -2.981 278 HE3 LYS 47 HE1 LYS 47 -5.205 46.269 -3.445 279 HZ1 LYS 47 HZ1 LYS 47 -4.173 48.160 -2.336 280 HZ2 LYS 47 HZ2 LYS 47 -3.917 47.230 -0.948 281 HZ3 LYS 47 HZ3 LYS 47 -5.491 47.577 -1.454 282 H CYS 48 HN CYS 48 -3.932 39.548 -0.811 283 HA CYS 48 HA CYS 48 -6.095 38.915 1.056 284 HB2 CYS 48 HB2 CYS 48 -5.920 36.638 0.288 285 HB3 CYS 48 HB1 CYS 48 -5.964 37.699 -1.123 286 H GLY 49 HN GLY 49 -2.636 38.524 0.583 287 HA2 GLY 49 HA2 GLY 49 -1.227 38.762 2.547 288 HA3 GLY 49 HA1 GLY 49 -2.433 37.849 3.440 289 H LYS 50 HN LYS 50 -2.155 36.434 0.440 290 HA LYS 50 HA LYS 50 -0.608 34.237 1.519 291 HB2 LYS 50 HB2 LYS 50 -1.738 34.621 -1.262 292 HB3 LYS 50 HB1 LYS 50 -1.046 33.132 -0.638 293 HG2 LYS 50 HG2 LYS 50 -3.555 34.487 0.338 294 HG3 LYS 50 HG1 LYS 50 -3.462 33.021 -0.638 295 HD2 LYS 50 HD2 LYS 50 -2.248 31.916 1.211 296 HD3 LYS 50 HD1 LYS 50 -2.453 33.375 2.182 297 HE2 LYS 50 HE2 LYS 50 -4.638 31.606 1.091 298 HE3 LYS 50 HE1 LYS 50 -4.148 31.765 2.777 299 HZ1 LYS 50 HZ1 LYS 50 -5.408 33.864 1.094 300 HZ2 LYS 50 HZ2 LYS 50 -4.833 34.117 2.662 301 HZ3 LYS 50 HZ3 LYS 50 -6.114 33.050 2.399 302 H GLU 51 HN GLU 51 0.122 37.109 0.105 303 HA GLU 51 HA GLU 51 2.017 38.081 -0.628 304 HB2 GLU 51 HB2 GLU 51 3.075 36.589 1.145 305 HB3 GLU 51 HB1 GLU 51 3.459 35.463 -0.146 306 HG2 GLU 51 HG2 GLU 51 4.850 37.113 -1.223 307 HG3 GLU 51 HG1 GLU 51 4.389 38.321 -0.025 308 H CYS 52 HN CYS 52 0.205 36.366 -2.303 309 HA CYS 52 HA CYS 52 1.764 35.306 -4.432 310 HB2 CYS 52 HB2 CYS 52 -0.471 35.431 -5.649 311 HB3 CYS 52 HB1 CYS 52 -0.407 34.413 -4.211 312 H THR 53 HN THR 53 0.062 38.318 -3.854 313 HA THR 53 HA THR 53 0.076 40.353 -4.813 314 HB THR 53 HB THR 53 2.303 41.221 -5.593 315 HG1 THR 53 HG1 THR 53 2.866 38.612 -5.765 316 HG21 THR 53 HG21 THR 53 3.325 41.115 -3.362 317 HG22 THR 53 HG22 THR 53 2.239 39.791 -2.934 318 HG23 THR 53 HG23 THR 53 1.585 41.394 -3.266 319 H GLY 54 HN GLY 54 -0.786 38.170 -6.572 320 HA2 GLY 54 HA2 GLY 54 -1.546 39.390 -8.785 321 HA3 GLY 54 HA1 GLY 54 0.136 39.077 -9.176 322 HA PRO 55 HA PRO 55 -2.807 35.362 -9.968 323 HB2 PRO 55 HB2 PRO 55 -3.150 35.602 -12.641 324 HB3 PRO 55 HB1 PRO 55 -4.220 36.374 -11.466 325 HG2 PRO 55 HG2 PRO 55 -1.910 37.550 -12.977 326 HG3 PRO 55 HG1 PRO 55 -3.530 38.226 -12.726 327 HD2 PRO 55 HD2 PRO 55 -1.423 39.009 -11.251 328 HD3 PRO 55 HD1 PRO 55 -3.055 38.890 -10.561 329 H ASP 56 HN ASP 56 0.124 36.630 -11.159 330 HA ASP 56 HA ASP 56 0.862 34.288 -12.697 331 HB2 ASP 56 HB2 ASP 56 2.547 36.667 -11.883 332 HB3 ASP 56 HB1 ASP 56 3.001 35.431 -13.048 333 H SER 57 HN SER 57 0.839 35.130 -9.467 334 HA SER 57 HA SER 57 2.581 32.873 -8.841 335 HB2 SER 57 HB2 SER 57 2.843 35.602 -7.555 336 HB3 SER 57 HB1 SER 57 3.723 34.151 -7.073 337 HG SER 57 HG SER 57 3.940 34.634 -9.734 338 H CYS 58 HN CYS 58 -0.308 33.422 -8.859 339 HA CYS 58 HA CYS 58 -1.193 33.810 -6.187 340 HB2 CYS 58 HB2 CYS 58 -2.400 34.019 -8.575 341 HB3 CYS 58 HB1 CYS 58 -2.952 32.415 -8.113 342 H LYS 59 HN LYS 59 -1.239 32.435 -4.591 343 HA LYS 59 HA LYS 59 -0.707 29.589 -5.100 344 HB2 LYS 59 HB2 LYS 59 -0.729 30.939 -2.407 345 HB3 LYS 59 HB1 LYS 59 0.110 29.474 -2.885 346 HG2 LYS 59 HG2 LYS 59 0.830 32.206 -3.920 347 HG3 LYS 59 HG1 LYS 59 1.556 31.485 -2.488 348 HD2 LYS 59 HD2 LYS 59 2.349 29.604 -3.863 349 HD3 LYS 59 HD1 LYS 59 1.643 30.368 -5.291 350 HE2 LYS 59 HE2 LYS 59 3.104 32.285 -5.029 351 HE3 LYS 59 HE1 LYS 59 3.754 31.619 -3.534 352 HZ1 LYS 59 HZ1 LYS 59 4.044 30.415 -6.233 353 HZ2 LYS 59 HZ2 LYS 59 4.664 29.771 -4.805 354 HZ3 LYS 59 HZ3 LYS 59 5.244 31.248 -5.385 355 H CYS 60 HN CYS 60 -3.323 31.437 -4.911 356 HA CYS 60 HA CYS 60 -4.923 29.489 -3.417 357 HB2 CYS 60 HB2 CYS 60 -6.152 31.669 -2.624 358 HB3 CYS 60 HB1 CYS 60 -4.706 31.102 -1.785 359 H GLY 61 HN GLY 61 -7.229 29.589 -3.966 360 HA2 GLY 61 HA2 GLY 61 -7.884 31.127 -6.349 361 HA3 GLY 61 HA1 GLY 61 -7.892 29.382 -6.518 362 H SER 62 HN SER 62 -10.095 30.634 -7.106 363 HA SER 62 HA SER 62 -12.286 30.642 -6.866 364 HB2 SER 62 HB2 SER 62 -11.778 28.666 -4.643 365 HB3 SER 62 HB1 SER 62 -13.349 28.984 -5.375 366 HG SER 62 HG SER 62 -11.096 28.199 -6.912 367 H SER 63 HN SER 63 -11.748 30.254 -3.379 368 HA SER 63 HA SER 63 -13.167 32.809 -3.111 369 HB2 SER 63 HB2 SER 63 -13.344 30.449 -1.239 370 HB3 SER 63 HB1 SER 63 -14.285 31.938 -1.159 371 HG SER 63 HG SER 63 -15.026 31.325 -3.353 372 H CYS 64 HN CYS 64 -10.715 33.464 -3.159 373 HA CYS 64 HA CYS 64 -9.876 33.561 -0.345 374 HB2 CYS 64 HB2 CYS 64 -8.200 32.594 -1.930 375 HB3 CYS 64 HB1 CYS 64 -8.167 34.133 -2.776 376 H SER 65 HN SER 65 -8.761 35.666 0.210 377 HA SER 65 HA SER 65 -10.614 37.759 -0.087 378 HB2 SER 65 HB2 SER 65 -7.766 37.992 0.857 379 HB3 SER 65 HB1 SER 65 -9.127 39.025 1.294 380 HG SER 65 HG SER 65 -10.002 36.769 1.993 381 H CYS 66 HN CYS 66 -8.177 36.749 -2.214 382 HA CYS 66 HA CYS 66 -7.978 39.409 -3.434 383 HB2 CYS 66 HB2 CYS 66 -6.128 38.455 -4.770 384 HB3 CYS 66 HB1 CYS 66 -5.824 38.397 -3.039 385 H LYS 67 HN LYS 67 -9.681 36.561 -3.707 386 HA LYS 67 HA LYS 67 -9.908 36.622 -6.605 387 HB2 LYS 67 HB2 LYS 67 -11.309 34.877 -4.569 388 HB3 LYS 67 HB1 LYS 67 -11.410 34.688 -6.308 389 HG2 LYS 67 HG2 LYS 67 -8.841 34.446 -4.748 390 HG3 LYS 67 HG1 LYS 67 -9.894 33.075 -5.153 391 HD2 LYS 67 HD2 LYS 67 -8.745 32.895 -7.050 392 HD3 LYS 67 HD1 LYS 67 -9.477 34.409 -7.562 393 HE2 LYS 67 HE2 LYS 67 -7.039 34.475 -7.773 394 HE3 LYS 67 HE1 LYS 67 -7.613 35.652 -6.591 395 HZ1 LYS 67 HZ1 LYS 67 -6.914 34.185 -4.818 396 HZ2 LYS 67 HZ2 LYS 67 -5.623 34.440 -5.865 397 HZ3 LYS 67 HZ3 LYS 67 -6.461 32.982 -5.923 Start of MODEL 14 1 HA2 GLY 1 HA1 GLY 1 -5.932 30.103 -17.773 2 HA3 GLY 1 HA2 GLY 1 -4.672 31.244 -17.328 3 H SER 2 HN SER 2 -5.648 30.087 -20.531 4 HA SER 2 HA SER 2 -6.214 32.883 -21.247 5 HB2 SER 2 HB2 SER 2 -4.226 31.891 -22.373 6 HB3 SER 2 HB1 SER 2 -5.265 30.651 -23.068 7 HG SER 2 HG SER 2 -6.018 32.041 -24.462 8 H GLY 3 HN GLY 3 -7.730 30.083 -20.526 9 HA2 GLY 3 HA2 GLY 3 -10.213 30.288 -20.783 10 HA3 GLY 3 HA1 GLY 3 -9.883 30.549 -22.488 11 H LYS 4 HN LYS 4 -11.322 28.401 -20.849 12 HA LYS 4 HA LYS 4 -9.806 26.055 -21.722 13 HB2 LYS 4 HB2 LYS 4 -12.016 26.456 -19.738 14 HB3 LYS 4 HB1 LYS 4 -11.763 24.869 -20.442 15 HG2 LYS 4 HG2 LYS 4 -10.648 24.983 -18.327 16 HG3 LYS 4 HG1 LYS 4 -9.437 24.913 -19.605 17 HD2 LYS 4 HD2 LYS 4 -9.135 27.336 -19.440 18 HD3 LYS 4 HD1 LYS 4 -10.349 27.396 -18.160 19 HE2 LYS 4 HE2 LYS 4 -8.973 26.004 -16.744 20 HE3 LYS 4 HE1 LYS 4 -7.781 25.826 -18.029 21 HZ1 LYS 4 HZ1 LYS 4 -7.418 28.226 -17.932 22 HZ2 LYS 4 HZ2 LYS 4 -7.074 27.478 -16.459 23 HZ3 LYS 4 HZ3 LYS 4 -8.511 28.344 -16.644 24 H GLY 5 HN GLY 5 -10.514 24.663 -23.219 25 HA2 GLY 5 HA2 GLY 5 -12.861 25.414 -24.779 26 HA3 GLY 5 HA1 GLY 5 -11.664 24.191 -25.208 27 H LYS 6 HN LYS 6 -11.752 23.092 -22.496 28 HA LYS 6 HA LYS 6 -13.915 21.246 -22.866 29 HB2 LYS 6 HB2 LYS 6 -11.837 21.546 -20.699 30 HB3 LYS 6 HB1 LYS 6 -13.034 20.260 -20.734 31 HG2 LYS 6 HG2 LYS 6 -10.981 20.752 -22.880 32 HG3 LYS 6 HG1 LYS 6 -10.825 19.569 -21.578 33 HD2 LYS 6 HD2 LYS 6 -12.878 18.472 -22.370 34 HD3 LYS 6 HD1 LYS 6 -12.964 19.625 -23.701 35 HE2 LYS 6 HE2 LYS 6 -10.817 18.841 -24.533 36 HE3 LYS 6 HE1 LYS 6 -10.698 17.709 -23.185 37 HZ1 LYS 6 HZ1 LYS 6 -12.709 16.622 -23.996 38 HZ2 LYS 6 HZ2 LYS 6 -11.480 16.595 -25.158 39 HZ3 LYS 6 HZ3 LYS 6 -12.762 17.683 -25.311 40 H GLY 7 HN GLY 7 -15.838 21.307 -21.941 41 HA2 GLY 7 HA2 GLY 7 -16.529 23.552 -20.272 42 HA3 GLY 7 HA1 GLY 7 -17.623 22.312 -20.875 43 H GLU 8 HN GLU 8 -15.293 23.122 -18.413 44 HA GLU 8 HA GLU 8 -15.459 20.733 -16.942 45 HB2 GLU 8 HB2 GLU 8 -14.712 23.532 -16.099 46 HB3 GLU 8 HB1 GLU 8 -14.545 22.120 -15.067 47 HG2 GLU 8 HG2 GLU 8 -13.175 22.517 -17.716 48 HG3 GLU 8 HG1 GLU 8 -12.436 22.752 -16.132 49 H LYS 9 HN LYS 9 -16.444 23.721 -15.411 50 HA LYS 9 HA LYS 9 -19.192 22.888 -15.112 51 HB2 LYS 9 HB2 LYS 9 -17.289 22.968 -12.795 52 HB3 LYS 9 HB1 LYS 9 -19.020 23.164 -12.570 53 HG2 LYS 9 HG2 LYS 9 -19.219 20.909 -13.803 54 HG3 LYS 9 HG1 LYS 9 -17.497 20.739 -13.462 55 HD2 LYS 9 HD2 LYS 9 -19.670 21.187 -11.417 56 HD3 LYS 9 HD1 LYS 9 -18.873 19.652 -11.754 57 HE2 LYS 9 HE2 LYS 9 -16.790 20.465 -10.960 58 HE3 LYS 9 HE1 LYS 9 -17.394 22.120 -10.871 59 HZ1 LYS 9 HZ1 LYS 9 -18.320 19.844 -9.209 60 HZ2 LYS 9 HZ2 LYS 9 -18.909 21.425 -9.130 61 HZ3 LYS 9 HZ3 LYS 9 -17.311 21.098 -8.694 62 H CYS 10 HN CYS 10 -18.360 24.995 -16.438 63 HA CYS 10 HA CYS 10 -18.617 27.277 -14.641 64 HB2 CYS 10 HB2 CYS 10 -17.839 27.138 -17.560 65 HB3 CYS 10 HB1 CYS 10 -18.017 28.634 -16.653 66 H THR 11 HN THR 11 -20.397 28.495 -14.555 67 HA THR 11 HA THR 11 -22.766 27.398 -15.712 68 HB THR 11 HB THR 11 -23.909 29.253 -14.502 69 HG1 THR 11 HG1 THR 11 -22.716 30.689 -13.333 70 HG21 THR 11 HG21 THR 11 -23.499 27.097 -13.407 71 HG22 THR 11 HG22 THR 11 -23.392 28.425 -12.254 72 HG23 THR 11 HG23 THR 11 -21.921 27.669 -12.867 73 H SER 12 HN SER 12 -24.438 29.154 -16.466 74 HA SER 12 HA SER 12 -23.736 29.946 -19.014 75 HB2 SER 12 HB2 SER 12 -25.942 31.076 -17.292 76 HB3 SER 12 HB1 SER 12 -25.875 31.069 -19.056 77 HG SER 12 HG SER 12 -26.864 29.228 -18.873 78 H ALA 13 HN ALA 13 -23.563 31.657 -15.980 79 HA ALA 13 HA ALA 13 -23.223 34.269 -16.995 80 HB1 ALA 13 HB1 ALA 13 -22.297 33.111 -14.368 81 HB2 ALA 13 HB2 ALA 13 -23.879 33.824 -14.683 82 HB3 ALA 13 HB3 ALA 13 -22.430 34.826 -14.755 83 H CYS 14 HN CYS 14 -20.907 31.766 -16.036 84 HA CYS 14 HA CYS 14 -18.612 33.387 -16.437 85 HB2 CYS 14 HB2 CYS 14 -18.702 31.378 -14.970 86 HB3 CYS 14 HB1 CYS 14 -18.797 30.378 -16.409 87 H ARG 15 HN ARG 15 -20.424 31.183 -18.483 88 HA ARG 15 HA ARG 15 -18.454 31.244 -20.575 89 HB2 ARG 15 HB2 ARG 15 -19.968 29.929 -21.880 90 HB3 ARG 15 HB1 ARG 15 -20.003 29.328 -20.230 91 HG2 ARG 15 HG2 ARG 15 -22.093 30.343 -19.816 92 HG3 ARG 15 HG1 ARG 15 -22.043 31.225 -21.343 93 HD2 ARG 15 HD2 ARG 15 -22.166 28.224 -21.051 94 HD3 ARG 15 HD1 ARG 15 -23.527 29.265 -21.456 95 HE ARG 15 HE ARG 15 -22.507 29.727 -23.554 96 HH11 ARG 15 HH11 ARG 15 -20.866 27.222 -21.705 97 HH12 ARG 15 HH12 ARG 15 -20.071 26.547 -23.082 98 HH21 ARG 15 HH21 ARG 15 -21.453 28.806 -25.390 99 HH22 ARG 15 HH22 ARG 15 -20.413 27.440 -25.181 100 H SER 16 HN SER 16 -20.637 33.502 -19.524 101 HA SER 16 HA SER 16 -21.414 34.538 -22.092 102 HB2 SER 16 HB2 SER 16 -21.635 35.725 -19.320 103 HB3 SER 16 HB1 SER 16 -22.340 36.424 -20.777 104 HG SER 16 HG SER 16 -22.909 33.777 -19.958 105 H GLU 17 HN GLU 17 -20.740 36.567 -22.924 106 HA GLU 17 HA GLU 17 -18.146 37.480 -21.899 107 HB2 GLU 17 HB2 GLU 17 -18.975 37.136 -24.779 108 HB3 GLU 17 HB1 GLU 17 -17.500 37.931 -24.253 109 HG2 GLU 17 HG2 GLU 17 -16.725 35.859 -23.242 110 HG3 GLU 17 HG1 GLU 17 -18.219 35.057 -23.728 111 HA PRO 18 HA PRO 18 -17.045 39.112 -21.357 112 HB2 PRO 18 HB2 PRO 18 -17.304 40.853 -19.290 113 HB3 PRO 18 HB1 PRO 18 -16.710 41.345 -20.881 114 HG2 PRO 18 HG2 PRO 18 -19.460 41.600 -19.727 115 HG3 PRO 18 HG1 PRO 18 -18.514 42.801 -20.627 116 HD2 PRO 18 HD2 PRO 18 -20.455 41.345 -21.797 117 HD3 PRO 18 HD1 PRO 18 -18.985 41.823 -22.672 118 H CYS 19 HN CYS 19 -16.556 38.190 -19.285 119 HA CYS 19 HA CYS 19 -18.291 36.223 -18.445 120 HB2 CYS 19 HB2 CYS 19 -15.690 36.870 -17.941 121 HB3 CYS 19 HB1 CYS 19 -16.431 37.188 -16.378 122 H GLN 20 HN GLN 20 -19.940 36.093 -17.055 123 HA GLN 20 HA GLN 20 -20.733 38.571 -15.677 124 HB2 GLN 20 HB2 GLN 20 -22.381 36.186 -16.491 125 HB3 GLN 20 HB1 GLN 20 -22.998 37.609 -15.667 126 HG2 GLN 20 HG2 GLN 20 -21.665 37.681 -18.354 127 HG3 GLN 20 HG1 GLN 20 -23.401 37.522 -18.116 128 HE21 GLN 20 HE21 GLN 20 -20.658 39.628 -17.866 129 HE22 GLN 20 HE22 GLN 20 -21.544 41.097 -17.645 130 H CYS 21 HN CYS 21 -19.052 35.999 -14.878 131 HA CYS 21 HA CYS 21 -20.407 34.821 -12.709 132 HB2 CYS 21 HB2 CYS 21 -17.775 34.744 -13.848 133 HB3 CYS 21 HB1 CYS 21 -17.664 34.840 -12.095 134 H GLY 22 HN GLY 22 -18.403 37.699 -12.964 135 HA2 GLY 22 HA2 GLY 22 -18.137 39.497 -11.583 136 HA3 GLY 22 HA1 GLY 22 -19.617 38.993 -10.787 137 H SER 23 HN SER 23 -19.154 39.155 -8.690 138 HA SER 23 HA SER 23 -16.629 38.037 -7.735 139 HB2 SER 23 HB2 SER 23 -18.628 39.807 -6.316 140 HB3 SER 23 HB1 SER 23 -17.095 39.251 -5.643 141 HG SER 23 HG SER 23 -17.203 40.659 -8.095 142 H LYS 24 HN LYS 24 -19.807 37.115 -8.144 143 HA LYS 24 HA LYS 24 -20.072 35.572 -5.721 144 HB2 LYS 24 HB2 LYS 24 -21.640 35.527 -8.310 145 HB3 LYS 24 HB1 LYS 24 -22.050 34.580 -6.889 146 HG2 LYS 24 HG2 LYS 24 -21.957 37.591 -6.994 147 HG3 LYS 24 HG1 LYS 24 -23.418 36.614 -7.120 148 HD2 LYS 24 HD2 LYS 24 -21.544 36.702 -4.755 149 HD3 LYS 24 HD1 LYS 24 -23.109 37.505 -4.862 150 HE2 LYS 24 HE2 LYS 24 -24.157 35.265 -5.198 151 HE3 LYS 24 HE1 LYS 24 -22.581 34.536 -4.900 152 HZ1 LYS 24 HZ1 LYS 24 -24.083 36.239 -2.994 153 HZ2 LYS 24 HZ2 LYS 24 -22.576 35.530 -2.700 154 HZ3 LYS 24 HZ3 LYS 24 -23.938 34.557 -2.912 155 H CYS 25 HN CYS 25 -19.401 35.014 -9.116 156 HA CYS 25 HA CYS 25 -18.354 33.394 -10.255 157 HB2 CYS 25 HB2 CYS 25 -16.702 34.053 -8.277 158 HB3 CYS 25 HB1 CYS 25 -16.961 32.362 -7.855 159 H GLN 26 HN GLN 26 -20.020 32.122 -10.786 160 HA GLN 26 HA GLN 26 -21.029 30.143 -8.913 161 HB2 GLN 26 HB2 GLN 26 -21.885 30.726 -11.736 162 HB3 GLN 26 HB1 GLN 26 -22.732 29.706 -10.584 163 HG2 GLN 26 HG2 GLN 26 -23.199 31.599 -9.180 164 HG3 GLN 26 HG1 GLN 26 -22.235 32.648 -10.221 165 HE21 GLN 26 HE21 GLN 26 -25.037 32.819 -9.479 166 HE22 GLN 26 HE22 GLN 26 -25.929 32.822 -10.959 167 H CYS 27 HN CYS 27 -18.635 30.182 -11.336 168 HA CYS 27 HA CYS 27 -19.083 27.487 -12.242 169 HB2 CYS 27 HB2 CYS 27 -17.008 27.759 -13.491 170 HB3 CYS 27 HB1 CYS 27 -18.065 29.148 -13.725 171 H GLY 28 HN GLY 28 -17.488 25.777 -12.035 172 HA2 GLY 28 HA2 GLY 28 -16.612 25.545 -9.276 173 HA3 GLY 28 HA1 GLY 28 -16.642 24.261 -10.472 174 H GLU 29 HN GLU 29 -14.544 23.622 -9.828 175 HA GLU 29 HA GLU 29 -12.356 25.491 -10.064 176 HB2 GLU 29 HB2 GLU 29 -12.316 22.516 -9.539 177 HB3 GLU 29 HB1 GLU 29 -10.946 23.605 -9.396 178 HG2 GLU 29 HG2 GLU 29 -12.091 24.802 -7.598 179 HG3 GLU 29 HG1 GLU 29 -13.451 23.688 -7.735 180 H GLY 30 HN GLY 30 -10.506 25.098 -11.426 181 HA2 GLY 30 HA2 GLY 30 -9.435 24.142 -13.293 182 HA3 GLY 30 HA1 GLY 30 -10.952 23.376 -13.743 183 H CYS 31 HN CYS 31 -11.417 26.594 -12.901 184 HA CYS 31 HA CYS 31 -11.682 27.261 -15.729 185 HB2 CYS 31 HB2 CYS 31 -13.693 27.668 -14.529 186 HB3 CYS 31 HB1 CYS 31 -12.836 28.536 -13.257 187 H THR 32 HN THR 32 -10.640 28.955 -12.784 188 HA THR 32 HA THR 32 -9.283 30.727 -12.454 189 HB THR 32 HB THR 32 -6.977 30.513 -13.326 190 HG1 THR 32 HG1 THR 32 -6.451 29.076 -14.864 191 HG21 THR 32 HG21 THR 32 -7.646 29.195 -11.385 192 HG22 THR 32 HG22 THR 32 -6.482 28.304 -12.370 193 HG23 THR 32 HG23 THR 32 -8.199 27.900 -12.448 194 H CYS 33 HN CYS 33 -11.294 31.281 -14.292 195 HA CYS 33 HA CYS 33 -10.608 32.504 -16.674 196 HB2 CYS 33 HB2 CYS 33 -12.884 32.362 -14.979 197 HB3 CYS 33 HB1 CYS 33 -12.628 34.058 -15.358 198 H ALA 34 HN ALA 34 -10.145 34.647 -17.237 199 HA ALA 34 HA ALA 34 -8.498 36.041 -15.296 200 HB1 ALA 34 HB1 ALA 34 -9.009 36.607 -18.217 201 HB2 ALA 34 HB2 ALA 34 -7.650 35.692 -17.565 202 HB3 ALA 34 HB3 ALA 34 -7.809 37.413 -17.208 203 H ALA 35 HN ALA 35 -11.378 35.956 -15.005 204 HA ALA 35 HA ALA 35 -11.872 38.819 -14.862 205 HB1 ALA 35 HB1 ALA 35 -12.948 38.068 -16.928 206 HB2 ALA 35 HB2 ALA 35 -14.143 38.552 -15.725 207 HB3 ALA 35 HB3 ALA 35 -13.833 36.842 -16.021 208 H CYS 36 HN CYS 36 -13.474 35.711 -14.230 209 HA CYS 36 HA CYS 36 -14.533 36.761 -11.761 210 HB2 CYS 36 HB2 CYS 36 -15.669 34.569 -11.650 211 HB3 CYS 36 HB1 CYS 36 -15.997 35.483 -13.118 212 H LYS 37 HN LYS 37 -12.175 34.335 -12.762 213 HA LYS 37 HA LYS 37 -11.700 33.790 -9.919 214 HB2 LYS 37 HB2 LYS 37 -12.717 31.990 -11.483 215 HB3 LYS 37 HB1 LYS 37 -11.083 31.826 -12.091 216 HG2 LYS 37 HG2 LYS 37 -10.298 30.895 -10.151 217 HG3 LYS 37 HG1 LYS 37 -11.532 31.668 -9.153 218 HD2 LYS 37 HD2 LYS 37 -12.079 29.456 -11.137 219 HD3 LYS 37 HD1 LYS 37 -11.847 29.203 -9.404 220 HE2 LYS 37 HE2 LYS 37 -13.768 30.694 -8.959 221 HE3 LYS 37 HE1 LYS 37 -14.016 30.877 -10.690 222 HZ1 LYS 37 HZ1 LYS 37 -14.421 28.478 -10.820 223 HZ2 LYS 37 HZ2 LYS 37 -15.519 29.255 -9.809 224 HZ3 LYS 37 HZ3 LYS 37 -14.256 28.360 -9.142 225 H THR 38 HN THR 38 -10.369 35.855 -10.738 226 HA THR 38 HA THR 38 -7.639 34.864 -11.195 227 HB THR 38 HB THR 38 -8.468 36.197 -13.131 228 HG1 THR 38 HG1 THR 38 -6.546 37.123 -13.344 229 HG21 THR 38 HG21 THR 38 -9.991 37.701 -11.939 230 HG22 THR 38 HG22 THR 38 -8.809 38.621 -12.872 231 HG23 THR 38 HG23 THR 38 -8.620 38.456 -11.126 232 H CYS 39 HN CYS 39 -6.096 36.833 -10.452 233 HA CYS 39 HA CYS 39 -6.766 37.127 -7.627 234 HB2 CYS 39 HB2 CYS 39 -4.571 36.127 -8.271 235 HB3 CYS 39 HB1 CYS 39 -4.119 37.678 -8.969 236 H ASN 40 HN ASN 40 -6.343 39.102 -6.513 237 HA ASN 40 HA ASN 40 -6.770 41.450 -8.228 238 HB2 ASN 40 HB2 ASN 40 -7.944 40.738 -5.549 239 HB3 ASN 40 HB1 ASN 40 -7.926 42.394 -6.144 240 HD21 ASN 40 HD21 ASN 40 -9.165 39.164 -6.716 241 HD22 ASN 40 HD22 ASN 40 -10.477 39.657 -7.734 242 H CYS 41 HN CYS 41 -4.538 39.956 -6.415 243 HA CYS 41 HA CYS 41 -3.536 42.214 -4.947 244 HB2 CYS 41 HB2 CYS 41 -2.271 39.532 -5.532 245 HB3 CYS 41 HB1 CYS 41 -1.673 40.722 -4.381 246 H THR 42 HN THR 42 -1.582 43.309 -5.392 247 HA THR 42 HA THR 42 -0.770 43.148 -8.206 248 HB THR 42 HB THR 42 -0.265 45.577 -8.043 249 HG1 THR 42 HG1 THR 42 -1.769 46.210 -5.933 250 HG21 THR 42 HG21 THR 42 -2.596 46.355 -8.079 251 HG22 THR 42 HG22 THR 42 -3.111 44.843 -7.332 252 HG23 THR 42 HG23 THR 42 -2.422 44.834 -8.956 253 H SER 43 HN SER 43 1.467 44.097 -8.538 254 HA SER 43 HA SER 43 3.351 42.726 -6.947 255 HB2 SER 43 HB2 SER 43 3.865 45.031 -8.837 256 HB3 SER 43 HB1 SER 43 5.008 43.779 -8.352 257 HG SER 43 HG SER 43 3.453 42.271 -9.324 258 H ASP 44 HN ASP 44 1.944 45.862 -6.788 259 HA ASP 44 HA ASP 44 3.928 47.117 -5.178 260 HB2 ASP 44 HB2 ASP 44 2.437 48.473 -6.494 261 HB3 ASP 44 HB1 ASP 44 1.031 47.795 -5.682 262 H GLY 45 HN GLY 45 1.004 45.278 -4.507 263 HA2 GLY 45 HA2 GLY 45 1.869 44.807 -1.837 264 HA3 GLY 45 HA1 GLY 45 0.526 45.937 -1.902 265 H CYS 46 HN CYS 46 1.022 43.017 -1.076 266 HA CYS 46 HA CYS 46 -0.875 41.548 -2.643 267 HB2 CYS 46 HB2 CYS 46 1.138 40.670 -1.228 268 HB3 CYS 46 HB1 CYS 46 0.027 40.798 0.129 269 H LYS 47 HN LYS 47 -3.040 41.582 -2.367 270 HA LYS 47 HA LYS 47 -4.092 43.325 -0.313 271 HB2 LYS 47 HB2 LYS 47 -5.436 41.940 -2.627 272 HB3 LYS 47 HB1 LYS 47 -6.292 42.940 -1.463 273 HG2 LYS 47 HG2 LYS 47 -4.727 44.815 -2.099 274 HG3 LYS 47 HG1 LYS 47 -4.176 43.788 -3.424 275 HD2 LYS 47 HD2 LYS 47 -6.443 43.679 -4.308 276 HD3 LYS 47 HD1 LYS 47 -7.033 44.646 -2.955 277 HE2 LYS 47 HE2 LYS 47 -5.574 46.500 -3.688 278 HE3 LYS 47 HE1 LYS 47 -5.072 45.531 -5.072 279 HZ1 LYS 47 HZ1 LYS 47 -7.390 45.486 -5.804 280 HZ2 LYS 47 HZ2 LYS 47 -6.804 47.061 -5.702 281 HZ3 LYS 47 HZ3 LYS 47 -7.832 46.467 -4.504 282 H CYS 48 HN CYS 48 -3.991 39.902 -0.955 283 HA CYS 48 HA CYS 48 -5.971 39.420 1.121 284 HB2 CYS 48 HB2 CYS 48 -5.833 37.102 0.512 285 HB3 CYS 48 HB1 CYS 48 -5.899 38.050 -0.975 286 H GLY 49 HN GLY 49 -2.521 38.997 0.547 287 HA2 GLY 49 HA2 GLY 49 -1.018 39.434 2.382 288 HA3 GLY 49 HA1 GLY 49 -2.182 38.669 3.455 289 H LYS 50 HN LYS 50 -2.151 36.838 0.714 290 HA LYS 50 HA LYS 50 -0.553 34.783 1.975 291 HB2 LYS 50 HB2 LYS 50 -1.868 34.717 -0.748 292 HB3 LYS 50 HB1 LYS 50 -1.322 33.337 0.195 293 HG2 LYS 50 HG2 LYS 50 -3.557 35.204 0.974 294 HG3 LYS 50 HG1 LYS 50 -3.761 33.612 0.248 295 HD2 LYS 50 HD2 LYS 50 -2.851 32.536 2.171 296 HD3 LYS 50 HD1 LYS 50 -2.306 34.075 2.841 297 HE2 LYS 50 HE2 LYS 50 -4.335 33.239 3.954 298 HE3 LYS 50 HE1 LYS 50 -4.590 34.790 3.162 299 HZ1 LYS 50 HZ1 LYS 50 -6.430 33.302 2.767 300 HZ2 LYS 50 HZ2 LYS 50 -5.405 32.137 2.111 301 HZ3 LYS 50 HZ3 LYS 50 -5.628 33.607 1.310 302 H GLU 51 HN GLU 51 0.160 37.387 0.210 303 HA GLU 51 HA GLU 51 1.993 38.214 -0.756 304 HB2 GLU 51 HB2 GLU 51 3.045 36.923 1.186 305 HB3 GLU 51 HB1 GLU 51 3.482 35.705 -0.001 306 HG2 GLU 51 HG2 GLU 51 4.980 37.112 -1.082 307 HG3 GLU 51 HG1 GLU 51 4.247 38.567 -0.410 308 H CYS 52 HN CYS 52 0.161 36.782 -2.375 309 HA CYS 52 HA CYS 52 1.718 35.361 -4.344 310 HB2 CYS 52 HB2 CYS 52 -0.571 35.783 -5.635 311 HB3 CYS 52 HB1 CYS 52 -0.402 34.523 -4.420 312 H THR 53 HN THR 53 0.061 38.457 -4.109 313 HA THR 53 HA THR 53 0.227 40.424 -5.200 314 HB THR 53 HB THR 53 2.533 41.224 -5.752 315 HG1 THR 53 HG1 THR 53 3.061 38.604 -5.779 316 HG21 THR 53 HG21 THR 53 3.330 41.182 -3.436 317 HG22 THR 53 HG22 THR 53 2.197 39.876 -3.077 318 HG23 THR 53 HG23 THR 53 1.590 41.471 -3.514 319 H GLY 54 HN GLY 54 -0.591 38.249 -6.907 320 HA2 GLY 54 HA2 GLY 54 -0.751 39.544 -9.287 321 HA3 GLY 54 HA1 GLY 54 0.705 38.564 -9.394 322 HA PRO 55 HA PRO 55 -3.265 36.044 -10.076 323 HB2 PRO 55 HB2 PRO 55 -3.032 36.158 -12.933 324 HB3 PRO 55 HB1 PRO 55 -4.335 36.764 -11.913 325 HG2 PRO 55 HG2 PRO 55 -2.559 38.331 -13.358 326 HG3 PRO 55 HG1 PRO 55 -3.548 38.901 -12.003 327 HD2 PRO 55 HD2 PRO 55 -0.669 38.181 -12.111 328 HD3 PRO 55 HD1 PRO 55 -1.504 39.377 -11.098 329 H ASP 56 HN ASP 56 -0.429 36.090 -12.196 330 HA ASP 56 HA ASP 56 -0.572 33.234 -12.606 331 HB2 ASP 56 HB2 ASP 56 1.489 33.460 -13.898 332 HB3 ASP 56 HB1 ASP 56 0.307 34.663 -14.393 333 H SER 57 HN SER 57 0.736 35.281 -10.308 334 HA SER 57 HA SER 57 2.466 33.164 -9.240 335 HB2 SER 57 HB2 SER 57 2.314 36.095 -8.494 336 HB3 SER 57 HB1 SER 57 3.472 34.925 -7.866 337 HG SER 57 HG SER 57 4.089 34.613 -10.136 338 H CYS 58 HN CYS 58 -0.605 33.706 -9.083 339 HA CYS 58 HA CYS 58 -0.983 33.956 -6.233 340 HB2 CYS 58 HB2 CYS 58 -2.547 35.045 -7.827 341 HB3 CYS 58 HB1 CYS 58 -3.039 33.450 -8.383 342 H LYS 59 HN LYS 59 -1.462 32.386 -4.874 343 HA LYS 59 HA LYS 59 -1.388 29.634 -5.912 344 HB2 LYS 59 HB2 LYS 59 -0.797 30.599 -3.119 345 HB3 LYS 59 HB1 LYS 59 -0.444 29.017 -3.796 346 HG2 LYS 59 HG2 LYS 59 1.294 29.841 -5.134 347 HG3 LYS 59 HG1 LYS 59 0.763 31.508 -4.940 348 HD2 LYS 59 HD2 LYS 59 1.894 29.774 -2.748 349 HD3 LYS 59 HD1 LYS 59 2.782 30.998 -3.663 350 HE2 LYS 59 HE2 LYS 59 1.205 32.716 -2.846 351 HE3 LYS 59 HE1 LYS 59 0.391 31.489 -1.880 352 HZ1 LYS 59 HZ1 LYS 59 1.961 32.803 -0.585 353 HZ2 LYS 59 HZ2 LYS 59 3.234 32.288 -1.571 354 HZ3 LYS 59 HZ3 LYS 59 2.403 31.174 -0.615 355 H CYS 60 HN CYS 60 -3.407 31.954 -4.690 356 HA CYS 60 HA CYS 60 -5.018 30.361 -2.944 357 HB2 CYS 60 HB2 CYS 60 -5.665 33.020 -4.218 358 HB3 CYS 60 HB1 CYS 60 -6.418 32.317 -2.789 359 H GLY 61 HN GLY 61 -7.294 29.895 -3.319 360 HA2 GLY 61 HA2 GLY 61 -7.672 28.874 -6.020 361 HA3 GLY 61 HA1 GLY 61 -8.624 28.459 -4.605 362 H SER 62 HN SER 62 -10.262 29.948 -3.903 363 HA SER 62 HA SER 62 -11.029 32.034 -5.787 364 HB2 SER 62 HB2 SER 62 -13.333 31.082 -5.999 365 HB3 SER 62 HB1 SER 62 -12.083 30.102 -6.768 366 HG SER 62 HG SER 62 -12.485 28.541 -5.415 367 H SER 63 HN SER 63 -11.437 30.438 -2.702 368 HA SER 63 HA SER 63 -13.300 32.471 -1.785 369 HB2 SER 63 HB2 SER 63 -12.223 30.025 -0.370 370 HB3 SER 63 HB1 SER 63 -13.518 31.073 0.213 371 HG SER 63 HG SER 63 -13.785 30.004 -2.351 372 H CYS 64 HN CYS 64 -10.896 33.607 -2.355 373 HA CYS 64 HA CYS 64 -9.866 34.225 0.321 374 HB2 CYS 64 HB2 CYS 64 -8.256 32.984 -1.187 375 HB3 CYS 64 HB1 CYS 64 -8.262 34.398 -2.229 376 H SER 65 HN SER 65 -8.894 36.457 0.402 377 HA SER 65 HA SER 65 -10.852 38.329 -0.373 378 HB2 SER 65 HB2 SER 65 -8.054 38.929 0.580 379 HB3 SER 65 HB1 SER 65 -9.485 39.950 0.734 380 HG SER 65 HG SER 65 -10.385 38.344 2.105 381 H CYS 66 HN CYS 66 -8.057 37.146 -2.020 382 HA CYS 66 HA CYS 66 -7.909 39.497 -3.736 383 HB2 CYS 66 HB2 CYS 66 -5.957 38.386 -4.733 384 HB3 CYS 66 HB1 CYS 66 -5.803 38.536 -2.988 385 H LYS 67 HN LYS 67 -10.191 37.535 -3.694 386 HA LYS 67 HA LYS 67 -10.139 36.860 -6.562 387 HB2 LYS 67 HB2 LYS 67 -11.360 35.243 -4.320 388 HB3 LYS 67 HB1 LYS 67 -11.519 34.875 -6.031 389 HG2 LYS 67 HG2 LYS 67 -8.860 35.043 -4.647 390 HG3 LYS 67 HG1 LYS 67 -9.794 33.551 -4.756 391 HD2 LYS 67 HD2 LYS 67 -9.623 33.498 -7.106 392 HD3 LYS 67 HD1 LYS 67 -9.083 35.176 -7.184 393 HE2 LYS 67 HE2 LYS 67 -7.519 32.970 -5.870 394 HE3 LYS 67 HE1 LYS 67 -7.288 33.469 -7.547 395 HZ1 LYS 67 HZ1 LYS 67 -6.869 35.129 -5.117 396 HZ2 LYS 67 HZ2 LYS 67 -6.817 35.726 -6.688 397 HZ3 LYS 67 HZ3 LYS 67 -5.686 34.575 -6.188 Start of MODEL 15 1 HA2 GLY 1 HA1 GLY 1 -8.395 13.279 -29.192 2 HA3 GLY 1 HA2 GLY 1 -7.041 13.623 -30.257 3 H SER 2 HN SER 2 -9.824 12.871 -31.982 4 HA SER 2 HA SER 2 -10.018 15.449 -33.118 5 HB2 SER 2 HB2 SER 2 -12.031 13.196 -33.261 6 HB3 SER 2 HB1 SER 2 -11.895 14.556 -34.375 7 HG SER 2 HG SER 2 -10.460 12.224 -34.263 8 H GLY 3 HN GLY 3 -12.115 13.695 -30.850 9 HA2 GLY 3 HA2 GLY 3 -13.805 16.037 -30.532 10 HA3 GLY 3 HA1 GLY 3 -14.055 14.457 -29.803 11 H LYS 4 HN LYS 4 -11.798 17.183 -29.691 12 HA LYS 4 HA LYS 4 -11.081 16.551 -26.967 13 HB2 LYS 4 HB2 LYS 4 -9.505 18.347 -27.072 14 HB3 LYS 4 HB1 LYS 4 -9.418 17.500 -28.603 15 HG2 LYS 4 HG2 LYS 4 -11.080 19.984 -28.277 16 HG3 LYS 4 HG1 LYS 4 -9.353 20.068 -28.608 17 HD2 LYS 4 HD2 LYS 4 -11.380 18.634 -30.334 18 HD3 LYS 4 HD1 LYS 4 -10.756 20.251 -30.642 19 HE2 LYS 4 HE2 LYS 4 -9.118 17.713 -30.536 20 HE3 LYS 4 HE1 LYS 4 -9.599 18.572 -31.993 21 HZ1 LYS 4 HZ1 LYS 4 -7.335 19.100 -31.369 22 HZ2 LYS 4 HZ2 LYS 4 -7.844 19.652 -29.859 23 HZ3 LYS 4 HZ3 LYS 4 -8.308 20.476 -31.256 24 H GLY 5 HN GLY 5 -11.277 18.114 -25.216 25 HA2 GLY 5 HA2 GLY 5 -13.931 19.296 -25.245 26 HA3 GLY 5 HA1 GLY 5 -12.899 19.077 -23.837 27 H LYS 6 HN LYS 6 -14.377 21.447 -24.889 28 HA LYS 6 HA LYS 6 -12.065 23.264 -25.141 29 HB2 LYS 6 HB2 LYS 6 -14.849 23.791 -26.177 30 HB3 LYS 6 HB1 LYS 6 -13.407 24.745 -26.466 31 HG2 LYS 6 HG2 LYS 6 -12.447 22.980 -27.800 32 HG3 LYS 6 HG1 LYS 6 -13.809 21.923 -27.434 33 HD2 LYS 6 HD2 LYS 6 -14.176 24.582 -28.792 34 HD3 LYS 6 HD1 LYS 6 -13.800 23.123 -29.702 35 HE2 LYS 6 HE2 LYS 6 -16.180 23.434 -29.748 36 HE3 LYS 6 HE1 LYS 6 -15.832 22.057 -28.709 37 HZ1 LYS 6 HZ1 LYS 6 -17.542 23.660 -27.857 38 HZ2 LYS 6 HZ2 LYS 6 -16.304 24.790 -27.645 39 HZ3 LYS 6 HZ3 LYS 6 -16.281 23.337 -26.793 40 H GLY 7 HN GLY 7 -14.304 22.198 -23.050 41 HA2 GLY 7 HA2 GLY 7 -14.156 24.648 -21.475 42 HA3 GLY 7 HA1 GLY 7 -15.759 24.019 -21.833 43 H GLU 8 HN GLU 8 -14.356 24.310 -19.259 44 HA GLU 8 HA GLU 8 -14.238 21.478 -18.509 45 HB2 GLU 8 HB2 GLU 8 -12.894 23.863 -17.251 46 HB3 GLU 8 HB1 GLU 8 -12.902 22.255 -16.541 47 HG2 GLU 8 HG2 GLU 8 -11.758 21.367 -18.511 48 HG3 GLU 8 HG1 GLU 8 -11.749 22.974 -19.230 49 H LYS 9 HN LYS 9 -14.236 23.392 -15.799 50 HA LYS 9 HA LYS 9 -16.955 22.524 -15.193 51 HB2 LYS 9 HB2 LYS 9 -14.714 23.499 -13.425 52 HB3 LYS 9 HB1 LYS 9 -16.303 23.019 -12.844 53 HG2 LYS 9 HG2 LYS 9 -15.943 20.761 -13.699 54 HG3 LYS 9 HG1 LYS 9 -14.357 21.239 -14.302 55 HD2 LYS 9 HD2 LYS 9 -14.170 20.052 -12.174 56 HD3 LYS 9 HD1 LYS 9 -13.632 21.723 -12.016 57 HE2 LYS 9 HE2 LYS 9 -15.017 21.002 -10.116 58 HE3 LYS 9 HE1 LYS 9 -15.740 22.342 -11.000 59 HZ1 LYS 9 HZ1 LYS 9 -17.196 20.760 -12.118 60 HZ2 LYS 9 HZ2 LYS 9 -17.382 20.679 -10.443 61 HZ3 LYS 9 HZ3 LYS 9 -16.509 19.480 -11.251 62 H CYS 10 HN CYS 10 -16.603 24.811 -16.875 63 HA CYS 10 HA CYS 10 -17.395 26.994 -15.144 64 HB2 CYS 10 HB2 CYS 10 -16.571 26.962 -18.032 65 HB3 CYS 10 HB1 CYS 10 -17.200 28.395 -17.228 66 H THR 11 HN THR 11 -19.339 27.987 -15.205 67 HA THR 11 HA THR 11 -21.475 26.475 -16.448 68 HB THR 11 HB THR 11 -22.944 27.988 -15.105 69 HG1 THR 11 HG1 THR 11 -22.020 29.471 -13.750 70 HG21 THR 11 HG21 THR 11 -22.178 25.837 -14.186 71 HG22 THR 11 HG22 THR 11 -22.340 27.055 -12.922 72 HG23 THR 11 HG23 THR 11 -20.743 26.631 -13.537 73 H SER 12 HN SER 12 -23.400 28.149 -17.054 74 HA SER 12 HA SER 12 -22.602 29.297 -19.496 75 HB2 SER 12 HB2 SER 12 -25.168 29.770 -17.960 76 HB3 SER 12 HB1 SER 12 -24.909 30.060 -19.680 77 HG SER 12 HG SER 12 -24.490 27.501 -18.548 78 H ALA 13 HN ALA 13 -22.923 30.583 -16.271 79 HA ALA 13 HA ALA 13 -23.054 33.322 -16.882 80 HB1 ALA 13 HB1 ALA 13 -22.340 33.675 -14.572 81 HB2 ALA 13 HB2 ALA 13 -21.882 31.976 -14.449 82 HB3 ALA 13 HB3 ALA 13 -23.575 32.420 -14.667 83 H CYS 14 HN CYS 14 -20.312 31.177 -16.251 84 HA CYS 14 HA CYS 14 -18.380 33.260 -16.588 85 HB2 CYS 14 HB2 CYS 14 -18.013 31.262 -15.161 86 HB3 CYS 14 HB1 CYS 14 -17.978 30.269 -16.610 87 H ARG 15 HN ARG 15 -19.865 30.837 -18.608 88 HA ARG 15 HA ARG 15 -18.009 31.102 -20.764 89 HB2 ARG 15 HB2 ARG 15 -20.679 29.770 -20.501 90 HB3 ARG 15 HB1 ARG 15 -19.900 29.922 -22.069 91 HG2 ARG 15 HG2 ARG 15 -18.612 28.623 -19.677 92 HG3 ARG 15 HG1 ARG 15 -19.512 27.745 -20.914 93 HD2 ARG 15 HD2 ARG 15 -17.174 27.594 -21.445 94 HD3 ARG 15 HD1 ARG 15 -17.936 28.661 -22.618 95 HE ARG 15 HE ARG 15 -16.410 29.687 -20.307 96 HH11 ARG 15 HH11 ARG 15 -17.120 29.698 -23.752 97 HH12 ARG 15 HH12 ARG 15 -16.049 31.013 -24.092 98 HH21 ARG 15 HH21 ARG 15 -15.002 31.446 -20.770 99 HH22 ARG 15 HH22 ARG 15 -14.850 32.003 -22.399 100 H SER 16 HN SER 16 -20.410 33.121 -19.670 101 HA SER 16 HA SER 16 -21.026 34.225 -22.278 102 HB2 SER 16 HB2 SER 16 -21.822 35.133 -19.499 103 HB3 SER 16 HB1 SER 16 -22.420 35.822 -21.011 104 HG SER 16 HG SER 16 -22.778 33.160 -20.067 105 H GLU 17 HN GLU 17 -20.612 36.519 -22.690 106 HA GLU 17 HA GLU 17 -18.244 37.474 -21.265 107 HB2 GLU 17 HB2 GLU 17 -18.719 37.597 -24.246 108 HB3 GLU 17 HB1 GLU 17 -17.362 38.337 -23.404 109 HG2 GLU 17 HG2 GLU 17 -16.639 36.116 -22.649 110 HG3 GLU 17 HG1 GLU 17 -17.972 35.394 -23.544 111 HA PRO 18 HA PRO 18 -17.391 38.979 -20.415 112 HB2 PRO 18 HB2 PRO 18 -18.261 40.568 -18.184 113 HB3 PRO 18 HB1 PRO 18 -16.944 40.893 -19.310 114 HG2 PRO 18 HG2 PRO 18 -19.263 42.342 -19.137 115 HG3 PRO 18 HG1 PRO 18 -18.217 42.297 -20.567 116 HD2 PRO 18 HD2 PRO 18 -20.784 40.869 -20.035 117 HD3 PRO 18 HD1 PRO 18 -20.155 41.530 -21.556 118 H CYS 19 HN CYS 19 -17.117 38.397 -17.952 119 HA CYS 19 HA CYS 19 -18.704 36.096 -17.568 120 HB2 CYS 19 HB2 CYS 19 -16.546 37.407 -15.991 121 HB3 CYS 19 HB1 CYS 19 -17.536 36.171 -15.220 122 H GLN 20 HN GLN 20 -20.268 35.613 -16.253 123 HA GLN 20 HA GLN 20 -21.554 37.831 -14.817 124 HB2 GLN 20 HB2 GLN 20 -22.821 35.343 -15.949 125 HB3 GLN 20 HB1 GLN 20 -23.654 36.711 -15.225 126 HG2 GLN 20 HG2 GLN 20 -22.026 36.786 -17.748 127 HG3 GLN 20 HG1 GLN 20 -23.782 36.722 -17.648 128 HE21 GLN 20 HE21 GLN 20 -21.931 38.735 -18.779 129 HE22 GLN 20 HE22 GLN 20 -22.367 40.232 -18.030 130 H CYS 21 HN CYS 21 -19.499 35.656 -14.108 131 HA CYS 21 HA CYS 21 -20.708 33.861 -12.320 132 HB2 CYS 21 HB2 CYS 21 -17.976 34.828 -12.892 133 HB3 CYS 21 HB1 CYS 21 -18.206 34.051 -11.341 134 H GLY 22 HN GLY 22 -19.592 37.149 -11.994 135 HA2 GLY 22 HA2 GLY 22 -20.117 38.735 -10.441 136 HA3 GLY 22 HA1 GLY 22 -21.187 37.569 -9.679 137 H SER 23 HN SER 23 -20.581 38.089 -7.631 138 HA SER 23 HA SER 23 -17.792 37.920 -6.869 139 HB2 SER 23 HB2 SER 23 -20.221 38.390 -5.129 140 HB3 SER 23 HB1 SER 23 -18.535 38.725 -4.721 141 HG SER 23 HG SER 23 -18.738 40.071 -6.804 142 H LYS 24 HN LYS 24 -20.549 35.929 -7.064 143 HA LYS 24 HA LYS 24 -19.859 34.121 -4.925 144 HB2 LYS 24 HB2 LYS 24 -21.788 33.904 -7.235 145 HB3 LYS 24 HB1 LYS 24 -21.555 32.636 -6.045 146 HG2 LYS 24 HG2 LYS 24 -22.310 34.144 -4.289 147 HG3 LYS 24 HG1 LYS 24 -22.537 35.422 -5.486 148 HD2 LYS 24 HD2 LYS 24 -24.653 34.297 -4.951 149 HD3 LYS 24 HD1 LYS 24 -24.205 34.065 -6.641 150 HE2 LYS 24 HE2 LYS 24 -23.332 31.836 -6.091 151 HE3 LYS 24 HE1 LYS 24 -23.783 32.078 -4.404 152 HZ1 LYS 24 HZ1 LYS 24 -25.663 32.017 -6.699 153 HZ2 LYS 24 HZ2 LYS 24 -26.087 32.210 -5.074 154 HZ3 LYS 24 HZ3 LYS 24 -25.415 30.756 -5.600 155 H CYS 25 HN CYS 25 -19.724 34.146 -8.421 156 HA CYS 25 HA CYS 25 -18.509 33.068 -9.932 157 HB2 CYS 25 HB2 CYS 25 -16.667 33.451 -8.061 158 HB3 CYS 25 HB1 CYS 25 -16.764 31.695 -7.959 159 H GLN 26 HN GLN 26 -19.893 31.782 -10.761 160 HA GLN 26 HA GLN 26 -20.928 29.501 -9.364 161 HB2 GLN 26 HB2 GLN 26 -21.424 30.493 -12.164 162 HB3 GLN 26 HB1 GLN 26 -22.315 29.198 -11.374 163 HG2 GLN 26 HG2 GLN 26 -23.191 30.715 -9.742 164 HG3 GLN 26 HG1 GLN 26 -22.172 32.020 -10.347 165 HE21 GLN 26 HE21 GLN 26 -23.911 33.341 -10.772 166 HE22 GLN 26 HE22 GLN 26 -24.996 33.060 -12.085 167 H CYS 27 HN CYS 27 -18.406 30.028 -11.714 168 HA CYS 27 HA CYS 27 -18.446 27.293 -12.618 169 HB2 CYS 27 HB2 CYS 27 -16.489 27.816 -13.889 170 HB3 CYS 27 HB1 CYS 27 -17.604 29.172 -14.057 171 H GLY 28 HN GLY 28 -16.711 25.800 -12.302 172 HA2 GLY 28 HA2 GLY 28 -15.843 25.823 -9.535 173 HA3 GLY 28 HA1 GLY 28 -15.635 24.510 -10.690 174 H GLU 29 HN GLU 29 -14.127 25.130 -12.569 175 HA GLU 29 HA GLU 29 -12.025 26.954 -12.091 176 HB2 GLU 29 HB2 GLU 29 -10.250 25.281 -11.655 177 HB3 GLU 29 HB1 GLU 29 -11.419 25.381 -10.344 178 HG2 GLU 29 HG2 GLU 29 -12.570 23.392 -11.373 179 HG3 GLU 29 HG1 GLU 29 -11.167 23.233 -12.427 180 H GLY 30 HN GLY 30 -10.220 26.546 -13.680 181 HA2 GLY 30 HA2 GLY 30 -9.420 25.429 -15.622 182 HA3 GLY 30 HA1 GLY 30 -11.049 24.849 -15.920 183 H CYS 31 HN CYS 31 -10.316 28.204 -15.148 184 HA CYS 31 HA CYS 31 -10.560 28.870 -17.983 185 HB2 CYS 31 HB2 CYS 31 -12.206 30.624 -17.556 186 HB3 CYS 31 HB1 CYS 31 -12.828 29.047 -17.082 187 H THR 32 HN THR 32 -9.728 29.929 -14.729 188 HA THR 32 HA THR 32 -8.428 31.596 -13.913 189 HB THR 32 HB THR 32 -6.212 31.924 -15.053 190 HG1 THR 32 HG1 THR 32 -7.562 30.848 -17.138 191 HG21 THR 32 HG21 THR 32 -6.536 30.124 -13.434 192 HG22 THR 32 HG22 THR 32 -5.429 29.627 -14.714 193 HG23 THR 32 HG23 THR 32 -7.099 29.059 -14.723 194 H CYS 33 HN CYS 33 -10.574 32.645 -15.097 195 HA CYS 33 HA CYS 33 -10.138 34.519 -17.118 196 HB2 CYS 33 HB2 CYS 33 -12.213 34.305 -14.971 197 HB3 CYS 33 HB1 CYS 33 -12.231 35.597 -16.167 198 H ALA 34 HN ALA 34 -10.499 36.867 -16.843 199 HA ALA 34 HA ALA 34 -8.812 37.877 -14.680 200 HB1 ALA 34 HB1 ALA 34 -9.637 39.191 -17.276 201 HB2 ALA 34 HB2 ALA 34 -8.085 38.414 -16.962 202 HB3 ALA 34 HB3 ALA 34 -8.534 39.874 -16.080 203 H ALA 35 HN ALA 35 -11.749 37.139 -14.754 204 HA ALA 35 HA ALA 35 -12.801 39.684 -13.731 205 HB1 ALA 35 HB1 ALA 35 -15.013 39.052 -14.586 206 HB2 ALA 35 HB2 ALA 35 -14.326 37.587 -15.284 207 HB3 ALA 35 HB3 ALA 35 -13.831 39.168 -15.890 208 H CYS 36 HN CYS 36 -13.903 36.298 -13.815 209 HA CYS 36 HA CYS 36 -14.742 36.490 -11.063 210 HB2 CYS 36 HB2 CYS 36 -15.668 34.272 -11.437 211 HB3 CYS 36 HB1 CYS 36 -16.133 35.390 -12.716 212 H LYS 37 HN LYS 37 -12.254 34.852 -12.944 213 HA LYS 37 HA LYS 37 -11.309 33.445 -10.548 214 HB2 LYS 37 HB2 LYS 37 -11.951 32.396 -12.943 215 HB3 LYS 37 HB1 LYS 37 -10.264 32.774 -13.240 216 HG2 LYS 37 HG2 LYS 37 -9.860 30.752 -12.401 217 HG3 LYS 37 HG1 LYS 37 -10.149 31.496 -10.826 218 HD2 LYS 37 HD2 LYS 37 -12.268 30.205 -12.535 219 HD3 LYS 37 HD1 LYS 37 -11.450 29.405 -11.193 220 HE2 LYS 37 HE2 LYS 37 -12.328 31.076 -9.649 221 HE3 LYS 37 HE1 LYS 37 -13.095 31.927 -10.988 222 HZ1 LYS 37 HZ1 LYS 37 -13.750 29.191 -10.043 223 HZ2 LYS 37 HZ2 LYS 37 -14.433 29.942 -11.400 224 HZ3 LYS 37 HZ3 LYS 37 -14.698 30.585 -9.866 225 H THR 38 HN THR 38 -10.692 36.084 -10.757 226 HA THR 38 HA THR 38 -7.908 36.074 -11.694 227 HB THR 38 HB THR 38 -9.491 37.603 -12.917 228 HG1 THR 38 HG1 THR 38 -7.346 38.140 -13.054 229 HG21 THR 38 HG21 THR 38 -10.131 39.702 -11.817 230 HG22 THR 38 HG22 THR 38 -9.451 39.113 -10.299 231 HG23 THR 38 HG23 THR 38 -10.851 38.310 -11.008 232 H CYS 39 HN CYS 39 -6.472 37.525 -10.546 233 HA CYS 39 HA CYS 39 -7.095 37.661 -7.690 234 HB2 CYS 39 HB2 CYS 39 -5.171 36.231 -8.230 235 HB3 CYS 39 HB1 CYS 39 -4.417 37.562 -9.099 236 H ASN 40 HN ASN 40 -6.823 39.609 -6.650 237 HA ASN 40 HA ASN 40 -6.646 41.893 -8.470 238 HB2 ASN 40 HB2 ASN 40 -7.895 41.549 -5.756 239 HB3 ASN 40 HB1 ASN 40 -7.602 43.147 -6.436 240 HD21 ASN 40 HD21 ASN 40 -9.382 40.157 -6.806 241 HD22 ASN 40 HD22 ASN 40 -10.593 40.779 -7.871 242 H CYS 41 HN CYS 41 -4.552 40.223 -6.686 243 HA CYS 41 HA CYS 41 -3.225 42.374 -5.353 244 HB2 CYS 41 HB2 CYS 41 -2.322 39.556 -5.927 245 HB3 CYS 41 HB1 CYS 41 -1.499 40.701 -4.872 246 H THR 42 HN THR 42 -0.901 42.817 -5.802 247 HA THR 42 HA THR 42 -0.322 42.720 -8.673 248 HB THR 42 HB THR 42 0.626 45.052 -8.428 249 HG1 THR 42 HG1 THR 42 -0.183 44.627 -5.859 250 HG21 THR 42 HG21 THR 42 -2.344 44.727 -7.978 251 HG22 THR 42 HG22 THR 42 -1.520 44.663 -9.537 252 HG23 THR 42 HG23 THR 42 -1.557 46.169 -8.619 253 H SER 43 HN SER 43 1.998 43.151 -9.135 254 HA SER 43 HA SER 43 3.653 41.547 -7.471 255 HB2 SER 43 HB2 SER 43 4.454 43.386 -9.736 256 HB3 SER 43 HB1 SER 43 5.422 42.078 -9.058 257 HG SER 43 HG SER 43 2.867 41.427 -9.957 258 H ASP 44 HN ASP 44 2.934 44.908 -7.580 259 HA ASP 44 HA ASP 44 5.293 45.701 -6.095 260 HB2 ASP 44 HB2 ASP 44 2.891 47.216 -7.096 261 HB3 ASP 44 HB1 ASP 44 4.092 47.954 -6.043 262 H GLY 45 HN GLY 45 2.513 44.179 -5.266 263 HA2 GLY 45 HA2 GLY 45 2.898 44.311 -2.548 264 HA3 GLY 45 HA1 GLY 45 1.792 45.623 -2.924 265 H CYS 46 HN CYS 46 1.813 42.691 -1.724 266 HA CYS 46 HA CYS 46 -0.352 41.462 -3.167 267 HB2 CYS 46 HB2 CYS 46 1.493 40.314 -1.764 268 HB3 CYS 46 HB1 CYS 46 0.539 40.791 -0.366 269 H LYS 47 HN LYS 47 -2.481 41.773 -2.814 270 HA LYS 47 HA LYS 47 -3.165 43.875 -0.939 271 HB2 LYS 47 HB2 LYS 47 -4.914 42.521 -2.990 272 HB3 LYS 47 HB1 LYS 47 -5.320 43.961 -2.068 273 HG2 LYS 47 HG2 LYS 47 -3.109 43.724 -4.101 274 HG3 LYS 47 HG1 LYS 47 -4.655 44.539 -4.337 275 HD2 LYS 47 HD2 LYS 47 -2.566 45.307 -2.294 276 HD3 LYS 47 HD1 LYS 47 -2.771 46.080 -3.863 277 HE2 LYS 47 HE2 LYS 47 -5.045 46.745 -3.226 278 HE3 LYS 47 HE1 LYS 47 -4.823 45.980 -1.653 279 HZ1 LYS 47 HZ1 LYS 47 -4.445 48.374 -1.569 280 HZ2 LYS 47 HZ2 LYS 47 -3.200 48.230 -2.704 281 HZ3 LYS 47 HZ3 LYS 47 -3.036 47.521 -1.182 282 H CYS 48 HN CYS 48 -3.704 40.432 -1.314 283 HA CYS 48 HA CYS 48 -5.667 40.464 0.829 284 HB2 CYS 48 HB2 CYS 48 -5.942 38.118 0.420 285 HB3 CYS 48 HB1 CYS 48 -5.876 38.928 -1.144 286 H GLY 49 HN GLY 49 -2.332 39.508 0.264 287 HA2 GLY 49 HA2 GLY 49 -0.770 39.853 2.089 288 HA3 GLY 49 HA1 GLY 49 -2.019 39.281 3.184 289 H LYS 50 HN LYS 50 -2.224 37.315 0.544 290 HA LYS 50 HA LYS 50 -0.881 35.179 1.948 291 HB2 LYS 50 HB2 LYS 50 -2.250 35.123 -0.747 292 HB3 LYS 50 HB1 LYS 50 -1.738 33.721 0.180 293 HG2 LYS 50 HG2 LYS 50 -3.903 35.685 0.894 294 HG3 LYS 50 HG1 LYS 50 -4.095 33.990 0.449 295 HD2 LYS 50 HD2 LYS 50 -2.888 33.323 2.469 296 HD3 LYS 50 HD1 LYS 50 -2.684 35.020 2.908 297 HE2 LYS 50 HE2 LYS 50 -5.172 35.232 2.915 298 HE3 LYS 50 HE1 LYS 50 -5.264 33.488 2.687 299 HZ1 LYS 50 HZ1 LYS 50 -4.043 33.206 4.760 300 HZ2 LYS 50 HZ2 LYS 50 -5.483 34.049 5.003 301 HZ3 LYS 50 HZ3 LYS 50 -4.014 34.882 4.990 302 H GLU 51 HN GLU 51 0.168 37.537 -0.016 303 HA GLU 51 HA GLU 51 2.134 37.996 -1.005 304 HB2 GLU 51 HB2 GLU 51 3.004 36.637 0.967 305 HB3 GLU 51 HB1 GLU 51 3.130 35.283 -0.144 306 HG2 GLU 51 HG2 GLU 51 4.784 36.363 -1.426 307 HG3 GLU 51 HG1 GLU 51 4.484 37.913 -0.643 308 H CYS 52 HN CYS 52 -0.059 36.404 -2.289 309 HA CYS 52 HA CYS 52 1.180 34.772 -4.261 310 HB2 CYS 52 HB2 CYS 52 -1.103 35.082 -5.397 311 HB3 CYS 52 HB1 CYS 52 -1.062 34.254 -3.841 312 H THR 53 HN THR 53 -0.094 38.057 -4.189 313 HA THR 53 HA THR 53 0.220 39.897 -5.466 314 HB THR 53 HB THR 53 2.515 40.356 -6.271 315 HG1 THR 53 HG1 THR 53 2.722 37.617 -6.034 316 HG21 THR 53 HG21 THR 53 1.936 40.766 -3.946 317 HG22 THR 53 HG22 THR 53 3.610 40.221 -4.075 318 HG23 THR 53 HG23 THR 53 2.357 39.104 -3.534 319 H GLY 54 HN GLY 54 -0.901 37.537 -6.835 320 HA2 GLY 54 HA2 GLY 54 -1.448 38.476 -9.293 321 HA3 GLY 54 HA1 GLY 54 0.107 37.684 -9.528 322 HA PRO 55 HA PRO 55 -3.636 34.697 -9.475 323 HB2 PRO 55 HB2 PRO 55 -3.924 34.238 -12.134 324 HB3 PRO 55 HB1 PRO 55 -4.796 35.499 -11.254 325 HG2 PRO 55 HG2 PRO 55 -2.348 35.727 -12.957 326 HG3 PRO 55 HG1 PRO 55 -3.761 36.794 -12.886 327 HD2 PRO 55 HD2 PRO 55 -1.423 37.371 -11.641 328 HD3 PRO 55 HD1 PRO 55 -2.999 37.884 -11.005 329 H ASP 56 HN ASP 56 -0.479 34.783 -10.798 330 HA ASP 56 HA ASP 56 -0.427 32.007 -11.564 331 HB2 ASP 56 HB2 ASP 56 1.029 33.556 -12.738 332 HB3 ASP 56 HB1 ASP 56 1.833 33.983 -11.229 333 H SER 57 HN SER 57 1.008 33.901 -8.930 334 HA SER 57 HA SER 57 1.734 31.444 -7.555 335 HB2 SER 57 HB2 SER 57 3.323 33.371 -7.629 336 HB3 SER 57 HB1 SER 57 2.163 34.322 -6.703 337 HG SER 57 HG SER 57 2.330 32.471 -5.143 338 H CYS 58 HN CYS 58 -1.047 32.926 -7.955 339 HA CYS 58 HA CYS 58 -2.011 33.379 -5.344 340 HB2 CYS 58 HB2 CYS 58 -2.896 34.177 -7.651 341 HB3 CYS 58 HB1 CYS 58 -3.735 32.631 -7.677 342 H LYS 59 HN LYS 59 -2.104 31.817 -3.887 343 HA LYS 59 HA LYS 59 -2.864 29.130 -4.796 344 HB2 LYS 59 HB2 LYS 59 -1.330 29.892 -2.310 345 HB3 LYS 59 HB1 LYS 59 -1.724 28.258 -2.818 346 HG2 LYS 59 HG2 LYS 59 0.135 30.195 -4.187 347 HG3 LYS 59 HG1 LYS 59 0.564 28.700 -3.361 348 HD2 LYS 59 HD2 LYS 59 -1.081 28.929 -5.884 349 HD3 LYS 59 HD1 LYS 59 0.601 28.413 -5.788 350 HE2 LYS 59 HE2 LYS 59 -0.059 26.475 -4.458 351 HE3 LYS 59 HE1 LYS 59 -1.740 27.004 -4.504 352 HZ1 LYS 59 HZ1 LYS 59 -1.363 25.308 -6.141 353 HZ2 LYS 59 HZ2 LYS 59 -0.092 26.173 -6.827 354 HZ3 LYS 59 HZ3 LYS 59 -1.670 26.769 -6.935 355 H CYS 60 HN CYS 60 -4.222 31.737 -3.435 356 HA CYS 60 HA CYS 60 -5.809 30.178 -1.542 357 HB2 CYS 60 HB2 CYS 60 -6.809 32.575 -1.095 358 HB3 CYS 60 HB1 CYS 60 -5.264 32.103 -0.403 359 H GLY 61 HN GLY 61 -8.115 30.259 -1.589 360 HA2 GLY 61 HA2 GLY 61 -9.090 29.666 -4.182 361 HA3 GLY 61 HA1 GLY 61 -10.043 29.729 -2.714 362 H SER 62 HN SER 62 -11.493 30.493 -4.574 363 HA SER 62 HA SER 62 -11.145 33.210 -5.457 364 HB2 SER 62 HB2 SER 62 -13.483 31.334 -5.849 365 HB3 SER 62 HB1 SER 62 -13.188 32.838 -6.726 366 HG SER 62 HG SER 62 -11.949 30.352 -6.964 367 H SER 63 HN SER 63 -12.004 32.087 -2.570 368 HA SER 63 HA SER 63 -14.134 34.067 -2.179 369 HB2 SER 63 HB2 SER 63 -13.304 31.827 -0.321 370 HB3 SER 63 HB1 SER 63 -14.742 32.838 -0.188 371 HG SER 63 HG SER 63 -15.382 31.959 -2.259 372 H CYS 64 HN CYS 64 -10.989 34.180 -2.218 373 HA CYS 64 HA CYS 64 -10.438 35.186 0.435 374 HB2 CYS 64 HB2 CYS 64 -8.723 33.898 -0.743 375 HB3 CYS 64 HB1 CYS 64 -8.703 35.078 -2.046 376 H SER 65 HN SER 65 -9.108 37.322 0.454 377 HA SER 65 HA SER 65 -10.872 39.419 -0.161 378 HB2 SER 65 HB2 SER 65 -7.938 39.664 0.503 379 HB3 SER 65 HB1 SER 65 -9.208 40.855 0.787 380 HG SER 65 HG SER 65 -10.177 39.282 2.209 381 H CYS 66 HN CYS 66 -8.086 38.084 -1.865 382 HA CYS 66 HA CYS 66 -7.922 40.322 -3.679 383 HB2 CYS 66 HB2 CYS 66 -6.205 38.965 -4.842 384 HB3 CYS 66 HB1 CYS 66 -5.868 39.154 -3.131 385 H LYS 67 HN LYS 67 -10.296 38.315 -3.395 386 HA LYS 67 HA LYS 67 -10.589 37.779 -6.283 387 HB2 LYS 67 HB2 LYS 67 -11.842 36.208 -4.034 388 HB3 LYS 67 HB1 LYS 67 -11.829 35.797 -5.743 389 HG2 LYS 67 HG2 LYS 67 -9.301 36.042 -4.147 390 HG3 LYS 67 HG1 LYS 67 -10.222 34.541 -4.223 391 HD2 LYS 67 HD2 LYS 67 -9.687 34.174 -6.420 392 HD3 LYS 67 HD1 LYS 67 -9.548 35.895 -6.782 393 HE2 LYS 67 HE2 LYS 67 -7.378 34.707 -6.847 394 HE3 LYS 67 HE1 LYS 67 -7.438 36.016 -5.670 395 HZ1 LYS 67 HZ1 LYS 67 -7.745 34.398 -3.920 396 HZ2 LYS 67 HZ2 LYS 67 -6.336 34.081 -4.786 397 HZ3 LYS 67 HZ3 LYS 67 -7.708 33.123 -5.034 Start of MODEL 16 1 HA2 GLY 1 HA1 GLY 1 -13.422 3.041 -21.023 2 HA3 GLY 1 HA2 GLY 1 -14.239 2.736 -22.549 3 H SER 2 HN SER 2 -16.317 3.737 -20.083 4 HA SER 2 HA SER 2 -16.082 6.564 -20.779 5 HB2 SER 2 HB2 SER 2 -18.649 4.965 -20.964 6 HB3 SER 2 HB1 SER 2 -18.537 6.718 -21.113 7 HG SER 2 HG SER 2 -17.202 4.849 -22.796 8 H GLY 3 HN GLY 3 -15.831 7.583 -18.897 9 HA2 GLY 3 HA2 GLY 3 -17.777 7.248 -16.805 10 HA3 GLY 3 HA1 GLY 3 -16.188 6.634 -16.375 11 H LYS 4 HN LYS 4 -16.886 9.442 -18.385 12 HA LYS 4 HA LYS 4 -15.104 11.064 -16.865 13 HB2 LYS 4 HB2 LYS 4 -15.665 12.874 -18.377 14 HB3 LYS 4 HB1 LYS 4 -15.455 11.405 -19.306 15 HG2 LYS 4 HG2 LYS 4 -18.176 12.383 -18.483 16 HG3 LYS 4 HG1 LYS 4 -17.375 12.964 -19.941 17 HD2 LYS 4 HD2 LYS 4 -17.221 10.625 -20.743 18 HD3 LYS 4 HD1 LYS 4 -18.098 10.101 -19.303 19 HE2 LYS 4 HE2 LYS 4 -19.992 11.531 -19.969 20 HE3 LYS 4 HE1 LYS 4 -19.121 11.971 -21.435 21 HZ1 LYS 4 HZ1 LYS 4 -19.197 9.701 -22.161 22 HZ2 LYS 4 HZ2 LYS 4 -20.767 10.191 -21.768 23 HZ3 LYS 4 HZ3 LYS 4 -19.902 9.206 -20.711 24 H GLY 5 HN GLY 5 -15.544 12.724 -15.407 25 HA2 GLY 5 HA2 GLY 5 -18.348 13.111 -14.650 26 HA3 GLY 5 HA1 GLY 5 -17.258 12.471 -13.434 27 H LYS 6 HN LYS 6 -15.768 14.645 -15.572 28 HA LYS 6 HA LYS 6 -15.433 16.560 -13.454 29 HB2 LYS 6 HB2 LYS 6 -13.542 16.108 -14.895 30 HB3 LYS 6 HB1 LYS 6 -14.468 16.544 -16.321 31 HG2 LYS 6 HG2 LYS 6 -14.570 18.855 -15.579 32 HG3 LYS 6 HG1 LYS 6 -13.704 18.434 -14.104 33 HD2 LYS 6 HD2 LYS 6 -12.593 18.062 -16.885 34 HD3 LYS 6 HD1 LYS 6 -12.273 19.471 -15.875 35 HE2 LYS 6 HE2 LYS 6 -11.256 18.042 -14.185 36 HE3 LYS 6 HE1 LYS 6 -11.619 16.615 -15.152 37 HZ1 LYS 6 HZ1 LYS 6 -9.313 17.377 -15.365 38 HZ2 LYS 6 HZ2 LYS 6 -9.852 18.832 -16.027 39 HZ3 LYS 6 HZ3 LYS 6 -10.130 17.377 -16.843 40 H GLY 7 HN GLY 7 -16.389 18.491 -13.224 41 HA2 GLY 7 HA2 GLY 7 -18.220 19.351 -15.364 42 HA3 GLY 7 HA1 GLY 7 -18.717 19.365 -13.677 43 H GLU 8 HN GLU 8 -18.138 21.430 -15.907 44 HA GLU 8 HA GLU 8 -15.989 23.042 -15.021 45 HB2 GLU 8 HB2 GLU 8 -18.440 23.803 -16.608 46 HB3 GLU 8 HB1 GLU 8 -16.985 24.775 -16.447 47 HG2 GLU 8 HG2 GLU 8 -15.711 23.296 -17.731 48 HG3 GLU 8 HG1 GLU 8 -16.897 22.000 -17.570 49 H LYS 9 HN LYS 9 -19.385 22.862 -14.189 50 HA LYS 9 HA LYS 9 -20.610 23.732 -12.481 51 HB2 LYS 9 HB2 LYS 9 -17.921 24.584 -11.414 52 HB3 LYS 9 HB1 LYS 9 -19.422 24.670 -10.511 53 HG2 LYS 9 HG2 LYS 9 -18.244 22.127 -11.601 54 HG3 LYS 9 HG1 LYS 9 -17.986 22.722 -9.960 55 HD2 LYS 9 HD2 LYS 9 -20.670 22.083 -11.182 56 HD3 LYS 9 HD1 LYS 9 -19.771 21.035 -10.083 57 HE2 LYS 9 HE2 LYS 9 -19.837 22.836 -8.386 58 HE3 LYS 9 HE1 LYS 9 -20.840 23.786 -9.475 59 HZ1 LYS 9 HZ1 LYS 9 -22.127 22.563 -7.801 60 HZ2 LYS 9 HZ2 LYS 9 -21.579 21.104 -8.447 61 HZ3 LYS 9 HZ3 LYS 9 -22.544 22.127 -9.377 62 H CYS 10 HN CYS 10 -19.490 25.423 -14.825 63 HA CYS 10 HA CYS 10 -19.563 28.073 -13.768 64 HB2 CYS 10 HB2 CYS 10 -19.431 27.019 -16.575 65 HB3 CYS 10 HB1 CYS 10 -19.523 28.740 -16.208 66 H THR 11 HN THR 11 -21.115 29.436 -13.591 67 HA THR 11 HA THR 11 -23.801 28.533 -14.095 68 HB THR 11 HB THR 11 -24.384 30.661 -12.889 69 HG1 THR 11 HG1 THR 11 -22.627 31.762 -11.898 70 HG21 THR 11 HG21 THR 11 -24.163 28.544 -11.674 71 HG22 THR 11 HG22 THR 11 -23.579 29.888 -10.695 72 HG23 THR 11 HG23 THR 11 -22.431 28.820 -11.498 73 H SER 12 HN SER 12 -25.303 30.487 -14.803 74 HA SER 12 HA SER 12 -24.795 30.973 -17.496 75 HB2 SER 12 HB2 SER 12 -26.671 32.474 -15.662 76 HB3 SER 12 HB1 SER 12 -26.759 32.417 -17.426 77 HG SER 12 HG SER 12 -28.033 30.847 -15.945 78 H ALA 13 HN ALA 13 -23.865 32.810 -14.678 79 HA ALA 13 HA ALA 13 -23.352 35.264 -15.981 80 HB1 ALA 13 HB1 ALA 13 -23.584 35.089 -13.552 81 HB2 ALA 13 HB2 ALA 13 -22.047 35.829 -14.001 82 HB3 ALA 13 HB3 ALA 13 -22.096 34.145 -13.477 83 H CYS 14 HN CYS 14 -21.302 32.464 -15.240 84 HA CYS 14 HA CYS 14 -18.982 33.671 -16.423 85 HB2 CYS 14 HB2 CYS 14 -19.080 31.895 -14.543 86 HB3 CYS 14 HB1 CYS 14 -19.273 30.738 -15.851 87 H ARG 15 HN ARG 15 -21.592 31.660 -17.481 88 HA ARG 15 HA ARG 15 -20.350 30.704 -19.882 89 HB2 ARG 15 HB2 ARG 15 -23.233 30.849 -19.020 90 HB3 ARG 15 HB1 ARG 15 -22.723 30.167 -20.554 91 HG2 ARG 15 HG2 ARG 15 -21.918 29.169 -17.832 92 HG3 ARG 15 HG1 ARG 15 -23.141 28.452 -18.883 93 HD2 ARG 15 HD2 ARG 15 -21.296 28.243 -20.622 94 HD3 ARG 15 HD1 ARG 15 -20.173 28.616 -19.314 95 HE ARG 15 HE ARG 15 -22.005 26.478 -18.733 96 HH11 ARG 15 HH11 ARG 15 -18.860 27.290 -20.077 97 HH12 ARG 15 HH12 ARG 15 -18.232 25.682 -19.907 98 HH21 ARG 15 HH21 ARG 15 -21.170 24.360 -18.520 99 HH22 ARG 15 HH22 ARG 15 -19.552 24.015 -19.041 100 H SER 16 HN SER 16 -21.761 33.650 -18.946 101 HA SER 16 HA SER 16 -22.828 34.548 -21.372 102 HB2 SER 16 HB2 SER 16 -23.266 35.628 -19.199 103 HB3 SER 16 HB1 SER 16 -21.582 36.143 -19.131 104 HG SER 16 HG SER 16 -21.926 37.591 -20.686 105 H GLU 17 HN GLU 17 -21.937 36.213 -22.744 106 HA GLU 17 HA GLU 17 -19.017 36.149 -22.958 107 HB2 GLU 17 HB2 GLU 17 -20.940 35.858 -25.274 108 HB3 GLU 17 HB1 GLU 17 -19.186 35.900 -25.384 109 HG2 GLU 17 HG2 GLU 17 -19.051 33.828 -24.109 110 HG3 GLU 17 HG1 GLU 17 -20.807 33.786 -23.986 111 HA PRO 18 HA PRO 18 -17.539 37.376 -22.683 112 HB2 PRO 18 HB2 PRO 18 -16.712 39.389 -21.098 113 HB3 PRO 18 HB1 PRO 18 -16.431 39.396 -22.844 114 HG2 PRO 18 HG2 PRO 18 -18.554 40.794 -21.262 115 HG3 PRO 18 HG1 PRO 18 -17.556 41.416 -22.588 116 HD2 PRO 18 HD2 PRO 18 -20.110 40.564 -22.943 117 HD3 PRO 18 HD1 PRO 18 -18.868 40.440 -24.206 118 H CYS 19 HN CYS 19 -16.794 36.987 -20.421 119 HA CYS 19 HA CYS 19 -18.771 35.810 -18.876 120 HB2 CYS 19 HB2 CYS 19 -16.515 35.069 -18.691 121 HB3 CYS 19 HB1 CYS 19 -15.965 36.667 -18.200 122 H GLN 20 HN GLN 20 -19.831 36.341 -17.010 123 HA GLN 20 HA GLN 20 -19.714 39.166 -16.147 124 HB2 GLN 20 HB2 GLN 20 -22.111 37.330 -16.165 125 HB3 GLN 20 HB1 GLN 20 -22.094 39.001 -15.628 126 HG2 GLN 20 HG2 GLN 20 -21.493 38.101 -18.425 127 HG3 GLN 20 HG1 GLN 20 -23.062 38.646 -17.858 128 HE21 GLN 20 HE21 GLN 20 -19.846 39.590 -18.698 129 HE22 GLN 20 HE22 GLN 20 -20.122 41.296 -18.714 130 H CYS 21 HN CYS 21 -18.533 36.449 -15.220 131 HA CYS 21 HA CYS 21 -19.688 35.957 -12.655 132 HB2 CYS 21 HB2 CYS 21 -17.517 34.856 -14.231 133 HB3 CYS 21 HB1 CYS 21 -17.052 35.034 -12.547 134 H GLY 22 HN GLY 22 -17.933 38.545 -13.758 135 HA2 GLY 22 HA2 GLY 22 -16.212 39.065 -11.557 136 HA3 GLY 22 HA1 GLY 22 -16.742 40.232 -12.757 137 H SER 23 HN SER 23 -19.599 39.317 -11.904 138 HA SER 23 HA SER 23 -19.992 41.467 -10.079 139 HB2 SER 23 HB2 SER 23 -21.695 40.854 -11.761 140 HB3 SER 23 HB1 SER 23 -21.939 39.312 -10.945 141 HG SER 23 HG SER 23 -22.181 41.659 -9.442 142 H LYS 24 HN LYS 24 -20.182 37.925 -9.775 143 HA LYS 24 HA LYS 24 -19.667 38.211 -6.910 144 HB2 LYS 24 HB2 LYS 24 -21.959 36.640 -8.079 145 HB3 LYS 24 HB1 LYS 24 -21.366 36.418 -6.442 146 HG2 LYS 24 HG2 LYS 24 -21.880 38.786 -5.973 147 HG3 LYS 24 HG1 LYS 24 -22.567 38.924 -7.593 148 HD2 LYS 24 HD2 LYS 24 -24.213 37.218 -7.061 149 HD3 LYS 24 HD1 LYS 24 -23.500 37.009 -5.460 150 HE2 LYS 24 HE2 LYS 24 -24.040 39.339 -4.931 151 HE3 LYS 24 HE1 LYS 24 -24.776 39.524 -6.521 152 HZ1 LYS 24 HZ1 LYS 24 -25.674 37.682 -4.380 153 HZ2 LYS 24 HZ2 LYS 24 -26.366 37.795 -5.920 154 HZ3 LYS 24 HZ3 LYS 24 -26.446 39.106 -4.863 155 H CYS 25 HN CYS 25 -19.989 36.021 -9.658 156 HA CYS 25 HA CYS 25 -18.726 34.307 -10.396 157 HB2 CYS 25 HB2 CYS 25 -16.783 35.696 -9.604 158 HB3 CYS 25 HB1 CYS 25 -16.833 34.796 -8.092 159 H GLN 26 HN GLN 26 -20.009 32.629 -10.136 160 HA GLN 26 HA GLN 26 -19.953 31.219 -7.548 161 HB2 GLN 26 HB2 GLN 26 -22.171 32.375 -8.903 162 HB3 GLN 26 HB1 GLN 26 -22.355 30.629 -8.962 163 HG2 GLN 26 HG2 GLN 26 -22.113 30.546 -6.516 164 HG3 GLN 26 HG1 GLN 26 -21.991 32.306 -6.493 165 HE21 GLN 26 HE21 GLN 26 -23.814 33.536 -6.827 166 HE22 GLN 26 HE22 GLN 26 -25.413 32.872 -6.841 167 H CYS 27 HN CYS 27 -18.654 30.994 -10.379 168 HA CYS 27 HA CYS 27 -19.610 28.425 -11.317 169 HB2 CYS 27 HB2 CYS 27 -18.044 28.693 -13.078 170 HB3 CYS 27 HB1 CYS 27 -18.717 30.300 -12.788 171 H GLY 28 HN GLY 28 -17.592 26.961 -11.990 172 HA2 GLY 28 HA2 GLY 28 -16.227 26.272 -9.526 173 HA3 GLY 28 HA1 GLY 28 -16.223 25.339 -11.022 174 H GLU 29 HN GLU 29 -14.160 26.711 -9.152 175 HA GLU 29 HA GLU 29 -12.876 28.618 -10.839 176 HB2 GLU 29 HB2 GLU 29 -10.947 28.045 -9.033 177 HB3 GLU 29 HB1 GLU 29 -12.258 29.180 -8.751 178 HG2 GLU 29 HG2 GLU 29 -11.941 27.670 -6.863 179 HG3 GLU 29 HG1 GLU 29 -13.528 27.473 -7.594 180 H GLY 30 HN GLY 30 -13.239 25.805 -11.743 181 HA2 GLY 30 HA2 GLY 30 -10.452 25.259 -12.515 182 HA3 GLY 30 HA1 GLY 30 -11.726 24.046 -12.468 183 H CYS 31 HN CYS 31 -12.862 26.993 -13.621 184 HA CYS 31 HA CYS 31 -13.184 25.955 -16.288 185 HB2 CYS 31 HB2 CYS 31 -14.543 27.861 -16.684 186 HB3 CYS 31 HB1 CYS 31 -14.878 27.366 -15.029 187 H THR 32 HN THR 32 -10.875 27.772 -14.647 188 HA THR 32 HA THR 32 -9.074 29.012 -15.168 189 HB THR 32 HB THR 32 -7.825 28.489 -17.248 190 HG1 THR 32 HG1 THR 32 -10.263 27.644 -18.089 191 HG21 THR 32 HG21 THR 32 -8.950 26.057 -15.860 192 HG22 THR 32 HG22 THR 32 -7.581 27.025 -15.313 193 HG23 THR 32 HG23 THR 32 -7.467 26.100 -16.811 194 H CYS 33 HN CYS 33 -11.748 30.096 -15.756 195 HA CYS 33 HA CYS 33 -11.735 31.640 -18.091 196 HB2 CYS 33 HB2 CYS 33 -13.663 31.151 -16.444 197 HB3 CYS 33 HB1 CYS 33 -13.034 32.506 -15.518 198 H ALA 34 HN ALA 34 -10.713 33.431 -18.599 199 HA ALA 34 HA ALA 34 -8.812 34.538 -16.689 200 HB1 ALA 34 HB1 ALA 34 -7.803 35.602 -18.647 201 HB2 ALA 34 HB2 ALA 34 -9.115 34.994 -19.656 202 HB3 ALA 34 HB3 ALA 34 -7.996 33.867 -18.892 203 H ALA 35 HN ALA 35 -11.612 35.071 -16.408 204 HA ALA 35 HA ALA 35 -11.557 37.981 -16.732 205 HB1 ALA 35 HB1 ALA 35 -13.087 37.035 -18.394 206 HB2 ALA 35 HB2 ALA 35 -13.955 37.983 -17.186 207 HB3 ALA 35 HB3 ALA 35 -13.976 36.221 -17.107 208 H CYS 36 HN CYS 36 -13.150 35.289 -15.064 209 HA CYS 36 HA CYS 36 -13.548 37.060 -12.775 210 HB2 CYS 36 HB2 CYS 36 -14.971 35.251 -11.891 211 HB3 CYS 36 HB1 CYS 36 -15.486 35.835 -13.469 212 H LYS 37 HN LYS 37 -11.948 34.047 -13.681 213 HA LYS 37 HA LYS 37 -10.939 33.722 -11.005 214 HB2 LYS 37 HB2 LYS 37 -11.508 31.707 -12.285 215 HB3 LYS 37 HB1 LYS 37 -10.284 32.123 -13.484 216 HG2 LYS 37 HG2 LYS 37 -8.579 32.027 -11.654 217 HG3 LYS 37 HG1 LYS 37 -9.838 31.393 -10.599 218 HD2 LYS 37 HD2 LYS 37 -10.114 29.468 -12.052 219 HD3 LYS 37 HD1 LYS 37 -8.916 30.124 -13.175 220 HE2 LYS 37 HE2 LYS 37 -7.231 30.051 -11.369 221 HE3 LYS 37 HE1 LYS 37 -8.430 29.314 -10.309 222 HZ1 LYS 37 HZ1 LYS 37 -8.552 27.432 -11.814 223 HZ2 LYS 37 HZ2 LYS 37 -6.964 27.674 -11.290 224 HZ3 LYS 37 HZ3 LYS 37 -7.414 28.155 -12.841 225 H THR 38 HN THR 38 -9.318 34.813 -10.307 226 HA THR 38 HA THR 38 -6.786 34.818 -11.458 227 HB THR 38 HB THR 38 -7.855 36.448 -13.058 228 HG1 THR 38 HG1 THR 38 -5.930 37.298 -13.129 229 HG21 THR 38 HG21 THR 38 -8.128 38.183 -10.592 230 HG22 THR 38 HG22 THR 38 -9.460 37.477 -11.507 231 HG23 THR 38 HG23 THR 38 -8.430 38.699 -12.252 232 H CYS 39 HN CYS 39 -5.539 36.767 -10.264 233 HA CYS 39 HA CYS 39 -6.362 36.505 -7.474 234 HB2 CYS 39 HB2 CYS 39 -4.069 35.812 -7.985 235 HB3 CYS 39 HB1 CYS 39 -3.726 37.409 -8.645 236 H ASN 40 HN ASN 40 -6.929 38.217 -6.272 237 HA ASN 40 HA ASN 40 -7.434 40.679 -7.727 238 HB2 ASN 40 HB2 ASN 40 -8.326 39.611 -5.068 239 HB3 ASN 40 HB1 ASN 40 -8.537 41.313 -5.467 240 HD21 ASN 40 HD21 ASN 40 -9.441 38.039 -6.311 241 HD22 ASN 40 HD22 ASN 40 -10.847 38.465 -7.215 242 H CYS 41 HN CYS 41 -4.928 39.478 -5.964 243 HA CYS 41 HA CYS 41 -4.212 41.882 -4.570 244 HB2 CYS 41 HB2 CYS 41 -2.575 39.414 -5.127 245 HB3 CYS 41 HB1 CYS 41 -2.194 40.681 -3.966 246 H THR 42 HN THR 42 -2.856 43.433 -5.209 247 HA THR 42 HA THR 42 -1.838 43.266 -7.953 248 HB THR 42 HB THR 42 -1.753 45.734 -7.854 249 HG1 THR 42 HG1 THR 42 -3.082 46.500 -5.852 250 HG21 THR 42 HG21 THR 42 -3.810 44.664 -8.657 251 HG22 THR 42 HG22 THR 42 -4.182 46.149 -7.782 252 HG23 THR 42 HG23 THR 42 -4.418 44.583 -7.003 253 H SER 43 HN SER 43 0.234 44.668 -8.206 254 HA SER 43 HA SER 43 2.192 43.629 -6.402 255 HB2 SER 43 HB2 SER 43 3.788 44.976 -7.816 256 HB3 SER 43 HB1 SER 43 2.806 43.823 -8.719 257 HG SER 43 HG SER 43 3.020 46.417 -9.100 258 H ASP 44 HN ASP 44 0.155 46.263 -6.340 259 HA ASP 44 HA ASP 44 1.834 48.127 -4.952 260 HB2 ASP 44 HB2 ASP 44 -0.054 48.985 -6.196 261 HB3 ASP 44 HB1 ASP 44 -1.167 47.959 -5.298 262 H GLY 45 HN GLY 45 -0.573 45.711 -4.075 263 HA2 GLY 45 HA2 GLY 45 0.596 45.334 -1.519 264 HA3 GLY 45 HA1 GLY 45 -0.910 46.236 -1.410 265 H CYS 46 HN CYS 46 0.068 43.415 -0.737 266 HA CYS 46 HA CYS 46 -1.518 41.649 -2.288 267 HB2 CYS 46 HB2 CYS 46 0.477 41.019 -0.858 268 HB3 CYS 46 HB1 CYS 46 -0.562 41.211 0.548 269 H LYS 47 HN LYS 47 -3.630 41.193 -2.138 270 HA LYS 47 HA LYS 47 -5.231 42.768 -0.329 271 HB2 LYS 47 HB2 LYS 47 -5.976 40.841 -2.520 272 HB3 LYS 47 HB1 LYS 47 -7.145 41.732 -1.562 273 HG2 LYS 47 HG2 LYS 47 -5.017 43.035 -3.247 274 HG3 LYS 47 HG1 LYS 47 -6.658 42.709 -3.806 275 HD2 LYS 47 HD2 LYS 47 -7.077 44.786 -3.048 276 HD3 LYS 47 HD1 LYS 47 -7.129 44.010 -1.467 277 HE2 LYS 47 HE2 LYS 47 -4.755 44.539 -1.132 278 HE3 LYS 47 HE1 LYS 47 -4.710 45.310 -2.717 279 HZ1 LYS 47 HZ1 LYS 47 -6.338 46.172 -0.391 280 HZ2 LYS 47 HZ2 LYS 47 -6.388 46.885 -1.925 281 HZ3 LYS 47 HZ3 LYS 47 -4.974 46.958 -1.009 282 H CYS 48 HN CYS 48 -4.497 39.344 -0.803 283 HA CYS 48 HA CYS 48 -6.357 38.622 1.307 284 HB2 CYS 48 HB2 CYS 48 -5.853 36.343 0.766 285 HB3 CYS 48 HB1 CYS 48 -6.038 37.226 -0.752 286 H GLY 49 HN GLY 49 -2.881 38.843 0.800 287 HA2 GLY 49 HA2 GLY 49 -1.493 39.502 2.658 288 HA3 GLY 49 HA1 GLY 49 -2.553 38.584 3.716 289 H LYS 50 HN LYS 50 -1.822 36.980 0.782 290 HA LYS 50 HA LYS 50 -0.022 35.189 2.235 291 HB2 LYS 50 HB2 LYS 50 -1.269 34.846 -0.501 292 HB3 LYS 50 HB1 LYS 50 -0.358 33.627 0.376 293 HG2 LYS 50 HG2 LYS 50 -3.019 34.796 1.162 294 HG3 LYS 50 HG1 LYS 50 -2.719 33.173 0.543 295 HD2 LYS 50 HD2 LYS 50 -1.424 32.628 2.526 296 HD3 LYS 50 HD1 LYS 50 -1.616 34.276 3.129 297 HE2 LYS 50 HE2 LYS 50 -4.057 33.937 3.189 298 HE3 LYS 50 HE1 LYS 50 -3.817 32.270 2.668 299 HZ1 LYS 50 HZ1 LYS 50 -4.106 32.435 5.057 300 HZ2 LYS 50 HZ2 LYS 50 -2.772 33.463 5.175 301 HZ3 LYS 50 HZ3 LYS 50 -2.562 31.858 4.685 302 H GLU 51 HN GLU 51 0.305 37.885 0.528 303 HA GLU 51 HA GLU 51 1.990 38.980 -0.487 304 HB2 GLU 51 HB2 GLU 51 3.243 37.897 1.477 305 HB3 GLU 51 HB1 GLU 51 3.855 36.745 0.298 306 HG2 GLU 51 HG2 GLU 51 5.016 38.427 -0.889 307 HG3 GLU 51 HG1 GLU 51 4.181 39.714 -0.023 308 H CYS 52 HN CYS 52 0.404 37.146 -1.979 309 HA CYS 52 HA CYS 52 2.116 35.940 -3.956 310 HB2 CYS 52 HB2 CYS 52 -0.217 35.760 -5.107 311 HB3 CYS 52 HB1 CYS 52 0.148 34.754 -3.698 312 H THR 53 HN THR 53 -0.155 38.629 -3.779 313 HA THR 53 HA THR 53 -0.449 40.530 -4.958 314 HB THR 53 HB THR 53 1.613 41.772 -5.623 315 HG1 THR 53 HG1 THR 53 2.683 39.273 -5.421 316 HG21 THR 53 HG21 THR 53 0.711 41.923 -3.360 317 HG22 THR 53 HG22 THR 53 2.474 41.994 -3.335 318 HG23 THR 53 HG23 THR 53 1.642 40.505 -2.883 319 H GLY 54 HN GLY 54 -0.917 38.215 -6.493 320 HA2 GLY 54 HA2 GLY 54 -1.624 38.970 -8.870 321 HA3 GLY 54 HA1 GLY 54 0.116 38.957 -9.124 322 HA PRO 55 HA PRO 55 -2.093 34.689 -9.623 323 HB2 PRO 55 HB2 PRO 55 -1.921 34.561 -12.369 324 HB3 PRO 55 HB1 PRO 55 -3.356 35.070 -11.474 325 HG2 PRO 55 HG2 PRO 55 -1.252 36.741 -12.791 326 HG3 PRO 55 HG1 PRO 55 -3.010 36.976 -12.756 327 HD2 PRO 55 HD2 PRO 55 -1.363 38.393 -11.180 328 HD3 PRO 55 HD1 PRO 55 -2.971 37.882 -10.627 329 H ASP 56 HN ASP 56 0.679 36.275 -11.061 330 HA ASP 56 HA ASP 56 2.061 33.993 -11.950 331 HB2 ASP 56 HB2 ASP 56 2.739 36.209 -12.662 332 HB3 ASP 56 HB1 ASP 56 3.149 36.648 -11.007 333 H SER 57 HN SER 57 2.440 35.823 -8.919 334 HA SER 57 HA SER 57 3.969 33.579 -7.825 335 HB2 SER 57 HB2 SER 57 3.568 36.357 -6.699 336 HB3 SER 57 HB1 SER 57 4.693 35.135 -6.106 337 HG SER 57 HG SER 57 4.954 35.690 -8.785 338 H CYS 58 HN CYS 58 0.920 33.791 -8.139 339 HA CYS 58 HA CYS 58 -0.070 33.981 -5.483 340 HB2 CYS 58 HB2 CYS 58 -1.315 34.386 -7.718 341 HB3 CYS 58 HB1 CYS 58 -1.540 32.639 -7.720 342 H LYS 59 HN LYS 59 0.545 32.587 -4.040 343 HA LYS 59 HA LYS 59 1.171 29.864 -4.746 344 HB2 LYS 59 HB2 LYS 59 1.136 31.109 -2.000 345 HB3 LYS 59 HB1 LYS 59 1.948 29.628 -2.486 346 HG2 LYS 59 HG2 LYS 59 2.648 32.426 -3.349 347 HG3 LYS 59 HG1 LYS 59 3.555 31.395 -2.240 348 HD2 LYS 59 HD2 LYS 59 4.030 29.832 -4.024 349 HD3 LYS 59 HD1 LYS 59 3.022 30.754 -5.140 350 HE2 LYS 59 HE2 LYS 59 5.388 31.232 -5.497 351 HE3 LYS 59 HE1 LYS 59 4.525 32.663 -4.939 352 HZ1 LYS 59 HZ1 LYS 59 5.391 32.300 -2.728 353 HZ2 LYS 59 HZ2 LYS 59 6.666 32.372 -3.840 354 HZ3 LYS 59 HZ3 LYS 59 6.167 30.881 -3.230 355 H CYS 60 HN CYS 60 -1.509 31.600 -3.510 356 HA CYS 60 HA CYS 60 -2.700 29.145 -2.498 357 HB2 CYS 60 HB2 CYS 60 -4.648 30.846 -1.963 358 HB3 CYS 60 HB1 CYS 60 -3.222 30.768 -0.940 359 H GLY 61 HN GLY 61 -4.335 28.089 -3.478 360 HA2 GLY 61 HA2 GLY 61 -5.100 29.147 -6.118 361 HA3 GLY 61 HA1 GLY 61 -4.722 27.452 -5.846 362 H SER 62 HN SER 62 -7.143 29.629 -6.178 363 HA SER 62 HA SER 62 -9.388 29.575 -5.938 364 HB2 SER 62 HB2 SER 62 -8.885 26.662 -5.309 365 HB3 SER 62 HB1 SER 62 -10.471 27.361 -5.625 366 HG SER 62 HG SER 62 -9.806 26.586 -7.550 367 H SER 63 HN SER 63 -11.161 29.376 -4.392 368 HA SER 63 HA SER 63 -12.189 29.488 -2.397 369 HB2 SER 63 HB2 SER 63 -9.810 28.012 -1.276 370 HB3 SER 63 HB1 SER 63 -11.419 28.126 -0.562 371 HG SER 63 HG SER 63 -12.059 27.176 -2.756 372 H CYS 64 HN CYS 64 -8.922 30.770 -2.540 373 HA CYS 64 HA CYS 64 -9.051 32.062 -0.001 374 HB2 CYS 64 HB2 CYS 64 -6.925 31.491 -1.156 375 HB3 CYS 64 HB1 CYS 64 -7.277 32.738 -2.349 376 H SER 65 HN SER 65 -8.881 34.457 0.236 377 HA SER 65 HA SER 65 -11.217 35.649 -0.778 378 HB2 SER 65 HB2 SER 65 -10.115 37.734 0.345 379 HB3 SER 65 HB1 SER 65 -10.649 36.383 1.345 380 HG SER 65 HG SER 65 -8.660 36.464 2.036 381 H CYS 66 HN CYS 66 -7.891 35.711 -1.876 382 HA CYS 66 HA CYS 66 -8.337 38.003 -3.563 383 HB2 CYS 66 HB2 CYS 66 -6.088 37.596 -4.438 384 HB3 CYS 66 HB1 CYS 66 -6.082 37.573 -2.682 385 H LYS 67 HN LYS 67 -9.503 34.999 -3.714 386 HA LYS 67 HA LYS 67 -9.215 34.678 -6.620 387 HB2 LYS 67 HB2 LYS 67 -10.452 32.789 -4.608 388 HB3 LYS 67 HB1 LYS 67 -10.100 32.436 -6.293 389 HG2 LYS 67 HG2 LYS 67 -7.981 33.139 -4.280 390 HG3 LYS 67 HG1 LYS 67 -8.492 31.480 -4.606 391 HD2 LYS 67 HD2 LYS 67 -7.097 31.411 -6.334 392 HD3 LYS 67 HD1 LYS 67 -7.962 32.748 -7.092 393 HE2 LYS 67 HE2 LYS 67 -5.628 33.324 -6.872 394 HE3 LYS 67 HE1 LYS 67 -6.595 34.316 -5.778 395 HZ1 LYS 67 HZ1 LYS 67 -4.593 33.540 -4.728 396 HZ2 LYS 67 HZ2 LYS 67 -4.997 31.928 -5.011 397 HZ3 LYS 67 HZ3 LYS 67 -5.936 32.875 -3.957 Start of MODEL 17 1 HA2 GLY 1 HA1 GLY 1 -17.329 8.030 -23.755 2 HA3 GLY 1 HA2 GLY 1 -17.250 9.179 -22.428 3 H SER 2 HN SER 2 -18.786 7.258 -21.782 4 HA SER 2 HA SER 2 -21.467 7.433 -22.745 5 HB2 SER 2 HB2 SER 2 -20.438 6.138 -20.209 6 HB3 SER 2 HB1 SER 2 -21.978 5.815 -21.008 7 HG SER 2 HG SER 2 -20.371 5.369 -22.893 8 H GLY 3 HN GLY 3 -22.734 9.122 -22.320 9 HA2 GLY 3 HA2 GLY 3 -24.018 10.535 -21.011 10 HA3 GLY 3 HA1 GLY 3 -23.172 9.936 -19.594 11 H LYS 4 HN LYS 4 -22.731 12.027 -22.419 12 HA LYS 4 HA LYS 4 -20.808 13.593 -20.862 13 HB2 LYS 4 HB2 LYS 4 -21.341 13.393 -23.813 14 HB3 LYS 4 HB1 LYS 4 -20.441 14.742 -23.139 15 HG2 LYS 4 HG2 LYS 4 -19.692 11.832 -22.907 16 HG3 LYS 4 HG1 LYS 4 -18.958 13.011 -23.996 17 HD2 LYS 4 HD2 LYS 4 -18.333 14.360 -21.971 18 HD3 LYS 4 HD1 LYS 4 -18.887 13.012 -20.979 19 HE2 LYS 4 HE2 LYS 4 -16.504 12.861 -21.237 20 HE3 LYS 4 HE1 LYS 4 -17.262 11.548 -22.135 21 HZ1 LYS 4 HZ1 LYS 4 -16.972 12.820 -24.171 22 HZ2 LYS 4 HZ2 LYS 4 -15.484 12.603 -23.400 23 HZ3 LYS 4 HZ3 LYS 4 -16.271 14.089 -23.306 24 H GLY 5 HN GLY 5 -20.957 16.055 -21.784 25 HA2 GLY 5 HA2 GLY 5 -22.857 17.615 -22.391 26 HA3 GLY 5 HA1 GLY 5 -23.694 16.846 -21.047 27 H LYS 6 HN LYS 6 -21.226 16.621 -19.487 28 HA LYS 6 HA LYS 6 -20.935 19.452 -18.752 29 HB2 LYS 6 HB2 LYS 6 -20.915 16.994 -17.012 30 HB3 LYS 6 HB1 LYS 6 -20.405 18.578 -16.450 31 HG2 LYS 6 HG2 LYS 6 -22.625 19.464 -16.881 32 HG3 LYS 6 HG1 LYS 6 -23.140 17.893 -17.500 33 HD2 LYS 6 HD2 LYS 6 -22.748 16.880 -15.335 34 HD3 LYS 6 HD1 LYS 6 -22.131 18.409 -14.708 35 HE2 LYS 6 HE2 LYS 6 -24.285 19.443 -15.006 36 HE3 LYS 6 HE1 LYS 6 -24.919 17.982 -15.759 37 HZ1 LYS 6 HZ1 LYS 6 -23.943 18.162 -12.957 38 HZ2 LYS 6 HZ2 LYS 6 -24.626 16.803 -13.686 39 HZ3 LYS 6 HZ3 LYS 6 -25.566 18.177 -13.420 40 H GLY 7 HN GLY 7 -19.075 20.127 -19.532 41 HA2 GLY 7 HA2 GLY 7 -16.683 18.467 -18.994 42 HA3 GLY 7 HA1 GLY 7 -16.853 19.423 -20.460 43 H GLU 8 HN GLU 8 -18.240 21.313 -18.319 44 HA GLU 8 HA GLU 8 -15.712 22.541 -17.507 45 HB2 GLU 8 HB2 GLU 8 -18.321 23.925 -18.174 46 HB3 GLU 8 HB1 GLU 8 -16.870 24.721 -17.590 47 HG2 GLU 8 HG2 GLU 8 -16.895 25.110 -19.894 48 HG3 GLU 8 HG1 GLU 8 -15.722 23.816 -19.668 49 H LYS 9 HN LYS 9 -15.616 23.385 -15.491 50 HA LYS 9 HA LYS 9 -17.635 22.393 -13.602 51 HB2 LYS 9 HB2 LYS 9 -14.892 23.528 -13.022 52 HB3 LYS 9 HB1 LYS 9 -15.934 22.663 -11.900 53 HG2 LYS 9 HG2 LYS 9 -15.706 20.631 -13.224 54 HG3 LYS 9 HG1 LYS 9 -14.687 21.485 -14.377 55 HD2 LYS 9 HD2 LYS 9 -13.286 20.207 -12.911 56 HD3 LYS 9 HD1 LYS 9 -13.072 21.916 -12.535 57 HE2 LYS 9 HE2 LYS 9 -14.487 21.727 -10.606 58 HE3 LYS 9 HE1 LYS 9 -14.916 20.068 -11.025 59 HZ1 LYS 9 HZ1 LYS 9 -12.639 19.406 -10.640 60 HZ2 LYS 9 HZ2 LYS 9 -13.239 20.184 -9.268 61 HZ3 LYS 9 HZ3 LYS 9 -12.185 20.997 -10.299 62 H CYS 10 HN CYS 10 -18.054 24.709 -15.280 63 HA CYS 10 HA CYS 10 -18.189 26.810 -13.248 64 HB2 CYS 10 HB2 CYS 10 -17.754 27.156 -16.215 65 HB3 CYS 10 HB1 CYS 10 -17.909 28.453 -15.035 66 H THR 11 HN THR 11 -19.905 28.393 -13.577 67 HA THR 11 HA THR 11 -22.372 27.038 -14.203 68 HB THR 11 HB THR 11 -23.373 29.205 -13.330 69 HG1 THR 11 HG1 THR 11 -21.960 30.639 -12.341 70 HG21 THR 11 HG21 THR 11 -23.131 27.225 -11.916 71 HG22 THR 11 HG22 THR 11 -22.806 28.691 -10.990 72 HG23 THR 11 HG23 THR 11 -21.470 27.681 -11.541 73 H SER 12 HN SER 12 -24.104 28.520 -15.241 74 HA SER 12 HA SER 12 -23.513 28.877 -17.926 75 HB2 SER 12 HB2 SER 12 -25.736 30.264 -16.426 76 HB3 SER 12 HB1 SER 12 -25.720 29.771 -18.121 77 HG SER 12 HG SER 12 -26.468 27.927 -17.492 78 H ALA 13 HN ALA 13 -23.493 31.189 -15.265 79 HA ALA 13 HA ALA 13 -23.266 33.541 -16.774 80 HB1 ALA 13 HB1 ALA 13 -22.219 32.996 -14.001 81 HB2 ALA 13 HB2 ALA 13 -23.856 33.520 -14.400 82 HB3 ALA 13 HB3 ALA 13 -22.487 34.584 -14.720 83 H CYS 14 HN CYS 14 -20.763 31.450 -15.370 84 HA CYS 14 HA CYS 14 -18.592 33.035 -16.278 85 HB2 CYS 14 HB2 CYS 14 -18.524 31.356 -14.411 86 HB3 CYS 14 HB1 CYS 14 -18.581 30.090 -15.627 87 H ARG 15 HN ARG 15 -20.502 30.482 -17.665 88 HA ARG 15 HA ARG 15 -18.766 30.020 -19.911 89 HB2 ARG 15 HB2 ARG 15 -21.598 29.174 -19.311 90 HB3 ARG 15 HB1 ARG 15 -20.776 28.755 -20.806 91 HG2 ARG 15 HG2 ARG 15 -19.796 28.017 -18.056 92 HG3 ARG 15 HG1 ARG 15 -20.734 26.957 -19.112 93 HD2 ARG 15 HD2 ARG 15 -18.019 28.133 -19.715 94 HD3 ARG 15 HD1 ARG 15 -18.357 26.461 -19.274 95 HE ARG 15 HE ARG 15 -19.904 26.881 -21.469 96 HH11 ARG 15 HH11 ARG 15 -16.486 27.224 -20.795 97 HH12 ARG 15 HH12 ARG 15 -15.995 26.901 -22.420 98 HH21 ARG 15 HH21 ARG 15 -19.274 26.477 -23.633 99 HH22 ARG 15 HH22 ARG 15 -17.600 26.492 -24.055 100 H SER 16 HN SER 16 -20.664 32.594 -19.154 101 HA SER 16 HA SER 16 -21.762 33.068 -21.782 102 HB2 SER 16 HB2 SER 16 -21.663 34.841 -19.333 103 HB3 SER 16 HB1 SER 16 -22.579 35.179 -20.801 104 HG SER 16 HG SER 16 -22.960 32.763 -19.386 105 H GLU 17 HN GLU 17 -21.305 35.176 -22.863 106 HA GLU 17 HA GLU 17 -18.559 36.105 -22.449 107 HB2 GLU 17 HB2 GLU 17 -18.563 34.531 -24.334 108 HB3 GLU 17 HB1 GLU 17 -19.815 35.478 -25.127 109 HG2 GLU 17 HG2 GLU 17 -18.194 37.403 -25.114 110 HG3 GLU 17 HG1 GLU 17 -16.964 36.255 -24.589 111 HA PRO 18 HA PRO 18 -17.478 37.766 -22.214 112 HB2 PRO 18 HB2 PRO 18 -17.474 39.732 -20.344 113 HB3 PRO 18 HB1 PRO 18 -17.125 40.048 -22.048 114 HG2 PRO 18 HG2 PRO 18 -19.690 40.421 -20.544 115 HG3 PRO 18 HG1 PRO 18 -18.902 41.515 -21.697 116 HD2 PRO 18 HD2 PRO 18 -20.962 39.918 -22.404 117 HD3 PRO 18 HD1 PRO 18 -19.652 40.328 -23.531 118 H CYS 19 HN CYS 19 -16.715 37.447 -19.893 119 HA CYS 19 HA CYS 19 -18.210 35.434 -18.692 120 HB2 CYS 19 HB2 CYS 19 -15.691 36.044 -18.513 121 HB3 CYS 19 HB1 CYS 19 -16.198 37.071 -17.178 122 H GLN 20 HN GLN 20 -20.034 35.563 -17.561 123 HA GLN 20 HA GLN 20 -20.788 38.136 -16.346 124 HB2 GLN 20 HB2 GLN 20 -22.480 35.752 -17.077 125 HB3 GLN 20 HB1 GLN 20 -23.081 37.248 -16.378 126 HG2 GLN 20 HG2 GLN 20 -21.757 36.934 -19.051 127 HG3 GLN 20 HG1 GLN 20 -23.474 37.166 -18.744 128 HE21 GLN 20 HE21 GLN 20 -20.385 38.650 -18.911 129 HE22 GLN 20 HE22 GLN 20 -20.915 40.290 -18.735 130 H CYS 21 HN CYS 21 -19.158 35.735 -15.320 131 HA CYS 21 HA CYS 21 -20.643 34.677 -13.136 132 HB2 CYS 21 HB2 CYS 21 -18.524 33.763 -14.334 133 HB3 CYS 21 HB1 CYS 21 -17.657 34.810 -13.234 134 H GLY 22 HN GLY 22 -18.924 37.588 -13.727 135 HA2 GLY 22 HA2 GLY 22 -18.573 39.482 -12.506 136 HA3 GLY 22 HA1 GLY 22 -19.873 38.918 -11.470 137 H SER 23 HN SER 23 -18.809 39.775 -9.674 138 HA SER 23 HA SER 23 -16.321 38.472 -8.938 139 HB2 SER 23 HB2 SER 23 -17.819 40.762 -7.661 140 HB3 SER 23 HB1 SER 23 -16.306 40.091 -7.047 141 HG SER 23 HG SER 23 -15.418 40.575 -9.166 142 H LYS 24 HN LYS 24 -19.548 37.860 -8.699 143 HA LYS 24 HA LYS 24 -19.676 36.887 -6.017 144 HB2 LYS 24 HB2 LYS 24 -21.358 36.384 -8.471 145 HB3 LYS 24 HB1 LYS 24 -21.673 35.593 -6.933 146 HG2 LYS 24 HG2 LYS 24 -21.954 37.806 -5.892 147 HG3 LYS 24 HG1 LYS 24 -21.731 38.548 -7.477 148 HD2 LYS 24 HD2 LYS 24 -23.700 37.494 -8.325 149 HD3 LYS 24 HD1 LYS 24 -23.858 36.506 -6.873 150 HE2 LYS 24 HE2 LYS 24 -24.181 38.577 -5.558 151 HE3 LYS 24 HE1 LYS 24 -24.139 39.499 -7.059 152 HZ1 LYS 24 HZ1 LYS 24 -26.400 39.040 -6.309 153 HZ2 LYS 24 HZ2 LYS 24 -26.115 37.379 -6.409 154 HZ3 LYS 24 HZ3 LYS 24 -26.100 38.321 -7.809 155 H CYS 25 HN CYS 25 -19.164 35.543 -9.211 156 HA CYS 25 HA CYS 25 -18.149 33.727 -9.971 157 HB2 CYS 25 HB2 CYS 25 -16.366 34.928 -8.587 158 HB3 CYS 25 HB1 CYS 25 -16.588 33.617 -7.430 159 H GLN 26 HN GLN 26 -19.774 32.298 -10.023 160 HA GLN 26 HA GLN 26 -20.144 30.551 -7.695 161 HB2 GLN 26 HB2 GLN 26 -21.872 31.100 -10.081 162 HB3 GLN 26 HB1 GLN 26 -22.177 29.756 -8.991 163 HG2 GLN 26 HG2 GLN 26 -22.496 31.252 -7.145 164 HG3 GLN 26 HG1 GLN 26 -22.022 32.632 -8.135 165 HE21 GLN 26 HE21 GLN 26 -23.982 33.634 -7.704 166 HE22 GLN 26 HE22 GLN 26 -25.449 33.139 -8.476 167 H CYS 27 HN CYS 27 -18.227 30.515 -10.313 168 HA CYS 27 HA CYS 27 -18.716 27.752 -11.062 169 HB2 CYS 27 HB2 CYS 27 -16.930 28.055 -12.673 170 HB3 CYS 27 HB1 CYS 27 -18.053 29.408 -12.773 171 H GLY 28 HN GLY 28 -16.596 26.372 -11.253 172 HA2 GLY 28 HA2 GLY 28 -15.401 26.385 -8.579 173 HA3 GLY 28 HA1 GLY 28 -15.416 25.032 -9.705 174 H GLU 29 HN GLU 29 -13.731 24.736 -11.020 175 HA GLU 29 HA GLU 29 -11.829 26.913 -11.426 176 HB2 GLU 29 HB2 GLU 29 -11.105 24.144 -10.453 177 HB3 GLU 29 HB1 GLU 29 -9.944 25.304 -11.073 178 HG2 GLU 29 HG2 GLU 29 -10.508 26.832 -9.248 179 HG3 GLU 29 HG1 GLU 29 -11.655 25.647 -8.622 180 H GLY 30 HN GLY 30 -10.348 26.443 -13.214 181 HA2 GLY 30 HA2 GLY 30 -9.742 25.151 -15.102 182 HA3 GLY 30 HA1 GLY 30 -11.280 24.311 -14.986 183 H CYS 31 HN CYS 31 -11.127 27.787 -14.755 184 HA CYS 31 HA CYS 31 -12.254 27.904 -17.473 185 HB2 CYS 31 HB2 CYS 31 -13.364 30.000 -16.693 186 HB3 CYS 31 HB1 CYS 31 -13.918 28.541 -15.874 187 H THR 32 HN THR 32 -9.847 29.009 -15.301 188 HA THR 32 HA THR 32 -8.132 30.458 -15.397 189 HB THR 32 HB THR 32 -6.906 30.576 -17.602 190 HG1 THR 32 HG1 THR 32 -9.247 29.844 -18.572 191 HG21 THR 32 HG21 THR 32 -6.306 28.189 -17.618 192 HG22 THR 32 HG22 THR 32 -7.718 27.839 -16.618 193 HG23 THR 32 HG23 THR 32 -6.407 28.833 -15.979 194 H CYS 33 HN CYS 33 -10.665 31.741 -15.495 195 HA CYS 33 HA CYS 33 -10.614 33.803 -17.453 196 HB2 CYS 33 HB2 CYS 33 -12.139 33.558 -14.858 197 HB3 CYS 33 HB1 CYS 33 -12.424 34.785 -16.085 198 H ALA 34 HN ALA 34 -10.712 36.089 -16.710 199 HA ALA 34 HA ALA 34 -8.957 36.692 -14.445 200 HB1 ALA 34 HB1 ALA 34 -7.897 38.474 -15.789 201 HB2 ALA 34 HB2 ALA 34 -8.800 37.924 -17.200 202 HB3 ALA 34 HB3 ALA 34 -7.592 36.873 -16.462 203 H ALA 35 HN ALA 35 -11.886 36.734 -15.489 204 HA ALA 35 HA ALA 35 -12.516 39.534 -14.936 205 HB1 ALA 35 HB1 ALA 35 -14.259 37.382 -16.148 206 HB2 ALA 35 HB2 ALA 35 -13.418 38.646 -17.044 207 HB3 ALA 35 HB3 ALA 35 -14.712 39.070 -15.925 208 H CYS 36 HN CYS 36 -13.853 36.294 -14.247 209 HA CYS 36 HA CYS 36 -15.020 37.354 -11.827 210 HB2 CYS 36 HB2 CYS 36 -16.028 35.161 -11.580 211 HB3 CYS 36 HB1 CYS 36 -16.234 35.778 -13.218 212 H LYS 37 HN LYS 37 -12.682 34.959 -12.835 213 HA LYS 37 HA LYS 37 -11.610 34.832 -10.156 214 HB2 LYS 37 HB2 LYS 37 -11.912 32.680 -11.202 215 HB3 LYS 37 HB1 LYS 37 -11.036 33.201 -12.634 216 HG2 LYS 37 HG2 LYS 37 -8.981 33.282 -11.434 217 HG3 LYS 37 HG1 LYS 37 -9.801 32.977 -9.899 218 HD2 LYS 37 HD2 LYS 37 -10.431 30.761 -10.703 219 HD3 LYS 37 HD1 LYS 37 -9.627 31.091 -12.242 220 HE2 LYS 37 HE2 LYS 37 -7.498 31.323 -11.119 221 HE3 LYS 37 HE1 LYS 37 -8.271 31.109 -9.550 222 HZ1 LYS 37 HZ1 LYS 37 -7.196 29.095 -10.332 223 HZ2 LYS 37 HZ2 LYS 37 -8.171 29.082 -11.707 224 HZ3 LYS 37 HZ3 LYS 37 -8.865 28.877 -10.172 225 H THR 38 HN THR 38 -10.610 36.768 -9.942 226 HA THR 38 HA THR 38 -8.170 37.041 -11.508 227 HB THR 38 HB THR 38 -9.883 38.607 -12.456 228 HG1 THR 38 HG1 THR 38 -7.919 39.420 -12.797 229 HG21 THR 38 HG21 THR 38 -11.144 39.076 -10.411 230 HG22 THR 38 HG22 THR 38 -10.554 40.573 -11.133 231 HG23 THR 38 HG23 THR 38 -9.743 39.894 -9.721 232 H CYS 39 HN CYS 39 -6.615 38.492 -10.387 233 HA CYS 39 HA CYS 39 -6.934 38.138 -7.497 234 HB2 CYS 39 HB2 CYS 39 -5.033 36.959 -8.691 235 HB3 CYS 39 HB1 CYS 39 -4.342 38.552 -8.975 236 H ASN 40 HN ASN 40 -6.860 39.841 -6.180 237 HA ASN 40 HA ASN 40 -6.885 42.485 -7.420 238 HB2 ASN 40 HB2 ASN 40 -7.419 41.738 -4.532 239 HB3 ASN 40 HB1 ASN 40 -7.779 43.276 -5.299 240 HD21 ASN 40 HD21 ASN 40 -8.773 41.991 -7.757 241 HD22 ASN 40 HD22 ASN 40 -10.323 41.344 -7.348 242 H CYS 41 HN CYS 41 -4.629 40.496 -6.082 243 HA CYS 41 HA CYS 41 -3.180 42.394 -4.506 244 HB2 CYS 41 HB2 CYS 41 -2.302 39.715 -5.549 245 HB3 CYS 41 HB1 CYS 41 -1.585 40.626 -4.222 246 H THR 42 HN THR 42 -1.272 43.394 -4.975 247 HA THR 42 HA THR 42 -0.489 43.399 -7.805 248 HB THR 42 HB THR 42 0.284 45.694 -7.475 249 HG1 THR 42 HG1 THR 42 -0.717 46.396 -5.156 250 HG21 THR 42 HG21 THR 42 -2.505 45.331 -6.363 251 HG22 THR 42 HG22 THR 42 -2.085 45.380 -8.076 252 HG23 THR 42 HG23 THR 42 -1.861 46.813 -7.071 253 H SER 43 HN SER 43 1.911 44.064 -8.015 254 HA SER 43 HA SER 43 3.454 42.253 -6.456 255 HB2 SER 43 HB2 SER 43 5.359 43.445 -7.789 256 HB3 SER 43 HB1 SER 43 4.214 42.403 -8.637 257 HG SER 43 HG SER 43 4.282 44.237 -9.807 258 H ASP 44 HN ASP 44 2.425 45.389 -5.937 259 HA ASP 44 HA ASP 44 4.720 46.175 -4.339 260 HB2 ASP 44 HB2 ASP 44 3.703 47.917 -5.664 261 HB3 ASP 44 HB1 ASP 44 2.121 47.581 -4.969 262 H GLY 45 HN GLY 45 1.447 45.009 -3.950 263 HA2 GLY 45 HA2 GLY 45 2.006 44.424 -1.190 264 HA3 GLY 45 HA1 GLY 45 0.769 45.646 -1.432 265 H CYS 46 HN CYS 46 1.110 42.587 -0.710 266 HA CYS 46 HA CYS 46 -0.792 41.349 -2.447 267 HB2 CYS 46 HB2 CYS 46 1.093 40.247 -1.054 268 HB3 CYS 46 HB1 CYS 46 -0.021 40.384 0.299 269 H LYS 47 HN LYS 47 -2.989 41.153 -2.115 270 HA LYS 47 HA LYS 47 -4.038 42.938 -0.052 271 HB2 LYS 47 HB2 LYS 47 -5.342 41.830 -2.531 272 HB3 LYS 47 HB1 LYS 47 -6.157 42.856 -1.359 273 HG2 LYS 47 HG2 LYS 47 -3.744 43.616 -2.995 274 HG3 LYS 47 HG1 LYS 47 -5.404 44.139 -3.284 275 HD2 LYS 47 HD2 LYS 47 -5.421 45.262 -1.104 276 HD3 LYS 47 HD1 LYS 47 -3.764 44.729 -0.814 277 HE2 LYS 47 HE2 LYS 47 -3.752 47.017 -1.568 278 HE3 LYS 47 HE1 LYS 47 -3.046 45.984 -2.809 279 HZ1 LYS 47 HZ1 LYS 47 -4.551 47.603 -3.769 280 HZ2 LYS 47 HZ2 LYS 47 -5.816 47.045 -2.803 281 HZ3 LYS 47 HZ3 LYS 47 -5.166 46.043 -3.992 282 H CYS 48 HN CYS 48 -3.815 39.607 -0.698 283 HA CYS 48 HA CYS 48 -6.019 39.075 1.167 284 HB2 CYS 48 HB2 CYS 48 -5.886 36.770 0.419 285 HB3 CYS 48 HB1 CYS 48 -6.014 37.847 -0.973 286 H GLY 49 HN GLY 49 -2.581 38.523 0.643 287 HA2 GLY 49 HA2 GLY 49 -1.120 38.727 2.555 288 HA3 GLY 49 HA1 GLY 49 -2.342 37.898 3.507 289 H LYS 50 HN LYS 50 -2.180 36.444 0.504 290 HA LYS 50 HA LYS 50 -0.739 34.180 1.603 291 HB2 LYS 50 HB2 LYS 50 -1.956 34.521 -1.145 292 HB3 LYS 50 HB1 LYS 50 -1.379 33.017 -0.451 293 HG2 LYS 50 HG2 LYS 50 -3.722 34.645 0.519 294 HG3 LYS 50 HG1 LYS 50 -3.797 33.130 -0.379 295 HD2 LYS 50 HD2 LYS 50 -2.608 32.022 1.502 296 HD3 LYS 50 HD1 LYS 50 -2.696 33.539 2.399 297 HE2 LYS 50 HE2 LYS 50 -5.152 33.470 2.230 298 HE3 LYS 50 HE1 LYS 50 -5.037 31.925 1.392 299 HZ1 LYS 50 HZ1 LYS 50 -3.931 31.027 3.394 300 HZ2 LYS 50 HZ2 LYS 50 -5.510 31.541 3.686 301 HZ3 LYS 50 HZ3 LYS 50 -4.214 32.497 4.186 302 H GLU 51 HN GLU 51 0.158 36.959 0.189 303 HA GLU 51 HA GLU 51 2.016 37.802 -0.744 304 HB2 GLU 51 HB2 GLU 51 3.071 36.279 1.042 305 HB3 GLU 51 HB1 GLU 51 3.422 35.173 -0.280 306 HG2 GLU 51 HG2 GLU 51 4.655 37.026 -1.407 307 HG3 GLU 51 HG1 GLU 51 4.419 37.995 0.044 308 H CYS 52 HN CYS 52 0.074 36.192 -2.330 309 HA CYS 52 HA CYS 52 1.529 34.931 -4.423 310 HB2 CYS 52 HB2 CYS 52 -0.698 35.225 -5.647 311 HB3 CYS 52 HB1 CYS 52 -0.706 34.237 -4.187 312 H THR 53 HN THR 53 0.047 38.090 -3.981 313 HA THR 53 HA THR 53 0.259 40.087 -5.017 314 HB THR 53 HB THR 53 2.570 40.781 -5.630 315 HG1 THR 53 HG1 THR 53 2.953 38.050 -5.556 316 HG21 THR 53 HG21 THR 53 3.504 40.532 -3.359 317 HG22 THR 53 HG22 THR 53 2.268 39.320 -3.008 318 HG23 THR 53 HG23 THR 53 1.799 40.987 -3.339 319 H GLY 54 HN GLY 54 -0.856 38.167 -6.716 320 HA2 GLY 54 HA2 GLY 54 -1.237 39.301 -9.045 321 HA3 GLY 54 HA1 GLY 54 0.386 38.677 -9.308 322 HA PRO 55 HA PRO 55 -3.247 35.491 -9.845 323 HB2 PRO 55 HB2 PRO 55 -3.472 35.612 -12.587 324 HB3 PRO 55 HB1 PRO 55 -4.521 36.481 -11.463 325 HG2 PRO 55 HG2 PRO 55 -2.138 37.465 -12.975 326 HG3 PRO 55 HG1 PRO 55 -3.684 38.276 -12.671 327 HD2 PRO 55 HD2 PRO 55 -1.467 38.875 -11.284 328 HD3 PRO 55 HD1 PRO 55 -3.074 38.899 -10.532 329 H ASP 56 HN ASP 56 -0.295 36.218 -11.559 330 HA ASP 56 HA ASP 56 0.110 33.634 -12.679 331 HB2 ASP 56 HB2 ASP 56 1.983 35.942 -12.176 332 HB3 ASP 56 HB1 ASP 56 2.494 34.445 -12.947 333 H SER 57 HN SER 57 0.688 35.004 -9.568 334 HA SER 57 HA SER 57 2.119 32.554 -8.776 335 HB2 SER 57 HB2 SER 57 2.305 35.294 -7.500 336 HB3 SER 57 HB1 SER 57 3.214 33.859 -7.027 337 HG SER 57 HG SER 57 3.501 35.507 -9.276 338 H CYS 58 HN CYS 58 -0.801 33.456 -8.886 339 HA CYS 58 HA CYS 58 -1.568 33.573 -6.122 340 HB2 CYS 58 HB2 CYS 58 -2.674 34.864 -7.980 341 HB3 CYS 58 HB1 CYS 58 -3.361 33.337 -8.526 342 H LYS 59 HN LYS 59 -1.434 31.791 -5.024 343 HA LYS 59 HA LYS 59 -1.995 29.209 -6.263 344 HB2 LYS 59 HB2 LYS 59 -0.904 29.840 -3.520 345 HB3 LYS 59 HB1 LYS 59 -0.945 28.262 -4.296 346 HG2 LYS 59 HG2 LYS 59 0.661 28.927 -5.918 347 HG3 LYS 59 HG1 LYS 59 0.563 30.612 -5.410 348 HD2 LYS 59 HD2 LYS 59 2.576 29.625 -4.525 349 HD3 LYS 59 HD1 LYS 59 1.459 29.959 -3.205 350 HE2 LYS 59 HE2 LYS 59 0.797 27.642 -3.120 351 HE3 LYS 59 HE1 LYS 59 1.788 27.274 -4.530 352 HZ1 LYS 59 HZ1 LYS 59 2.795 28.219 -1.903 353 HZ2 LYS 59 HZ2 LYS 59 3.748 27.872 -3.253 354 HZ3 LYS 59 HZ3 LYS 59 2.893 26.634 -2.487 355 H CYS 60 HN CYS 60 -3.543 31.536 -4.365 356 HA CYS 60 HA CYS 60 -5.212 29.607 -2.976 357 HB2 CYS 60 HB2 CYS 60 -6.315 31.856 -2.183 358 HB3 CYS 60 HB1 CYS 60 -4.771 31.333 -1.519 359 H GLY 61 HN GLY 61 -7.492 29.530 -3.189 360 HA2 GLY 61 HA2 GLY 61 -8.254 29.702 -5.960 361 HA3 GLY 61 HA1 GLY 61 -9.200 29.009 -4.659 362 H SER 62 HN SER 62 -10.921 30.087 -5.874 363 HA SER 62 HA SER 62 -11.087 32.913 -6.010 364 HB2 SER 62 HB2 SER 62 -13.288 30.868 -6.306 365 HB3 SER 62 HB1 SER 62 -13.307 32.532 -6.890 366 HG SER 62 HG SER 62 -12.710 31.295 -8.619 367 H SER 63 HN SER 63 -11.610 30.703 -3.487 368 HA SER 63 HA SER 63 -13.603 32.319 -2.151 369 HB2 SER 63 HB2 SER 63 -12.099 29.881 -1.176 370 HB3 SER 63 HB1 SER 63 -13.471 30.639 -0.370 371 HG SER 63 HG SER 63 -14.649 30.214 -2.384 372 H CYS 64 HN CYS 64 -10.708 33.216 -2.753 373 HA CYS 64 HA CYS 64 -9.915 33.812 -0.006 374 HB2 CYS 64 HB2 CYS 64 -8.256 32.867 -1.671 375 HB3 CYS 64 HB1 CYS 64 -8.360 34.403 -2.524 376 H SER 65 HN SER 65 -8.905 36.135 0.155 377 HA SER 65 HA SER 65 -11.107 37.904 -0.401 378 HB2 SER 65 HB2 SER 65 -8.500 38.457 1.021 379 HB3 SER 65 HB1 SER 65 -9.929 39.493 1.024 380 HG SER 65 HG SER 65 -9.661 38.028 2.872 381 H CYS 66 HN CYS 66 -8.266 37.124 -2.057 382 HA CYS 66 HA CYS 66 -8.006 39.762 -3.277 383 HB2 CYS 66 HB2 CYS 66 -6.105 38.754 -4.482 384 HB3 CYS 66 HB1 CYS 66 -5.946 38.602 -2.738 385 H LYS 67 HN LYS 67 -10.285 37.726 -3.642 386 HA LYS 67 HA LYS 67 -10.114 37.509 -6.568 387 HB2 LYS 67 HB2 LYS 67 -11.810 35.866 -4.687 388 HB3 LYS 67 HB1 LYS 67 -11.585 35.612 -6.416 389 HG2 LYS 67 HG2 LYS 67 -9.270 35.540 -4.518 390 HG3 LYS 67 HG1 LYS 67 -10.269 34.118 -4.797 391 HD2 LYS 67 HD2 LYS 67 -9.327 33.736 -6.805 392 HD3 LYS 67 HD1 LYS 67 -9.429 35.437 -7.263 393 HE2 LYS 67 HE2 LYS 67 -7.107 34.679 -7.179 394 HE3 LYS 67 HE1 LYS 67 -7.437 35.915 -5.967 395 HZ1 LYS 67 HZ1 LYS 67 -6.066 34.101 -5.133 396 HZ2 LYS 67 HZ2 LYS 67 -7.322 32.997 -5.398 397 HZ3 LYS 67 HZ3 LYS 67 -7.508 34.251 -4.276 Start of MODEL 18 1 HA2 GLY 1 HA1 GLY 1 -16.162 15.340 -26.164 2 HA3 GLY 1 HA2 GLY 1 -16.911 16.796 -25.528 3 H SER 2 HN SER 2 -15.348 17.038 -23.912 4 HA SER 2 HA SER 2 -14.842 14.908 -22.037 5 HB2 SER 2 HB2 SER 2 -13.984 17.809 -21.939 6 HB3 SER 2 HB1 SER 2 -13.329 16.490 -20.966 7 HG SER 2 HG SER 2 -13.232 15.789 -23.534 8 H GLY 3 HN GLY 3 -17.364 16.984 -22.413 9 HA2 GLY 3 HA2 GLY 3 -17.836 17.816 -19.736 10 HA3 GLY 3 HA1 GLY 3 -19.018 17.785 -21.037 11 H LYS 4 HN LYS 4 -18.608 14.939 -21.560 12 HA LYS 4 HA LYS 4 -19.448 12.913 -21.001 13 HB2 LYS 4 HB2 LYS 4 -17.760 13.167 -19.128 14 HB3 LYS 4 HB1 LYS 4 -19.071 13.736 -18.109 15 HG2 LYS 4 HG2 LYS 4 -18.571 11.389 -17.691 16 HG3 LYS 4 HG1 LYS 4 -20.198 11.582 -18.344 17 HD2 LYS 4 HD2 LYS 4 -19.413 10.926 -20.552 18 HD3 LYS 4 HD1 LYS 4 -17.759 10.803 -19.946 19 HE2 LYS 4 HE2 LYS 4 -18.407 8.992 -18.471 20 HE3 LYS 4 HE1 LYS 4 -20.091 9.158 -18.966 21 HZ1 LYS 4 HZ1 LYS 4 -17.843 8.383 -20.745 22 HZ2 LYS 4 HZ2 LYS 4 -19.454 8.531 -21.207 23 HZ3 LYS 4 HZ3 LYS 4 -18.999 7.328 -20.111 24 H GLY 5 HN GLY 5 -21.129 15.305 -21.215 25 HA2 GLY 5 HA2 GLY 5 -23.618 14.512 -21.198 26 HA3 GLY 5 HA1 GLY 5 -23.386 14.700 -19.463 27 H LYS 6 HN LYS 6 -21.936 16.887 -19.182 28 HA LYS 6 HA LYS 6 -23.490 18.977 -20.539 29 HB2 LYS 6 HB2 LYS 6 -22.456 18.922 -17.709 30 HB3 LYS 6 HB1 LYS 6 -23.118 20.349 -18.486 31 HG2 LYS 6 HG2 LYS 6 -25.244 19.137 -18.803 32 HG3 LYS 6 HG1 LYS 6 -24.563 17.784 -17.896 33 HD2 LYS 6 HD2 LYS 6 -24.289 19.169 -15.946 34 HD3 LYS 6 HD1 LYS 6 -24.813 20.596 -16.844 35 HE2 LYS 6 HE2 LYS 6 -26.640 19.821 -15.510 36 HE3 LYS 6 HE1 LYS 6 -26.993 19.499 -17.207 37 HZ1 LYS 6 HZ1 LYS 6 -25.951 17.499 -15.282 38 HZ2 LYS 6 HZ2 LYS 6 -26.387 17.201 -16.887 39 HZ3 LYS 6 HZ3 LYS 6 -27.564 17.638 -15.757 40 H GLY 7 HN GLY 7 -22.280 20.031 -21.899 41 HA2 GLY 7 HA2 GLY 7 -19.401 20.114 -21.620 42 HA3 GLY 7 HA1 GLY 7 -20.347 20.799 -22.939 43 H GLU 8 HN GLU 8 -18.163 21.933 -21.274 44 HA GLU 8 HA GLU 8 -17.565 23.913 -20.348 45 HB2 GLU 8 HB2 GLU 8 -20.310 24.870 -21.188 46 HB3 GLU 8 HB1 GLU 8 -18.955 25.890 -20.730 47 HG2 GLU 8 HG2 GLU 8 -17.708 25.149 -22.668 48 HG3 GLU 8 HG1 GLU 8 -19.011 24.046 -23.109 49 H LYS 9 HN LYS 9 -17.341 23.476 -18.237 50 HA LYS 9 HA LYS 9 -19.589 23.028 -16.511 51 HB2 LYS 9 HB2 LYS 9 -16.692 23.461 -15.768 52 HB3 LYS 9 HB1 LYS 9 -17.948 22.807 -14.726 53 HG2 LYS 9 HG2 LYS 9 -16.780 21.533 -17.188 54 HG3 LYS 9 HG1 LYS 9 -16.598 21.004 -15.516 55 HD2 LYS 9 HD2 LYS 9 -19.043 20.607 -15.425 56 HD3 LYS 9 HD1 LYS 9 -19.147 21.034 -17.133 57 HE2 LYS 9 HE2 LYS 9 -17.541 19.202 -17.625 58 HE3 LYS 9 HE1 LYS 9 -17.619 18.740 -15.924 59 HZ1 LYS 9 HZ1 LYS 9 -19.895 18.762 -17.835 60 HZ2 LYS 9 HZ2 LYS 9 -20.005 18.363 -16.193 61 HZ3 LYS 9 HZ3 LYS 9 -19.113 17.386 -17.236 62 H CYS 10 HN CYS 10 -18.391 25.777 -17.782 63 HA CYS 10 HA CYS 10 -18.558 27.501 -15.493 64 HB2 CYS 10 HB2 CYS 10 -18.567 28.209 -18.423 65 HB3 CYS 10 HB1 CYS 10 -18.244 29.288 -17.073 66 H THR 11 HN THR 11 -20.165 29.017 -15.110 67 HA THR 11 HA THR 11 -22.799 28.144 -15.924 68 HB THR 11 HB THR 11 -22.498 28.645 -13.586 69 HG1 THR 11 HG1 THR 11 -24.492 29.289 -13.855 70 HG21 THR 11 HG21 THR 11 -20.627 30.147 -13.672 71 HG22 THR 11 HG22 THR 11 -21.951 30.956 -12.830 72 HG23 THR 11 HG23 THR 11 -21.589 31.365 -14.507 73 H SER 12 HN SER 12 -24.401 29.976 -16.375 74 HA SER 12 HA SER 12 -23.901 31.152 -18.813 75 HB2 SER 12 HB2 SER 12 -25.832 32.080 -16.692 76 HB3 SER 12 HB1 SER 12 -25.958 32.388 -18.428 77 HG SER 12 HG SER 12 -27.252 30.605 -17.659 78 H ALA 13 HN ALA 13 -23.308 32.373 -15.591 79 HA ALA 13 HA ALA 13 -22.950 35.090 -16.172 80 HB1 ALA 13 HB1 ALA 13 -21.644 33.444 -14.009 81 HB2 ALA 13 HB2 ALA 13 -23.223 34.220 -13.903 82 HB3 ALA 13 HB3 ALA 13 -21.764 35.202 -14.041 83 H CYS 14 HN CYS 14 -20.605 32.426 -16.083 84 HA CYS 14 HA CYS 14 -18.362 34.056 -16.780 85 HB2 CYS 14 HB2 CYS 14 -18.267 31.886 -15.512 86 HB3 CYS 14 HB1 CYS 14 -18.645 31.069 -17.016 87 H ARG 15 HN ARG 15 -20.816 32.370 -18.467 88 HA ARG 15 HA ARG 15 -19.418 32.273 -20.997 89 HB2 ARG 15 HB2 ARG 15 -22.263 31.597 -20.254 90 HB3 ARG 15 HB1 ARG 15 -21.565 31.355 -21.849 91 HG2 ARG 15 HG2 ARG 15 -20.029 29.729 -21.007 92 HG3 ARG 15 HG1 ARG 15 -20.495 30.082 -19.343 93 HD2 ARG 15 HD2 ARG 15 -21.523 28.012 -20.177 94 HD3 ARG 15 HD1 ARG 15 -22.722 29.231 -19.752 95 HE ARG 15 HE ARG 15 -22.119 29.442 -22.491 96 HH11 ARG 15 HH11 ARG 15 -23.747 27.307 -20.245 97 HH12 ARG 15 HH12 ARG 15 -24.840 26.682 -21.425 98 HH21 ARG 15 HH21 ARG 15 -23.583 28.653 -24.047 99 HH22 ARG 15 HH22 ARG 15 -24.754 27.455 -23.613 100 H SER 16 HN SER 16 -20.638 34.791 -19.410 101 HA SER 16 HA SER 16 -21.866 36.018 -21.774 102 HB2 SER 16 HB2 SER 16 -21.980 36.878 -18.874 103 HB3 SER 16 HB1 SER 16 -22.792 37.682 -20.216 104 HG SER 16 HG SER 16 -23.231 35.022 -19.305 105 H GLU 17 HN GLU 17 -21.339 38.323 -22.138 106 HA GLU 17 HA GLU 17 -18.636 39.017 -21.240 107 HB2 GLU 17 HB2 GLU 17 -19.792 39.379 -24.008 108 HB3 GLU 17 HB1 GLU 17 -18.254 40.040 -23.475 109 HG2 GLU 17 HG2 GLU 17 -17.384 37.811 -23.121 110 HG3 GLU 17 HG1 GLU 17 -18.942 37.114 -23.566 111 HA PRO 18 HA PRO 18 -17.529 40.422 -20.443 112 HB2 PRO 18 HB2 PRO 18 -17.914 41.786 -17.931 113 HB3 PRO 18 HB1 PRO 18 -16.755 42.143 -19.209 114 HG2 PRO 18 HG2 PRO 18 -18.877 43.717 -18.538 115 HG3 PRO 18 HG1 PRO 18 -18.082 43.746 -20.121 116 HD2 PRO 18 HD2 PRO 18 -20.655 42.479 -19.297 117 HD3 PRO 18 HD1 PRO 18 -20.209 43.220 -20.847 118 H CYS 19 HN CYS 19 -16.825 39.495 -18.245 119 HA CYS 19 HA CYS 19 -18.511 37.265 -17.782 120 HB2 CYS 19 HB2 CYS 19 -16.004 37.253 -17.741 121 HB3 CYS 19 HB1 CYS 19 -16.085 38.097 -16.198 122 H GLN 20 HN GLN 20 -19.834 36.797 -16.111 123 HA GLN 20 HA GLN 20 -20.331 38.984 -14.195 124 HB2 GLN 20 HB2 GLN 20 -22.264 36.869 -15.134 125 HB3 GLN 20 HB1 GLN 20 -22.632 38.258 -14.121 126 HG2 GLN 20 HG2 GLN 20 -21.677 38.380 -16.968 127 HG3 GLN 20 HG1 GLN 20 -23.346 38.551 -16.432 128 HE21 GLN 20 HE21 GLN 20 -21.523 40.402 -17.831 129 HE22 GLN 20 HE22 GLN 20 -21.516 41.845 -16.876 130 H CYS 21 HN CYS 21 -18.754 36.201 -14.243 131 HA CYS 21 HA CYS 21 -19.917 34.836 -12.004 132 HB2 CYS 21 HB2 CYS 21 -17.451 34.487 -13.626 133 HB3 CYS 21 HB1 CYS 21 -17.516 33.736 -12.037 134 H GLY 22 HN GLY 22 -18.055 37.621 -12.246 135 HA2 GLY 22 HA2 GLY 22 -16.535 37.307 -9.822 136 HA3 GLY 22 HA1 GLY 22 -16.715 38.784 -10.757 137 H SER 23 HN SER 23 -18.572 36.622 -8.682 138 HA SER 23 HA SER 23 -19.334 38.610 -6.844 139 HB2 SER 23 HB2 SER 23 -20.752 39.322 -8.801 140 HB3 SER 23 HB1 SER 23 -21.548 37.752 -8.737 141 HG SER 23 HG SER 23 -21.442 39.181 -6.359 142 H LYS 24 HN LYS 24 -20.876 35.806 -8.398 143 HA LYS 24 HA LYS 24 -20.821 34.428 -5.791 144 HB2 LYS 24 HB2 LYS 24 -22.744 34.062 -8.095 145 HB3 LYS 24 HB1 LYS 24 -22.712 33.060 -6.655 146 HG2 LYS 24 HG2 LYS 24 -23.214 35.077 -5.306 147 HG3 LYS 24 HG1 LYS 24 -23.378 35.989 -6.809 148 HD2 LYS 24 HD2 LYS 24 -25.159 34.470 -7.532 149 HD3 LYS 24 HD1 LYS 24 -24.999 33.566 -6.026 150 HE2 LYS 24 HE2 LYS 24 -26.875 35.077 -5.868 151 HE3 LYS 24 HE1 LYS 24 -25.597 35.607 -4.777 152 HZ1 LYS 24 HZ1 LYS 24 -26.117 36.746 -7.469 153 HZ2 LYS 24 HZ2 LYS 24 -24.949 37.277 -6.370 154 HZ3 LYS 24 HZ3 LYS 24 -26.584 37.447 -6.004 155 H CYS 25 HN CYS 25 -20.585 34.032 -9.285 156 HA CYS 25 HA CYS 25 -19.512 32.618 -10.626 157 HB2 CYS 25 HB2 CYS 25 -17.564 33.452 -9.364 158 HB3 CYS 25 HB1 CYS 25 -17.729 32.088 -8.260 159 H GLN 26 HN GLN 26 -20.890 31.028 -11.113 160 HA GLN 26 HA GLN 26 -21.088 28.753 -9.279 161 HB2 GLN 26 HB2 GLN 26 -22.763 29.411 -11.711 162 HB3 GLN 26 HB1 GLN 26 -23.031 28.061 -10.619 163 HG2 GLN 26 HG2 GLN 26 -23.403 29.686 -8.784 164 HG3 GLN 26 HG1 GLN 26 -23.268 30.989 -9.965 165 HE21 GLN 26 HE21 GLN 26 -25.368 31.686 -9.609 166 HE22 GLN 26 HE22 GLN 26 -26.743 30.797 -10.151 167 H CYS 27 HN CYS 27 -18.816 29.431 -11.096 168 HA CYS 27 HA CYS 27 -18.678 27.632 -13.251 169 HB2 CYS 27 HB2 CYS 27 -16.721 29.182 -11.660 170 HB3 CYS 27 HB1 CYS 27 -16.097 27.806 -12.558 171 H GLY 28 HN GLY 28 -17.826 25.632 -13.467 172 HA2 GLY 28 HA2 GLY 28 -17.667 23.981 -11.094 173 HA3 GLY 28 HA1 GLY 28 -17.496 23.438 -12.764 174 H GLU 29 HN GLU 29 -15.730 22.561 -10.817 175 HA GLU 29 HA GLU 29 -13.429 24.221 -10.691 176 HB2 GLU 29 HB2 GLU 29 -13.994 22.485 -8.983 177 HB3 GLU 29 HB1 GLU 29 -13.597 21.250 -10.169 178 HG2 GLU 29 HG2 GLU 29 -11.307 22.006 -10.251 179 HG3 GLU 29 HG1 GLU 29 -11.681 23.342 -9.165 180 H GLY 30 HN GLY 30 -12.178 24.645 -12.330 181 HA2 GLY 30 HA2 GLY 30 -10.489 23.414 -13.776 182 HA3 GLY 30 HA1 GLY 30 -11.914 22.647 -14.463 183 H CYS 31 HN CYS 31 -12.089 25.990 -13.501 184 HA CYS 31 HA CYS 31 -12.399 26.696 -16.295 185 HB2 CYS 31 HB2 CYS 31 -14.107 27.472 -14.685 186 HB3 CYS 31 HB1 CYS 31 -12.864 28.356 -13.805 187 H THR 32 HN THR 32 -11.198 28.285 -17.282 188 HA THR 32 HA THR 32 -8.699 29.004 -15.921 189 HB THR 32 HB THR 32 -7.645 28.897 -18.219 190 HG1 THR 32 HG1 THR 32 -10.017 28.736 -19.095 191 HG21 THR 32 HG21 THR 32 -7.268 27.113 -16.609 192 HG22 THR 32 HG22 THR 32 -7.468 26.415 -18.216 193 HG23 THR 32 HG23 THR 32 -8.796 26.354 -17.053 194 H CYS 33 HN CYS 33 -11.207 30.479 -16.110 195 HA CYS 33 HA CYS 33 -11.040 32.491 -18.094 196 HB2 CYS 33 HB2 CYS 33 -13.094 31.812 -16.776 197 HB3 CYS 33 HB1 CYS 33 -12.406 32.666 -15.408 198 H ALA 34 HN ALA 34 -10.736 34.814 -17.556 199 HA ALA 34 HA ALA 34 -8.557 35.150 -15.601 200 HB1 ALA 34 HB1 ALA 34 -8.983 36.635 -18.197 201 HB2 ALA 34 HB2 ALA 34 -7.785 35.373 -17.918 202 HB3 ALA 34 HB3 ALA 34 -7.667 36.906 -17.055 203 H ALA 35 HN ALA 35 -11.492 35.426 -15.280 204 HA ALA 35 HA ALA 35 -11.525 38.245 -14.448 205 HB1 ALA 35 HB1 ALA 35 -13.869 36.746 -15.616 206 HB2 ALA 35 HB2 ALA 35 -12.919 37.974 -16.450 207 HB3 ALA 35 HB3 ALA 35 -13.883 38.413 -15.041 208 H CYS 36 HN CYS 36 -13.395 35.213 -14.009 209 HA CYS 36 HA CYS 36 -13.991 36.036 -11.303 210 HB2 CYS 36 HB2 CYS 36 -15.295 33.862 -11.265 211 HB3 CYS 36 HB1 CYS 36 -15.802 35.062 -12.440 212 H LYS 37 HN LYS 37 -12.106 33.583 -12.955 213 HA LYS 37 HA LYS 37 -11.049 32.686 -10.383 214 HB2 LYS 37 HB2 LYS 37 -12.034 30.957 -11.867 215 HB3 LYS 37 HB1 LYS 37 -10.866 31.367 -13.107 216 HG2 LYS 37 HG2 LYS 37 -9.736 30.597 -10.492 217 HG3 LYS 37 HG1 LYS 37 -10.588 29.326 -11.370 218 HD2 LYS 37 HD2 LYS 37 -9.199 29.807 -13.349 219 HD3 LYS 37 HD1 LYS 37 -8.293 30.996 -12.406 220 HE2 LYS 37 HE2 LYS 37 -7.032 28.972 -12.415 221 HE3 LYS 37 HE1 LYS 37 -7.738 29.139 -10.809 222 HZ1 LYS 37 HZ1 LYS 37 -7.917 26.878 -11.769 223 HZ2 LYS 37 HZ2 LYS 37 -8.930 27.501 -12.972 224 HZ3 LYS 37 HZ3 LYS 37 -9.409 27.556 -11.352 225 H THR 38 HN THR 38 -9.566 34.297 -9.974 226 HA THR 38 HA THR 38 -7.013 34.057 -11.136 227 HB THR 38 HB THR 38 -8.115 35.289 -13.014 228 HG1 THR 38 HG1 THR 38 -6.543 37.106 -12.953 229 HG21 THR 38 HG21 THR 38 -9.753 36.568 -11.709 230 HG22 THR 38 HG22 THR 38 -8.766 37.641 -12.699 231 HG23 THR 38 HG23 THR 38 -8.448 37.496 -10.969 232 H CYS 39 HN CYS 39 -5.781 36.289 -10.493 233 HA CYS 39 HA CYS 39 -6.527 36.792 -7.690 234 HB2 CYS 39 HB2 CYS 39 -4.440 35.581 -7.779 235 HB3 CYS 39 HB1 CYS 39 -3.785 36.714 -8.956 236 H ASN 40 HN ASN 40 -6.661 38.832 -6.988 237 HA ASN 40 HA ASN 40 -6.623 40.904 -9.052 238 HB2 ASN 40 HB2 ASN 40 -7.868 40.759 -6.316 239 HB3 ASN 40 HB1 ASN 40 -7.767 42.273 -7.208 240 HD21 ASN 40 HD21 ASN 40 -9.157 39.062 -7.161 241 HD22 ASN 40 HD22 ASN 40 -10.417 39.384 -8.288 242 H CYS 41 HN CYS 41 -4.423 39.752 -6.922 243 HA CYS 41 HA CYS 41 -3.435 42.234 -5.885 244 HB2 CYS 41 HB2 CYS 41 -2.158 39.506 -5.981 245 HB3 CYS 41 HB1 CYS 41 -1.547 40.896 -5.091 246 H THR 42 HN THR 42 -1.366 43.114 -6.331 247 HA THR 42 HA THR 42 -0.210 42.461 -8.933 248 HB THR 42 HB THR 42 0.025 44.922 -9.382 249 HG1 THR 42 HG1 THR 42 -1.346 46.319 -8.162 250 HG21 THR 42 HG21 THR 42 -2.297 45.280 -10.103 251 HG22 THR 42 HG22 THR 42 -2.815 43.942 -9.076 252 HG23 THR 42 HG23 THR 42 -1.764 43.637 -10.460 253 H SER 43 HN SER 43 1.971 43.662 -9.132 254 HA SER 43 HA SER 43 3.554 43.069 -6.854 255 HB2 SER 43 HB2 SER 43 4.258 44.659 -9.332 256 HB3 SER 43 HB1 SER 43 5.411 44.023 -8.160 257 HG SER 43 HG SER 43 3.717 42.588 -9.924 258 H ASP 44 HN ASP 44 1.781 45.789 -7.818 259 HA ASP 44 HA ASP 44 3.183 47.840 -6.460 260 HB2 ASP 44 HB2 ASP 44 1.628 48.519 -8.114 261 HB3 ASP 44 HB1 ASP 44 0.339 47.550 -7.412 262 H GLY 45 HN GLY 45 0.681 45.570 -5.523 263 HA2 GLY 45 HA2 GLY 45 1.349 45.722 -2.795 264 HA3 GLY 45 HA1 GLY 45 -0.092 46.681 -3.105 265 H CYS 46 HN CYS 46 0.668 43.935 -1.824 266 HA CYS 46 HA CYS 46 -0.948 42.066 -3.254 267 HB2 CYS 46 HB2 CYS 46 0.962 41.634 -1.527 268 HB3 CYS 46 HB1 CYS 46 -0.307 41.841 -0.327 269 H LYS 47 HN LYS 47 -3.052 42.093 -3.341 270 HA LYS 47 HA LYS 47 -4.558 43.988 -1.832 271 HB2 LYS 47 HB2 LYS 47 -5.420 41.935 -3.859 272 HB3 LYS 47 HB1 LYS 47 -6.475 43.160 -3.171 273 HG2 LYS 47 HG2 LYS 47 -3.952 43.820 -4.666 274 HG3 LYS 47 HG1 LYS 47 -5.530 43.678 -5.443 275 HD2 LYS 47 HD2 LYS 47 -6.403 45.489 -4.145 276 HD3 LYS 47 HD1 LYS 47 -4.955 45.539 -3.140 277 HE2 LYS 47 HE2 LYS 47 -4.966 46.063 -6.110 278 HE3 LYS 47 HE1 LYS 47 -5.085 47.329 -4.888 279 HZ1 LYS 47 HZ1 LYS 47 -2.809 46.966 -5.729 280 HZ2 LYS 47 HZ2 LYS 47 -2.816 45.411 -5.058 281 HZ3 LYS 47 HZ3 LYS 47 -2.943 46.767 -4.062 282 H CYS 48 HN CYS 48 -4.179 40.499 -1.714 283 HA CYS 48 HA CYS 48 -6.352 40.295 0.204 284 HB2 CYS 48 HB2 CYS 48 -5.908 37.920 0.212 285 HB3 CYS 48 HB1 CYS 48 -5.947 38.492 -1.452 286 H GLY 49 HN GLY 49 -2.850 40.009 0.124 287 HA2 GLY 49 HA2 GLY 49 -1.592 40.921 1.963 288 HA3 GLY 49 HA1 GLY 49 -2.844 40.334 3.052 289 H LYS 50 HN LYS 50 -2.340 38.016 0.697 290 HA LYS 50 HA LYS 50 -0.895 36.294 2.515 291 HB2 LYS 50 HB2 LYS 50 -1.681 35.799 -0.367 292 HB3 LYS 50 HB1 LYS 50 -1.112 34.589 0.768 293 HG2 LYS 50 HG2 LYS 50 -3.697 36.127 0.943 294 HG3 LYS 50 HG1 LYS 50 -3.510 34.439 0.470 295 HD2 LYS 50 HD2 LYS 50 -2.518 34.023 2.738 296 HD3 LYS 50 HD1 LYS 50 -2.987 35.671 3.164 297 HE2 LYS 50 HE2 LYS 50 -4.832 33.441 2.305 298 HE3 LYS 50 HE1 LYS 50 -4.672 34.101 3.931 299 HZ1 LYS 50 HZ1 LYS 50 -5.476 36.230 3.086 300 HZ2 LYS 50 HZ2 LYS 50 -6.603 35.004 2.835 301 HZ3 LYS 50 HZ3 LYS 50 -5.675 35.565 1.542 302 H GLU 51 HN GLU 51 -0.046 38.654 0.437 303 HA GLU 51 HA GLU 51 1.862 39.462 -0.396 304 HB2 GLU 51 HB2 GLU 51 2.798 38.602 1.797 305 HB3 GLU 51 HB1 GLU 51 3.331 37.176 0.920 306 HG2 GLU 51 HG2 GLU 51 4.751 38.530 -0.493 307 HG3 GLU 51 HG1 GLU 51 4.156 39.999 0.280 308 H CYS 52 HN CYS 52 0.245 37.526 -1.831 309 HA CYS 52 HA CYS 52 2.101 35.996 -3.404 310 HB2 CYS 52 HB2 CYS 52 0.039 35.601 -4.844 311 HB3 CYS 52 HB1 CYS 52 -0.009 34.970 -3.201 312 H THR 53 HN THR 53 0.263 38.965 -3.733 313 HA THR 53 HA THR 53 0.333 40.704 -5.168 314 HB THR 53 HB THR 53 2.617 41.460 -5.905 315 HG1 THR 53 HG1 THR 53 3.237 38.907 -5.321 316 HG21 THR 53 HG21 THR 53 2.293 40.713 -3.002 317 HG22 THR 53 HG22 THR 53 1.617 42.139 -3.782 318 HG23 THR 53 HG23 THR 53 3.368 41.962 -3.633 319 H GLY 54 HN GLY 54 -0.388 38.226 -6.435 320 HA2 GLY 54 HA2 GLY 54 -0.908 38.827 -8.935 321 HA3 GLY 54 HA1 GLY 54 0.809 38.482 -9.082 322 HA PRO 55 HA PRO 55 -2.223 34.647 -9.111 323 HB2 PRO 55 HB2 PRO 55 -2.022 34.198 -11.847 324 HB3 PRO 55 HB1 PRO 55 -3.392 34.957 -11.033 325 HG2 PRO 55 HG2 PRO 55 -1.087 36.229 -12.447 326 HG3 PRO 55 HG1 PRO 55 -2.799 36.695 -12.448 327 HD2 PRO 55 HD2 PRO 55 -1.010 38.034 -10.992 328 HD3 PRO 55 HD1 PRO 55 -2.643 37.724 -10.370 329 H ASP 56 HN ASP 56 0.811 35.484 -10.672 330 HA ASP 56 HA ASP 56 1.685 32.836 -11.188 331 HB2 ASP 56 HB2 ASP 56 3.288 35.374 -10.836 332 HB3 ASP 56 HB1 ASP 56 3.956 33.845 -11.397 333 H SER 57 HN SER 57 1.956 34.919 -8.386 334 HA SER 57 HA SER 57 3.386 32.762 -6.983 335 HB2 SER 57 HB2 SER 57 3.226 35.692 -6.243 336 HB3 SER 57 HB1 SER 57 4.216 34.460 -5.458 337 HG SER 57 HG SER 57 5.149 34.179 -7.661 338 H CYS 58 HN CYS 58 0.426 33.466 -7.520 339 HA CYS 58 HA CYS 58 -0.701 33.903 -4.927 340 HB2 CYS 58 HB2 CYS 58 -1.697 34.674 -7.100 341 HB3 CYS 58 HB1 CYS 58 -2.044 32.992 -7.472 342 H LYS 59 HN LYS 59 -0.931 32.388 -3.446 343 HA LYS 59 HA LYS 59 -1.039 29.601 -4.363 344 HB2 LYS 59 HB2 LYS 59 0.109 30.658 -1.784 345 HB3 LYS 59 HB1 LYS 59 0.001 28.961 -2.228 346 HG2 LYS 59 HG2 LYS 59 1.645 31.083 -3.594 347 HG3 LYS 59 HG1 LYS 59 2.241 29.746 -2.609 348 HD2 LYS 59 HD2 LYS 59 1.326 28.160 -4.263 349 HD3 LYS 59 HD1 LYS 59 0.787 29.520 -5.244 350 HE2 LYS 59 HE2 LYS 59 2.887 28.621 -6.087 351 HE3 LYS 59 HE1 LYS 59 3.093 30.269 -5.496 352 HZ1 LYS 59 HZ1 LYS 59 4.076 29.424 -3.490 353 HZ2 LYS 59 HZ2 LYS 59 4.886 28.755 -4.814 354 HZ3 LYS 59 HZ3 LYS 59 3.770 27.827 -3.956 355 H CYS 60 HN CYS 60 -2.950 31.949 -3.197 356 HA CYS 60 HA CYS 60 -4.476 30.122 -1.503 357 HB2 CYS 60 HB2 CYS 60 -5.938 32.388 -1.371 358 HB3 CYS 60 HB1 CYS 60 -4.587 32.057 -0.297 359 H GLY 61 HN GLY 61 -5.890 28.884 -2.479 360 HA2 GLY 61 HA2 GLY 61 -6.806 29.669 -5.146 361 HA3 GLY 61 HA1 GLY 61 -6.745 28.027 -4.523 362 H SER 62 HN SER 62 -8.701 30.524 -5.298 363 HA SER 62 HA SER 62 -10.873 31.024 -5.010 364 HB2 SER 62 HB2 SER 62 -11.223 28.664 -5.578 365 HB3 SER 62 HB1 SER 62 -11.011 28.207 -3.890 366 HG SER 62 HG SER 62 -13.235 28.959 -5.133 367 H SER 63 HN SER 63 -12.525 31.532 -3.443 368 HA SER 63 HA SER 63 -13.410 32.133 -1.469 369 HB2 SER 63 HB2 SER 63 -12.745 29.877 -0.679 370 HB3 SER 63 HB1 SER 63 -11.210 30.546 -0.132 371 HG SER 63 HG SER 63 -13.682 30.648 1.016 372 H CYS 64 HN CYS 64 -9.901 32.662 -1.853 373 HA CYS 64 HA CYS 64 -9.763 34.510 0.300 374 HB2 CYS 64 HB2 CYS 64 -7.791 33.357 -0.677 375 HB3 CYS 64 HB1 CYS 64 -7.940 34.392 -2.095 376 H SER 65 HN SER 65 -9.179 36.822 0.045 377 HA SER 65 HA SER 65 -11.320 38.151 -1.242 378 HB2 SER 65 HB2 SER 65 -10.274 38.883 0.902 379 HB3 SER 65 HB1 SER 65 -8.845 39.376 -0.005 380 HG SER 65 HG SER 65 -10.167 40.853 -1.149 381 H CYS 66 HN CYS 66 -8.095 37.368 -2.292 382 HA CYS 66 HA CYS 66 -8.117 39.418 -4.339 383 HB2 CYS 66 HB2 CYS 66 -5.966 38.489 -5.051 384 HB3 CYS 66 HB1 CYS 66 -5.970 38.814 -3.325 385 H LYS 67 HN LYS 67 -9.742 36.643 -4.016 386 HA LYS 67 HA LYS 67 -9.360 35.638 -6.729 387 HB2 LYS 67 HB2 LYS 67 -11.192 34.669 -4.530 388 HB3 LYS 67 HB1 LYS 67 -10.901 33.854 -6.057 389 HG2 LYS 67 HG2 LYS 67 -8.694 34.434 -4.113 390 HG3 LYS 67 HG1 LYS 67 -9.682 32.970 -3.997 391 HD2 LYS 67 HD2 LYS 67 -8.048 32.126 -5.319 392 HD3 LYS 67 HD1 LYS 67 -8.985 32.892 -6.604 393 HE2 LYS 67 HE2 LYS 67 -6.739 33.538 -6.939 394 HE3 LYS 67 HE1 LYS 67 -7.568 34.930 -6.233 395 HZ1 LYS 67 HZ1 LYS 67 -6.556 34.548 -4.167 396 HZ2 LYS 67 HZ2 LYS 67 -5.319 34.377 -5.298 397 HZ3 LYS 67 HZ3 LYS 67 -6.022 33.007 -4.612 Start of MODEL 19 1 HA2 GLY 1 HA1 GLY 1 -21.828 21.305 -37.006 2 HA3 GLY 1 HA2 GLY 1 -21.598 19.672 -36.400 3 H SER 2 HN SER 2 -19.967 19.242 -34.989 4 HA SER 2 HA SER 2 -18.612 19.665 -33.237 5 HB2 SER 2 HB2 SER 2 -16.467 20.825 -33.800 6 HB3 SER 2 HB1 SER 2 -16.905 19.564 -34.947 7 HG SER 2 HG SER 2 -17.943 21.960 -35.676 8 H GLY 3 HN GLY 3 -20.237 20.777 -32.065 9 HA2 GLY 3 HA2 GLY 3 -19.952 23.697 -32.011 10 HA3 GLY 3 HA1 GLY 3 -21.306 22.787 -31.351 11 H LYS 4 HN LYS 4 -20.037 24.737 -29.883 12 HA LYS 4 HA LYS 4 -18.253 23.343 -28.052 13 HB2 LYS 4 HB2 LYS 4 -19.171 26.229 -28.136 14 HB3 LYS 4 HB1 LYS 4 -18.113 25.573 -26.900 15 HG2 LYS 4 HG2 LYS 4 -16.713 26.688 -28.429 16 HG3 LYS 4 HG1 LYS 4 -16.511 24.971 -28.769 17 HD2 LYS 4 HD2 LYS 4 -18.008 25.146 -30.675 18 HD3 LYS 4 HD1 LYS 4 -18.323 26.840 -30.302 19 HE2 LYS 4 HE2 LYS 4 -15.654 25.660 -31.072 20 HE3 LYS 4 HE1 LYS 4 -16.706 26.604 -32.124 21 HZ1 LYS 4 HZ1 LYS 4 -16.464 28.463 -30.538 22 HZ2 LYS 4 HZ2 LYS 4 -15.011 28.020 -31.262 23 HZ3 LYS 4 HZ3 LYS 4 -15.329 27.558 -29.670 24 H GLY 5 HN GLY 5 -19.462 21.943 -26.900 25 HA2 GLY 5 HA2 GLY 5 -21.814 23.052 -25.514 26 HA3 GLY 5 HA1 GLY 5 -21.623 21.359 -25.943 27 H LYS 6 HN LYS 6 -19.908 23.877 -24.090 28 HA LYS 6 HA LYS 6 -19.045 21.806 -22.223 29 HB2 LYS 6 HB2 LYS 6 -18.315 24.734 -22.407 30 HB3 LYS 6 HB1 LYS 6 -17.699 23.634 -21.184 31 HG2 LYS 6 HG2 LYS 6 -16.696 22.259 -22.978 32 HG3 LYS 6 HG1 LYS 6 -17.242 23.454 -24.156 33 HD2 LYS 6 HD2 LYS 6 -15.897 25.168 -23.061 34 HD3 LYS 6 HD1 LYS 6 -15.381 24.002 -21.843 35 HE2 LYS 6 HE2 LYS 6 -14.319 22.654 -23.596 36 HE3 LYS 6 HE1 LYS 6 -14.823 23.837 -24.802 37 HZ1 LYS 6 HZ1 LYS 6 -13.481 25.501 -23.652 38 HZ2 LYS 6 HZ2 LYS 6 -12.538 24.202 -24.162 39 HZ3 LYS 6 HZ3 LYS 6 -12.969 24.342 -22.537 40 H GLY 7 HN GLY 7 -19.195 22.283 -19.883 41 HA2 GLY 7 HA2 GLY 7 -20.759 24.120 -18.626 42 HA3 GLY 7 HA1 GLY 7 -21.911 22.927 -19.214 43 H GLU 8 HN GLU 8 -18.868 23.170 -17.420 44 HA GLU 8 HA GLU 8 -19.311 20.621 -16.147 45 HB2 GLU 8 HB2 GLU 8 -17.196 22.726 -15.671 46 HB3 GLU 8 HB1 GLU 8 -17.202 21.119 -14.964 47 HG2 GLU 8 HG2 GLU 8 -16.976 20.108 -17.148 48 HG3 GLU 8 HG1 GLU 8 -17.085 21.687 -17.919 49 H LYS 9 HN LYS 9 -18.348 23.605 -14.541 50 HA LYS 9 HA LYS 9 -20.627 23.319 -12.718 51 HB2 LYS 9 HB2 LYS 9 -17.740 23.741 -11.913 52 HB3 LYS 9 HB1 LYS 9 -19.104 23.925 -10.820 53 HG2 LYS 9 HG2 LYS 9 -19.688 21.529 -11.313 54 HG3 LYS 9 HG1 LYS 9 -18.148 21.407 -12.162 55 HD2 LYS 9 HD2 LYS 9 -18.453 22.226 -9.270 56 HD3 LYS 9 HD1 LYS 9 -18.069 20.593 -9.810 57 HE2 LYS 9 HE2 LYS 9 -16.025 21.441 -10.874 58 HE3 LYS 9 HE1 LYS 9 -16.411 23.065 -10.307 59 HZ1 LYS 9 HZ1 LYS 9 -15.965 20.728 -8.527 60 HZ2 LYS 9 HZ2 LYS 9 -16.188 22.330 -8.040 61 HZ3 LYS 9 HZ3 LYS 9 -14.799 21.888 -8.886 62 H CYS 10 HN CYS 10 -20.110 25.064 -14.978 63 HA CYS 10 HA CYS 10 -19.668 27.611 -13.691 64 HB2 CYS 10 HB2 CYS 10 -19.617 26.723 -16.520 65 HB3 CYS 10 HB1 CYS 10 -20.002 28.405 -16.180 66 H THR 11 HN THR 11 -20.991 29.408 -14.302 67 HA THR 11 HA THR 11 -23.826 28.737 -14.301 68 HB THR 11 HB THR 11 -23.292 30.154 -12.468 69 HG1 THR 11 HG1 THR 11 -24.851 31.491 -12.891 70 HG21 THR 11 HG21 THR 11 -22.051 32.310 -12.776 71 HG22 THR 11 HG22 THR 11 -21.691 31.801 -14.426 72 HG23 THR 11 HG23 THR 11 -21.085 30.862 -13.059 73 H SER 12 HN SER 12 -25.218 30.152 -15.650 74 HA SER 12 HA SER 12 -24.437 30.156 -18.328 75 HB2 SER 12 HB2 SER 12 -26.796 30.129 -17.530 76 HB3 SER 12 HB1 SER 12 -26.627 31.818 -17.055 77 HG SER 12 HG SER 12 -26.531 30.708 -19.660 78 H ALA 13 HN ALA 13 -24.155 32.587 -15.846 79 HA ALA 13 HA ALA 13 -23.609 34.811 -17.498 80 HB1 ALA 13 HB1 ALA 13 -22.758 34.270 -14.657 81 HB2 ALA 13 HB2 ALA 13 -24.250 35.064 -15.162 82 HB3 ALA 13 HB3 ALA 13 -22.690 35.834 -15.465 83 H CYS 14 HN CYS 14 -21.595 32.247 -16.206 84 HA CYS 14 HA CYS 14 -19.171 33.624 -16.985 85 HB2 CYS 14 HB2 CYS 14 -19.404 32.197 -14.900 86 HB3 CYS 14 HB1 CYS 14 -19.373 30.803 -15.972 87 H ARG 15 HN ARG 15 -21.233 31.060 -18.148 88 HA ARG 15 HA ARG 15 -19.327 30.143 -20.088 89 HB2 ARG 15 HB2 ARG 15 -21.230 28.753 -19.085 90 HB3 ARG 15 HB1 ARG 15 -22.299 29.625 -20.178 91 HG2 ARG 15 HG2 ARG 15 -21.061 28.795 -22.095 92 HG3 ARG 15 HG1 ARG 15 -19.928 27.970 -21.025 93 HD2 ARG 15 HD2 ARG 15 -21.458 26.336 -21.809 94 HD3 ARG 15 HD1 ARG 15 -21.873 26.667 -20.129 95 HE ARG 15 HE ARG 15 -23.461 28.341 -21.630 96 HH11 ARG 15 HH11 ARG 15 -22.941 24.877 -21.400 97 HH12 ARG 15 HH12 ARG 15 -24.562 24.467 -21.841 98 HH21 ARG 15 HH21 ARG 15 -25.631 27.800 -22.251 99 HH22 ARG 15 HH22 ARG 15 -26.094 26.132 -22.317 100 H SER 16 HN SER 16 -21.217 32.866 -19.854 101 HA SER 16 HA SER 16 -21.633 33.164 -22.702 102 HB2 SER 16 HB2 SER 16 -23.322 33.974 -21.013 103 HB3 SER 16 HB1 SER 16 -22.135 35.165 -20.484 104 HG SER 16 HG SER 16 -23.614 36.004 -22.028 105 H GLU 17 HN GLU 17 -20.791 35.158 -23.717 106 HA GLU 17 HA GLU 17 -18.209 35.953 -22.582 107 HB2 GLU 17 HB2 GLU 17 -18.717 35.311 -25.493 108 HB3 GLU 17 HB1 GLU 17 -17.190 35.845 -24.802 109 HG2 GLU 17 HG2 GLU 17 -17.089 33.808 -23.453 110 HG3 GLU 17 HG1 GLU 17 -18.609 33.269 -24.159 111 HA PRO 18 HA PRO 18 -16.714 37.567 -22.641 112 HB2 PRO 18 HB2 PRO 18 -16.668 39.661 -20.915 113 HB3 PRO 18 HB1 PRO 18 -16.175 39.802 -22.608 114 HG2 PRO 18 HG2 PRO 18 -18.790 40.515 -21.334 115 HG3 PRO 18 HG1 PRO 18 -17.832 41.435 -22.508 116 HD2 PRO 18 HD2 PRO 18 -19.975 39.979 -23.241 117 HD3 PRO 18 HD1 PRO 18 -18.553 40.155 -24.290 118 H CYS 19 HN CYS 19 -16.074 37.367 -20.303 119 HA CYS 19 HA CYS 19 -17.812 35.617 -18.972 120 HB2 CYS 19 HB2 CYS 19 -15.404 35.448 -18.754 121 HB3 CYS 19 HB1 CYS 19 -15.319 37.050 -18.040 122 H GLN 20 HN GLN 20 -19.588 36.111 -17.871 123 HA GLN 20 HA GLN 20 -19.787 38.779 -16.649 124 HB2 GLN 20 HB2 GLN 20 -22.072 36.903 -17.203 125 HB3 GLN 20 HB1 GLN 20 -22.134 38.631 -16.894 126 HG2 GLN 20 HG2 GLN 20 -20.917 37.357 -19.331 127 HG3 GLN 20 HG1 GLN 20 -22.542 38.016 -19.235 128 HE21 GLN 20 HE21 GLN 20 -22.091 39.489 -20.876 129 HE22 GLN 20 HE22 GLN 20 -21.117 40.893 -20.618 130 H CYS 21 HN CYS 21 -18.707 36.040 -15.622 131 HA CYS 21 HA CYS 21 -20.402 35.331 -13.445 132 HB2 CYS 21 HB2 CYS 21 -18.452 33.985 -14.559 133 HB3 CYS 21 HB1 CYS 21 -17.428 34.855 -13.449 134 H GLY 22 HN GLY 22 -18.111 37.804 -14.023 135 HA2 GLY 22 HA2 GLY 22 -17.577 39.707 -12.902 136 HA3 GLY 22 HA1 GLY 22 -18.968 39.385 -11.888 137 H SER 23 HN SER 23 -17.871 40.239 -10.142 138 HA SER 23 HA SER 23 -15.490 38.889 -9.182 139 HB2 SER 23 HB2 SER 23 -17.083 41.157 -7.983 140 HB3 SER 23 HB1 SER 23 -15.495 40.605 -7.445 141 HG SER 23 HG SER 23 -15.852 41.341 -10.131 142 H LYS 24 HN LYS 24 -18.819 38.543 -8.983 143 HA LYS 24 HA LYS 24 -18.944 37.545 -6.296 144 HB2 LYS 24 HB2 LYS 24 -21.214 36.748 -6.951 145 HB3 LYS 24 HB1 LYS 24 -20.961 38.459 -7.254 146 HG2 LYS 24 HG2 LYS 24 -20.611 38.002 -9.615 147 HG3 LYS 24 HG1 LYS 24 -20.819 36.276 -9.323 148 HD2 LYS 24 HD2 LYS 24 -22.878 37.185 -10.191 149 HD3 LYS 24 HD1 LYS 24 -23.110 36.736 -8.503 150 HE2 LYS 24 HE2 LYS 24 -22.831 39.060 -7.830 151 HE3 LYS 24 HE1 LYS 24 -22.539 39.524 -9.506 152 HZ1 LYS 24 HZ1 LYS 24 -24.770 38.820 -10.053 153 HZ2 LYS 24 HZ2 LYS 24 -24.812 39.976 -8.826 154 HZ3 LYS 24 HZ3 LYS 24 -25.052 38.347 -8.458 155 H CYS 25 HN CYS 25 -18.675 36.198 -9.543 156 HA CYS 25 HA CYS 25 -18.025 34.226 -10.336 157 HB2 CYS 25 HB2 CYS 25 -16.032 34.921 -8.948 158 HB3 CYS 25 HB1 CYS 25 -16.620 33.817 -7.709 159 H GLN 26 HN GLN 26 -20.047 33.314 -10.417 160 HA GLN 26 HA GLN 26 -21.013 31.783 -8.143 161 HB2 GLN 26 HB2 GLN 26 -22.286 32.140 -10.855 162 HB3 GLN 26 HB1 GLN 26 -23.048 31.480 -9.418 163 HG2 GLN 26 HG2 GLN 26 -22.096 34.313 -9.782 164 HG3 GLN 26 HG1 GLN 26 -23.768 33.759 -9.822 165 HE21 GLN 26 HE21 GLN 26 -24.771 33.158 -7.901 166 HE22 GLN 26 HE22 GLN 26 -24.127 33.595 -6.358 167 H CYS 27 HN CYS 27 -18.974 31.201 -10.731 168 HA CYS 27 HA CYS 27 -19.882 28.493 -11.214 169 HB2 CYS 27 HB2 CYS 27 -18.177 28.331 -12.859 170 HB3 CYS 27 HB1 CYS 27 -18.847 29.951 -13.014 171 H GLY 28 HN GLY 28 -18.383 26.695 -11.022 172 HA2 GLY 28 HA2 GLY 28 -17.114 26.771 -8.387 173 HA3 GLY 28 HA1 GLY 28 -17.491 25.330 -9.318 174 H GLU 29 HN GLU 29 -15.344 24.637 -8.731 175 HA GLU 29 HA GLU 29 -13.059 26.035 -9.775 176 HB2 GLU 29 HB2 GLU 29 -13.200 23.184 -8.769 177 HB3 GLU 29 HB1 GLU 29 -11.747 24.138 -8.996 178 HG2 GLU 29 HG2 GLU 29 -12.149 24.105 -6.684 179 HG3 GLU 29 HG1 GLU 29 -12.658 25.703 -7.230 180 H GLY 30 HN GLY 30 -11.479 24.795 -11.181 181 HA2 GLY 30 HA2 GLY 30 -10.998 23.427 -13.008 182 HA3 GLY 30 HA1 GLY 30 -12.684 22.942 -13.059 183 H CYS 31 HN CYS 31 -12.751 26.186 -12.833 184 HA CYS 31 HA CYS 31 -13.339 26.441 -15.643 185 HB2 CYS 31 HB2 CYS 31 -14.878 27.479 -14.140 186 HB3 CYS 31 HB1 CYS 31 -13.582 28.363 -13.339 187 H THR 32 HN THR 32 -11.125 27.944 -13.328 188 HA THR 32 HA THR 32 -9.284 29.205 -13.533 189 HB THR 32 HB THR 32 -7.604 28.483 -15.224 190 HG1 THR 32 HG1 THR 32 -9.705 27.582 -16.531 191 HG21 THR 32 HG21 THR 32 -8.975 26.259 -13.716 192 HG22 THR 32 HG22 THR 32 -7.759 27.360 -13.066 193 HG23 THR 32 HG23 THR 32 -7.324 26.210 -14.330 194 H CYS 33 HN CYS 33 -11.470 30.540 -14.499 195 HA CYS 33 HA CYS 33 -11.054 31.711 -17.044 196 HB2 CYS 33 HB2 CYS 33 -12.965 31.896 -14.919 197 HB3 CYS 33 HB1 CYS 33 -12.450 33.522 -15.354 198 H ALA 34 HN ALA 34 -10.623 34.073 -17.319 199 HA ALA 34 HA ALA 34 -8.472 34.928 -15.500 200 HB1 ALA 34 HB1 ALA 34 -8.829 35.617 -18.419 201 HB2 ALA 34 HB2 ALA 34 -7.720 34.399 -17.790 202 HB3 ALA 34 HB3 ALA 34 -7.482 36.100 -17.387 203 H ALA 35 HN ALA 35 -11.535 35.392 -15.798 204 HA ALA 35 HA ALA 35 -11.410 38.319 -15.574 205 HB1 ALA 35 HB1 ALA 35 -13.744 36.648 -16.497 206 HB2 ALA 35 HB2 ALA 35 -12.686 37.603 -17.536 207 HB3 ALA 35 HB3 ALA 35 -13.716 38.404 -16.350 208 H CYS 36 HN CYS 36 -13.631 35.667 -14.597 209 HA CYS 36 HA CYS 36 -14.294 37.065 -12.209 210 HB2 CYS 36 HB2 CYS 36 -15.564 35.031 -11.624 211 HB3 CYS 36 HB1 CYS 36 -15.913 35.659 -13.231 212 H LYS 37 HN LYS 37 -12.313 34.272 -13.025 213 HA LYS 37 HA LYS 37 -11.300 34.039 -10.344 214 HB2 LYS 37 HB2 LYS 37 -11.108 32.478 -12.820 215 HB3 LYS 37 HB1 LYS 37 -9.608 32.547 -11.914 216 HG2 LYS 37 HG2 LYS 37 -10.673 30.611 -11.177 217 HG3 LYS 37 HG1 LYS 37 -10.963 31.792 -9.903 218 HD2 LYS 37 HD2 LYS 37 -13.203 32.210 -10.837 219 HD3 LYS 37 HD1 LYS 37 -12.885 30.993 -12.081 220 HE2 LYS 37 HE2 LYS 37 -12.655 29.273 -10.391 221 HE3 LYS 37 HE1 LYS 37 -12.855 30.464 -9.111 222 HZ1 LYS 37 HZ1 LYS 37 -14.887 29.225 -9.516 223 HZ2 LYS 37 HZ2 LYS 37 -14.919 29.743 -11.127 224 HZ3 LYS 37 HZ3 LYS 37 -15.102 30.863 -9.879 225 H THR 38 HN THR 38 -10.364 36.067 -10.000 226 HA THR 38 HA THR 38 -7.735 36.328 -11.223 227 HB THR 38 HB THR 38 -9.248 37.829 -12.519 228 HG1 THR 38 HG1 THR 38 -7.426 38.895 -12.622 229 HG21 THR 38 HG21 THR 38 -10.865 38.333 -10.743 230 HG22 THR 38 HG22 THR 38 -10.206 39.811 -11.445 231 HG23 THR 38 HG23 THR 38 -9.630 39.248 -9.876 232 H CYS 39 HN CYS 39 -6.286 37.609 -9.949 233 HA CYS 39 HA CYS 39 -6.896 37.398 -7.121 234 HB2 CYS 39 HB2 CYS 39 -4.743 36.532 -7.999 235 HB3 CYS 39 HB1 CYS 39 -4.312 38.161 -8.496 236 H ASN 40 HN ASN 40 -7.126 39.084 -5.782 237 HA ASN 40 HA ASN 40 -7.500 41.684 -7.043 238 HB2 ASN 40 HB2 ASN 40 -8.385 40.472 -4.447 239 HB3 ASN 40 HB1 ASN 40 -8.439 42.214 -4.686 240 HD21 ASN 40 HD21 ASN 40 -9.654 39.133 -5.831 241 HD22 ASN 40 HD22 ASN 40 -11.063 39.772 -6.606 242 H CYS 41 HN CYS 41 -5.055 40.100 -5.556 243 HA CYS 41 HA CYS 41 -4.047 42.230 -3.939 244 HB2 CYS 41 HB2 CYS 41 -2.690 39.734 -4.953 245 HB3 CYS 41 HB1 CYS 41 -2.090 40.796 -3.682 246 H THR 42 HN THR 42 -2.407 43.633 -4.408 247 HA THR 42 HA THR 42 -1.918 44.005 -7.271 248 HB THR 42 HB THR 42 -1.393 46.331 -6.707 249 HG1 THR 42 HG1 THR 42 -1.533 45.300 -4.098 250 HG21 THR 42 HG21 THR 42 -3.728 45.748 -7.163 251 HG22 THR 42 HG22 THR 42 -3.627 47.037 -5.962 252 HG23 THR 42 HG23 THR 42 -3.971 45.382 -5.456 253 H SER 43 HN SER 43 0.232 44.952 -7.838 254 HA SER 43 HA SER 43 2.325 43.289 -6.914 255 HB2 SER 43 HB2 SER 43 2.616 45.845 -8.500 256 HB3 SER 43 HB1 SER 43 3.699 44.452 -8.491 257 HG SER 43 HG SER 43 2.069 43.233 -9.496 258 H ASP 44 HN ASP 44 1.273 46.528 -6.132 259 HA ASP 44 HA ASP 44 3.625 47.314 -4.721 260 HB2 ASP 44 HB2 ASP 44 2.080 48.992 -5.602 261 HB3 ASP 44 HB1 ASP 44 0.799 48.391 -4.553 262 H GLY 45 HN GLY 45 0.669 45.656 -3.831 263 HA2 GLY 45 HA2 GLY 45 1.850 44.805 -1.375 264 HA3 GLY 45 HA1 GLY 45 0.564 45.977 -1.139 265 H CYS 46 HN CYS 46 1.018 42.988 -0.710 266 HA CYS 46 HA CYS 46 -1.031 41.671 -2.182 267 HB2 CYS 46 HB2 CYS 46 0.937 40.548 -1.113 268 HB3 CYS 46 HB1 CYS 46 0.219 40.882 0.457 269 H LYS 47 HN LYS 47 -3.124 41.054 -1.418 270 HA LYS 47 HA LYS 47 -4.054 42.796 0.754 271 HB2 LYS 47 HB2 LYS 47 -5.584 41.796 -1.643 272 HB3 LYS 47 HB1 LYS 47 -6.288 42.717 -0.322 273 HG2 LYS 47 HG2 LYS 47 -4.688 44.560 -0.847 274 HG3 LYS 47 HG1 LYS 47 -4.185 43.644 -2.266 275 HD2 LYS 47 HD2 LYS 47 -5.777 45.078 -3.152 276 HD3 LYS 47 HD1 LYS 47 -6.723 43.627 -2.837 277 HE2 LYS 47 HE2 LYS 47 -6.561 46.044 -1.026 278 HE3 LYS 47 HE1 LYS 47 -7.885 45.688 -2.130 279 HZ1 LYS 47 HZ1 LYS 47 -8.192 43.578 -0.846 280 HZ2 LYS 47 HZ2 LYS 47 -8.539 44.984 0.009 281 HZ3 LYS 47 HZ3 LYS 47 -7.092 44.174 0.294 282 H CYS 48 HN CYS 48 -3.795 39.507 -0.240 283 HA CYS 48 HA CYS 48 -5.811 38.730 1.735 284 HB2 CYS 48 HB2 CYS 48 -5.721 36.524 0.826 285 HB3 CYS 48 HB1 CYS 48 -5.773 37.645 -0.532 286 H GLY 49 HN GLY 49 -2.361 38.469 1.083 287 HA2 GLY 49 HA2 GLY 49 -0.941 38.662 3.081 288 HA3 GLY 49 HA1 GLY 49 -2.028 37.526 3.862 289 H LYS 50 HN LYS 50 -1.722 36.469 0.752 290 HA LYS 50 HA LYS 50 0.147 34.402 1.553 291 HB2 LYS 50 HB2 LYS 50 -1.261 34.822 -1.083 292 HB3 LYS 50 HB1 LYS 50 -0.373 33.383 -0.608 293 HG2 LYS 50 HG2 LYS 50 -2.850 34.412 0.755 294 HG3 LYS 50 HG1 LYS 50 -2.810 33.122 -0.443 295 HD2 LYS 50 HD2 LYS 50 -1.225 31.905 1.093 296 HD3 LYS 50 HD1 LYS 50 -1.596 33.138 2.306 297 HE2 LYS 50 HE2 LYS 50 -3.966 32.568 2.169 298 HE3 LYS 50 HE1 LYS 50 -3.610 31.350 0.946 299 HZ1 LYS 50 HZ1 LYS 50 -2.681 31.337 3.761 300 HZ2 LYS 50 HZ2 LYS 50 -2.245 30.193 2.592 301 HZ3 LYS 50 HZ3 LYS 50 -3.852 30.323 3.081 302 H GLU 51 HN GLU 51 0.364 37.419 0.190 303 HA GLU 51 HA GLU 51 2.005 38.644 -0.729 304 HB2 GLU 51 HB2 GLU 51 3.753 36.262 -0.094 305 HB3 GLU 51 HB1 GLU 51 4.346 37.834 -0.613 306 HG2 GLU 51 HG2 GLU 51 3.240 38.827 1.399 307 HG3 GLU 51 HG1 GLU 51 2.883 37.188 1.936 308 H CYS 52 HN CYS 52 0.344 36.856 -2.289 309 HA CYS 52 HA CYS 52 1.810 35.835 -4.499 310 HB2 CYS 52 HB2 CYS 52 -0.628 36.147 -5.498 311 HB3 CYS 52 HB1 CYS 52 -0.258 34.854 -4.347 312 H THR 53 HN THR 53 -0.121 38.725 -3.953 313 HA THR 53 HA THR 53 -0.223 40.773 -4.883 314 HB THR 53 HB THR 53 1.896 41.831 -5.616 315 HG1 THR 53 HG1 THR 53 2.649 39.251 -5.936 316 HG21 THR 53 HG21 THR 53 2.110 40.196 -3.088 317 HG22 THR 53 HG22 THR 53 1.287 41.745 -3.250 318 HG23 THR 53 HG23 THR 53 3.039 41.652 -3.458 319 H GLY 54 HN GLY 54 -1.101 38.668 -6.611 320 HA2 GLY 54 HA2 GLY 54 -1.831 39.895 -8.844 321 HA3 GLY 54 HA1 GLY 54 -0.169 39.476 -9.238 322 HA PRO 55 HA PRO 55 -3.295 35.825 -9.668 323 HB2 PRO 55 HB2 PRO 55 -4.125 36.078 -12.233 324 HB3 PRO 55 HB1 PRO 55 -4.980 36.783 -10.859 325 HG2 PRO 55 HG2 PRO 55 -3.098 38.085 -12.785 326 HG3 PRO 55 HG1 PRO 55 -4.625 38.699 -12.129 327 HD2 PRO 55 HD2 PRO 55 -2.201 39.469 -11.188 328 HD3 PRO 55 HD1 PRO 55 -3.650 39.385 -10.167 329 H ASP 56 HN ASP 56 -0.838 37.203 -11.704 330 HA ASP 56 HA ASP 56 -0.330 34.728 -13.122 331 HB2 ASP 56 HB2 ASP 56 1.425 37.191 -13.070 332 HB3 ASP 56 HB1 ASP 56 1.396 35.918 -14.282 333 H SER 57 HN SER 57 0.653 36.277 -10.254 334 HA SER 57 HA SER 57 2.752 34.254 -9.841 335 HB2 SER 57 HB2 SER 57 2.622 37.034 -8.640 336 HB3 SER 57 HB1 SER 57 3.934 35.869 -8.456 337 HG SER 57 HG SER 57 4.161 35.996 -10.797 338 H CYS 58 HN CYS 58 -0.193 34.319 -9.295 339 HA CYS 58 HA CYS 58 -0.483 34.636 -6.487 340 HB2 CYS 58 HB2 CYS 58 -2.288 34.961 -8.248 341 HB3 CYS 58 HB1 CYS 58 -2.411 33.206 -8.291 342 H LYS 59 HN LYS 59 -0.730 33.137 -4.937 343 HA LYS 59 HA LYS 59 0.406 30.498 -5.576 344 HB2 LYS 59 HB2 LYS 59 0.445 32.057 -2.992 345 HB3 LYS 59 HB1 LYS 59 1.216 30.502 -3.267 346 HG2 LYS 59 HG2 LYS 59 2.873 31.411 -4.608 347 HG3 LYS 59 HG1 LYS 59 1.922 32.850 -4.979 348 HD2 LYS 59 HD2 LYS 59 3.749 33.382 -3.469 349 HD3 LYS 59 HD1 LYS 59 2.192 33.621 -2.679 350 HE2 LYS 59 HE2 LYS 59 2.437 31.394 -1.619 351 HE3 LYS 59 HE1 LYS 59 4.037 31.255 -2.344 352 HZ1 LYS 59 HZ1 LYS 59 4.763 33.158 -1.089 353 HZ2 LYS 59 HZ2 LYS 59 4.104 32.024 -0.027 354 HZ3 LYS 59 HZ3 LYS 59 3.214 33.397 -0.456 355 H CYS 60 HN CYS 60 -2.445 31.920 -5.009 356 HA CYS 60 HA CYS 60 -3.477 29.881 -3.187 357 HB2 CYS 60 HB2 CYS 60 -4.979 32.258 -4.236 358 HB3 CYS 60 HB1 CYS 60 -5.271 31.338 -2.765 359 H GLY 61 HN GLY 61 -5.180 28.560 -3.749 360 HA2 GLY 61 HA2 GLY 61 -5.681 28.343 -6.654 361 HA3 GLY 61 HA1 GLY 61 -5.679 26.982 -5.539 362 H SER 62 HN SER 62 -7.305 30.036 -6.180 363 HA SER 62 HA SER 62 -9.413 30.779 -5.897 364 HB2 SER 62 HB2 SER 62 -9.869 28.804 -7.421 365 HB3 SER 62 HB1 SER 62 -10.262 27.868 -5.980 366 HG SER 62 HG SER 62 -12.159 28.734 -6.824 367 H SER 63 HN SER 63 -11.530 30.258 -4.485 368 HA SER 63 HA SER 63 -12.476 30.203 -2.436 369 HB2 SER 63 HB2 SER 63 -10.293 28.233 -1.743 370 HB3 SER 63 HB1 SER 63 -11.840 28.426 -0.917 371 HG SER 63 HG SER 63 -12.557 28.070 -3.342 372 H CYS 64 HN CYS 64 -9.496 31.598 -2.863 373 HA CYS 64 HA CYS 64 -9.161 32.303 -0.060 374 HB2 CYS 64 HB2 CYS 64 -7.162 31.734 -1.453 375 HB3 CYS 64 HB1 CYS 64 -7.481 33.171 -2.417 376 H SER 65 HN SER 65 -8.786 34.613 0.458 377 HA SER 65 HA SER 65 -11.099 36.059 -0.318 378 HB2 SER 65 HB2 SER 65 -8.738 36.928 1.342 379 HB3 SER 65 HB1 SER 65 -10.273 37.790 1.211 380 HG SER 65 HG SER 65 -10.175 35.081 2.002 381 H CYS 66 HN CYS 66 -7.999 35.871 -1.761 382 HA CYS 66 HA CYS 66 -8.224 38.527 -2.882 383 HB2 CYS 66 HB2 CYS 66 -6.157 37.964 -4.152 384 HB3 CYS 66 HB1 CYS 66 -5.963 37.811 -2.418 385 H LYS 67 HN LYS 67 -9.826 35.777 -3.415 386 HA LYS 67 HA LYS 67 -10.027 36.228 -6.324 387 HB2 LYS 67 HB2 LYS 67 -10.742 33.693 -4.832 388 HB3 LYS 67 HB1 LYS 67 -10.704 33.917 -6.575 389 HG2 LYS 67 HG2 LYS 67 -8.341 33.956 -4.708 390 HG3 LYS 67 HG1 LYS 67 -8.754 32.690 -5.865 391 HD2 LYS 67 HD2 LYS 67 -8.242 34.047 -7.703 392 HD3 LYS 67 HD1 LYS 67 -8.294 35.523 -6.740 393 HE2 LYS 67 HE2 LYS 67 -6.021 35.131 -7.095 394 HE3 LYS 67 HE1 LYS 67 -6.341 34.559 -5.457 395 HZ1 LYS 67 HZ1 LYS 67 -4.953 33.047 -6.699 396 HZ2 LYS 67 HZ2 LYS 67 -6.160 32.843 -7.865 397 HZ3 LYS 67 HZ3 LYS 67 -6.414 32.311 -6.279 Start of MODEL 20 1 HA2 GLY 1 HA1 GLY 1 -15.980 17.268 -31.928 2 HA3 GLY 1 HA2 GLY 1 -16.822 16.772 -33.390 3 H SER 2 HN SER 2 -16.909 14.174 -31.413 4 HA SER 2 HA SER 2 -19.656 14.713 -30.643 5 HB2 SER 2 HB2 SER 2 -18.021 12.202 -30.224 6 HB3 SER 2 HB1 SER 2 -19.776 12.353 -30.129 7 HG SER 2 HG SER 2 -19.423 13.187 -32.447 8 H GLY 3 HN GLY 3 -16.517 14.238 -29.183 9 HA2 GLY 3 HA2 GLY 3 -16.123 15.432 -27.080 10 HA3 GLY 3 HA1 GLY 3 -17.707 14.863 -26.559 11 H LYS 4 HN LYS 4 -15.278 14.438 -25.167 12 HA LYS 4 HA LYS 4 -15.388 11.558 -24.949 13 HB2 LYS 4 HB2 LYS 4 -12.901 11.331 -25.134 14 HB3 LYS 4 HB1 LYS 4 -13.711 11.714 -26.647 15 HG2 LYS 4 HG2 LYS 4 -13.086 14.091 -26.322 16 HG3 LYS 4 HG1 LYS 4 -12.168 13.613 -24.893 17 HD2 LYS 4 HD2 LYS 4 -10.758 12.177 -26.264 18 HD3 LYS 4 HD1 LYS 4 -11.705 12.593 -27.693 19 HE2 LYS 4 HE2 LYS 4 -11.048 14.933 -27.451 20 HE3 LYS 4 HE1 LYS 4 -10.105 14.523 -26.018 21 HZ1 LYS 4 HZ1 LYS 4 -8.735 14.705 -28.006 22 HZ2 LYS 4 HZ2 LYS 4 -9.615 13.473 -28.751 23 HZ3 LYS 4 HZ3 LYS 4 -8.688 13.138 -27.375 24 H GLY 5 HN GLY 5 -15.792 14.160 -23.415 25 HA2 GLY 5 HA2 GLY 5 -14.864 13.177 -20.903 26 HA3 GLY 5 HA1 GLY 5 -13.933 14.571 -21.433 27 H LYS 6 HN LYS 6 -14.960 16.561 -21.697 28 HA LYS 6 HA LYS 6 -16.297 18.270 -21.100 29 HB2 LYS 6 HB2 LYS 6 -18.423 16.175 -21.498 30 HB3 LYS 6 HB1 LYS 6 -18.782 17.863 -21.176 31 HG2 LYS 6 HG2 LYS 6 -17.610 18.510 -23.219 32 HG3 LYS 6 HG1 LYS 6 -17.224 16.818 -23.534 33 HD2 LYS 6 HD2 LYS 6 -19.133 17.483 -24.868 34 HD3 LYS 6 HD1 LYS 6 -19.642 16.318 -23.645 35 HE2 LYS 6 HE2 LYS 6 -20.445 18.179 -22.242 36 HE3 LYS 6 HE1 LYS 6 -19.975 19.315 -23.505 37 HZ1 LYS 6 HZ1 LYS 6 -22.319 18.829 -23.626 38 HZ2 LYS 6 HZ2 LYS 6 -22.016 17.174 -23.738 39 HZ3 LYS 6 HZ3 LYS 6 -21.551 18.200 -24.996 40 H GLY 7 HN GLY 7 -15.515 18.638 -19.079 41 HA2 GLY 7 HA2 GLY 7 -17.037 17.479 -16.843 42 HA3 GLY 7 HA1 GLY 7 -15.460 18.254 -16.708 43 H GLU 8 HN GLU 8 -15.359 20.553 -17.185 44 HA GLU 8 HA GLU 8 -15.917 22.695 -16.833 45 HB2 GLU 8 HB2 GLU 8 -18.632 21.851 -17.835 46 HB3 GLU 8 HB1 GLU 8 -18.037 23.504 -17.735 47 HG2 GLU 8 HG2 GLU 8 -16.185 22.831 -19.278 48 HG3 GLU 8 HG1 GLU 8 -17.016 21.293 -19.492 49 H LYS 9 HN LYS 9 -15.739 23.147 -14.759 50 HA LYS 9 HA LYS 9 -17.849 22.439 -12.871 51 HB2 LYS 9 HB2 LYS 9 -15.303 23.992 -12.371 52 HB3 LYS 9 HB1 LYS 9 -16.337 23.240 -11.166 53 HG2 LYS 9 HG2 LYS 9 -15.729 21.040 -11.985 54 HG3 LYS 9 HG1 LYS 9 -14.743 21.774 -13.252 55 HD2 LYS 9 HD2 LYS 9 -13.367 22.846 -11.492 56 HD3 LYS 9 HD1 LYS 9 -14.304 21.974 -10.277 57 HE2 LYS 9 HE2 LYS 9 -12.703 20.688 -12.486 58 HE3 LYS 9 HE1 LYS 9 -12.152 20.876 -10.824 59 HZ1 LYS 9 HZ1 LYS 9 -14.491 19.288 -11.737 60 HZ2 LYS 9 HZ2 LYS 9 -14.062 19.528 -10.121 61 HZ3 LYS 9 HZ3 LYS 9 -13.026 18.685 -11.149 62 H CYS 10 HN CYS 10 -17.572 24.731 -15.089 63 HA CYS 10 HA CYS 10 -18.312 26.964 -13.379 64 HB2 CYS 10 HB2 CYS 10 -17.574 26.957 -16.295 65 HB3 CYS 10 HB1 CYS 10 -17.856 28.380 -15.297 66 H THR 11 HN THR 11 -19.931 28.467 -14.188 67 HA THR 11 HA THR 11 -22.304 26.973 -14.985 68 HB THR 11 HB THR 11 -23.530 28.917 -14.072 69 HG1 THR 11 HG1 THR 11 -21.982 30.331 -12.748 70 HG21 THR 11 HG21 THR 11 -22.979 28.551 -11.721 71 HG22 THR 11 HG22 THR 11 -21.431 27.845 -12.180 72 HG23 THR 11 HG23 THR 11 -22.933 27.023 -12.601 73 H SER 12 HN SER 12 -23.943 28.483 -16.174 74 HA SER 12 HA SER 12 -22.921 29.091 -18.707 75 HB2 SER 12 HB2 SER 12 -25.499 30.087 -17.487 76 HB3 SER 12 HB1 SER 12 -25.132 29.934 -19.205 77 HG SER 12 HG SER 12 -25.605 27.893 -19.110 78 H ALA 13 HN ALA 13 -23.391 31.093 -15.852 79 HA ALA 13 HA ALA 13 -23.145 33.606 -17.128 80 HB1 ALA 13 HB1 ALA 13 -24.072 33.433 -14.895 81 HB2 ALA 13 HB2 ALA 13 -22.636 34.463 -14.868 82 HB3 ALA 13 HB3 ALA 13 -22.541 32.804 -14.283 83 H CYS 14 HN CYS 14 -20.815 31.444 -15.600 84 HA CYS 14 HA CYS 14 -18.610 33.203 -15.944 85 HB2 CYS 14 HB2 CYS 14 -18.661 31.440 -14.225 86 HB3 CYS 14 HB1 CYS 14 -18.636 30.219 -15.490 87 H ARG 15 HN ARG 15 -19.849 30.427 -17.760 88 HA ARG 15 HA ARG 15 -17.703 30.556 -19.669 89 HB2 ARG 15 HB2 ARG 15 -18.921 28.439 -19.021 90 HB3 ARG 15 HB1 ARG 15 -20.291 29.029 -19.954 91 HG2 ARG 15 HG2 ARG 15 -18.792 29.159 -21.937 92 HG3 ARG 15 HG1 ARG 15 -17.542 28.375 -20.975 93 HD2 ARG 15 HD2 ARG 15 -19.007 26.442 -20.664 94 HD3 ARG 15 HD1 ARG 15 -20.254 27.238 -21.625 95 HE ARG 15 HE ARG 15 -17.624 26.771 -22.815 96 HH11 ARG 15 HH11 ARG 15 -21.042 26.027 -22.709 97 HH12 ARG 15 HH12 ARG 15 -21.039 25.208 -24.230 98 HH21 ARG 15 HH21 ARG 15 -17.620 25.696 -24.831 99 HH22 ARG 15 HH22 ARG 15 -19.083 25.009 -25.442 100 H SER 16 HN SER 16 -20.150 32.611 -19.202 101 HA SER 16 HA SER 16 -21.148 32.901 -21.852 102 HB2 SER 16 HB2 SER 16 -22.336 33.675 -19.756 103 HB3 SER 16 HB1 SER 16 -21.149 34.973 -19.643 104 HG SER 16 HG SER 16 -22.685 34.549 -21.979 105 H GLU 17 HN GLU 17 -20.805 34.979 -23.055 106 HA GLU 17 HA GLU 17 -17.974 35.771 -22.921 107 HB2 GLU 17 HB2 GLU 17 -19.723 35.580 -25.379 108 HB3 GLU 17 HB1 GLU 17 -18.011 35.975 -25.343 109 HG2 GLU 17 HG2 GLU 17 -19.060 33.347 -24.345 110 HG3 GLU 17 HG1 GLU 17 -18.667 33.618 -26.039 111 HA PRO 18 HA PRO 18 -16.965 37.167 -22.142 112 HB2 PRO 18 HB2 PRO 18 -16.539 39.139 -20.414 113 HB3 PRO 18 HB1 PRO 18 -16.303 39.395 -22.148 114 HG2 PRO 18 HG2 PRO 18 -18.626 40.165 -20.423 115 HG3 PRO 18 HG1 PRO 18 -17.804 41.112 -21.676 116 HD2 PRO 18 HD2 PRO 18 -20.148 39.733 -22.076 117 HD3 PRO 18 HD1 PRO 18 -18.996 40.128 -23.366 118 H CYS 19 HN CYS 19 -16.303 37.104 -19.646 119 HA CYS 19 HA CYS 19 -18.081 35.311 -18.445 120 HB2 CYS 19 HB2 CYS 19 -15.626 35.382 -18.081 121 HB3 CYS 19 HB1 CYS 19 -15.843 36.840 -17.121 122 H GLN 20 HN GLN 20 -19.737 35.552 -17.114 123 HA GLN 20 HA GLN 20 -20.337 38.249 -16.076 124 HB2 GLN 20 HB2 GLN 20 -22.268 36.014 -16.693 125 HB3 GLN 20 HB1 GLN 20 -22.677 37.654 -16.209 126 HG2 GLN 20 HG2 GLN 20 -21.255 36.910 -18.746 127 HG3 GLN 20 HG1 GLN 20 -22.980 37.222 -18.601 128 HE21 GLN 20 HE21 GLN 20 -20.919 38.578 -20.158 129 HE22 GLN 20 HE22 GLN 20 -20.986 40.246 -19.695 130 H CYS 21 HN CYS 21 -18.909 35.698 -14.988 131 HA CYS 21 HA CYS 21 -20.521 34.782 -12.836 132 HB2 CYS 21 HB2 CYS 21 -18.340 33.784 -13.992 133 HB3 CYS 21 HB1 CYS 21 -17.531 34.672 -12.723 134 H GLY 22 HN GLY 22 -18.218 37.364 -13.319 135 HA2 GLY 22 HA2 GLY 22 -17.775 39.287 -12.182 136 HA3 GLY 22 HA1 GLY 22 -19.316 39.048 -11.386 137 H SER 23 HN SER 23 -18.247 40.091 -9.608 138 HA SER 23 HA SER 23 -16.099 38.773 -8.261 139 HB2 SER 23 HB2 SER 23 -17.944 40.947 -7.255 140 HB3 SER 23 HB1 SER 23 -16.380 40.496 -6.576 141 HG SER 23 HG SER 23 -15.897 40.963 -9.086 142 H LYS 24 HN LYS 24 -19.363 38.113 -8.524 143 HA LYS 24 HA LYS 24 -19.784 37.156 -5.844 144 HB2 LYS 24 HB2 LYS 24 -21.352 36.665 -8.387 145 HB3 LYS 24 HB1 LYS 24 -21.853 36.165 -6.778 146 HG2 LYS 24 HG2 LYS 24 -21.882 38.549 -6.102 147 HG3 LYS 24 HG1 LYS 24 -21.516 38.987 -7.772 148 HD2 LYS 24 HD2 LYS 24 -23.895 39.178 -7.412 149 HD3 LYS 24 HD1 LYS 24 -23.586 37.809 -8.481 150 HE2 LYS 24 HE2 LYS 24 -23.812 36.278 -6.581 151 HE3 LYS 24 HE1 LYS 24 -24.104 37.646 -5.510 152 HZ1 LYS 24 HZ1 LYS 24 -26.080 38.161 -6.850 153 HZ2 LYS 24 HZ2 LYS 24 -26.171 36.646 -6.119 154 HZ3 LYS 24 HZ3 LYS 24 -25.818 36.764 -7.764 155 H CYS 25 HN CYS 25 -19.155 35.836 -9.041 156 HA CYS 25 HA CYS 25 -18.221 33.959 -9.772 157 HB2 CYS 25 HB2 CYS 25 -16.479 34.840 -8.103 158 HB3 CYS 25 HB1 CYS 25 -17.023 33.527 -7.063 159 H GLN 26 HN GLN 26 -19.905 32.706 -10.151 160 HA GLN 26 HA GLN 26 -20.981 31.025 -7.992 161 HB2 GLN 26 HB2 GLN 26 -22.081 31.534 -10.755 162 HB3 GLN 26 HB1 GLN 26 -22.877 30.633 -9.474 163 HG2 GLN 26 HG2 GLN 26 -22.163 33.551 -9.336 164 HG3 GLN 26 HG1 GLN 26 -23.746 32.914 -9.764 165 HE21 GLN 26 HE21 GLN 26 -25.000 31.925 -8.177 166 HE22 GLN 26 HE22 GLN 26 -24.687 32.150 -6.490 167 H CYS 27 HN CYS 27 -18.604 30.775 -10.213 168 HA CYS 27 HA CYS 27 -19.286 28.119 -11.198 169 HB2 CYS 27 HB2 CYS 27 -17.395 28.315 -12.633 170 HB3 CYS 27 HB1 CYS 27 -18.180 29.887 -12.636 171 H GLY 28 HN GLY 28 -16.638 27.126 -11.342 172 HA2 GLY 28 HA2 GLY 28 -15.767 26.827 -8.567 173 HA3 GLY 28 HA1 GLY 28 -16.177 25.380 -9.489 174 H GLU 29 HN GLU 29 -13.578 25.966 -8.439 175 HA GLU 29 HA GLU 29 -11.890 27.156 -10.310 176 HB2 GLU 29 HB2 GLU 29 -11.238 25.031 -8.269 177 HB3 GLU 29 HB1 GLU 29 -10.041 25.927 -9.190 178 HG2 GLU 29 HG2 GLU 29 -10.040 27.203 -7.332 179 HG3 GLU 29 HG1 GLU 29 -11.378 27.986 -8.167 180 H GLY 30 HN GLY 30 -12.240 26.561 -12.327 181 HA2 GLY 30 HA2 GLY 30 -10.879 24.225 -13.260 182 HA3 GLY 30 HA1 GLY 30 -12.623 24.143 -13.491 183 H CYS 31 HN CYS 31 -11.672 27.302 -13.476 184 HA CYS 31 HA CYS 31 -11.427 27.397 -16.391 185 HB2 CYS 31 HB2 CYS 31 -12.632 29.510 -16.337 186 HB3 CYS 31 HB1 CYS 31 -13.606 28.265 -15.560 187 H THR 32 HN THR 32 -10.553 29.758 -16.902 188 HA THR 32 HA THR 32 -8.314 30.276 -15.083 189 HB THR 32 HB THR 32 -6.951 30.714 -17.164 190 HG1 THR 32 HG1 THR 32 -7.827 30.313 -19.076 191 HG21 THR 32 HG21 THR 32 -8.047 27.933 -16.693 192 HG22 THR 32 HG22 THR 32 -6.653 28.659 -15.896 193 HG23 THR 32 HG23 THR 32 -6.586 28.286 -17.620 194 H CYS 33 HN CYS 33 -10.857 31.616 -15.271 195 HA CYS 33 HA CYS 33 -10.801 33.902 -16.861 196 HB2 CYS 33 HB2 CYS 33 -12.249 33.257 -14.321 197 HB3 CYS 33 HB1 CYS 33 -12.477 34.769 -15.193 198 H ALA 34 HN ALA 34 -10.321 35.936 -16.529 199 HA ALA 34 HA ALA 34 -8.788 36.669 -14.136 200 HB1 ALA 34 HB1 ALA 34 -7.453 36.803 -16.192 201 HB2 ALA 34 HB2 ALA 34 -7.767 38.419 -15.558 202 HB3 ALA 34 HB3 ALA 34 -8.687 37.819 -16.937 203 H ALA 35 HN ALA 35 -11.692 36.517 -14.767 204 HA ALA 35 HA ALA 35 -12.430 39.338 -14.447 205 HB1 ALA 35 HB1 ALA 35 -13.352 38.355 -16.493 206 HB2 ALA 35 HB2 ALA 35 -14.635 38.742 -15.351 207 HB3 ALA 35 HB3 ALA 35 -14.103 37.075 -15.545 208 H CYS 36 HN CYS 36 -13.772 36.126 -13.652 209 HA CYS 36 HA CYS 36 -14.825 37.234 -11.200 210 HB2 CYS 36 HB2 CYS 36 -15.916 35.074 -10.934 211 HB3 CYS 36 HB1 CYS 36 -16.188 35.765 -12.530 212 H LYS 37 HN LYS 37 -12.588 34.770 -12.288 213 HA LYS 37 HA LYS 37 -11.640 34.299 -9.579 214 HB2 LYS 37 HB2 LYS 37 -12.201 32.423 -11.215 215 HB3 LYS 37 HB1 LYS 37 -10.764 32.900 -12.104 216 HG2 LYS 37 HG2 LYS 37 -9.501 32.536 -9.907 217 HG3 LYS 37 HG1 LYS 37 -10.955 31.696 -9.363 218 HD2 LYS 37 HD2 LYS 37 -9.878 29.906 -10.251 219 HD3 LYS 37 HD1 LYS 37 -10.625 30.498 -11.736 220 HE2 LYS 37 HE2 LYS 37 -7.809 31.019 -10.784 221 HE3 LYS 37 HE1 LYS 37 -8.294 30.013 -12.144 222 HZ1 LYS 37 HZ1 LYS 37 -7.501 32.128 -12.919 223 HZ2 LYS 37 HZ2 LYS 37 -8.587 32.969 -11.938 224 HZ3 LYS 37 HZ3 LYS 37 -9.161 32.035 -13.225 225 H THR 38 HN THR 38 -11.036 36.770 -10.446 226 HA THR 38 HA THR 38 -8.271 36.627 -11.387 227 HB THR 38 HB THR 38 -9.819 38.137 -12.631 228 HG1 THR 38 HG1 THR 38 -8.126 40.021 -11.674 229 HG21 THR 38 HG21 THR 38 -11.198 38.922 -10.765 230 HG22 THR 38 HG22 THR 38 -10.460 40.283 -11.608 231 HG23 THR 38 HG23 THR 38 -9.802 39.741 -10.064 232 H CYS 39 HN CYS 39 -6.610 37.447 -10.246 233 HA CYS 39 HA CYS 39 -6.997 37.680 -7.412 234 HB2 CYS 39 HB2 CYS 39 -5.066 36.471 -8.346 235 HB3 CYS 39 HB1 CYS 39 -4.501 37.959 -9.094 236 H ASN 40 HN ASN 40 -6.875 39.509 -6.209 237 HA ASN 40 HA ASN 40 -6.796 42.022 -7.734 238 HB2 ASN 40 HB2 ASN 40 -8.181 41.289 -5.164 239 HB3 ASN 40 HB1 ASN 40 -7.976 42.961 -5.677 240 HD21 ASN 40 HD21 ASN 40 -9.524 39.921 -6.362 241 HD22 ASN 40 HD22 ASN 40 -10.700 40.548 -7.464 242 H CYS 41 HN CYS 41 -4.722 40.251 -6.120 243 HA CYS 41 HA CYS 41 -3.654 42.224 -4.339 244 HB2 CYS 41 HB2 CYS 41 -2.516 39.603 -5.297 245 HB3 CYS 41 HB1 CYS 41 -1.846 40.597 -4.008 246 H THR 42 HN THR 42 -2.076 43.605 -4.725 247 HA THR 42 HA THR 42 -1.321 43.999 -7.496 248 HB THR 42 HB THR 42 -0.481 46.168 -6.768 249 HG1 THR 42 HG1 THR 42 -0.856 45.043 -4.178 250 HG21 THR 42 HG21 THR 42 -2.899 45.958 -7.140 251 HG22 THR 42 HG22 THR 42 -2.549 47.134 -5.873 252 HG23 THR 42 HG23 THR 42 -3.118 45.519 -5.446 253 H SER 43 HN SER 43 0.899 44.319 -8.134 254 HA SER 43 HA SER 43 2.735 42.482 -7.051 255 HB2 SER 43 HB2 SER 43 3.357 44.892 -8.769 256 HB3 SER 43 HB1 SER 43 4.307 43.414 -8.630 257 HG SER 43 HG SER 43 2.739 42.294 -9.697 258 H ASP 44 HN ASP 44 2.022 45.801 -6.509 259 HA ASP 44 HA ASP 44 4.315 46.587 -5.091 260 HB2 ASP 44 HB2 ASP 44 2.727 48.187 -6.018 261 HB3 ASP 44 HB1 ASP 44 1.468 47.590 -4.946 262 H GLY 45 HN GLY 45 1.247 45.166 -4.069 263 HA2 GLY 45 HA2 GLY 45 2.441 44.199 -1.646 264 HA3 GLY 45 HA1 GLY 45 1.252 45.469 -1.389 265 H CYS 46 HN CYS 46 1.449 42.445 -0.950 266 HA CYS 46 HA CYS 46 -0.653 41.295 -2.497 267 HB2 CYS 46 HB2 CYS 46 1.240 40.062 -1.326 268 HB3 CYS 46 HB1 CYS 46 0.361 40.323 0.175 269 H LYS 47 HN LYS 47 -2.784 40.787 -1.818 270 HA LYS 47 HA LYS 47 -3.743 42.611 0.271 271 HB2 LYS 47 HB2 LYS 47 -5.170 41.507 -2.141 272 HB3 LYS 47 HB1 LYS 47 -5.955 42.451 -0.888 273 HG2 LYS 47 HG2 LYS 47 -3.702 43.401 -2.653 274 HG3 LYS 47 HG1 LYS 47 -5.407 43.804 -2.848 275 HD2 LYS 47 HD2 LYS 47 -3.682 44.500 -0.463 276 HD3 LYS 47 HD1 LYS 47 -4.165 45.607 -1.745 277 HE2 LYS 47 HE2 LYS 47 -6.507 45.327 -1.127 278 HE3 LYS 47 HE1 LYS 47 -6.051 44.171 0.123 279 HZ1 LYS 47 HZ1 LYS 47 -5.360 47.052 0.034 280 HZ2 LYS 47 HZ2 LYS 47 -4.742 45.968 1.165 281 HZ3 LYS 47 HZ3 LYS 47 -6.401 46.296 1.133 282 H CYS 48 HN CYS 48 -3.824 39.263 -0.777 283 HA CYS 48 HA CYS 48 -5.837 38.662 1.242 284 HB2 CYS 48 HB2 CYS 48 -5.873 36.434 0.344 285 HB3 CYS 48 HB1 CYS 48 -5.888 37.576 -1.003 286 H GLY 49 HN GLY 49 -2.414 38.073 0.645 287 HA2 GLY 49 HA2 GLY 49 -1.009 38.097 2.677 288 HA3 GLY 49 HA1 GLY 49 -2.222 37.069 3.420 289 H LYS 50 HN LYS 50 -2.122 35.945 0.387 290 HA LYS 50 HA LYS 50 -0.508 33.680 1.097 291 HB2 LYS 50 HB2 LYS 50 -1.739 34.419 -1.562 292 HB3 LYS 50 HB1 LYS 50 -1.056 32.856 -1.149 293 HG2 LYS 50 HG2 LYS 50 -3.458 34.114 0.164 294 HG3 LYS 50 HG1 LYS 50 -3.501 32.858 -1.074 295 HD2 LYS 50 HD2 LYS 50 -2.156 31.423 0.480 296 HD3 LYS 50 HD1 LYS 50 -2.395 32.667 1.713 297 HE2 LYS 50 HE2 LYS 50 -4.785 32.383 1.609 298 HE3 LYS 50 HE1 LYS 50 -4.633 31.261 0.259 299 HZ1 LYS 50 HZ1 LYS 50 -5.003 30.109 2.349 300 HZ2 LYS 50 HZ2 LYS 50 -3.606 30.800 3.004 301 HZ3 LYS 50 HZ3 LYS 50 -3.486 29.717 1.713 302 H GLU 51 HN GLU 51 0.119 36.703 -0.229 303 HA GLU 51 HA GLU 51 1.985 37.729 -0.976 304 HB2 GLU 51 HB2 GLU 51 3.336 35.078 -0.441 305 HB3 GLU 51 HB1 GLU 51 4.176 36.559 -0.877 306 HG2 GLU 51 HG2 GLU 51 3.328 37.629 1.150 307 HG3 GLU 51 HG1 GLU 51 2.511 36.132 1.590 308 H CYS 52 HN CYS 52 0.121 36.292 -2.646 309 HA CYS 52 HA CYS 52 1.524 35.200 -4.873 310 HB2 CYS 52 HB2 CYS 52 -0.796 35.618 -5.935 311 HB3 CYS 52 HB1 CYS 52 -0.658 34.432 -4.632 312 H THR 53 HN THR 53 -0.030 38.268 -4.127 313 HA THR 53 HA THR 53 0.066 40.346 -4.985 314 HB THR 53 HB THR 53 2.293 41.180 -5.747 315 HG1 THR 53 HG1 THR 53 2.760 38.532 -6.078 316 HG21 THR 53 HG21 THR 53 1.668 41.165 -3.388 317 HG22 THR 53 HG22 THR 53 3.397 40.863 -3.582 318 HG23 THR 53 HG23 THR 53 2.299 39.527 -3.223 319 H GLY 54 HN GLY 54 -0.985 38.341 -6.783 320 HA2 GLY 54 HA2 GLY 54 -1.771 39.606 -8.925 321 HA3 GLY 54 HA1 GLY 54 -0.099 39.323 -9.388 322 HA PRO 55 HA PRO 55 -3.179 35.649 -10.152 323 HB2 PRO 55 HB2 PRO 55 -3.361 35.948 -12.890 324 HB3 PRO 55 HB1 PRO 55 -4.559 36.544 -11.737 325 HG2 PRO 55 HG2 PRO 55 -2.333 38.013 -13.090 326 HG3 PRO 55 HG1 PRO 55 -3.995 38.544 -12.770 327 HD2 PRO 55 HD2 PRO 55 -1.939 39.377 -11.263 328 HD3 PRO 55 HD1 PRO 55 -3.535 39.056 -10.554 329 H ASP 56 HN ASP 56 -0.360 36.933 -11.786 330 HA ASP 56 HA ASP 56 0.433 34.617 -13.184 331 HB2 ASP 56 HB2 ASP 56 2.186 36.827 -12.089 332 HB3 ASP 56 HB1 ASP 56 2.656 35.651 -13.306 333 H SER 57 HN SER 57 0.794 35.571 -9.866 334 HA SER 57 HA SER 57 2.269 33.077 -9.380 335 HB2 SER 57 HB2 SER 57 3.693 35.143 -9.163 336 HB3 SER 57 HB1 SER 57 2.645 35.658 -7.844 337 HG SER 57 HG SER 57 3.191 33.538 -6.884 338 H CYS 58 HN CYS 58 -0.633 33.870 -9.261 339 HA CYS 58 HA CYS 58 -1.235 33.847 -6.443 340 HB2 CYS 58 HB2 CYS 58 -2.595 35.114 -8.140 341 HB3 CYS 58 HB1 CYS 58 -3.183 33.563 -8.728 342 H LYS 59 HN LYS 59 -1.955 32.213 -5.252 343 HA LYS 59 HA LYS 59 -1.974 29.536 -6.499 344 HB2 LYS 59 HB2 LYS 59 -1.063 30.417 -3.753 345 HB3 LYS 59 HB1 LYS 59 -1.241 28.737 -4.228 346 HG2 LYS 59 HG2 LYS 59 0.542 30.629 -5.727 347 HG3 LYS 59 HG1 LYS 59 1.095 29.747 -4.304 348 HD2 LYS 59 HD2 LYS 59 -0.110 28.419 -6.732 349 HD3 LYS 59 HD1 LYS 59 1.624 28.652 -6.504 350 HE2 LYS 59 HE2 LYS 59 1.545 27.340 -4.453 351 HE3 LYS 59 HE1 LYS 59 -0.192 27.136 -4.629 352 HZ1 LYS 59 HZ1 LYS 59 0.162 25.874 -6.626 353 HZ2 LYS 59 HZ2 LYS 59 1.087 25.208 -5.376 354 HZ3 LYS 59 HZ3 LYS 59 1.829 26.152 -6.559 355 H CYS 60 HN CYS 60 -4.024 31.720 -5.618 356 HA CYS 60 HA CYS 60 -5.648 30.122 -3.788 357 HB2 CYS 60 HB2 CYS 60 -6.261 32.911 -4.643 358 HB3 CYS 60 HB1 CYS 60 -6.597 32.110 -3.108 359 H GLY 61 HN GLY 61 -7.930 29.922 -4.194 360 HA2 GLY 61 HA2 GLY 61 -8.444 29.373 -6.995 361 HA3 GLY 61 HA1 GLY 61 -9.470 28.938 -5.637 362 H SER 62 HN SER 62 -11.306 29.989 -5.500 363 HA SER 62 HA SER 62 -11.531 32.645 -6.746 364 HB2 SER 62 HB2 SER 62 -13.691 30.527 -6.664 365 HB3 SER 62 HB1 SER 62 -13.752 32.074 -7.510 366 HG SER 62 HG SER 62 -13.175 30.681 -9.057 367 H SER 63 HN SER 63 -11.894 30.790 -3.929 368 HA SER 63 HA SER 63 -13.799 32.708 -2.799 369 HB2 SER 63 HB2 SER 63 -13.065 29.927 -1.861 370 HB3 SER 63 HB1 SER 63 -14.213 30.998 -1.056 371 HG SER 63 HG SER 63 -14.442 29.650 -3.515 372 H CYS 64 HN CYS 64 -10.825 33.054 -3.108 373 HA CYS 64 HA CYS 64 -10.008 33.213 -0.308 374 HB2 CYS 64 HB2 CYS 64 -8.364 32.365 -1.963 375 HB3 CYS 64 HB1 CYS 64 -8.429 33.909 -2.802 376 H SER 65 HN SER 65 -8.757 35.327 0.205 377 HA SER 65 HA SER 65 -10.680 37.392 0.208 378 HB2 SER 65 HB2 SER 65 -7.763 37.528 0.971 379 HB3 SER 65 HB1 SER 65 -9.032 38.650 1.464 380 HG SER 65 HG SER 65 -10.060 36.566 2.270 381 H CYS 66 HN CYS 66 -8.058 36.658 -1.967 382 HA CYS 66 HA CYS 66 -8.052 39.362 -3.019 383 HB2 CYS 66 HB2 CYS 66 -6.293 38.508 -4.566 384 HB3 CYS 66 HB1 CYS 66 -5.887 38.351 -2.866 385 H LYS 67 HN LYS 67 -10.158 36.973 -3.343 386 HA LYS 67 HA LYS 67 -10.530 37.438 -6.232 387 HB2 LYS 67 HB2 LYS 67 -11.545 35.045 -4.690 388 HB3 LYS 67 HB1 LYS 67 -11.561 35.274 -6.431 389 HG2 LYS 67 HG2 LYS 67 -9.151 34.845 -4.679 390 HG3 LYS 67 HG1 LYS 67 -9.823 33.725 -5.865 391 HD2 LYS 67 HD2 LYS 67 -9.228 35.203 -7.669 392 HD3 LYS 67 HD1 LYS 67 -8.720 36.453 -6.532 393 HE2 LYS 67 HE2 LYS 67 -6.697 35.521 -7.102 394 HE3 LYS 67 HE1 LYS 67 -7.118 34.597 -5.662 395 HZ1 LYS 67 HZ1 LYS 67 -7.440 33.743 -8.472 396 HZ2 LYS 67 HZ2 LYS 67 -8.006 32.864 -7.141 397 HZ3 LYS 67 HZ3 LYS 67 -6.344 33.133 -7.340
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